smiles zinc_id inchikey mwt logp reactive purchasable tranche_name features C[C@@H](Sc1ncc(-c2ccc(F)cc2)o1)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 10715099 BXEQQQLTYNMWCQ-SNVBAGLBSA-N 455.389 5.527 5 20 JKBD CC(=O)N(c1cccc(C(F)(F)F)c1)c1nc(COC(=O)c2ccc(Cl)cc2[N+](=O)[O-])cs1 10748316 JQVJLLHEMYWPCE-UHFFFAOYSA-N 499.854 5.765 5 20 JKBD Cc1ccc(C)c(NC(=O)[C@@H](OC(=O)Cn2c3ccccc3c(=O)c3ccccc32)c2ccccc2)c1 11276451 SOKLKMFAEHJETJ-PMERELPUSA-N 490.559 5.695 5 20 JKBD CCOc1cc(C(=O)O[C@@H](C)C(=O)N2c3ccccc3Sc3ccccc32)c([N+](=O)[O-])cc1OC 27008483 SJRLRUWRVDMUTE-HNNXBMFYSA-N 494.525 5.377 5 20 JKBD Cc1nc2ccccc2nc1S[C@H](C)C(=O)Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1 28190970 WZQLXPVFFXSZBM-CYBMUJFWSA-N 451.533 5.089 5 20 JKBD Cc1ccc(C(=O)OCC(=O)Nc2c(Cl)c(Cl)cc(Cl)c2Cl)cc1[N+](=O)[O-] 28802235 RNNRJTFOYFIRKF-UHFFFAOYSA-N 452.077 5.312 5 20 JKBD CC(C)c1nnc(S[C@H](C)C(=O)Nc2nc(-c3cccc([N+](=O)[O-])c3)cs2)n1Cc1ccco1 29963431 LCNOAFRXIXTZRV-CQSZACIVSA-N 498.590 5.194 5 20 JKBD O=C(NCc1ccc([N+](=O)[O-])cc1)c1ccc(-n2nc(SCc3ccccc3)sc2=S)cc1 68734707 FZIRSLRLFNDLKW-UHFFFAOYSA-N 494.623 5.794 5 20 JKBD C[C@@H]1c2ccsc2CCN1C(=O)Cc1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1 477385603 NISVZOOVXNEFCB-QGZVFWFLSA-N 458.543 5.197 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)Nc2cc(NC(=O)c3ccccc3)ccc2C)cc1SC 482757562 FRBJJTXFSISDIB-UHFFFAOYSA-N 451.504 5.138 5 20 JKBD O=C(C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)Nc1cccnc1-n1cccn1 484320321 VLPPZKFSUGKNSZ-SDXDJHTJSA-N 482.525 5.355 5 20 JKBD O=C(Nc1ccccc1OC1CCCC1)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 486401997 SWCISTDVXXNGGO-UHFFFAOYSA-N 477.483 5.790 5 20 JKBD CC1CCN(c2ccc(C(=O)Nc3nc(-c4ccc5c(c4)CCC(=O)N5)cs3)cc2[N+](=O)[O-])CC1 490933443 LEZRVXXACNLRFI-UHFFFAOYSA-N 491.573 5.092 5 20 JKBD CCOc1ccccc1Oc1ccc(CNC(=O)Cn2c3ccccc3c(=O)c3ccccc32)cn1 502245649 BCZDEVZUHOUQMC-UHFFFAOYSA-N 479.536 5.057 5 20 JKBD CSCC[C@@H](NC(=O)c1ccc([N+](=O)[O-])o1)C(=O)Nc1ccc(Oc2ccccc2Cl)cc1 508279319 KAQZMJLPJAEGDV-QGZVFWFLSA-N 489.937 5.124 5 20 JKBD CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)NCc1ccc(-c2nc3ccccc3s2)o1 509295290 UUCLNMUKKRRNOM-UHFFFAOYSA-N 450.520 5.585 5 20 JKBD COc1ccc(Br)cc1[C@@H]1CCCN1C(=O)Nc1ccc([N+](=O)[O-])cc1Cl 510584701 OYOFYOKRNIERSX-INIZCTEOSA-N 454.708 5.388 5 20 JKBD Cc1oncc1C(=O)Nc1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2Sc2ccccc2)cc1 512532751 UUVDRPYVDWLGQM-UHFFFAOYSA-N 474.498 5.547 5 20 JKBD CC(=O)N(c1ccc(C(F)(F)F)cc1)c1nc(COc2ccc([N+](=O)[O-])c(C)c2)cs1 512545834 XORCOIBZENYCTB-UHFFFAOYSA-N 451.426 5.642 5 20 JKBD CCn1c(SCc2cc(OC)c(OC(F)F)cc2[N+](=O)[O-])nnc1-c1cccc(Cl)c1 514874556 PKEWLHYDKXNZJH-UHFFFAOYSA-N 470.885 5.429 5 20 JKBD Cc1ccc([N+](=O)[O-])cc1NC(=O)CNc1ccc(Cl)cc1C(=O)N1[C@@H](C)CCC[C@H]1C 515662801 JTLYBFOWCDYWHL-IYBDPMFKSA-N 458.946 5.010 5 20 JKBD CCOc1cc([N+](=O)[O-])c(C(=O)Nc2cc(C(C)(C)C)nn2-c2cccc(Cl)c2)cc1OC 518256720 FMPYKYYYTVGDJK-UHFFFAOYSA-N 472.929 5.391 5 20 JKBD O=C(CSc1nnc(-c2ccccc2Cl)o1)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 519654692 BIAZXMWEMZUTOJ-UHFFFAOYSA-N 458.805 5.048 5 20 JKBD COc1cc(C(=O)N2CCCc3cc(Br)cc(Cl)c32)c([N+](=O)[O-])cc1OC(F)F 521526351 KVFMCKDILFDGMR-UHFFFAOYSA-N 491.672 5.214 5 20 JKBD COCCN(C(=O)c1ccc(-c2cccs2)nc1C)c1nc(-c2ccc([N+](=O)[O-])cc2)cs1 553598072 UGDCUQWSADCAIW-UHFFFAOYSA-N 480.571 5.443 5 20 JKBD Cc1ccc(C(=O)N2C[C@@H](C)C[C@@H](C)C2)cc1NC(=O)c1cc2cc([N+](=O)[O-])ccc2s1 603977210 XQSJPQKLDQUYPX-GASCZTMLSA-N 451.548 5.488 5 20 JKBD CCOc1cc([N+](=O)[O-])c(C(=O)N[C@H](C)c2ccc(Oc3ccccc3)c(F)c2)cc1OC 603990949 HMNWVPURTDRUFC-OAHLLOKOSA-N 454.454 5.425 5 20 JKBD COc1cccc(/C=C(\CC(=O)NCc2ccc(OC)c([N+](=O)[O-])c2)c2nc3ccccc3s2)c1 604018604 JVOYDTMSHRZIRE-XDHOZWIPSA-N 489.553 5.469 5 20 JKBD C[C@@H](NC(=O)c1ccc(C(=O)N[C@H](C)c2cc3ccccc3o2)c([N+](=O)[O-])c1)c1cc2ccccc2o1 609043651 GYLXBDONHZULPH-IAGOWNOFSA-N 497.507 6.069 5 20 JKBD O=[N+]([O-])c1cc(C(F)(F)F)ccc1Sc1nnc(-c2c[nH]c3ccccc23)n1C[C@@H]1CCCO1 619671202 UZCUJAZLMBTZGO-AWEZNQCLSA-N 489.479 5.684 5 20 JKBD Cn1cnc([N+](=O)[O-])c1Sc1nnc(-c2ccc(Cl)cc2Cl)n1Cc1ccccc1 619699148 HWPVAWSDBRCQIF-UHFFFAOYSA-N 461.334 5.093 5 20 JKBD CC(C)(C)OC(=O)Nc1cc(C(=O)N(Cc2ccccc2[N+](=O)[O-])CC(F)(F)F)ccc1F 730477445 HOEWNKOGPGBIFR-UHFFFAOYSA-N 471.407 5.286 5 20 JKBD O=C(NCc1ccc(NC(=S)Nc2ccc([N+](=O)[O-])cc2)cc1)c1ccc(Br)cc1 730736188 CIDNXAMRNINVAS-UHFFFAOYSA-N 485.363 5.096 5 20 JKBD Cc1nc(-c2cccs2)sc1C(=O)N(Cc1nnc(-c2cccc([N+](=O)[O-])c2)o1)C(C)C 744001365 CDNOPMXSPIGEMU-UHFFFAOYSA-N 469.548 5.189 5 20 JKBD Cc1c(C(=O)Nc2ccc(NC(=O)Nc3ccc(Cl)cc3)cc2)cc([N+](=O)[O-])cc1[N+](=O)[O-] 748722827 VUIILSKKRGRCNQ-UHFFFAOYSA-N 469.841 5.361 5 20 JKBD C[C@H](OC(=O)c1ccc(C(C)(C)C)c([N+](=O)[O-])c1)C(=O)Nc1ccc(NC(=O)c2cccs2)cc1 750115815 NLPMQMNWPXKODN-HNNXBMFYSA-N 495.557 5.390 5 20 JKBD O=C(NCCc1cn(-c2ccccc2)nc1-c1ccc(Cl)cc1)c1cc(F)ccc1[N+](=O)[O-] 751108064 DRQPTNSAZPQIKG-UHFFFAOYSA-N 464.884 5.213 5 20 JKBD CC(C)S(=O)(=O)c1ccc(C(=O)Nc2cc(Cl)c([N+](=O)[O-])cc2OCc2ccccc2)cc1 915827640 DHVJNYOWNOCEQK-UHFFFAOYSA-N 488.949 5.262 5 20 JKBD COc1ccc(N2C(=S)N[C@H](c3ccc([N+](=O)[O-])cc3)C(C(=O)Nc3ccccc3C)=C2C)cc1 916167706 BWFJGXVHDFVFEB-XMMPIXPASA-N 488.569 5.260 5 20 JKBD Cc1ccn(-c2ccc(C(=O)O[C@@H](C(=O)Nc3ccc([N+](=O)[O-])cc3Cl)c3ccccc3)cc2)n1 919185228 NLMKTMLEEPZDRZ-HSZRJFAPSA-N 490.903 5.279 5 20 JKBD O=C(NC1(c2ccc(NC(=O)c3cc(Cl)nc4ccccc34)cc2)CCC1)c1ccc([N+](=O)[O-])[nH]1 1788990436 OJNCVSFRNDENCS-UHFFFAOYSA-N 489.919 5.186 5 20 JKBD Cc1[nH]ccc1C(=O)NC1(c2ccc(NC(=O)c3ccc(Br)c([N+](=O)[O-])c3)cc2)CCC1 1790642509 ZGSSJLPRPAKURK-UHFFFAOYSA-N 497.349 5.055 5 20 JKBD O=C(CSc1ccccc1[N+](=O)[O-])Nc1ccc(C2(NC(=O)[C@H]3CC=CCC3)CCC2)cc1 1791523792 TZJKSNWWPXYVQI-SFHVURJKSA-N 465.575 5.177 5 20 JKBD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)/C=C/c1ccc([N+](=O)[O-])o1)c1cccc2c1oc1ccccc12 1793276391 UBXHQKBQEYUONW-LTYMNLCQSA-N 485.496 5.052 5 20 JKBD O=C(Nc1cc([C@H]2CCCCN2C(=O)CCc2cccc([N+](=O)[O-])c2)[nH]n1)c1ccc2occc2c1 1818703505 LBJMRCWTVJFGJM-JOCHJYFZSA-N 487.516 5.003 5 20 JKBD Cc1c(C(=O)N2CCCC[C@H]2c2cc(NC(=O)c3ccc(F)cc3)n[nH]2)cc(Cl)cc1[N+](=O)[O-] 1820555593 CVEGFWXIKXDLCF-IBGZPJMESA-N 485.903 5.039 5 20 JKBD C[C@@H](CC(=O)N1CCCC[C@@H]1c1cc(NC(=O)/C=C/c2ccccc2[N+](=O)[O-])n[nH]1)c1ccccc1 1823503403 LDUKJVZVSBKIDC-AOVICEOCSA-N 487.560 5.217 5 20 JKBD O=C(CCc1ccccc1Cl)N1CCC([C@@H]2CCCCN2C(=O)Cc2cccc([N+](=O)[O-])c2)CC1 1823678301 JHYXHWMXZGAVRF-VWLOTQADSA-N 498.023 5.043 5 20 JKBD Cc1c(C(=O)N2CCCC[C@H]2C2CCN(C(=O)c3ccccc3)CC2)cc(Cl)cc1[N+](=O)[O-] 1830735747 LKSTZEKCFUUEGV-QFIPXVFZSA-N 469.969 5.104 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)N1CCC([C@H]2CCCCN2C(=O)[C@]2(F)CCCC=C2F)CC1 1832983372 GZLVKJDAOSHPHI-NLFFAJNJSA-N 493.526 5.021 5 20 JKBD Cc1ccc(C(=O)Nc2ccc(NS(=O)(=O)c3c(Cl)cccc3Cl)cc2)cc1[N+](=O)[O-] 11325475 VUCDCPOJOYUONT-UHFFFAOYSA-N 480.329 5.263 5 20 JKBD C[C@H](OC(=O)c1ccc(N2CCC[C@@H](C)C2)c([N+](=O)[O-])c1)C(=O)Nc1ccccc1C(F)(F)F 15816662 POSWJEFPUISALV-CABCVRRESA-N 479.455 5.034 5 20 JKBD COc1ccc(C)cc1NC(=O)[C@@H](OC(=O)c1cc(SC)ccc1[N+](=O)[O-])c1ccccc1 16196185 SFLSOYQGZFZYAF-QFIPXVFZSA-N 466.515 5.171 5 20 JKBD C[C@@H](OC(=O)c1csc(-c2ccc(Cl)cc2)n1)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl 16457309 ULWARVFNWXYSEG-SNVBAGLBSA-N 466.302 5.209 5 20 JKBD Cc1c(NC(=O)[C@H](C)OC(=O)c2cc(-c3ccccc3)nc3c2cnn3C(C)C)cccc1[N+](=O)[O-] 25361017 JTQSDLUSFLGQNX-KRWDZBQOSA-N 487.516 5.080 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Cl)[C@@H](NCc1ccc(C(F)(F)F)cc1)c1ccccc1 28623182 KAEZFOZVJYURQE-FQEVSTJZSA-N 463.843 5.737 5 20 JKBD C[C@@H](NC(=O)c1ccccc1NC(=O)c1ccc([N+](=O)[O-])cc1Cl)c1cccc(OC(F)F)c1 72009746 FUACJCMOOHGJAG-CYBMUJFWSA-N 489.862 5.593 5 20 JKBD COc1cc([C@@H](C)NC(=O)C2CCN(c3ccccc3[N+](=O)[O-])CC2)ccc1OC1CCCC1 107881728 HDTVLSSFMPKBFZ-GOSISDBHSA-N 467.566 5.019 5 20 JKBD COc1ccc2cc(CNC(=O)c3ccc(N[C@H](C)c4ccccn4)c([N+](=O)[O-])c3)ccc2c1 115705107 DJVZFSXEQMXZFO-QGZVFWFLSA-N 456.502 5.255 5 20 JKBD Cc1ccc(C(=O)Nc2nc(-c3cccc([N+](=O)[O-])c3)c(C)s2)cc1NC(=O)c1ccco1 195703932 CDHDPUZAPJAXON-UHFFFAOYSA-N 462.487 5.433 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)Nc2ncc(Cc3ccc(C(F)(F)F)cc3)s2)cc1SC 303234880 ZTWPQERLUTYUGJ-UHFFFAOYSA-N 483.493 5.644 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)Nc2ccc(NC(=O)c3ccoc3)cc2C(F)(F)F)cc1SC 483019832 UAHGCGOJMWUWFO-UHFFFAOYSA-N 495.435 5.442 5 20 JKBD CN1C/C(=C/c2ccc(-c3cccc([N+](=O)[O-])c3)s2)c2nc3ccccc3c(C(=O)O)c2C1 489656121 UMHYBZAKBJXMGN-VBKFSLOCSA-N 457.511 5.556 5 20 JKBD CCOc1cc([N+](=O)[O-])c(C(=O)N[C@@H](C)c2sc(-c3ccc(C)cc3)nc2C)cc1OC 502411506 BFSLZHSFYAFYOD-AWEZNQCLSA-N 455.536 5.233 5 20 JKBD COc1ccc2cc(CN(C)C(=O)c3ccc(N[C@@H](C)c4ccccn4)c([N+](=O)[O-])c3)ccc2c1 506029866 GCWALSBUXLFYAL-SFHVURJKSA-N 470.529 5.597 5 20 JKBD Cc1nc(-c2ccc(F)cc2)sc1[C@H](C)Nc1ccc(C(=O)c2nccn2C)cc1[N+](=O)[O-] 511428264 XJXAIPHSXXUYKY-ZDUSSCGKSA-N 465.510 5.303 5 20 JKBD O=C1CCCN1Cc1ccccc1CNCc1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1 513603641 AMHPHALYGDGLCQ-UHFFFAOYSA-N 465.937 5.453 5 20 JKBD C[C@H](c1nnc(-c2cccs2)o1)N1CCN(Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)CC1 515479765 LMLJHWNGYZQWQF-MRXNPFEDSA-N 481.603 5.314 5 20 JKBD CC(C)Oc1ccc(CN[C@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Br)c2ccccc2)cn1 515523105 SOXRDOUYHYNUOJ-QFIPXVFZSA-N 499.365 5.009 5 20 JKBD CCCOc1ncccc1CN[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Br)c1ccccc1 516837744 FZMJEKFPPSZWBB-OAQYLSRUSA-N 499.365 5.011 5 20 JKBD COc1ccc([N+](=O)[O-])c(C(=O)N[C@H](c2ccccc2)c2ccc3nc(C(F)(F)F)[nH]c3c2)c1 518617898 WDMZWHUXVXGKFS-HXUWFJFHSA-N 470.407 5.018 5 20 JKBD O=C(Cn1c2ccccc2c(=O)c2ccccc21)N(Cc1ccc2c(c1)OCO2)c1ccccc1 519231164 PUNADGWVEJIDCK-UHFFFAOYSA-N 462.505 5.117 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Br)[C@H](NCc1ccc(F)cc1F)c1ccccc1 521766607 AMOXOOSZJACKNN-HXUWFJFHSA-N 476.277 5.105 5 20 JKBD CC(C)c1cccc(C(C)C)c1NC(=O)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 602504722 TYFMLKGPZCSFKA-UHFFFAOYSA-N 477.527 6.716 5 20 JKBD COc1cc(C(=O)Nc2ccc3nc(-c4cccc(F)c4)[nH]c3c2)c([N+](=O)[O-])cc1OC(F)F 603984073 XJICLRNXCYERIM-UHFFFAOYSA-N 472.379 5.140 5 20 JKBD CCCC(=O)Nc1ccc(CN[C@@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2ccccc2)cc1 604045587 XCVVRBBHEXOGIM-XMMPIXPASA-N 480.952 5.456 5 20 JKBD COCCn1ncc2ccc(NC(=O)c3ccc(Oc4ccc(Cl)cc4[N+](=O)[O-])cc3)cc21 604509154 DAFWXIYVODUNBO-UHFFFAOYSA-N 466.881 5.289 5 20 JKBD COc1cc(CSc2nnc(-c3ccc(C(C)C)cc3)o2)c([N+](=O)[O-])cc1OC(F)F 608929899 AIKASOBMVFKDLU-UHFFFAOYSA-N 451.451 5.671 5 20 JKBD O=C(c1csc(-c2ccc([N+](=O)[O-])cc2)n1)N1CCO[C@@H](c2ccc(Cl)c(Cl)c2)C1 608965578 ZNTKKFKTMOWFJE-GOSISDBHSA-N 464.330 5.239 5 20 JKBD C[C@@H](N[C@H](C)c1cc(F)c(Cl)cc1Cl)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 610246675 UMFRPCUKCYAMNU-RKDXNWHRSA-N 468.234 5.737 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Cl)[C@@H](NCCc1nc2ccccc2s1)c1ccccc1 610556467 GTXWQJMUCFIJIO-QFIPXVFZSA-N 466.950 5.370 5 20 JKBD O=C(O[C@@H](C(=O)Nc1ccc(F)cc1)c1ccccc1)c1cc([N+](=O)[O-])ccc1Br 725984211 FWMIUWARCGVBAC-LJQANCHMSA-N 473.254 5.033 5 20 JKBD O=C(Oc1ccc2c(-c3ccc([N+](=O)[O-])cc3)cc(=O)oc2c1)c1sc(N2CCCC2)nc1Cl 728163031 NCTSMZUODDOOMN-UHFFFAOYSA-N 497.916 5.298 5 20 JKBD O=C(Nc1cc([N+](=O)[O-])ccc1OC(F)F)c1sc2cc(Br)ccc2c1Cl 729824240 FBQQXAGLNVLBFL-UHFFFAOYSA-N 477.670 6.079 5 20 JKBD Cc1ccc(C)c(NC(=O)[C@@H](C)OC(=O)Cc2cn(-c3ccccc3)nc2-c2ccc([N+](=O)[O-])cc2)c1 729847914 XLYOHSFPWYEUNC-HXUWFJFHSA-N 498.539 5.177 5 20 JKBD O=C(OCc1cc(=O)c(O)co1)c1c2c(nc3ccccc13)/C(=C\c1cccc([N+](=O)[O-])c1)CCC2 746839815 DSSJAUGPELHGMV-BOPFTXTBSA-N 484.464 5.036 5 20 JKBD COC(=O)c1c(NC(=O)CCn2cc([N+](=O)[O-])nc2C)sc(C)c1-c1ccc(Cl)cc1Cl 747123624 JLNNEKCBPAHRGS-UHFFFAOYSA-N 497.360 5.259 5 20 JKBD C[C@@H](OC(=O)c1c(-n2cccc2)sc2c1CCSC2)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 762807960 JWJPOTNPNZENPN-CYBMUJFWSA-N 482.543 5.204 5 20 JKBD C[C@@H](OC(=O)/C(=C\c1ccc(F)cc1)c1cccs1)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl 772026583 SBPCRUIFQCIRMA-GPLLRDDGSA-N 474.897 5.560 5 20 JKBD O=C(C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)Nc1ccccc1C(=O)NC1CC1 864266688 XIARDOOOJCEPOB-OBGWFSINSA-N 498.564 5.666 5 20 JKBD O=C(Nc1cc([N+](=O)[O-])c(F)cc1F)c1cc(-c2nc3ccccc3s2)nc2ccccc12 890493685 KJZXZTIFGBWMRO-UHFFFAOYSA-N 462.437 5.950 5 20 JKBD C[C@H](OC(=O)/C=C\c1ccc2ccc(Cl)cc2n1)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl 912870360 RLRYBCWPSHGNEF-PWWFUAJNSA-N 460.273 5.033 5 20 JKBD O=C(Nc1ccccc1C(=O)Nc1cccc(-c2cnco2)c1)c1ccc([N+](=O)[O-])cc1Cl 916730297 JYZLZBRMFSNRSK-UHFFFAOYSA-N 462.849 5.408 5 20 JKBD O=C(NC1(c2ccc(NC(=O)c3ccc([N+](=O)[O-])o3)cc2)CCC1)c1ccc2occ(Cl)c2c1 1785749693 IJSIJEPPURRWRB-UHFFFAOYSA-N 479.876 5.649 5 20 JKBD Cc1cc(C(=O)Nc2ccc(C3(NC(=O)c4cc5cc([N+](=O)[O-])ccc5s4)CCC3)cc2)on1 1787404133 WYVRJOUIZKIYSO-UHFFFAOYSA-N 476.514 5.167 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)NC1(c2ccc(NC(=O)CNc3ccc(F)cc3)cc2)CCC1 1787987007 ZBMZDKYAVRIICY-UHFFFAOYSA-N 494.498 5.041 5 20 JKBD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc2cc([N+](=O)[O-])ccc2s1)c1ccccc1Cl 1801207520 RTXTULIKJXZWLK-MUJYYYPQSA-N 469.950 5.029 5 20 JKBD O=C(/C=C/c1ccc([N+](=O)[O-])o1)N1CCCC2(CCN(C(=O)[C@@H]3CCC[C@H]4CCCC[C@@H]43)CC2)C1 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DYTDKGBPLMKRLV-UHFFFAOYSA-N 489.313 5.009 5 20 JKBD O=C(Nc1nnc(C(F)F)s1)c1ccccc1Sc1ccc(C(F)(F)F)cc1[N+](=O)[O-] 409454911 DZEFLORNNLGBMS-UHFFFAOYSA-N 476.408 5.806 5 20 JKBD O=C(Nc1cccc(S(=O)(=O)Nc2ccccc2)c1)c1cc2ccccc2c2cccnc12 479093321 HETVUPBYNXHJIU-UHFFFAOYSA-N 453.523 5.441 5 20 JKBD C[C@H](Nc1ccc(C(=O)NCc2ccc(-c3nc4ccccc4s3)o2)cc1[N+](=O)[O-])c1ccccn1 506089152 ZYEOJYDUEIVPIQ-INIZCTEOSA-N 499.552 5.963 5 20 JKBD Cc1cccc(-c2nc(C(C)C)no2)c1NC(=O)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1 509046097 AUGDDMJIIUPTBN-UHFFFAOYSA-N 492.919 6.775 5 20 JKBD COc1ccc(C(=O)N2CCCCCC2)cc1NC(=O)N(Cc1ccc([N+](=O)[O-])cc1)C(C)C 509940766 FIDFPVZTBXSDKP-UHFFFAOYSA-N 468.554 5.062 5 20 JKBD COCCN(C(=O)[C@@H]1C[C@@H]1c1ccc2ccccc2c1)c1nc(-c2ccc([N+](=O)[O-])cc2)cs1 518701605 UTWQJDAXUIQESM-DHIUTWEWSA-N 473.554 5.655 5 20 JKBD COc1ccc(N(C)C(=O)C/C(=C\c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)cn1 521801571 BYXSHRDNTYUQBH-GHRIWEEISA-N 460.515 5.202 5 20 JKBD Cc1cc([N+](=O)[O-])cc(S(=O)(=O)Nc2nc(C)c(-c3nc4ccccc4n3C(F)F)s2)c1C 591583271 SGPLVUNOLMJRCW-UHFFFAOYSA-N 493.517 5.189 5 20 JKBD C[C@H](SCc1nc(O)c2c(-c3ccccc3)csc2n1)C(=O)N1CCc2cc([N+](=O)[O-])ccc21 591602084 OMDULJBUKSBUBZ-AWEZNQCLSA-N 492.582 5.183 5 20 JKBD NC(=O)c1ccc(NCc2ccc(Oc3ccc(F)cc3)c([N+](=O)[O-])c2)cc1N1CCCCC1 600846882 ACNHSTYXSRGHMF-UHFFFAOYSA-N 464.497 5.228 5 20 JKBD COc1cc(C(=O)N(CCc2ccccc2)c2nc3ccccc3s2)c([N+](=O)[O-])cc1OC 602756650 BYXTVOHOBVIAQA-UHFFFAOYSA-N 463.515 5.111 5 20 JKBD CCOc1cc([N+](=O)[O-])c(C(=O)Nc2ccc(C(=O)N(C)C3CCCCC3)c(Cl)c2)cc1OC 603982663 OOJBHOBPPJWYBU-UHFFFAOYSA-N 489.956 5.313 5 20 JKBD Cc1ccccc1NC(=O)[C@H]1CCc2ccccc2N1C(=O)c1ccc(N2CCCC2)c([N+](=O)[O-])c1 608799972 WOJZQEPAZZCLNO-RUZDIDTESA-N 484.556 5.104 5 20 JKBD O=[N+]([O-])c1ccc(-c2ccc(CNC3CCN(c4ccccc4)CC3)o2)c(Br)c1 608836217 ZQJOKEIIJVRKER-UHFFFAOYSA-N 456.340 5.376 5 20 JKBD O=C(CSc1ccc(C(F)(F)F)cc1[N+](=O)[O-])Oc1ccccc1OCC(F)(F)F 727745932 ADPUZSFLAYTVHY-UHFFFAOYSA-N 455.332 5.252 5 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475.526 5.867 5 20 JKBD Cc1cc(C)c(NC(=O)[C@H](C)OC(=O)c2ccc(N[C@@H](C)c3ccccn3)c([N+](=O)[O-])c2)c(C)c1 920545593 UEMUEZHVSVFPGN-OALUTQOASA-N 476.533 5.272 5 20 JKBD C[C@H](OC(=O)[C@@H](C)Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)Nc1ccccc1Cc1ccccc1 920779300 RVIFOBNEYXXJKK-DLBZAZTESA-N 482.920 5.177 5 20 JKBD Cc1oc(C(C)(C)C)cc1C(=O)N1CCCC2(CCN(C(=O)c3c(F)ccc([N+](=O)[O-])c3C)CC2)C1 1808381299 KZGZMMUOBTYFIK-UHFFFAOYSA-N 499.583 5.400 5 20 JKBD O=C(CCc1cccc([N+](=O)[O-])c1)Nc1cc([C@@H]2CCCCN2C(=O)c2ccccc2C2CC2)[nH]n1 1815538599 BZZMHPGKNWYWIS-DEOSSOPVSA-N 487.560 5.134 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2ccc3ccoc3c2)n[nH]1 1821456924 GPDQFKYWDWLXRO-FQEVSTJZSA-N 491.479 5.131 5 20 JKBD C/C(=C\c1cccs1)C(=O)N1CCCC[C@H]1c1cc(NC(=O)/C=C/c2ccccc2[N+](=O)[O-])n[nH]1 1823501174 OOSUITXCIUQLNN-CCNDIDFDSA-N 491.573 5.188 5 20 JKBD Cc1ccc(CC(=O)N2CCC([C@@H]3CCCCN3C(=O)c3cc4ccoc4s3)CC2)cc1[N+](=O)[O-] 1827409903 JBJGGIOFXKOKGH-NRFANRHFSA-N 495.601 5.187 5 20 JKBD Cc1cc(C(=O)N2CCCC[C@H]2C2CCN(C(=O)c3ccc(C(C)(C)C)s3)CC2)ncc1[N+](=O)[O-] 1827829992 BRVNYYFAJZNQQZ-FQEVSTJZSA-N 498.649 5.204 5 20 JKBD CCC(C)(C)C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cccc(Br)c2[N+](=O)[O-])CC1 1830697535 HDURHWCPMNFPAQ-IBGZPJMESA-N 494.430 5.027 5 20 JKBD C[C@@H](OC(=O)CSc1ccc([N+](=O)[O-])cc1)C(=O)Nc1c(Cl)cc(Cl)cc1Cl 9352371 PFZUIJNDJXPLKY-SECBINFHSA-N 463.726 5.218 5 20 JKBD O=C(CSc1ccccc1[N+](=O)[O-])OCC(=O)N1c2ccccc2Sc2ccccc21 24721076 KHSHPCSRPGUHLZ-UHFFFAOYSA-N 452.513 5.060 5 20 JKBD CCOc1cc([N+](=O)[O-])c(C(=O)Nc2cc(Cl)ccc2Oc2ccc(OC)cc2)cc1OC 28245903 BMUZPKZVFLQJRX-UHFFFAOYSA-N 472.881 5.709 5 20 JKBD C[C@@H](Oc1ccccc1)C(=O)O[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Br)c1ccccc1 28302499 FTMVMMUGZPPFBO-VFNWGFHPSA-N 499.317 5.048 5 20 JKBD Cn1ccnc1[C@H](NC(=O)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1)c1ccccc1F 29999174 AEGZZJYVGSDDIL-JOCHJYFZSA-N 480.883 5.433 5 20 JKBD CSc1nc(-c2ccco2)nc(C)c1C(=O)Nc1nc(-c2cccc([N+](=O)[O-])c2)c(C)s1 195704193 CMNXFFOQGSLSFG-UHFFFAOYSA-N 467.532 5.359 5 20 JKBD O=C(Nc1nnc(C(F)F)s1)c1c2c(nc3ccccc13)/C(=C\c1ccc([N+](=O)[O-])cc1)CCC2 409461712 WHINXRRDVFQVRA-OWBHPGMISA-N 493.495 6.061 5 20 JKBD Cn1cc(C(=O)Nc2ccc(Oc3cccc(Br)c3)nc2)c(-c2ccc([N+](=O)[O-])cc2)n1 503334753 HEYBFHBQTJGJMD-UHFFFAOYSA-N 494.305 5.197 5 20 JKBD C[C@H](Nc1ccc(C(=O)N[C@H]2CCSc3c(F)cccc32)cc1[N+](=O)[O-])c1ccccn1 506087630 SBNAEPPYDIEXJJ-LIRRHRJNSA-N 452.511 5.269 5 20 JKBD CCC(CC)n1c(COc2ccccc2Cl)nnc1Sc1ccc(C(=O)NC)cc1[N+](=O)[O-] 507104821 SSBWCOJKIIBAAX-UHFFFAOYSA-N 489.985 5.291 5 20 JKBD COc1cc(C(=O)Nc2ccc(Oc3ccc(C)cc3)nc2)c([N+](=O)[O-])cc1OCc1cscn1 509959618 YILXQKZRUOUVNT-UHFFFAOYSA-N 492.513 5.387 5 20 JKBD COc1ccc(CSc2nnc(SCc3cc([N+](=O)[O-])ccc3OC(C)C)s2)cc1 511059753 OHXMNAGSVNTASE-UHFFFAOYSA-N 463.606 5.827 5 20 JKBD COc1ccc(-c2nnc(S[C@@H](C)C(=O)Nc3ccc([N+](=O)[O-])cc3Cl)n2CC(C)C)cc1 513917233 TWVDBSGESXRXTQ-AWEZNQCLSA-N 489.985 5.291 5 20 JKBD O=[N+]([O-])c1ccc(-c2ccc(CNCc3cccc(OCC(F)(F)F)c3)o2)c(Br)c1 520950267 MLMXBPVRACTUQM-UHFFFAOYSA-N 485.256 5.848 5 20 JKBD CC[C@@H](C)NC(=O)c1cccc(CNCc2cn(-c3ccccc3)nc2-c2ccc([N+](=O)[O-])cc2)c1 520950337 PFVNOTCUJNSFMU-HXUWFJFHSA-N 483.572 5.266 5 20 JKBD O=C1Nc2cc(Cl)ccc2[C@H]1C1CCN(C(=O)c2cc3ccccc3c3cccnc23)CC1 589589836 LDXLBVFIBITLPM-XMMPIXPASA-N 455.945 5.630 5 20 JKBD O=C(CSc1nnc(-c2ccccc2)n1-c1ccccc1)Nc1cc([N+](=O)[O-])ccc1OC(F)F 603638613 AXUURLJXVYMGSF-UHFFFAOYSA-N 497.483 5.175 5 20 JKBD CC(C)Oc1cccc([C@@H](C)NC(=O)C2CCN(c3ccc(C(F)(F)F)cc3[N+](=O)[O-])CC2)c1 603903224 WIFRHLOMHADSHJ-MRXNPFEDSA-N 479.499 5.495 5 20 JKBD CCc1cc(N2CCC(c3c(OC)cc(OC)cc3OC)CC2)nc(-c2ccc([N+](=O)[O-])cc2)n1 604303523 LXXTULBRRNAOOP-UHFFFAOYSA-N 478.549 5.024 5 20 JKBD Cc1ccc(-c2nnc([C@@H](C)Nc3ccc(NS(=O)(=O)c4ccc(C)c([N+](=O)[O-])c4)cc3)o2)cc1 610550764 NVQVGXZHKXZUDR-QGZVFWFLSA-N 493.545 5.236 5 20 JKBD C[C@@H](OC(=O)c1cc([N+](=O)[O-])ccc1Br)C(=O)Nc1ccccc1Cc1ccccc1 725984456 CMRHOVJWAUCESQ-OAHLLOKOSA-N 483.318 5.132 5 20 JKBD C[C@@H](OC(=O)c1csc(-c2ccccc2Cl)n1)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl 727563791 IZUWDSCXVVCDTI-SNVBAGLBSA-N 466.302 5.209 5 20 JKBD CC(=O)Nc1ccc(N[C@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2ccccc2)cc1C 913095710 WFSRRGLDLHTQKK-QFIPXVFZSA-N 452.898 5.307 5 20 JKBD CC(=O)Nc1cccc(-n2c(Sc3cc(Cl)c(C(F)(F)F)cc3[N+](=O)[O-])nnc2C2CC2)c1 914571096 KRZQUTQYLALMED-UHFFFAOYSA-N 497.886 5.835 5 20 JKBD C[C@H](Cc1ccco1)NC(=O)c1ccccc1Sc1ccc(C(F)(F)F)cc1[N+](=O)[O-] 914744217 GYESAUJLFHZEPL-CYBMUJFWSA-N 450.438 5.719 5 20 JKBD COc1ccc(Oc2ccc([N+](=O)[O-])cc2C(=O)OCC(=O)Nc2c(C)cc(C)cc2Cl)cc1 915441456 CWPYBGRWDIOGNX-UHFFFAOYSA-N 484.892 5.461 5 20 JKBD Cc1ccc(-c2csc(NC(=O)c3cc(OCC(F)(F)F)ccc3[N+](=O)[O-])n2)cc1[N+](=O)[O-] 915834612 YMCSVTFRMCKVCS-UHFFFAOYSA-N 482.396 5.128 5 20 JKBD CCN(C(=O)COC(=O)c1cc([N+](=O)[O-])ccc1Oc1ccccc1)c1nc2ccccc2s1 919193204 SSUTUQRFHDKBGW-UHFFFAOYSA-N 477.498 5.207 5 20 JKBD Cc1ccc(NC(=O)[C@@H](OC(=O)c2cc(F)cc3nc(C)c(C)nc23)c2ccccc2)c([N+](=O)[O-])c1 919546900 UAXYDJQELBMGID-DEOSSOPVSA-N 488.475 5.139 5 20 JKBD C[C@H](SCc1nc(O)c2c(-c3ccccc3)csc2n1)C(=O)O[C@H](C)c1ccc([N+](=O)[O-])cc1 920155591 XWPDUDFGZQTPHJ-CABCVRRESA-N 495.582 5.898 5 20 JKBD C[C@@H](OC(=O)c1csc(-c2ccc(Cl)cc2Cl)n1)C(=O)Nc1ccc([N+](=O)[O-])cc1 921222695 GLFQMFREPFNWIO-SNVBAGLBSA-N 466.302 5.209 5 20 JKBD O=C(/C=C/c1ccc([N+](=O)[O-])o1)Nc1ccc(C2(NC(=O)[C@H]3CCCCC3(F)F)CCC2)cc1 1786205936 VEHFDXGJGFWRON-SINXNMPMSA-N 473.476 5.161 5 20 JKBD O=C(CCc1cccc([N+](=O)[O-])c1)Nc1ccc(C2(NC(=O)C3(C(F)(F)F)CC3)CCC2)cc1 1786600410 SDIOCRQBZWTUAA-UHFFFAOYSA-N 475.467 5.004 5 20 JKBD O=C(Cc1cc(F)ccc1[N+](=O)[O-])NC1(c2ccc(NC(=O)c3ccc4occc4c3)cc2)CCC1 1789051555 ZDOYBBMXITXANE-UHFFFAOYSA-N 487.487 5.471 5 20 JKBD O=C(CCc1cccc([N+](=O)[O-])c1)NC1(c2ccc(NC(=O)[C@@]3(F)CCCC=C3F)cc2)CCC1 1792374183 PRKVAQOVMNBMDK-AREMUKBSSA-N 483.515 5.407 5 20 JKBD CC1(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cc4cc([N+](=O)[O-])ccc4s2)C3)CCCCC1 1802217548 YTCRLJKPIPQEEC-BCDXTJNWSA-N 455.580 5.032 5 20 JKBD Cc1c(C(=O)N2CC[C@H](CNC(=O)[C@@]3(C)CC=CCC3)[C@@H]2c2cccnc2)cc(Cl)cc1[N+](=O)[O-] 1813585354 HOWFZNVZQUBFGJ-BLFHIAQRSA-N 496.995 5.018 5 20 JKBD O=C(CCc1ccccc1Cl)Nc1cc([C@H]2CCCCN2C(=O)c2ccc([N+](=O)[O-])cc2F)[nH]n1 1817004617 PXJMFQSXBFLHLG-OAQYLSRUSA-N 499.930 5.049 5 20 JKBD O=C(Nc1cc([C@@H]2CCCCN2C(=O)[C@@H]2CCC[C@@H]3CCCC[C@@H]32)[nH]n1)c1ccc([N+](=O)[O-])cc1F 1821054578 PNEBDIJECQGCCX-CVFMPKEZSA-N 497.571 5.369 5 20 JKBD O=C(Nc1cc([C@@H]2CCCCN2C(=O)CC2CCC2)[nH]n1)c1cc2cc([N+](=O)[O-])ccc2s1 1821610708 JLNOXCRNMRTZKW-SFHVURJKSA-N 467.551 5.029 5 20 JKBD O=C(/C=C/c1ccccc1[N+](=O)[O-])N1CCC([C@H]2CCCCN2C(=O)[C@@H]2CCCCC2(F)F)CC1 1824651109 KHYXEHRCBOUXHF-QFBGAIGZSA-N 489.563 5.053 5 20 JKBD Cc1cc(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3cc4cc([N+](=O)[O-])ccc4s3)CC2)ccn1 1829252022 DXYAQPNGELVMOR-JOCHJYFZSA-N 492.601 5.060 5 20 JKBD CC[C@H]1CC[C@H](C(=O)N2CCC([C@@H]3CCCCN3C(=O)c3ccc([N+](=O)[O-])cc3F)CC2)CC1 1830497808 NIXXNGKOGIYUBY-WXVUKLJWSA-N 473.589 5.184 5 20 JKBD Cc1ccc(C)c(C(=O)N2CCC([C@@H]3CCCCN3C(=O)CSc3ccccc3[N+](=O)[O-])CC2)c1 1831777073 BOVUDPSUKORWQS-QHCPKHFHSA-N 495.645 5.237 5 20 JKBD O=C(CSc1nnc(COc2ccccc2Cl)n1C1CC1)Nc1ccc(Cl)c([N+](=O)[O-])c1 9415031 QTMQYXLUSNUDSC-UHFFFAOYSA-N 494.360 5.138 5 20 JKBD CC(C)n1c(SCC(=O)Nc2cc([N+](=O)[O-])ccc2F)nnc1-c1ccc(Cl)cc1Cl 9826812 GJNVIYBNRQEMNG-UHFFFAOYSA-N 484.340 5.611 5 20 JKBD C[C@H](Sc1nnc(-c2ccco2)n1C1CCCCC1)C(=O)Nc1ccc(F)c([N+](=O)[O-])c1 10015125 HYFVBQQVCUFLSN-ZDUSSCGKSA-N 459.503 5.210 5 20 JKBD O=C(COC(=O)CCc1ncc(-c2ccc(Cl)cc2Cl)o1)Nc1ccc([N+](=O)[O-])cc1Cl 12271886 YPLYIIAUEZVPIJ-UHFFFAOYSA-N 498.706 5.325 5 20 JKBD O=C(Nc1ccc(S(=O)(=O)C(F)F)cc1)c1ccc(NCc2ccccc2Cl)c([N+](=O)[O-])c1 15998673 QIOBOCKTEHSMLT-UHFFFAOYSA-N 495.891 5.109 5 20 JKBD O=C(OCc1nnc(-c2ccc([N+](=O)[O-])cc2)o1)c1ccc(Oc2ccc(C(F)(F)F)cn2)cc1 16169041 JNQZLXFFNKFIIU-UHFFFAOYSA-N 486.362 5.208 5 20 JKBD CSc1ccc([N+](=O)[O-])c(C(=O)O[C@H](C(=O)Nc2cc(C)ccc2C)c2ccccc2)c1 16196138 ADYDPBYQJZGBAH-QFIPXVFZSA-N 450.516 5.470 5 20 JKBD O=C(CCC(=O)c1ccccc1)O[C@@H](C(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1)c1ccccc1 20863476 TWYQXYXXPVYGGM-HSZRJFAPSA-N 466.877 5.134 5 20 JKBD Cc1cccc(-c2nnc(S[C@@H](C(=O)Nc3ccc(C)cc3[N+](=O)[O-])c3ccccc3)n2C)c1 22010638 YRPOUNMLVJNEAQ-JOCHJYFZSA-N 473.558 5.479 5 20 JKBD O=C(NCc1cccc(NC(=O)C2CCC2)c1)c1cc([N+](=O)[O-])ccc1Sc1ccccc1 30478059 SBJBVGUOELJQPX-UHFFFAOYSA-N 461.543 5.415 5 20 JKBD Cn1cnnc1Sc1ccc(C(=O)Nc2ccccc2Oc2cccc(F)c2)cc1[N+](=O)[O-] 59920292 PJRXQJCEVOXGAU-UHFFFAOYSA-N 465.466 5.058 5 20 JKBD Cc1cc(-c2cccc(Cl)c2)ccc1NC(=O)CSc1ccc(C(N)=O)cc1[N+](=O)[O-] 72085093 LZGBGDDAFKUISE-UHFFFAOYSA-N 455.923 5.053 5 20 JKBD COc1ccc2[nH]cc(C3CCN(C(=O)c4ccc(N[C@H](C)c5ccccn5)c([N+](=O)[O-])c4)CC3)c2c1 108866968 DZKASYXHKPIVCP-GOSISDBHSA-N 499.571 5.673 5 20 JKBD Cc1c(C(=O)Nc2ccccc2Oc2ncc(Cl)cc2Cl)nnn1-c1cccc([N+](=O)[O-])c1 195612612 PPIGJBFDHISYSD-UHFFFAOYSA-N 485.287 5.230 5 20 JKBD CC(C)(C)S(=O)(=O)Cc1ccc(NC(=O)CSc2ccc(C(F)(F)F)cc2[N+](=O)[O-])cc1 497778362 HCDUUDLSAAYNCR-UHFFFAOYSA-N 490.525 5.058 5 20 JKBD CC(=O)N1CCN(c2ccc(C(=O)Nc3ccc(SC4CCCCC4)cc3C)cc2[N+](=O)[O-])CC1 498474768 CEDGNDMYQZRFGY-UHFFFAOYSA-N 496.633 5.249 5 20 JKBD O=C(CCNc1ccc(C(F)(F)F)cc1[N+](=O)[O-])Nc1ccc(NC(=O)N2CCCCCC2)cc1 498531059 YWNWUOPSIKTNMY-UHFFFAOYSA-N 493.486 5.462 5 20 JKBD CN(C)C(=O)Cc1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2Sc2ccc(Cl)cc2)cc1 499991411 QZJHFPXXWNWDTP-UHFFFAOYSA-N 469.950 5.282 5 20 JKBD COc1ccc(-c2csc(NC(=O)c3ccc(N[C@@H](C)c4ccccn4)c([N+](=O)[O-])c3)n2)cc1F 505983058 XUDCZLJJZDMRTP-AWEZNQCLSA-N 493.520 5.686 5 20 JKBD O=C(c1c2c(nc3ccccc13)/C(=C\c1cccc([N+](=O)[O-])c1)CCC2)N1CCCSCC1 512522517 VKPRMTAQUBFGQN-MNDPQUGUSA-N 459.571 5.599 5 20 JKBD Cc1csc(N(CC(F)(F)F)C(=O)c2ccc(N[C@@H](C)c3ccccn3)c([N+](=O)[O-])c2)n1 512639143 UXFAYADBISFJNG-ZDUSSCGKSA-N 465.457 5.137 5 20 JKBD COc1ccc(-c2[nH]c3ccccc3c2CCC(=O)N2CCc3ccc([N+](=O)[O-])cc32)c(OC)c1 513032494 MKDXTKAWGUTSIH-UHFFFAOYSA-N 471.513 5.282 5 20 JKBD Cc1cc([N+](=O)[O-])ccc1NC(=O)CCSc1nnc(-c2ccccc2Cl)n1C1CCCC1 514348809 DJMICHVHVBUHIF-UHFFFAOYSA-N 485.997 6.051 5 20 JKBD COc1cccc([C@H](CNC(=O)c2ccc(Cl)cc2[N+](=O)[O-])c2c[nH]c3ccccc23)c1OC 514981577 ABHMVULJPFGMOE-FQEVSTJZSA-N 479.920 5.309 5 20 JKBD COc1ccc([C@H](C)N[C@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Br)c2ccccc2)cc1 521153041 JPJAUBQVIDNSQB-NYHFZMIOSA-N 484.350 5.397 5 20 JKBD COc1cc(C(=O)NC(C)(C)c2cccc(C(F)(F)F)c2)c([N+](=O)[O-])cc1OCc1cscn1 573811387 KIHSGHSGTXPLEY-UHFFFAOYSA-N 495.479 5.323 5 20 JKBD O=C(Nc1ccccc1CN1CCOCC1)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1 604002697 JSCDYHQWWQEIQC-UHFFFAOYSA-N 467.909 5.125 5 20 JKBD O=C(Nc1cc(Cl)ccc1C(=O)N1CCCCC1)c1csc(-c2ccc([N+](=O)[O-])cc2)n1 609057284 FECJCNYWJKHRRY-UHFFFAOYSA-N 470.938 5.250 5 20 JKBD Cc1ccc(Sc2ccc(C(=O)NC3CCN(C(=O)c4ccccc4)CC3)cc2[N+](=O)[O-])cc1 612978626 IDWZFEWMUQECJP-UHFFFAOYSA-N 475.570 5.089 5 20 JKBD CC(C)N(Cc1nnc(-c2cccc([N+](=O)[O-])c2)o1)C(=O)c1csc(-c2ccc(Cl)cc2)n1 746135198 WFNLTXYKIZUXDW-UHFFFAOYSA-N 483.937 5.473 5 20 JKBD O=C(Oc1ccc2c(-c3ccc([N+](=O)[O-])cc3)cc(=O)oc2c1)c1csc(-c2cccs2)n1 747482398 ZWEQUEUNEUNZJM-UHFFFAOYSA-N 476.491 5.772 5 20 JKBD COc1ccc(-c2nc(COC(=O)c3csc(-c4ccc([N+](=O)[O-])cc4)n3)cs2)c(OC)c1 747957716 QUFFXMXPCJKZMJ-UHFFFAOYSA-N 483.527 5.216 5 20 JKBD C[C@H](OC(=O)c1cc(-c2cccc(Cl)c2)no1)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 748925004 KRWANHOTMGIMEO-JTQLQIEISA-N 483.786 5.106 5 20 JKBD Cc1c(C(=O)OCC(=O)Nc2c(C(C)C)cccc2C(C)C)cc([N+](=O)[O-])c(C)c1[N+](=O)[O-] 748947566 OGABGJILEFHGHE-UHFFFAOYSA-N 457.483 5.162 5 20 JKBD O=C(NCc1ccccc1COCc1ccccc1)c1cc([N+](=O)[O-])ccc1Br 751088525 JOPDSKZWBAPZEN-UHFFFAOYSA-N 455.308 5.004 5 20 JKBD CN(C(=O)c1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2Br)cc1Cl)C1CCCCC1 751093172 NONKQORSGRQBCV-UHFFFAOYSA-N 494.773 5.668 5 20 JKBD C[C@H](Nc1ccc(-c2nc(-c3cccnc3Oc3ccccc3)no2)cc1[N+](=O)[O-])c1ccccn1 904455082 XYCXSWWOEGYKMJ-KRWDZBQOSA-N 480.484 6.067 5 20 JKBD O=[N+]([O-])c1cccc(-c2nc(-c3nc(-c4ccc(Oc5ccc(F)cc5)nc4)no3)cs2)c1 904512861 ZJNJVQUBKLBUNO-UHFFFAOYSA-N 461.434 5.762 5 20 JKBD COc1cccc([C@H](CNC(=S)Nc2ccc([N+](=O)[O-])cc2)c2c[nH]c3ccccc23)c1OC 916123757 CWLWCQIHYVZLEC-NRFANRHFSA-N 476.558 5.212 5 20 JKBD Cc1nccn1-c1ccc(NC(=O)c2ccc(NCc3ccccc3Cl)c([N+](=O)[O-])c2)cn1 917190314 QFBJSJDKXANRHA-UHFFFAOYSA-N 462.897 5.002 5 20 JKBD CC(=O)N(c1ccc(C(F)(F)F)cc1)c1nc(COC(=O)c2cccc(C)c2[N+](=O)[O-])cs1 920490800 WCKDALMSQVAKPZ-UHFFFAOYSA-N 479.436 5.420 5 20 JKBD O=C(c1cc([N+](=O)[O-])ccc1Oc1ccccc1)N1CCc2c(ncn2CCc2ccccc2)C1 929067948 XETIJEHUYGIDLK-UHFFFAOYSA-N 468.513 5.025 5 20 JKBD O=C(CCc1ccccn1)Nc1ccc(C2(NC(=O)C3(c4cccc([N+](=O)[O-])c4)CCC3)CCC2)cc1 1786961149 ZASSUEALMDLOPY-UHFFFAOYSA-N 498.583 5.178 5 20 JKBD O=C(CSc1ccccc1[N+](=O)[O-])NC1(c2ccc(NC(=O)c3ccsc3)cc2)CCC1 1787286397 UZZJHUUPDOXUHR-UHFFFAOYSA-N 467.572 5.196 5 20 JKBD Cc1cc(CCCC(=O)NC2(c3ccc(NC(=O)c4cncs4)cc3)CCC2)c([N+](=O)[O-])cc1F 1787529945 DDBLZGNPUSJYHF-UHFFFAOYSA-N 496.564 5.269 5 20 JKBD CC1=CC[C@@H](C(=O)Nc2ccc(C3(NC(=O)c4cc([N+](=O)[O-])c(O)cc4C)CCC3)cc2)CC1 1789115612 YIMAVHBKAHXTSC-GOSISDBHSA-N 463.534 5.103 5 20 JKBD CN(C)c1ccc([N+](=O)[O-])cc1C(=O)Nc1ccc(C2(NC(=O)c3cccc4cc[nH]c34)CCC2)cc1 1790794301 LMTQFTIUBQAHJY-UHFFFAOYSA-N 497.555 5.204 5 20 JKBD O=C(c1ccc([N+](=O)[O-])o1)N1CCCC2(CCN(C(=O)c3ccc(Cl)cc3C(F)(F)F)CC2)C1 1804650028 NPBXIBBBTWEXND-UHFFFAOYSA-N 499.873 5.019 5 20 JKBD CC(C)C1(C(=O)N2CCC([C@@H]3CCCCN3C(=O)Cc3ccc(Cl)cc3[N+](=O)[O-])CC2)CCC1 1824158517 LTHGQCZCXVQTCY-QFIPXVFZSA-N 490.044 5.237 5 20 JKBD Cc1cccc(C(=O)N2CCCC[C@H]2C2CCN(C(=O)c3ccc([N+](=O)[O-])cc3F)CC2)c1Cl 1832602784 FCFGWXWFUGNPBD-QFIPXVFZSA-N 487.959 5.243 5 20 JKBD COc1ccc(C(=O)C2CCN(C(=O)c3ccc(Nc4ccccc4)c([N+](=O)[O-])c3)CC2)cc1 12741472 GIRZINWKXJXCJK-UHFFFAOYSA-N 459.502 5.082 5 20 JKBD CCOc1ccc(Oc2ccccc2NC(=O)c2ccc(Sc3nncn3C)c([N+](=O)[O-])c2)cc1 14794247 LYSZUZCKRNVYDF-UHFFFAOYSA-N 491.529 5.318 5 20 JKBD Cc1ccc(Sc2ccc(C(=O)Nc3cc(S(C)(=O)=O)ccc3Cl)cc2[N+](=O)[O-])cc1 15911409 JLKMFCPYOFTEDF-UHFFFAOYSA-N 476.963 5.364 5 20 JKBD CC(=O)Nc1cccc(N[C@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Br)c2ccccc2)c1 23865220 LHOOFVALGHDJMB-NRFANRHFSA-N 483.322 5.108 5 20 JKBD Cc1ccc(-n2c(SCc3cc([N+](=O)[O-])cc4c3OCOC4)nnc2-c2ccncc2)cc1C 24641796 SJVDVKSSLHYVGA-UHFFFAOYSA-N 475.530 5.013 5 20 JKBD COc1ccc(CSCC(=O)Nc2cc(Cl)ccc2OCC(F)(F)F)cc1[N+](=O)[O-] 31907304 IRLNARXAAMFSMT-UHFFFAOYSA-N 464.849 5.070 5 20 JKBD CN(Cc1nc(-c2cccc([N+](=O)[O-])c2)no1)Cc1cn(-c2ccccc2)nc1-c1ccccc1 43783027 LYNQAQWRBMLYFH-UHFFFAOYSA-N 466.501 5.130 5 20 JKBD Cc1sc(NC(=O)c2cnn(-c3ccccc3)c2C(F)(F)F)nc1-c1cccc([N+](=O)[O-])c1 195704129 WKORRPFMRFWYEU-UHFFFAOYSA-N 473.436 5.484 5 20 JKBD O=C(NCC[C@@H]1C(=O)Nc2ccccc21)c1cc([N+](=O)[O-])ccc1Sc1ccc(Cl)cc1 491242833 JDEQWZAYCUIYLY-SFHVURJKSA-N 467.934 5.255 5 20 JKBD CSc1ccc(C(=O)Nc2nc(-c3sccc3Br)cs2)cc1[N+](=O)[O-] 500737191 AEWJJBNPYMKOEI-UHFFFAOYSA-N 456.368 5.517 5 20 JKBD O=C(Nc1ccc(NC(=O)c2ccc(NC3CC3)c([N+](=O)[O-])c2)cc1)c1ccc(Cl)cc1 507613107 OCPZFCXHLFGLFB-UHFFFAOYSA-N 450.882 5.327 5 20 JKBD CC(C)CNC(=O)c1ccc(NC(=O)c2ccc(N[C@@H](C)c3ccccn3)c([N+](=O)[O-])c2)cc1Cl 509266135 XFDSEQQKOHRGOU-INIZCTEOSA-N 495.967 5.454 5 20 JKBD C[C@@H]1CCC[C@@H](C)N1C(=O)c1cc(Cl)ccc1NC(=O)c1ccc(-n2ccnc2)c([N+](=O)[O-])c1 512340146 GGPNURIZYIAESA-HZPDHXFCSA-N 481.940 5.089 5 20 JKBD CCOc1cc(NC(=O)N2CC=C(c3c[nH]c4ccccc34)CC2)c([N+](=O)[O-])cc1OCC 514543068 ICJVRBYKMJVGRU-UHFFFAOYSA-N 450.495 5.195 5 20 JKBD CCCCc1c(C)nc2nc(S[C@@H](C)C(=O)Nc3ccc([N+](=O)[O-])cc3C(F)(F)F)nn2c1C 515565113 CTRUWGIGCRWMBP-ZDUSSCGKSA-N 496.515 5.130 5 20 JKBD COc1ccc(OC)c([C@H]2CCCN2C(=O)COc2ccc(-c3ccccc3)cc2[N+](=O)[O-])c1 516786533 NXDUFTAVEHUCPS-JOCHJYFZSA-N 462.502 5.022 5 20 JKBD COc1ccc(CNC[C@@H]2CCCO[C@H]2c2ccccc2)cc1OCc1ccc([N+](=O)[O-])cc1 517549450 URVZDNZVOGEURP-HOFKKMOUSA-N 462.546 5.440 5 20 JKBD COc1cc(CNCc2ccc(Br)cc2Cl)c([N+](=O)[O-])cc1OCC(F)(F)F 520217866 LBEWHXVITOIIOL-UHFFFAOYSA-N 483.668 5.250 5 20 JKBD COc1ccc(Oc2ccc([N+](=O)[O-])cc2C(=O)NCc2coc(-c3cccs3)n2)cc1 520399335 PMBZUJDXEXOQPP-UHFFFAOYSA-N 451.460 5.042 5 20 JKBD COc1cc([C@H](C)NCc2cn(-c3ccccc3)nc2-c2ccc([N+](=O)[O-])cc2)cc(OC)c1OC 520949762 PQDJEFNUPNLBPX-SFHVURJKSA-N 488.544 5.324 5 20 JKBD COc1cc(C(=O)N(C)c2nc3ccccc3o2)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 591888074 LRARXLKICOXNKT-UHFFFAOYSA-N 453.838 5.467 5 20 JKBD C[C@@H](c1ccccc1)n1c(SCCC(=O)Nc2ccccc2[N+](=O)[O-])nnc1-c1ccccc1 603917470 SFHHHDPCMIIXAV-SFHVURJKSA-N 473.558 5.584 5 20 JKBD CC(C)Oc1ccccc1CN[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Br)c1ccccc1 604047339 PCJBSJNFFYROAX-QHCPKHFHSA-N 498.377 5.614 5 20 JKBD CSc1ccc(C(=O)c2ccccc2C(=O)N2CCC[C@@H](CN3CCC(C)CC3)C2)cc1[N+](=O)[O-] 604525404 BANDNAXMIDTRED-FQEVSTJZSA-N 495.645 5.132 5 20 JKBD O=C(Nc1cnn(Cc2ccccn2)c1)c1ccc(Sc2nc3ccccc3s2)c([N+](=O)[O-])c1 604548894 GRTUIHVCCCOZND-UHFFFAOYSA-N 488.554 5.248 5 20 JKBD C[C@H](Nc1ccc(C(=O)Nc2ccccc2NC(=O)c2cccs2)cc1[N+](=O)[O-])c1ccccn1 608808833 HDDAKIMDIYNCLV-INIZCTEOSA-N 487.541 5.729 5 20 JKBD C[C@H](Nc1ccc(C(=O)N[C@H]2C[C@H]2c2cccc(Br)c2)cc1[N+](=O)[O-])c1ccccn1 608809388 FBGAVOCWJYKGCV-XQAUZQBESA-N 481.350 5.211 5 20 JKBD Cc1ccc(NC(=O)c2ccc(N[C@@H](C)c3nc4ccccc4n3C(F)F)c([N+](=O)[O-])c2)cc1 608972395 GBEGUHXAYWCGMV-HNNXBMFYSA-N 465.460 6.073 5 20 JKBD C[C@H](Nc1ccc(C(=O)N(Cc2ccc3c(c2)CCO3)C2CCCC2)cc1[N+](=O)[O-])c1ccccn1 609064522 BWGVXQXDNFIDFL-IBGZPJMESA-N 486.572 5.683 5 20 JKBD C[C@H](OC(=O)c1cc(-c2ccc(C(F)(F)F)cc2)no1)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl 730857995 IUWKPOQIXPSAIW-JTQLQIEISA-N 483.786 5.106 5 20 JKBD Cc1ccc(C(=O)N(C)c2ccc(OC(=O)c3cc([N+](=O)[O-])ccc3Br)cc2)cc1 751061642 OEOBLOJMXWTMBR-UHFFFAOYSA-N 469.291 5.162 5 20 JKBD CC(=O)N(c1cccc(Cl)c1)c1nc(COC(=O)CSc2ccccc2[N+](=O)[O-])cs1 819010864 MRXLUVRVPPMWBJ-UHFFFAOYSA-N 477.951 5.225 5 20 JKBD COc1ccc(-c2cc(C(=O)N(Cc3nnc(-c4cccc([N+](=O)[O-])c4)o3)C(C)C)sc2C)cc1 864244600 DTZBNFYUDZSPGM-UHFFFAOYSA-N 492.557 5.741 5 20 JKBD C[C@H](OC(=O)CCOc1ccc(Cl)c(Cl)c1)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 914963158 WDCGSRCWCAXDBB-JTQLQIEISA-N 495.237 5.260 5 20 JKBD Cc1nc(Cc2ccccc2)sc1C(=O)N(Cc1nnc(-c2cccc([N+](=O)[O-])c2)o1)C(C)C 915135273 CMABSESTWIGFLS-UHFFFAOYSA-N 477.546 5.051 5 20 JKBD O=C(Nc1ccc2oc(=O)ccc2c1)c1cc([N+](=O)[O-])ccc1Sc1ccc(Cl)cc1 918669290 COVRTFYPZJVYAR-UHFFFAOYSA-N 452.875 5.758 5 20 JKBD O=C1CCc2cc(C(=O)COC(=O)c3ccc(Oc4ccc(Cl)cc4[N+](=O)[O-])cc3)c(F)cc2N1 918881869 PNTKQURSKZIMBN-UHFFFAOYSA-N 498.850 5.104 5 20 JKBD C[C@H](Nc1ccc(C(=O)O[C@@H](Cn2cncn2)c2ccc(Cl)cc2)cc1[N+](=O)[O-])c1ccccn1 920772879 CFDWVHGNLVIQGA-HJPURHCSSA-N 492.923 5.006 5 20 JKBD O=C(CCc1cccc([N+](=O)[O-])c1)Nc1ccc(C2(NC(=O)c3c(F)ccnc3Cl)CCC2)cc1 1786601699 NDHSSBIGNNJQCH-UHFFFAOYSA-N 496.926 5.163 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)c3cccc(F)c3[N+](=O)[O-])CCC2)cc1)c1cc2cc(F)ccc2[nH]1 1789235876 OHQGJKIYKBHOOE-UHFFFAOYSA-N 490.466 5.416 5 20 JKBD C/C(=C\c1ccc(C)o1)C(=O)Nc1ccc(C2(NC(=O)c3cc(C)c([N+](=O)[O-])cn3)CCC2)cc1 1789584873 MCLZEPNIWNNURH-GHRIWEEISA-N 474.517 5.051 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)Nc1ccc(C2(NC(=O)CCC(F)(F)F)CCC2)cc1 1790771051 NIUVICJQOWJRKS-UHFFFAOYSA-N 467.419 5.133 5 20 JKBD Cc1cc(CCCC(=O)N2CCCC3(CCN(C(=O)C4CC5(CCC5)C4)CC3)C2)c([N+](=O)[O-])cc1F 1805823107 FOTITOUQBNZJJM-UHFFFAOYSA-N 499.627 5.177 5 20 JKBD CC1(C)CCC(CC(=O)NC[C@H]2CCN(C(=O)c3cccc(F)c3[N+](=O)[O-])[C@H]2c2cccnc2)CC1 1808901694 IEOWCPUOEYWEAM-YKSBVNFPSA-N 496.583 5.055 5 20 JKBD Cc1c(Cl)cccc1C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cc(F)cc([N+](=O)[O-])c2)n[nH]1 1821163559 SHBISVWGHVRBRX-HXUWFJFHSA-N 485.903 5.039 5 20 JKBD O=C(CCC1CCCC1)N1CCC([C@@H]2CCCCN2C(=O)/C=C/c2ccccc2[N+](=O)[O-])CC1 1832903213 VIXUNTZENPTUJY-RQOTYCFOSA-N 467.610 5.198 5 20 JKBD Cc1c(-c2ccccc2)oc2c(C(=O)OCC(=O)Nc3cc(Cl)ccc3[N+](=O)[O-])cccc2c1=O 9459337 YZPPRJNGZUHPAK-UHFFFAOYSA-N 492.871 5.126 5 20 JKBD Cc1csc(SCc2ccccc2C(=O)O[C@H](C)C(=O)Nc2cc([N+](=O)[O-])ccc2Cl)n1 9622842 RBPHLUGSODHVPL-CYBMUJFWSA-N 491.978 5.489 5 20 JKBD CCn1c(S[C@H](C)C(=O)Nc2ccccc2[N+](=O)[O-])nc2scc(-c3cccs3)c2c1=O 9751462 MAMKAIWYBQDSBE-GFCCVEGCSA-N 486.600 5.234 5 20 JKBD Cc1nn(-c2ccccc2)c(C)c1NC(=O)c1ccc(NCc2ccccc2Cl)c([N+](=O)[O-])c1 10539792 JELGNZRRHHOFNT-UHFFFAOYSA-N 475.936 5.915 5 20 JKBD Cc1cc(=O)c(C(=O)Nc2ccccc2Oc2ccccc2Cl)nn1-c1ccccc1[N+](=O)[O-] 15711444 LZBOHMCWDXZOMB-UHFFFAOYSA-N 476.876 5.147 5 20 JKBD COc1ccc([C@@H](CNC(=O)C2CCN(c3ccccc3[N+](=O)[O-])CC2)c2c[nH]c3ccccc23)cc1 18074478 MGSVVUCDFGMIAZ-XMMPIXPASA-N 498.583 5.249 5 20 JKBD Cc1cccc([N+](=O)[O-])c1NC(=O)CSc1nc2cc(Cl)ccc2c(=O)n1CCC(C)C 20972746 OWEWLNKJVDNXKN-UHFFFAOYSA-N 474.970 5.043 5 20 JKBD CCSc1nnc(S[C@@H](C(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)c2ccccc2)s1 22041955 ZISWETIQJMFUKN-OAHLLOKOSA-N 466.997 5.684 5 20 JKBD O=C(CSc1ccc([N+](=O)[O-])cc1)N(Cc1ccccn1)c1ccc(Br)cc1 59782281 ZFKHRGZNYGCXEF-UHFFFAOYSA-N 458.337 5.078 5 20 JKBD CC(C)Oc1ccc(NC(=O)c2ccccc2NC(=O)c2ccc([N+](=O)[O-])cc2Cl)cc1 72010961 VMTHVLCOOHGLDQ-UHFFFAOYSA-N 453.882 5.540 5 20 JKBD CN(C(=O)c1ccc(NC(=O)Cn2c3ccccc3c(=O)c3ccccc32)cc1)C1CCCCC1 108435876 ITCHJNJEJSQIHT-UHFFFAOYSA-N 467.569 5.198 5 20 JKBD COc1cc(C(=O)Nc2cccc(OC3CCCC3)c2)c([N+](=O)[O-])cc1OCc1cscn1 108906506 FYVMNYBHMPNZLU-UHFFFAOYSA-N 469.519 5.213 5 20 JKBD C[C@@H](Sc1nnc(-c2ccc(Cl)cc2)o1)C(=O)Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1 255929837 NZYPIAFOKKBLJR-LLVKDONJSA-N 487.950 5.541 5 20 JKBD Cc1c(Cl)cc(S(=O)(=O)N(Cc2cccnc2)c2ccc(Br)cc2)cc1[N+](=O)[O-] 303022096 ZZBAPPZBULMSGK-UHFFFAOYSA-N 496.770 5.110 5 20 JKBD C[C@@H]1C[C@@H](C)CN(C(=O)c2ccccc2NC(=O)c2csc(-c3ccc([N+](=O)[O-])cc3)n2)C1 303040719 PSZFSQUNBBHVHK-HZPDHXFCSA-N 464.547 5.089 5 20 JKBD C[C@H]1C[C@@H](C)CN(C(=O)c2ccccc2NC(=O)c2csc(-c3ccc([N+](=O)[O-])cc3)n2)C1 303040721 PSZFSQUNBBHVHK-IYBDPMFKSA-N 464.547 5.089 5 20 JKBD O=C(Cn1c2ccccc2c(=O)c2ccccc21)Nc1ccc(Oc2ccncc2)c(Cl)c1 505726546 SLIGFHYUFGGLHZ-UHFFFAOYSA-N 455.901 5.634 5 20 JKBD C[C@@H](Nc1ccc(C(=O)Nc2cc(Cl)ccc2OCC(F)(F)F)cc1[N+](=O)[O-])c1ccccn1 506137104 NVRGEUIWMMMPBT-CYBMUJFWSA-N 494.857 6.010 5 20 JKBD O=C(CSc1ccc(C(F)(F)F)cc1[N+](=O)[O-])Nc1cc(Cl)ccc1OC[C@H]1CCCO1 509803021 HFHUYQVMDQKUPK-CQSZACIVSA-N 490.887 5.556 5 20 JKBD COc1cc(C(=O)N(C)Cc2c(Cl)cccc2Cl)c([N+](=O)[O-])cc1OCc1cscn1 509912435 HJPLWGJWDIKWAO-UHFFFAOYSA-N 482.345 5.218 5 20 JKBD COc1cc(C(=O)N(C2CC2)[C@H]2CCCc3ccccc32)c([N+](=O)[O-])cc1OCc1cscn1 512443882 IHPGGRABGMFTEK-NRFANRHFSA-N 479.558 5.321 5 20 JKBD CN(Cc1cccnc1)C(=O)c1c2c(nc3ccccc13)/C(=C\c1ccc([N+](=O)[O-])cc1)CCC2 514963069 RWNGDTXGEOEDLU-PGMHBOJBSA-N 464.525 5.687 5 20 JKBD O=C(C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)NCCOc1ccccc1 515007146 RBXDACDNESMUNG-KNTRCKAVSA-N 459.527 5.330 5 20 JKBD Cc1csc(N(C(=O)Cc2cn(-c3ccccc3)nc2-c2ccc([N+](=O)[O-])cc2)c2ccccc2)n1 515101836 ZRMORTXBGSPFMO-UHFFFAOYSA-N 495.564 6.120 5 20 JKBD COc1ccc([C@H]2CCCN2C(=O)c2ccc(NCc3ccccc3)c([N+](=O)[O-])c2)cc1OC 591887562 FMKUHCLMFHRSOP-JOCHJYFZSA-N 461.518 5.201 5 20 JKBD CN(Cc1nccn1C)C(=O)c1c2c(nc3ccccc13)/C(=C/c1ccc([N+](=O)[O-])cc1)CCC2 600831566 IPZOBNZSBKTMNO-KNTRCKAVSA-N 467.529 5.026 5 20 JKBD COc1cccc(N2C(=O)c3ccccc3N[C@H]2c2csc(-c3cccc([N+](=O)[O-])c3)n2)c1 602756646 BSIQBNFPJBXGCL-JOCHJYFZSA-N 458.499 5.498 5 20 JKBD CCOC(=O)c1sc(-c2cccc([N+](=O)[O-])c2)cc1NC(=O)CCc1nnc(-c2ccsc2)o1 603011727 PEYGSHFZMWEXHY-UHFFFAOYSA-N 498.542 5.183 5 20 JKBD CNC(=O)c1cccc(NC(=O)C/C(=C/c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)c1C 603624425 QQYCHLNSLAZCJJ-JXAWBTAJSA-N 486.553 5.442 5 20 JKBD COc1ccc(-c2nn(Cc3ccccc3)cc2C(=O)Nc2cccc([N+](=O)[O-])c2C)cc1OC 603829896 ZJBZGDWABWOCKK-UHFFFAOYSA-N 472.501 5.085 5 20 JKBD Cc1nc(-c2c[nH]c(C(=O)N3CCN(Cc4ccc(-c5ccccc5[N+](=O)[O-])s4)CC3)c2)cs1 603918052 FLUURCOTMRJKHA-UHFFFAOYSA-N 493.614 5.041 5 20 JKBD O=C(C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1)N1CCC[C@H](c2ccccc2)CC1 608968489 RDGOZKKPVBNGOO-IBGZPJMESA-N 475.511 5.626 5 20 JKBD Cc1ccc(NC(=O)c2ccc(N3CCC(n4c(O)nc5ccccc54)CC3)c([N+](=O)[O-])c2)cc1 608971222 DIHKDELENBKNMU-UHFFFAOYSA-N 471.517 5.052 5 20 JKBD Cc1ccc(NC(=O)c2ccc(Sc3nnc(Cc4csc(C)n4)o3)c([N+](=O)[O-])c2)cc1 608972595 ZDHXWIHHBQPBJJ-UHFFFAOYSA-N 467.532 5.045 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Cl)[C@H](c1ccccc1)N1CCCO[C@@H](c2ccccc2)C1 609233242 BSSMTRRCZVUMMT-RPWUZVMVSA-N 465.937 5.392 5 20 JKBD O=C(Cc1coc(-c2ccc(Cl)cc2)n1)Oc1ccc(NC(=O)c2cccc([N+](=O)[O-])c2)cc1 729304835 KCXUHWFNSKQKRG-UHFFFAOYSA-N 477.860 5.304 5 20 JKBD CC(C)c1ccc(-c2nc(C(=O)OC[C@@H]3CCCN3C(=O)c3ccccc3[N+](=O)[O-])cs2)cc1 730705588 XMVHWHJYKFAENX-IBGZPJMESA-N 479.558 5.303 5 20 JKBD COc1c(F)cc(Br)cc1S(=O)(=O)Oc1ccc([N+](=O)[O-])cc1-c1cccs1 730810764 ASXVHCOXQPMBRG-UHFFFAOYSA-N 488.312 5.001 5 20 JKBD CC(=O)N(c1ccc(C)c(C)c1)c1nc(/C=C2\N=C(c3c(Cl)cccc3[N+](=O)[O-])OC2=O)cs1 730957426 CQSZEFYUEDFXGI-ZDLGFXPLSA-N 496.932 5.351 5 20 JKBD CN(C)C(=O)c1cccc(NC(=O)c2cc([N+](=O)[O-])ccc2N2CCC(Cc3ccccc3)CC2)c1 823469135 PNFLFRRFBPLRPN-UHFFFAOYSA-N 486.572 5.008 5 20 JKBD CCc1ccccc1NC(=O)[C@@H](C)Oc1ccc2c(-c3ccc([N+](=O)[O-])cc3)cc(=O)oc2c1 851958929 LNESNNNHKOULGN-MRXNPFEDSA-N 458.470 5.337 5 20 JKBD COc1cc2c(cc1OC)[C@H](c1ccccc1)N(C(=O)c1cc(Cl)ccc1[N+](=O)[O-])CC2 863930733 OUFJNFDMYSYCMA-QHCPKHFHSA-N 452.894 5.053 5 20 JKBD CC(C)[C@H](OC(=O)Cn1c2ccccc2c(=O)c2ccccc21)C(=O)Nc1cc(Cl)ccc1Cl 915385348 UBBYFOCBYDDTPH-VWLOTQADSA-N 497.378 5.668 5 20 JKBD Cc1ccc(-n2ncc(C(=O)O[C@H](C)c3nnc(-c4ccc([N+](=O)[O-])cc4)o3)c2C(F)(F)F)cc1 915528441 CZMIPYNJAFWBMU-CYBMUJFWSA-N 487.394 5.076 5 20 JKBD CC(C)N(Cc1nnc(-c2cccc([N+](=O)[O-])c2)o1)C(=O)c1ccc(O[C@@H](C)c2ccccc2)nc1 915822919 ACBJPPZEEJPBEH-SFHVURJKSA-N 487.516 5.231 5 20 JKBD COc1ccc(N2C(=S)N[C@@H](c3ccccc3[N+](=O)[O-])C(C(=O)Nc3ccc(F)cc3)=C2C)cc1 916167553 ACDQEUPYNVXMSL-QHCPKHFHSA-N 492.532 5.091 5 20 JKBD Cc1c(C(=O)Nc2ccc(Oc3ncc(Cl)cc3Cl)cc2)cc([N+](=O)[O-])cc1[N+](=O)[O-] 916411507 ZIPHCKQTRQLPFX-UHFFFAOYSA-N 463.233 5.558 5 20 JKBD CN(Cc1ccc2ccccc2c1)C(=O)c1ccccc1NC(=O)c1ccc([N+](=O)[O-])cc1Cl 916563640 DXHUTOXBNUNUIZ-UHFFFAOYSA-N 473.916 5.926 5 20 JKBD Cc1ccc(C(C)C)cc1O[C@H](C)C(=O)O[C@@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 919408922 WPYFQIDJTBUYSQ-LSDHHAIUSA-N 482.455 5.383 5 20 JKBD C[C@H](OC(=O)[C@H]1CCCN(C(=O)c2ccc(Cl)c(Cl)c2)C1)c1ccccc1[N+](=O)[O-] 920267503 KALYMGKHXCEIMD-ZFWWWQNUSA-N 451.306 5.058 5 20 JKBD C[C@@H](Nc1ccc(C(=O)OCc2cccc(C(=O)Nc3ccccc3)c2)cc1[N+](=O)[O-])c1ccccn1 920544303 LRHGFOMYNBEYPE-LJQANCHMSA-N 496.523 5.772 5 20 JKBD C[C@H](Nc1ccc(C(=O)OCc2csc(-c3ccco3)n2)cc1[N+](=O)[O-])c1ccccn1 920549746 YOXKUFJDECBBDG-AWEZNQCLSA-N 450.476 5.236 5 20 JKBD O=C(NC1(c2ccc(NC(=O)[C@H]3CCCCC3(F)F)cc2)CCC1)c1cccc(F)c1[N+](=O)[O-] 1786464739 GRAUBODUZIVYSB-GOSISDBHSA-N 475.467 5.307 5 20 JKBD CCOc1cccc(C(=O)NC2(c3ccc(NC(=O)Cc4cc([N+](=O)[O-])ccc4F)cc3)CCC2)c1 1786672634 GDPGEXGHHFAVJV-UHFFFAOYSA-N 491.519 5.123 5 20 JKBD CCOc1cccc(C(=O)Nc2ccc(C3(NC(=O)Cc4ccc([N+](=O)[O-])cc4F)CCC3)cc2)c1 1790342919 NDVNCUHETLKZSX-UHFFFAOYSA-N 491.519 5.123 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1c(F)cc(Cl)cc1Cl 1800577240 ZGDWUYAYYGQGMG-BTTYYORXSA-N 498.313 5.054 5 20 JKBD CC(C)=CCCC(=O)Nc1cc([C@H]2CCCCN2C(=O)C2(c3cccc([N+](=O)[O-])c3)CCC2)[nH]n1 1820805131 VEAKUYRNUZDNLK-JOCHJYFZSA-N 479.581 5.178 5 20 JKBD CC(C)[C@H]1CC[C@H](C(=O)Nc2cc([C@@H]3CCCCN3C(=O)Cc3cc(F)ccc3[N+](=O)[O-])[nH]n2)CC1 1822103840 ANGHJTOTOBIMRD-BSRJHKFKSA-N 499.587 5.154 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cccc3cc[nH]c23)CC1 1828316759 QUFMMYYBHQEWCS-HSZRJFAPSA-N 492.551 5.071 5 20 JKBD Cc1ccc(SCC(=O)N2CCC([C@@H]3CCCCN3C(=O)c3ccc([N+](=O)[O-])cc3F)CC2)cc1 1830496996 USILYPXUHFPTNX-DEOSSOPVSA-N 499.608 5.068 5 20 JKBD Cc1ccc(CC(=O)N2CCC([C@@H]3CCCCN3C(=O)c3ccc(C4CC4)cc3)CC2)cc1[N+](=O)[O-] 1830749856 JWCGVTHOOZNTOM-SANMLTNESA-N 489.616 5.257 5 20 JKBD O=C(/C=C/c1ccccc1[N+](=O)[O-])N1CCC([C@@H]2CCCCN2C(=O)c2ccc(C3CC3)cc2)CC1 1830752344 MBTMNEZGVPRCIH-BOMYWPOKSA-N 487.600 5.419 5 20 JKBD O=C(Cc1ccc(Cl)cc1)N1CCC([C@@H]2CCCCN2C(=O)/C=C/c2ccccc2[N+](=O)[O-])CC1 1832903240 WNYSUNNCRVPBDV-MURVUTHMSA-N 496.007 5.124 5 20 JKBD Cc1c(C(=O)N2CCC([C@@H]3CCCCN3C(=O)/C=C/c3ccccc3[N+](=O)[O-])CC2)ccc(F)c1F 1832904772 WNNYOVZISBRWLQ-SRLUVNLFSA-N 497.542 5.128 5 20 JKBD Cc1occc1-c1nnc(S[C@@H](C)C(=O)Nc2ccc(F)c([N+](=O)[O-])c2)n1Cc1ccccc1 21684862 DSXKNYZPCBEZME-HNNXBMFYSA-N 481.509 5.061 5 20 JKBD CC(=O)N(c1ccc(Cl)c(Cl)c1)c1nc(COC(=O)c2ccc([N+](=O)[O-])s2)cs1 23631348 LMGQYUZCRMQQIC-UHFFFAOYSA-N 472.331 5.461 5 20 JKBD O=C(CCSc1nnc(-c2ccccc2Cl)n1Cc1ccccc1)Nc1ccccc1[N+](=O)[O-] 26226400 XBGFSUMLZQNUDU-UHFFFAOYSA-N 493.976 5.676 5 20 JKBD O=C(C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1)N(Cc1cccs1)C1CC1 30303097 MQKHOSNUSMUAII-UHFFFAOYSA-N 453.486 5.083 5 20 JKBD O=C(NCCNc1ccc(C(F)(F)F)cc1[N+](=O)[O-])c1ccccc1SCc1cscn1 30800260 GDQAGPSMWQVWPE-UHFFFAOYSA-N 482.509 5.204 5 20 JKBD O=C(C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1)N(Cc1cccs1)C[C@H]1CCCO1 104929071 UQCMMRPGULAVEJ-GOSISDBHSA-N 497.539 5.099 5 20 JKBD O=C(C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)N1CCCCC[C@H]1c1ccncc1 479304778 SUNFQZJUXXJXMK-CBPAOYKXSA-N 498.608 6.674 5 20 JKBD O=C(C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)NC[C@@H]1Cc2ccccc2O1 482657777 LSLOFVHTOZPCFP-YMFQVDJJSA-N 471.538 5.255 5 20 JKBD CSc1ccc(C(=O)Nc2ccc(Cl)c(C(=O)NCc3ccccc3F)c2)cc1[N+](=O)[O-] 484193735 MDXAWCIRGUNRBB-UHFFFAOYSA-N 473.913 5.292 5 20 JKBD O=C(Nc1cc(-c2cccc([N+](=O)[O-])c2)[nH]n1)c1ccc(SCc2cn3ccccc3n2)cc1 499052587 IPYIKDZYJAIUSP-UHFFFAOYSA-N 470.514 5.177 5 20 JKBD CCN(C(=O)c1csc(-c2ccc([N+](=O)[O-])cc2)n1)[C@H]1CCN([C@H](C)c2ccccc2)C1 501948590 PZLWZXAQOZVMLD-UTKZUKDTSA-N 450.564 5.016 5 20 JKBD CC[C@@H](C)n1c(SCC(=O)N(Cc2ccc([N+](=O)[O-])cc2)C(C)C)nnc1-c1ccccc1 504063872 YBCLGZBSODFGDA-GOSISDBHSA-N 467.595 5.354 5 20 JKBD O=C(C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1)N1CCO[C@H](c2ccccc2Cl)C1 505155093 POBJUXTUKPJAAP-NRFANRHFSA-N 497.901 5.084 5 20 JKBD C[C@H](NC(=O)c1ccc(N[C@@H](C)c2ccccn2)c([N+](=O)[O-])c1)c1ccc(OC(F)F)cc1 506847818 SVYPCACXKTWCMQ-GJZGRUSLSA-N 456.449 5.255 5 20 JKBD COc1cc(C(=O)N[C@@H](c2ccc(F)cc2)C2CCCC2)c([N+](=O)[O-])cc1OCc1cscn1 512198477 SVBMJIUFNQRLJQ-HSZRJFAPSA-N 485.537 5.439 5 20 JKBD O=C(Nc1cc([N+](=O)[O-])ccc1OC(F)F)C1CCN(c2ncc(C(F)(F)F)cc2Cl)CC1 515215412 BYYZAOAWLHOIPC-UHFFFAOYSA-N 494.804 5.119 5 20 JKBD CC[C@H](C)N(C(=O)c1ccc(Sc2nc(C)cs2)c([N+](=O)[O-])c1)c1ccc(C(N)=O)cc1 521176041 OZYLNFXLTBVQLF-AWEZNQCLSA-N 470.576 5.055 5 20 JKBD CC1CCN(c2ccc(C(=O)N[C@@H](C)c3nc4ccccc4n3C(F)F)cc2[N+](=O)[O-])CC1 590478046 KHYJOMTYOFXEJE-HNNXBMFYSA-N 457.481 5.067 5 20 JKBD Cc1nc(CSc2ccccc2C(=O)Nc2nc(-c3cccc([N+](=O)[O-])c3)cs2)cs1 591310875 FIMCXNLCVKUOQU-UHFFFAOYSA-N 468.585 6.028 5 20 JKBD CN(C)C(=O)c1ccc(NC(=O)C/C(=C\c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)cc1 600864385 AIEINKMQNQQLBB-XDJHFCHBSA-N 486.553 5.476 5 20 JKBD COC(=O)c1ccsc1NC(=O)C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1 603965309 KRXVCHAYASXVHD-NTCAYCPXSA-N 479.539 5.622 5 20 JKBD CC(C)CCSc1ccc(C(=O)N2C[C@@H](C(F)(F)F)C[C@@H](C(F)(F)F)C2)cc1[N+](=O)[O-] 604257972 RCZVMPYODDMGLY-OKILXGFUSA-N 472.451 5.936 5 20 JKBD C[C@H](Nc1ccc(NC(=O)[C@@H](C)NC(=O)c2cccc([N+](=O)[O-])c2)cc1Cl)c1ccccc1 609072007 CEJLXKBIOXEUDI-JKSUJKDBSA-N 466.925 5.178 5 20 JKBD Cc1ccc([C@H](OC[C@H](O)Cn2cnc3cc4ccccc4cc3c2=O)c2ccccc2)cc1 636934057 DVNVHCMOYIKHDZ-LEAFIULHSA-N 450.538 5.025 5 20 JKBD CCN(CC)S(=O)(=O)c1cc(C)c(C)c(NC(=O)c2cc3ccccc3c3cccnc23)c1 642518114 KLNOTRLCBWWCOT-UHFFFAOYSA-N 461.587 5.288 5 20 JKBD O=C(NS(=O)(=O)Cc1ccc([N+](=O)[O-])cc1)c1sc2cc(Cl)cc(Cl)c2c1Cl 729885972 ULDIIMQWBLXUGC-UHFFFAOYSA-N 479.750 5.030 5 20 JKBD O=C(OCc1cccc([N+](=O)[O-])c1)c1cnn(-c2ncc(C(F)(F)F)cc2Cl)c1C(F)F 730967129 SSTTYCSLWDKFPD-UHFFFAOYSA-N 476.745 5.142 5 20 JKBD CC[C@H](C)Sc1ccc(NC(=O)c2cc([N+](=O)[O-])cc([N+](=O)[O-])c2C)c(C(F)(F)F)c1 748658717 WFJYFYLZONUBFE-JTQLQIEISA-N 457.430 5.973 5 20 JKBD CCS(=O)(=O)c1ccccc1Oc1ccc(NCc2c(Br)cccc2[N+](=O)[O-])cc1 864008219 SKILLQZMGANDQZ-UHFFFAOYSA-N 491.363 5.555 5 20 JKBD CC(C)(C)OC(=O)NC1(c2noc(-c3ccccc3Sc3ccccc3[N+](=O)[O-])n2)CC1 904987592 FSCQQNGUQKLXGY-UHFFFAOYSA-N 454.508 5.310 5 20 JKBD O=C(Nc1ccc(Cl)c(C(=O)NCc2ccccc2F)c1)c1ccc(Cl)c([N+](=O)[O-])c1 916086732 AZAHIDJTOFEIRK-UHFFFAOYSA-N 462.264 5.223 5 20 JKBD CC1=C(C(=O)Nc2ccc(F)cc2)[C@H](c2ccc([N+](=O)[O-])o2)NC(=S)N1c1ccc2c(c1)CCC2 918109560 PXGJAHSEZLQTNK-QHCPKHFHSA-N 492.532 5.164 5 20 JKBD O=C(Nc1nc(Cc2ccc(Br)cc2)cs1)c1c[nH]c2cc([N+](=O)[O-])ccc12 918632985 HAEGMQNFEJONIP-UHFFFAOYSA-N 457.309 5.138 5 20 JKBD CC(=O)N(c1ccc(C)cc1)c1nc(COC(=O)c2ccc(Br)c([N+](=O)[O-])c2)cs1 918802280 RVCBBVOLMUFLJT-UHFFFAOYSA-N 490.335 5.164 5 20 JKBD CC(C)N(Cc1ccc([N+](=O)[O-])cc1)Cn1nc(-c2cccnc2)n(-c2ccccc2)c1=S 919950090 GBSCAKQEINGISE-UHFFFAOYSA-N 460.563 5.242 5 20 JKBD CCC(CC)c1cc[n+](/C(C(=S)Nc2ccc3c(c2)CCC3)=C(/O)c2cccc([N+](=O)[O-])c2)cc1 920394902 AFOULADGZHZHSJ-UHFFFAOYSA-O 488.633 6.598 5 20 JKBD CC(=O)N(c1cccc(C(F)(F)F)c1)c1nc(COc2ccc([N+](=O)[O-])c(F)c2)cs1 921268655 XDHLKHUKZARDLN-UHFFFAOYSA-N 455.389 5.473 5 20 JKBD O=C(NC1(c2ccc(NC(=O)c3cccc4ccncc34)cc2)CCC1)c1cccc(F)c1[N+](=O)[O-] 1790859500 KHCLCGRAGBGONQ-UHFFFAOYSA-N 484.487 5.344 5 20 JKBD CC(C)[C@@H](C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CCc1cccc([N+](=O)[O-])c1)C2)c1ccc(Cl)cc1 1801549873 BNRPUZXXLVTWIE-ZGXDEKTJSA-N 498.023 5.259 5 20 JKBD O=C(CCc1cccc([N+](=O)[O-])c1)Nc1cc([C@H]2CCCCN2C(=O)c2cccc3ccoc23)[nH]n1 1815538845 ZNQWBXOHOFCZCT-JOCHJYFZSA-N 487.516 5.003 5 20 JKBD CC[C@H](C)CC(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cccc([N+](=O)[O-])c2Br)CC1 1824346472 GHLGABRLSYLZHP-LPHOPBHVSA-N 494.430 5.027 5 20 JKBD CC(C)=CCCC(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2c(F)ccc([N+](=O)[O-])c2C)CC1 1830257776 WXRZBPSKJGIMEH-JOCHJYFZSA-N 459.562 5.022 5 20 JKBD Cc1cc2[nH]c(C(=O)N3CCC([C@@H]4CCCCN4C(=O)c4ccc([N+](=O)[O-])cc4F)CC3)cc2s1 1830498862 LQAGBZWYNHRPDK-QFIPXVFZSA-N 498.580 5.132 5 20 JKBD Cc1ccc(-n2c(S[C@@H](C)C(=O)Nc3cc([N+](=O)[O-])ccc3Cl)nnc2-c2ccncc2)cc1 10730685 VUGCTJYBOOBXFJ-HNNXBMFYSA-N 494.964 5.319 5 20 JKBD O=C(Nc1ncc(S(=O)(=O)c2ccc([N+](=O)[O-])cc2)s1)c1sc2cc(F)ccc2c1Cl 14827063 SMXAQLMEMVFJQE-UHFFFAOYSA-N 497.938 5.144 5 20 JKBD CN1CCc2nc(NC(=O)c3cc([N+](=O)[O-])ccc3Sc3ccc(Cl)cc3)sc2C1 23606680 SHLRBYFQYYOPOH-UHFFFAOYSA-N 460.968 5.096 5 20 JKBD COc1cc2c(cc1OC)[C@@H](c1cccs1)N(C(=O)[C@@H](C)Sc1ccc([N+](=O)[O-])cc1)CC2 24445909 CVHNENBBKUFTCK-CMJOXMDJSA-N 484.599 5.328 5 20 JKBD O=C(COC(=O)Cc1csc(-c2ccc(C(F)(F)F)cc2)n1)Nc1cc([N+](=O)[O-])ccc1Cl 25661575 ABZOZDODDVCDNE-UHFFFAOYSA-N 499.854 5.115 5 20 JKBD COc1ccc(Oc2ccc([N+](=O)[O-])cc2C(=O)Nc2nc3ccc(NC(C)=O)cc3s2)cc1 30566702 IYCRCKCATQCQJW-UHFFFAOYSA-N 478.486 5.216 5 20 JKBD Cc1ccc([N+](=O)[O-])cc1NC(=O)CSc1nnc(-c2cccs2)n1Cc1ccccc1 39578455 FNUGWBDJKANLNC-UHFFFAOYSA-N 465.560 5.002 5 20 JKBD CCOc1cc(C(=O)Nc2cc(C3CCCC3)nn2-c2ccccc2)c([N+](=O)[O-])cc1OC 302960853 OVHHTWUHHVJTJU-UHFFFAOYSA-N 450.495 5.098 5 20 JKBD COc1ccc2[nH]cc(C3CCN(C(=O)c4csc(-c5ccc([N+](=O)[O-])cc5)n4)CC3)c2c1 497491942 RILHCXAKYRLRAL-UHFFFAOYSA-N 462.531 5.228 5 20 JKBD CCOc1cc([N+](=O)[O-])c(C(=O)Nc2nc(-c3c(F)cc(F)cc3F)c(C)s2)cc1OC 504743989 ZNVKBCXUQZEPNQ-UHFFFAOYSA-N 467.425 5.104 5 20 JKBD CCOc1ccc(C(=O)N(CC(=O)Nc2ccc(Cl)cc2C(F)(F)F)C(C)C)cc1[N+](=O)[O-] 504781950 JROYXGKLWTZJRZ-UHFFFAOYSA-N 487.862 5.155 5 20 JKBD COc1cc(C(=O)N(Cc2ccccc2)CC(C)(C)C)c([N+](=O)[O-])cc1OCc1cscn1 504877609 XRHGIXFHJIOIPS-UHFFFAOYSA-N 469.563 5.327 5 20 JKBD COc1cc(OC)c(NC(=O)c2ccc(N[C@@H](C)c3ccccn3)c([N+](=O)[O-])c2)cc1Cl 506219637 MJCHRWCLIQRGGD-ZDUSSCGKSA-N 456.886 5.086 5 20 JKBD CC(C)Oc1ccc([N+](=O)[O-])cc1CSc1nnc(-c2cccc(Br)c2)o1 511071356 CYKXXWOQIYNNLU-UHFFFAOYSA-N 450.314 5.487 5 20 JKBD Cc1ccc(N(C(=O)CSc2ccc(C(N)=O)cc2[N+](=O)[O-])c2nc3ccccc3s2)c(C)c1 518820487 UPABAEDOHKLJJZ-UHFFFAOYSA-N 492.582 5.377 5 20 JKBD Cc1ccc(NC(=O)c2cccc(C(F)(F)F)c2)cc1NC(=O)c1cc2cccc([N+](=O)[O-])c2[nH]1 518887812 CQONAZHTVVMIHT-UHFFFAOYSA-N 482.418 5.908 5 20 JKBD CCN(C[C@H]1CCCO1)C(=O)C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1 520107394 NMJBWFONLLWBFJ-BKHFDQEPSA-N 451.548 5.163 5 20 JKBD COc1ccc(-c2ccc(CN[C@H](C)c3ccc(OC)c(Br)c3)o2)c([N+](=O)[O-])c1 520207350 STLQRICUJVUKDP-CYBMUJFWSA-N 461.312 5.485 5 20 JKBD CC[C@H](C)NC(=O)c1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2Oc2ccc(OC)cc2)c(C)c1 520593608 CRSRYCDCCSMXTR-KRWDZBQOSA-N 477.517 5.485 5 20 JKBD Cc1cc(COc2ccc(C(=O)Nc3cc([N+](=O)[O-])ccc3OC(F)F)cc2Br)no1 521378908 HZEKDWUYYUYVBT-UHFFFAOYSA-N 498.236 5.086 5 20 JKBD Cc1csc(Sc2ccc(NC(=O)[C@@H]3CCCN3C(=O)c3ccc([N+](=O)[O-])c(C)c3)c(C)c2)n1 549331149 AZPUTQNTIGNMPU-NRFANRHFSA-N 496.614 5.371 5 20 JKBD Cn1ccnc1COc1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2Sc2ccccc2)cc1 603965530 SKDVQDRJAOCTLK-UHFFFAOYSA-N 460.515 5.311 5 20 JKBD CC(C)CNC(=O)c1ccc(NC(=O)c2ccc(N3CCC(C)CC3)c([N+](=O)[O-])c2)cc1Cl 604004823 RZXMDTNJKVWXSL-UHFFFAOYSA-N 472.973 5.123 5 20 JKBD CCN(Cc1cnn(C)c1)C(=O)c1ccccc1Sc1ccc(C(F)(F)F)cc1[N+](=O)[O-] 604481957 PDTFBSRGUNMIAX-UHFFFAOYSA-N 464.469 5.161 5 20 JKBD CN(Cc1cc([N+](=O)[O-])ccc1Cl)C(=O)CCCCOc1ccc(Br)cc1 731164916 NQJYSPRVMFDCBP-UHFFFAOYSA-N 455.736 5.218 5 20 JKBD Cc1ccc(NC(=O)[C@H](OC(=O)c2nc(-c3ccco3)sc2C)c2ccccc2)c([N+](=O)[O-])c1 913307094 AXTVMRYGGZYONJ-OAQYLSRUSA-N 477.498 5.465 5 20 JKBD C[C@H](NC(=O)c1ccc(Br)c([N+](=O)[O-])c1)c1cccc(NC(=O)c2ccccc2)c1 915600306 MNRAUOSMIIIIFW-AWEZNQCLSA-N 468.307 5.101 5 20 JKBD Cc1nc(-c2ccccc2NC(=O)c2ccc(Sc3nc4ccccc4s3)c([N+](=O)[O-])c2)no1 915867053 XWAKBMMADLOCKK-UHFFFAOYSA-N 489.538 5.966 5 20 JKBD C[C@@H]1CCCCN1C(=O)c1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2N2CCCCC2)cc1Cl 917761067 FXMSCNISQPAJFO-QGZVFWFLSA-N 484.984 5.505 5 20 JKBD C[C@H](OC(=O)c1cc([N+](=O)[O-])ccc1Oc1ccccc1)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl 919192990 RXYDFTBDKMRSRP-ZDUSSCGKSA-N 485.836 5.133 5 20 JKBD C[C@H](OC(=O)c1ccc(N[C@H](C)c2ccccn2)c([N+](=O)[O-])c1)C(=O)N[C@H](C)c1ccc(Cl)cc1 920548896 UUFFRMVDHOJOCK-ZACQAIPSSA-N 496.951 5.239 5 20 JKBD CC1(C)CCc2cccc(C(=O)NC3(c4ccc(NC(=O)c5ccc([N+](=O)[O-])o5)cc4)CCC3)c2O1 1785748853 LVJRUHXJOFPKPG-UHFFFAOYSA-N 489.528 5.353 5 20 JKBD COc1ccc(Cl)c(C(=O)NC2(c3ccc(NC(=O)/C=C/c4ccc([N+](=O)[O-])o4)cc3)CCC2)c1 1786208043 HEHAFFUDBJLDFK-DHZHZOJOSA-N 495.919 5.311 5 20 JKBD Cc1cc(C(=O)Nc2ccc(C3(NC(=O)/C=C/c4ccccc4[N+](=O)[O-])CCC3)cc2)c(C)o1 1787345188 KDZJNQMLTSTVTO-MDWZMJQESA-N 459.502 5.266 5 20 JKBD CCC[C@H](C(=O)Nc1ccc(C2(NC(=O)/C=C/c3ccc([N+](=O)[O-])o3)CCC2)cc1)n1cccc1 1788597578 JLFLMRGBMPXCSD-UFSNDUKISA-N 476.533 5.178 5 20 JKBD O=C(NC1(c2ccc(NC(=O)c3cccc4cccnc34)cc2)CCC1)c1ccc([N+](=O)[O-])cc1F 1788913859 ZFDIQWMUSPQPMB-UHFFFAOYSA-N 484.487 5.344 5 20 JKBD O=C(Cc1cc(F)ccc1[N+](=O)[O-])NC1(c2ccc(NC(=O)c3cccc4cc[nH]c34)cc2)CCC1 1789093176 TWQPZYSJTLGFQY-UHFFFAOYSA-N 486.503 5.206 5 20 JKBD COc1cc(C(=O)Nc2ccc(C3(NC(=O)c4ccc(C)s4)CCC3)cc2)cc([N+](=O)[O-])c1OC 1790813048 MEIHIEQTULFBDE-UHFFFAOYSA-N 495.557 5.043 5 20 JKBD C/C(=C\c1cccs1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cc3cc([N+](=O)[O-])ccc3s1)C2 1792536525 RQPPTVODAJYKMU-XOXKHUMBSA-N 481.599 5.226 5 20 JKBD CC(C)(C)CCCCCC(=O)N1CC[C@@H](CNC(=O)/C=C/c2ccc([N+](=O)[O-])o2)[C@H]1c1cccnc1 1803263573 CCDXQMFRKNSIRX-KRQJIXKBSA-N 496.608 5.299 5 20 JKBD C[C@H](Sc1ccccc1)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cccc(F)c2[N+](=O)[O-])CC1 1824392708 ROMJWJWVPHZJBE-FDDCHVKYSA-N 499.608 5.148 5 20 JKBD Cc1cc(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3ccc(C(C)(C)C)s3)CC2)ncc1[N+](=O)[O-] 1827829997 BRVNYYFAJZNQQZ-HXUWFJFHSA-N 498.649 5.204 5 20 JKBD O=C(c1ccc([N+](=O)[O-])cc1F)N1CCC([C@H]2CCCCN2C(=O)c2ccc(Cl)c(F)c2)CC1 1830486208 LNBLZUXKEVXVOD-JOCHJYFZSA-N 491.922 5.074 5 20 JKBD Cc1cccc([N+](=O)[O-])c1NC(=O)COC(=O)CCc1c(-c2ccc(F)cc2)[nH]c2ccccc12 10693218 BRQLKWUILNIEQL-UHFFFAOYSA-N 475.476 5.305 5 20 JKBD COc1ccccc1Oc1ccc(NC(=O)c2ccc(Cn3nc(C)c([N+](=O)[O-])c3C)cc2)cc1 11517727 VNCSKORQEFZZLX-UHFFFAOYSA-N 472.501 5.510 5 20 JKBD O=C(Nc1ccccc1C(=O)NCCCn1ccc2ccccc21)c1ccc([N+](=O)[O-])cc1Cl 15372907 LJNXHDTZXZYPQO-UHFFFAOYSA-N 476.920 5.275 5 20 JKBD CCOc1ccc([C@@H](CNC(=O)c2cc([N+](=O)[O-])ccc2OC)c2c[nH]c3ccccc23)cc1OC 24113698 OPXONNZMMWMHEZ-OAQYLSRUSA-N 489.528 5.054 5 20 JKBD Cc1ccc2[nH]c3c(c2c1)CN(C(=O)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1)CC3 25542832 TZHFYCDYTZYRPB-UHFFFAOYSA-N 486.494 5.205 5 20 JKBD Cc1cc(C(=O)N2CCC[C@@H]2C(=O)Nc2cccc(CO[C@@H]3CCC[C@@H](C)C3)c2)ccc1[N+](=O)[O-] 216622226 NMTVSGYCWLYZKR-DVKBMCPXSA-N 479.577 5.242 5 20 JKBD O=C(Nc1ncc(Cc2cc(C(F)(F)F)cc(C(F)(F)F)c2)s1)c1ccc([N+](=O)[O-])o1 487290960 KJAQWDFIJXSSFI-UHFFFAOYSA-N 465.331 5.525 5 20 JKBD CCOc1ccc(C(=O)Nc2cccc(NC(=O)c3cccc(C(F)(F)F)c3)c2)cc1[N+](=O)[O-] 504781206 BNGCTXFHOKYUQK-UHFFFAOYSA-N 473.407 5.517 5 20 JKBD CCN(C(=O)c1ccc(N[C@@H](C)c2ccccn2)c([N+](=O)[O-])c1)[C@@H](C)c1cc2ccccc2o1 509700705 ULISVVCACZLUCY-ROUUACIJSA-N 458.518 6.132 5 20 JKBD COc1cc(C(=O)N2CCC(CCc3ccc(C)cc3)CC2)c([N+](=O)[O-])cc1OCc1cscn1 509868975 IJGBYLNKCLUQEW-UHFFFAOYSA-N 495.601 5.432 5 20 JKBD CC[C@H](C)Oc1ccc(NC(=O)c2cc(OC)c(OCc3cscn3)cc2[N+](=O)[O-])cc1 512798822 XIFKTXRHZSGMPY-AWEZNQCLSA-N 457.508 5.069 5 20 JKBD CC(C)OCc1ccccc1CNCc1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1 517550020 LZIHMXSIUNVCNH-UHFFFAOYSA-N 456.546 5.662 5 20 JKBD C[C@H](Nc1ccc(C(=O)Nc2ccc(OCc3ccccc3)nc2)cc1[N+](=O)[O-])c1ccccn1 518431039 RAFQAKBVLUFYGD-SFHVURJKSA-N 469.501 5.389 5 20 JKBD Cc1cc(C)n([C@H](C)C(=O)Nc2ccc(NC(=O)c3cc4cc([N+](=O)[O-])ccc4o3)cc2Cl)n1 520956058 QFFPPMAWRONCRO-CQSZACIVSA-N 481.896 5.260 5 20 JKBD COc1ccc(NC(=O)c2ccn(-c3cccc([N+](=O)[O-])c3)n2)cc1OCc1ccc2ccccc2n1 524386382 ZMRICHWZYKVBRG-UHFFFAOYSA-N 495.495 5.169 5 20 JKBD CCOCCOc1ccc(Cl)cc1NC(=O)c1cc([N+](=O)[O-])ccc1Sc1ccccc1 524457503 LCJOBPSSZPWPFX-UHFFFAOYSA-N 472.950 6.067 5 20 JKBD C[C@H]1CCCN(c2ccc(C(=O)N(C[C@H]3CCCO3)c3nc4ccccc4s3)cc2[N+](=O)[O-])C1 602756160 FPEDUDUXSABVJL-PKOBYXMFSA-N 480.590 5.267 5 20 JKBD CCOC(=O)c1nc(N(CCc2ccccc2)C(=O)c2cc3cc([N+](=O)[O-])ccc3o2)sc1C 603732185 AXZGPATXKAUUEP-UHFFFAOYSA-N 479.514 5.172 5 20 JKBD CCNc1ccc(C(=O)Nc2ccc(NC(=O)c3ccccc3F)cc2C(F)(F)F)cc1[N+](=O)[O-] 603744123 QEEYQDTVWJILFI-UHFFFAOYSA-N 490.413 5.689 5 20 JKBD O=C(Cn1ccc([N+](=O)[O-])n1)N(c1ccc(Oc2ccccc2)cc1)c1nc2ccccc2s1 603946644 PSHQIEZNXGLHOV-UHFFFAOYSA-N 471.498 5.558 5 20 JKBD C[C@@H](NC(=O)N(C)Cc1cn(-c2ccccc2)nc1-c1ccccc1)c1cccc([N+](=O)[O-])c1 604126734 UPPWUNIZWGLVNG-LJQANCHMSA-N 455.518 5.350 5 20 JKBD O=C(C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)N1CCOc2ccccc2C1 604255774 SSJXAJKQTJKDEK-HMMYKYKNSA-N 471.538 5.556 5 20 JKBD CCOc1cc(C(=O)N[C@@H](c2ccc(C(C)(C)C)cc2)C(F)(F)F)c([N+](=O)[O-])cc1OC 604257409 IIBJHBQVMHWDRQ-IBGZPJMESA-N 454.445 5.333 5 20 JKBD Cc1ncc([N+](=O)[O-])cc1C(=O)N(C)Cc1cn(Cc2ccccc2Cl)nc1-c1ccccc1 604564521 XVJWXFZWIPRGEW-UHFFFAOYSA-N 475.936 5.136 5 20 JKBD C[C@@H]1CCCN(c2ccc(C(=O)N3CCC([C@H]4C(=O)Nc5cc(Cl)ccc54)CC3)cc2[N+](=O)[O-])C1 608971110 IGQFRTNXLXZQPP-VOIUYBSRSA-N 496.995 5.073 5 20 JKBD C[C@@H](NCc1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1)c1cccc(S(=O)(=O)N(C)C)c1 608983113 HVLUBLPJQUIHJG-MRXNPFEDSA-N 489.981 5.142 5 20 JKBD CCc1cccc2c(C(=O)[C@@H](OC(=O)CCn3nc(C)c([N+](=O)[O-])c3C)c3ccccc3)c[nH]c12 726646892 FZIPQKYUSATBIE-SANMLTNESA-N 474.517 5.009 5 20 JKBD Cc1ccc(NC(=O)[C@H](OC(=O)Cc2csc(C(C)(C)C)n2)c2ccccc2)c([N+](=O)[O-])c1 726835625 ZABWLTIZVVEULZ-OAQYLSRUSA-N 467.547 5.123 5 20 JKBD O=C(Nc1ccc(OCc2cccnc2)cc1)c1cc([N+](=O)[O-])ccc1NCc1ccccc1 728495946 JAJALZFAABZIPM-UHFFFAOYSA-N 454.486 5.433 5 20 JKBD C[C@H](OC(=O)c1c(Cl)ccc(Cl)c1Cl)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 755643800 ABOIPZVQRUFELF-ZETCQYMHSA-N 485.629 5.758 5 20 JKBD CC(C)(C)OC(=O)N1CCOC[C@H]1c1noc(-c2ccccc2Sc2ccccc2[N+](=O)[O-])n1 904696924 RKSJPUMOVVSZOA-KRWDZBQOSA-N 484.534 5.104 5 20 JKBD Cc1onc(-c2c(Cl)cccc2Cl)c1C(=O)OCC(=O)Nc1cc(Cl)ccc1[N+](=O)[O-] 913350016 DRTKWHVQOCQCTF-UHFFFAOYSA-N 484.679 5.314 5 20 JKBD Cc1ccc(C(=O)N(Cc2nnc(-c3cccc([N+](=O)[O-])c3)o2)C(C)C)cc1NC(=O)c1ccccc1 914838616 YUDJTOBSDDOZRK-UHFFFAOYSA-N 499.527 5.256 5 20 JKBD COC(=O)Nc1cccc(NC(=O)c2ccccc2Sc2ccc(C(F)(F)F)cc2[N+](=O)[O-])c1 917705963 PWBWMNQNSZYHIG-UHFFFAOYSA-N 491.447 6.195 5 20 JKBD CC1=C(C(=O)Nc2ccccc2C)[C@H](c2ccc(Br)c([N+](=O)[O-])c2)NC(=O)N1CC1CC1 918075204 GBULPBPXZSDWRN-NRFANRHFSA-N 499.365 5.055 5 20 JKBD Cc1ccc(NC(=O)[C@H](C)OC(=O)c2ccc(N[C@H](C)c3ccccn3)c([N+](=O)[O-])c2)c(Cl)c1 920548107 PTVXOKAGRDEDTN-CVEARBPZSA-N 482.924 5.309 5 20 JKBD C[C@@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)OCC(=O)Nc1cc(Cl)c(Cl)cc1Cl 920778904 QTWKNCWVVGHARC-MRVPVSSYSA-N 482.103 5.158 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)c3ccccc3N3CCCCC3)CCC2)cc1)c1ccc([N+](=O)[O-])o1 1785751166 RSVAOBPLRZIEAG-UHFFFAOYSA-N 488.544 5.240 5 20 JKBD Cn1ccc2cccc(C(=O)NC3(c4ccc(NC(=O)Cc5cccc([N+](=O)[O-])c5)cc4)CCC3)c21 1785791532 BVJYFGJDIMNQAR-UHFFFAOYSA-N 482.540 5.077 5 20 JKBD Cc1ccc(C(=O)Nc2ccc(C3(NC(=O)c4cc5cc([N+](=O)[O-])ccc5s4)CCC3)cc2)cn1 1787303067 GXGWYTSZCJGEAS-UHFFFAOYSA-N 486.553 5.574 5 20 JKBD Cc1nc(C)c(C(=O)Nc2ccc(C3(NC(=O)c4c(F)ccc([N+](=O)[O-])c4C)CCC3)cc2)s1 1787335825 FDDMPXSNZSAFCH-UHFFFAOYSA-N 482.537 5.177 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)c3cccc4ccoc34)CCC2)cc1)c1ccc([N+](=O)[O-])cc1F 1790626510 YVLCSHVGQRERRC-UHFFFAOYSA-N 473.460 5.542 5 20 JKBD Cc1ncc(/C=C/C(=O)Nc2ccc(C3(NC(=O)Cc4ccc(C)c([N+](=O)[O-])c4)CCC3)cc2)s1 1791958828 LBRQPJSPIICSQG-ZHACJKMWSA-N 490.585 5.058 5 20 JKBD CC[C@H](C)[C@@H](C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CSc1ccccc1[N+](=O)[O-])c1ccccc1 1802183275 PPZLZUDFMNEIDO-YAZAZGCCSA-N 495.645 5.155 5 20 JKBD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)/C=C/c1ccccc1[N+](=O)[O-])c1sc2ccccc2c1Cl 1804342238 HFSQQXRAXBAEIJ-SQSUDPNUSA-N 495.988 5.428 5 20 JKBD COc1cc(C(=O)N2CCC([C@H]3CCCCN3C(=O)c3ccc(Cl)cc3C)CC2)ccc1[N+](=O)[O-] 1823913105 YGFZRMUDGAVBRB-JOCHJYFZSA-N 499.995 5.112 5 20 JKBD O=C(/C=C/c1ccccc1)N1CCC([C@@H]2CCCCN2C(=O)Cc2ccc(Cl)cc2[N+](=O)[O-])CC1 1824162344 VFONNPISPGZABY-LUFJGRFYSA-N 496.007 5.124 5 20 JKBD O=C(/C=C/c1ccccc1[N+](=O)[O-])N1CCC([C@@H]2CCCCN2C(=O)c2cccc3cccnc23)CC1 1828040210 YBBUOYMSUIUNBQ-AAJFVQQISA-N 498.583 5.090 5 20 JKBD Cc1c(C(=O)N2CCC([C@@H]3CCCCN3C(=O)[C@@H]3CCC[C@H]3C)CC2)cc(Cl)cc1[N+](=O)[O-] 1828486408 OGPQRAMDSUKUSY-CNDZOEFASA-N 476.017 5.226 5 20 JKBD Cc1ccc(C(=O)N2CCCC[C@H]2C2CCN(C(=O)CSc3ccccc3[N+](=O)[O-])CC2)c(C)c1 1829951961 KMPGCZNXXHQLRL-QHCPKHFHSA-N 495.645 5.237 5 20 JKBD O=C(/C=C/c1ccc([N+](=O)[O-])o1)N1CC2(CCCN2C(=O)C2CCC(c3ccc(Cl)cc3)CC2)C1 1841407429 HUZNEFHODSTTDH-ZRDIBKRKSA-N 497.979 5.032 5 20 JKBD Cc1sc(NC(=O)c2cc([N+](=O)[O-])c(C)c([N+](=O)[O-])c2)nc1-c1ccc(OC(F)F)cc1 10955687 NTOMBTVHYWSAGI-UHFFFAOYSA-N 464.406 5.097 5 20 JKBD O=C(NCCc1cn2ccccc2n1)c1cc([N+](=O)[O-])ccc1Sc1ccc(Cl)cc1 11534360 UJWWVPGCJQRHSM-UHFFFAOYSA-N 452.923 5.020 5 20 JKBD CN(Cc1ccccc1NC(=O)Cn1c2ccccc2c(=O)c2ccccc21)C1CCCCC1 25154938 TWBKMQPCYDDCRJ-UHFFFAOYSA-N 453.586 5.558 5 20 JKBD CSc1ccc([N+](=O)[O-])c(C(=O)O[C@@H](C)C(=O)Nc2ccccc2Oc2ccccc2)c1 28400850 XBEGMCZKMNLTNS-HNNXBMFYSA-N 452.488 5.293 5 20 JKBD O=C(C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)Nc1cccc(NC(=O)C2CC2)c1 29170130 QNLAQOULYVIWEC-RGEXLXHISA-N 498.564 6.122 5 20 JKBD COC(=O)c1sc2nc(/C(Cl)=C\c3ccc(-c4cccc([N+](=O)[O-])c4)o3)nc(O)c2c1C 97993455 STOCSGYJCTZLGN-NTEUORMPSA-N 471.878 5.397 5 20 JKBD Cc1ccc(NC(=O)C2CC2)cc1NC(=O)CSc1ccc(C(F)(F)F)cc1[N+](=O)[O-] 481853940 FXPGQPFLMSFTAP-UHFFFAOYSA-N 453.442 5.001 5 20 JKBD COC(=O)c1sc(-c2ccccc2Cl)cc1NC(=O)c1cc(SC)c(OC)cc1[N+](=O)[O-] 483461558 CVNFUQYQDCQYKB-UHFFFAOYSA-N 492.962 5.746 5 20 JKBD CCN(c1ccccc1)S(=O)(=O)c1ccc(N[C@@H](c2ccccc2)c2cccnc2)c([N+](=O)[O-])c1 488014425 MCSDZDOVELEZFF-SANMLTNESA-N 488.569 5.407 5 20 JKBD CCN1C/C(=C\c2ccc(-c3cccc([N+](=O)[O-])c3)s2)c2nc3ccccc3c(C(=O)O)c2C1 489676976 HHFOZHAVEQYMKK-GHRIWEEISA-N 471.538 5.946 5 20 JKBD CC(C)c1nnc(NC(=O)C/C(=C/c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)s1 491392895 DFCRXQWTHHXURW-PTNGSMBKSA-N 465.560 5.749 5 20 JKBD COc1cc(CCNC(=O)[C@H](Sc2ccc(F)c(F)c2)c2ccccc2)c([N+](=O)[O-])cc1OC 499679249 UBFDQHAPKDMDFL-HSZRJFAPSA-N 488.512 5.083 5 20 JKBD CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)Cc1csc(-c2cccc(C(F)(F)F)c2)n1 502016469 ZMEQUTNPKDWIFD-UHFFFAOYSA-N 463.481 5.717 5 20 JKBD COc1ccc([C@H](C)NC(=O)C/C(=C/c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)cc1F 503212730 QHIUAEVILDUPKV-UEIJICEPSA-N 491.544 6.160 5 20 JKBD COc1cc(C(=O)N2CCN(C)Cc3ccccc32)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 504844677 CPKSMFKJJJAFQN-UHFFFAOYSA-N 467.909 5.141 5 20 JKBD C[C@@H](Nc1ccc(C(=O)N(C)Cc2ccccc2OC(F)(F)F)cc1[N+](=O)[O-])c1ccccn1 506124492 HHTMAKNHEGRPBL-OAHLLOKOSA-N 474.439 5.334 5 20 JKBD O=C(Nc1ccc(-c2nc3ccccc3o2)cc1)c1ccc([N+](=O)[O-])cc1I 508793156 FSAPPIDSHWQJIQ-UHFFFAOYSA-N 485.237 5.260 5 20 JKBD CN(C)C(=O)C[C@H](NCc1ccc(Oc2ccccc2Cl)c([N+](=O)[O-])c1)c1ccccc1 509614276 BEFJNCXTUIFSQV-FQEVSTJZSA-N 453.926 5.350 5 20 JKBD Cc1cccc(-c2nnc(-c3ccc(C(=O)N(Cc4ccc([N+](=O)[O-])cc4)C(C)C)cc3)o2)c1 509699291 QCXYOYUDUCCDAK-UHFFFAOYSA-N 456.502 5.671 5 20 JKBD Cc1ccc(C)n1C1CCN(C(=O)c2ccccc2NC(=O)c2ccc([N+](=O)[O-])cc2Cl)CC1 509954117 CGFRQMCYPZJWMW-UHFFFAOYSA-N 480.952 5.396 5 20 JKBD CCOc1cc(NC(=O)Cc2csc(-c3ccc(Cl)s3)n2)c([N+](=O)[O-])cc1OCC 512971527 HWAHXFHAPOSDTK-UHFFFAOYSA-N 467.956 5.412 5 20 JKBD CC(C)Oc1ccc(CN[C@@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Br)c2ccccc2)cn1 515523104 SOXRDOUYHYNUOJ-JOCHJYFZSA-N 499.365 5.009 5 20 JKBD COc1ccc(Oc2ccc([N+](=O)[O-])cc2C(=O)Nc2cccc(C(=O)N3CCCCC3)c2)cc1 515628052 YKKKRBHGDZHLSN-UHFFFAOYSA-N 475.501 5.274 5 20 JKBD O=[N+]([O-])c1cc(CNCc2ccc(OCC(F)(F)F)nc2)ccc1Oc1ccc(F)cc1 517535980 RZVULJILJIMBOU-UHFFFAOYSA-N 451.376 5.152 5 20 JKBD Cc1ccc(NC(=O)c2ccc(NCc3ccccc3Cl)c([N+](=O)[O-])c2)cc1C(=O)NC(C)C 520891228 MLCZNMVTTFLORD-UHFFFAOYSA-N 480.952 5.559 5 20 JKBD CCCC(=O)NC[C@@H]1CCCN(C(=O)c2ccc(Sc3nc4ccccc4s3)c([N+](=O)[O-])c2)C1 523170882 HGKPMMFWWUCIDP-INIZCTEOSA-N 498.630 5.124 5 20 JKBD CSc1ccc([N+](=O)[O-])c(C(=O)N2CCCC[C@@H]2C(=O)Nc2cc(Cl)ccc2Cl)c1 523717372 QHKFQDDLMZOONH-GOSISDBHSA-N 468.362 5.257 5 20 JKBD CCc1sc(NC(=O)Cn2c3ccccc3c(=O)c3ccccc32)nc1-c1ccc(OC)cc1 591205866 ICNDANHAZVXBOX-UHFFFAOYSA-N 469.566 5.488 5 20 JKBD CC1CCN(c2ccc(C(=O)N3CCC[C@H](c4nc5ccccc5s4)C3)cc2[N+](=O)[O-])CC1 603437321 DYIJPYDQBMGAOV-IBGZPJMESA-N 464.591 5.461 5 20 JKBD Cc1nn(Cc2ccc(C(=O)Nc3ccc(CN4CCCC[C@H]4C)cc3)cc2)c(C)c1[N+](=O)[O-] 603680339 IPXWSKWONIRZQQ-GOSISDBHSA-N 461.566 5.083 5 20 JKBD CCN(C[C@H]1CCOC1)C(=O)c1c2c(nc3ccccc13)/C(=C\c1ccc([N+](=O)[O-])cc1)CCC2 604431459 ODQLDQAQTBOCRR-JSZIULHXSA-N 471.557 5.519 5 20 JKBD O=C(Nc1ccc(NC(=O)C2CC2)cc1C(F)(F)F)c1csc(-c2ccc([N+](=O)[O-])cc2)n1 604517124 LXVLJICVCRPPTR-UHFFFAOYSA-N 476.436 5.338 5 20 JKBD CCCCOc1ccc([C@@H](C)Nc2cnn(-c3ccc([N+](=O)[O-])cc3)c(=O)c2Cl)cc1OC 608830910 HJDXASFTWTWJAI-OAHLLOKOSA-N 472.929 5.155 5 20 JKBD CN(CC(=O)Nc1cc(F)cc(F)c1)C(=O)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1 608945942 RZTCIJAQZYWFNQ-UHFFFAOYSA-N 475.835 5.029 5 20 JKBD O=[N+]([O-])c1c(F)cccc1S(=O)(=O)Nc1nc2nc(-c3ccccc3)cc(C(F)(F)F)c2s1 727245556 CWIFNYXAWSTPPJ-UHFFFAOYSA-N 498.439 5.225 5 20 JKBD O=C(NC1CCN(C(=O)c2ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])cc2)CC1)Oc1ccccc1 727336875 ZUVPLEXJZMPRHA-UHFFFAOYSA-N 495.919 5.434 5 20 JKBD O=C(COc1ccc([N+](=O)[O-])c(F)c1)Nc1cccc(NC(=O)c2cccc(C(F)(F)F)c2)c1 728848903 WKZSCLJPDHMXIK-UHFFFAOYSA-N 477.370 5.023 5 20 JKBD CSCC[C@H](NC(=O)c1ccc(Cl)cc1Cl)C(=O)O[C@@H](C)c1cccc([N+](=O)[O-])c1 729357370 JNTYTULFWDXENZ-SGTLLEGYSA-N 471.362 5.058 5 20 JKBD C[C@H](OC(=O)c1c(NC(=O)C(C)(C)C)sc2c1CCC2)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 746144235 RAEPMCCPISMYDZ-LBPRGKRZSA-N 484.534 5.098 5 20 JKBD Cc1ccc(NC(=O)[C@@H](C)Oc2ccc3c(-c4ccc([N+](=O)[O-])cc4)cc(=O)oc3c2)c(F)c1 851958729 IULIMYSRPVHKQN-OAHLLOKOSA-N 462.433 5.222 5 20 JKBD CC(C)N(Cc1ccc([N+](=O)[O-])cc1)Cn1nc(-c2ccccc2)n(Cc2ccco2)c1=S 919950747 SBJYPAZCXMRDGQ-UHFFFAOYSA-N 463.563 5.499 5 20 JKBD C[C@@H](Nc1ccc(C(=O)O[C@H](C)c2nc(-c3cccs3)no2)cc1[N+](=O)[O-])c1ccccn1 920544731 DZWNYYBRRJRYIM-ZIAGYGMSSA-N 465.491 5.192 5 20 JKBD COc1cc(C(=O)O[C@@H](C)c2ccccc2Br)c([N+](=O)[O-])cc1OCc1cscn1 920651912 HACDEOHLVSWYHS-LBPRGKRZSA-N 493.335 5.319 5 20 JKBD CC(C)(C)Oc1ccc(CNC(=O)c2ccccc2NC(=O)c2ccc([N+](=O)[O-])cc2Cl)cc1 920746646 DFNRVLOVJNQUMA-UHFFFAOYSA-N 481.936 5.608 5 20 JKBD COc1cc(C(=O)Nc2sccc2C(=O)NC2CC2)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 921015687 ALAJRNMQMWVUBK-UHFFFAOYSA-N 487.921 5.255 5 20 JKBD Cn1c(CC(=O)Nc2ccc(C3(NC(=O)Cc4cccc([N+](=O)[O-])c4)CCC3)cc2)cc2ccccc21 1786031350 QTQYOWUVBBXTRN-UHFFFAOYSA-N 496.567 5.006 5 20 JKBD Cc1cc(CCC(=O)Nc2ccc(C3(NC(=O)c4c(F)ccc([N+](=O)[O-])c4C)CCC3)cc2)ccn1 1786742230 SAZILFNBDVPGTR-UHFFFAOYSA-N 490.535 5.126 5 20 JKBD O=C(CCc1cccc([N+](=O)[O-])c1)NC1(c2ccc(NC(=O)c3cnc4ccoc4c3)cc2)CCC1 1788481027 HDBGRAFXYDSILJ-UHFFFAOYSA-N 484.512 5.117 5 20 JKBD O=C(Cc1ccc([N+](=O)[O-])cc1F)NC1(c2ccc(NC(=O)c3cccc4cnccc34)cc2)CCC1 1789327896 QRMYPJDGDTYHCP-UHFFFAOYSA-N 498.514 5.273 5 20 JKBD COc1ccc(CC(=O)NC2(c3ccc(NC(=O)/C=C/C4CCCC4)cc3)CCC2)c([N+](=O)[O-])c1 1790515059 CASSJCJAVLTWST-VGOFMYFVSA-N 477.561 5.026 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)c3cccc4cc[nH]c34)CCC2)cc1)c1cc(F)cc([N+](=O)[O-])c1 1790696621 OZOMNUSUQLTAHX-UHFFFAOYSA-N 472.476 5.277 5 20 JKBD Cc1c(C(=O)N2CCC3(CCCN(C(=O)[C@@H](F)c4ccccc4)C3)CC2)cc(Cl)cc1[N+](=O)[O-] 1806524735 FJLDTFWOIHDGPU-QFIPXVFZSA-N 487.959 5.112 5 20 JKBD CC[C@H](C)[C@@H](C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2ccc([N+](=O)[O-])o2)[nH]n1)c1ccccc1 1816848405 VAOJCPPYCNXFRU-BTCOZLQPSA-N 479.537 5.047 5 20 JKBD CC(C)[C@@H](C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2ccc([N+](=O)[O-])o2)[nH]n1)c1ccc(Cl)cc1 1821856652 GTMDPRDMVNBOAB-XMSQKQJNSA-N 499.955 5.310 5 20 JKBD CC(C)(C)CCCCCC(=O)Nc1cc([C@H]2CCCCN2C(=O)c2ccc(O)c([N+](=O)[O-])c2)[nH]n1 1822116139 PHVNNUDOQYLBRY-LJQANCHMSA-N 485.585 5.326 5 20 JKBD O=C(c1cccc(F)c1[N+](=O)[O-])N1CCC([C@@H]2CCCCN2C(=O)c2ccc3occc3c2)CC1 1828257357 HIMFAIOGPAUKPM-QFIPXVFZSA-N 479.508 5.027 5 20 JKBD O=C([C@@H]1CCC[C@@H]2CCCC[C@@H]21)N1CCC([C@@H]2CCCCN2C(=O)c2ccc(O)c([N+](=O)[O-])c2)CC1 1830487850 GLOFVZNBGAGGBC-LSUHJGNXSA-N 497.636 5.140 5 20 JKBD C[C@H](OC(=O)Cc1ccc(-c2ccccc2)cc1)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 10715696 KMSFKQBYJSRCBH-HNNXBMFYSA-N 472.419 5.394 5 20 JKBD Cc1csc(Sc2ccc([N+](=O)[O-])cc2C(=O)OCc2csc(-c3ccccn3)n2)n1 12476185 UJGDYRUBUWEQSG-UHFFFAOYSA-N 470.557 5.386 5 20 JKBD C[C@@H](Sc1nc(/C=C/c2ccccc2)n[nH]1)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 12834954 XNERDVTVJONLLB-OFFHKIPUSA-N 463.441 5.021 5 20 JKBD COc1cc2c(cc1OC)[C@@H](c1cccs1)N(C(=O)c1ccc(Cl)c([N+](=O)[O-])c1)CC2 16002491 ARHGOCDONLQXNZ-NRFANRHFSA-N 458.923 5.115 5 20 JKBD C[C@H](OC(=O)c1ccccc1SCc1ccco1)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl 18410877 JTPOTDVIEOVMFS-ZDUSSCGKSA-N 460.895 5.318 5 20 JKBD C[C@@H](c1ccccc1)n1c(SCc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)nc2ccccc2c1=O 29876465 JDDPSNZVTLMJGP-INIZCTEOSA-N 485.525 5.256 5 20 JKBD NC(=O)c1cc(-c2csc(NC(=O)c3cc([N+](=O)[O-])ccc3Sc3ccc(Cl)cc3)n2)c[nH]1 30981221 QYDFASBTIZVOGO-UHFFFAOYSA-N 499.961 5.202 5 20 JKBD O=C(c1ccc(N2CCCC2)c([N+](=O)[O-])c1)N(Cc1ccc(Cl)c(Cl)c1)Cc1ccccn1 72052680 WZJRQIVRBBPKAH-UHFFFAOYSA-N 485.371 5.739 5 20 JKBD COc1ccc(CSCC(=O)Nc2cccc(NC(=O)Nc3ccccc3)c2)cc1[N+](=O)[O-] 105980531 MGQPURVRFLDQRV-UHFFFAOYSA-N 466.519 5.119 5 20 JKBD C[C@H](Nc1ccc(C(=O)N[C@H](C)c2ccc(NC(=O)C3CC3)cc2)cc1[N+](=O)[O-])c1ccccn1 108783605 FKWFLVHJJLUTRN-SJORKVTESA-N 473.533 5.002 5 20 JKBD COc1ccc(-c2cc(C(=O)OCc3nc(-c4ccc([N+](=O)[O-])cc4)no3)sc2C)cc1 108804238 FOAGDNPKMOPBSQ-UHFFFAOYSA-N 451.460 5.047 5 20 JKBD Cc1nc(COc2cccc(C(=O)Nc3nc(-c4cccc([N+](=O)[O-])c4)c(C)s3)c2)cs1 195704066 URXGUJBASODLQN-UHFFFAOYSA-N 466.544 5.623 5 20 JKBD O=C1CCCc2cc(NC(=O)c3ccc(NCc4ccccc4Cl)c([N+](=O)[O-])c3)ccc2N1 483887694 BSSCSBKTFWPNMS-UHFFFAOYSA-N 464.909 5.387 5 20 JKBD CC(C)N(C)Cc1ccccc1CNC(=O)Cc1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1 484647134 ALJBMTAEPYSHFY-UHFFFAOYSA-N 497.599 5.147 5 20 JKBD CC(C)N(Cc1cccnc1)C(=O)C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1 488641673 LFFFFPWFUOGWNJ-STZFKDTASA-N 472.570 5.967 5 20 JKBD O=C(C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)NCCOC1CCCCC1 490817567 IJVNDXOLNVWCMH-KNTRCKAVSA-N 465.575 5.601 5 20 JKBD CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)Cc1csc(-c2cccc(Br)c2)n1 502018983 OTXRVYRTEDMWJG-UHFFFAOYSA-N 474.380 5.461 5 20 JKBD COc1cc(CCC(=O)Nc2nc(-c3cccc([N+](=O)[O-])c3)cs2)ccc1OCC(F)(F)F 504350913 VFOPCRSLCWVBLJ-UHFFFAOYSA-N 481.452 5.239 5 20 JKBD COc1cc(C(=O)N[C@@H](C)c2ccc(SC(C)C)cc2)c([N+](=O)[O-])cc1OCc1cscn1 504713751 YORBAMBRNAIGAM-HNNXBMFYSA-N 487.603 5.630 5 20 JKBD CCOc1cc(NC(=O)Cc2csc(-c3cccc(C(F)(F)F)c3)n2)c([N+](=O)[O-])cc1OCC 508814478 XCPQDBUZOBYGSX-UHFFFAOYSA-N 495.479 5.716 5 20 JKBD C[C@@H](Nc1ccc(C(=O)NCCc2ccc(F)c(Br)c2)cc1[N+](=O)[O-])c1ccccn1 509148614 BMOUFOUGOJEWQW-CQSZACIVSA-N 487.329 5.037 5 20 JKBD COc1cc(C(=O)N(C)Cc2ccc(C(C)C)cc2)c([N+](=O)[O-])cc1OCc1cscn1 509906829 BXZXAGCKQASJJN-UHFFFAOYSA-N 455.536 5.035 5 20 JKBD COc1cc(C(=O)Nc2nc3cc(Cl)ccc3s2)c([N+](=O)[O-])cc1OCc1cscn1 512663743 PNRAYZAGFPAWOT-UHFFFAOYSA-N 476.923 5.154 5 20 JKBD CCNc1ccc(C(=O)Nc2ccc(NC(=O)c3ccccc3)cc2C(F)(F)F)cc1[N+](=O)[O-] 514445869 BOBYWMZADZTEGF-UHFFFAOYSA-N 472.423 5.550 5 20 JKBD Cc1ccc(NC(=O)N2CCN(c3ccc(C(F)(F)F)cc3[N+](=O)[O-])CC2)c(Br)c1 515225297 ZQIISYBFBIEMRD-UHFFFAOYSA-N 487.276 5.039 5 20 JKBD C[C@@H]1CCCN(CCCCNC(=O)C/C(=C\c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)C1 517094679 FIRSLELMXUJSSH-LCMCWVSWSA-N 492.645 5.764 5 20 JKBD Cc1cc(NC(=O)c2ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])cc2)ccc1C(=O)NC(C)C 518184934 LVZUDUKZJWELRB-UHFFFAOYSA-N 467.909 5.739 5 20 JKBD O=[N+]([O-])c1ccc(-c2ccc(CNCc3cnn(Cc4ccccc4)c3)o2)c(Br)c1 520207362 SWGPTDQVRZNJIM-UHFFFAOYSA-N 467.323 5.152 5 20 JKBD Cc1ccc(NC(=O)c2ccc(NCc3ccc(NC(=O)c4cccnc4)cc3)c([N+](=O)[O-])c2)cc1 520260383 MXTFBHWNNNSWQZ-UHFFFAOYSA-N 481.512 5.415 5 20 JKBD Cc1ccc(Cn2nccc2NC(=O)c2ccc(NCc3ccccc3Cl)c([N+](=O)[O-])c2)o1 520899614 SIENJERDWNHFOI-UHFFFAOYSA-N 465.897 5.259 5 20 JKBD C[C@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)N1CCC[C@@H](c2nc(-c3ccc(Cl)cc3)no2)C1 523281327 LDPNMPZVQUERCO-DZGCQCFKSA-N 491.331 5.125 5 20 JKBD O=C(Cn1c2ccccc2c(=O)c2ccccc21)Nc1ccc(CC(=O)Nc2ccccc2F)cc1 524388564 LJLMZHBFNANPDF-UHFFFAOYSA-N 479.511 5.114 5 20 JKBD O=C(Nc1cc([N+](=O)[O-])ccc1OC(F)F)c1oc2ccccc2c1COc1ccccc1 603638870 IYLWHTIMBJQVGL-UHFFFAOYSA-N 454.385 5.774 5 20 JKBD C[C@@H](c1ccccc1)n1c(S[C@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)nnc1-c1ccccc1 603917265 LBJHUBLQGJVRTH-ZWKOTPCHSA-N 498.568 6.366 5 20 JKBD COc1cccc(C[C@@H]2CCCN2C(=O)c2ccc(N[C@H](C)c3ccccn3)c([N+](=O)[O-])c2)c1 604310432 MFUAFGTZXIRMDG-NQIIRXRSSA-N 460.534 5.019 5 20 JKBD C[C@@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)N[C@H](C)c1cccc(NC(=O)Cc2ccccc2F)c1 604442238 BWHUFRSXIMGAES-HZPDHXFCSA-N 499.926 5.213 5 20 JKBD O=C(Nc1nc(C2CC2)c(Cc2ccccc2Cl)s1)c1ccc(-n2cncn2)c([N+](=O)[O-])c1 608850616 ZKYQNPJIQCANDT-UHFFFAOYSA-N 480.937 5.006 5 20 JKBD Cc1c(NC(=O)c2ccc(N[C@H](C)c3ccccn3)c([N+](=O)[O-])c2)cccc1OCC(F)(F)F 609022819 XXUMKMHVTCRNLG-OAHLLOKOSA-N 474.439 5.665 5 20 JKBD CC1CCN(c2ccc([N+](=O)[O-])cc2C(=O)Nc2ccc(CC(=O)Nc3ccccc3F)cc2)CC1 728006440 VQEVFVMQNMYSTL-UHFFFAOYSA-N 490.535 5.404 5 20 JKBD C[C@@H](NC(=O)c1cc([N+](=O)[O-])ccc1Sc1ccc(Cl)cc1)c1ccc2c(c1)CC(=O)N2C 728254032 GLBRTGBKFYRATK-CQSZACIVSA-N 481.961 5.409 5 20 JKBD O=C(Nc1ccc(OCc2cccnc2)cc1)c1ccc(NCc2ccccc2)c([N+](=O)[O-])c1 728553522 YLXHDLCKOXKFCW-UHFFFAOYSA-N 454.486 5.433 5 20 JKBD O=C(OCC(=O)N(Cc1ccc(F)cc1)c1nc(-c2ccccc2)cs1)c1ccc([N+](=O)[O-])cc1 747834858 XCEIWHLXTARHJT-UHFFFAOYSA-N 491.500 5.248 5 20 JKBD C[C@@H](OC(=O)c1csc(-c2cccc([N+](=O)[O-])c2)n1)C(=O)Nc1ccc(C(C)(C)C)cc1 747961815 JEXSJBRBPHTXJN-CQSZACIVSA-N 453.520 5.200 5 20 JKBD O=C(Oc1cccc(C(=O)N2CCc3ccccc3C2)c1)c1csc(-c2cccc([N+](=O)[O-])c2)n1 751179456 HGJPSJOWVRFGLL-UHFFFAOYSA-N 485.521 5.136 5 20 JKBD C[C@H]([C@@H]1C[C@H]2CC[C@H]1C2)n1c(SCC(=O)Nc2cc([N+](=O)[O-])ccc2F)nnc1-c1ccco1 848592659 MNPUJMWHJFCNBM-AESZEHBQSA-N 485.541 5.313 5 20 JKBD Cc1ncc([N+](=O)[O-])cc1-c1nc(-c2ccc(Oc3ncc(C(F)(F)F)cc3Cl)cc2)no1 904668088 YQFHRXYJKMWAOJ-UHFFFAOYSA-N 477.786 5.875 5 20 JKBD COc1ccc(N2C(=S)N[C@@H](c3ccc([N+](=O)[O-])cc3)C(C(=O)Nc3ccc(F)cc3)=C2C)cc1 916168329 LPAATQQDKLHWBF-QHCPKHFHSA-N 492.532 5.091 5 20 JKBD Cc1c(C(=O)Nc2ccccc2NC(=O)c2ccc(C(C)(C)C)cc2)cc([N+](=O)[O-])cc1[N+](=O)[O-] 916425217 KCIXXAFWSCVWHP-UHFFFAOYSA-N 476.489 5.614 5 20 JKBD CN1CCCN(c2ccc(NC(=O)c3ccc(Oc4ccc(Cl)cc4[N+](=O)[O-])cc3)cc2)CC1 916453285 QVGBGRBJWPPXRR-UHFFFAOYSA-N 480.952 5.435 5 20 JKBD CCOc1cc(/C=C(/C(=O)OCc2nc(-c3ccc([N+](=O)[O-])cc3)no2)c2ccccc2)ccc1O 918951351 FKVOGVNRLQZRBE-KGENOOAVSA-N 487.468 5.033 5 20 JKBD Cc1oc2cc(OS(=O)(=O)c3c(Cl)cccc3[N+](=O)[O-])ccc2c(=O)c1-c1ccccc1 920314942 QBDWFIWHSXXVOW-UHFFFAOYSA-N 471.874 5.098 5 20 JKBD O=C(Cc1ccc([N+](=O)[O-])cc1F)Nc1ccc(C2(NC(=O)CCCCn3cccc3)CCC2)cc1 1791184031 MISIILHSIVNIJJ-UHFFFAOYSA-N 492.551 5.083 5 20 JKBD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(-c2ccccc2)c(F)c1)c1ccc([N+](=O)[O-])cc1F 1799343562 MPNNVYFTZSRKPU-ACDBMABISA-N 491.494 5.106 5 20 JKBD O=C(Nc1cc([C@H]2CCCCN2C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)[nH]n1)c1ccc(Cl)o1 1818427854 XSJOQBJURCFMPF-OAHLLOKOSA-N 499.936 5.399 5 20 JKBD CC(C)c1ccc(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)Cc3ccc([N+](=O)[O-])cc3F)n[nH]2)cc1 1821843125 ZXBXICQRICWZBI-HSZRJFAPSA-N 493.539 5.129 5 20 JKBD Cc1ccc(C(=O)N2CCC([C@@H]3CCCCN3C(=O)Cc3ccc(Cl)cc3[N+](=O)[O-])CC2)cc1 1824162311 TUCIAQCXGDUBPJ-QHCPKHFHSA-N 483.996 5.033 5 20 JKBD O=C(c1ccc2ccoc2c1)N1CCC([C@@H]2CCCCN2C(=O)CCc2cccc([N+](=O)[O-])c2)CC1 1824842449 IMEUJRJNOYWJAO-VWLOTQADSA-N 489.572 5.207 5 20 JKBD Cc1cnc(C(=O)N2CCCC[C@H]2C2CCN(C(=O)c3cc4cc([N+](=O)[O-])ccc4s3)CC2)s1 1825694768 DGMMTUFMIQXHEA-IBGZPJMESA-N 498.630 5.122 5 20 JKBD Cc1ccc2[nH]c(C(=O)N3CCCC[C@H]3C3CCN(C(=O)c4ccc([N+](=O)[O-])cc4F)CC3)cc2c1 1828123585 WWIUERAQRPGLFG-VWLOTQADSA-N 492.551 5.071 5 20 JKBD Cc1ccc(CC(=O)N2CCC([C@@H]3CCCCN3C(=O)c3cccc4ccoc34)CC2)cc1[N+](=O)[O-] 1830990163 AGTNJMZNPZJITG-DEOSSOPVSA-N 489.572 5.125 5 20 JKBD Cc1ccc(C)c(NC(=O)[C@@H](OC(=O)CSc2ccc([N+](=O)[O-])cc2)c2ccccc2)c1 9352078 NOQGFXBNPDRMMZ-QHCPKHFHSA-N 450.516 5.227 5 20 JKBD Cc1cc([N+](=O)[O-])ccc1NC(=O)CSc1nnc(-c2ccncc2)n1-c1cccc(Cl)c1C 10318052 CECXVPZUIXTHLS-UHFFFAOYSA-N 494.964 5.239 5 20 JKBD C[C@H](Sc1nnc(-c2ccncc2)n1-c1ccc(Cl)cc1)C(=O)Nc1cccc([N+](=O)[O-])c1 11410365 LELBEQKAOLKHCX-AWEZNQCLSA-N 480.937 5.010 5 20 JKBD Cc1cc(CSc2ccccc2C(=O)O[C@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)on1 16542384 ARGPACZDYQZQFK-CYBMUJFWSA-N 475.910 5.021 5 20 JKBD O=C(Cn1c2ccccc2c(=O)c2ccccc21)Nc1ncc(Cc2ccc(C(F)(F)F)cc2)s1 22865379 DWYGYXPLUAPUHY-UHFFFAOYSA-N 493.510 5.860 5 20 JKBD O=C(CSc1nnc(Nc2ccccc2)s1)Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1 23647416 ZPZQVUQVJRAWET-UHFFFAOYSA-N 470.561 5.044 5 20 JKBD O=C(C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1)N1CCC[C@@H]1c1ccc(F)cc1 25325832 KVOPLDMOPDWQSH-LJQANCHMSA-N 465.447 5.333 5 20 JKBD CC(=O)Nc1ccc(CNC(=O)c2ccc(Sc3nc4ccccc4s3)c([N+](=O)[O-])c2)cc1 25553379 FKRXGRWRTBSTAP-UHFFFAOYSA-N 478.555 5.244 5 20 JKBD COc1cc(C(=O)Nc2ccc3c(c2)NC(=O)[C@H](C)O3)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 27019080 PQIUUYQFOGXGFZ-LBPRGKRZSA-N 483.864 5.021 5 20 JKBD CC(=O)Nc1cccc([C@@H](C)NC(=O)c2ccc(NCc3ccccc3Cl)c([N+](=O)[O-])c2)c1 30273755 FWJOKSVFWHTWQC-OAHLLOKOSA-N 466.925 5.310 5 20 JKBD O=C(Nc1ccccc1C(=O)N1CCN(c2ccccc2Cl)CC1)c1ccc([N+](=O)[O-])cc1Cl 30615313 QKCABAOPQMDCGG-UHFFFAOYSA-N 499.354 5.116 5 20 JKBD COc1cc(C(=O)Nc2cccc(-c3nncn3C)c2)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 33127291 CYCGVFANVTYSHY-UHFFFAOYSA-N 479.880 5.097 5 20 JKBD O=C(CSc1ccc([N+](=O)[O-])cc1)Nc1ccc(NC(=O)c2ccc(F)cc2)cc1C(F)(F)F 69611215 CZBWXGJIEQQIET-UHFFFAOYSA-N 493.438 5.736 5 20 JKBD C[C@H](Nc1ccc(C(=O)N2CCC(c3c[nH]c4ccccc34)CC2)cc1[N+](=O)[O-])c1ccccn1 108787456 PDPMJJMYADFPPN-SFHVURJKSA-N 469.545 5.664 5 20 JKBD Cc1sc(NC(=O)c2sc3nc(C(F)(F)F)ccc3c2C)nc1-c1cccc([N+](=O)[O-])c1 195704273 ICCTWHMJUUESQM-UHFFFAOYSA-N 478.477 6.216 5 20 JKBD O=C(NCc1cccc2ccccc12)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 302936695 INEVBQYQTSUHBA-UHFFFAOYSA-N 457.452 5.300 5 20 JKBD COCc1cccc(CNC(=O)c2ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])c(OC)c2)c1 482390102 XKMHYYKUHOWWQB-UHFFFAOYSA-N 456.882 5.126 5 20 JKBD CCOc1ccc([C@H](NC(=O)c2cc(SC)c(OC)cc2[N+](=O)[O-])c2ccccc2)cc1 482812971 NZDVECZDPRJTAM-HSZRJFAPSA-N 452.532 5.243 5 20 JKBD O=C(NCc1cscn1)c1c2c(nc3ccccc13)/C(=C\c1cccc([N+](=O)[O-])c1)CCC2 495563865 RAYGJFQHFSILDZ-BOPFTXTBSA-N 456.527 5.406 5 20 JKBD CCOc1cc(NC(=O)c2cccc(NC(=O)C3CCCCC3)c2)c([N+](=O)[O-])cc1OCC 512234741 SVRLFFHNFBMTPF-UHFFFAOYSA-N 455.511 5.163 5 20 JKBD C[C@H](Sc1nnc(C[C@H](C)c2ccccc2)o1)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 514298461 PJSKZWLZOKCRJH-STQMWFEESA-N 480.468 5.462 5 20 JKBD O=C(Nc1ccccc1-c1nc2ccccc2s1)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-] 515286077 IXDJCLWLHXMTRR-UHFFFAOYSA-N 473.432 6.065 5 20 JKBD Cc1ncc2c(n1)CCN(C(=O)c1c3c(nc4ccccc14)/C(=C/c1ccc([N+](=O)[O-])cc1)CCC3)C2 517343243 WBSBTQFGTZVJNH-HMMYKYKNSA-N 491.551 5.317 5 20 JKBD CC1CCC(OC2CCN(C(=O)c3ccc(NCc4ccccc4)c([N+](=O)[O-])c3)CC2)CC1 518146669 COFULMXIURUYBA-UHFFFAOYSA-N 451.567 5.407 5 20 JKBD C[C@H]1CCCN(c2ccc(C(=O)Nc3cc(-c4nnc5n4CCCCC5)ccc3F)cc2[N+](=O)[O-])C1 603154549 GTSVKSMSAZPTQO-KRWDZBQOSA-N 492.555 5.207 5 20 JKBD CCCN(CC(=O)Nc1cc(Cl)ccc1Cl)C(=O)c1cc2cc([N+](=O)[O-])ccc2o1 603729577 CNZJZUBTUIDWMR-UHFFFAOYSA-N 450.278 5.139 5 20 JKBD O=C(C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1)N1CCCc2cc(F)cc(F)c21 603962849 BOESYJKBMFCTEU-UHFFFAOYSA-N 469.410 5.088 5 20 JKBD O=C(Nc1ccc(-n2ccnn2)cc1)c1ccccc1Sc1ccc(C(F)(F)F)cc1[N+](=O)[O-] 608873631 BAVYRLYFACDBGR-UHFFFAOYSA-N 485.447 5.598 5 20 JKBD COc1cc(C(=O)N[C@H](c2ccc3c(c2)CCCC3)c2cccs2)c([N+](=O)[O-])cc1OC 612668038 JZOHNHQUAKNBBU-HSZRJFAPSA-N 452.532 5.072 5 20 JKBD CC(=O)N(c1ccc(Cl)c(Cl)c1)c1nc(COC(=O)c2cc(C)cc([N+](=O)[O-])c2N)cs1 727900796 OIUTXQIPZXPFGH-UHFFFAOYSA-N 495.344 5.290 5 20 JKBD CCOC(=O)/C(=C\c1ccc(-c2ccccc2[N+](=O)[O-])o1)c1nc(O)c2c(C)c(C)sc2n1 745999932 QZBVHKIRIONJRW-WJDWOHSUSA-N 465.487 5.286 5 20 JKBD Cc1cc(C)c(NC(=O)CCCOC(=O)c2csc(-c3ccc([N+](=O)[O-])cc3)n2)c(C)c1 747955815 CQXLLEKGSFZJPO-UHFFFAOYSA-N 453.520 5.219 5 20 JKBD O=C(COC(=O)c1csc(-c2ccc([N+](=O)[O-])cc2)n1)Nc1ccc(Oc2ccccc2)cc1 747958820 VULNABSMWIPACS-UHFFFAOYSA-N 475.482 5.306 5 20 JKBD C[C@H](OC(=O)c1csc(-c2ccc([N+](=O)[O-])cc2)n1)c1ccc(NC(=O)c2ccccc2)cc1 748016465 LPWLCVZBSOKFEV-INIZCTEOSA-N 473.510 5.889 5 20 JKBD CCN(C(=O)[C@@H](C)OC(=O)c1ccccc1C(=O)c1ccc(SC)c([N+](=O)[O-])c1)c1ccccc1 777420939 OGSGJTNVMPZWSY-QGZVFWFLSA-N 492.553 5.146 5 20 JKBD Cc1csc(Sc2ccc([N+](=O)[O-])cc2C(=O)O[C@@H](C)C(=O)Nc2ccccc2C)n1 849132710 QUEOYYABMXVUAX-AWEZNQCLSA-N 457.533 5.003 5 20 JKBD O=[N+]([O-])c1ccc(/C=C(/Cc2nc(COc3ccccc3)no2)c2nc3ccccc3s2)cc1 904306744 LANANCMAGKMDDP-JXAWBTAJSA-N 470.510 5.950 5 20 JKBD O=[N+]([O-])c1ccc(/C=C(\Cc2nc(Cc3cccs3)no2)c2nc3ccccc3s2)cc1 904344868 UVFZNBVTXNKMAJ-FOWTUZBSSA-N 460.540 6.023 5 20 JKBD CCCCc1ccc(NC(=S)/C(=C(/O)c2cccc([N+](=O)[O-])c2)[n+]2ccc(C(C)(C)C)cc2)cc1 912842551 PHCJWLGNDCDBTE-UHFFFAOYSA-O 490.649 6.846 5 20 JKBD Cc1nc(Cc2ccccc2)sc1C(=O)O[C@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 915447411 ZIUYTRXDLUNWDV-CYBMUJFWSA-N 493.463 5.153 5 20 JKBD Cc1nc2nc(S[C@@H](C(=O)Nc3ccc(Cl)c([N+](=O)[O-])c3)c3ccccc3)nn2c(C)c1C 917251544 ZPLBSRBBURHNSD-LJQANCHMSA-N 482.953 5.083 5 20 JKBD CC(=O)N(c1ccc(F)cc1)c1nc(/C=C2\C(=O)Nc3cc(Cl)c([N+](=O)[O-])cc32)cs1 917560748 YIIUKEJLDKVICN-UUASQNMZSA-N 458.858 5.021 5 20 JKBD Cc1sc2nc([C@@H](C)OC(=O)c3cc([N+](=O)[O-])ccc3Oc3ccccc3)nc(O)c2c1C 919191110 CCCRDGHHLZMXSQ-CYBMUJFWSA-N 465.487 5.632 5 20 JKBD Cc1ccc(OCc2nc(COC(=O)[C@H](C)Oc3ccc(Cl)cc3[N+](=O)[O-])cs2)cc1 920778508 KTNRPPSIUBLZQX-AWEZNQCLSA-N 462.911 5.103 5 20 JKBD O=C(Cc1cc([N+](=O)[O-])ccc1F)NC1(c2ccc(NC(=O)c3cc4sccc4[nH]3)cc2)CCC1 1789366741 LHRXWSYAVZSCPB-UHFFFAOYSA-N 492.532 5.267 5 20 JKBD Cc1noc(C)c1C(=O)NC1(c2ccc(NC(=O)C3(c4cccc([N+](=O)[O-])c4)CCC3)cc2)CCC1 1790475880 JPNCOCCJUVCLNW-UHFFFAOYSA-N 488.544 5.069 5 20 JKBD Cc1ccc(CCC(=O)Nc2ccc(C3(NC(=O)/C=C/c4ccccc4[N+](=O)[O-])CCC3)cc2)c(C)n1 1791773475 WEKXEVVUCSMULB-GZTJUZNOSA-N 498.583 5.387 5 20 JKBD CC1(C(=O)NC[C@@H]2CCN(C(=O)c3cc4cc([N+](=O)[O-])ccc4s3)[C@H]2c2cccnc2)CCCC1 1802625748 TXRWEYGHOFCBPH-MBSDFSHPSA-N 492.601 5.104 5 20 JKBD Cc1c(C(=O)N2CCC3(CCCN(C(=O)/C=C/c4ccccc4)C3)CC2)cc(Cl)cc1[N+](=O)[O-] 1809305869 FYTCHOSUVGMWPC-CMDGGOBGSA-N 481.980 5.115 5 20 JKBD O=C(Nc1cc([C@H]2CCCCN2C(=O)/C=C/c2ccoc2)[nH]n1)c1cc2cc([N+](=O)[O-])ccc2s1 1821612050 PWSROUUPUQFYEE-ZLHKHBAESA-N 491.529 5.145 5 20 JKBD Cc1c(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)CC(C)(C)C)CC2)cc(Cl)cc1[N+](=O)[O-] 1830736700 YWUASWKILWCOBQ-HXUWFJFHSA-N 464.006 5.226 5 20 JKBD Cc1c(C(=O)N2CCC([C@@H]3CCCCN3C(=O)CCc3ccoc3)CC2)cc(Cl)cc1[N+](=O)[O-] 1832349433 MXIZYOAQPHJOLH-QFIPXVFZSA-N 487.984 5.016 5 20 JKBD C[C@H](Sc1nnc(NCc2ccccc2)s1)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 11409233 LOIUMVQMMHONME-NSHDSACASA-N 483.497 5.197 5 20 JKBD Cc1ccc(NC(=O)[C@@H](C)OC(=O)c2ccccc2C(=O)c2ccc(Cl)c([N+](=O)[O-])c2)c(C)c1 15710212 GFMUHHCBMNJFAD-MRXNPFEDSA-N 480.904 5.280 5 20 JKBD CC[C@H]1CCc2sc(-c3nnc(S[C@@H](C)c4nnc(-c5ccc([N+](=O)[O-])cc5)o4)n3C)cc2C1 17717209 YGCQYWPHBYMQIP-KBPBESRZSA-N 496.618 5.870 5 20 JKBD C[C@H](Sc1nnc(-c2ccc(Cl)cc2)n1Cc1ccco1)C(=O)Nc1cccc([N+](=O)[O-])c1 21119501 JZYLMMHUWQNWAS-AWEZNQCLSA-N 483.937 5.267 5 20 JKBD Cn1cnnc1Sc1ccc(C(=O)N[C@H](c2ccccc2)c2ccc(Cl)cc2)cc1[N+](=O)[O-] 21840568 YVZCVNXRURMISY-OAQYLSRUSA-N 479.949 5.047 5 20 JKBD CSc1cccc(NC(=O)COC(=O)c2ccccc2NC(=O)c2ccc([N+](=O)[O-])cc2Cl)c1 26908395 UNOJHIYJKAGTTR-UHFFFAOYSA-N 499.932 5.018 5 20 JKBD CCOc1cc([N+](=O)[O-])c(C(=O)Nc2c3ccccc3n3c(C)nc4ccccc4c23)cc1OC 28248120 WGJWZQZPMQNEGO-UHFFFAOYSA-N 470.485 5.517 5 20 JKBD COc1cc2c(cc1OC)[C@H](c1ccccc1)N(C(=O)[C@@H](C)Sc1ccc([N+](=O)[O-])cc1)CC2 32891784 ZDGFTFCLWDFPEP-NSYGIPOTSA-N 478.570 5.267 5 20 JKBD Cc1c(C(=O)Nc2ccccc2NC23CC4CC(CC(C4)C2)C3)nnn1-c1cccc([N+](=O)[O-])c1 72053489 JIRRZIKGHSQSQY-UHFFFAOYSA-N 472.549 5.117 5 20 JKBD COc1ccc([N+](=O)[O-])cc1NC(=O)c1cccnc1Sc1ccc(Br)cc1 104797977 FTRDTDSTUSLWDO-UHFFFAOYSA-N 460.309 5.164 5 20 JKBD COc1cc(C(=O)Nc2ccc(-c3nnco3)cc2)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 105761086 DNPSIJGCXVDNNE-UHFFFAOYSA-N 466.837 5.351 5 20 JKBD O=C(Nc1ccc(Oc2ncc(Cl)cc2Cl)cc1)c1ccn(-c2ccc([N+](=O)[O-])cc2)n1 195715209 DFUXWNBKHLTNRD-UHFFFAOYSA-N 470.272 5.527 5 20 JKBD O=C(Nc1nc(-c2ccc3c(c2)CCO3)cs1)c1csc(-c2cccc([N+](=O)[O-])c2)n1 303014541 KIFSNEJOTUSUQB-UHFFFAOYSA-N 450.501 5.029 5 20 JKBD CC(C)N(Cc1nnc(-c2ccccc2Cl)o1)C(=O)c1ccc(C(C)(C)C)c([N+](=O)[O-])c1 485498729 CNQNWQNCISPWEK-UHFFFAOYSA-N 456.930 5.647 5 20 JKBD COc1ccc(-c2nc(NC(=O)c3csc(-c4cccc([N+](=O)[O-])c4)n3)sc2C)cc1 496411361 LYLYZDOUPFTPJZ-UHFFFAOYSA-N 452.517 5.411 5 20 JKBD C[C@@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)Nc1ccc(CC(=O)N2CCCc3ccccc32)cc1 503449238 SQTSSQFBXQJZBF-QGZVFWFLSA-N 493.947 5.176 5 20 JKBD CN(C(=O)c1csc(-c2cccc([N+](=O)[O-])c2)n1)[C@@H]1CCSc2ccc(Br)cc21 504614147 NFKDGZXWHCEMME-QGZVFWFLSA-N 490.404 5.790 5 20 JKBD COc1ccc(CN[C@@H](C)c2cccc(N3CCCC3=O)c2)cc1OCc1ccc([N+](=O)[O-])cc1 507902880 LCUDLHNZACAVQQ-IBGZPJMESA-N 475.545 5.160 5 20 JKBD CC(C)N(C)C(=O)c1ccc(Cl)c(NC(=O)c2cc([N+](=O)[O-])ccc2Sc2ccccc2)c1 509290935 SJODBQDDBDZBAW-UHFFFAOYSA-N 483.977 6.132 5 20 JKBD CC[C@H](c1ccccc1)N(CC)C(=O)c1cc(OC)c(OCc2cscn2)cc1[N+](=O)[O-] 512411327 XPGODMHEDPNELV-LJQANCHMSA-N 455.536 5.252 5 20 JKBD O=C(C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)N1CCC[C@H]1c1cccc(F)c1 516142306 RSSUMHKYQKISKJ-ATOQVSERSA-N 487.556 6.638 5 20 JKBD COc1cc([C@@H](C)NCc2ccc(-c3ccc([N+](=O)[O-])cc3Br)o2)cc(OC)c1OC 517537436 WYAOGIQYMSOQIB-CYBMUJFWSA-N 491.338 5.494 5 20 JKBD CC[C@H](NCc1ccc(Sc2ccc(C)cc2)c([N+](=O)[O-])c1)c1nnc2n1CCCCC2 520963565 RKSFAVOZFPVCNJ-FQEVSTJZSA-N 451.596 5.613 5 20 JKBD CCCN(Cc1nnc(-c2ccccc2Cl)o1)C(=O)[C@@H](C)Oc1ccc(Cl)cc1[N+](=O)[O-] 521275672 OLOBJOWPGPPNQO-CYBMUJFWSA-N 479.320 5.158 5 20 JKBD COCCN(C(=O)C1CC(c2cccc(F)c2)C1)c1nc(-c2ccc([N+](=O)[O-])cc2)cs1 522203223 SRVOHHBRVFWLED-UHFFFAOYSA-N 455.511 5.031 5 20 JKBD Cc1csc(Sc2c(Cl)cccc2NC(=O)CCn2nc(C)c([N+](=O)[O-])c2C)n1 523288401 QJWSJKZDPIYCOP-UHFFFAOYSA-N 451.961 5.006 5 20 JKBD Cc1ccc(NC(=O)C(C)C)cc1NC(=O)c1cc([N+](=O)[O-])ccc1Sc1ccc(Cl)cc1 603744575 SRBWTBOONTUDNK-UHFFFAOYSA-N 483.977 6.555 5 20 JKBD Cc1c(NC(=O)c2cc([N+](=O)[O-])ccc2NCc2ccccc2)cccc1-c1nnc2n1CCCCC2 603962394 TYRJKYVHPGUDJS-UHFFFAOYSA-N 496.571 5.753 5 20 JKBD Cc1ccc(NC(=O)c2ccc(Nc3cccc(NC(=O)[C@@H](C)n4cccn4)c3)c([N+](=O)[O-])c2)cc1 608972877 KNNULVQWBQOSIS-GOSISDBHSA-N 484.516 5.295 5 20 JKBD CC1CCC(OC2CCN(C(=O)c3ccc(N4C[C@H](C)C[C@@H](C)C4)c([N+](=O)[O-])c3)CC2)CC1 609374195 IVMRAZIKWFKDNR-QHCGNWPDSA-N 457.615 5.277 5 20 JKBD Cc1ccc(N(C(=O)c2ccc(N[C@H](C)c3ccccn3)c([N+](=O)[O-])c2)C2CCCCC2)nc1 609375671 KJZXQWCZVREYJZ-LJQANCHMSA-N 459.550 5.846 5 20 JKBD Cn1c(COc2ccccc2Cl)nnc1Sc1ccc(C(=O)c2ccccc2)cc1[N+](=O)[O-] 619676395 NOAFDRPFSDSXDD-UHFFFAOYSA-N 480.933 5.338 5 20 JKBD Cn1c(-c2ccc(NC(=O)c3cc([N+](=O)[O-])ccc3I)cc2)nc2ccccc21 727351744 SHRJWECWVQNGQV-UHFFFAOYSA-N 498.280 5.005 5 20 JKBD Cc1ccc2c(Cl)c(C(=O)N(Cc3nnc(-c4cccc([N+](=O)[O-])c4)o3)C(C)C)sc2c1 729169478 YHZYKOFKMWELHQ-UHFFFAOYSA-N 470.938 5.872 5 20 JKBD C[C@H](OC(=O)[C@H]1C[C@@H]1c1ccc(Cl)cc1Cl)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 730613830 MHVLAEMWTBEFLQ-FZZIBODNSA-N 491.249 5.594 5 20 JKBD C[C@H](OC(=O)c1ccc(-c2ccc3c(c2)OCCO3)s1)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 746165953 OKOLJSJDJNNLMB-ZDUSSCGKSA-N 479.470 5.063 5 20 JKBD O=C(CSc1ccccc1C(=O)N1CCc2ccc([N+](=O)[O-])cc21)NC1CCCCCCC1 794102413 YPBFXBHTQIKOHW-UHFFFAOYSA-N 467.591 5.119 5 20 JKBD O=C(Nc1cc([N+](=O)[O-])c(F)cc1F)c1cc(-c2ccc3c(c2)OCCO3)nc2ccccc12 897509117 PPLGWXSYZCGOMC-UHFFFAOYSA-N 463.396 5.112 5 20 JKBD CCN(c1ccccc1)S(=O)(=O)c1ccc(Cl)c(C(=O)Nc2cc([N+](=O)[O-])ccc2C)c1 912934399 LBGUJMYFMXRELJ-UHFFFAOYSA-N 473.938 5.024 5 20 JKBD O=C(Nc1ccc(C(=O)Nc2cc([N+](=O)[O-])c(F)cc2F)cc1)c1cccc(Br)c1 918562967 IXBVJEZSEQGQTH-UHFFFAOYSA-N 476.233 5.140 5 20 JKBD CC(C)N(C(=O)COC(=O)c1ccc([N+](=O)[O-])cc1F)c1ccc(Nc2ccccc2)cc1 919567996 WATMZDKDGQGAKO-UHFFFAOYSA-N 451.454 5.076 5 20 JKBD O=C(NC1(c2ccc(NC(=O)c3cccc(F)c3[N+](=O)[O-])cc2)CCC1)c1cc2sccn2c1 1790699173 ZRUDQFQVGJGSLV-UHFFFAOYSA-N 478.505 5.110 5 20 JKBD CC(C)(C)c1cc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cc4cc([N+](=O)[O-])ccc4s2)C3)ccn1 1794600963 DGFAQRMHQYCXMA-REPLKXPHSA-N 492.601 5.068 5 20 JKBD CC[C@H](C)CC(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cc(Cl)cc([N+](=O)[O-])c2C)n[nH]1 1821289433 HCRWAPZCGPKPMY-UGSOOPFHSA-N 461.950 5.022 5 20 JKBD Cc1cc(Cl)ccc1C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cc(F)cc([N+](=O)[O-])c2)CC1 1823911577 DAEREXIGZJSCPB-HSZRJFAPSA-N 487.959 5.243 5 20 JKBD Cc1c(C(=O)N2CCCC[C@H]2C2CCN(C(=O)c3cc(F)cc([N+](=O)[O-])c3)CC2)oc2ccccc12 1828128500 UCHGKSNUEZTMEF-QHCPKHFHSA-N 493.535 5.336 5 20 JKBD CC1=CC[C@H](C(=O)N2CCC([C@@H]3CCCCN3C(=O)C3(c4cccc([N+](=O)[O-])c4)CCC3)CC2)CC1 1830293151 SVLXQVTUAVMDIP-OZXSUGGESA-N 493.648 5.383 5 20 JKBD CC(C)(C)CC(=O)N1CCC([C@@H]2CCCCN2C(=O)c2ccc(Br)c([N+](=O)[O-])c2)CC1 1830523210 TVNPLTONWNDVAS-IBGZPJMESA-N 494.430 5.027 5 20 JKBD Cc1cc2[nH]c(C(=O)N3CCCC[C@@H]3C3CCN(C(=O)c4cccc(F)c4[N+](=O)[O-])CC3)cc2s1 1830890284 SWABKKLHCMQSLN-OAQYLSRUSA-N 498.580 5.132 5 20 JKBD O=C(CCc1cccc([N+](=O)[O-])c1)N1CCC([C@@H]2CCCCN2C(=O)C23CCC(CC2)CC3)CC1 1832386303 QKVFXBBNIZBNQL-FJOOJYTASA-N 481.637 5.118 5 20 JKBD CCSc1nnc(NC(=O)c2ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])c(OC)c2)s1 14740109 QOMYLTXBLKJZRP-UHFFFAOYSA-N 466.928 5.265 5 20 JKBD CCSc1nnc(NC(=O)C/C(=C/c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)s1 14740319 JSRTVKARWJEFTQ-KAMYIIQDSA-N 483.600 5.737 5 20 JKBD CCCn1c(S[C@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)nnc1-c1cccc(C)c1 21159204 ALGIYOUVGXEGCO-CQSZACIVSA-N 459.959 5.344 5 20 JKBD O=C(Nc1ccc(Cl)c(C(F)(F)F)c1)[C@@H](Oc1cccnc1[N+](=O)[O-])c1ccccc1 22027533 BEBUFWYYOHKWSU-KRWDZBQOSA-N 451.788 5.421 5 20 JKBD C[C@H](NC(=O)c1ccc(NCc2ccccc2)c([N+](=O)[O-])c1)c1ccc(NC(=O)C2CC2)cc1 30395713 GNMOELSEQOEMAP-KRWDZBQOSA-N 458.518 5.046 5 20 JKBD CCC(C)(C)C1CCC(NC(=O)c2cc(OC)c(OCc3cscn3)cc2[N+](=O)[O-])CC1 72024566 CPUZNHJKCKAJHZ-UHFFFAOYSA-N 461.584 5.364 5 20 JKBD CC(C)(C)OC(=O)Nc1ccc(C(F)(F)F)cc1NC(=O)c1ccn(-c2ccc([N+](=O)[O-])cc2)n1 109293402 JGLNOSQPQWYTCW-UHFFFAOYSA-N 491.426 5.399 5 20 JKBD Cc1cc(NC(=O)Cn2c3ccccc3c(=O)c3ccccc32)n(-c2cccc(C(F)(F)F)c2)n1 302925860 BPPBBTVXVPNMRP-UHFFFAOYSA-N 476.458 5.306 5 20 JKBD CCN(C(=O)Cc1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1)c1ccc(OC)cc1 477490871 ONRHZTFWAKJODF-UHFFFAOYSA-N 456.502 5.052 5 20 JKBD CCOc1cc([N+](=O)[O-])c(C(=O)N[C@@H](C)c2ccc(NC(=O)Nc3ccccc3)cc2)cc1OC 480780491 SFPYUYLJQAZYBD-INIZCTEOSA-N 478.505 5.137 5 20 JKBD COCCN(C(=O)c1ccc(-c2ccc(F)cc2)o1)c1nc(-c2ccc([N+](=O)[O-])cc2)cs1 483274431 YSGXHHUXMWQEFC-UHFFFAOYSA-N 467.478 5.411 5 20 JKBD O=C(Nc1ccc(Cl)c(C(=O)NCc2ccccc2F)c1)c1ccc(N2CCCC2)c([N+](=O)[O-])c1 484266716 MSKMZUOCJUFDFS-UHFFFAOYSA-N 496.926 5.170 5 20 JKBD O=C(NCCCCOc1ccc(Cl)cc1)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 493029314 VYIHVEGFXIBYSI-UHFFFAOYSA-N 499.917 5.459 5 20 JKBD CCCOc1ccccc1Oc1ncccc1CNC(=O)c1ccc(SC)c([N+](=O)[O-])c1 502292521 XIEODRFLMAVUJT-UHFFFAOYSA-N 453.520 5.223 5 20 JKBD O=C(CSc1ccc(C(F)(F)F)cc1[N+](=O)[O-])N1CCCC[C@@H]1c1nc(-c2ccccc2)no1 505333049 ZKNLYNSXLYLPSP-MRXNPFEDSA-N 492.479 5.510 5 20 JKBD CCc1cccc(CC)c1NC(=O)Cc1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1 506631159 PAIKOJNASHGSQB-UHFFFAOYSA-N 454.530 5.754 5 20 JKBD O=[N+]([O-])c1cc(CNCc2cn3cc(Br)ccc3n2)ccc1Oc1ccccc1Cl 509573048 SOHGQTHVIWBZJA-UHFFFAOYSA-N 487.741 5.741 5 20 JKBD COc1ccc(CNC(=O)Nc2ccc(NC(=O)c3ccccc3)cc2C(F)(F)F)cc1[N+](=O)[O-] 515772798 AJZNSYKRNNNNIZ-UHFFFAOYSA-N 488.422 5.196 5 20 JKBD COc1cc(C(=O)N[C@@H](c2ccc(F)cc2)c2cccs2)c([N+](=O)[O-])cc1OCc1cscn1 517759741 FXOMJCVOKDCDIG-QFIPXVFZSA-N 499.545 5.359 5 20 JKBD COc1cc(C(=O)Nc2nc(-c3ccc(Cl)cc3Cl)cs2)c([N+](=O)[O-])cc1OC 602808532 LYMJISNFTPFVDZ-UHFFFAOYSA-N 454.291 5.295 5 20 JKBD COCCN(C(=O)c1ccc(-c2ccc(C(C)=O)cc2)o1)c1nc(-c2ccc([N+](=O)[O-])cc2)cs1 603461302 MMRJUCVEZKAVHB-UHFFFAOYSA-N 491.525 5.474 5 20 JKBD O=C(NC[C@H](c1ccccc1Cl)c1c[nH]c2ccccc12)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl 603697361 IDHVOHDNROEFSB-QGZVFWFLSA-N 497.338 5.270 5 20 JKBD COc1ccc([N+](=O)[O-])cc1NC(=O)c1nc(-c2ccccc2)n(-c2cccc(C(F)(F)F)c2)n1 603826183 BWHCJLHFOLYMJZ-UHFFFAOYSA-N 483.406 5.122 5 20 JKBD Cc1ccc(N(C(=O)[C@@H](C)Sc2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)c(C)c1 604440881 LQPFLEBNXOXUQA-QGZVFWFLSA-N 463.584 6.667 5 20 JKBD COc1ccc(Oc2ccc([N+](=O)[O-])cc2C(=O)Nc2ccc(OC)cc2Br)cc1 608901061 SNSDNPRMQPAOQU-UHFFFAOYSA-N 473.279 5.419 5 20 JKBD O=C(C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)Nc1nc2c(s1)COCC2 609022680 XVSWSLLFQVAJPL-RVDMUPIBSA-N 478.555 5.303 5 20 JKBD CCOc1ccc(N(C(=O)c2ccc(OCC)c([N+](=O)[O-])c2)C2CCN(CC(F)(F)F)CC2)cc1 609151393 MSGDXXOVLIADIB-UHFFFAOYSA-N 495.498 5.066 5 20 JKBD CC(C)OC(=O)C[C@@H](NC(=O)Nc1cccc(C(=O)c2ccccc2)c1)c1ccccc1[N+](=O)[O-] 609210921 UHOCUICIDRXNCM-JOCHJYFZSA-N 475.501 5.030 5 20 JKBD CCOc1cc(NC(=O)c2ccc(-c3ccc4c(c3)OCCO4)s2)c([N+](=O)[O-])cc1OCC 619213051 GBPMZSGRIVLRPW-UHFFFAOYSA-N 470.503 5.144 5 20 JKBD Cc1ccc(Sc2ccc(CN[C@H](C)c3ccc(N4CCOC4=O)cc3)cc2[N+](=O)[O-])cc1 725848447 SRHJDISLHDFADX-GOSISDBHSA-N 463.559 5.862 5 20 JKBD CN(CCCc1cc(-c2ccc(F)cc2)no1)C(=O)c1cc([N+](=O)[O-])ccc1N1CCCCC1 751242502 COOVUUTXOMPOLK-UHFFFAOYSA-N 466.513 5.084 5 20 JKBD CC1=C(C(=O)Nc2cccc(Cl)c2)[C@H](c2ccc([N+](=O)[O-])o2)NC(=S)N1c1ccccc1 812514837 KZLOIFNSGYONBX-FQEVSTJZSA-N 468.922 5.190 5 20 JKBD Cc1nn(C)c2nc(C3CC3)cc(C(=O)Nc3cc(Cl)c([N+](=O)[O-])cc3OCc3ccccc3)c12 844276349 GBUWXVKWQTWWNX-UHFFFAOYSA-N 491.935 5.547 5 20 JKBD CC(C)c1ccccc1NC(=O)c1ccc(NS(=O)(=O)c2ccc(Cl)c([N+](=O)[O-])c2)cc1 864049003 AGXOTJGLGJLJOY-UHFFFAOYSA-N 473.938 5.425 5 20 JKBD CCOC(=O)c1sc(-c2cccc([N+](=O)[O-])c2)cc1NC(=O)c1cc([N+](=O)[O-])ccc1Cl 903390773 JATQWMNKOGYMFP-UHFFFAOYSA-N 475.866 5.314 5 20 JKBD COc1cccc(/C=C(/CC(=O)Nc2cc([N+](=O)[O-])ccc2F)c2nc3ccccc3s2)c1 916667108 RODAFLRQDLKSBD-WJDWOHSUSA-N 463.490 5.922 5 20 JKBD O=C(Cn1ncc2ccc([N+](=O)[O-])cc21)C(c1nc2ccccc2s1)c1nc2ccccc2s1 916844790 BYDTZRYTMMTKHS-UHFFFAOYSA-N 485.550 5.565 5 20 JKBD O=C(Cn1ccc2ccccc21)O[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1 918770976 IGYFVNNBMLZSBJ-QHCPKHFHSA-N 463.877 5.126 5 20 JKBD CCOC(=O)N(C)c1ccc(N[C@@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2ccccc2)cc1 920062616 QRSOLWDXFHRZGG-JOCHJYFZSA-N 482.924 5.633 5 20 JKBD C[C@@H](Nc1ccc(C(=O)Oc2ccc(C(=O)Nc3cccnc3)cc2)cc1[N+](=O)[O-])c1ccccn1 921008939 WJHPIWNAMOLEIZ-QGZVFWFLSA-N 483.484 5.029 5 20 JKBD O=C(CCc1cccc([N+](=O)[O-])c1)Nc1ccc(C2(NC(=O)C(Cl)(Cl)Cl)CCC2)cc1 1786601565 XZWLGFZZZCNPPP-UHFFFAOYSA-N 484.767 5.032 5 20 JKBD COc1cc(CC(=O)NC2(c3ccc(NC(=O)/C=C/C4CCCC4)cc3)CCC2)ccc1[N+](=O)[O-] 1790515701 XAMCBSPBQREACE-RIYZIHGNSA-N 477.561 5.026 5 20 JKBD COc1ccc(CC(=O)Nc2ccc(C3(NC(=O)[C@H](C)c4cccs4)CCC3)cc2)c([N+](=O)[O-])c1 1790574108 SHWGOAGXVRORGK-QGZVFWFLSA-N 493.585 5.145 5 20 JKBD COc1cccc(/C=C/C(=O)Nc2ccc(C3(NC(=O)/C=C/c4ccc([N+](=O)[O-])o4)CCC3)cc2)c1 1791387608 WUXCTNUUJNVDKP-IRBLODBNSA-N 487.512 5.057 5 20 JKBD COc1ccc(CC(=O)NC2(c3ccc(NC(=O)[C@H](C)c4cccs4)cc3)CCC2)c([N+](=O)[O-])c1 1791814996 CXYDUKXNJJHNDM-QGZVFWFLSA-N 493.585 5.145 5 20 JKBD Cc1ccc(CC(=O)NC2(c3ccc(NC(=O)[C@]4(F)CCCC=C4F)cc3)CCC2)cc1[N+](=O)[O-] 1792379548 KXGCXFFLDAJGJN-SANMLTNESA-N 483.515 5.325 5 20 JKBD O=C(c1ccnc(Cl)c1)N1CCCC2(CCN(C(=O)c3cc4cc([N+](=O)[O-])ccc4s3)CC2)C1 1808359418 UCICPOWYOIIFTM-UHFFFAOYSA-N 498.992 5.017 5 20 JKBD CC(C)[C@H]1CC[C@H](C(=O)N2CCCC[C@H]2c2cc(NC(=O)c3cccc(F)c3[N+](=O)[O-])n[nH]2)CC1 1821175038 SCSBVLXVQUVBNF-FIKGOQFSSA-N 485.560 5.225 5 20 JKBD O=C(Nc1cc([C@H]2CCCCN2C(=O)CC2CCC2)[nH]n1)c1cc2cc([N+](=O)[O-])ccc2s1 1821610705 JLNOXCRNMRTZKW-GOSISDBHSA-N 467.551 5.029 5 20 JKBD O=C(Nc1cc([C@H]2CCCCN2C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)[nH]n1)C1CC2(CCC2)C1 1823055766 IHXSTBZJPUASBD-LJQANCHMSA-N 493.589 5.419 5 20 JKBD CCCc1ccc(C(=O)N2CCC([C@@H]3CCCCN3C(=O)/C=C/c3ccc([N+](=O)[O-])o3)CC2)cc1 1824276806 YOWWZOCFJFBSFC-CWSBKQHBSA-N 479.577 5.087 5 20 JKBD O=C(CCCc1ccccc1F)N1CCC([C@@H]2CCCCN2C(=O)c2cc(F)cc([N+](=O)[O-])c2)CC1 1830613345 ZRKFPILRWUFUME-VWLOTQADSA-N 499.558 5.129 5 20 JKBD Cc1ccc(C(=O)N2CCCC[C@H]2C2CCN(C(=O)/C=C/c3ccccc3[N+](=O)[O-])CC2)c(F)c1F 1832616881 UWYWEVLRVYEOIY-YUAYGMJFSA-N 497.542 5.128 5 20 JKBD O=C(O[C@@H](C(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1)c1ccccc1)c1nc(Cl)ccc1Cl 9644988 ZLGQCOBMYVEWQH-GOSISDBHSA-N 480.691 5.487 5 20 JKBD Cc1ccc(Nc2nnc(S[C@H](C)C(=O)Nc3ccc([N+](=O)[O-])cc3C(F)(F)F)s2)cc1 10317378 ROGHWONODLYJTM-LLVKDONJSA-N 483.497 5.636 5 20 JKBD COc1ccc(C(=O)OCC(=O)Nc2c(Cl)c(Cl)cc(Cl)c2Cl)cc1[N+](=O)[O-] 11341850 ISGHAIJNLGSCMJ-UHFFFAOYSA-N 468.076 5.013 5 20 JKBD O=C(Nc1ccccc1C(=O)NCCCSc1ccc(F)cc1)c1ccc([N+](=O)[O-])cc1Cl 15372915 QFTAUOLMAXYHQE-UHFFFAOYSA-N 487.940 5.552 5 20 JKBD COC(=O)c1ccc(COc2ccc(/C=C(\Cl)c3nc4cc([N+](=O)[O-])ccc4[nH]3)cc2OC)o1 18064352 BJYIFGRPNDESNX-SXGWCWSVSA-N 483.864 5.175 5 20 JKBD C[C@@H](NC(=O)CSc1nc2cc3ccccc3cc2c(=O)n1C)c1cccc2ccccc12 19417877 VUHQWDJGMJJHKE-QGZVFWFLSA-N 453.567 5.209 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Br)[C@H](NCc1ccccc1Cl)c1ccccc1 21819446 WRSLVKXEYCNYLN-HXUWFJFHSA-N 474.742 5.480 5 20 JKBD CC(=O)N(c1nc(COC(=O)c2cc([N+](=O)[O-])ccc2N2CCCC2)cs1)c1ccc(C)cc1C 22617114 KLHVXCYPYQXXAG-UHFFFAOYSA-N 494.573 5.310 5 20 JKBD CCn1c(S[C@H](C(=O)N2CCc3sccc3C2)C(C)C)nc2cc3ccccc3cc2c1=O 31747542 AUBZSDZPWRJSGA-QHCPKHFHSA-N 477.655 5.333 5 20 JKBD COc1ccc(N2C(=O)/C(=C\c3cccs3)N=C2S/C=C\c2ccc([N+](=O)[O-])o2)cc1Cl 96936389 YYVQWEQUJBIZPE-JXZZBUNNSA-N 487.946 6.059 5 20 JKBD CC(C)CCSc1ccc(C(=O)N[C@@H](c2nc(-c3ccncc3)no2)C(C)C)cc1[N+](=O)[O-] 110598926 CZLCVICFDSRKJS-HXUWFJFHSA-N 469.567 5.305 5 20 JKBD C[C@@H]1CCCN(c2ccc(C(=O)Nc3ccc(F)c(-c4nnc5n4CCCCC5)c3)cc2[N+](=O)[O-])C1 115560633 FYRRANAPSNSASP-QGZVFWFLSA-N 492.555 5.207 5 20 JKBD O=C(Nc1ccnn1C1CCCCC1)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 247306821 HBRJUPSWJBIZNB-UHFFFAOYSA-N 465.476 5.170 5 20 JKBD COc1ccccc1CN(Cc1cccs1)C(=O)c1ccc(N2CCCC2)c([N+](=O)[O-])c1 255940158 ZJDYIXQCJIAZAU-UHFFFAOYSA-N 451.548 5.108 5 20 JKBD CC(C)(C)[C@@H](NC(=O)CCCn1c(=O)oc2cc([N+](=O)[O-])ccc21)c1cccc(C(F)(F)F)c1 303172591 RTWAGXBFCOYNOM-FQEVSTJZSA-N 479.455 5.205 5 20 JKBD O=C(C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)Nc1cccc2c[nH]nc12 477043052 ACOXWVZRJOZALT-SFQUDFHCSA-N 455.499 5.650 5 20 JKBD O=C(c1csc(-c2ccc([N+](=O)[O-])cc2)n1)N(CCc1ccccc1)c1nc2ccccc2s1 496410852 JWIMSKUAJJTLKZ-UHFFFAOYSA-N 486.578 6.218 5 20 JKBD CCN(C(=O)c1ccn(-c2cccc([N+](=O)[O-])c2)n1)[C@H]1CCSc2ccc(Br)cc21 504552882 MAXVMNCQERAKJO-IBGZPJMESA-N 487.379 5.242 5 20 JKBD CCN(C(=O)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)[C@H]1CCSc2ccc(Br)cc21 510304962 PMVITTULERTHHV-INIZCTEOSA-N 498.786 5.035 5 20 JKBD CCOc1cc(C(=O)Nc2nc(-c3ccc(F)c(Cl)c3)cs2)c([N+](=O)[O-])cc1OC 511628129 XQMDSAQAXUVJMB-UHFFFAOYSA-N 451.863 5.170 5 20 JKBD COc1cc(C(=O)N2CCC(n3c(C)ccc3C)CC2)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 512591092 DAQJHJMKYIMIRL-UHFFFAOYSA-N 483.952 5.945 5 20 JKBD Cc1cc([N+](=O)[O-])ccc1NC(=O)CSc1nnc(-c2ccccc2)n1[C@H](C)c1ccccc1 515488841 ZFWNRWUTPWSZJM-GOSISDBHSA-N 473.558 5.502 5 20 JKBD CN(C(=O)c1ccccc1Sc1ccc(C(F)(F)F)cc1[N+](=O)[O-])c1nc2ccccc2o1 517927256 PIAGTSKHMZSYHO-UHFFFAOYSA-N 473.432 6.183 5 20 JKBD O=C(Nc1ccc(CNCc2ccc(-c3ccc([N+](=O)[O-])cc3Br)o2)cc1)c1ccco1 520217393 ZXFDMHXXMUBMCI-UHFFFAOYSA-N 496.317 5.752 5 20 JKBD Cc1ccccc1-c1cc(NCc2ccc(-c3ccc([N+](=O)[O-])cc3Br)o2)n(CCO)n1 520964148 IGNJZWBPYKRQGK-UHFFFAOYSA-N 497.349 5.394 5 20 JKBD O=C(NCCc1ccc([N+](=O)[O-])cc1)N(Cc1ccc(Cl)c(Cl)c1)Cc1ccccn1 524657207 KMHUBMCUZTYJEK-UHFFFAOYSA-N 459.333 5.251 5 20 JKBD Cc1ccc(-c2csc3ncnc(SCC(=O)N[C@@H](C)c4cccc([N+](=O)[O-])c4)c23)cc1 603904770 QEOXTHYKSVPBIO-HNNXBMFYSA-N 464.572 5.544 5 20 JKBD Cc1c(NC(=O)[C@H](C)Nc2ccc(Oc3ncc(Cl)cc3Cl)cc2)cccc1[N+](=O)[O-] 604044741 MWRMSZULYCGFNH-ZDUSSCGKSA-N 461.305 5.836 5 20 JKBD O=C(Cc1ccc([N+](=O)[O-])cc1)Nc1nc(-c2ccc(OC(F)F)cc2OC(F)F)cs1 604511018 LGHOJTKNQKKFNA-UHFFFAOYSA-N 471.388 5.102 5 20 JKBD CC(C)CCSc1ccc(C(=O)N(C)C[C@H]2CCCO[C@@H]2c2ccccc2)cc1[N+](=O)[O-] 604519188 RCNPWOPRMCZRMO-ZJSXRUAMSA-N 456.608 5.973 5 20 JKBD O=c1c(Cl)c(N[C@@H]2CCOc3c(-c4ccccc4)cccc32)cnn1-c1ccc([N+](=O)[O-])cc1 608831172 IYFXAWDDNZCSAL-OAQYLSRUSA-N 474.904 5.397 5 20 JKBD CN(Cc1ccccc1[N+](=O)[O-])C(=O)Nc1ccccc1OCc1ncc(-c2cccc(Cl)c2)o1 608864115 KARUPPNAWHJUIX-UHFFFAOYSA-N 492.919 6.146 5 20 JKBD O=C(Nc1ccc(F)cc1-c1ccc(Cl)cc1)c1cc([N+](=O)[O-])ccc1N1CCOCC1 728483705 LWYKQVUYPUAUJL-UHFFFAOYSA-N 455.873 5.143 5 20 JKBD CCN(CCc1ccccn1)C(=O)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])c(OC)c1 746834276 ZCGITPCMDHPEBU-UHFFFAOYSA-N 455.898 5.149 5 20 JKBD C[C@@H](OC(=O)c1ccc(N2CCCC2)c([N+](=O)[O-])c1)c1ccccc1NC(=O)c1ccccc1 748020195 CWLWCSBXRJFKQC-GOSISDBHSA-N 459.502 5.365 5 20 JKBD Cc1noc2nc(C(C)C)cc(C(=O)Oc3ccc(NC(=O)c4cc([N+](=O)[O-])ccc4Cl)cc3)c12 835391662 JZBRISJCBMPMNP-UHFFFAOYSA-N 494.891 5.688 5 20 JKBD CC(C)[C@@H](OC(=O)c1ccc(N2CCCC2)c([N+](=O)[O-])c1)C(=O)Nc1ccccc1C(F)(F)F 915370903 ZSWBTMRSQDFDFA-HXUWFJFHSA-N 479.455 5.034 5 20 JKBD O=C(Oc1ccc2c(-c3ccc([N+](=O)[O-])cc3)cc(=O)oc2c1)[C@H]1CCC[C@@H](C(F)(F)F)C1 916035258 IBXORKZHYRAJGX-LSDHHAIUSA-N 461.392 5.642 5 20 JKBD O=C(Nc1ccc(F)c([N+](=O)[O-])c1)c1sc(-c2ccccc2)cc1OCC(=O)N1CCCCC1 916372097 SOBBWPUEUBVBIO-UHFFFAOYSA-N 483.521 5.106 5 20 JKBD COc1cc(C(=O)NCCSC(F)(F)F)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 917191774 MNXBTBGZWOXSLK-UHFFFAOYSA-N 450.822 5.032 5 20 JKBD CC(=O)N(c1ccc(C)cc1)c1nc(COC(=O)C2CCN(c3ccccc3[N+](=O)[O-])CC2)cs1 918842239 FXSQHDXZHIIZRY-UHFFFAOYSA-N 494.573 5.004 5 20 JKBD Cc1c(Cl)cccc1NC(=O)[C@@H](C)OC(=O)c1ccc(N[C@@H](C)c2ccccn2)c([N+](=O)[O-])c1 920549432 XUQULNZBAZFIBS-JKSUJKDBSA-N 482.924 5.309 5 20 JKBD Cc1nc(-c2ccc(Cl)s2)sc1C(=O)O[C@@H](C)C(=O)Nc1ccc(F)c([N+](=O)[O-])c1 921104078 SHUNYQHKYBVOHN-VIFPVBQESA-N 469.903 5.065 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)c3ccc([N+](=O)[O-])c4c3OCO4)CCC2)cc1)c1ccccc1Cl 1790224739 DKPVBJUBTYGWKF-UHFFFAOYSA-N 493.903 5.038 5 20 JKBD O=C(Cc1c[nH]c2ccccc12)Nc1ccc(C2(NC(=O)c3ccc([N+](=O)[O-])cc3F)CCC2)cc1 1790396425 AJKUGGOUNXRXGQ-UHFFFAOYSA-N 486.503 5.206 5 20 JKBD O=C(NC1(c2ccc(NC(=O)C3(c4cccc([N+](=O)[O-])c4)CCC3)cc2)CCC1)[C@H]1CCCS1 1790476648 PZARTZMHAZAFEC-JOCHJYFZSA-N 479.602 5.046 5 20 JKBD O=C(CSc1ccccc1[N+](=O)[O-])Nc1ccc(C2(NC(=O)C3CCCC3)CCC2)cc1 1791521315 JJEDVDWNIUNFMW-UHFFFAOYSA-N 453.564 5.011 5 20 JKBD COc1ccc(C(=O)NC2(c3ccc(NC(=O)CSc4ccccc4[N+](=O)[O-])cc3)CCC2)cc1 1791523888 YVNVNHRUOQWVNW-UHFFFAOYSA-N 491.569 5.143 5 20 JKBD C[C@@H](C(=O)Nc1ccc(C2(NC(=O)c3nc4cc([N+](=O)[O-])ccc4[nH]3)CCC2)cc1)c1cccs1 1791815694 IRDPVQAIVVRRHK-OAHLLOKOSA-N 489.557 5.084 5 20 JKBD CC(C)[C@H]1CC[C@H](C(=O)N2CCCC[C@@H]2c2cc(NC(=O)c3ccc([N+](=O)[O-])cc3F)n[nH]2)CC1 1821050773 QCYXLTIYHDGIPY-DRSNIGMVSA-N 485.560 5.225 5 20 JKBD O=C(c1ccc([N+](=O)[O-])o1)N1CCC([C@@H]2CCCCN2C(=O)[C@@H]2CCC[C@H]3CCCC[C@H]32)CC1 1828455455 BAZQHRQUWXENNU-NMIHRBCNSA-N 471.598 5.028 5 20 JKBD O=C(c1cccc(F)c1[N+](=O)[O-])N1CCC([C@@H]2CCCCN2C(=O)c2ccc(Cl)c(F)c2)CC1 1830486386 XCMVBMQHLWRFHX-NRFANRHFSA-N 491.922 5.074 5 20 JKBD Cc1cc(C)c(B2Nc3ccc4ccccc4c3-c3c2cc2ccc4cccc5ccc3c2c45)c(C)c1 2332241087 HJNRVKBYPXBLPV-UHFFFAOYSA-N 471.412 7.861 5 20 JKBD C[C@@H](OC(=O)c1cc(Cl)ccc1Cl)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 11029970 MOYWSAKKUAAJAB-MRVPVSSYSA-N 451.184 5.104 5 20 JKBD CCOc1ccccc1Nc1nnc(S[C@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)s1 17541351 CBVHDPOXIUGQLN-GFCCVEGCSA-N 470.536 5.492 5 20 JKBD C[C@H](Sc1nnc2c(Cl)cc(C(F)(F)F)cn12)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 17715059 BUSOKXZEFNQFOS-QMMMGPOBSA-N 470.820 5.213 5 20 JKBD C[C@H](Sc1nnc(-c2ccco2)n1-c1ccccc1)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl 20819419 QDJYKESHRUDVQQ-ZDUSSCGKSA-N 469.910 5.208 5 20 JKBD O=C(c1ccc([N+](=O)[O-])s1)N(C[C@@H]1CCCO1)c1nc(-c2ccc(Br)cc2)cs1 21083678 WYSSAQVXLJDSLI-AWEZNQCLSA-N 494.392 5.368 5 20 JKBD Cc1c(C(=O)Oc2ccc(NC(=O)c3cc([N+](=O)[O-])ccc3Cl)cc2)cnn1-c1ccccc1 27151818 WYKVWXSYEKWQGH-UHFFFAOYSA-N 476.876 5.214 5 20 JKBD CCOc1cc(C(=O)NC[C@H](c2ccccc2)c2c[nH]c3ccccc23)c([N+](=O)[O-])cc1OC 45863796 HHVKHURMHHMTFB-HXUWFJFHSA-N 459.502 5.045 5 20 JKBD CC[C@H](C)Sc1ccc(NC(=O)c2ccn(-c3ccc([N+](=O)[O-])cc3)n2)c(C(F)(F)F)c1 60306302 HZVZJESQMZLVET-ZDUSSCGKSA-N 464.469 5.942 5 20 JKBD O=C(Cn1c2ccccc2c(=O)c2ccccc21)Nc1cc(-c2ccoc2)nn1-c1ccccc1 72050391 MBVOYFDAPWGKEZ-UHFFFAOYSA-N 460.493 5.239 5 20 JKBD O=C(NC1CCCCC1)c1cc(NC(=O)c2cc([N+](=O)[O-])ccc2N2CCCC2)ccc1Cl 108676542 ULPFCUZQLHLFJO-UHFFFAOYSA-N 470.957 5.163 5 20 JKBD O=C(Nc1cc([N+](=O)[O-])ccc1Nc1cccc(C(F)(F)F)c1)c1cc2c(s1)CCOC2 482034624 CKJSTJYDDOGQTF-UHFFFAOYSA-N 463.437 5.744 5 20 JKBD CCOC(=O)c1cc(C(=O)Nc2ccc(S[C@@H](C)CC)cc2C(F)(F)F)cc([N+](=O)[O-])c1 499559223 NLFPOHACUXCZMA-LBPRGKRZSA-N 470.469 5.933 5 20 JKBD C[C@@H]1Cc2cc([N+](=O)[O-])ccc2N1C(=O)c1cc(OCC(F)(F)F)cc(OCC(F)(F)F)c1 504366109 RTIOOFDZUDGXFH-LLVKDONJSA-N 478.345 5.068 5 20 JKBD Cc1cccc(-c2nc(C(C)C)no2)c1NC(=O)c1ccc(N2CCC[C@@H](C)C2)c([N+](=O)[O-])c1 509348482 PUXKKYDRAKSAQH-MRXNPFEDSA-N 463.538 5.565 5 20 JKBD Cc1c(NC(=O)c2cc([N+](=O)[O-])ccc2Oc2ccccc2)cccc1-c1nnc2n1CCCCC2 515705288 KAKDCAIRNNQJSF-UHFFFAOYSA-N 483.528 5.933 5 20 JKBD CN(CCCCCc1cc(-c2cccc(F)c2)no1)Cc1cc([N+](=O)[O-])cc2c1OCOC2 521818080 LHJZKZMOFWFFPP-UHFFFAOYSA-N 455.486 5.100 5 20 JKBD O=C(Nc1ccc(Cl)cc1C(=O)N1CCCC1)c1ccc(NCc2ccccc2)c([N+](=O)[O-])c1 522586638 RPMXHKPSBUIYOR-UHFFFAOYSA-N 478.936 5.349 5 20 JKBD O=C(Nc1ccc(F)cc1)[C@@H]1CCc2ccccc2N1C(=O)c1cc2cc([N+](=O)[O-])ccc2o1 524017677 OAYPBDZRVBEGJD-NRFANRHFSA-N 459.433 5.080 5 20 JKBD COc1ccc(N2C(=O)c3ccccc3N[C@@H]2c2cc(OC)c(OCC(F)F)cc2[N+](=O)[O-])cc1 602762635 WRKUOJKBQMCPHW-QHCPKHFHSA-N 485.443 5.027 5 20 JKBD COc1cc(C(=O)Nc2ncc(Cc3ccc(C)c(C)c3)s2)c([N+](=O)[O-])cc1OC(F)F 603762330 HQJKNELFGPGYSU-UHFFFAOYSA-N 463.462 5.121 5 20 JKBD Cc1nc(NC(=O)c2ccc([N+](=O)[O-])cc2F)sc1Cc1cccc(Br)c1 603975057 HQEJBJOHEVUSML-UHFFFAOYSA-N 450.289 5.104 5 20 JKBD CCC(CC)C(=O)N1CCC(NC(=O)c2ccc(Sc3ccc(C)cc3)c([N+](=O)[O-])c2)CC1 604180683 KXXDCBMEXDAMAL-UHFFFAOYSA-N 469.607 5.211 5 20 JKBD Cc1ccc(CN(CCc2ccccc2)C(=O)C2CCN(c3ccccc3[N+](=O)[O-])CC2)s1 604484832 MPMNLJONQUGXCS-UHFFFAOYSA-N 463.603 5.453 5 20 JKBD CN(C(=O)c1ccc(Nc2ccccc2)c([N+](=O)[O-])c1)[C@H](c1cccc(F)c1)c1cnn(C)c1 608799778 IFTWPIQTQBUAMR-XMMPIXPASA-N 459.481 5.073 5 20 JKBD O=C(c1c2c(nc3ccccc13)/C(=C/c1cccc([N+](=O)[O-])c1)CCC2)N1CC[C@H](N2CCCC2)C1 608905714 IDFWCFOCYKADRC-WTKRLXQWSA-N 482.584 5.330 5 20 JKBD COc1ccc(CCNC(=O)C/C(=C\c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)cc1F 609116405 KIWGADBJQVLHCJ-XMHGGMMESA-N 491.544 5.642 5 20 JKBD Cc1ccc2c(Cl)c(C(=O)Nc3ncc(S(=O)(=O)c4ccc([N+](=O)[O-])cc4)s3)sc2c1 609149385 OFUUJXQGMGXVMK-UHFFFAOYSA-N 493.975 5.313 5 20 JKBD Cc1ccc[n+](/C(C(=S)Nc2ccccc2-c2ccccc2)=C(/O)c2cccc([N+](=O)[O-])c2)c1 725764560 ZGFAJCLMEJXMJJ-UHFFFAOYSA-O 468.558 6.181 5 20 JKBD O=C(NC[C@H](c1ccc(Cl)cc1)N1CCc2sccc2C1)c1cc(F)c(F)cc1[N+](=O)[O-] 727708689 BNELVHHPDCDLKZ-HXUWFJFHSA-N 477.920 5.117 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)Nc2ccccc2SC[C@H]2CC2(Cl)Cl)cc1SC 728468746 KIOXJGGWDRHLEH-LLVKDONJSA-N 473.403 5.864 5 20 JKBD CCn1c(SCC(=O)O[C@@H](C)c2cccc([N+](=O)[O-])c2)nnc1-c1ccc(Cl)cc1Cl 729461276 IYBGXASEUPQPGO-LBPRGKRZSA-N 481.361 5.577 5 20 JKBD CCCOc1cc(NC(=O)c2c(C)nn(-c3ccccc3)c2Cl)c([N+](=O)[O-])cc1OCCC 790512618 UONOUWPLMYNFND-UHFFFAOYSA-N 472.929 5.572 5 20 JKBD Cc1cccc([N+](=O)[O-])c1NC(=O)COC(=O)Cc1c(C)nc2ccccc2c1-c1ccccc1 800369712 VFDIIAYIHAVREL-UHFFFAOYSA-N 469.497 5.151 5 20 JKBD Cc1nc(COc2ccc(C(=O)Nc3cc(Cl)c([N+](=O)[O-])cc3OCc3ccccc3)cc2)no1 822219349 BGPAKCLBTSKDIY-UHFFFAOYSA-N 494.891 5.350 5 20 JKBD Cc1nc(-c2ccc([C@H](C)NC(=O)c3cc([N+](=O)[O-])ccc3I)cc2)cs1 915294099 RJCMPRCTPBELPS-NSHDSACASA-N 493.326 5.122 5 20 JKBD O=C(Nc1cc(Cl)c([N+](=O)[O-])cc1OCc1ccccc1)c1sccc1Br 915827578 CKAVRUSOJNWAQJ-UHFFFAOYSA-N 467.728 5.904 5 20 JKBD CC1=C(C(=O)Nc2ccccc2C)[C@@H](c2ccc([N+](=O)[O-])cc2)NC(=O)N1Cc1ccccc1 916159206 NINIAGKBVRBUKK-XMMPIXPASA-N 456.502 5.082 5 20 JKBD Cc1csc(Sc2ccc(C(=O)OCc3nnc(-c4cc(C)oc4C)o3)cc2[N+](=O)[O-])n1 916507336 YCLLGEPEXDXWHQ-UHFFFAOYSA-N 472.504 5.128 5 20 JKBD C[C@H](OC(=O)CCc1ccc2ccccc2c1)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 919552744 BYYSBACCPGXKMV-AWEZNQCLSA-N 460.408 5.270 5 20 JKBD O=[N+]([O-])c1cc(-c2ccccc2)ccc1OCc1nnc(-c2ccc(Br)s2)o1 920307494 JOZAQMBELJNMHL-UHFFFAOYSA-N 458.293 5.715 5 20 JKBD Cc1ccc2[nH]c(C(=O)Nc3ccc(C4(NC(=O)c5cc(O)cc([N+](=O)[O-])c5)CCC4)cc3)cc2c1 1788964163 PGHIRXARNKYPQL-UHFFFAOYSA-N 484.512 5.152 5 20 JKBD O=C(CC[C@H]1CCOC1)NC1(c2ccc(NC(=O)c3cc4cc([N+](=O)[O-])ccc4s3)cc2)CCC1 1791010007 HGUANVPYZGMYNH-KRWDZBQOSA-N 493.585 5.374 5 20 JKBD O=C(Cc1cccc([N+](=O)[O-])c1)NC1(c2ccc(NC(=O)[C@@H]3C[C@@H]3c3ccccc3)cc2)CCC1 1791528295 YFXOAXAEVZPXNG-JWQCQUIFSA-N 469.541 5.075 5 20 JKBD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc(Cl)c1)c1cc2cc([N+](=O)[O-])ccc2s1 1799619437 FIRKUUCNSBMMOP-BCDXTJNWSA-N 469.950 5.029 5 20 JKBD CC(C)[C@@H](C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)/C=C/c1ccccc1[N+](=O)[O-])c1ccc(Cl)cc1 1804345209 YHIWHVHJHHXNOZ-CSDUMEFYSA-N 496.007 5.339 5 20 JKBD CC(C)[C@H](C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2ccc([N+](=O)[O-])o2)n[nH]1)c1ccc(Cl)cc1 1814307508 GFUUSNOAHPAHEY-GCJKJVERSA-N 499.955 5.310 5 20 JKBD C[C@H](CC(=O)Nc1cc([C@H]2CCCCN2C(=O)/C=C/c2ccccc2[N+](=O)[O-])[nH]n1)c1ccccc1 1822045330 SZCUOLHPYATVFV-NJENJEQFSA-N 487.560 5.217 5 20 JKBD O=C(/C=C/c1ccccc1[N+](=O)[O-])N1CCC([C@@H]2CCCCN2C(=O)c2cc3ccsc3[nH]2)CC1 1830888532 RZGWVINUBMUILF-UVIRAJKCSA-N 492.601 5.084 5 20 JKBD C[C@H](Sc1ncc(C(F)(F)F)cc1Cl)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 9160381 GXTRVMXRUKUXHO-ZETCQYMHSA-N 473.782 5.800 5 20 JKBD O=C(OCC(=O)N1CCC(C(=O)Nc2ccccc2)CC1)c1c2ccccc2cc2ccccc12 10941522 GNKAODDJJYTCNI-UHFFFAOYSA-N 466.537 5.027 5 20 JKBD Cc1ccc(NC(=O)[C@H](Sc2nnc(-c3ccccc3C)n2C)c2ccccc2)c([N+](=O)[O-])c1 21674583 JMGCBLZVITWZQB-JOCHJYFZSA-N 473.558 5.479 5 20 JKBD O=C(Nc1ccccc1C(=O)Nc1ccc(NC(=O)C2CC2)cc1)c1ccc([N+](=O)[O-])cc1Cl 25610395 MLKQCLCBYUGTOD-UHFFFAOYSA-N 478.892 5.101 5 20 JKBD CSc1ccc([N+](=O)[O-])c(C(=O)O[C@H](C)C(=O)Nc2ccccc2Cc2ccccc2)c1 28400847 GFUKDUCZOVUGOF-MRXNPFEDSA-N 450.516 5.092 5 20 JKBD COc1cc([N+](=O)[O-])ccc1NC(=O)CSc1ncnc2sc(-c3ccccc3)cc12 28416565 RUZVGACXZOXUBV-UHFFFAOYSA-N 452.517 5.006 5 20 JKBD Cc1ccc(Sc2ccc(C(=O)N3CCC(c4nnc5ccccn45)CC3)cc2[N+](=O)[O-])cc1 28734646 BUGMFPCGBNMUGZ-UHFFFAOYSA-N 473.558 5.117 5 20 JKBD COc1ccc(CSc2nnc(SCc3nc(-c4cccc([N+](=O)[O-])c4)no3)s2)cc1 31843915 XFEWSISOYABQAR-UHFFFAOYSA-N 473.561 5.090 5 20 JKBD C[C@H](Nc1ccc(C(=O)NCc2ccc(Oc3cccc(F)c3)nc2)cc1[N+](=O)[O-])c1ccccn1 68814934 TZUODFCVNDXHTF-KRWDZBQOSA-N 487.491 5.419 5 20 JKBD Cc1sc(NC(=O)c2ccc(-n3ccnc3)c([N+](=O)[O-])c2)nc1-c1ccc(OC(F)F)cc1 69908811 YHGBJVDJEZRPTE-UHFFFAOYSA-N 471.445 5.066 5 20 JKBD COc1ccc([N+](=O)[O-])cc1NC(=O)[C@H]1CCC(=O)N(c2ccc(C)cc2)[C@H]1c1cccs1 104798103 LZABILXCIFJYCL-FDDCHVKYSA-N 465.531 5.096 5 20 JKBD COc1cc(C(=O)Nc2ccc(CC(=O)NC(C)C)cc2)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 482341825 IATLPIMMHXVIHF-UHFFFAOYSA-N 497.935 5.369 5 20 JKBD Cc1ncc(NC(=O)c2c3c(nc4ccccc24)/C(=C/c2ccc([N+](=O)[O-])cc2)CCC3)cn1 484422849 DGAYRBMGCJCVBB-QGOAFFKASA-N 451.486 5.371 5 20 JKBD COc1cccc(CNC(=O)C/C(=C\c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)c1OC 498920354 ZBQOIHLIWYACKA-XMHGGMMESA-N 489.553 5.469 5 20 JKBD Cc1csc(Sc2ccc(C(=O)NCCc3nc4ccccc4s3)cc2[N+](=O)[O-])n1 500482012 CMJVTBBZLAYLEK-UHFFFAOYSA-N 456.574 5.093 5 20 JKBD C[C@@H](Nc1ccc(C(=O)Nc2cc(Cl)ccc2N2CCCCC2)cc1[N+](=O)[O-])c1ccccn1 506017032 MVHPZQHHAWOUAZ-QGZVFWFLSA-N 479.968 6.059 5 20 JKBD CCOc1cc(C(=O)Nc2ccc(Cl)cc2C(=O)N2[C@@H](C)CCC[C@H]2C)c([N+](=O)[O-])cc1OC 508283945 CZIDSOISJYJZHG-GASCZTMLSA-N 489.956 5.311 5 20 JKBD C[C@H](Nc1ccc(C(=O)Nc2ccccc2COc2ccccc2)cc1[N+](=O)[O-])c1ccccn1 509143438 ZDKGRYYUUSGUHO-IBGZPJMESA-N 468.513 5.994 5 20 JKBD COc1ccc(Oc2ccc([N+](=O)[O-])cc2C(=O)Nc2ccc(NC3CCOCC3)cc2)cc1 513072665 BMTSGVUDKPVOLI-UHFFFAOYSA-N 463.490 5.239 5 20 JKBD Cc1csc(Sc2ccc(C(=O)Nc3ccc(C(=O)NCC(F)(F)F)cc3)cc2[N+](=O)[O-])n1 514835058 AWQSANRZTBVFOM-UHFFFAOYSA-N 496.492 5.055 5 20 JKBD O=C(c1ccccc1)c1cc([N+](=O)[O-])ccc1NC(=O)C1CCN(c2ccc(C(F)(F)F)cn2)CC1 516487762 LZOXGRRAEXXWMV-UHFFFAOYSA-N 498.461 5.095 5 20 JKBD CCOc1cc([N+](=O)[O-])c(C(=O)Nc2cc(-c3cccc(C)c3)nn2Cc2ccccc2)cc1OC 603456644 CVQGGQBJAWECCQ-UHFFFAOYSA-N 486.528 5.475 5 20 JKBD CCN(CC(=O)Nc1c(F)cccc1F)C(=O)c1cc([N+](=O)[O-])ccc1Sc1ccccc1 603466747 ZOHVBDXWJQUWCE-UHFFFAOYSA-N 471.485 5.125 5 20 JKBD Cc1ccc(NC(=O)c2cccc(C(F)(F)F)c2)cc1NC(=O)Cc1ccccc1[N+](=O)[O-] 604449375 JNDGSWAKHFGTLD-UHFFFAOYSA-N 457.408 5.356 5 20 JKBD CC1CCN(c2ccc(C(=O)N3CCC[C@@H](c4nc(-c5cccc(F)c5)no4)C3)cc2[N+](=O)[O-])CC1 608817306 MVZQYZHMFYKKNH-HXUWFJFHSA-N 493.539 5.040 5 20 JKBD Cc1ccc(Sc2ccc(C(=O)NC3CCN(C(=O)c4ccc(C)cc4)CC3)cc2[N+](=O)[O-])cc1 608964189 NIFXSULHDZOGHI-UHFFFAOYSA-N 489.597 5.397 5 20 JKBD O=C(Nc1nc2c(s1)C(=O)CCC2)c1ccc(NCc2ccccc2Cl)c([N+](=O)[O-])c1 609021312 MXBYBLDLOQGJIV-UHFFFAOYSA-N 456.911 5.088 5 20 JKBD O=C(c1c2c(nc3ccccc13)/C(=C/c1cccc([N+](=O)[O-])c1)CCC2)N1CCC[C@@H](n2ccnc2)C1 609131128 ICDZXWZNHYBJOT-BTZCDPCDSA-N 493.567 5.694 5 20 JKBD O=C(N[C@@H](c1ccccc1)c1cc2ccccc2o1)C1CCN(c2ccccc2[N+](=O)[O-])CC1 619110832 TUGVZRUZTXCEAF-SANMLTNESA-N 455.514 5.463 5 20 JKBD COc1ccc(NC(=S)/C(=C(/O)c2cccc([N+](=O)[O-])c2)[n+]2ccc(C(C)(C)C)cc2)cc1F 726576415 RZHOTSBOWNKOSC-UHFFFAOYSA-O 482.557 5.651 5 20 JKBD CCC(CC)c1cc[n+](/C(C(=S)N[C@H](C)c2cccs2)=C(/O)c2ccc([N+](=O)[O-])cc2)cc1 726578568 FXLGUTNAHGQLAA-QGZVFWFLSA-O 482.651 6.409 5 20 JKBD O=C(NCc1ccccc1-c1ccc(Cn2ccnc2)cc1)c1cc([N+](=O)[O-])ccc1N1CCCC1 728882657 DKJPUYFDJLIPCB-UHFFFAOYSA-N 481.556 5.037 5 20 JKBD C[C@H](NC(=O)CC1(CC(=O)N[C@H](C)c2cccc([N+](=O)[O-])c2)CCCCC1)c1cccc([N+](=O)[O-])c1 729823989 CMXNKNHFMRTLDG-KDURUIRLSA-N 496.564 5.288 5 20 JKBD CC(=O)N(c1ccc(C)c(C)c1)c1nc(/C=C2/N=C(c3ccc([N+](=O)[O-])c(C)c3)OC2=O)cs1 812447892 OGPGHSCPEQURTM-RGVLZGJSSA-N 476.514 5.006 5 20 JKBD Cc1cc(C(=O)N2CCC[C@@H]2c2nc(-c3ccsc3C(F)(F)F)no2)ccc1[N+](=O)[O-] 904924397 RJABFINIKSUKFH-CQSZACIVSA-N 452.414 5.011 5 20 JKBD CC(C)[C@H](OC(=O)c1ccc(Br)c([N+](=O)[O-])c1)C(=O)Nc1ccccc1C(F)(F)F 915365814 IBMCUISEXQXDJE-INIZCTEOSA-N 489.244 5.196 5 20 JKBD O=C(O[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1)[C@H]1CCC[C@H](C(F)(F)F)C1 917286056 RWNDVEZRIVSEHX-DOXZYTNZSA-N 484.858 5.840 5 20 JKBD C[C@@H](NC(=O)c1ccc(Br)c([N+](=O)[O-])c1)c1ccc(NC(=O)c2ccc(F)cc2)cc1 917841274 KVHRBFXFVWATTR-CYBMUJFWSA-N 486.297 5.240 5 20 JKBD COC(=O)Nc1ccc(N[C@@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Br)c2ccccc2)cc1 917939001 SXCXBZHYOOBKCT-HXUWFJFHSA-N 499.321 5.328 5 20 JKBD COc1ccc(COC(=O)c2sc(NC(=O)c3ccccc3Cl)cc2C)cc1[N+](=O)[O-] 919163736 KNACRDSZXVSUTJ-UHFFFAOYSA-N 460.895 5.236 5 20 JKBD O=C(OCC(=O)N(Cc1ccc(F)cc1)c1nc(-c2ccccc2)cs1)c1csc([N+](=O)[O-])c1 919371926 TZTHRYXSHKTDAC-UHFFFAOYSA-N 497.529 5.309 5 20 JKBD Cc1cc(NC(=O)c2ccc(Br)c([N+](=O)[O-])c2)n(-c2ccccc2C(F)(F)F)n1 920974143 YSBKTGCZHFEGIH-UHFFFAOYSA-N 469.217 5.123 5 20 JKBD O=C(CCc1cccc([N+](=O)[O-])c1)Nc1ccc(C2(NC(=O)[C@H]3CCc4ccoc4C3)CCC2)cc1 1786598941 ICMVGGPSGSPYAR-NRFANRHFSA-N 487.556 5.060 5 20 JKBD O=C(/C=C/c1cccnc1)Nc1ccc(C2(NC(=O)c3cc4cc([N+](=O)[O-])ccc4s3)CCC2)cc1 1786927231 MLQSXXDNKBZRNJ-NYYWCZLTSA-N 498.564 5.666 5 20 JKBD O=C(CCCCn1cccc1)Nc1ccc(C2(NC(=O)c3cc(F)cc([N+](=O)[O-])c3)CCC2)cc1 1789603857 KWOCCXUKIOSIBH-UHFFFAOYSA-N 478.524 5.154 5 20 JKBD C/C(=C\c1ccc(C)o1)C(=O)NC1(c2ccc(NC(=O)c3cc(O)cc([N+](=O)[O-])c3)cc2)CCC1 1790756229 UXIDWVNJORHTQF-FOWTUZBSSA-N 475.501 5.053 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)c3ccc([N+](=O)[O-])o3)CCC2)cc1)c1cnc2ccc(Cl)cc2c1 1790867980 RUCLQKNYJNNIIM-UHFFFAOYSA-N 490.903 5.451 5 20 JKBD COc1cc(C(=O)Nc2ccc(C3(NC(=O)c4cscc4C)CCC3)cc2)ccc1[N+](=O)[O-] 1792164438 DUIDUULAVHUMPF-UHFFFAOYSA-N 465.531 5.035 5 20 JKBD O=C(CCc1cccc([N+](=O)[O-])c1)N1CCC([C@H]2CCCCN2C(=O)c2cc3ccccc3o2)CC1 1828186267 ASOMNGGZBQQBAM-XMMPIXPASA-N 489.572 5.207 5 20 JKBD Cc1c(Cl)cccc1C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2ccc([N+](=O)[O-])cc2F)CC1 1830492433 GDAAIXQQFOZLLT-QHCPKHFHSA-N 487.959 5.243 5 20 JKBD CCCCC[C@@H](C)C(=O)N1CCC([C@@H]2CCCCN2C(=O)CSc2ccccc2[N+](=O)[O-])CC1 1831777905 XTPWPXYHZKWFNJ-IRLDBZIGSA-N 489.682 5.523 5 20 JKBD COc1cc(CSc2nnc(-c3ccncc3)n2-c2ccccc2C)c([N+](=O)[O-])cc1OC(F)F 10395725 SXUNJEAHPVCHSB-UHFFFAOYSA-N 499.499 5.448 5 20 JKBD CC1CCN(c2ccc(C(=O)N(Cc3nnc(-c4ccccc4Cl)o3)C(C)C)cc2[N+](=O)[O-])CC1 16011399 YLRPDSBDHOIVML-UHFFFAOYSA-N 497.983 5.585 5 20 JKBD COc1ccccc1CCC(=O)O[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1 20891225 QHQAYEDFAAVEEO-QHCPKHFHSA-N 468.893 5.113 5 20 JKBD CCn1c(SCC(=O)Nc2ccc([N+](=O)[O-])cc2Cl)nnc1-c1ccc(C(C)(C)C)cc1 21123327 KMLBJDRUCICWNJ-UHFFFAOYSA-N 473.986 5.555 5 20 JKBD Cc1c(NC(=O)[C@@H](C)Sc2nnc(-c3ccccc3)n2-c2ccc(F)cc2)cccc1[N+](=O)[O-] 23209079 GAFAHDWZBJJTAQ-MRXNPFEDSA-N 477.521 5.409 5 20 JKBD CSc1ccc([N+](=O)[O-])c(C(=O)N[C@H](c2ccccc2)c2ccc3nc(C(F)(F)F)[nH]c3c2)c1 26130231 RVIJMXCTMMVYBA-HXUWFJFHSA-N 486.475 5.731 5 20 JKBD C[C@@H](NC(=O)c1ccc(NCc2ccccc2)c([N+](=O)[O-])c1)c1ccc(NC(=O)C2CC2)cc1 30395712 GNMOELSEQOEMAP-QGZVFWFLSA-N 458.518 5.046 5 20 JKBD COc1cc(C(=O)N[C@H](c2ccc(Cl)cc2)c2cccs2)c([N+](=O)[O-])cc1OC(F)F 117302249 GDGZDYDVFVAZPF-GOSISDBHSA-N 468.865 5.439 5 20 JKBD C[C@@H](NC(=O)Cn1c2ccccc2c(=O)c2ccccc21)c1ccc(OCc2ccc(F)cc2)cc1 485625219 XRDLZLBBECIRMS-HXUWFJFHSA-N 480.539 5.750 5 20 JKBD COc1ccc(-c2nnc(SCC(=O)c3ccc([N+](=O)[O-])cc3)n2CCc2ccccc2)cc1 500474040 BMNBFGRHSOFMAU-UHFFFAOYSA-N 474.542 5.080 5 20 JKBD CCOc1cc([N+](=O)[O-])c(C(=O)N(C)[C@H]2CCSc3ccc(Br)cc32)cc1OC 504623283 XQFQRDUNSAKKOW-HNNXBMFYSA-N 481.368 5.074 5 20 JKBD CCN(Cc1c(F)cccc1F)C(=O)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 505893181 MSBQJHFIFKDTGS-UHFFFAOYSA-N 471.426 5.157 5 20 JKBD C[C@H](Nc1ccc(C(=O)Nc2ccc(C(=O)NC3CCCC3)cc2)cc1[N+](=O)[O-])c1ccccn1 507402598 LRKRFJDMPKFNKK-KRWDZBQOSA-N 473.533 5.088 5 20 JKBD COc1cc(C(=O)Nc2nc(-c3ccc(C)c(C)c3)cs2)c([N+](=O)[O-])cc1OCc1cscn1 511646050 GFKMOXBNPUYNRS-UHFFFAOYSA-N 496.570 5.632 5 20 JKBD O=C(c1ccccc1)c1ccc(Sc2nnc(-c3cccnc3)n2Cc2ccco2)c([N+](=O)[O-])c1 515164746 VCTUMFCZAAKBJG-UHFFFAOYSA-N 483.509 5.272 5 20 JKBD COc1cc([C@@H]2Nc3ccccc3C(=O)N2c2ccc(F)cc2Cl)c([N+](=O)[O-])cc1OC 515591750 VSSRFZDJGSXJER-OAQYLSRUSA-N 457.845 5.176 5 20 JKBD CCCN1CCC(N(C)C(=O)C/C(=C\c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)CC1 518807410 NCCKRXLREKALGQ-LVZFUZTISA-N 478.618 5.468 5 20 JKBD CC(C)c1nc2ccc(N[C@H](C)C(=O)Nc3ccc([N+](=O)[O-])cc3C(F)(F)F)cc2s1 519165494 DKQMVTSMZRUTRW-LLVKDONJSA-N 452.458 5.786 5 20 JKBD Cc1nc(-c2ccc(F)cc2)sc1[C@@H](C)N[C@@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl 520634574 UIPWFJXACZIXJF-YPMHNXCESA-N 462.934 5.497 5 20 JKBD CCOc1cc(C(=O)Nc2cc(CC(C)(C)C)nn2-c2ccccc2)c([N+](=O)[O-])cc1OC 522207078 XCKNJTUBBBVEOG-UHFFFAOYSA-N 452.511 5.029 5 20 JKBD C[C@@H]1CCCN(c2ccc(C(=O)N3CCC[C@H](c4nc(-c5cccc(F)c5)no4)C3)cc2[N+](=O)[O-])C1 522577644 VICCWUUKRIIVPI-XLIONFOSSA-N 493.539 5.040 5 20 JKBD COc1cc(C(=O)Nc2ccc3nc(C)cn3c2)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 523009505 SHVVXRTUBKVWRO-UHFFFAOYSA-N 452.854 5.258 5 20 JKBD CN(Cc1nccn1CC(F)(F)F)C(=O)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1 524333627 KCTUJYYSYBHUJJ-UHFFFAOYSA-N 468.819 5.072 5 20 JKBD O=C(C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)Nc1cccc(C(=O)O)c1 554502144 ROSXATOHKZDDBX-SFQUDFHCSA-N 459.483 5.472 5 20 JKBD CN(C)[C@H](CNC(=O)C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)c1ccccc1 603454111 WNNXURFUAADYAJ-OFVJEAJMSA-N 486.597 5.554 5 20 JKBD C[C@H](c1ccccc1)n1c(SCC(=O)Nc2ccc([N+](=O)[O-])cc2Cl)nnc1-c1ccccc1 603917226 GQASZDMJXWUQJG-MRXNPFEDSA-N 493.976 5.847 5 20 JKBD O=C(CCOc1ccccc1[N+](=O)[O-])Nc1ccc(NC(=O)c2ccc(F)cc2)cc1C(F)(F)F 603961134 HLTQVTJVLHHMOT-UHFFFAOYSA-N 491.397 5.413 5 20 JKBD CC(C)(C)c1ccc(Oc2ccc(CN[C@H]3CCCc4c3cnn4CCO)cc2[N+](=O)[O-])cc1 608782027 HDNBDBBOVXPALJ-QFIPXVFZSA-N 464.566 5.041 5 20 JKBD CC(C)(C(=O)Nc1ccc(Oc2ccnc3cc(Cl)ccc23)c(F)c1)n1cc([N+](=O)[O-])cn1 609066211 MPRJJIGMAWMRND-UHFFFAOYSA-N 469.860 5.298 5 20 JKBD COc1cc(/C=C\C(=O)Nc2ccc([N+](=O)[O-])c(Cl)c2)ccc1OCc1c(C)noc1C 727712423 WXZADSBGCUOAIG-UITAMQMPSA-N 457.870 5.093 5 20 JKBD O=C(Nc1nc(C2CC2)c(Cc2cccc(C(F)(F)F)c2)s1)c1cc(F)c(F)cc1[N+](=O)[O-] 727712667 IVBRMSWFCWFIQT-UHFFFAOYSA-N 483.418 6.069 5 20 JKBD O=C(CSc1ccc(C(F)(F)F)cc1[N+](=O)[O-])Nc1ccc(OCc2cccnc2)cc1 728496945 GWCUXQVTOZVMFA-UHFFFAOYSA-N 463.437 5.318 5 20 JKBD C[C@@H](OC(=O)c1c[nH]c2ccc([N+](=O)[O-])cc12)C(=O)N1c2ccccc2Sc2ccccc21 749315596 BKZYKCNFGDPDTC-CQSZACIVSA-N 459.483 5.451 5 20 JKBD Cc1nc(CN(C(=O)c2cc([N+](=O)[O-])ccc2Br)c2ccc(F)cc2)cs1 751089625 NBXIHGIYDFLLBV-UHFFFAOYSA-N 450.289 5.108 5 20 JKBD Cc1ccc(/C(O)=C(/C(=S)NCc2cccs2)[n+]2ccc(C(C)(C)C)cc2)cc1[N+](=O)[O-] 839413454 NGGMCUGPYOAIOA-UHFFFAOYSA-O 468.624 5.551 5 20 JKBD O=[N+]([O-])c1cc(S(=O)(=O)N(Cc2ncc(-c3ccccc3)o2)c2ccccc2)ccc1Cl 849356408 SYORDIYSVUBVHN-UHFFFAOYSA-N 469.906 5.299 5 20 JKBD C[C@H](Nc1ccc(-c2nc(-c3ccc(Br)cn3)no2)cc1[N+](=O)[O-])c1ccccn1 904848016 FSLRERKSKUWROD-LBPRGKRZSA-N 467.283 5.037 5 20 JKBD COc1cc(CNC(=O)c2ccccc2NC(=O)c2ccc([N+](=O)[O-])cc2Cl)ccc1OC(C)C 914848917 OTAFGVMVRDIICF-UHFFFAOYSA-N 497.935 5.226 5 20 JKBD CC(C)N(Cc1nnc(-c2cccc([N+](=O)[O-])c2)o1)C(=O)CCCc1ncc(-c2ccccc2)o1 915276509 WCLOFWBVJDFIHG-UHFFFAOYSA-N 475.505 5.060 5 20 JKBD O=C(Nc1ccc(Cl)c([N+](=O)[O-])c1)C(=O)N[C@@H](CCCc1ccccc1)c1ccccc1 915744652 LWZMRKYFOQYIJS-NRFANRHFSA-N 451.910 5.067 5 20 JKBD CC1=C(C(=O)Nc2cccc(C)c2C)[C@@H](c2ccc([N+](=O)[O-])cc2)NC(=S)N1c1ccccc1 916162397 OQBXAMCPBUCEGC-XMMPIXPASA-N 472.570 5.560 5 20 JKBD COC(=O)Nc1cccc(NC(=O)c2ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])c(OC)c2)c1 917706066 WGRQGRCELXKQON-UHFFFAOYSA-N 471.853 5.480 5 20 JKBD CCOc1cc([N+](=O)[O-])c(C(=O)Nc2nc(Cc3ccc(Br)cc3)cs2)cc1OC 917715106 ZTPNAOWGGWOTPH-UHFFFAOYSA-N 492.351 5.064 5 20 JKBD Cc1nn(Cc2ccc(C(=O)Nc3nc(-c4cccc([N+](=O)[O-])c4)c(C)s3)cc2)c(C)c1[N+](=O)[O-] 917792138 WPVXDERGTIEFJV-UHFFFAOYSA-N 492.517 5.049 5 20 JKBD CSc1ccc([N+](=O)[O-])c(C(=O)OCc2csc(N(C(C)=O)c3ccc(Cl)cc3)n2)c1 918921140 LQPNYUMXNXOZHZ-UHFFFAOYSA-N 477.951 5.468 5 20 JKBD Cc1oc(-c2ccccc2)nc1COC(=O)c1ccc(N[C@H](C)c2ccccn2)c([N+](=O)[O-])c1 920546635 LTDCKIDOMLGPBJ-MRXNPFEDSA-N 458.474 5.483 5 20 JKBD O=C(Nc1cc(Cl)c([N+](=O)[O-])cc1OCc1ccccc1)c1ccc(CN2CCCC2=O)cc1 921190753 FPLPTSSPKFGIKN-UHFFFAOYSA-N 479.920 5.202 5 20 JKBD Cc1ccc(C(=O)N2CCCC[C@H]2C2CCN(C(=O)c3cc4cc([N+](=O)[O-])ccc4s3)CC2)nc1 1826073000 IDLOMNSTAWQYOE-QFIPXVFZSA-N 492.601 5.060 5 20 JKBD O=C(C[C@H]1CCCCO1)N1CCC([C@@H]2CCCCN2C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)CC1 1831059034 BCGDUKPUYPHHKK-YADHBBJMSA-N 499.633 5.002 5 20 JKBD Cc1ccc(C(=O)O[C@@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Br)c2ccccc2)s1 10647521 JTYKHCGPPNIHKR-GOSISDBHSA-N 475.320 5.264 5 20 JKBD COc1cc2c(cc1NC(=O)c1cc(OC)c(OC(F)F)cc1[N+](=O)[O-])oc1ccccc12 10958297 WBSWSWACDLAKOQ-UHFFFAOYSA-N 458.373 5.365 5 20 JKBD Cc1ccc(NC(=O)[C@@H](OC(=O)CCc2ncc(-c3ccccc3)o2)c2ccccc2)c([N+](=O)[O-])c1 11942423 ZGIBUMNWDXHVBI-SANMLTNESA-N 485.496 5.414 5 20 JKBD O=C1c2ccccc2N[C@@H](c2ccc(-c3ccc([N+](=O)[O-])cc3Br)o2)N1C[C@H]1CCCO1 15503672 HFIAFUHIUQWFMA-IVZQSRNASA-N 498.333 5.363 5 20 JKBD COc1ccc(C)cc1CCN[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1 15506767 CRQYABXDIBFILG-HSZRJFAPSA-N 453.926 5.077 5 20 JKBD C[C@@H](OC(=O)c1c(-n2cccc2)sc2c1CCSC2)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl 16412731 PLNYNBDJRZVOPH-GFCCVEGCSA-N 491.978 5.074 5 20 JKBD C[C@@H](Sc1nnc(COc2ccccc2F)n1-c1ccccc1)C(=O)Nc1cccc([N+](=O)[O-])c1 23591471 UQSSQHJEPXDUII-MRXNPFEDSA-N 493.520 5.013 5 20 JKBD C[C@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccc(Br)cc1Br 24048922 FEFIICKNZWHLHZ-VIFPVBQESA-N 460.147 5.239 5 20 JKBD COCCn1c(S[C@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)nc2cc(Cl)ccc21 57853077 IUBAAOVGMSDFLJ-GFCCVEGCSA-N 459.915 5.148 5 20 JKBD Cc1ccc(-c2noc(CCCN3CCN(C(=O)c4cc5ccccc5c5cccnc45)CC3)n2)cc1 97489850 MPFJYWMIECTPGF-UHFFFAOYSA-N 491.595 5.137 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)NCc2ccc(-n3nc(C)cc3C)cc2C(F)(F)F)cc1SC 97547480 XDCGEKRRSUUCRX-UHFFFAOYSA-N 494.495 5.077 5 20 JKBD O=C(CSc1nnc(-c2cccs2)n1Cc1ccccc1)Nc1ccc(Cl)cc1[N+](=O)[O-] 97601242 CQAKQHPXHXOETF-UHFFFAOYSA-N 485.978 5.347 5 20 JKBD O=C(C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1)N1CCCc2c(F)cc(F)cc21 106217769 IKZCLPNDYJIPGE-UHFFFAOYSA-N 469.410 5.088 5 20 JKBD O=C(N[C@H](c1ccccc1)c1cc2ccccc2o1)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-] 478150425 VPPHMGCTOJSULW-JOCHJYFZSA-N 470.403 5.802 5 20 JKBD Cc1ccc(NC(=O)C(C)C)cc1NC(=O)CSc1ccc(C(F)(F)F)cc1[N+](=O)[O-] 479302124 JHLJFYUTVRRFMM-UHFFFAOYSA-N 455.458 5.247 5 20 JKBD Cc1sc(NC(=O)c2cnc(-c3ccc4c(c3)OCO4)s2)nc1-c1cccc([N+](=O)[O-])c1 483375274 IWFZPBHMYSSGKO-UHFFFAOYSA-N 466.500 5.131 5 20 JKBD O=C(Nc1nnc(SCc2ccc(Cl)cc2)s1)c1csc(-c2cccc([N+](=O)[O-])c2)n1 496445899 DFFVGQIFAOGARY-UHFFFAOYSA-N 489.991 5.768 5 20 JKBD CC(C)N(C)C(=O)c1ccc(Cl)c(NC(=O)c2csc(-c3ccc([N+](=O)[O-])cc3)n2)c1 509282346 CJIPSNYCBTZULY-UHFFFAOYSA-N 458.927 5.104 5 20 JKBD Cn1ccnc1[C@@H](NCc1ccc(Oc2ccccc2Cl)c([N+](=O)[O-])c1)c1cccc(F)c1 509598595 BYAPMKLLLODOAO-QHCPKHFHSA-N 466.900 5.792 5 20 JKBD O=C(CSc1ccc(C(F)(F)F)cc1[N+](=O)[O-])Nc1cc(Cl)ccc1OC[C@@H]1CCCO1 509803016 HFHUYQVMDQKUPK-AWEZNQCLSA-N 490.887 5.556 5 20 JKBD C[C@H]1CCCCN1C(=O)c1ccc(NC(=O)c2cc(OCC(F)(F)F)ccc2[N+](=O)[O-])cc1Cl 515442121 IBQJNHXMSQZMTD-ZDUSSCGKSA-N 499.873 5.456 5 20 JKBD Cc1ccc(Sc2ccc(CNCc3ccc(CS(=O)(=O)NC(C)C)cc3)cc2[N+](=O)[O-])cc1 517547376 PXQQRWFZNNAXOE-UHFFFAOYSA-N 499.658 5.172 5 20 JKBD Cc1ccc(NC(=O)c2ccc(N3C[C@@H](C)C[C@H](C)C3)c([N+](=O)[O-])c2)cc1NC(=O)c1ccncc1 521393143 WFDSHQORPCFHKO-ROUUACIJSA-N 487.560 5.285 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1F)[C@@H]1C[C@H]2CCCC[C@@H]2N1C(=O)c1ccc2ccccc2c1 524164149 NSJDMPFDFGVZAQ-DKLXNKCPSA-N 461.493 5.299 5 20 JKBD CNC(=O)c1cccc(NC(=O)c2cc([N+](=O)[O-])ccc2Sc2ccc(Cl)cc2)c1C 603624408 NCCDSFVRLMCCPQ-UHFFFAOYSA-N 455.923 5.320 5 20 JKBD CC(C)Oc1ccccc1[C@@H](C)NC(=O)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 603906123 TZXZYKSAPOAFQX-MRXNPFEDSA-N 479.499 5.495 5 20 JKBD C[C@@H](Nc1ccccc1COCc1ccccc1)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 603954650 ASPGNFZATGHKRF-MRXNPFEDSA-N 473.451 5.770 5 20 JKBD O=C(CSc1nnc(-c2ccc3ccccc3c2)o1)Nc1cc([N+](=O)[O-])ccc1OC(F)F 603961514 ZQJYUXKRZYOJKN-UHFFFAOYSA-N 472.429 5.130 5 20 JKBD C[C@@H](N[C@H](C)c1ccc(NC(=O)c2ccc(F)cc2)cc1)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl 604047833 WVOOXLBYAVXPHS-HUUCEWRRSA-N 484.915 5.317 5 20 JKBD Cc1csc(Sc2ccc(C(=O)N3CCC[C@@H]3c3nc4ccccc4n3C)cc2[N+](=O)[O-])n1 604481220 QRVPVKOAFUDPRF-GOSISDBHSA-N 479.587 5.375 5 20 JKBD CCOC(=O)C[C@@H](c1ccccc1)C1CCN(C(=O)c2csc(-c3cccc([N+](=O)[O-])c3)n2)CC1 604519560 WLYWXLJGJZRZND-QFIPXVFZSA-N 493.585 5.308 5 20 JKBD CC(=O)Nc1ccc(C)cc1NC(=O)c1ccc(NCc2ccccc2Cl)c([N+](=O)[O-])c1 609022941 VEMRPVQINRKWFI-UHFFFAOYSA-N 452.898 5.379 5 20 JKBD COc1ccccc1[C@H](NC(=O)c1ccc(N[C@@H](C)c2ccccn2)c([N+](=O)[O-])c1)c1ccccc1 609373908 AGZQFZTYFWXCDP-UZTOHYMASA-N 482.540 5.691 5 20 JKBD C[C@@H]1C[C@@H](C)CN(c2ccc(C(=O)O[C@H](C)c3nnc(-c4cccs4)o3)cc2[N+](=O)[O-])C1 745930535 OPBFYERZOZFJKX-RBSFLKMASA-N 456.524 5.107 5 20 JKBD CC(C)[C@@H](OC(=O)c1csc(-c2cccc([N+](=O)[O-])c2)n1)C(=O)Nc1cccc2ncccc12 747960753 BGBDTQSXAGUDCZ-OAQYLSRUSA-N 476.514 5.087 5 20 JKBD O=C(NO[C@H]1CCCCO1)c1c2c(nc3ccccc13)/C(=C\c1ccc([N+](=O)[O-])cc1)CCC2 749620673 WAJLHIRWJCPHJI-BZNBOCDVSA-N 459.502 5.208 5 20 JKBD CC(C)c1cccc(C(C)C)c1NC(=O)COC(=O)c1cc([N+](=O)[O-])ccc1N1CCCCC1 823229672 BVRQKTOJWLCTEM-UHFFFAOYSA-N 467.566 5.627 5 20 JKBD C[C@H](OC(=O)c1ccc(-n2ccnc2)c([N+](=O)[O-])c1)C(=O)N1c2ccccc2Sc2ccccc21 855086507 YRFNTXLXSUQIIW-INIZCTEOSA-N 486.509 5.155 5 20 JKBD Cc1ccc(C)c(NC(=O)[C@H](OC(=O)CCOc2cc(C)ccc2[N+](=O)[O-])c2ccccc2)c1 915442276 HYBYFLMUFDJETQ-RUZDIDTESA-N 462.502 5.212 5 20 JKBD CN(CCN(C)C(=O)c1cc2ccccc2c2cccnc12)C(=O)c1cc2ccccc2c2cccnc12 917337500 UHUODGPALLEJOC-UHFFFAOYSA-N 498.586 5.934 5 20 JKBD O=C(O[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1)c1cc(-c2cccc(F)c2)no1 919189413 BENJJKJIFLEKNW-JOCHJYFZSA-N 495.850 5.579 5 20 JKBD COc1ccc(NC(=O)[C@@H](OC(=O)c2cc([N+](=O)[O-])c(C)c([N+](=O)[O-])c2)c2ccccc2)cc1Cl 919228139 DRISPAXOHRMSGA-NRFANRHFSA-N 499.863 5.010 5 20 JKBD Cc1cc(C(=O)O[C@H](C)C(=O)Nc2cc([N+](=O)[O-])ccc2Cl)c2ccc(Br)cc2n1 919522303 DENRUJVUOODRTK-LLVKDONJSA-N 492.713 5.051 5 20 JKBD CC1CCN(c2ccc([N+](=O)[O-])cc2C(=O)N(C)c2ccc(Br)cc2F)CC1 920008168 BYAZLVFXAJWASR-UHFFFAOYSA-N 450.308 5.009 5 20 JKBD O=C(COC(=O)c1cccnc1Oc1ccc(Cl)cc1Cl)Nc1ccc([N+](=O)[O-])cc1Cl 920911813 FQSFJJXRWQOXRQ-UHFFFAOYSA-N 496.690 5.538 5 20 JKBD COc1ccc(CC(=O)NC2(c3ccc(NC(=O)c4cc5ccccc5o4)cc3)CCC2)c([N+](=O)[O-])c1 1789004640 OOOHPUZPALODFO-UHFFFAOYSA-N 499.523 5.340 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)[C@]3(F)CCCC=C3F)CCC2)cc1)c1cc([N+](=O)[O-])cc2c1OCC2 1790045490 RTMZDOPFYLJGLM-SANMLTNESA-N 497.498 5.023 5 20 JKBD O=C(Cc1c[nH]c2ccccc12)Nc1ccc(C2(NC(=O)c3cccc(F)c3[N+](=O)[O-])CCC2)cc1 1790396466 DIXUNYIEOKOFJT-UHFFFAOYSA-N 486.503 5.206 5 20 JKBD Cc1nc(C)c(C(=O)NC2(c3ccc(NC(=O)c4c(F)ccc([N+](=O)[O-])c4C)cc3)CCC2)s1 1790770552 IAHLIIPNGXBYMV-UHFFFAOYSA-N 482.537 5.177 5 20 JKBD COc1cc(C(=O)NC2(c3ccc(NC(=O)c4cc5ccsc5[nH]4)cc3)CCC2)ccc1[N+](=O)[O-] 1790876307 ISLZWHBCCPJOLF-UHFFFAOYSA-N 490.541 5.208 5 20 JKBD Cc1cc(Cl)ccc1C(=O)N1CCCC[C@H]1C1CCN(C(=O)Cc2cccc([N+](=O)[O-])c2)CC1 1823908336 UEMBRUSACQPSPS-DEOSSOPVSA-N 483.996 5.033 5 20 JKBD O=C(c1ccc([N+](=O)[O-])cc1F)N1CCC([C@@H]2CCCCN2C(=O)c2cccc3ccccc23)CC1 1828010044 WEFSMMISIKJTQR-SANMLTNESA-N 489.547 5.434 5 20 JKBD O=C(c1ccc(Cl)c(F)c1)N1CCC([C@H]2CCCCN2C(=O)c2ccc([N+](=O)[O-])cc2F)CC1 1830499080 NEXMJNRFYFIAHF-JOCHJYFZSA-N 491.922 5.074 5 20 JKBD Cc1ccc(-n2ccnc2SCC(=O)Nc2ccc([N+](=O)[O-])cc2C(F)(F)F)c(C)c1 11424423 NLKDWRMHKDVGBD-UHFFFAOYSA-N 450.442 5.147 5 20 JKBD O=C(OCC(=O)N(Cc1ccccc1)c1nc(-c2ccc(F)cc2)cs1)c1cccc([N+](=O)[O-])c1 14857920 ZHLQOAQJPJCJOG-UHFFFAOYSA-N 491.500 5.248 5 20 JKBD COc1ccc(OC)c([C@@H]2CCCN2C(=O)CSc2ccc(C(F)(F)F)cc2[N+](=O)[O-])c1 15827906 LXUJTDHCPSZKHE-INIZCTEOSA-N 470.469 5.087 5 20 JKBD O=C(COC(=O)C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)NC1CCCCC1 18494023 KEDOBDGRIOTOEK-JXAWBTAJSA-N 479.558 5.127 5 20 JKBD O=C(CCc1ccc(Cl)cc1)Oc1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2Cl)cc1 24692959 TZLOJPXPAAUANH-UHFFFAOYSA-N 459.285 5.692 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Cl)[C@H](NCc1ccc(Br)s1)c1ccccc1 28373969 BLCFGXZGEUFNNV-GOSISDBHSA-N 480.771 5.542 5 20 JKBD C[C@@H](NC(=O)c1csc(-c2cccc([N+](=O)[O-])c2)n1)c1cccc(NC(=O)c2ccccc2)c1 303018581 LDGWKCYMSVQUGJ-MRXNPFEDSA-N 472.526 5.462 5 20 JKBD C[C@H](Nc1ccc(C(=O)N[C@@H](CC(F)(F)F)c2ccccc2)cc1[N+](=O)[O-])c1ccccn1 409893501 WDVCWHOTNWFPKQ-YWZLYKJASA-N 458.440 5.586 5 20 JKBD CCOc1cc(NC(=O)c2occc2CN2c3ccccc3C[C@@H]2C)c([N+](=O)[O-])cc1OCC 481932106 PFWJJLLQGDDXPF-INIZCTEOSA-N 465.506 5.189 5 20 JKBD O=C(Cn1c2ccccc2c(=O)c2ccccc21)Nc1ccc(F)cc1-c1ccc(Cl)cc1 485662700 XWZXDGCODXKSQN-UHFFFAOYSA-N 456.904 6.253 5 20 JKBD O=C(Nc1ccccc1C(=O)N1CCC[C@H](CN2CCCCCC2)C1)c1ccc([N+](=O)[O-])cc1Cl 487808551 NWPPYYGEVWPHLA-LJQANCHMSA-N 499.011 5.229 5 20 JKBD COc1cc(C(=O)N(Cc2cc(Br)ccc2F)C(C)C)c([N+](=O)[O-])cc1OC(F)F 499944433 LKWHFRVEYBSGEO-UHFFFAOYSA-N 491.260 5.157 5 20 JKBD Cn1cc(C(=O)Nc2nnc(SCc3ccc(Cl)cc3)s2)c(-c2ccc([N+](=O)[O-])cc2)n1 506218962 KMHFAJXTYJPZEQ-UHFFFAOYSA-N 486.966 5.045 5 20 JKBD CC(=O)N(c1ccc(Cl)cc1)c1nc(/C=C/c2ccc3cccc([N+](=O)[O-])c3n2)cs1 510636253 AAMNAOCWVKTDNV-MDZDMXLPSA-N 450.907 6.108 5 20 JKBD O=C(c1cc([N+](=O)[O-])ccc1NCc1ccccc1)N1CCCc2cc(OC(F)F)ccc21 511622061 JQMGJIMWYOUNTE-UHFFFAOYSA-N 453.445 5.401 5 20 JKBD CN(Cc1cnn(-c2ccccc2)c1)[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1 514745027 KWGIHKIHEBICIT-DEOSSOPVSA-N 475.936 5.246 5 20 JKBD C[C@H](NC(=O)c1ccc2c(c1)C(=O)N(c1cc(Cl)ccc1Cl)C2=O)c1cccc([N+](=O)[O-])c1 515681786 JIQKFUGLJJSVJL-LBPRGKRZSA-N 484.295 5.193 5 20 JKBD C[C@H](Nc1ccc(C(=O)N2CCCC[C@@H]2c2cc3ccccc3[nH]2)cc1[N+](=O)[O-])c1ccccn1 520832856 VPJNJMIJOHZKOL-AVRWGWEMSA-N 469.545 6.012 5 20 JKBD O=[N+]([O-])c1ccc(-c2ccc(CNc3cc(-c4ccccc4)nn3CCO)o2)c(Br)c1 521833724 GCPJXQFCWUNQFZ-UHFFFAOYSA-N 483.322 5.085 5 20 JKBD O=C(Nc1ccc2nc(N3CCCC3)sc2c1)c1csc(-c2ccc([N+](=O)[O-])cc2)n1 522638673 XHUHBQRNGMRJHX-UHFFFAOYSA-N 451.533 5.181 5 20 JKBD C[C@H](CC(=O)Nc1cccc(N2CCCC2)c1)NC(=O)c1cc([N+](=O)[O-])ccc1Oc1ccccc1 523553880 SATUTPHGZBRNGK-LJQANCHMSA-N 488.544 5.134 5 20 JKBD C[C@H](Sc1n[nH]c(/C=C\c2ccccc2)n1)C(=O)Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1 598953241 NXLAKSOWCPXVGM-BMSUMIBZSA-N 478.559 5.126 5 20 JKBD CCCN(Cc1nnc(-c2ccccc2Cl)o1)C(=O)c1ccc(N2CCC[C@H](C)C2)c([N+](=O)[O-])c1 603820951 BFYACGBNGBCQFC-KRWDZBQOSA-N 497.983 5.587 5 20 JKBD O=[N+]([O-])c1ccc(-c2noc(CN[C@H](c3ccccc3)c3ccc(Cl)c(Cl)c3)n2)cc1 604010609 FPIFYAKPLFXYPP-OAQYLSRUSA-N 455.301 5.831 5 20 JKBD O=C(Nc1ccccn1)[C@H]1CCCN(C(=O)c2cc([N+](=O)[O-])ccc2Sc2ccc(Cl)cc2)C1 604106035 ISWNDZALMICAFU-INIZCTEOSA-N 496.976 5.285 5 20 JKBD C[C@H](Nc1ccc(C(=O)NCc2ccnc(Oc3ccccc3)c2)cc1[N+](=O)[O-])c1ccccn1 604309116 QJVDTJSILBLICP-SFHVURJKSA-N 469.501 5.280 5 20 JKBD O=C(N[C@@H]1CCCc2nc(-c3ccc(F)cc3)sc21)C1CCN(c2ccccc2[N+](=O)[O-])CC1 609186776 PEXJWYNLYZFAFA-LJQANCHMSA-N 480.565 5.268 5 20 JKBD O=C(Nc1ccccc1OCc1ncc(-c2cccc(Cl)c2)o1)c1cc(Cl)ccc1[N+](=O)[O-] 726763432 IDUSJBUKIRKDAA-UHFFFAOYSA-N 484.295 6.388 5 20 JKBD O=C(O[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1)c1cccc(C(F)F)c1 729747206 UBYFOTQYKHQODZ-LJQANCHMSA-N 460.820 5.723 5 20 JKBD Cc1ccc(Sc2ccc(C(=O)N3CCC([C@H](O)c4ccc(F)cc4)CC3)cc2[N+](=O)[O-])cc1 731057045 TVFJIOXUHNWZBB-RUZDIDTESA-N 480.561 5.779 5 20 JKBD O=C(OCc1nnc(-c2ccc([N+](=O)[O-])cc2)o1)c1nc(-c2ccccc2)oc1-c1ccccc1 731378114 JYZQOTDLOVGBNZ-UHFFFAOYSA-N 468.425 5.324 5 20 JKBD O=C(CNc1ccccc1Cl)Oc1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2Cl)cc1 745837550 BOMHVZGGJVZYCC-UHFFFAOYSA-N 460.273 5.171 5 20 JKBD O=C(COC(=O)c1ccccc1NC(=O)c1ccc([N+](=O)[O-])cc1Cl)c1cc2ccccc2o1 847380785 UFAATLRJNOIITL-UHFFFAOYSA-N 478.844 5.286 5 20 JKBD C[C@H](OC(=O)/C=C/c1ccc2ccc(Cl)cc2n1)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 912874649 YNSMKVLOLXKETC-LZGFCCKTSA-N 493.825 5.399 5 20 JKBD O=C(c1ccc(NS(=O)(=O)c2ccc(Cl)c([N+](=O)[O-])c2)cc1)N1CCC[C@@H]1c1cccs1 913408655 XFTDLIAJEWYCCG-GOSISDBHSA-N 491.978 5.088 5 20 JKBD Cc1c([N+](=O)[O-])cc(C(=O)Nc2ccc(Cl)cc2C(=O)N2[C@@H](C)CCC[C@@H]2C)cc1[N+](=O)[O-] 915153929 FBWRAUFVDPIIKW-STQMWFEESA-N 474.901 5.120 5 20 JKBD CCOC(=O)C[C@H](c1ccccc1)C1CCN(C(=O)c2cc([N+](=O)[O-])ccc2N2CCCCC2)CC1 917381452 FQQIGZAUDZUNBL-XMMPIXPASA-N 493.604 5.174 5 20 JKBD Cc1ccc(/C(O)=C(/C(=S)N[C@H](C)c2ccccc2)[n+]2ccc3c(c2)CCCC3)cc1[N+](=O)[O-] 917612667 NYQMJJLVMHHQEZ-LJQANCHMSA-O 474.606 5.632 5 20 JKBD O=C(Nc1ccc(N2CCOC2=O)cc1)c1ccc(Sc2nc3ccccc3s2)c([N+](=O)[O-])c1 918683144 UQMSXAQKXOPRSH-UHFFFAOYSA-N 492.538 5.565 5 20 JKBD CCn1c(SCC(=O)OCCc2ccc([N+](=O)[O-])cc2)nnc1-c1ccc(Cl)cc1Cl 918798935 JRUYYSWGUIADFR-UHFFFAOYSA-N 481.361 5.058 5 20 JKBD C[C@@H](OC(=O)CCSc1ccc(Br)cc1)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl 920581157 JMACHRXIRPCGLX-LLVKDONJSA-N 487.759 5.063 5 20 JKBD O=C(NC1(c2ccc(NC(=O)[C@@H]3C[C@@H]3C3CC3)cc2)CCC1)c1cccc(Br)c1[N+](=O)[O-] 1786054462 CLKHLYOGCZQGBK-RTBURBONSA-N 498.377 5.151 5 20 JKBD Cc1cc(C(=O)Nc2ccc(C3(NC(=O)/C=C/c4cc5ccccc5o4)CCC3)cc2)ncc1[N+](=O)[O-] 1788766267 BYWRSJMEYSEJSG-VAWYXSNFSA-N 496.523 5.506 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)c3cccc4ccoc34)CCC2)cc1)c1nc2cc([N+](=O)[O-])ccc2[nH]1 1790827359 GUBZBNDNBZDJRZ-UHFFFAOYSA-N 495.495 5.279 5 20 JKBD Cc1occc1C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)[nH]n1 1816437122 ZOGFQFNLARDQCY-GOSISDBHSA-N 479.518 5.054 5 20 JKBD O=C(/C=C/c1ccccc1[N+](=O)[O-])N1CCC([C@H]2CCCCN2C(=O)[C@@H]2C[C@H]2c2ccccc2)CC1 1832023583 FZVFBHMLMYEUIM-PDLWVZGPSA-N 487.600 5.031 5 20 JKBD O=C(c1cc2cc([N+](=O)[O-])ccc2s1)N1CCC([C@@H]2CCCCN2C(=O)C2CC3(CCC3)C2)CC1 1832478396 QSHBHGPKMZHERW-QFIPXVFZSA-N 495.645 5.623 5 20 JKBD CCc1cccc(C)c1NC(=O)COC(=O)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])c(OC)c1 10911634 ZLAQRKSJWYDAML-UHFFFAOYSA-N 498.919 5.715 5 20 JKBD CC(C)n1ncc2c(C(=O)OCC(=O)Nc3ccc(Cl)cc3[N+](=O)[O-])cc(-c3cccs3)nc21 11049237 KBRBGIFBJQWGCZ-UHFFFAOYSA-N 499.936 5.098 5 20 JKBD COc1ccc(C[C@@H](N[C@@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2ccc(OC)cc2)cc1 19670886 QUTDDTZYLANBID-UPCLLVRISA-N 483.952 5.166 5 20 JKBD CC(C)c1ccccc1-n1c(S[C@H](C)C(=O)Nc2ccccc2[N+](=O)[O-])nnc1-c1cccnc1 21739222 OEYDFFMDBHFJNX-QGZVFWFLSA-N 488.573 5.480 5 20 JKBD CCn1c(SCC(=O)Nc2cc(C)c(Cl)cc2OC)nc2cc3ccccc3cc2c1=O 22177783 OHRBSHFBMMEKEM-UHFFFAOYSA-N 467.978 5.271 5 20 JKBD C[C@@H](OC(=O)c1ccc([N+](=O)[O-])cc1Cl)C(=O)N1c2ccccc2Sc2ccccc21 22668049 WATKOVDNTWDSGB-CYBMUJFWSA-N 454.891 5.623 5 20 JKBD O=C(Nc1ccc(NC(=O)[C@H]2CCCO2)cc1)c1cc([N+](=O)[O-])ccc1Sc1ccccc1 30503136 SULXDWNOYVJBFN-OAQYLSRUSA-N 463.515 5.116 5 20 JKBD CC(C)CCSc1ccc(C(=O)N2CCC[C@H](c3nnc4n3CCCCC4)C2)cc1[N+](=O)[O-] 30623586 HQXIJKWGSDZUIO-IBGZPJMESA-N 471.627 5.071 5 20 JKBD O=C(CSc1nnc(-c2ccc(F)cc2)c2ccccc12)N1CCc2cc([N+](=O)[O-])ccc21 45555712 HLLWAKBUQVVBMJ-UHFFFAOYSA-N 460.490 5.026 5 20 JKBD Cc1cc(C)n([C@H](C)C(=O)Nc2ccc(NC(=O)c3ccc(Cl)cc3[N+](=O)[O-])cc2Cl)n1 109141003 ZZPHVCULKPEWHD-CYBMUJFWSA-N 476.320 5.167 5 20 JKBD Cc1sc(NC(=O)c2ccc(NC(=O)c3ccccc3)cc2)nc1-c1cccc([N+](=O)[O-])c1 195704228 ZLSCHBNHHMFZQU-UHFFFAOYSA-N 458.499 5.531 5 20 JKBD C[C@H](Nc1ccc(C(=O)Nc2ccc3nc(C(C)(C)C)[nH]c3c2)cc1[N+](=O)[O-])c1ccccn1 476181661 YBLWGLZUKPYNLP-HNNXBMFYSA-N 458.522 5.589 5 20 JKBD C[C@@H]1C[C@@H](C)CN(c2ccc(C(=O)Nc3cc(Cl)ccc3C(=O)N3CCCC3)cc2[N+](=O)[O-])C1 485311632 HSUVOELNCSBSDP-IAGOWNOFSA-N 484.984 5.219 5 20 JKBD C[C@@H](Nc1ccc(C(=O)N(Cc2ccc(C(F)(F)F)cc2)C2CC2)cc1[N+](=O)[O-])c1ccccn1 506178108 JYCHBJQJIJCVGM-MRXNPFEDSA-N 484.478 5.987 5 20 JKBD C[C@@H](Nc1ccc(C(=O)Nc2ccccc2OCCc2ccccc2)cc1[N+](=O)[O-])c1ccccn1 507052744 OQCFLGCDIMRRDG-HXUWFJFHSA-N 482.540 6.037 5 20 JKBD COc1cc(Br)c(NC(=O)c2ccc(NCc3ccccc3)c([N+](=O)[O-])c2)cc1OC 509400964 IGNUDVHYFCEIPF-UHFFFAOYSA-N 486.322 5.239 5 20 JKBD Cc1ccc(C(=O)Nc2cc([N+](=O)[O-])ccc2Nc2cccc(C(F)(F)F)c2)cc1S(C)(=O)=O 514449944 BIYGAKXTMVXXHM-UHFFFAOYSA-N 493.463 5.321 5 20 JKBD COc1ccc([N+](=O)[O-])cc1NC(=O)[C@H](C)N[C@@H](C)c1ccc(Oc2ccccc2)c(F)c1 515717557 OVBRYXRIJZANJY-HOTGVXAUSA-N 453.470 5.213 5 20 JKBD CC(C)Sc1ccc(Cl)cc1NC(=O)c1ccc([N+](=O)[O-])cc1I 519134400 XWSZRNJPEFWBPN-UHFFFAOYSA-N 476.723 5.606 5 20 JKBD CN(C)c1ccc(C(=O)c2ccccc2C(=O)Nc2ccc(OCc3ccncc3)cc2)cc1[N+](=O)[O-] 520530851 SUMYBYYCWFGMEU-UHFFFAOYSA-N 496.523 5.118 5 20 JKBD COCCc1ccc(Oc2ccc(NC(=O)c3cn(C)nc3-c3ccc([N+](=O)[O-])cc3)cc2)cc1 521716445 JBHZCXDATQRMOR-UHFFFAOYSA-N 472.501 5.229 5 20 JKBD CCOc1cc(C(=O)N[C@@H](Cc2ccccc2Cl)c2ccccc2)c([N+](=O)[O-])cc1OC 521728975 KYCLVOKNSNNMCW-FQEVSTJZSA-N 454.910 5.369 5 20 JKBD CCN(C(=O)c1ccc(NCc2ccccc2Cl)c([N+](=O)[O-])c1)c1ccc(Br)cn1 522583099 IRPXKKAUAGLVBA-UHFFFAOYSA-N 489.757 5.685 5 20 JKBD C[C@@H](Nc1ccc(C(=O)NCc2cccc(COC(C)(C)C)c2)cc1[N+](=O)[O-])c1ccccn1 523873071 DKQVONJUOVTZAP-GOSISDBHSA-N 462.550 5.408 5 20 JKBD Cc1cc(C(=O)Nc2cc(OCC(F)(F)F)cc(OCC(F)(F)F)c2)ccc1[N+](=O)[O-] 585732880 HKXLBSIAMZZLLN-UHFFFAOYSA-N 452.307 5.038 5 20 JKBD O=C(Nc1nc(-c2ccc(F)c(F)c2)cs1)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-] 603728463 DNURWDIEJJXOHF-UHFFFAOYSA-N 459.352 5.190 5 20 JKBD CCOc1cc(C(=O)Nc2nc(C)c(Cc3ccccc3Cl)s2)c([N+](=O)[O-])cc1OC 603974771 FSBJTFBXALHLOT-UHFFFAOYSA-N 461.927 5.264 5 20 JKBD O=C(NCc1ccc(OCc2ccccn2)cc1)c1cc([N+](=O)[O-])ccc1Sc1ccccc1 603982309 FOEBLTFQKGYUAA-UHFFFAOYSA-N 471.538 5.650 5 20 JKBD Cc1ccc(NC(=O)CS[C@H](C)C(=O)Nc2nc(-c3cccc([N+](=O)[O-])c3)c(C)s2)cc1 603996765 COGAUIKVXGRJME-OAHLLOKOSA-N 470.576 5.034 5 20 JKBD CCOc1cccc(N[C@@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Br)c2ccccc2)c1 604047940 TWWLCUOZAKAHDT-OAQYLSRUSA-N 470.323 5.548 5 20 JKBD O=C(Nc1nc2cc(C(F)(F)F)ccc2s1)c1ccc([N+](=O)[O-])cc1I 604566445 QTUAVPQSCMKEBN-UHFFFAOYSA-N 493.204 5.080 5 20 JKBD C[C@H](Nc1ccc(C(=O)Nc2nc(-c3ccc4c(c3)CCO4)cs2)cc1[N+](=O)[O-])c1ccccn1 609113101 VIMGMJFKXYUQTM-HNNXBMFYSA-N 487.541 5.474 5 20 JKBD O=C(C1CCN(c2ccccc2[N+](=O)[O-])CC1)N1CCc2sccc2[C@@H]1c1cccs1 609549689 KDTKIOOYJGDCPJ-JOCHJYFZSA-N 453.589 5.109 5 20 JKBD CCc1cc[n+](/C(C(=S)Nc2ccc(OC(C)C)cc2)=C(/O)c2ccc(C)c([N+](=O)[O-])c2)cc1 726574122 MTNVMRPMOJTFMJ-UHFFFAOYSA-O 478.594 5.864 5 20 JKBD COc1ccc(NC(C)=O)cc1NC(=O)CCC(=O)c1ccc2ccc3cccc4ccc1c2c34 727752503 BREHQXLFHBCKFH-UHFFFAOYSA-N 464.521 6.153 5 20 JKBD O=C(Cn1c2ccccc2c(=O)c2ccccc21)Nc1ccc(CC[C@H](O)c2ccccc2)cc1 727763052 QPXPDNVAWWNUGD-NDEPHWFRSA-N 462.549 5.460 5 20 JKBD COC1CCN(c2ccc(NC(=O)c3cc([N+](=O)[O-])ccc3N3CCCC3)cc2C(F)(F)F)CC1 728039551 ZVMHJFSEGZSHAL-UHFFFAOYSA-N 492.498 5.081 5 20 JKBD O=C(OCc1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[C@H](Oc1ccc(F)cc1Cl)c1ccccc1 730609328 DCIRWADFLOKCGA-OAQYLSRUSA-N 483.839 5.301 5 20 JKBD O=C(O[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1)c1ccc2ncccc2c1 743217683 QVTJBSATWWABGM-JOCHJYFZSA-N 461.861 5.333 5 20 JKBD CCOc1cccc([C@@H](C)NC(=O)c2ccccc2NC(=O)c2ccc([N+](=O)[O-])cc2Cl)c1 745123345 KHOOWRMIFKPXCV-OAHLLOKOSA-N 467.909 5.390 5 20 JKBD CCOC(=O)Nc1nc2ccc(NC(=O)c3csc(-c4cccc([N+](=O)[O-])c4)n3)cc2s1 747653004 OUJSGAOZCSXMPO-UHFFFAOYSA-N 469.504 5.149 5 20 JKBD O=C(O[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1)c1ccc(Cl)nc1Cl 747936248 BAHYOLJNWIHBTG-KRWDZBQOSA-N 480.691 5.487 5 20 JKBD Cc1c(C(=O)Nc2ccc(NC(=O)c3ccco3)cc2C(F)(F)F)cc([N+](=O)[O-])c(C)c1[N+](=O)[O-] 748619870 YTVSDANRWKVHPL-UHFFFAOYSA-N 492.366 5.236 5 20 JKBD C[C@H](OC(=O)c1cc2cc([N+](=O)[O-])ccc2s1)C(=O)Nc1ccc(NC(=O)c2cccs2)cc1 750112741 NGPXSZXBMRLUMW-ZDUSSCGKSA-N 495.538 5.307 5 20 JKBD CCOc1cc([N+](=O)[O-])c(C(=O)Nc2nc3ccc(SC(F)F)cc3s2)cc1OC 750549131 CJZBVTXTOCLDFZ-UHFFFAOYSA-N 455.464 5.179 5 20 JKBD COc1cccc(NCc2nnc(SCc3cc(F)ccc3[N+](=O)[O-])n2C2CCCCC2)c1 915793535 YOVAKBLEUDHWRV-UHFFFAOYSA-N 471.558 5.744 5 20 JKBD Cc1c(NC(=O)[C@H](C)OC(=O)c2cc(C(C)C)nc3c2c(C)nn3C(C)(C)C)cccc1[N+](=O)[O-] 919207835 FAEJQUQAWBSXKF-INIZCTEOSA-N 481.553 5.019 5 20 JKBD Cc1nccn1-c1ncccc1NC(=O)C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1 919984572 NVLDACPKRGTEFS-XDJHFCHBSA-N 496.552 5.663 5 20 JKBD COc1ccc(Cl)cc1C(=O)NC1(c2ccc(NC(=O)/C=C/c3ccc([N+](=O)[O-])o3)cc2)CCC1 1786207714 IFEAFKVEUCHCOH-DHZHZOJOSA-N 495.919 5.311 5 20 JKBD COCc1c[nH]c(C(=O)NC2(c3ccc(NC(=O)c4cc(Cl)cc([N+](=O)[O-])c4C)cc3)CCC2)c1 1790773576 CMTVGFVLMNOSEK-UHFFFAOYSA-N 496.951 5.093 5 20 JKBD Cc1ccc(-c2ccccc2C(=O)N2CCCC[C@@H]2c2cc(NC(=O)c3ccc([N+](=O)[O-])[nH]3)n[nH]2)cc1 1820367264 MEHHNWARCLJYFS-HSZRJFAPSA-N 498.543 5.241 5 20 JKBD CC(C)(C)c1ccc(C(=O)N2CCC([C@@H]3CCCCN3C(=O)c3ccc([N+](=O)[O-])o3)CC2)s1 1823613045 YLHOWQMMJFMJOK-KRWDZBQOSA-N 473.595 5.094 5 20 JKBD O=C(CCc1cccc([N+](=O)[O-])c1)N1CCC([C@H]2CCCCN2C(=O)c2ccc(Cl)cc2)CC1 1830024318 AZGDXAQNXBPPKR-XMMPIXPASA-N 483.996 5.114 5 20 JKBD CC(=O)N(c1ccc(Cl)c(Cl)c1)c1nc(COC(=O)/C=C/c2ccc([N+](=O)[O-])cc2)cs1 10756998 WCRVWAQUKSMRJR-RUDMXATFSA-N 492.340 5.799 5 20 JKBD O=C(CCc1ncc(-c2ccccc2)o1)Oc1ccc(NC(=O)c2cccc([N+](=O)[O-])c2)cc1 12832668 RIWYIMBDFSGAPA-UHFFFAOYSA-N 457.442 5.040 5 20 JKBD CCOc1ccc(NC(=O)c2ccc(NC(=O)Cn3c4ccccc4c(=O)c4ccccc43)cc2)cc1 14807967 MIAHRVFWCCHJAZ-UHFFFAOYSA-N 491.547 5.444 5 20 JKBD Cc1ccc(NC(=O)[C@@H](Sc2nnnn2-c2ccc(Cl)cc2)c2ccccc2)c([N+](=O)[O-])c1 16485371 UXHHCNCZUQPUKE-FQEVSTJZSA-N 480.937 5.004 5 20 JKBD Cc1cccc(C)c1NC(=O)[C@@H](C)OC(=O)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 17109899 QFGJJZDZJOLURR-MRXNPFEDSA-N 493.482 5.017 5 20 JKBD O=C(CSc1ncnc2scc(-c3ccc(F)cc3)c12)Nc1cc([N+](=O)[O-])ccc1Cl 21608107 PTMFMQCKXSWRBW-UHFFFAOYSA-N 474.926 5.790 5 20 JKBD Cc1ccc(-n2ccnc2S[C@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2C(F)(F)F)cc1C 23050424 NQPCXFRBVPWMSG-CQSZACIVSA-N 464.469 5.535 5 20 JKBD COCc1cccc(N[C@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Br)c2ccccc2)c1 28371295 PWLCBQOSNFYTNJ-NRFANRHFSA-N 470.323 5.296 5 20 JKBD Cc1nc(-c2ccc(CCNC(=O)c3ccc(N[C@H](C)c4ccccn4)c([N+](=O)[O-])c3)cc2)cs1 108785999 OLBALXBWKWMLFY-QGZVFWFLSA-N 487.585 5.567 5 20 JKBD COc1ccc(CSCC(=O)NCc2nc(-c3ccc(Cl)cc3)c(C)s2)cc1[N+](=O)[O-] 108881986 MMVURTLEGXRGPW-UHFFFAOYSA-N 477.995 5.238 5 20 JKBD CCn1c(S[C@@H](C)C(=O)Nc2nc(-c3cccc([N+](=O)[O-])c3)cs2)nnc1-c1cccc(C)c1 255934478 RSJGVRVBVZKBOI-HNNXBMFYSA-N 494.602 5.424 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)Nc2cc(NC(=O)Nc3ccccc3)ccc2C)cc1SC 482986107 NJAIVLCSFJXZFO-UHFFFAOYSA-N 466.519 5.530 5 20 JKBD COc1ccc(NC(=O)c2csc(-c3cccc([N+](=O)[O-])c3)n2)cc1NC(=O)c1cccc(F)c1 496267447 QXRULUNTNPWRSD-UHFFFAOYSA-N 492.488 5.371 5 20 JKBD Cc1cc(C(=O)N2CCCC2)ccc1NC(=O)c1cc([N+](=O)[O-])ccc1NCc1ccccc1 498482901 IJWSFTZECUVRCX-UHFFFAOYSA-N 458.518 5.004 5 20 JKBD CCOc1cc(Br)c(NC(=O)[C@H](C)Sc2ccc([N+](=O)[O-])cc2)cc1OCC 508053392 ISCAPTMVXZAYRY-LBPRGKRZSA-N 469.357 5.274 5 20 JKBD Cc1noc([C@H](C)NC(=O)c2c3c(nc4ccccc24)/C(=C\c2cccc([N+](=O)[O-])c2)CCC3)n1 509111144 HLTHUZHMPBGFBK-LUJRCDHRSA-N 469.501 5.202 5 20 JKBD CCCNC(=O)c1ccc(NC(=O)c2ccc(Sc3nc(C)cs3)c([N+](=O)[O-])c2)cc1Cl 509347869 GIHWBFFRTRYWCB-UHFFFAOYSA-N 490.994 5.556 5 20 JKBD C[C@@H](NCc1ccc(Oc2ccccc2Cl)c([N+](=O)[O-])c1)c1ccc(NC(=O)NC2CC2)cc1 509593289 PLGKFAHVMIBPJW-MRXNPFEDSA-N 480.952 6.175 5 20 JKBD CN(C(=O)c1ccc(Cl)cc1)c1ccc(NC(=O)Cn2c3ccccc3c(=O)c3ccccc32)cc1 511602486 BEJTVNDWGPNOLK-UHFFFAOYSA-N 495.966 5.723 5 20 JKBD COc1cc(C(=O)N[C@H](c2ccccc2)C(C)(C)C)c([N+](=O)[O-])cc1OCc1cscn1 512337582 IDCDYYSRGHCEBX-OAQYLSRUSA-N 455.536 5.156 5 20 JKBD O=C(Nc1ccc(Cl)cc1NC(=O)c1ccco1)c1ccc(NCc2ccccc2)c([N+](=O)[O-])c1 515816635 GLCZWSGIQVYXIN-UHFFFAOYSA-N 490.903 5.958 5 20 JKBD O=C(Nc1ccc(NC(=O)c2cccs2)cc1)c1csc(-c2cccc([N+](=O)[O-])c2)n1 523334855 FQEWGUPJYMGWCK-UHFFFAOYSA-N 450.501 5.284 5 20 JKBD CCNc1ccc(C(=O)Nc2ccc(NC(=O)c3ccc(F)cc3)cc2C(F)(F)F)cc1[N+](=O)[O-] 603743149 SXTQPUQZLPNUGS-UHFFFAOYSA-N 490.413 5.689 5 20 JKBD O=C(CC1CCN(C(=O)c2ccc(NCc3ccccc3Cl)c([N+](=O)[O-])c2)CC1)NC1CCCC1 604396697 ODFHWCYQCFLXOW-UHFFFAOYSA-N 499.011 5.161 5 20 JKBD COc1ccc(NC(=O)[C@@H](C)Oc2ccc(Cl)cc2[N+](=O)[O-])cc1NC(=O)c1cccc(F)c1 604446414 NFVFOYUOYBBKTB-CYBMUJFWSA-N 487.871 5.054 5 20 JKBD CN(C[C@@H]1CCCO[C@@H]1c1ccccc1)C(=O)c1ccc(NCc2ccccc2)c([N+](=O)[O-])c1 604519002 DHEHJGYLGPBEAY-JYFHCDHNSA-N 459.546 5.447 5 20 JKBD Cc1c(C(=O)Nc2ccc(Oc3cccc(F)c3)c3ccncc23)nnn1-c1cccc([N+](=O)[O-])c1 609106108 YANSIMKUABWHQI-UHFFFAOYSA-N 484.447 5.216 5 20 JKBD C[C@@H](NC(=O)Nc1ccc(CNC(=O)c2ccc(Br)cc2)cc1)c1cccc([N+](=O)[O-])c1 609356064 BRABNUDLGNFGLU-OAHLLOKOSA-N 497.349 5.170 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)O[C@H](C)C(=O)Nc2ccccc2Oc2ccccc2)cc1SC 728659151 ZQGHYYHGQLNMHX-OAHLLOKOSA-N 482.514 5.302 5 20 JKBD C[C@@H](OC(=O)CCSCc1nc(O)c2c3c(sc2n1)CCCC3)c1cccc([N+](=O)[O-])c1 729537517 DZNXRNFINKFJKP-CYBMUJFWSA-N 473.576 5.112 5 20 JKBD Cc1ccc(-c2ncc(C(=O)OCC(=O)Nc3ccc([N+](=O)[O-])cc3C(F)(F)F)s2)c(C)c1 747262644 BBGKITFGGBFWMP-UHFFFAOYSA-N 479.436 5.149 5 20 JKBD CC(C)c1ccc(-c2noc(COC(=O)c3csc(-c4ccc([N+](=O)[O-])cc4)n3)n2)cc1 747955916 FAIYSBKCFPKNPE-UHFFFAOYSA-N 450.476 5.249 5 20 JKBD Cc1c(NC(=O)[C@@H](C)OC(=O)CCC(=O)c2ccc(-c3ccccc3)cc2)cccc1[N+](=O)[O-] 857749969 MIOYBUBEIAZULI-GOSISDBHSA-N 460.486 5.104 5 20 JKBD COc1ccc(-c2nc(Cc3noc(-c4ccc(NCc5ccccc5)c([N+](=O)[O-])c4)n3)co2)cc1 904333953 ZMMSMKVAEHJSEI-UHFFFAOYSA-N 483.484 5.511 5 20 JKBD Cc1cccc(C)c1NC(=O)CCCOC(=O)c1ccc(N2CCC(C)CC2)c([N+](=O)[O-])c1 916590221 LEJWTTACPKVACV-UHFFFAOYSA-N 453.539 5.024 5 20 JKBD CCn1c(S[C@@H](C(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)c2ccccc2)nnc1-c1cccnc1 916664911 WIZQRYCWYVLCTN-HXUWFJFHSA-N 494.964 5.394 5 20 JKBD Cc1nn(Cc2ccc(F)cc2)c(Cl)c1C(=O)Nc1nc(-c2cccc([N+](=O)[O-])c2)c(C)s1 917790867 LTDTYIJALKEBPI-UHFFFAOYSA-N 485.928 5.625 5 20 JKBD CCc1ccccc1N(C(C)=O)c1nc(COC(=O)c2cc3cc([N+](=O)[O-])ccc3o2)cs1 919213460 KQWBTOCVZWUUAT-UHFFFAOYSA-N 465.487 5.402 5 20 JKBD CC(=O)N(c1ccc(C(F)(F)F)cc1)c1nc(COC(=O)c2ccc(Cl)cc2[N+](=O)[O-])cs1 920518336 OPNCFIZHKYXTFK-UHFFFAOYSA-N 499.854 5.765 5 20 JKBD O=C(COc1cccc(Cl)c1)Nc1ccc(C2(NC(=O)Cc3cccc([N+](=O)[O-])c3)CCC2)cc1 1785990598 JIWTVNYCQRYUHY-UHFFFAOYSA-N 493.947 5.004 5 20 JKBD Cc1c(C(=O)NC2(c3ccc(NC(=O)CN4CCC(C)CC4)cc3)CCC2)cc(Cl)cc1[N+](=O)[O-] 1786272520 ADYQNFYAOWLAFW-UHFFFAOYSA-N 499.011 5.036 5 20 JKBD Cc1ccc2cc(C(=O)Nc3ccc(C4(NC(=O)c5ccc(O)c([N+](=O)[O-])c5)CCC4)cc3)ccc2n1 1789034567 MHWYSEIMPQUJOE-UHFFFAOYSA-N 496.523 5.219 5 20 JKBD O=C(CCc1ccsc1)NC1(c2ccc(NC(=O)c3cccc(F)c3[N+](=O)[O-])cc2)CCC1 1790698658 HARDMGBMJDPFQG-UHFFFAOYSA-N 467.522 5.176 5 20 JKBD Cc1cc(O)c([N+](=O)[O-])cc1C(=O)Nc1ccc(C2(NC(=O)C(C)(C)C(C)(F)F)CCC2)cc1 1790807217 SUSXGKZNRODGIZ-UHFFFAOYSA-N 475.492 5.038 5 20 JKBD COc1ccc(CC(=O)NC2(c3ccc(NC(=O)c4ccc5ccoc5c4)cc3)CCC2)c([N+](=O)[O-])c1 1790892790 UTGLJVRNCTUSHI-UHFFFAOYSA-N 499.523 5.340 5 20 JKBD O=C(CSc1ccccc1[N+](=O)[O-])Nc1ccc(C2(NC(=O)c3ccc(F)cc3)CCC2)cc1 1791522878 CONOMDOIIYTATO-UHFFFAOYSA-N 479.533 5.274 5 20 JKBD O=C(CCc1cccc([N+](=O)[O-])c1)Nc1cc([C@H]2CCCCN2C(=O)c2cccc(F)c2Cl)[nH]n1 1815538500 LXANAMBOKFAZJL-HXUWFJFHSA-N 499.930 5.049 5 20 JKBD O=C(/C=C/C1CCCC1)N1CCC([C@@H]2CCCCN2C(=O)Cc2ccc(Cl)cc2[N+](=O)[O-])CC1 1824160294 BWDXSMKQKXJRSM-HDFUYHJRSA-N 488.028 5.157 5 20 JKBD O=C(c1ccc([N+](=O)[O-])o1)N1CCC([C@@H]2CCCCN2C(=O)[C@@H]2CCC[C@@H]3CCCC[C@@H]32)CC1 1828455457 BAZQHRQUWXENNU-UVUJQTEASA-N 471.598 5.028 5 20 JKBD Cc1c(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)/C=C/c3ccco3)CC2)cc(Cl)cc1[N+](=O)[O-] 1830734557 NEGUJBVHANDCHX-VQKOGROQSA-N 485.968 5.096 5 20 JKBD Cc1ccc(C)c(C(=O)N2CCCC[C@H]2C2CCN(C(=O)CSc3ccccc3[N+](=O)[O-])CC2)c1 1832568067 JEPKQDUVQSGDHD-QHCPKHFHSA-N 495.645 5.237 5 20 JKBD CCn1c(S[C@@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2)nc2scc(-c3cccs3)c2c1=O 9750671 DCQFNRVSEGFYHM-LBPRGKRZSA-N 486.600 5.234 5 20 JKBD O=C(Nc1ncc(Cc2cc(Cl)ccc2Cl)s1)c1cc([N+](=O)[O-])ccc1N1CCOCC1 15322750 VLFXAFJSWNKLIN-UHFFFAOYSA-N 493.372 5.038 5 20 JKBD O=C(CCc1nc(-c2ccsc2)no1)Oc1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2Cl)cc1 15602749 XAABFSVDURKJNE-UHFFFAOYSA-N 498.904 5.150 5 20 JKBD C[C@@H](NC[C@H](c1ccccc1)c1c[nH]c2ccccc12)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 19623571 IKOUMIXYAAIWAZ-OXQOHEQNSA-N 496.489 5.844 5 20 JKBD C[C@@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccc(NC(=O)C2CC2)cc1C(F)(F)F 22185663 QSVZEXMJGGDIND-LLVKDONJSA-N 453.442 5.081 5 20 JKBD Cn1ncc2c1CCC[C@H]2NC(=O)C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1 24994310 HRZGCUAQISLDBI-MBGNVJMVSA-N 473.558 5.063 5 20 JKBD O=C(COC(=O)c1ccc(-c2nc3ccccc3s2)s1)Nc1cc([N+](=O)[O-])ccc1Cl 28305136 XVQNFNPDGPLHRP-UHFFFAOYSA-N 473.919 5.382 5 20 JKBD O=C(Nc1cccc(NC(=O)c2ccc(NCc3ccccc3)c([N+](=O)[O-])c2)c1)c1ccncc1 32450540 IAXYYOJSACPLLI-UHFFFAOYSA-N 467.485 5.107 5 20 JKBD CC(=O)N(c1nc(COc2ccc([N+](=O)[O-])cc2C(F)(F)F)cs1)c1cccc(C)c1C 72033585 OGIOXPUHFFGETN-UHFFFAOYSA-N 465.453 5.951 5 20 JKBD CCC(=O)Nc1ccc(C)c(NC(=O)c2ccc(Sc3nc(C)cs3)c([N+](=O)[O-])c2)c1 107637260 GOBMVWQVYKJVJL-UHFFFAOYSA-N 456.549 5.420 5 20 JKBD C[C@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)NCc1ccccc1-c1ccc(Cn2cccn2)cc1 110621591 TXBOXWFJJQDGHH-IBGZPJMESA-N 472.570 5.304 5 20 JKBD CSc1ccc(C(=O)Nc2ccc(NC(=O)c3ccoc3)cc2C(F)(F)F)cc1[N+](=O)[O-] 195625086 ONWCNNSJRHNFFT-UHFFFAOYSA-N 465.409 5.433 5 20 JKBD O=C1CCCN1Cc1ccc(CNCc2ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])cc2)cc1 303020485 ZNJWAWKASDPYSE-UHFFFAOYSA-N 465.937 5.453 5 20 JKBD C[C@H](Nc1ccc(C(=O)N2CCC[C@H]2c2ccccc2Cl)cc1[N+](=O)[O-])c1ccccn1 410083521 AWFYVNVXIYFZGX-AOMKIAJQSA-N 450.926 5.794 5 20 JKBD C[C@@H](NC(=O)c1ccc(Sc2nc3ccccc3s2)c([N+](=O)[O-])c1)c1ccc(NC(N)=O)cc1 480351563 SDEUECYFJYGZLU-CYBMUJFWSA-N 493.570 5.337 5 20 JKBD O=C(CSc1cccc(C(F)(F)F)c1)N(Cc1ccccc1[N+](=O)[O-])CC(F)(F)F 486115165 AMJGBGDYWNJUEP-UHFFFAOYSA-N 452.376 5.297 5 20 JKBD C[C@H]1CCCN(c2ccc(C(=O)Nc3ccc(OC(F)F)cc3OC(F)F)cc2[N+](=O)[O-])C1 486830056 WBGJNKCHAHCWHH-LBPRGKRZSA-N 471.407 5.286 5 20 JKBD COc1ccc(CN(Cc2ccccc2)C(=O)Cn2c3ccccc3c(=O)c3ccccc32)cc1 491721639 LQBOFRALRFKSCN-UHFFFAOYSA-N 462.549 5.392 5 20 JKBD O=C(NCCNc1ccc([N+](=O)[O-])cc1)c1oc2ccccc2c1CSc1cccs1 496831629 OHDICSICXYOPNN-UHFFFAOYSA-N 453.545 5.537 5 20 JKBD CCCOc1ccc(CNC(=O)C/C(=C/c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)cn1 502430069 JOZHMOZDBXIFLI-ZHZULCJRSA-N 488.569 5.635 5 20 JKBD Cc1nn(Cc2ccc(C(=O)Nc3ccc(-c4nc5c(F)cccc5[nH]4)cc3)cc2)c(C)c1[N+](=O)[O-] 502515869 XJHLWSUYAMUEMN-UHFFFAOYSA-N 484.491 5.391 5 20 JKBD O=C(C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)NCc1ccc(N2CCCC2)nc1 502927500 YCMYUJSCGNLIJI-RCCKNPSSSA-N 499.596 5.447 5 20 JKBD CN(C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)[C@H]1CCSc2ccc(Br)cc21 508259135 XKZFNJDBGDIBCZ-HNNXBMFYSA-N 456.749 5.712 5 20 JKBD CC(C)N(C)Cc1ccccc1CN[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1 511006257 YNLASLQLVJBGBP-RUZDIDTESA-N 480.996 5.558 5 20 JKBD O=C(Nc1ccc(Cl)cc1Cl)[C@@H]1CCCCN1C(=O)c1cc2cc([N+](=O)[O-])ccc2o1 515282599 WRUAJIXXMXHTMM-KRWDZBQOSA-N 462.289 5.281 5 20 JKBD O=[N+]([O-])c1ccc(-c2nn(-c3ccccc3)cc2CNCc2ccc(Oc3ccccc3)nc2)cc1 518279258 JIROSWJWLMEOBA-UHFFFAOYSA-N 477.524 5.925 5 20 JKBD Cc1sc(NC(=O)c2cccc(NC(=O)c3ccc(F)cc3)c2)nc1-c1cccc([N+](=O)[O-])c1 603997191 BRZHQNBHEBCNED-UHFFFAOYSA-N 476.489 5.670 5 20 JKBD C[C@@H]1CCN(C(=O)C2CCN(c3ccc(C(F)(F)F)cc3[N+](=O)[O-])CC2)[C@H]2CCCC[C@H]21 604102558 JGMOPYMWZAWOEI-MNEFBYGVSA-N 453.505 5.257 5 20 JKBD CN(CCCc1cc(-c2ccc(F)cc2)no1)C(=O)Nc1cc([N+](=O)[O-])ccc1OC(F)F 608785281 KWQXTGPHILQPFU-UHFFFAOYSA-N 464.400 5.087 5 20 JKBD Cc1cc(C(=O)N2CCC[C@H]2C(=O)N2CCC(c3cccc4ccccc34)CC2)ccc1[N+](=O)[O-] 608806644 ARBZTMKVVDWPOB-SANMLTNESA-N 471.557 5.067 5 20 JKBD O=C(Cn1c2ccccc2c(=O)c2ccccc21)NCc1cn(-c2ccccc2)nc1-c1ccccc1 653095939 IJERMPCZLQMPDC-UHFFFAOYSA-N 484.559 5.324 5 20 JKBD C[C@H](NCc1ccc(Oc2ccccc2Cl)c([N+](=O)[O-])c1)c1ccc(N2CCCC2=O)cc1 725848638 ZORKIWAWGQGACL-KRWDZBQOSA-N 465.937 6.018 5 20 JKBD CC(C)(C)OC(=O)N1CCC[C@H]1[C@@H]1CCCCN1C(=O)Nc1ccc([N+](=O)[O-])cc1Cl 725855062 SFRYIPGDGRXGEG-ROUUACIJSA-N 452.939 5.034 5 20 JKBD C[C@H]1CN(c2ccc(NC(=O)N[C@@H](C)c3cccc([N+](=O)[O-])c3)cc2C(F)(F)F)C[C@@H](C)O1 728130135 MAGJDJLHJVFHEX-ZNMIVQPWSA-N 466.460 5.110 5 20 JKBD O=C(Nc1ccc(OCc2ccccn2)c(Cl)c1)c1cc([N+](=O)[O-])ccc1N1CCCC1 744010407 KZYWICDCNNYUGO-UHFFFAOYSA-N 452.898 5.075 5 20 JKBD Cc1nnc([C@H](C)OC(=O)c2ccccc2Sc2ccc(C(F)(F)F)cc2[N+](=O)[O-])o1 744478990 UAIIUFUJVZSIAT-JTQLQIEISA-N 453.398 5.374 5 20 JKBD O=C(C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)OCC(=O)c1cc(F)ccc1F 748579265 MBGGXGCILIHAAH-LFIBNONCSA-N 494.475 5.840 5 20 JKBD COc1ccc(Cl)c(C(=O)O[C@@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2ccccc2)c1N 750228468 JLWRBWBFYZFYPQ-HXUWFJFHSA-N 490.299 5.029 5 20 JKBD COc1cc(C(=O)Nc2ccc(SC(C)(C)C)cc2C)c([N+](=O)[O-])cc1OCc1cscn1 751252758 RCHXVASLYUJQCE-UHFFFAOYSA-N 487.603 6.090 5 20 JKBD CC(=O)N(c1ccc(C)c(C)c1)c1nc(/C=C2/N=C(c3ccc(Cl)c([N+](=O)[O-])c3)OC2=O)cs1 812447963 UFJWWCGSXYQYII-VXLYETTFSA-N 496.932 5.351 5 20 JKBD COC1(c2noc(C/C(=C\c3ccc([N+](=O)[O-])cc3)c3nc4ccccc4s3)n2)CCOCC1 904816769 PPURGNHKKFSHQU-SAPNQHFASA-N 478.530 5.023 5 20 JKBD O=C(c1ccc(Cl)cc1)C1CCN(c2c([N+](=O)[O-])cc(C(F)(F)F)cc2[N+](=O)[O-])CC1 918735844 RFYYYVAZPNGUJE-UHFFFAOYSA-N 457.792 5.275 5 20 JKBD CCOC(=O)N(C)c1ccc(NC(=O)c2ccc(N[C@@H](C)c3ccccn3)c([N+](=O)[O-])c2)cc1 919769949 LLSDMCBHGDEXIJ-INIZCTEOSA-N 463.494 5.008 5 20 JKBD C[C@@H](NC(=O)c1cc([N+](=O)[O-])ccc1Sc1ccccc1)c1ccc(N2CCOC2=O)cc1 920953018 WYHSGVJFDXIADA-MRXNPFEDSA-N 463.515 5.194 5 20 JKBD O=C(Cc1cccc([N+](=O)[O-])c1)Nc1ccc(C2(NC(=O)[C@@H]3[C@@H]4Sc5ccccc5[C@H]43)CCC2)cc1 1785793686 UMHHOBRRPMBRQS-KKUQBAQOSA-N 499.592 5.159 5 20 JKBD O=C(CCC(F)(F)F)Nc1ccc(C2(NC(=O)CCc3cccc([N+](=O)[O-])c3)CCC2)cc1 1787868978 LJLPIKAFMUIPNI-UHFFFAOYSA-N 463.456 5.004 5 20 JKBD O=C(NC1(c2ccc(NC(=O)c3ccoc3C(F)(F)F)cc2)CCC1)c1cc(F)cc([N+](=O)[O-])c1 1788727302 PYIRSPLZCWTEOV-UHFFFAOYSA-N 491.397 5.407 5 20 JKBD Cc1ccc(CC(=O)NC2(c3ccc(NC(=O)c4ccc5ncoc5c4)cc3)CCC2)cc1[N+](=O)[O-] 1789078913 QVUHOTPYOMMZTN-UHFFFAOYSA-N 484.512 5.035 5 20 JKBD C[C@@H](Sc1cccs1)C(=O)Nc1ccc(C2(NC(=O)/C=C/c3ccc([N+](=O)[O-])o3)CCC2)cc1 1789414158 VIRDWGSKRVEVNW-PXUDHTSWSA-N 497.598 5.577 5 20 JKBD C[C@@H](Sc1ccccn1)C(=O)Nc1ccc(C2(NC(=O)c3cccc(F)c3[N+](=O)[O-])CCC2)cc1 1791834770 IRXUKPKPTKWNJG-MRXNPFEDSA-N 494.548 5.057 5 20 JKBD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)/C=C/C1CCCCC1)c1cc2cc([N+](=O)[O-])ccc2s1 1800125025 OZQPRPIQBDIUOF-NWKATUPTSA-N 467.591 5.198 5 20 JKBD CC(C)c1ccc(CC(=O)N2CCCC[C@H]2c2cc(NC(=O)c3cc(F)cc([N+](=O)[O-])c3)n[nH]2)cc1 1821168027 GYAJBDRLRUGUFM-QHCPKHFHSA-N 493.539 5.129 5 20 JKBD CC1(C)CCC(CC(=O)N2CCCC[C@H]2c2cc(NC(=O)Cc3cc(F)ccc3[N+](=O)[O-])n[nH]2)CC1 1823487583 NJTJRYVPKWHBRV-QFIPXVFZSA-N 499.587 5.298 5 20 JKBD CC[C@H](C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cc(F)cc([N+](=O)[O-])c2)CC1)c1ccccc1 1830613937 IZRLHSDGZKEGIR-DQEYMECFSA-N 481.568 5.161 5 20 JKBD O=C(c1cccc2cccnc12)N1CCC([C@H]2CCCCN2C(=O)/C=C/c2ccccc2[N+](=O)[O-])CC1 1832907525 XBBCLQAOZOUHBV-AKNQKSQZSA-N 498.583 5.090 5 20 JKBD C[C@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccc(NC(=O)C2CC2)cc1C(F)(F)F 22185666 QSVZEXMJGGDIND-NSHDSACASA-N 453.442 5.081 5 20 JKBD Cc1ccccc1N(C(=O)Cn1c2ccccc2c(=O)c2ccccc21)c1nc2ccccc2s1 22314338 QMCQEFVAENDQRC-UHFFFAOYSA-N 475.573 6.438 5 20 JKBD CCN(CC)C(=O)c1ccc(CN[C@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2ccccc2)cc1 30497002 QRRRPXRMKBVHLZ-DEOSSOPVSA-N 494.979 5.200 5 20 JKBD Cc1c(C(=O)N[C@@H](c2ccccc2)c2ccc3nc(C(F)(F)F)[nH]c3c2)cccc1[N+](=O)[O-] 105573840 JYPCNYYONKZASI-FQEVSTJZSA-N 454.408 5.318 5 20 JKBD O=C(N[C@@H](CN1CCCC1=O)c1ccccc1)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1 108920169 SJZLTCQKWKMARX-NRFANRHFSA-N 479.920 5.134 5 20 JKBD Cc1occc1CN(C)[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Br)c1ccccc1 195616927 CHZXLGBLPCHWMQ-FQEVSTJZSA-N 458.312 5.071 5 20 JKBD COc1ccccc1-c1cc(NC(=O)c2ccc(OC)c([N+](=O)[O-])c2)n(-c2ccc(C)cc2)n1 195624898 VBVGJWOBSRPHSU-UHFFFAOYSA-N 458.474 5.025 5 20 JKBD Cc1c(C(=O)Nc2ccc(NCc3ccccc3)c(Cl)c2)nnn1-c1cccc([N+](=O)[O-])c1 497526958 PNEKHOKKXMIJDQ-UHFFFAOYSA-N 462.897 5.002 5 20 JKBD COc1cc(C(=O)N[C@H](C)c2sc(-c3ccccc3)nc2C)c([N+](=O)[O-])cc1OC(F)F 501605416 JPSYKESWGZKGNA-LLVKDONJSA-N 463.462 5.128 5 20 JKBD C[C@H](Nc1ccc(C(=O)NCc2ccnc(Oc3ccc(F)cc3)c2)cc1[N+](=O)[O-])c1ccccn1 503358484 VTAVECLPAVTHNE-KRWDZBQOSA-N 487.491 5.419 5 20 JKBD COc1ccc(Br)c(NC(=O)c2cc([N+](=O)[O-])ccc2NCc2ccccc2)c1 503451098 WCEVSOBDHGDFHB-UHFFFAOYSA-N 456.296 5.230 5 20 JKBD O=C(C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)Nc1cnn(Cc2ccncc2)c1 503828703 NLEREINFYORRLT-MOSHPQCFSA-N 496.552 5.414 5 20 JKBD C[C@@H]1Cc2cc([N+](=O)[O-])ccc2N1C(=O)c1cccc(NC(=O)Cc2ccc(Br)cc2)c1 504335320 VMMQCHKIQIHJFS-OAHLLOKOSA-N 494.345 5.130 5 20 JKBD CC1CCN(Cc2ccc(CNC(=O)c3ccc(N[C@H](C)c4ccccn4)c([N+](=O)[O-])c3)cc2)CC1 506181226 ZLXXYGDBHHUBSV-OAQYLSRUSA-N 487.604 5.325 5 20 JKBD C[C@H](Nc1ccc(C(=O)N[C@H](C)c2ccccc2OC(F)F)cc1[N+](=O)[O-])c1ccccn1 506190393 MQKAXNKAXXEFJS-CABCVRRESA-N 456.449 5.255 5 20 JKBD C[C@@H](Nc1ccc(C(=O)Nc2nc(-c3ccc(F)cc3)cs2)cc1[N+](=O)[O-])c1ccccn1 506245569 LOUQUBKRTCOOKS-CQSZACIVSA-N 463.494 5.678 5 20 JKBD C[C@@H]1CCCN(c2ccc(C(=O)Nc3cc(Cl)ccc3OC[C@@H]3CCCO3)cc2[N+](=O)[O-])C1 509790294 XHHLAROJGUEUEP-APWZRJJASA-N 473.957 5.295 5 20 JKBD COc1ccc(NC(=O)c2ccc(NCc3ccccc3)c([N+](=O)[O-])c2)cc1OCc1ccncc1 512838521 NRJWANWBWXUXPQ-UHFFFAOYSA-N 484.512 5.442 5 20 JKBD O=C(CCCSc1ccc(Br)cc1)Nc1cc2c(cc1[N+](=O)[O-])OCCCO2 517431213 URAADDHENLRNMA-UHFFFAOYSA-N 467.341 5.030 5 20 JKBD Cc1nn(Cc2ccc(C(=O)Nc3ccccc3NC(=O)c3cccs3)cc2)c(C)c1[N+](=O)[O-] 523270282 PHDAEPXDYVLVQQ-UHFFFAOYSA-N 475.530 5.023 5 20 JKBD O=C(c1csc(-c2ccc([N+](=O)[O-])cc2)n1)N1CCC[C@@H](c2nc3ccccc3s2)C1 523301773 RALMUUNFGQYHMS-OAHLLOKOSA-N 450.545 5.348 5 20 JKBD CN(C)c1ccc(C(=O)c2ccccc2C(=O)N2CCC[C@@H](c3cc4ccccc4[nH]3)C2)cc1[N+](=O)[O-] 604244529 SWPGIPOIKDJXLI-OAQYLSRUSA-N 496.567 5.393 5 20 JKBD C[C@H](NC(=O)c1ccc(C(=O)N[C@H](C)c2c(F)cccc2F)c([N+](=O)[O-])c1)c1c(F)cccc1F 609044076 UWGKCJKAMOPMOX-QWHCGFSZSA-N 489.425 5.133 5 20 JKBD COc1ccc(-c2cc(CSCc3cc(OC)c(OC(F)F)cc3[N+](=O)[O-])on2)cc1 609235833 HINYYABVDRSLHM-UHFFFAOYSA-N 452.435 5.302 5 20 JKBD Cc1cc(NC(=O)Cn2c3ccccc3c(=O)c3ccccc32)n(-c2ccccc2C(F)(F)F)n1 648867552 RGRZJCIFQDULST-UHFFFAOYSA-N 476.458 5.306 5 20 JKBD Cc1c(-c2ccccc2)oc2c(C(=O)OCC3CCN(c4ncccc4[N+](=O)[O-])CC3)cccc2c1=O 729193548 UEVMRKVDABTMGB-UHFFFAOYSA-N 499.523 5.145 5 20 JKBD C[C@@H](NC(=O)c1ccccc1NC(=O)c1cc([N+](=O)[O-])ccc1Br)c1ccccc1 751055701 AUGNBXGOMSHXAZ-CQSZACIVSA-N 468.307 5.101 5 20 JKBD O=C(COC(=O)/C=C\c1ccc(-c2ccc(F)cc2)s1)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 842093624 QESUQJQGHVONSV-YFHOEESVSA-N 494.422 5.676 5 20 JKBD CSCC[C@H](NC(=O)c1ccc(Cl)c([N+](=O)[O-])c1)C(=O)O[C@H](C)c1ccc(Cl)cc1 857760872 UAVWXSPIEABUDI-PXAZEXFGSA-N 471.362 5.058 5 20 JKBD COc1ccc(COCc2cccc(NCc3c(Br)cccc3[N+](=O)[O-])c2)cc1 864026822 GSIDKTYUOLUVHS-UHFFFAOYSA-N 457.324 5.695 5 20 JKBD O=[N+]([O-])c1ccc2c(ccn2Cc2nc(-c3ccc(Cn4cnc5ccccc54)cc3)no2)c1 904473019 MZIPZEUQQKDHIC-UHFFFAOYSA-N 450.458 5.046 5 20 JKBD O=C(CSc1ccccc1C(=O)Nc1cc([N+](=O)[O-])ccc1F)NC1CCCCCCC1 913183126 UQPFKSQTYZMGAF-UHFFFAOYSA-N 459.543 5.307 5 20 JKBD COc1ccc(Oc2ccc([N+](=O)[O-])cc2C(=O)OCC(=O)Nc2c(C)cccc2C(C)C)cc1 915249550 ITRURHZZAHWWAY-UHFFFAOYSA-N 478.501 5.623 5 20 JKBD Cc1oc(-c2cccs2)nc1C(=O)Oc1ccc2c(-c3ccc([N+](=O)[O-])cc3)cc(=O)oc2c1 915812306 LFBMGTDBPKCVSJ-UHFFFAOYSA-N 474.450 5.612 5 20 JKBD Cc1nc(-c2ccccc2NC(=O)c2ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])cc2)no1 915867139 BUYQLVFDWCAWSI-UHFFFAOYSA-N 450.838 5.651 5 20 JKBD Cc1c([N+](=O)[O-])cc(C(=O)Nc2ccc(Oc3ncc(Cl)cc3Cl)cc2)cc1[N+](=O)[O-] 916410480 CRJQJQZUSHYYIT-UHFFFAOYSA-N 463.233 5.558 5 20 JKBD O=C(Nc1ccccc1SC[C@@H]1CC1(Cl)Cl)c1ccn(-c2cccc([N+](=O)[O-])c2)n1 917752183 SSEDGUFRPAFGSP-ZDUSSCGKSA-N 463.346 5.319 5 20 JKBD O=C(/C=C/c1ccc([N+](=O)[O-])o1)Nc1ccc(C2(NC(=O)[C@]3(F)CCCCC3(F)F)CCC2)cc1 1786207455 OJCAKVVKLBPPTP-YIEPXFBBSA-N 491.466 5.253 5 20 JKBD O=C(C[C@H]1C[C@@H]2CC[C@H]1C2)NC1(c2ccc(NC(=O)c3cc(F)cc([N+](=O)[O-])c3)cc2)CCC1 1790699665 XFNSNGGWJUOFIY-FGTMMUONSA-N 465.525 5.308 5 20 JKBD Cc1c(C(=O)NC[C@@H]2CCN(C(=O)C3(C)CCCCC3)[C@H]2c2cccnc2)cc(Cl)cc1[N+](=O)[O-] 1811796758 KZEMJENGAXYGBV-CVDCTZTESA-N 499.011 5.242 5 20 JKBD Cc1ccc(C(=O)N2CCCC[C@H]2c2cc(NC(=O)c3ccc([N+](=O)[O-])cc3F)n[nH]2)cc1Cl 1821049198 GLEFJVJPAFFTME-FQEVSTJZSA-N 485.903 5.039 5 20 JKBD Cc1ncccc1C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)CC1 1825845464 XJCGYSQDEQNODH-JOCHJYFZSA-N 492.601 5.060 5 20 JKBD CC[C@H](C(=O)N1CCC([C@H]2CCCCN2C(=O)c2ccc([N+](=O)[O-])cc2F)CC1)c1ccccc1 1830495823 WXJDKDXWNDTZED-WIOPSUGQSA-N 481.568 5.161 5 20 JKBD O=C(CCc1cccc([N+](=O)[O-])c1)N1CCC([C@@H]2CCCCN2C(=O)c2cc3ccsc3[nH]2)CC1 1830882389 FDWRTKSLNBCUBO-QHCPKHFHSA-N 494.617 5.004 5 20 JKBD Cc1c(C(=O)N2CCC([C@@H]3CCCCN3C(=O)C3CC4(CCC4)C3)CC2)cc(Cl)cc1[N+](=O)[O-] 1832477401 WONGVGRDEPYXPB-QFIPXVFZSA-N 488.028 5.370 5 20 JKBD COc1cc(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)C[C@@H](C)c3ccccc3)CC2)ccc1[N+](=O)[O-] 1832697225 KRGKBWGPWQTROZ-HYBUGGRVSA-N 493.604 5.031 5 20 JKBD O=C(O)c1ccc(-c2c3ccccc3c(-c3ccc(C(=O)O)c(O)c3)c3ccccc23)cc1O 2048532929 XMYSOWFONCKVHG-UHFFFAOYSA-N 450.446 6.135 5 20 JKBD CCn1c(S[C@H](C(=O)Nc2ccc(C)cc2[N+](=O)[O-])c2ccccc2)nnc1-c1ccco1 8619977 HCBDAPJHSURGKT-FQEVSTJZSA-N 463.519 5.247 5 20 JKBD O=C(CSc1ccc(C(F)(F)F)cc1[N+](=O)[O-])Nc1ccc(N2CCCC2=O)c(Cl)c1 11416801 SGHGJPZGZRCZDR-UHFFFAOYSA-N 473.860 5.125 5 20 JKBD COc1ccc(NS(=O)(=O)c2cc(NC(=O)c3cc4cc([N+](=O)[O-])ccc4s3)ccc2C)cc1 15632095 DMGUDTRVSKODRR-UHFFFAOYSA-N 497.554 5.180 5 20 JKBD COc1ccc(-c2nnc(S[C@H](C)c3nnc(-c4ccc([N+](=O)[O-])cc4)o3)n2CC(C)C)cc1 17536412 OAXRKJPKVMOUTD-OAHLLOKOSA-N 480.550 5.421 5 20 JKBD Cc1cc([N+](=O)[O-])ccc1NC(=O)CSc1nc2sc(C)c(C)c2c(=O)n1C1CCCC1 21996717 VDIINYYHUMURGP-UHFFFAOYSA-N 472.592 5.137 5 20 JKBD CCCCSc1nnc(SCC(=O)Nc2nc(-c3cccc([N+](=O)[O-])c3)cs2)s1 22490198 BDZSRUPIPZVAQV-UHFFFAOYSA-N 467.623 5.193 5 20 JKBD O=C(c1ccc(NCc2ccccc2Cl)c([N+](=O)[O-])c1)N1CCC[C@H](c2nc3ccccc3o2)C1 31129097 AWNGPCVLHCXCLH-IBGZPJMESA-N 490.947 6.021 5 20 JKBD C[C@@H](Nc1ccc(C(=O)N[C@H](c2ccccc2)c2ccncc2)cc1[N+](=O)[O-])c1ccccn1 72016897 KCDVDGZQKVRXRY-IQGLISFBSA-N 453.502 5.077 5 20 JKBD CC(=O)N(c1nc(COc2ccc([N+](=O)[O-])cc2C(F)(F)F)cs1)c1ccc(C)cc1C 72033583 CRLNNMKCRNSLJY-UHFFFAOYSA-N 465.453 5.951 5 20 JKBD Cc1ccc(-c2csc(NC(=O)c3cccc(OCc4cscn4)c3)n2)cc1[N+](=O)[O-] 105355129 OMAXDWXLJWFXOR-UHFFFAOYSA-N 452.517 5.315 5 20 JKBD O=C(CCSc1nnc(Nc2ccc(SC(F)F)cc2)s1)Nc1ccccc1[N+](=O)[O-] 105589742 QAQTVLGWUCGFHI-UHFFFAOYSA-N 483.547 5.626 5 20 JKBD C[C@H](Nc1ccc(C(=O)N(Cc2ccc(F)cc2F)C2CC2)cc1[N+](=O)[O-])c1ccccn1 108785251 FOKONNVUCRBPFJ-HNNXBMFYSA-N 452.461 5.246 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)Nc2ccc(NC(=O)c3ccco3)c(Cl)c2)cc1SC 483408213 OFWYLKWHOFENCK-UHFFFAOYSA-N 461.883 5.076 5 20 JKBD C[C@@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)N(CC(=O)Nc1ccccc1F)Cc1ccccc1F 488115956 FVFCKUOZJXZABM-MRXNPFEDSA-N 485.512 5.021 5 20 JKBD CCN(C(=O)c1cc(OC)c(OC)cc1[N+](=O)[O-])[C@@H]1CCSc2ccc(Br)cc21 504650454 OGVNXMXNCNKGIU-OAHLLOKOSA-N 481.368 5.074 5 20 JKBD COc1ccc([C@H]2CCN(C(=O)c3ccc(Oc4ccc(Cl)cc4[N+](=O)[O-])c(OC)c3)C2)cc1 504925994 WIROGEYAYNYJPS-SFHVURJKSA-N 482.920 5.687 5 20 JKBD C[C@@H](Nc1ccc(C(=O)NCCCSc2ccc(F)cc2)cc1[N+](=O)[O-])c1ccccn1 506018282 ZSCFILJTLHFSSG-MRXNPFEDSA-N 454.527 5.214 5 20 JKBD C[C@H](Nc1ccc(C(=O)NC[C@H](c2cccc(Cl)c2)N2CCCC2)cc1[N+](=O)[O-])c1ccccn1 507050984 HEHULGHZQZJWQS-AVRWGWEMSA-N 493.995 5.383 5 20 JKBD CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)NCc1cccc(NC(=O)C2CCCCC2)c1 509433873 VVRANGGUBOCOJM-UHFFFAOYSA-N 452.555 5.234 5 20 JKBD COc1cc(C(=O)Nc2cc(C(F)(F)F)ccc2Cl)c([N+](=O)[O-])cc1OCc1cscn1 511128097 WNQWRPSWPRRXHC-UHFFFAOYSA-N 487.843 5.563 5 20 JKBD CN(CCc1ccccn1)C(=O)C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1 594669227 IOUALZRWFBWBES-MNDPQUGUSA-N 458.543 5.231 5 20 JKBD CCOc1cc(C(=O)N(c2cccc(C(F)(F)F)c2)[C@@H](C)C2CC2)c([N+](=O)[O-])cc1OC 603964324 DMQFRGDXZKBEGY-ZDUSSCGKSA-N 452.429 5.466 5 20 JKBD COc1ccccc1OCC(=O)Nc1cccc(NC(=O)c2ccc(C(C)(C)C)c([N+](=O)[O-])c2)c1 603995092 SFUGGKJOVFWPKM-UHFFFAOYSA-N 477.517 5.171 5 20 JKBD COc1ccc(CCCN(C)C(=O)c2cc([N+](=O)[O-])ccc2Oc2ccc(OC)cc2)cc1 604198034 GJASHBBRTDCDKV-UHFFFAOYSA-N 450.491 5.109 5 20 JKBD Cc1ccc2[nH]c3c(c2c1)CN(C(=O)c1ccc(N[C@@H](C)c2ccccn2)c([N+](=O)[O-])c1)CC3 604301736 UOTAJGWBUMNLMR-KRWDZBQOSA-N 455.518 5.151 5 20 JKBD O=[N+]([O-])c1ccc(-c2ccc(CNCc3cn(-c4ccccc4)nc3-c3ccncc3)o2)cc1 608836807 HQTUDLRTQAYBLG-UHFFFAOYSA-N 451.486 5.392 5 20 JKBD Cc1ccccc1NC(=O)[C@H]1CCc2ccccc2N1C(=O)c1cc2cc([N+](=O)[O-])ccc2o1 608871979 IMTVVDDKRRJOJR-JOCHJYFZSA-N 455.470 5.250 5 20 JKBD CCOc1ccc(NC(=O)c2ccc(C(=O)Nc3ccc(OCC)cc3C)c([N+](=O)[O-])c2)c(C)c1 609044944 WQGDHTHMKRAOJG-UHFFFAOYSA-N 477.517 5.514 5 20 JKBD C[C@@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)N1CCc2[nH]c3ccc(Br)cc3c2C1 609195876 ILXGHRRINRNLNV-LBPRGKRZSA-N 468.311 5.008 5 20 JKBD c1coc(Cn2c(SCc3nc4ccccc4c4ccccc34)nnc2N2CCCCC2)c1 629947787 UBZHNVAZSQONHO-UHFFFAOYSA-N 455.587 5.903 5 20 JKBD CC(C)Oc1ccc(NC(=S)/C(=C(/O)c2ccc([N+](=O)[O-])cc2)[n+]2ccc3c(c2)CCCC3)cc1 726573909 ICAXLNDYEJZDPC-UHFFFAOYSA-O 490.605 5.872 5 20 JKBD COC1CCN(c2ccc(NC(=S)Nc3ccc([N+](=O)[O-])cc3)cc2C(F)(F)F)CC1 727981414 MCVATTQHCSZIBR-UHFFFAOYSA-N 454.474 5.038 5 20 JKBD Cc1csc(Sc2ccc(C(=O)O[C@@H](C)C(=O)Nc3ccc(F)cc3Cl)cc2[N+](=O)[O-])n1 849119908 AGJUYSILDKVGDX-NSHDSACASA-N 495.941 5.487 5 20 JKBD CN(Cc1cc([N+](=O)[O-])ccc1Cl)C(=O)[C@@H]1CCCN(C(=O)c2ccc(Cl)c(Cl)c2)C1 914849798 ZAZPLSFEVYJNSU-CQSZACIVSA-N 484.767 5.066 5 20 JKBD CCN1C(=O)N[C@H](c2ccc(Cl)c([N+](=O)[O-])c2)C(C(=O)Nc2ccccc2C(F)(F)F)=C1C 916164993 JJIKZNOHTQOYIS-GOSISDBHSA-N 482.846 5.266 5 20 JKBD Cc1cccc(C(C)C)c1NC(=O)[C@H](C)OC(=O)c1cc([N+](=O)[O-])ccc1Oc1ccccc1 919192918 QIDHUFALYUOBLO-SFHVURJKSA-N 462.502 6.003 5 20 JKBD CC(C)N(Cc1ccc([N+](=O)[O-])cc1)Cn1nc(COc2ccccc2Cl)n(C2CC2)c1=S 919950411 KKOPAYOLCRFRCG-UHFFFAOYSA-N 488.013 5.758 5 20 JKBD C[C@H](Nc1ccc(C(=O)O[C@H](C)C(=O)Nc2ccc3ccccc3c2)cc1[N+](=O)[O-])c1ccccn1 920546489 YLNVQIRIWRMGFE-ZWKOTPCHSA-N 484.512 5.500 5 20 JKBD COc1ccc([C@H](C)C(=O)Nc2ccc(C3(NC(=O)Cc4cccc([N+](=O)[O-])c4)CCC3)cc2)cc1 1786035586 HHSZMDYXQDIQFF-IBGZPJMESA-N 487.556 5.084 5 20 JKBD O=C(CCC1CCCC1)Nc1ccc(C2(NC(=O)c3ccc(O)c([N+](=O)[O-])c3)CCC2)cc1 1787619506 MITHIOWUJICDKI-UHFFFAOYSA-N 451.523 5.019 5 20 JKBD COc1cc(CC(=O)Nc2ccc(C3(NC(=O)[C@@H]4C[C@@H]4c4ccccc4)CCC3)cc2)ccc1[N+](=O)[O-] 1790479165 AELHQRULHKVMFD-DNQXCXABSA-N 499.567 5.084 5 20 JKBD COc1cc(C(=O)Nc2ccc(C3(NC(=O)c4cc5ccsc5[nH]4)CCC3)cc2)ccc1[N+](=O)[O-] 1792166030 WYOHBYOYVUXOCD-UHFFFAOYSA-N 490.541 5.208 5 20 JKBD CC(C)[C@H](C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2ccc([N+](=O)[O-])cc2F)n[nH]1)c1ccccc1 1821049646 UTKBQCFQRQRSTF-VWNXMTODSA-N 493.539 5.203 5 20 JKBD O=C(Nc1cc([C@@H]2CCCCN2C(=O)CCc2ccoc2)[nH]n1)c1cc2cc([N+](=O)[O-])ccc2s1 1821611262 OYECACOWWDWWEE-IBGZPJMESA-N 493.545 5.064 5 20 JKBD Cc1ccc(S/C=C/C(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3ccc([N+](=O)[O-])o3)CC2)cc1 1828878845 QSMHVFIPZKHBRO-RYEVTAHJSA-N 483.590 5.036 5 20 JKBD C[C@@H](CC(=O)N1CCCC[C@@H]1C1CCN(C(=O)Cc2cc([N+](=O)[O-])ccc2F)CC1)c1ccccc1 1831504374 RLDSPPSQPAOSQN-RXFWQSSRSA-N 495.595 5.090 5 20 JKBD O=C(Oc1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2Cl)cc1)c1ccc(OCC(F)(F)F)nc1 9675341 YJOVPXDRLRGPPE-UHFFFAOYSA-N 495.797 5.056 5 20 JKBD O=C(CSc1ncc(-c2ccc(F)cc2)o1)Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1 10714826 JKGBOEIDTAQPLE-UHFFFAOYSA-N 456.480 5.243 5 20 JKBD O=C(/C=C/c1ccc([N+](=O)[O-])cc1)O[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1 10757439 MLMREOSKVBZGHO-MKGTUJQCSA-N 481.848 5.093 5 20 JKBD COc1ccc([C@@H]2CCCN2C(=O)CSc2ccc(C(F)(F)F)cc2[N+](=O)[O-])c(OC)c1 15829676 OORDGDRPGHUQQK-INIZCTEOSA-N 470.469 5.087 5 20 JKBD CCn1c(S[C@H](C)C(=O)N2CCC[C@H]2c2cccs2)nc2cc3ccccc3cc2c1=O 26581202 MWBXMNIXHILNMZ-IERDGZPVSA-N 463.628 5.475 5 20 JKBD CSc1ccc([N+](=O)[O-])c(C(=O)Nc2ccc(Cl)c(-c3nnc4n3CCCCC4)c2)c1 29714285 OMJBARXNXFDYIL-UHFFFAOYSA-N 457.943 5.207 5 20 JKBD O=C(Nc1ncc(Cc2cccc(C(F)(F)F)c2)s1)c1ccc(-n2ccnc2)c([N+](=O)[O-])c1 33229798 FQJXOLQWDXFPJS-UHFFFAOYSA-N 473.436 5.099 5 20 JKBD Cc1c(C(=O)Nc2nc(-c3cccc(C(F)(F)F)c3)cs2)cc([N+](=O)[O-])cc1[N+](=O)[O-] 71852220 ORCIXZFTURDJFS-UHFFFAOYSA-N 452.370 5.206 5 20 JKBD O=C1/C(=C/c2ccccc2)N=C(SCCOc2ccccc2[N+](=O)[O-])N1c1ccc(F)cc1 71960198 IXQVRGZSHYCYQO-SILNSSARSA-N 463.490 5.290 5 20 JKBD O=C(c1csc(-c2cccc([N+](=O)[O-])c2)n1)N1CCC(c2nc3cc(Cl)ccc3o2)CC1 215799247 CKNBSAOQJBZQNR-UHFFFAOYSA-N 468.922 5.533 5 20 JKBD C[C@@H](Nc1ccc(C(=O)N2CCC(C(=O)c3ccc(Cl)cc3)CC2)cc1[N+](=O)[O-])c1ccccn1 302989121 KYUHKHNUZBWTRT-QGZVFWFLSA-N 492.963 5.551 5 20 JKBD O=C(Nc1cc(Cl)cc(Cl)c1)[C@@H]1CCCN1C(=O)c1csc(-c2cccc([N+](=O)[O-])c2)n1 303076063 ZFLXWFZSMWUJPG-SFHVURJKSA-N 491.356 5.268 5 20 JKBD CC(C)[C@H](NC(=O)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1)c1nc(-c2cccnc2)no1 303198264 WVNYCESQPUMUSZ-NRFANRHFSA-N 493.907 5.613 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)N[C@@H](C)c2cccc(NC(=O)c3ccccc3)c2)cc1SC 482879392 QDWWQWLLVBZSON-HNNXBMFYSA-N 465.531 5.069 5 20 JKBD CN(C(=O)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1)c1cccc(OC(F)(F)F)c1 484037156 GGVPFTBDLSRLIW-UHFFFAOYSA-N 491.388 5.392 5 20 JKBD C[C@@H]1CCc2c(sc3nc([C@@H](C)Sc4nc5cc6ccccc6cc5c(=O)n4C)nc(O)c23)C1 495383252 BARAIONPMWNFNZ-ZIAGYGMSSA-N 488.638 5.775 5 20 JKBD C[C@@H]1C[C@@H](C)CN(C(=O)c2ccccc2NC(=O)c2csc(-c3cccc([N+](=O)[O-])c3)n2)C1 496355241 CSSIUXAKOXANBY-HZPDHXFCSA-N 464.547 5.089 5 20 JKBD COc1cc(C(=O)Nc2nc(-c3ccc(C)c([N+](=O)[O-])c3)cs2)ccc1OCc1cscn1 498432674 HKBCCNDOTGNKOL-UHFFFAOYSA-N 482.543 5.323 5 20 JKBD O=C(Nc1cc([N+](=O)[O-])ccc1Nc1cccc(C(F)(F)F)c1)c1ccc(=O)n(-c2ccccc2)n1 498738913 FWUGKAFKPZHPSN-UHFFFAOYSA-N 495.417 5.155 5 20 JKBD COc1cc(C(=O)N[C@H](c2ccccc2)c2nccs2)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 505086720 IRJWCTMRVAAGPT-JOCHJYFZSA-N 495.944 6.025 5 20 JKBD COc1ccc(CN[C@H]2CCOc3c(Cl)cccc32)cc1OCc1ccc([N+](=O)[O-])cc1 507904650 QTADDVLLQPNWKG-NRFANRHFSA-N 454.910 5.449 5 20 JKBD COc1cc(CNCc2cccc(Br)c2)c([N+](=O)[O-])cc1OCc1ccccc1 507946252 RGWGKTQEUCJTBS-UHFFFAOYSA-N 457.324 5.235 5 20 JKBD O=[N+]([O-])c1cc(CNC2CCN(c3ccc(C(F)(F)F)cn3)CC2)ccc1Oc1ccc(F)cc1 508104872 RXHLUOISRVIPST-UHFFFAOYSA-N 490.457 5.699 5 20 JKBD COc1cc([N+](=O)[O-])ccc1OCc1csc(N(C(C)=O)c2ccc(C(F)(F)F)cc2)n1 509071679 YALPLADNXTWIJF-UHFFFAOYSA-N 467.425 5.342 5 20 JKBD O=[N+]([O-])c1cc(CNCc2ccc(N3CCCCC3)nc2)ccc1Oc1ccccc1Cl 509610958 YECPPXDWLDYQFZ-UHFFFAOYSA-N 452.942 5.716 5 20 JKBD CC(C)C[C@H](C)n1nccc1NC(=O)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 515650571 BZCPAPROWWLUNE-HNNXBMFYSA-N 467.492 5.272 5 20 JKBD CO[C@H](CNC(=O)C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)c1ccccc1 518330640 DVKUWLVXWJHRTF-QFXGEWDLSA-N 473.554 5.639 5 20 JKBD Cn1cc(C(=O)Nc2ccc(Oc3ccc(C(F)(F)F)cc3)nc2)c(-c2ccc([N+](=O)[O-])cc2)n1 519125599 RGLQEBIJBOICKO-UHFFFAOYSA-N 483.406 5.454 5 20 JKBD O=C(CCCn1c(=O)oc2cc([N+](=O)[O-])ccc21)N[C@H](Cc1ccccc1Cl)c1ccccc1 519494683 SLVBRQUOMJOUID-OAQYLSRUSA-N 479.920 5.037 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Br)[C@H](NCc1cc(F)ccc1F)c1ccccc1 521535804 KZLXGCOJGNIJFR-HXUWFJFHSA-N 476.277 5.105 5 20 JKBD COc1ccc(CC[C@H]2CCCCN2C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)cc1OC 523565698 NBJNBGQFNATSOR-GOSISDBHSA-N 454.548 5.454 5 20 JKBD Cn1c(CC(=O)Nc2cc([N+](=O)[O-])ccc2Nc2cccc(C(F)(F)F)c2)nnc1-c1ccccc1 551761495 WBFOOMOLPDALTR-UHFFFAOYSA-N 496.449 5.334 5 20 JKBD Cc1c(NC(=O)[C@@H](C)Sc2nnc(COc3ccc(Cl)cc3Cl)o2)cccc1[N+](=O)[O-] 598877393 AXHFTUZSNWLOHP-LLVKDONJSA-N 483.333 5.291 5 20 JKBD COc1cc(NC(=O)c2cc3cc([N+](=O)[O-])ccc3o2)c(C(=O)N2[C@@H](C)CCC[C@@H]2C)cc1OC 603738322 VBLANSPRQOISHD-GJZGRUSLSA-N 481.505 5.014 5 20 JKBD COc1ccc(OC2CCN(C(=O)c3ccc(Oc4ccc(Cl)cc4[N+](=O)[O-])cc3)CC2)cc1 603816422 GIJWWONVZXHDAL-UHFFFAOYSA-N 482.920 5.733 5 20 JKBD CO[C@@H](C)C(=O)Nc1cccc(NC(=O)c2cc([N+](=O)[O-])ccc2Sc2ccc(Cl)cc2)c1 604449165 ZFCIZLDRZDDUTM-AWEZNQCLSA-N 485.949 5.625 5 20 JKBD C[C@H]1CCCN(c2ccc(C(=O)N3CCC[C@H](c4nc(-c5ccc(F)cc5)no4)C3)cc2[N+](=O)[O-])C1 608817229 GNBXDJPXNDXMMD-PXNSSMCTSA-N 493.539 5.040 5 20 JKBD O=C(NCc1c(F)cccc1Cl)c1ccc(C(=O)NCc2c(F)cccc2Cl)c([N+](=O)[O-])c1 609043700 MKWMFHVCLGISBH-UHFFFAOYSA-N 494.281 5.040 5 20 JKBD COc1ccc(CC(=O)N(Cc2ccccc2OC(F)(F)F)C2CCCC2)cc1[N+](=O)[O-] 609175926 PIQCPZBALNJYGK-UHFFFAOYSA-N 452.429 5.016 5 20 JKBD CCN(CCc1ccccn1)C(=O)C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1 746834762 VVKWULGJYPITSN-JZJYNLBNSA-N 472.570 5.621 5 20 JKBD O=C1c2cc(Cl)ccc2N[C@@H](c2ccc(Br)c([N+](=O)[O-])c2)N1c1ccncc1 877852433 AERVBUWYYLIXTA-GOSISDBHSA-N 459.687 5.177 5 20 JKBD CC(C)Cc1ccc([C@@H](NC(=O)C(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)c2cccs2)cc1 915740942 ZRZDEFTXCQCTMZ-OAQYLSRUSA-N 471.966 5.353 5 20 JKBD CC(C)N(Cc1nnc(-c2cccc([N+](=O)[O-])c2)o1)C(=O)[C@H](C)Oc1cccc(C(C)(C)C)c1 916036338 KCSXZEWYGPAKTK-KRWDZBQOSA-N 466.538 5.147 5 20 JKBD CCc1cccc(CC)c1NC(=S)Nc1ccc(NS(=O)(=O)c2ccc(C)c([N+](=O)[O-])c2)cc1 916119953 CIZMTLBXPCSCHJ-UHFFFAOYSA-N 498.630 5.638 5 20 JKBD CC1=C(C(=O)Nc2ccccc2C(F)(F)F)[C@H](c2ccc([N+](=O)[O-])cc2)NC(=O)N1CCC(C)C 916165665 HYRAXIICNNLXGT-NRFANRHFSA-N 490.482 5.639 5 20 JKBD Cc1ccc(O)c[n+]1/C(C(=S)Nc1c(C(C)C)cccc1C(C)C)=C(/O)c1cccc([N+](=O)[O-])c1 920486985 RQLTWXYUEBWDRF-UHFFFAOYSA-O 492.621 6.466 5 20 JKBD Cc1ccc(-c2noc([C@@H](C)OC(=O)c3ccc(N[C@H](C)c4ccccn4)c([N+](=O)[O-])c3)n2)cc1F 920549183 WFKRQRHKWBEVAZ-HZPDHXFCSA-N 491.479 5.578 5 20 JKBD O=C(NC1(c2ccc(NC(=O)c3ccc([N+](=O)[O-])o3)cc2)CCC1)c1cccc(-c2ccccc2)n1 1785748960 QLPWUIDFDDTNOR-UHFFFAOYSA-N 482.496 5.311 5 20 JKBD O=C(NC1(c2ccc(NC(=O)C3(c4cccc([N+](=O)[O-])c4)CCC3)cc2)CCC1)[C@@H]1C[C@]1(F)Cl 1790476331 BRAJDANBASPMQG-NBGIEHNGSA-N 485.943 5.075 5 20 JKBD Cc1cc(O)c([N+](=O)[O-])cc1C(=O)Nc1ccc(C2(NC(=O)C[C@H]3C[C@@H]4CC[C@H]3C4)CCC2)cc1 1790808000 OEOLFQYSTZOGGI-CEXWTWQISA-N 477.561 5.183 5 20 JKBD Cc1cc2cccc(C(=O)N3[C@H]4CC[C@@H]3C[C@H](NC(=O)c3cc5cc([N+](=O)[O-])ccc5s3)C4)c2[nH]1 1797509723 YXEKGPHYSRHBGX-REPLKXPHSA-N 488.569 5.165 5 20 JKBD Cc1cc(O)c([N+](=O)[O-])cc1C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cccc3ccccc23)[nH]n1 1821345222 GTOQVDMQJFOSCF-JOCHJYFZSA-N 499.527 5.105 5 20 JKBD O=C(Nc1cc([C@@H]2CCCCN2C(=O)[C@H]2CC=CCC2)[nH]n1)c1cc2cc([N+](=O)[O-])ccc2s1 1821610684 IYCJZDSHJCYJND-KXBFYZLASA-N 479.562 5.195 5 20 JKBD CC[C@H](C)CC(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cc(Cl)cc([N+](=O)[O-])c2C)CC1 1824346820 NAGPZSBEHRIYPO-KKSFZXQISA-N 464.006 5.226 5 20 JKBD Cc1cc(Cl)cc(C(=O)N2CCC([C@@H]3CCCCN3C(=O)c3cc(F)cc([N+](=O)[O-])c3)CC2)c1 1830616184 UVXDJFGUKFZWTM-QHCPKHFHSA-N 487.959 5.243 5 20 JKBD Cc1cc(O)c([N+](=O)[O-])cc1C(=O)N1CCCC[C@H]1C1CCN(C(=O)CC2CCC(C)(C)CC2)CC1 1830788690 BYEYHXXWSNBPDG-QHCPKHFHSA-N 499.652 5.449 5 20 JKBD Cc1ccc(C(=O)N2CCC([C@H]3CCCCN3C(=O)c3cc4cc([N+](=O)[O-])ccc4s3)CC2)nc1 1831060017 MTFTYLGCSZDYGR-JOCHJYFZSA-N 492.601 5.060 5 20 JKBD CC(C)(C)CCCCCC(=O)N1CCCC[C@H]1C1CCN(C(=O)c2ccc([N+](=O)[O-])[nH]2)CC1 1831578049 VXUFQUFXBXGNLH-NRFANRHFSA-N 460.619 5.153 5 20 JKBD COc1ccc([N+](=O)[O-])cc1NC(=O)[C@H](C)Sc1nnc(-c2cccs2)n1-c1ccccc1 3468564 PXLGJDXELULFPL-AWEZNQCLSA-N 481.559 5.032 5 20 JKBD CCOc1ccc([C@H](C)N[C@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2ccccc2)cc1 11708081 GIEKIMWQFJMADS-HJPURHCSSA-N 453.926 5.678 5 20 JKBD CCOc1cc(C(=O)Nc2ccc(NC(=O)c3ccco3)cc2C(F)(F)F)c([N+](=O)[O-])cc1OC 22182182 GFHVZLVBOHQZIF-UHFFFAOYSA-N 493.394 5.119 5 20 JKBD Cn1c(SCC(=O)c2ccc(NC(=O)C(C)(C)C)cc2)nc2cc3ccccc3cc2c1=O 22254269 LMQXDJLBUQMOLE-UHFFFAOYSA-N 459.571 5.046 5 20 JKBD O=C(Nc1cccc(NC(=O)c2cccs2)c1)c1ccc(NCc2ccccc2)c([N+](=O)[O-])c1 24028454 PJBLJLRPNOHESH-UHFFFAOYSA-N 472.526 5.773 5 20 JKBD COc1cc(C)c(CN(C)C(=O)c2ccccc2C(=O)c2ccc(SC)c([N+](=O)[O-])c2)cc1OC 25766456 UVJNVJVFJMLCNP-UHFFFAOYSA-N 494.569 5.146 5 20 JKBD O=C1CCc2cc(F)c(NC(=O)c3ccc(Sc4nc5ccccc5s4)c([N+](=O)[O-])c3)cc2N1 32048487 BWONUIZDFHLGHG-UHFFFAOYSA-N 494.529 5.632 5 20 JKBD O=[N+]([O-])c1ccc(OCCCSc2nnc(-c3c[nH]c4ccccc34)n2C[C@@H]2CCCO2)cc1 71971067 GCPIVXAHJNIJKC-IBGZPJMESA-N 479.562 5.075 5 20 JKBD O=C(NCc1cccc(COc2ccccc2)c1)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-] 108389088 DGVFYHXNCFJCRC-UHFFFAOYSA-N 460.408 5.045 5 20 JKBD C[C@@H](Nc1ccc(C(=O)Nc2cc(F)ccc2Sc2nccn2C)cc1[N+](=O)[O-])c1ccccn1 116436595 RUBHXZZSFKHCRK-OAHLLOKOSA-N 492.536 5.439 5 20 JKBD O=C(c1csc(-c2cccc([N+](=O)[O-])c2)n1)N1CCCN(Cc2ccc(C(F)(F)F)cc2)CC1 302977514 CIBCBYZWXSSCRV-UHFFFAOYSA-N 490.507 5.085 5 20 JKBD O=C(CN(Cc1ccc(Cl)cc1)C(=O)c1c[nH]c2cc([N+](=O)[O-])ccc12)Nc1ccccc1F 488064356 GXIOIKRNZDIUOC-UHFFFAOYSA-N 480.883 5.150 5 20 JKBD Cc1cc(N[C@@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Br)c2ccccc2)ccc1F 488460411 PVTVRQCHCVHABB-HXUWFJFHSA-N 458.287 5.597 5 20 JKBD C[C@H]1CCCN(C(=O)C2CCN(C(=O)c3ccc(Oc4ccc(Cl)cc4[N+](=O)[O-])cc3)CC2)C1 500281209 LPHXUVNIMDZLFZ-KRWDZBQOSA-N 485.968 5.151 5 20 JKBD C[C@@H](Sc1nc(-c2cccs2)c(-c2cccs2)[nH]1)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 501339221 XSKXSNYISCRYSL-GFCCVEGCSA-N 481.584 6.678 5 20 JKBD Cc1cc(NC(=O)c2ccc(N[C@H](C)c3ccccn3)c([N+](=O)[O-])c2)ccc1Br 506008345 BAYAXNZXYQOCTQ-CQSZACIVSA-N 455.312 5.486 5 20 JKBD COc1cc(C(=O)Nc2ccc(OC3CCCC3)c(Cl)c2)c([N+](=O)[O-])cc1OC(F)F 508257338 MNZCDXAORFWAHL-UHFFFAOYSA-N 456.829 5.432 5 20 JKBD Cc1nn(C)c(C(=O)N2C[C@@H](c3ccccc3Cl)c3c([nH]c4ccccc34)[C@H]2C)c1[N+](=O)[O-] 512291908 DUOKABIYALADEN-PBHICJAKSA-N 463.925 5.120 5 20 JKBD Cc1ccc([C@@H](NC(=O)CCCn2c(=O)oc3cc([N+](=O)[O-])ccc32)c2ccc(F)cc2Cl)cc1 517436866 WVWSELWTRBMHEZ-XMMPIXPASA-N 497.910 5.290 5 20 JKBD CCCN(Cc1nnc(-c2ccccc2Cl)o1)C(=O)c1csc(-c2cccc([N+](=O)[O-])c2)n1 522091981 VMCHMAMCGWQEPS-UHFFFAOYSA-N 483.937 5.474 5 20 JKBD CCCOc1cc(NC(=O)c2cc(C(C)C)nc3onc(C)c23)c([N+](=O)[O-])cc1OCCC 590852961 RLQBLKZQDGRHSP-UHFFFAOYSA-N 456.499 5.393 5 20 JKBD CN(C)C(=O)c1cc(NC(=O)c2ccc(NCc3ccccc3Cl)c([N+](=O)[O-])c2)ccc1Cl 603623755 KVQNNJOWNVLWJM-UHFFFAOYSA-N 487.343 5.468 5 20 JKBD COc1ccc(NC(=O)[C@H](C)Oc2ccc(Cl)cc2[N+](=O)[O-])cc1NC(=O)c1cccc(F)c1 604446415 NFVFOYUOYBBKTB-ZDUSSCGKSA-N 487.871 5.054 5 20 JKBD C[C@@H](Nc1ccc(C(=O)Nc2c(-c3ccccc3)ncn2C2CC2)cc1[N+](=O)[O-])c1ccccn1 604544462 KQENDMMLLHIRDR-QGZVFWFLSA-N 468.517 5.614 5 20 JKBD O=C(c1c2c(nc3ccccc13)/C(=C/c1cccc([N+](=O)[O-])c1)CCC2)N1CCC[C@H](c2cc[nH]n2)C1 608813476 XEMVNURNRNJHBW-UZLGTAQGSA-N 493.567 5.763 5 20 JKBD COc1ccc(CC(=O)Nc2cccc(NC(=O)c3cccc(C(F)(F)F)c3)c2)cc1[N+](=O)[O-] 609141529 QPRNIFYSTKWLCL-UHFFFAOYSA-N 473.407 5.056 5 20 JKBD O=C(CNC(=O)c1c(Cl)cccc1[N+](=O)[O-])Nc1ccc(Sc2ccc(Cl)cc2)cc1 609391851 JDBZSCJFCHMOJV-UHFFFAOYSA-N 476.341 5.421 5 20 JKBD O=C(Nc1cccc(NC(=O)c2cc(F)c(F)cc2[N+](=O)[O-])c1)Nc1cccc(C(F)(F)F)c1 727710688 YUTSZQPKZJHZQY-UHFFFAOYSA-N 480.349 5.788 5 20 JKBD C[C@@H]1CC(=O)c2c(OC(=O)C3CCN(c4ccc(C(F)(F)F)cc4[N+](=O)[O-])CC3)ccc(F)c21 728289578 PHVAFFMLRDZQPH-GFCCVEGCSA-N 480.414 5.265 5 20 JKBD O=C(O[C@H](c1ccccc1)c1cccnc1)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 728419584 VKFVEXPQCKRRSH-HSZRJFAPSA-N 485.462 5.558 5 20 JKBD COc1ccccc1[C@H](C)CC(=O)O[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1 728657705 CKHQXOPJYSUNMX-GYCJOSAFSA-N 482.920 5.674 5 20 JKBD C[C@H](OC(=O)c1csc(-c2ccc([N+](=O)[O-])cc2)n1)c1ccccc1NC(=O)c1ccccc1 748020236 DKWAAAJKMYXCSD-INIZCTEOSA-N 473.510 5.889 5 20 JKBD CC(=O)N(c1ccc(C)c(C)c1)c1nc(COC(=O)/C=C\c2ccc([N+](=O)[O-])cc2)cs1 798127512 JGGZWGDWCPPGLV-XFFZJAGNSA-N 451.504 5.109 5 20 JKBD O=C(CCc1nnc(-c2ccsc2)o1)Oc1ccc2c(-c3ccc([N+](=O)[O-])cc3)cc(=O)oc2c1 879523671 MJMPENMLRWFBHX-UHFFFAOYSA-N 489.465 5.018 5 20 JKBD O=C(Nc1ccccc1C(=O)NCc1cccnc1OC1CCCC1)c1ccc([N+](=O)[O-])cc1Cl 915201634 XDVLKXLJTAMBCS-UHFFFAOYSA-N 494.935 5.147 5 20 JKBD O=C(COc1ccc(C2SCCCS2)cc1)Nc1cc([N+](=O)[O-])ccc1OC(F)F 915283090 GZPMXJLVCJEJJH-UHFFFAOYSA-N 456.492 5.082 5 20 JKBD CSc1ccc([N+](=O)[O-])c(C(=O)Nc2ccccc2C(=O)Nc2cccc(C(F)(F)F)c2)c1 920819867 NXWRERGPGXGNIB-UHFFFAOYSA-N 475.448 5.840 5 20 JKBD CC(C)c1nc2ccc(NC(=O)c3cc([N+](=O)[O-])ccc3I)cc2s1 921156989 DWBFSRQPXHQCQA-UHFFFAOYSA-N 467.288 5.185 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)[C@H](F)c3ccccc3)CCC2)cc1)c1cc(F)cc([N+](=O)[O-])c1 1790695215 HSXPUXDIIKVGEQ-JOCHJYFZSA-N 465.456 5.192 5 20 JKBD O=C(Cc1ccc([N+](=O)[O-])cc1F)Nc1ccc(C2(NC(=O)[C@H](F)c3ccccc3)CCC2)cc1 1791184331 OOUDHIPVHDWBQL-XMMPIXPASA-N 479.483 5.121 5 20 JKBD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2cc3c(Cl)cccc3s2)[nH]n1)c1ccc([N+](=O)[O-])[nH]1 1820365009 MCLKRTKGYSDRHY-INIZCTEOSA-N 498.952 5.134 5 20 JKBD O=C(Cc1cc(F)ccc1[N+](=O)[O-])N1CCC([C@H]2CCCCN2C(=O)c2cc3ccoc3s2)CC1 1827411175 AIKUKISUYUNXMH-HXUWFJFHSA-N 499.564 5.018 5 20 JKBD O=C(N1CCC([C@H]2CCCCN2C(=O)C2(c3cccc([N+](=O)[O-])c3)CCC2)CC1)C1(F)CCCCC1 1830293154 SVUUKQNRBCHOEL-XMMPIXPASA-N 499.627 5.309 5 20 JKBD O=C(Cc1cccs1)N1CCC([C@@H]2CCCCN2C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)CC1 1831061431 SOONIBSMTMOMAF-NRFANRHFSA-N 497.642 5.347 5 20 JKBD Cc1csc(Sc2ccc([N+](=O)[O-])cc2C(=O)OCC(=O)Nc2ccccc2C(F)(F)F)n1 3520609 MNGPTAXCUFXTBJ-UHFFFAOYSA-N 497.476 5.325 5 20 JKBD Cc1c(Cl)cccc1-n1c(S[C@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2)nnc1-c1ccncc1 10318045 PWPGBVVHKZSTTD-OAHLLOKOSA-N 494.964 5.319 5 20 JKBD COc1ccc([N+](=O)[O-])cc1C(=O)Nc1cccc(C(=O)Nc2cccc(C(F)(F)F)c2)c1 18086334 UODJNOGWAHXVLQ-UHFFFAOYSA-N 459.380 5.127 5 20 JKBD Cc1nc(CSc2ccc(C(=O)OCc3nnc(-c4ccc([N+](=O)[O-])cc4)o3)cc2)cs1 23512576 NUBIGYJCVKZMIN-UHFFFAOYSA-N 468.516 5.059 5 20 JKBD CCn1c(S[C@@H](C)C(=O)Nc2cc([N+](=O)[O-])ccc2OC)nnc1-c1ccc(C(C)(C)C)cc1 23554468 NFPFRNXOARZHBD-HNNXBMFYSA-N 483.594 5.299 5 20 JKBD CCOc1cc2c(cc1CN[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1)O[C@H](C)C2 25704097 WYLGBWNXKRSWSN-PUAOIOHZSA-N 495.963 5.440 5 20 JKBD CN(Cc1nccn1C(F)F)C(=O)c1cc([N+](=O)[O-])ccc1Sc1ccc(Cl)cc1 29181665 WYZQQOQGDXPSMO-UHFFFAOYSA-N 452.870 5.263 5 20 JKBD CS(=O)(=O)Nc1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2Sc2ccccc2)cc1Cl 29315916 XGFSCJUGCVFXGJ-UHFFFAOYSA-N 477.951 5.023 5 20 JKBD CC(=O)N(c1nc(COc2ccc([N+](=O)[O-])cc2C(F)(F)F)cs1)c1c(C)cc(C)cc1C 72033586 YNIIGAZIZBBQNE-UHFFFAOYSA-N 479.480 6.259 5 20 JKBD Cc1cc(C(=O)N2CCCC2)ccc1NC(=O)c1ccc(NCc2ccccc2Cl)c([N+](=O)[O-])c1 216195279 DOQCQICDOZSREB-UHFFFAOYSA-N 492.963 5.657 5 20 JKBD CN(C)C(=O)c1cccc(C(=O)Nc2cc([N+](=O)[O-])ccc2Nc2cccc(C(F)(F)F)c2)c1 482039519 METYCWYHRMMLBI-UHFFFAOYSA-N 472.423 5.311 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)N[C@H](C)c2ccc(OCc3ccc(F)cc3)cc2)cc1SC 485564821 XOYNVEWTFAYUFU-OAHLLOKOSA-N 470.522 5.534 5 20 JKBD COc1ccc(CCC2CCN(C(=O)c3csc(-c4cccc([N+](=O)[O-])c4)n3)CC2)cc1 502548755 OSYKJRCTJRXTAD-UHFFFAOYSA-N 451.548 5.212 5 20 JKBD Cc1ccc2nc([C@@H]3CCCN(C(=O)c4ccc(Sc5nc(C)cs5)c([N+](=O)[O-])c4)C3)[nH]c2c1 502983861 KQPGPZTYOHGAPR-QGZVFWFLSA-N 493.614 5.715 5 20 JKBD C[C@@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)N(C)[C@@H]1CCSc2ccc(Br)cc21 504567168 ZILOENQWSBAVBM-SJKOYZFVSA-N 467.410 5.533 5 20 JKBD O=[N+]([O-])c1cc(S(=O)(=O)Nc2ccccc2)ccc1N[C@H](c1ccccc1)c1nccs1 505571423 ZHPSLBZPSLRMLJ-OAQYLSRUSA-N 466.544 5.054 5 20 JKBD CN(C)c1ccc(C(=O)c2ccccc2C(=O)Nc2ccc(-c3cnc(C4CC4)o3)cc2)cc1[N+](=O)[O-] 509683043 GFQLHAROWWONIE-UHFFFAOYSA-N 496.523 5.677 5 20 JKBD O=C(Nc1cccc(CNCc2ccc(Oc3ccc(F)cc3)c([N+](=O)[O-])c2)c1)c1ccccn1 513647938 MAMPEFWSTKRYCB-UHFFFAOYSA-N 472.476 5.463 5 20 JKBD Cn1cc(C(=O)Nc2ccc(NC(=O)Nc3ccc(Cl)cc3)cc2)c(-c2ccc([N+](=O)[O-])cc2)n1 516357564 XRHOEGDXSBRMMX-UHFFFAOYSA-N 490.907 5.545 5 20 JKBD Cn1ccnc1[C@@H](NCc1ccc(Oc2ccc(F)cc2)c([N+](=O)[O-])c1)c1ccccc1F 520210223 BVGIKHGLJSUFAL-QHCPKHFHSA-N 450.445 5.278 5 20 JKBD O=C(Nc1ccc(NC(=O)c2ccccc2F)cc1C(F)(F)F)c1ccc([N+](=O)[O-])s1 520490085 KCXIZSBKPKWTML-UHFFFAOYSA-N 453.373 5.319 5 20 JKBD COc1cc2c(cc1OC)CN(Cc1ccccc1NC(=O)c1ccc(Cl)cc1[N+](=O)[O-])CC2 520869758 ZFLSNUKMLYAXTO-UHFFFAOYSA-N 481.936 5.076 5 20 JKBD Cc1nc([N+](=O)[O-])cn1CC(=O)N(c1ccc(Oc2ccccc2)cc1)c1nc2ccccc2s1 520963865 IUFFFHBDNFQCBU-UHFFFAOYSA-N 485.525 5.867 5 20 JKBD Cc1ccc(C(=O)Nc2cccc(C(F)(F)F)c2)cc1NC(=O)c1ccc([N+](=O)[O-])cc1Cl 521288426 XTCCRBHIIWVZQF-UHFFFAOYSA-N 477.826 6.080 5 20 JKBD COc1ccc(Cn2ncc(C)c2NC(=O)c2ccc(Nc3ccccc3)c([N+](=O)[O-])c2)cc1OC 524464766 JBNUEZCXXFQKAY-UHFFFAOYSA-N 487.516 5.161 5 20 JKBD CN(Cc1cccc(F)c1)C(=O)C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1 603469412 CKSMAHSKMLPLLX-CPNJWEJPSA-N 461.518 5.933 5 20 JKBD O=C(C[C@H](NC(=O)c1ccccc1Cl)c1ccccc1)Nc1cc([N+](=O)[O-])ccc1OC(F)F 603638320 ATXWJMZPKIHYSU-SFHVURJKSA-N 489.862 5.350 5 20 JKBD CCN(Cc1ccc(OCc2cccs2)c(OC)c1)C(=O)c1ccc(N2CCCC2)c([N+](=O)[O-])c1 603944868 RWDOHKAQTBONDG-UHFFFAOYSA-N 495.601 5.506 5 20 JKBD COc1ccc2c(c1)CCCN(C(=O)c1ccccc1NC(=O)c1ccc([N+](=O)[O-])cc1Cl)C2 609131982 RVJKZBRPYZEMHV-UHFFFAOYSA-N 479.920 5.098 5 20 JKBD CCOc1ccc(OC)cc1NC(=O)C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1 609182410 MYUCCIIJXBCUOY-JXAWBTAJSA-N 489.553 6.181 5 20 JKBD COC(=O)c1ccc(NC(=O)C/C(=C\c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)s1 610423188 RRASCHYEAVISIR-NTCAYCPXSA-N 479.539 5.622 5 20 JKBD COc1cc(C(=O)O[C@H]2CCc3ccc(Cl)cc32)c([N+](=O)[O-])cc1OCc1cscn1 727959745 DQRREPZAIFLHRE-SFHVURJKSA-N 460.895 5.137 5 20 JKBD O=[N+]([O-])c1ccc(OCc2nnc(-c3ccc(Br)s3)o2)c(C(F)(F)F)c1 747062851 TTZINXQDFKAJCS-UHFFFAOYSA-N 450.192 5.067 5 20 JKBD Cc1sc(NC(=O)c2csc(-c3ccc([N+](=O)[O-])cc3)n2)c(C(N)=O)c1-c1ccccc1 747635042 SYEBZSTZFIFPFG-UHFFFAOYSA-N 464.528 5.106 5 20 JKBD Cc1ccc(S(=O)(=O)c2ccc(COC(=O)c3csc(-c4ccc([N+](=O)[O-])cc4)n3)cc2)cc1 747954730 KWLHJWTXWXBTAR-UHFFFAOYSA-N 494.550 5.217 5 20 JKBD O=C(COC(=O)c1csc(-c2ccc([N+](=O)[O-])cc2)n1)N[C@@H](c1ccc(F)cc1)C1CCCC1 747954793 LFKQEJJTYQEESC-JOCHJYFZSA-N 483.521 5.062 5 20 JKBD CC(=O)N(c1ccc(F)cc1)c1nc(COC(=O)c2csc(-c3ccc([N+](=O)[O-])cc3)n2)cs1 747954906 OLPIMTQUWKWFIH-UHFFFAOYSA-N 498.517 5.356 5 20 JKBD O=C(OCC1CCN(c2ncccc2[N+](=O)[O-])CC1)[C@H]1CC=CC[C@@H]1c1nc2ccccc2s1 749358646 MWNBXAXNSNJYHC-OALUTQOASA-N 478.574 5.109 5 20 JKBD COc1ccc([C@@H]2[C@H](C(=O)Nc3cc([N+](=O)[O-])c(F)cc3F)CCC(=O)N2c2ccc(C)cc2)cc1 897500588 ZTHVIPNXNHCCIE-KBMIEXCESA-N 495.482 5.313 5 20 JKBD Cc1nc(C(F)(F)F)ccc1C(=O)Nc1cc(Cl)c([N+](=O)[O-])cc1OCc1ccccc1 914466248 MQDDPYSJGYKDCA-UHFFFAOYSA-N 465.815 5.802 5 20 JKBD O=C(Cn1ncc2ccc([N+](=O)[O-])cc21)Nc1sc2c(c1-c1nc3ccccc3[nH]1)CCCC2 915279668 ZIWKXSDQZKCTSJ-UHFFFAOYSA-N 472.530 5.067 5 20 JKBD O=C(CCc1ccccc1)N1CCC(Nc2cc(Cl)c(C(F)(F)F)cc2[N+](=O)[O-])CC1 917076614 SKVXNDUKGVQANH-UHFFFAOYSA-N 455.864 5.303 5 20 JKBD CCCC(=O)Nc1ccc(CNC(=O)c2ccccc2NC(=O)c2ccc([N+](=O)[O-])cc2Cl)cc1 918584569 JNJPEYBPSDGAQG-UHFFFAOYSA-N 494.935 5.169 5 20 JKBD O=C(O[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1)c1cccn1Cc1cccs1 919624671 GGGYTMOCNBVMQU-JOCHJYFZSA-N 495.944 5.696 5 20 JKBD COCCOc1ccc(N[C@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2ccccc2)cc1F 920060735 SPXMKRHFVULRNW-QFIPXVFZSA-N 473.888 5.204 5 20 JKBD C[C@@H](Nc1ccc(C(=O)OCc2coc(-c3cccc(F)c3)n2)cc1[N+](=O)[O-])c1ccccn1 920543642 GSKMHOBDVXHGRY-OAHLLOKOSA-N 462.437 5.314 5 20 JKBD C[C@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)OCc1cccc(C(=O)Nc2ccccc2)c1 920776920 BEFYFSPBIZSSSA-HNNXBMFYSA-N 454.866 5.011 5 20 JKBD O=C(Cc1cc(F)ccc1[N+](=O)[O-])NC1(c2ccc(NC(=O)c3cccc4cccnc34)cc2)CCC1 1788912772 ZTBCGJACRTVBPQ-UHFFFAOYSA-N 498.514 5.273 5 20 JKBD O=C(CSc1ccccc1[N+](=O)[O-])NC1(c2ccc(NC(=O)c3ccoc3Cl)cc2)CCC1 1790207821 QQJKBPRXVQUHTJ-UHFFFAOYSA-N 485.949 5.381 5 20 JKBD COc1ccc(C(=O)Nc2ccc(C3(NC(=O)/C=C/c4ccccc4[N+](=O)[O-])CCC3)cc2)cc1 1790302855 DAKUIVUHVNYVJV-CXUHLZMHSA-N 471.513 5.065 5 20 JKBD O=C(NC1(c2ccc(NC(=O)C3(c4cccc([N+](=O)[O-])c4)CCC3)cc2)CCC1)[C@@H]1CCCS1 1790476649 PZARTZMHAZAFEC-QFIPXVFZSA-N 479.602 5.046 5 20 JKBD Cc1ccc(CC(=O)Nc2ccc(C3(NC(=O)[C@@]4(F)CCCC=C4F)CCC3)cc2)cc1[N+](=O)[O-] 1790523323 CSBUGHHQAMAGPD-AREMUKBSSA-N 483.515 5.325 5 20 JKBD CC1(C(=O)N2CC[C@H](CNC(=O)c3cc4cc([N+](=O)[O-])ccc4s3)[C@H]2c2cccnc2)CCCC1 1812304867 VJQGPBYBROZLMI-WZONZLPQSA-N 492.601 5.104 5 20 JKBD O=C(CCc1cccc([N+](=O)[O-])c1)N1CCC([C@@H]2CCCCN2C(=O)c2ccc(C3CC3)cc2)CC1 1830746621 KDYIYTXDMRSTHW-MHZLTWQESA-N 489.616 5.338 5 20 JKBD CC(C)OCc1c(C(=O)O[C@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)oc2ccccc12 10915139 XJWIBGDVGOLYSQ-CYBMUJFWSA-N 460.870 5.103 5 20 JKBD O=C(COC(=O)c1ccccc1C(=O)c1ccc(Cl)c([N+](=O)[O-])c1)Nc1ccc(F)c(Cl)c1 11029319 WUTYRTZFQUVSCL-UHFFFAOYSA-N 491.258 5.067 5 20 JKBD COc1ccc(NC(C)=O)cc1NC(=O)c1ccc(NCc2ccccc2Cl)c([N+](=O)[O-])c1 14793111 JPEIKGYIMZDYRH-UHFFFAOYSA-N 468.897 5.080 5 20 JKBD COc1ccc(OC)c(NC(=O)c2ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])c(OC)c2)c1 15082784 WBBTUTFMGBWPJO-UHFFFAOYSA-N 458.854 5.319 5 20 JKBD Cc1ccc(NC(=O)[C@H](Sc2nnc(-c3ccoc3C)n2C)c2ccccc2)c([N+](=O)[O-])c1 21620418 KQEKAZJCZOEVOD-HXUWFJFHSA-N 463.519 5.072 5 20 JKBD CCn1c(S[C@@H](C)C(=O)Nc2cc(Cl)ccc2OC)nc2cc3ccccc3cc2c1=O 22178137 IADHMSOFTPNAOD-AWEZNQCLSA-N 467.978 5.351 5 20 JKBD CCn1c(SCC(=O)N(C)Cc2ccc(Cl)s2)nc2cc3ccccc3cc2c1=O 22178758 IUGHEQZATCBDQR-UHFFFAOYSA-N 458.008 5.035 5 20 JKBD COc1cc([N+](=O)[O-])ccc1NC(=O)CSc1ncnc2cc(-c3ccc(F)cc3)sc12 23550592 XJQXTBLONPFBFR-UHFFFAOYSA-N 470.507 5.145 5 20 JKBD O=C(OCC(=O)N1N=C(c2cc3ccccc3o2)C[C@@H]1c1ccco1)c1cc([N+](=O)[O-])ccc1Cl 24459184 LYCFUBBOEFAHFK-LJQANCHMSA-N 493.859 5.122 5 20 JKBD Cc1c(NC(=O)[C@H](C)OC(=O)c2ccc(Oc3ccc(C(F)(F)F)cn3)cc2)cccc1[N+](=O)[O-] 28396530 YSMWCAWYYQPVNS-AWEZNQCLSA-N 489.406 5.293 5 20 JKBD O=[N+]([O-])c1ccc(-c2nnc(CSc3nnc(-c4ccc(F)cc4)n3Cc3ccccc3)o2)cc1 29828414 BDBOYENTCTWZRP-UHFFFAOYSA-N 488.504 5.383 5 20 JKBD O=C(c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1)N1CCN(Cc2ccsc2)CC1 30541370 CRFAFDROBGCGJV-UHFFFAOYSA-N 457.939 5.060 5 20 JKBD CCOc1cc(C(=O)Nc2nc(-c3ccc(Cl)cc3Cl)cs2)c([N+](=O)[O-])cc1OC 45438652 IZKZWODVJCDNIX-UHFFFAOYSA-N 468.318 5.685 5 20 JKBD C[C@@H](Nc1ccc2nc(C3CC3)sc2c1)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 195733782 FCZMMOVIAMRARZ-SNVBAGLBSA-N 450.442 5.540 5 20 JKBD Cc1ccccc1-c1nnc(SCCCOc2ccc([N+](=O)[O-])cc2)n1Cc1ccco1 302950955 KCLRGGJTNNNANV-UHFFFAOYSA-N 450.520 5.364 5 20 JKBD COc1ccc(CCN(Cc2ccccc2)C(=O)Cn2c3ccccc3c(=O)c3ccccc32)cc1 303168964 QVVXFURXKURBCJ-UHFFFAOYSA-N 476.576 5.435 5 20 JKBD O=C(Nc1ccc(OC(F)F)cc1OC(F)F)c1ccc(NCc2ccccc2)c([N+](=O)[O-])c1 478958787 LDEGDBNOEVJGQI-UHFFFAOYSA-N 479.386 5.662 5 20 JKBD COc1cc(C)ccc1Oc1ccc(F)cc1NC(=O)c1cc(SC)c(OC)cc1[N+](=O)[O-] 483467119 SOGRXLOCJLUSDR-UHFFFAOYSA-N 472.494 5.826 5 20 JKBD O=C(Nc1cccc(COCC(F)(F)C(F)F)c1)c1csc(-c2ccc([N+](=O)[O-])cc2)n1 498612103 FROUJGCXFNVGBB-UHFFFAOYSA-N 469.416 5.388 5 20 JKBD CCOc1ccc([C@H]2CCCN2C(=O)c2cc(OC)c(OCc3cscn3)cc2[N+](=O)[O-])cc1 512305369 DHACKOIVCQNYGM-HXUWFJFHSA-N 483.546 5.015 5 20 JKBD CCN(C(=O)c1ccc(N2CCCC2)c([N+](=O)[O-])c1)[C@@H](c1cccnc1)c1ccc(F)c(F)c1 517810305 XQHRXEKRCJZCCP-XMMPIXPASA-N 466.488 5.120 5 20 JKBD CC(C)c1noc2nc(C3CC3)cc(C(=O)N(Cc3ccccc3[N+](=O)[O-])CC(F)(F)F)c12 603742447 WADDLRBVYJFDNM-UHFFFAOYSA-N 462.428 5.337 5 20 JKBD CCOC1CCN(C(=O)c2ccccc2Sc2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 604255798 XUPPUBJCYUIUPE-UHFFFAOYSA-N 454.470 5.406 5 20 JKBD O=C(CCNc1ccc(C(F)(F)F)cc1[N+](=O)[O-])Nc1ccccc1NC(=O)c1cccs1 608808997 MRZHMDNRFSKBDL-UHFFFAOYSA-N 478.452 5.368 5 20 JKBD COc1ccc(CN[C@H](C)c2nc3ccccc3n2C(F)F)cc1OCc1ccc([N+](=O)[O-])cc1 609006460 FONDARYHCXQLJI-MRXNPFEDSA-N 482.487 5.778 5 20 JKBD CN1C(=O)CCc2cc(NC(=O)c3ccc(Sc4nc5ccccc5s4)c([N+](=O)[O-])c3)ccc21 609186120 YTAOWBAOWAJVQK-UHFFFAOYSA-N 490.566 5.517 5 20 JKBD Cc1ccc(/C(O)=C(/C(=S)NCc2cccc(C(F)(F)F)c2)[n+]2ccccc2)cc1[N+](=O)[O-] 726570227 YMSZPSYYIMVZIV-UHFFFAOYSA-O 474.484 5.211 5 20 JKBD Cc1c(Br)cccc1NC(=O)c1ccccc1NC(=O)c1ccc([N+](=O)[O-])cc1Cl 726946885 GGINAFCZQSKTNR-UHFFFAOYSA-N 488.725 5.824 5 20 JKBD C[C@H](Nc1ccc(C(=O)N2CCCC[C@@H]2[C@@H](C)NC(=O)OC(C)(C)C)cc1[N+](=O)[O-])c1ccccn1 727376858 DKRBVNXAQDUACI-NJNPRVFISA-N 497.596 5.071 5 20 JKBD COc1ccc(NC(=O)c2cc(F)c(F)cc2[N+](=O)[O-])cc1NC(=O)c1ccc(Cl)cc1F 727708653 YPMVXHKGLAJREU-UHFFFAOYSA-N 479.798 5.179 5 20 JKBD Cc1c(C(=O)Nc2nc(-c3ccccc3OC(F)F)cs2)cc([N+](=O)[O-])c(C)c1[N+](=O)[O-] 727716314 YYVZOMHKFXIYQU-UHFFFAOYSA-N 464.406 5.097 5 20 JKBD O=C(COC(=O)c1ccccc1OCc1cccs1)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 730617781 KKCRDVRNAHAKAX-UHFFFAOYSA-N 480.420 5.050 5 20 JKBD C[C@H](Nc1ccc(C(=O)NCCc2ccc(Br)cc2F)cc1[N+](=O)[O-])c1ccccn1 730971827 CQMLFLLKDZVMJN-AWEZNQCLSA-N 487.329 5.037 5 20 JKBD CC(C)Oc1ccc(-c2nc(C(=O)O[C@H](C)C(=O)Nc3ccc([N+](=O)[O-])cc3Cl)cs2)cc1 749315646 LOFIUFVAPPMBRH-CYBMUJFWSA-N 489.937 5.343 5 20 JKBD O=C(C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)Nc1ccc2nc(O)[nH]c2c1 857748683 CMGRZYBGTBVQFO-PTNGSMBKSA-N 471.498 5.356 5 20 JKBD Cc1cccc([N+](=O)[O-])c1NC(=O)COC(=O)c1sc(-c2ccco2)nc1-c1ccccc1 900278984 QZBIZGMVXMYJJS-UHFFFAOYSA-N 463.471 5.082 5 20 JKBD COc1cccc([C@@H](CNC(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)c2c[nH]c3ccccc23)c1OC 915307512 FTOGJQCHCYCETL-LJQANCHMSA-N 494.935 5.700 5 20 JKBD CC(C)Oc1ccc(Cl)cc1C(=O)O[C@@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 920619119 ZRYGWBKUTXXGNY-NSHDSACASA-N 474.819 5.238 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)C3(c4ccccc4)CCC3)CCC2)cc1)c1ccc([N+](=O)[O-])o1 1785751567 JNWGRFQDPJZEEQ-UHFFFAOYSA-N 459.502 5.057 5 20 JKBD CCOc1ccsc1C(=O)Nc1ccc(C2(NC(=O)c3ccc([N+](=O)[O-])cc3F)CCC2)cc1 1785773835 CJZLIRWIODDHKP-UHFFFAOYSA-N 483.521 5.256 5 20 JKBD Cc1ccsc1C(=O)NC1(c2ccc(NC(=O)/C=C/c3ccc([N+](=O)[O-])o3)cc2)CCC1 1786206127 ABUDPVABLAFEPR-VQHVLOKHSA-N 451.504 5.019 5 20 JKBD COc1cc(C(=O)NC2(c3ccc(NC(=O)c4cc(C)cs4)cc3)CCC2)cc([N+](=O)[O-])c1OC 1786487920 OCARPRCRKIVMDO-UHFFFAOYSA-N 495.557 5.043 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)c3c[nH]c4c(Cl)cccc34)CCC2)cc1)c1ccc([N+](=O)[O-])[nH]1 1790186059 FFDOCGWCWYXACP-UHFFFAOYSA-N 477.908 5.119 5 20 JKBD O=C(/C=C/c1ccc([N+](=O)[O-])o1)NC1(c2ccc(NC(=O)Cc3c[nH]c4ccccc34)cc2)CCC1 1790396869 JJBXGBSTMUARRH-ZRDIBKRKSA-N 484.512 5.059 5 20 JKBD Cc1cc2[nH]c(C(=O)Nc3ccc(C4(NC(=O)/C=C/c5ccc([N+](=O)[O-])o5)CCC4)cc3)cc2s1 1790876290 HESDWXPBVLHZSE-VQHVLOKHSA-N 490.541 5.500 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)C3(c4cccc([N+](=O)[O-])c4)CCC3)CCC2)cc1)[C@H]1C[C@]1(F)Cl 1791675144 QBMZLYRVSGMJOB-CJFMBICVSA-N 485.943 5.075 5 20 JKBD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc(F)c1Cl)c1cc2cc([N+](=O)[O-])ccc2s1 1800457927 LJGZRBYVSOIUKO-QDMKHBRRSA-N 487.940 5.168 5 20 JKBD CCC[C@H]1CC[C@H](C(=O)NC[C@@H]2CCN(C(=O)c3ccc([N+](=O)[O-])cc3F)[C@@H]2c2cccnc2)CC1 1812789325 IERQJOKXZVTITN-SHNDDRJUSA-N 496.583 5.055 5 20 JKBD Cc1cc(C(=O)Nc2cc([C@H]3CCCCN3C(=O)c3cc4cc([N+](=O)[O-])ccc4s3)[nH]n2)c(C)o1 1816416314 HFTXSVWCRBNDAJ-LJQANCHMSA-N 493.545 5.362 5 20 JKBD O=C(Nc1cc([C@@H]2CCCCN2C(=O)/C=C/c2ccccc2[N+](=O)[O-])[nH]n1)c1sccc1Cl 1819958936 INVRJSJTZHGGCP-BLGFXRMMSA-N 485.953 5.052 5 20 JKBD CC(C)c1ccc(C(=O)Nc2cc([C@H]3CCCCN3C(=O)Cc3cc([N+](=O)[O-])ccc3F)[nH]n2)cc1 1820590537 XCKCWJVCOSOHPU-HSZRJFAPSA-N 493.539 5.129 5 20 JKBD Cc1ccc(CC(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3cc4ccccc4o3)CC2)cc1[N+](=O)[O-] 1830365885 HPPXKPFWNNBWHO-HSZRJFAPSA-N 489.572 5.125 5 20 JKBD C[C@H](Sc1ccccc1)C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2ccc([N+](=O)[O-])cc2F)CC1 1830492300 BKLSNKNPBPXBMC-UUOWRZLLSA-N 499.608 5.148 5 20 JKBD CC1(C(=O)N2CCCC[C@H]2C2CCN(C(=O)Cn3ccc4ccc([N+](=O)[O-])cc43)CC2)CCCCC1 1831791081 RXQFOOFJZPARPT-DEOSSOPVSA-N 494.636 5.140 5 20 JKBD Cc1ccc(/C=C/C(=O)N2CCCC[C@H]2C2CCN(C(=O)c3cc(F)cc([N+](=O)[O-])c3)CC2)s1 1832173980 NXPFPHJGWWIWNZ-MNQSQUENSA-N 485.581 5.051 5 20 JKBD O=C(Nc1ccc(-c2csc(N3CCOCC3)n2)cc1)c1cc2cc([N+](=O)[O-])ccc2s1 10500334 OZHYHDUIRZBLFY-UHFFFAOYSA-N 466.544 5.022 5 20 JKBD Cn1c(SCC(=O)Nc2c(Cl)cccc2C(F)(F)F)nc2cc3ccccc3cc2c1=O 22253104 NINMWADLAULJAL-UHFFFAOYSA-N 477.895 5.490 5 20 JKBD COc1cc2c(cc1OC)[C@H](c1cccs1)N(C(=O)c1cc3cc([N+](=O)[O-])ccc3s1)CC2 24446470 CDVYVDIJPKJOQF-HSZRJFAPSA-N 480.567 5.676 5 20 JKBD CCOc1cc(NC(=O)c2cc(SC)ccc2[N+](=O)[O-])c(OCC)cc1NC(=O)c1ccccc1 24476662 BHLRASVJCSCQJG-UHFFFAOYSA-N 495.557 5.619 5 20 JKBD Cc1cc(CSc2ncccc2C(=O)Oc2ccc(NC(=O)c3cccc([N+](=O)[O-])c3)cc2)no1 25710105 ZMCYJMOTVZMCQF-UHFFFAOYSA-N 490.497 5.050 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Br)[C@H](Nc1ccc(F)c(F)c1)c1ccccc1 26997461 BWBZYJTXHLCTPP-LJQANCHMSA-N 462.250 5.427 5 20 JKBD O=C(COc1ccc2c(-c3ccc([N+](=O)[O-])cc3)cc(=O)oc2c1)Nc1ccc(SC(F)F)cc1 28609933 OGWIDSBLCZTWKS-UHFFFAOYSA-N 498.463 5.700 5 20 JKBD COc1ccccc1CN(Cc1cccs1)C(=O)c1cc(OC)c(OC(F)F)cc1[N+](=O)[O-] 45644686 MUTFQGGZSJEHKH-UHFFFAOYSA-N 478.473 5.118 5 20 JKBD Cc1ccc(-c2nc(C)c([C@H](C)NC(=O)[C@H]3CCCN3C(=O)c3ccc([N+](=O)[O-])c(C)c3)s2)cc1 78661123 SCAIPHARFMOHGG-HTAPYJJXSA-N 492.601 5.126 5 20 JKBD O=C(c1cc2cccc([N+](=O)[O-])c2[nH]1)N(Cc1ccc(Cl)c(Cl)c1)Cc1ccccn1 109206045 OIQUCMPGXWBHBW-UHFFFAOYSA-N 455.301 5.621 5 20 JKBD Cc1csc(Sc2ccc(C(=O)N3CCC[C@@H](CN4CCC(C)CC4)C3)cc2[N+](=O)[O-])n1 109661712 ZIAOYKQIIHASLL-SFHVURJKSA-N 474.652 5.095 5 20 JKBD O=C(c1ccc(NCc2ccccc2Cl)c([N+](=O)[O-])c1)N1CC=C(c2ccc(O)cc2)CC1 216850369 PKRWRUSONWCJJO-UHFFFAOYSA-N 463.921 5.495 5 20 JKBD Cc1ccc(Sc2ccc(C(=O)N(Cc3ccco3)C3CCN(C)CC3)cc2[N+](=O)[O-])cc1 302981701 UCUQFTGXUULZIX-UHFFFAOYSA-N 465.575 5.384 5 20 JKBD CCOc1cc2c(cc1[C@@H]1C[C@@H]1C(=O)N(Cc1ccccc1[N+](=O)[O-])CC(F)(F)F)O[C@@H](C)C2 409796346 XUBAEKLHUNJKAF-FNHZYXHNSA-N 478.467 5.012 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)Nc2cc(C(=O)Nc3ccccc3)ccc2C)cc1SC 482814739 CJYBHHWYGQMSIX-UHFFFAOYSA-N 451.504 5.138 5 20 JKBD CC(C)c1nc(-c2ccccc2NC(=O)c2ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])cc2)n[nH]1 492666180 BRNCMDADAIUAQF-UHFFFAOYSA-N 477.908 6.201 5 20 JKBD CSCC[C@H](NC(=O)c1ccc([N+](=O)[O-])o1)C(=O)Nc1ccc(-c2cc3ccccc3o2)cc1 497192150 VQBYVPVEGYNPOR-SFHVURJKSA-N 479.514 5.091 5 20 JKBD C[C@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)Nc1ccc(NC(=O)N2CCCCCC2)cc1 498504060 GVHUGRXNBMOORW-HNNXBMFYSA-N 460.918 5.062 5 20 JKBD Cc1nn(Cc2ccc(C(=O)N[C@H](C)c3ccc(SC(C)C)cc3)cc2)c(C)c1[N+](=O)[O-] 504702673 IOFAVNAREBVHAM-MRXNPFEDSA-N 452.580 5.448 5 20 JKBD COc1ccc(-c2nnc(SCc3cc([N+](=O)[O-])ccc3OC(C)C)n2C[C@H]2CCCO2)cc1 511056824 CQIPWTOTZHDRBM-OAQYLSRUSA-N 484.578 5.120 5 20 JKBD O=c1c2cc([N+](=O)[O-])ccc2nc2n1CC/C2=C\c1ccc(-c2ccc(C(F)(F)F)cc2)o1 513521175 RFFHBDPOAOKTQQ-SDNWHVSQSA-N 453.376 5.528 5 20 JKBD O=C(Nc1cccc(C(F)F)c1)N1CCN(Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)CC1 513913204 MTQMTPDEGPBSCX-UHFFFAOYSA-N 472.517 5.611 5 20 JKBD O=C(C1CCN(c2ccccc2[N+](=O)[O-])CC1)N(CCc1ccccc1)c1nc2ccccc2s1 514607576 MNIXONFCNRVXOQ-UHFFFAOYSA-N 486.597 5.697 5 20 JKBD CSc1ccc([N+](=O)[O-])c(C(=O)N2CCCC[C@H]2C(=O)Nc2ccc(Cl)cc2Cl)c1 515071555 KLTIGMBSCOIGAG-SFHVURJKSA-N 468.362 5.257 5 20 JKBD C[C@H](Nc1ccc(C(=O)N[C@H](C)c2ccc(OCC(F)(F)F)cc2)cc1[N+](=O)[O-])c1ccccn1 516322278 DHHVWSMDPTWFQC-CVEARBPZSA-N 488.466 5.595 5 20 JKBD COCCOc1cc([N+](=O)[O-])c(C(=O)N(c2ccccc2)c2nc3ccccc3s2)cc1OC 517299522 NHNDOVMZCVPXMR-UHFFFAOYSA-N 479.514 5.217 5 20 JKBD CSc1ccc(C(=O)c2ccccc2C(=O)N2CCC[C@@H](N3[C@@H](C)CC[C@H]3C)C2)cc1[N+](=O)[O-] 550895716 SFEQLYVJZCXTTJ-WSTZPKSXSA-N 481.618 5.025 5 20 JKBD O=C(Nc1ccc(Br)cc1Cl)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-] 603731014 WSPGOLPTMDNVDZ-UHFFFAOYSA-N 453.598 5.204 5 20 JKBD CCCC(=O)Nc1ccc(CNC(=O)Cc2cn(-c3ccccc3)nc2-c2ccc([N+](=O)[O-])cc2)cc1 603762018 YUFSABZOOHPKNJ-UHFFFAOYSA-N 497.555 5.045 5 20 JKBD CC1CCN(c2ccc(C(=O)Nc3ccc(C(=O)N4CCCC[C@@H]4C)cc3)cc2[N+](=O)[O-])CC1 603993041 JRUIIUWBRIWQLQ-IBGZPJMESA-N 464.566 5.098 5 20 JKBD Cc1sc(NC(=O)c2cccc(OCc3cscn3)c2)nc1-c1cccc([N+](=O)[O-])c1 603997193 BXMQFGHGZMBGDF-UHFFFAOYSA-N 452.517 5.315 5 20 JKBD O=C(c1c2c(nc3ccccc13)/C(=C/c1ccc([N+](=O)[O-])cc1)CCC2)N1CCC[C@@H](c2cc[nH]n2)C1 608813489 YEJUBKLOWPQTCY-DHUDHEQZSA-N 493.567 5.763 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1F)c1cccnc1Oc1ccc(F)cc1Br 608870316 BBOCNXBCYFZEFO-UHFFFAOYSA-N 450.195 5.075 5 20 JKBD CCc1cc[n+](/C(C(=S)Nc2ccc(OC)c(Cl)c2)=C(/O)c2cccc([N+](=O)[O-])c2)cc1 726960775 CKXHHGARLFMLNK-UHFFFAOYSA-O 470.958 5.430 5 20 JKBD Cc1nc(C(=O)N(CC2CC2)c2ccc(Cl)c([N+](=O)[O-])c2)nn1-c1c(Cl)cccc1Cl 728237370 COTYUZDMBSMCGA-UHFFFAOYSA-N 480.739 5.501 5 20 JKBD CCN(C(=S)Nc1ccc([N+](=O)[O-])cc1)[C@@H]1CCSc2ccc(Br)cc21 728797756 SSKRYJSITKOHQL-MRXNPFEDSA-N 452.399 5.613 5 20 JKBD O=C(COc1ccc([N+](=O)[O-])c(F)c1)Nc1ccc(NC(=O)c2ccc(F)cc2)cc1C(F)(F)F 745766343 YCMYSBUEQKZFIB-UHFFFAOYSA-N 495.360 5.162 5 20 JKBD Cc1cc(C(=O)COC(=O)c2csc(-c3ccc([N+](=O)[O-])cc3)n2)c(C)n1CCc1cccs1 747958666 RTORIQRGBZXSCR-UHFFFAOYSA-N 495.582 5.481 5 20 JKBD O=C(OCC1CCN(c2ccc([N+](=O)[O-])cn2)CC1)/C(=C/c1ccc(F)cc1)c1cccs1 750426790 PCMDJNTWHXKITM-KGENOOAVSA-N 467.522 5.191 5 20 JKBD Cc1onc(-c2c(Cl)cccc2Cl)c1C(=O)OCC(=O)Nc1cc([N+](=O)[O-])ccc1Cl 913350517 ROJQCUBFCYUBRD-UHFFFAOYSA-N 484.679 5.314 5 20 JKBD O=C(Cc1ccc(NC(=O)c2cccc(Br)c2)cc1)Nc1cc([N+](=O)[O-])c(F)cc1F 916042954 OCTNOUZFLAFAOC-UHFFFAOYSA-N 490.260 5.069 5 20 JKBD Cn1cnnc1-c1cccc(NC(=O)c2cc([N+](=O)[O-])ccc2N2CCC(Cc3ccccc3)CC2)c1 918596251 WZSCHRZCDUIZLK-UHFFFAOYSA-N 496.571 5.102 5 20 JKBD O=C(OCc1nnc(-c2ccc(Cl)cc2)o1)c1cc([N+](=O)[O-])ccc1Oc1ccccc1 919191508 GACPRZCNJNMBRE-UHFFFAOYSA-N 451.822 5.448 5 20 JKBD C[C@H](OC(=O)c1cc([N+](=O)[O-])ccc1Oc1ccccc1)C(=O)Nc1ccc(F)cc1Cl 919192781 OJURXEHZJVDUID-ZDUSSCGKSA-N 458.829 5.364 5 20 JKBD Cc1cccc(C(C)C)c1NC(=O)[C@H](C)OC(=O)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-] 919195720 NFJNCMWJJCPAOV-AWEZNQCLSA-N 468.428 5.152 5 20 JKBD Cn1cc(C(=O)Nc2nc(Cc3ccc(Br)cc3)cs2)c(-c2ccc([N+](=O)[O-])cc2)n1 919752181 OAUMZZDGPHAGRA-UHFFFAOYSA-N 498.362 5.057 5 20 JKBD Cc1nc(-c2ccc(Cl)s2)sc1C(=O)OCc1nc(-c2cccc([N+](=O)[O-])c2)no1 921104618 IFPHGXMNJLPWOR-UHFFFAOYSA-N 462.896 5.149 5 20 JKBD CC(C)N(Cc1nnc(-c2cccc([N+](=O)[O-])c2)o1)C(=O)c1ccc(-n2cnc3ccccc32)cc1 921194936 RLDONZKCXFQSCF-UHFFFAOYSA-N 482.500 5.035 5 20 JKBD C[C@H](Sc1ccccc1)C(=O)Nc1ccc(C2(NC(=O)/C=C/c3ccc([N+](=O)[O-])o3)CCC2)cc1 1786287304 ARJPIFMWNCIACM-SZEUEKNRSA-N 491.569 5.516 5 20 JKBD O=C(NC1(c2ccc(NC(=O)c3nc[nH]c3[N+](=O)[O-])cc2)CCC1)c1ccc(Oc2ccccc2)cc1 1788614376 XTZPZUZNKQETLV-UHFFFAOYSA-N 497.511 5.172 5 20 JKBD COc1cc(C(=O)Nc2ccc(C3(NC(=O)c4cc5ccoc5s4)CCC3)cc2)ccc1[N+](=O)[O-] 1792164414 ANNRVFPQZMHVNX-UHFFFAOYSA-N 491.525 5.473 5 20 JKBD CC(C)[C@H](C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CCc1cccc([N+](=O)[O-])c1)c1ccc(Cl)cc1 1793936671 LUMBHAVFIKXRQK-LNEBKTTKSA-N 498.023 5.259 5 20 JKBD Cc1ccc(-c2ccccc2C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cc(F)cc([N+](=O)[O-])c2)cc1 1800523465 FGRQFGQYDVOWKN-NUNAXRQHSA-N 487.531 5.275 5 20 JKBD CC(C)[C@H](C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2ccc([N+](=O)[O-])o2)[nH]n1)c1ccc(Cl)cc1 1814936687 GTMDPRDMVNBOAB-AVRDEDQJSA-N 499.955 5.310 5 20 JKBD Cc1oc(C(C)(C)C)cc1C(=O)Nc1cc([C@@H]2CCCCN2C(=O)/C=C/c2ccc([N+](=O)[O-])o2)[nH]n1 1816462407 TZFSTXWMVGDAFY-RQMBKDMJSA-N 495.536 5.129 5 20 JKBD CC(C)(C)c1ccc(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)c3cc(O)cc([N+](=O)[O-])c3)n[nH]2)s1 1821262472 YRRZIGKTQOUGAF-GOSISDBHSA-N 497.577 5.002 5 20 JKBD CC[C@@H](C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2ccc([N+](=O)[O-])cc2F)CC1)c1ccccc1 1826316482 HRQWTTJHODLRHJ-RDGATRHJSA-N 481.568 5.161 5 20 JKBD CC1(C)CCC(CC(=O)N2CCCC[C@H]2C2CCN(C(=O)c3cc(O)cc([N+](=O)[O-])c3)CC2)CC1 1830423202 ILKFCUHASKAMSY-DEOSSOPVSA-N 485.625 5.140 5 20 JKBD Cc1cc2cc(C(=O)N3CCCC[C@@H]3C3CCN(C(=O)c4cccc(F)c4[N+](=O)[O-])CC3)ccc2[nH]1 1831035585 FADJZLKDSLDFMK-XMMPIXPASA-N 492.551 5.071 5 20 JKBD Cc1c(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)/C=C/c3ccccc3[N+](=O)[O-])CC2)ccc(F)c1F 1832620530 IGMQHGQCVQOPGH-JYLQPTBZSA-N 497.542 5.128 5 20 JKBD Cc1ccccc1CSCC(=O)Nc1c(Br)cc([N+](=O)[O-])cc1Br 9620254 DRQFNWJVIUMBRC-UHFFFAOYSA-N 474.174 5.300 5 20 JKBD O=C(Cn1c2ccccc2c(=O)c2ccccc21)OCc1csc(COc2ccc(Cl)cc2)n1 10723586 IEOJEAGENSXCKD-UHFFFAOYSA-N 490.968 5.587 5 20 JKBD C[C@@H](OC(=O)c1sc2cc(F)ccc2c1Cl)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl 11443773 KSBGQDMLKPWULC-MRVPVSSYSA-N 457.266 5.439 5 20 JKBD Cc1ccc(NC(=O)c2ccc([N+](=O)[O-])cc2Cl)cc1S(=O)(=O)Nc1ccccc1Cl 16065998 JRIHBMYGSBFSGC-UHFFFAOYSA-N 480.329 5.263 5 20 JKBD Cc1c(NC(=O)c2ccccc2)cccc1NC(=O)c1ccc(N2CCC[C@H](C)C2)c([N+](=O)[O-])c1 117559915 CMQWDEVQEJXQCO-SFHVURJKSA-N 472.545 5.644 5 20 JKBD Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)c1ccccc1SCC(=O)NCC1CCCCC1 481307284 ITIWCPGUYIBGSG-UHFFFAOYSA-N 455.580 5.253 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)Nc2nc(C)c(Cc3cccc(Cl)c3)s2)cc1SC 483011253 JHRQQZIQBBWCSH-UHFFFAOYSA-N 463.968 5.587 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Cl)[C@@H](Nc1cccc(CN2CCCCC2=O)c1)c1ccccc1 497509089 JPVGYYICDVVNOA-VWLOTQADSA-N 492.963 5.553 5 20 JKBD COc1ccc(Br)cc1[C@@H]1CCCN1C(=O)c1ccc(SC)c([N+](=O)[O-])c1 504894537 JFLZXTGDSFVFFL-HNNXBMFYSA-N 451.342 5.065 5 20 JKBD CCOc1cc([N+](=O)[O-])c(C(=O)N(CCc2ccccc2)c2nc3ccccc3s2)cc1OC 506790958 VLBVAUDOYREYCZ-UHFFFAOYSA-N 477.542 5.501 5 20 JKBD O=C(Nc1ccc(Br)cc1Br)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-] 514428125 SVNXYHCEWXFWOZ-UHFFFAOYSA-N 498.049 5.313 5 20 JKBD Cn1cnnc1-c1ccc(NC(=O)c2ccc(Sc3nc4ccccc4s3)c([N+](=O)[O-])c2)cc1 515171389 DBFZDTBNFWHISA-UHFFFAOYSA-N 488.554 5.404 5 20 JKBD O=C(CSc1ccc([N+](=O)[O-])cc1)N(Cc1cccnc1)c1ccc(Br)cc1 515627680 MDSQQDJCFPVIJE-UHFFFAOYSA-N 458.337 5.078 5 20 JKBD O=C(C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)NCCCN1CCCCC1 516378577 HZAFQPBQKZGBJU-LVZFUZTISA-N 464.591 5.127 5 20 JKBD COC(=O)Cc1ccc(NC(=O)c2ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])c(OC)c2)cc1 518850855 FHRLXTWYHAIYKN-UHFFFAOYSA-N 470.865 5.017 5 20 JKBD O=C(C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)NCCc1ccc2ccccc2n1 520103015 CJVBQLAWMMYZKU-HEHNFIMWSA-N 494.576 6.042 5 20 JKBD O=C(Nc1ccc(Cl)cc1)N1CCCN(C(=O)c2cc([N+](=O)[O-])ccc2Oc2ccccc2)CC1 522593719 GADGTXQOOKPRRP-UHFFFAOYSA-N 494.935 5.421 5 20 JKBD CCCN(Cc1nnc(-c2ccccc2Cl)o1)C(=O)c1csc(-c2ccc([N+](=O)[O-])cc2)n1 522635189 PMEWCPQMEWAJJP-UHFFFAOYSA-N 483.937 5.474 5 20 JKBD Cc1csc(Sc2ccc(C(=O)NCCc3cccc4cccnc34)cc2[N+](=O)[O-])n1 591593936 LOOBHXMTUMWWRT-UHFFFAOYSA-N 450.545 5.032 5 20 JKBD O=C(CSc1ccc(C(F)(F)F)cc1[N+](=O)[O-])N(C[C@H]1CCCO1)c1nc2ccccc2s1 602760084 WXZVIYCPXKLVOS-CQSZACIVSA-N 497.520 5.528 5 20 JKBD COc1ccc(NC(=O)c2ccc(N3C[C@@H](C)C[C@@H](C)C3)c([N+](=O)[O-])c2)cc1OCc1ccncc1 603876745 PMWNTAYOZYRMKE-KDURUIRLSA-N 490.560 5.312 5 20 JKBD C[C@@H](Nc1ccc(C(=O)N(CCc2ccccc2)C2CCCC2)cc1[N+](=O)[O-])c1ccccn1 604491481 NIRRZFYPTUMLOG-HXUWFJFHSA-N 458.562 5.790 5 20 JKBD CC1CCN(c2ccc(C(=O)Nc3ccccc3NC(=O)c3cccs3)cc2[N+](=O)[O-])CC1 608808845 IIZHJLXTKLSJKJ-UHFFFAOYSA-N 464.547 5.397 5 20 JKBD COc1ccc([C@H](Nc2cnn(-c3ccc([N+](=O)[O-])cc3)c(=O)c2Cl)c2ccc(C)cc2)cc1 608830778 CLXXUVYVCHUXGH-XMMPIXPASA-N 476.920 5.313 5 20 JKBD Cn1c(SCC(=O)N(Cc2ccco2)c2ccccc2)nc2cc3ccccc3cc2c1=O 677801558 UNHCBJZSUYZOFM-UHFFFAOYSA-N 455.539 5.005 5 20 JKBD CSc1ccc(C(=O)c2ccccc2C(=O)Oc2ccc(C(C)=O)cc2F)cc1[N+](=O)[O-] 728492185 PSYQUZVPNXMCIQ-UHFFFAOYSA-N 453.447 5.109 5 20 JKBD Cc1ccc2oc(C(=O)Oc3ccc(NC(=O)c4cc([N+](=O)[O-])ccc4Cl)cc3)cc2n1 729167533 NGVADDMOALAUAG-UHFFFAOYSA-N 451.822 5.169 5 20 JKBD O=C(OCc1nc(-c2ccc(C(F)(F)F)cc2)no1)c1csc(-c2ccc([N+](=O)[O-])cc2)n1 747957731 RXJQSWBTGNDQCN-UHFFFAOYSA-N 476.392 5.144 5 20 JKBD O=[N+]([O-])c1cccc(-c2nccc(/C=C/c3csc(COc4ccc(Cl)cc4)n3)[n+]2[O-])c1 918712059 GQEJMVJBUBLYQO-VOTSOKGWSA-N 466.906 5.150 5 20 JKBD C[C@@H](Nc1ccc(C(=O)OCc2cc(-c3cccs3)on2)cc1[N+](=O)[O-])c1ccccn1 920549700 YHRNYFXFLGSRSV-CQSZACIVSA-N 450.476 5.236 5 20 JKBD C[C@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)O[C@H](C)C(=O)Nc1c(Cl)cc(Cl)cc1Cl 920778701 LRVATWLKJJIKKM-BDAKNGLRSA-N 496.130 5.546 5 20 JKBD Cc1cc(O)c([N+](=O)[O-])cc1C(=O)NC1(c2ccc(NC(=O)Cc3c[nH]c4ccccc34)cc2)CCC1 1790396572 QPWCDXRACJRPIR-UHFFFAOYSA-N 498.539 5.081 5 20 JKBD C/C(=C\c1cccs1)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)Cc2ccc(C)c([N+](=O)[O-])c2)[nH]n1 1814413736 SUESKYOWMFXUAY-RKCQOLGWSA-N 493.589 5.026 5 20 JKBD Cc1cc(CCCC(=O)N2CCCC[C@@H]2C2CCN(C(=O)CC(C)C)CC2)c([N+](=O)[O-])cc1F 1824370419 YTYJFYSVVWOPSP-HSZRJFAPSA-N 475.605 5.031 5 20 JKBD O=C(c1cc(O)cc([N+](=O)[O-])c1)N1CCC([C@@H]2CCCCN2C(=O)[C@@H]2CCC[C@@H]3CCCC[C@@H]32)CC1 1828460942 VDAWNHVTCHDFIG-XSGUUIGASA-N 497.636 5.140 5 20 JKBD C[C@@H](C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)CC1)n1cccc1 1832112703 AFZCHYXALQBWAF-PGRDOPGGSA-N 494.617 5.106 5 20 JKBD CSc1ccc(C(=O)Nc2ccc(NC(=O)c3ccco3)cc2C(F)(F)F)cc1[N+](=O)[O-] 10641010 UDEDIFGPFITCED-UHFFFAOYSA-N 465.409 5.433 5 20 JKBD O=C(OCc1nc2ccccc2c2ccccc12)C1CCN(C(=O)c2ccc(C(F)(F)F)cc2)CC1 12106487 SZYBCLXGTWFBOM-UHFFFAOYSA-N 492.497 6.002 5 20 JKBD Cc1noc(C)c1CSc1ccccc1C(=O)O[C@H](C)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 17665080 DCCNETMXTSLIHC-OAHLLOKOSA-N 480.502 5.460 5 20 JKBD CCN(c1ccccc1)S(=O)(=O)c1ccc(Sc2nnc(-c3ccccc3C)o2)c([N+](=O)[O-])c1 20667728 VERWFUBYFNITCM-UHFFFAOYSA-N 496.570 5.320 5 20 JKBD Cc1ccc(Cn2c(S[C@@H](C)C(=O)Nc3cccc([N+](=O)[O-])c3C)nc3ccccc3c2=O)cc1 21779362 FIDTYSRQVNAGLA-SFHVURJKSA-N 488.569 5.089 5 20 JKBD Cc1sc2nc(S[C@@H](C)C(=O)Nc3ccccc3[N+](=O)[O-])n(C3CCCC3)c(=O)c2c1C 22101829 NCWWLSFYIOPSNV-AWEZNQCLSA-N 472.592 5.217 5 20 JKBD O=C(COC(=O)Cc1csc(-c2ccc(C(F)(F)F)cc2)n1)Nc1ccc(Cl)c([N+](=O)[O-])c1 25661642 HODBPPGIOBLYDH-UHFFFAOYSA-N 499.854 5.115 5 20 JKBD Cc1cccc([N+](=O)[O-])c1NC(=O)COC(=O)c1sc(-c2ccc(C(F)(F)F)cc2)nc1C 25663678 ZJKFKUINNUESOO-UHFFFAOYSA-N 479.436 5.149 5 20 JKBD COc1ccc(NC(=O)c2ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])cc2)cc1N1CCCC1=O 28038591 GBQASCYCVUERJO-UHFFFAOYSA-N 481.892 5.428 5 20 JKBD COc1ccc(-c2n[nH]c(S[C@@H](C(=O)Nc3ccc(C)cc3[N+](=O)[O-])c3ccccc3)n2)cc1 36803530 AOHYDRCFMOSMJO-OAQYLSRUSA-N 475.530 5.169 5 20 JKBD CCn1c(S[C@@H](C(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)c2ccccc2)nnc1-c1ccncc1 104768800 OUIRMNSGBGOAET-HXUWFJFHSA-N 494.964 5.394 5 20 JKBD Cc1ccc(NC(=O)CSc2ccc(C(F)(F)F)cc2[N+](=O)[O-])c(OC[C@H]2CCCO2)c1 108889309 SRQMDRHIFFYQPA-OAHLLOKOSA-N 470.469 5.211 5 20 JKBD O=C(Nc1nc(-c2cc(Cl)sc2Cl)cs1)c1cnn(-c2ccc([N+](=O)[O-])cc2)c1 302948478 NIKUSXOCCITBDR-UHFFFAOYSA-N 466.331 5.525 5 20 JKBD COc1cc(C(=O)Nc2ccc(OCc3cccc(F)c3)c(F)c2)c([N+](=O)[O-])cc1OC(F)F 484017199 VGAFTSKQEAWBKO-UHFFFAOYSA-N 480.370 5.314 5 20 JKBD CCn1c(SCC(=O)c2ccc(CC[C@H](C)NC(C)=O)cc2)nc2cc3ccccc3cc2c1=O 495450972 ZBKSTQARCJLMND-SFHVURJKSA-N 487.625 5.002 5 20 JKBD C[C@@H](Nc1ccc(C(=O)N(C)[C@H](C)c2ccc(C(F)(F)F)cc2)cc1[N+](=O)[O-])c1ccccn1 506188064 GOHHUSIZJIDBPC-HZPDHXFCSA-N 472.467 6.015 5 20 JKBD C[C@@H]1CCCN(c2ccc(C(=O)Nc3ccccc3OC[C@H]3CCCCO3)cc2[N+](=O)[O-])C1 510010639 AUYITQJSZIYARH-UYAOXDASSA-N 453.539 5.031 5 20 JKBD O=C(NCC1(c2ccccc2)CCOCC1)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1 512499486 OWRWBQAHFRSECE-UHFFFAOYSA-N 466.921 5.519 5 20 JKBD Cc1ccc([C@@H](NC(=O)C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2ccc(F)cc2Cl)cc1 517468480 OJDWXBKGTXAMPE-HXUWFJFHSA-N 476.291 5.193 5 20 JKBD CN(CC(=O)Nc1ccc(Cl)c(C(F)(F)F)c1)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl 517802912 FSMCPRNKCSOPBN-UHFFFAOYSA-N 465.215 5.023 5 20 JKBD Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)c1cnn(-c2ncc(C(F)(F)F)cc2Cl)c1C(F)F 518638294 DEIYXEXTYGEQHI-UHFFFAOYSA-N 489.788 5.654 5 20 JKBD CCOc1cccc([C@@H](C)N[C@@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2ccccc2)c1 520140179 FATDXKJMRDZIOT-WAIKUNEKSA-N 453.926 5.678 5 20 JKBD Cc1ccc(C(=O)Nc2cccc(C(F)(F)F)c2)cc1NC(=O)Cc1ccccc1[N+](=O)[O-] 521293155 PKVRSSJPPLUFNV-UHFFFAOYSA-N 457.408 5.356 5 20 JKBD Cc1[nH]nc(C(=O)NC[C@@H](c2ccccc2)c2c(-c3ccccc3)[nH]c3ccccc23)c1[N+](=O)[O-] 522222744 JSCDEYMBNSUPTI-NRFANRHFSA-N 465.513 5.337 5 20 JKBD O=C(Nc1ccccc1NC(=O)c1cccs1)c1csc(-c2ccc([N+](=O)[O-])cc2)n1 522558426 MKRYRBLJZRBELU-UHFFFAOYSA-N 450.501 5.284 5 20 JKBD CCCn1c(C)cc(-c2csc(NC(=O)c3cc(OC)c(OC(F)F)cc3[N+](=O)[O-])n2)c1C 585691876 IROSIFSYDATTLK-UHFFFAOYSA-N 480.493 5.409 5 20 JKBD CCCC(=O)Nc1ccc(CNCc2cn(-c3ccccc3)nc2-c2ccc([N+](=O)[O-])cc2)cc1 608836246 SZEOEZTVULCATP-UHFFFAOYSA-N 469.545 5.476 5 20 JKBD Cc1ccc([C@@H](OC[C@@H](O)Cn2cnc3cc4ccccc4cc3c2=O)c2ccccc2)cc1 636934060 DVNVHCMOYIKHDZ-LSYYVWMOSA-N 450.538 5.025 5 20 JKBD COc1ccc(NC(=S)/C(=C(/O)c2ccc(C)c([N+](=O)[O-])c2)[n+]2ccc(C(C)(C)C)cc2)cn1 726962934 NOGVGNHNNRZTND-UHFFFAOYSA-O 479.582 5.215 5 20 JKBD CC(=O)N(c1nc(COC(=O)c2c[nH]c3cc([N+](=O)[O-])ccc23)cs1)c1ccc(C)cc1C 756769839 ZPJLLSHKDNYOFB-UHFFFAOYSA-N 464.503 5.191 5 20 JKBD O=C(O[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1)c1cc(Cl)c(Cl)[nH]1 828610565 MGKXJCMUZAZPDV-MRXNPFEDSA-N 468.680 5.420 5 20 JKBD CC(C)Cn1cc([C@H]2N(Cc3cc(Cl)cc(Cl)c3[N+](=O)[O-])CC23CCOCC3)cn1 849481970 STOONPGHSSJHMO-HXUWFJFHSA-N 453.370 5.108 5 20 JKBD O=C(Nc1ccc(OC[C@H](O)CO[C@H]2CCCc3ccccc32)cc1)c1cc([N+](=O)[O-])ccc1Cl 914794872 CSBMNWOMRYCNQX-CPJSRVTESA-N 496.947 5.334 5 20 JKBD O=C(C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)Oc1ccc(NC(=O)C2CC2)cc1 918603496 OAWGZUIEJURNSS-XDJHFCHBSA-N 499.548 6.089 5 20 JKBD C[C@@H](OC(=O)[C@@H](C)Sc1ccc(Br)cc1)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl 919468412 WMZJQPIBSFCILL-GHMZBOCLSA-N 487.759 5.062 5 20 JKBD O=C(COc1cccc(NC(=O)c2ccco2)c1)Oc1ccc(-c2ccccc2)cc1[N+](=O)[O-] 920330244 WDVOEJBDJPDDGE-UHFFFAOYSA-N 458.426 5.092 5 20 JKBD COc1ccc(NC(=O)[C@@H](C)Oc2ccc(Cl)cc2[N+](=O)[O-])cc1NC(=O)OC(C)(C)C 920766327 WFWQXUNPLOSJFZ-GFCCVEGCSA-N 465.890 5.010 5 20 JKBD COc1cc(NC(=O)C2CC2)c(C(=O)OCc2nc3ccccc3c3ccccc23)cc1OC 921284725 ILSMOBJBLGSDLL-UHFFFAOYSA-N 456.498 5.111 5 20 JKBD C[C@H](C(=O)Nc1ccc(C2(NC(=O)c3ccc([N+](=O)[O-])[nH]3)CCC2)cc1)c1ccc(Cl)cc1 1785988936 POQMMLBYLYCRNF-HNNXBMFYSA-N 466.925 5.128 5 20 JKBD Cc1cc(O)c([N+](=O)[O-])cc1C(=O)Nc1ccc(C2(NC(=O)c3cccc4cc[nH]c34)CCC2)cc1 1790809701 WXAJNOBFWUBYOV-UHFFFAOYSA-N 484.512 5.152 5 20 JKBD Cc1ncccc1C(=O)NC1(c2ccc(NC(=O)c3cc4cc([N+](=O)[O-])ccc4s3)cc2)CCC1 1791011233 RLOWXCZURYIAKZ-UHFFFAOYSA-N 486.553 5.574 5 20 JKBD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccccc1Oc1ccccc1)c1cccc(F)c1[N+](=O)[O-] 1799551257 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COc1ccc([N+](=O)[O-])cc1NC(=O)[C@H]1CCC(=O)N(c2ccc(C)cc2)[C@@H]1c1cccs1 104798101 LZABILXCIFJYCL-MBSDFSHPSA-N 465.531 5.096 5 20 JKBD O=C(CSc1ccc(C(F)(F)F)cc1[N+](=O)[O-])Nc1cc(F)ccc1NC(=O)c1ccccn1 108698419 MHOCEKSIDMKGQJ-UHFFFAOYSA-N 494.426 5.131 5 20 JKBD Cc1c([C@@H](C)NC(=O)c2ccc(N[C@H](C)c3ccccn3)c([N+](=O)[O-])c2)cnn1-c1ccc(F)cc1 108777000 GXGJNWLNHGSLBO-IAGOWNOFSA-N 488.523 5.287 5 20 JKBD C[C@H](Nc1ccc(C(=O)N2CCC[C@@H]2Cc2ccccc2Cl)cc1[N+](=O)[O-])c1ccccn1 108892940 BNDOLXCSFGNQBJ-FXAWDEMLSA-N 464.953 5.664 5 20 JKBD O=C(Nc1cc(-c2cccc([N+](=O)[O-])c2)n[nH]1)c1ccc(Cl)c(NC(=O)c2cccs2)c1 302995666 GTSHZHVXXGUNON-UHFFFAOYSA-N 467.894 5.204 5 20 JKBD O=C(C[C@@H]1C=CCC1)Nc1ccccc1NC(=O)Cn1c2ccccc2c(=O)c2ccccc21 303317043 QKFTXIRBENXWQG-LJQANCHMSA-N 451.526 5.088 5 20 JKBD CCC(C)(C)NC(=O)c1ccc(NC(=O)c2cc(SC)c(OC)cc2[N+](=O)[O-])cc1Cl 483434234 DBNIJJPXFUARON-UHFFFAOYSA-N 465.959 5.149 5 20 JKBD Cc1ccc(-c2csc(N(C(=O)CCn3cc([N+](=O)[O-])nc3C)c3cc(C)ccc3C)n2)cc1 488386581 RZHBLBJKPUYNAG-UHFFFAOYSA-N 475.574 5.903 5 20 JKBD COc1ccc(CSCC(=O)N2CCC(c3c(C)[nH]c4ccccc34)CC2)cc1[N+](=O)[O-] 490398803 JGHZDCNXTRPNQB-UHFFFAOYSA-N 453.564 5.033 5 20 JKBD COc1ccc(NC(=O)CSc2ccc(C(F)(F)F)cc2[N+](=O)[O-])c(C(F)(F)F)c1 500748321 GFJHTDZWSHWPCK-UHFFFAOYSA-N 454.348 5.372 5 20 JKBD C[C@H](Nc1ccc(C(=O)Nc2ccc(-c3nc4ccccc4[nH]3)cc2)cc1[N+](=O)[O-])c1ccccn1 506086165 OVVCYRXREQWEOX-KRWDZBQOSA-N 478.512 5.959 5 20 JKBD CC(C)N(C)C(=O)c1ccc(Cl)c(NC(=O)c2ccc(N[C@H](C)c3ccccn3)c([N+](=O)[O-])c2)c1 509299275 BVBQGZPVQSZMEA-MRXNPFEDSA-N 495.967 5.549 5 20 JKBD COc1ccccc1NC(=O)Nc1cc(NC(=O)c2cc3cc([N+](=O)[O-])ccc3o2)ccc1OC 509454916 SHXQBQFQCIWCPN-UHFFFAOYSA-N 476.445 5.255 5 20 JKBD C[C@H]1CCCN(c2ccc(C(=O)Nc3cc(Cl)ccc3OC[C@@H]3CCCO3)cc2[N+](=O)[O-])C1 509790307 XHHLAROJGUEUEP-LPHOPBHVSA-N 473.957 5.295 5 20 JKBD CCNc1ccc(C(=O)Nc2ccc(N(C)C(=O)c3ccc(Cl)cc3)cc2)cc1[N+](=O)[O-] 511606350 UTCUGCHHHKAAOK-UHFFFAOYSA-N 452.898 5.209 5 20 JKBD COc1cc(C(=O)N(Cc2cccc(C)c2)CC(C)C)c([N+](=O)[O-])cc1OCc1cscn1 512419973 GAWLJEBOQDVDGV-UHFFFAOYSA-N 469.563 5.246 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Br)[C@H](NCc1cc2ccccc2s1)c1ccccc1 512912662 QERJHYVJZYYCRP-JOCHJYFZSA-N 496.386 6.042 5 20 JKBD CC(C)(C)c1ccc(C(=O)N2CCC([C@H]3C(=O)Nc4cc(Cl)ccc43)CC2)cc1[N+](=O)[O-] 514731263 XWGKNFDPYHGDSE-OAQYLSRUSA-N 455.942 5.134 5 20 JKBD C[C@H](SCc1nc(O)c2c(-c3ccccc3)csc2n1)C(=O)Nc1ccc([N+](=O)[O-])cc1 514944631 YDFPTTIEORNQCL-ZDUSSCGKSA-N 466.544 5.233 5 20 JKBD Cc1sc(NC(=O)CS[C@@H](C)c2nc3ccccc3[nH]2)nc1-c1cccc([N+](=O)[O-])c1 603996763 CMIOYEARBOOYBX-ZDUSSCGKSA-N 453.549 5.336 5 20 JKBD COc1ccc(C(=O)N(C)C)cc1NC(=O)c1cc([N+](=O)[O-])ccc1Sc1ccc(Cl)cc1 604006298 BXRNPVWNCOSAAE-UHFFFAOYSA-N 485.949 5.362 5 20 JKBD Cc1csc(Sc2ccc(C(=O)NC[C@H]3CCN(c4ccc(F)c(F)c4)C3)cc2[N+](=O)[O-])n1 604459118 OAMJVWWMPCJYAC-CQSZACIVSA-N 490.557 5.045 5 20 JKBD Cc1ccc([N+](=O)[O-])cc1C(=O)N(C[C@@H]1CCCO1)c1nc(-c2cccc(C(F)(F)F)c2)cs1 604470114 YEBNEGTWSIJXIP-SFHVURJKSA-N 491.491 5.871 5 20 JKBD CSCCc1ccc(N[C@@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2ccccc2)cc1 609041518 JJWHDLBNFXNUSN-JOCHJYFZSA-N 455.967 5.946 5 20 JKBD CN1CCN(C[C@H](NCc2ccc(Oc3ccccc3Cl)c([N+](=O)[O-])c2)c2ccccc2)CC1 609042392 UPBCCGOUEZWJPM-QHCPKHFHSA-N 480.996 5.119 5 20 JKBD Cc1ccc(C(=O)Nc2ccc(OC(=O)c3csc(-c4ccc([N+](=O)[O-])cc4)n3)cc2)cc1 726962903 WLQXPEMMXKMMQK-UHFFFAOYSA-N 459.483 5.498 5 20 JKBD O=c1ccc(-c2cccc([N+](=O)[O-])c2)nn1CN1CCC(CCc2cccc(C(F)(F)F)c2)CC1 747075589 DOARUMUABVSUQZ-UHFFFAOYSA-N 486.494 5.140 5 20 JKBD C[C@H]1CN(c2ccc(NC(=O)c3ccc(N[C@H](C)c4ccccn4)c([N+](=O)[O-])c3)cc2)C[C@@H](C)O1 747390978 WNQJMWWPVQXCOP-CEXWTWQISA-N 475.549 5.029 5 20 JKBD CCOC(=O)c1cc(-c2ccccc2)ccc1NC(=O)c1cc(OCC)c(OC)cc1[N+](=O)[O-] 748195529 YOWIUNPHURXLQW-UHFFFAOYSA-N 464.474 5.098 5 20 JKBD Cc1c(C(=O)Nc2ccc(Oc3cccc(Br)c3)nc2)cc([N+](=O)[O-])cc1[N+](=O)[O-] 749521846 VOJVMKYMWHJRIC-UHFFFAOYSA-N 473.239 5.014 5 20 JKBD Cc1oc(-c2cccs2)nc1COC(=O)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 841792471 CHZDLNWZHBXHCK-UHFFFAOYSA-N 495.479 5.598 5 20 JKBD O=C(Nc1ccc(OC[C@H](O)COCc2ccc(Cl)cc2)cc1)c1cc([N+](=O)[O-])ccc1Cl 914795784 ZQWYAVYEUVWADP-LJQANCHMSA-N 491.327 5.110 5 20 JKBD O=[N+]([O-])c1cccc(-c2nccc(/C=C\c3csc(-c4cccc(Br)c4)n3)[n+]2[O-])c1 915987717 JNXWHDZKLYVJCA-FPLPWBNLSA-N 481.331 5.347 5 20 JKBD O=C(Nc1ccc(S(=O)(=O)c2ccc(Br)cc2)cc1)c1cc(Cl)ccc1[N+](=O)[O-] 916440440 YTBDWCXFHFLSKN-UHFFFAOYSA-N 495.738 5.096 5 20 JKBD O=[N+]([O-])c1ccccc1CN(Cn1nc(NC2CCCCC2)sc1=S)CC(F)(F)F 917450703 NPZCFSYOMGALJW-UHFFFAOYSA-N 461.535 5.349 5 20 JKBD O=C(NC1(c2ccc(NC(=O)C34CC(F)(C3)C4)cc2)CCC1)c1cc2cc([N+](=O)[O-])ccc2s1 1786425002 RGCAJQWYFUZIAN-UHFFFAOYSA-N 479.533 5.449 5 20 JKBD CC(C)c1cc(C(=O)Nc2ccc(C3(NC(=O)/C=C/c4ccccc4[N+](=O)[O-])CCC3)cc2)no1 1787547319 NXXDWKZBQZBLAZ-MDWZMJQESA-N 474.517 5.167 5 20 JKBD O=C(CCc1ccsc1)Nc1ccc(C2(NC(=O)Cc3cc(F)ccc3[N+](=O)[O-])CCC2)cc1 1788188201 KCVRTUZNURNPOS-UHFFFAOYSA-N 481.549 5.105 5 20 JKBD COc1cc(C(=O)NC2(c3ccc(NC(=O)Cc4c[nH]c5ccccc45)cc3)CCC2)ccc1[N+](=O)[O-] 1790396660 NEWHFTWSOYUKKX-UHFFFAOYSA-N 498.539 5.075 5 20 JKBD O=C(/C=C/c1cccnc1)NC1(c2ccc(NC(=O)C3(c4cccc([N+](=O)[O-])c4)CCC3)cc2)CCC1 1790475922 LEOWVJSQIPCCLJ-MDWZMJQESA-N 496.567 5.259 5 20 JKBD O=C(/C=C/c1cnccn1)Nc1ccc(C2(NC(=O)c3cc4cc([N+](=O)[O-])ccc4s3)CCC2)cc1 1791927004 KLXVVENEGRQSRF-RMKNXTFCSA-N 499.552 5.061 5 20 JKBD COc1cc(C(=O)Nc2ccc(C3(NC(=O)/C=C/C4CCCC4)CCC3)cc2)ccc1[N+](=O)[O-] 1792165469 AFTGOQIJKPKIQC-VGOFMYFVSA-N 463.534 5.098 5 20 JKBD O=C(Cc1ccc(Cl)cc1[N+](=O)[O-])N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H]1CCC[C@H]2CCCC[C@H]21 1797869601 MYTRCMBBQRYNOZ-CJHLONAUSA-N 488.028 5.035 5 20 JKBD CC[C@H](C)[C@@H](C(=O)N1CCC2(CCCN(C(=O)Cc3cccc([N+](=O)[O-])c3)C2)CC1)c1ccccc1 1804751441 QJAFMBAXLSKPDN-WXVAWEFUSA-N 491.632 5.198 5 20 JKBD CC(C)c1ccc(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)c3cccc(F)c3[N+](=O)[O-])n[nH]2)cc1 1821173242 WIRMPHMRCIFOBQ-OAQYLSRUSA-N 479.512 5.200 5 20 JKBD CC(C)[C@H](C(=O)N1CCC([C@@H]2CCCCN2C(=O)Cc2cccc([N+](=O)[O-])c2)CC1)c1ccccc1 1823677287 SUJGFXBBAHFPLN-XCZPVHLTSA-N 491.632 5.197 5 20 JKBD O=C(c1cc2ccoc2s1)N1CCC([C@H]2CCCCN2C(=O)Cc2cc([N+](=O)[O-])ccc2F)CC1 1824949810 ZCMPAFYXTUUEMZ-OAQYLSRUSA-N 499.564 5.018 5 20 JKBD Cc1cc2cccc(C(=O)N3CCC([C@@H]4CCCCN4C(=O)c4cccc(F)c4[N+](=O)[O-])CC3)c2[nH]1 1830621525 LXOSULUTWCWEJD-QHCPKHFHSA-N 492.551 5.071 5 20 JKBD C[C@H]1CC[C@H](C(=O)N2CCCC[C@@H]2C2CCN(C(=O)/C=C/c3ccccc3[N+](=O)[O-])CC2)CC1 1832373532 QWUGZVZXOUQEJS-ZBEUAWRESA-N 467.610 5.054 5 20 JKBD O=C(COC(=O)Cn1c2ccccc2c(=O)c2ccccc21)Nc1ccccc1Oc1ccccc1 11275848 LGPVXPYCSGVEAP-UHFFFAOYSA-N 478.504 5.129 5 20 JKBD C[C@@H](OC(=O)c1cn(-c2ccccc2)nc1-c1cccs1)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 17530771 CKCDIBGVXPTFCG-OAHLLOKOSA-N 487.497 5.477 5 20 JKBD CC(C)n1ncc2c(C(=O)O[C@@H](C)c3nnc(-c4ccc([N+](=O)[O-])cc4)o3)cc(-c3ccccc3)nc21 17709239 GILXJMDQGWJWJR-INIZCTEOSA-N 498.499 5.555 5 20 JKBD COc1ccc(OCc2csc(-c3cc(Br)ccc3OC)n2)c([N+](=O)[O-])c1 22044240 WFXLJALYGVZYCE-UHFFFAOYSA-N 451.298 5.077 5 20 JKBD C[C@@H](Sc1ncc(-c2ccccc2)n1C[C@@H]1CCCO1)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl 22239516 AEAQRIWXDMTUTO-QAPCUYQASA-N 486.981 5.410 5 20 JKBD CC(C)Cn1c(SCC(=O)Nc2ccccc2[N+](=O)[O-])nnc1-c1ccc(Cl)cc1Cl 22720609 HEYBURQJDCVNBU-UHFFFAOYSA-N 480.377 5.547 5 20 JKBD CC(=O)N(c1nc(COc2ccc([N+](=O)[O-])cc2C(F)(F)F)cs1)c1ccccc1F 72033572 BZVZQQWOKUULJG-UHFFFAOYSA-N 455.389 5.473 5 20 JKBD CCOc1ccc([C@H](CNC(=O)c2ccc([N+](=O)[O-])cc2C)c2c[nH]c3ccccc23)cc1OC 72068638 NQKBDNRTUHPSOG-QFIPXVFZSA-N 473.529 5.354 5 20 JKBD C[C@H]1CCCN(c2ccc(C(=O)N(C)CCCc3cc(-c4cccc(F)c4)n[nH]3)cc2[N+](=O)[O-])C1 117694610 YZYLBZZZYAJPRZ-SFHVURJKSA-N 479.556 5.065 5 20 JKBD Cn1cnnc1Sc1ccc(C(=O)N[C@@H](Cc2ccccc2Cl)c2ccccc2)cc1[N+](=O)[O-] 195728220 SIKXOISNPPHXDH-FQEVSTJZSA-N 493.976 5.242 5 20 JKBD CC(C)C(=O)NC1CCN(C(=O)c2ccccc2Sc2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 478406780 QTOWEEQCMFRXRD-UHFFFAOYSA-N 495.523 5.142 5 20 JKBD COc1ccc([C@H](NCc2cc([N+](=O)[O-])ccc2OC)c2ccccc2)cc1Br 488082081 NGJXYZFBLWKBEX-JOCHJYFZSA-N 457.324 5.254 5 20 JKBD O=C(Nc1ccc(CN2CCOCC2)cc1)c1cc([N+](=O)[O-])ccc1Sc1ccc(Cl)cc1 497328571 ASNHOFBWDNRQIP-UHFFFAOYSA-N 483.977 5.484 5 20 JKBD COc1cc(C(=O)Nc2ccc(SC3CCCCC3)cc2C)c([N+](=O)[O-])cc1OC(F)F 498433256 LURKHUNSVPXAHB-UHFFFAOYSA-N 466.506 6.190 5 20 JKBD Cc1c(NC(=O)c2ccc(N3CCC[C@H](C)C3)c([N+](=O)[O-])c2)cccc1C(=O)Nc1ccccc1 498461766 GYNXHMSYJOOIOP-SFHVURJKSA-N 472.545 5.644 5 20 JKBD O=C(Cn1ccc2cc([N+](=O)[O-])ccc21)Nc1ccc2c(c1)CCC(=O)N2Cc1ccc(Cl)cc1 499151036 MWRURRRWUAKGOQ-UHFFFAOYSA-N 488.931 5.321 5 20 JKBD COC(=O)c1cc(C(=O)Nc2ccc(Oc3ncc(Cl)cc3Cl)cc2)cc([N+](=O)[O-])c1 500373014 RMGPQYSOFZFWCF-UHFFFAOYSA-N 462.245 5.128 5 20 JKBD C[C@H](c1cccc(C(F)(F)F)c1)N(C(=O)C1CCN(c2ccccc2[N+](=O)[O-])CC1)C1CC1 502888794 UHPAOERLQKUBRP-MRXNPFEDSA-N 461.484 5.582 5 20 JKBD Cc1ccc(C(=O)N2c3ccc([N+](=O)[O-])cc3C[C@H]2C)cc1NC(=O)c1ccc(Br)cc1 504334144 INQMFCNDXGWABV-OAHLLOKOSA-N 494.345 5.509 5 20 JKBD COc1ccc([C@H]2CCN(C(=O)C/C(=C/c3ccc([N+](=O)[O-])cc3)c3nc4ccccc4s3)C2)cc1 504947403 DHSWWJMSANVSTJ-YVUGPFRESA-N 499.592 6.160 5 20 JKBD C[C@H](Nc1ccc(C(=O)N2CCO[C@@H](c3ccccc3Cl)C2)cc1[N+](=O)[O-])c1ccccn1 505137114 QCZWHOHCMLTQID-QMHKHESXSA-N 466.925 5.030 5 20 JKBD COc1ccc(Oc2ccc([N+](=O)[O-])cc2C(=O)N2CCC(Nc3ccc(F)cc3)CC2)cc1 512122292 MCQBJGIIBASHOD-UHFFFAOYSA-N 465.481 5.252 5 20 JKBD Cc1ccccc1OCCCC(=O)Nc1ccc(CNC(=O)c2ccc(Cl)cc2[N+](=O)[O-])cc1 515560830 CWAYSWNMAGJPGN-UHFFFAOYSA-N 481.936 5.284 5 20 JKBD CC(C)CCSc1ccc(C(=O)N2CCC(NC(=O)CC3CCCC3)CC2)cc1[N+](=O)[O-] 517507950 AZZQJALGLRNFKY-UHFFFAOYSA-N 461.628 5.034 5 20 JKBD O=C(Nc1ccc(Oc2ccccc2C(F)(F)F)c(F)c1)c1ccc(-n2cncn2)c([N+](=O)[O-])c1 520446495 HUYSIBWJZMCJGE-UHFFFAOYSA-N 487.369 5.378 5 20 JKBD O=C(Nc1ccc(NC(=O)c2ccn(-c3ccc([N+](=O)[O-])cc3)n2)c(C(F)(F)F)c1)c1ccccc1 520683238 ZCNOEIREZQUBNS-UHFFFAOYSA-N 495.417 5.304 5 20 JKBD COc1cc(C(=O)N[C@H](CC2CCCCC2)c2ccccc2)c([N+](=O)[O-])cc1OCc1cscn1 523567778 GHIHRKBYTBPCPA-JOCHJYFZSA-N 495.601 6.080 5 20 JKBD C[C@H](CCc1ccco1)NC(=O)C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1 592465288 VGUPPJXYIOJACP-JFPYRBRCSA-N 461.543 5.866 5 20 JKBD O=C(CCNc1ccc(C(F)(F)F)cc1[N+](=O)[O-])Nc1ccc(Cl)cc1NC(=O)c1ccco1 604098358 YACCKSSHNSGCCK-UHFFFAOYSA-N 496.829 5.553 5 20 JKBD COc1cc(C(=O)N[C@@H](c2cccc(C(F)(F)F)c2)C(C)(C)C)c([N+](=O)[O-])cc1OC(F)F 608898979 OCJBEMNBZDLRKQ-KRWDZBQOSA-N 476.398 5.741 5 20 JKBD O=C(c1ccc(NCc2ccccc2Cl)c([N+](=O)[O-])c1)N1CCO[C@H](c2cccc(F)c2)C1 608965284 SZTMCPMZDFEUDB-QHCPKHFHSA-N 469.900 5.213 5 20 JKBD C[C@@H]1CO[C@H](c2ccccc2)CN1C(=O)C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1 608966522 PCMJOFQBGSFRJL-ZMRVYZJESA-N 499.592 6.124 5 20 JKBD COc1cccc([C@H](CNC(=O)c2c[nH]c3cc([N+](=O)[O-])ccc23)c2c[nH]c3ccccc23)c1OC 609586836 WNSFQVYLWUMREI-NRFANRHFSA-N 484.512 5.137 5 20 JKBD O=C(Cn1c2ccccc2c(=O)c2ccccc21)N1CCC[C@@H]1c1ccccc1C(F)(F)F 728034824 HCGBZCNTOQXDAT-OAQYLSRUSA-N 450.460 5.537 5 20 JKBD Cn1c(-c2cccc(OC(=O)Cn3c4ccccc4c(=O)c4ccccc43)c2)nc2ccccc21 728224455 UYLOOXXXLQGRGO-UHFFFAOYSA-N 459.505 5.314 5 20 JKBD Cc1nnc(SCc2c(C(=O)Nc3cc([N+](=O)[O-])c(F)cc3F)oc3ccccc23)s1 748616873 BURGKGMJSUDLKQ-UHFFFAOYSA-N 462.459 5.324 5 20 JKBD C[C@H]1CCC[C@@H](C)N1C(=O)c1cc(Cl)ccc1NC(=O)c1cc([N+](=O)[O-])ccc1Br 751080937 MZOPVSQYYDZNGR-BETUJISGSA-N 494.773 5.666 5 20 JKBD O=C(Nc1ccc(S(=O)(=O)Nc2cccc(C(F)(F)F)c2)cc1)c1ccc(Cl)cc1[N+](=O)[O-] 912988371 OWJQBMXTNYETML-UHFFFAOYSA-N 499.854 5.320 5 20 JKBD O=C(OCc1nnc(-c2ccc([N+](=O)[O-])cc2)o1)c1sc2cccc(Cl)c2c1Cl 913329071 XRAGWYNZSWMPMW-UHFFFAOYSA-N 450.259 5.523 5 20 JKBD Cc1cc(C)c(NC(=O)CCCOC(=O)c2cc([N+](=O)[O-])ccc2N2CCCCC2)c(C)c1 916591222 VDGUFMCNBFFARJ-UHFFFAOYSA-N 453.539 5.086 5 20 JKBD Cc1c(C(=O)OCC(=O)N2c3ccccc3Sc3ccc(Cl)cc32)cc([N+](=O)[O-])cc1[N+](=O)[O-] 919223613 JWMFJRDLMTUTSI-UHFFFAOYSA-N 499.888 5.451 5 20 JKBD CC(=O)N(c1ccc(Cl)c(Cl)c1)c1nc(COC(=O)c2cc(F)cc([N+](=O)[O-])c2N)cs1 919505202 MVCVSRZZEIIXBE-UHFFFAOYSA-N 499.307 5.121 5 20 JKBD C[C@@H](OC(=O)Cc1csc(-c2ccc(Cl)s2)n1)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl 920677004 TYWQHFUYBJTPKI-SECBINFHSA-N 486.358 5.200 5 20 JKBD Cc1cc2[nH]c(C(=O)NC3(c4ccc(NC(=O)c5ccc(O)c([N+](=O)[O-])c5)cc4)CCC3)cc2s1 1790618643 DAUJEKSROIMFSZ-UHFFFAOYSA-N 490.541 5.213 5 20 JKBD CC1=CC[C@@H](C(=O)Nc2cc([C@@H]3CCCCN3C(=O)c3cc(Cl)cc([N+](=O)[O-])c3C)[nH]n2)CC1 1818808446 YLOLCDLWYQMDMU-UZLBHIALSA-N 485.972 5.332 5 20 JKBD Cc1ccc(CCC(=O)O[C@@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2C(F)(F)F)cc1Cl 10740146 OZYNLSCOJYQYBQ-LBPRGKRZSA-N 458.820 5.078 5 20 JKBD COc1ccc(/C=C/C(=O)O[C@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2ccccc2)cc1 10899141 DOWTWKVFMYNRAV-PZVJUEDKSA-N 466.877 5.193 5 20 JKBD CCCCSc1nnc(SCC(=O)Nc2ccc([N+](=O)[O-])cc2C(F)(F)F)s1 22489594 NJKIFYYSCWFYMI-UHFFFAOYSA-N 452.505 5.088 5 20 JKBD O=C(c1ccc(C2SCCS2)cc1)N1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 22917381 FSIOSXWGQBZGBK-UHFFFAOYSA-N 483.537 5.055 5 20 JKBD CC(C)n1ncc2cc(NC(=O)c3ccccc3NC(=O)c3ccc([N+](=O)[O-])cc3Cl)cnc21 23008138 KAYCBLIHGQTATR-UHFFFAOYSA-N 478.896 5.078 5 20 JKBD C[C@@H](Nc1ccc2oc(C(C)(C)C)nc2c1)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 27043517 KSTUBIXYPUIBPG-LLVKDONJSA-N 450.417 5.491 5 20 JKBD O=C(CCCn1c(=O)oc2cc([N+](=O)[O-])ccc21)Nc1ccc2[nH]c(-c3ccccc3Cl)nc2c1 68729046 XKCHYMDEGPKRIR-UHFFFAOYSA-N 491.891 5.118 5 20 JKBD O=C(Cn1c2ccccc2c(=O)c2ccccc21)Nc1nc(-c2cccc(C(F)(F)F)c2)cs1 69569668 RVAMHKRKRYRCRF-UHFFFAOYSA-N 479.483 5.936 5 20 JKBD CCc1cc(Sc2nnc(-c3cccs3)n2C2CC2)nc(-c2ccc([N+](=O)[O-])cc2)n1 72018780 XPJANVMKCMPMRU-UHFFFAOYSA-N 450.549 5.420 5 20 JKBD CCN(Cc1c(F)cccc1F)C(=O)c1ccccc1NC(=O)c1ccc([N+](=O)[O-])cc1Cl 116592391 CXNOJQKFSDGXON-UHFFFAOYSA-N 473.863 5.441 5 20 JKBD COc1cc(C(=O)Nc2cc(NC(C)=O)ccc2F)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 484401034 HKXGJBZACVAHLS-UHFFFAOYSA-N 473.844 5.399 5 20 JKBD C[C@H]1C[C@@H](C)CN(c2ccc(C(=O)Nc3ccc(N(C)C)cc3C(F)(F)F)cc2[N+](=O)[O-])C1 485293106 ZOAFZIQFJLBPHI-GASCZTMLSA-N 464.488 5.414 5 20 JKBD CC(C)N(CC(=O)Nc1ccccc1C(F)(F)F)C(=O)c1csc(-c2ccc([N+](=O)[O-])cc2)n1 505242624 NBVSWWNRZCDGMU-UHFFFAOYSA-N 492.479 5.226 5 20 JKBD C[C@@H](c1ccc(Cl)c(Cl)c1)N(C)C(=O)c1ccc(N[C@H](C)c2ccccn2)c([N+](=O)[O-])c1 506176759 BFFJVCUQJSRLNE-CABCVRRESA-N 473.360 6.303 5 20 JKBD O=C(c1ccccc1F)N1CCC(NCc2ccc(Oc3ccccc3Cl)c([N+](=O)[O-])c2)CC1 509587800 SRYLRLXSCKHNNA-UHFFFAOYSA-N 483.927 5.574 5 20 JKBD CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccc(C(=O)NCc2ccccc2F)cc1 509591600 JLUPJMLIZAUYMX-UHFFFAOYSA-N 464.497 5.106 5 20 JKBD O=C(Nc1cccc(CNCc2ccc(Oc3ccccc3Cl)c([N+](=O)[O-])c2)c1)[C@@H]1CCCO1 509621978 VHLJJBMUGFFQID-DEOSSOPVSA-N 481.936 5.448 5 20 JKBD COc1cc(C(=O)N(C2CC2)[C@H](C)c2ccc(Cl)cc2)c([N+](=O)[O-])cc1OCc1cscn1 512326797 BJYPGMSJUKOAGS-CQSZACIVSA-N 487.965 5.658 5 20 JKBD CCOC(=O)c1c(C2CC2)csc1NC(=O)c1ccc(N[C@@H](C)c2ccccn2)c([N+](=O)[O-])c1 512553661 HOANKTWQJYQPPT-AWEZNQCLSA-N 480.546 5.531 5 20 JKBD O=C(Nc1nc2ccc(S(=O)(=O)N3CCCC3)cc2s1)c1cc2ccccc2c2cccnc12 515157213 NDTGHPXAPWZLQC-UHFFFAOYSA-N 488.594 5.035 5 20 JKBD C[C@H](NC(=O)c1cnn(-c2cccc(C(F)(F)F)c2)c1C(F)(F)F)c1cccc([N+](=O)[O-])c1 515682013 XGVNRYQXQNXZAY-NSHDSACASA-N 472.345 5.309 5 20 JKBD COc1ccc([N+](=O)[O-])c(C(=O)Nc2cc(C)nn2-c2cc(C(F)(F)F)ccc2Cl)c1 516321937 RZCQQPJMTGHXBK-UHFFFAOYSA-N 454.792 5.022 5 20 JKBD CC(=O)N(c1nc(COc2ccc(-c3ccccc3)cc2[N+](=O)[O-])cs1)c1ccccc1F 516343619 LXAMSUQRGWVTLV-UHFFFAOYSA-N 463.490 6.121 5 20 JKBD CC[C@@H](NC(=O)C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)c1nc(C)cs1 519122776 XAQUOWHNDKMQFA-XYSGSMRZSA-N 478.599 6.168 5 20 JKBD Cc1ccc([N+](=O)[O-])cc1C(=O)Nc1ccccc1OCc1ncc(-c2cccc(Cl)c2)o1 524210045 GLNWECOKDXMGJO-UHFFFAOYSA-N 463.877 6.043 5 20 JKBD COc1ccc(C2(NC(=O)c3ccc(N[C@H](C)c4ccccn4)c([N+](=O)[O-])c3)CCCC2)cc1 574298220 VHOZYJZRIHTQQU-GOSISDBHSA-N 460.534 5.371 5 20 JKBD Cc1nc(CSc2ccccc2C(=O)NCCNc2ccc(C(F)(F)F)cc2[N+](=O)[O-])cs1 591659420 HLYVFLJGKMVMPM-UHFFFAOYSA-N 496.536 5.513 5 20 JKBD C[C@H](Nc1ccc(CCN2CCCCC2)cc1)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 604046843 KIFXKLNPLMILMW-INIZCTEOSA-N 464.488 5.081 5 20 JKBD O=C(c1cc([N+](=O)[O-])ccc1Sc1ccccc1)N1CCC(N2CCc3ccccc3C2)CC1 604482456 JSHYGACENZSVJV-UHFFFAOYSA-N 473.598 5.409 5 20 JKBD CN(CCCc1cc(-c2ccc(F)cc2)no1)C(=O)c1ccc(NCc2ccccc2)c([N+](=O)[O-])c1 608778361 PALMPTRHRPXKDE-UHFFFAOYSA-N 488.519 5.706 5 20 JKBD Cc1ccc(NC(=O)c2ccc(N3CCC[C@@H](C(=O)Nc4ccccc4)C3)c([N+](=O)[O-])c2)cc1 608972427 JGHYFMHTAAUIBT-HXUWFJFHSA-N 458.518 5.011 5 20 JKBD O=[N+]([O-])c1ccc(-c2ccc(CNCCCc3nc4ccccc4[nH]3)o2)c(Br)c1 609006809 YMKBPHNXHMLCCB-UHFFFAOYSA-N 455.312 5.216 5 20 JKBD CCOCCOc1ccc(Cl)cc1NC(=O)c1ccc(N2CCC[C@H](C)C2)c([N+](=O)[O-])c1 609103689 SHPVRDJIBIPCDB-INIZCTEOSA-N 461.946 5.152 5 20 JKBD O=C(C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)N1CCC[C@@H](N2CCCC2)C1 609346253 WDQISEIVQDURTL-QMZMWQIVSA-N 476.602 5.222 5 20 JKBD COc1ccc(NC(=S)/C(=C(/O)c2ccc([N+](=O)[O-])cc2)[n+]2ccc(C(C)(C)C)cc2)cc1F 726576580 VYPHOFUYIUUTJH-UHFFFAOYSA-O 482.557 5.651 5 20 JKBD O=C(CCC(=O)c1ccc2ccc3cccc4ccc1c2c34)NCc1ccc(N2CCOCC2)nc1 727753707 PHVRGWHLZOOLHO-UHFFFAOYSA-N 477.564 5.095 5 20 JKBD O=C(OCC1CCN(c2ncccc2[N+](=O)[O-])CC1)c1csc(-c2cccc(C(F)(F)F)c2)n1 729195331 JDCYPBBCOCLNSL-UHFFFAOYSA-N 492.479 5.206 5 20 JKBD C[C@H](Nc1ccc(C(=O)Nc2ccc(SC(=O)N(C)C)cc2)cc1[N+](=O)[O-])c1ccccn1 729248470 RWLFSQSODNFMRY-HNNXBMFYSA-N 465.535 5.189 5 20 JKBD C[C@@H](Nc1ccc(OCc2ccccn2)c(Cl)c1)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 744262217 XAHJOKXZKNPIKC-CYBMUJFWSA-N 494.857 5.680 5 20 JKBD C[C@H](Sc1nc2ccc([N+](=O)[O-])cc2s1)C(=O)Nc1ccc(NC(=O)c2cccs2)cc1 749453905 YOXMCMYPYHWYRD-LBPRGKRZSA-N 484.584 5.638 5 20 JKBD COc1cc(C2SCCS2)ccc1OC(=O)c1cc([N+](=O)[O-])ccc1Br 751060867 IZFLVGQATXHTOL-UHFFFAOYSA-N 456.339 5.064 5 20 JKBD Cc1c(C(=O)Nc2nc3cc(C(F)(F)F)ccc3n2Cc2ccco2)cc([N+](=O)[O-])cc1[N+](=O)[O-] 790910471 HCVQYJYRQDGMLZ-UHFFFAOYSA-N 489.366 5.074 5 20 JKBD CC(C)c1ccc(-c2nc(C(=O)O[C@H](C)C(=O)Nc3ccc(F)c([N+](=O)[O-])c3)cs2)cc1 900234700 HWHUZCWYGISGTH-CYBMUJFWSA-N 457.483 5.165 5 20 JKBD CCc1ccc(-c2csc(NC(=O)c3cc([N+](=O)[O-])ccc3I)n2)s1 915277584 XAQINCGXBYZPQO-UHFFFAOYSA-N 485.328 5.199 5 20 JKBD Cc1ccc(/C(O)=C(/C(=S)Nc2ccc3ccccc3c2)[n+]2ccc(C(C)(C)C)cc2)cc1[N+](=O)[O-] 917611093 YXRHYJMWIZAHEL-UHFFFAOYSA-O 498.628 6.965 5 20 JKBD Cc1ccc(Cn2ccccc2=NC(=O)c2ccc(N[C@H](C)c3ccccn3)c([N+](=O)[O-])c2)cc1 919746094 SPPMTUNOJSPGEC-HXUWFJFHSA-N 467.529 5.062 5 20 JKBD O=C(Cc1cccc([N+](=O)[O-])c1)Nc1ccc(C2(NC(=O)Cc3cccc4ncccc34)CCC2)cc1 1785791824 LADRCTIOBILERA-UHFFFAOYSA-N 494.551 5.062 5 20 JKBD Cc1ccc2[nH]cc(CC(=O)Nc3ccc(C4(NC(=O)c5cc(C)c([N+](=O)[O-])cn5)CCC4)cc3)c2c1 1786781284 ADGIEXNEBWKURK-UHFFFAOYSA-N 497.555 5.078 5 20 JKBD CSc1ccc(CC(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)cc1 1801208935 WSCMYUWAGQJKMV-REPLKXPHSA-N 495.626 5.026 5 20 JKBD CC(C)c1ccc(CC(=O)N2CCCC[C@H]2c2cc(NC(=O)c3ccc([N+](=O)[O-])cc3F)n[nH]2)cc1 1821051485 ZXERDTWTFZZPJT-QHCPKHFHSA-N 493.539 5.129 5 20 JKBD CC/C=C(\C)C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cc3cc([N+](=O)[O-])ccc3s2)n[nH]1 1821610593 HALOWYWDPCIHHR-LQELHHAWSA-N 467.551 5.195 5 20 JKBD O=C(c1cc2cc([N+](=O)[O-])ccc2s1)N1CCC([C@@H]2CCCCN2C(=O)C2=CCCC2)CC1 1826278831 OJQVGHFXVQPECT-NRFANRHFSA-N 467.591 5.153 5 20 JKBD Cc1ccc(C(=O)N2CCC([C@@H]3CCCCN3C(=O)c3cccc(F)c3[N+](=O)[O-])CC2)cc1Cl 1830616001 CSQJXRQTTUVFOU-QFIPXVFZSA-N 487.959 5.243 5 20 JKBD Cc1nc(C(=O)N2CCC([C@@H]3CCCCN3C(=O)c3cc4cc([N+](=O)[O-])ccc4s3)CC2)cs1 1831060547 ZEXSOLXXDBIBNQ-FQEVSTJZSA-N 498.630 5.122 5 20 JKBD C[C@@H](CC(=O)N1CCCC[C@H]1C1CCN(C(=O)/C=C/c2ccccc2[N+](=O)[O-])CC1)c1ccccc1 1831510413 MRFQHHULILGEFM-AINZQRSMSA-N 489.616 5.422 5 20 JKBD C[C@@H](C(=O)N1CCCC[C@H]1C1CCN(C(=O)Cc2ccc(Cl)cc2[N+](=O)[O-])CC1)c1ccccc1 1832889286 LCIHZCXVBGTPME-DVECYGJZSA-N 498.023 5.214 5 20 JKBD COc1cc(OC)c(NC(=O)c2ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])c(OC)c2)cc1Cl 14716448 DRRGYIMLLFEBOS-UHFFFAOYSA-N 493.299 5.972 5 20 JKBD CCn1c(SCC(=O)Nc2ccccc2-c2ccccc2)nc2cc3ccccc3cc2c1=O 22178102 HTNIZCGCJROYKH-UHFFFAOYSA-N 465.578 5.967 5 20 JKBD CCOC(=O)c1cc(C(=O)N(Cc2ccccc2)[C@@H](C)c2cccc(NC(C)=O)c2)cc([N+](=O)[O-])c1 23193147 XZOQLKHKTFZNAB-SFHVURJKSA-N 489.528 5.134 5 20 JKBD O=C(c1ccc([N+](=O)[O-])cc1)N(C[C@H]1CCCO1)c1nc(-c2cccc(C(F)(F)F)c2)cs1 26131624 TXBOGUNNJASAIG-GOSISDBHSA-N 477.464 5.563 5 20 JKBD Cc1c(NC(=O)[C@H](C)Sc2nnc(Cc3cccs3)n2-c2ccccc2)cccc1[N+](=O)[O-] 26978346 ZUYJBAGHYFFCNY-INIZCTEOSA-N 479.587 5.256 5 20 JKBD C[C@H](NC(=O)c1cc([N+](=O)[O-])ccc1NCc1ccccc1)c1ccc(NC(=O)C2CC2)cc1 27299355 AWTUZISDANAYSI-KRWDZBQOSA-N 458.518 5.046 5 20 JKBD Cn1cnnc1Sc1ccc(C(=O)N[C@H](Cc2ccc(Cl)cc2)c2ccccc2)cc1[N+](=O)[O-] 68740242 URGZZHSHXLBOTD-HXUWFJFHSA-N 493.976 5.242 5 20 JKBD COc1cc(C(=O)N[C@@H](c2ccccc2)c2ccncc2)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 104831348 RHDXVQXMKQBEIP-VWLOTQADSA-N 489.915 5.964 5 20 JKBD Cc1sc(NC(=O)c2ccn(-c3cccc([N+](=O)[O-])c3)n2)nc1-c1ccc(OC(F)F)cc1 106205766 CFEXYGLQVJEGQD-UHFFFAOYSA-N 471.445 5.066 5 20 JKBD O=C(Cn1c2ccccc2c(=O)c2ccccc21)NCc1ccc(COCc2ccccc2)cc1 480344532 DOTJVPYRALBPAF-UHFFFAOYSA-N 462.549 5.188 5 20 JKBD O=C(c1csc(-c2ccc([N+](=O)[O-])cc2)n1)N1CCC[C@@H]1c1cccc(Br)c1 497501823 GDUDKDCHPVMJBH-GOSISDBHSA-N 458.337 5.458 5 20 JKBD C[C@H]1Cc2cc([N+](=O)[O-])ccc2N1C(=O)c1ccc2c(c1)C(=O)N(c1cc(Cl)ccc1Cl)C2=O 504347071 FXXBXAUASBVCGF-LBPRGKRZSA-N 496.306 5.294 5 20 JKBD Cn1cc(C(=O)Nc2ccc(Oc3ncc(Cl)cc3Cl)cc2)c(-c2ccc([N+](=O)[O-])cc2)n1 508967575 LYWZPLHQJIPIJZ-UHFFFAOYSA-N 484.299 5.742 5 20 JKBD Cc1noc(C2CCN(C(=O)C/C(=C/c3ccc([N+](=O)[O-])cc3)c3nc4ccccc4s3)CC2)n1 509141054 RYHCBSZXPQPBQK-RGEXLXHISA-N 489.557 5.233 5 20 JKBD C[C@@H](NC(=O)CSc1ncnc2scc(-c3ccccc3)c12)c1cccc([N+](=O)[O-])c1 516126642 JHUHWHSIBFZKOB-CQSZACIVSA-N 450.545 5.236 5 20 JKBD Cc1ccc(NC(=O)c2ccc(Sc3nnc(NCc4ccco4)s3)c([N+](=O)[O-])c2)cc1 518388419 ABWJAENBAFPEMN-UHFFFAOYSA-N 467.532 5.363 5 20 JKBD O=[N+]([O-])c1ccc(-c2nnc(CN(Cc3ccc(-c4ccccc4C(F)(F)F)o3)C3CC3)o2)cc1 518576646 RNHOSGXOKCIWCO-UHFFFAOYSA-N 484.434 6.088 5 20 JKBD C[C@H](NC(=O)Nc1ccc2c(c1)CCC(=O)N2Cc1ccc(Cl)cc1)c1cccc([N+](=O)[O-])c1 519501109 ILDVOIIPEYUCFI-INIZCTEOSA-N 478.936 5.610 5 20 JKBD CC(C)COC1CCN([C@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Br)c2ccccc2)CC1 520041431 YCERNFWLXCSAIZ-QFIPXVFZSA-N 490.398 5.174 5 20 JKBD O=C(Cn1c2ccccc2c(=O)c2ccccc21)Nc1cccc(COCCc2ccccc2)c1 520449183 RJYXDMNTDVMSKY-UHFFFAOYSA-N 462.549 5.553 5 20 JKBD O=C(c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1)N1CCO[C@@H](c2ccccc2F)C1 524052719 UMBKMLJHSJDBRD-JOCHJYFZSA-N 456.857 5.393 5 20 JKBD O=C(C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)N1CCC[C@H]1c1ccc(F)cc1 592950220 QZKQKOGPDIURPY-JTENEOOYSA-N 487.556 6.638 5 20 JKBD CN(C)[C@@H](CNC(=O)C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)c1ccccc1 603454112 WNNXURFUAADYAJ-RTWFUWSXSA-N 486.597 5.554 5 20 JKBD Cc1csc(Sc2ccc(C(=O)Nc3nc(-c4ccncc4)cs3)cc2[N+](=O)[O-])n1 603454684 DFFCTKIWQUCCCH-UHFFFAOYSA-N 455.546 5.282 5 20 JKBD Cc1ccc(-c2csc(NC(=O)c3cccc(C)c3I)n2)cc1[N+](=O)[O-] 603636629 GVDSGMKKCUBHMA-UHFFFAOYSA-N 479.299 5.192 5 20 JKBD Cc1ccc(NC(=O)Cc2ccc(NC(=O)c3cccc(Br)c3)cc2)cc1[N+](=O)[O-] 603750356 ICKDCMDEQJFANZ-UHFFFAOYSA-N 468.307 5.099 5 20 JKBD Cc1c(Cl)cccc1NC(=O)c1ccc(C(=O)Nc2cccc(Cl)c2C)c([N+](=O)[O-])c1 603834514 OKYITZYFBRZYKC-UHFFFAOYSA-N 458.301 6.023 5 20 JKBD Cc1ccc(C(=O)N2C[C@H](C)C[C@@H](C)C2)cc1NC(=O)c1cc2cc([N+](=O)[O-])ccc2s1 603977213 XQSJPQKLDQUYPX-HUUCEWRRSA-N 451.548 5.488 5 20 JKBD C[C@@H](Nc1ccc(Oc2cccc(F)c2)cc1)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 604046343 AIMNVJBQOWZNJW-CYBMUJFWSA-N 463.387 5.984 5 20 JKBD O=C(c1ccc(Cl)cc1)C1CCN(C(=O)CCNc2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 604195683 LFEYPJUFHHWCGO-UHFFFAOYSA-N 483.874 5.191 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Cl)[C@@H](c1ccccc1)N1CCCO[C@H](c2ccccc2)C1 609233239 BSSMTRRCZVUMMT-BJKOFHAPSA-N 465.937 5.392 5 20 JKBD O=C(CNC(=O)c1c(Cl)cccc1[N+](=O)[O-])Nc1cccc(-c2ccc(Cl)c(Cl)c2)c1 731051415 LEZYWVACRNADIA-UHFFFAOYSA-N 478.719 5.591 5 20 JKBD C[C@H](OC(=O)c1cnc(-c2ccccc2Cl)s1)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl 747954984 RERGBYMLELPOCH-JTQLQIEISA-N 466.302 5.209 5 20 JKBD CC[C@@H](C)Sc1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2N2CCOCC2)c(C(F)(F)F)c1 748658668 VUMHOQJCPBCLKQ-CQSZACIVSA-N 483.512 5.593 5 20 JKBD C[C@H](Nc1ccc(C(=O)Oc2ccccc2Oc2ccccn2)cc1[N+](=O)[O-])c1ccccn1 748675696 NWYBNJGXMONAKD-KRWDZBQOSA-N 456.458 5.569 5 20 JKBD O=C(Nc1ccc(N2CCCCC2)c(Cl)c1)c1ccc([N+](=O)[O-])cc1I 751097471 KUAJFQNNSLEPCH-UHFFFAOYSA-N 485.709 5.095 5 20 JKBD C[C@@H](OC(=O)Cc1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1)C(=O)c1ccc(F)cc1F 760450269 KOFQYQKNTJSCTC-MRXNPFEDSA-N 491.450 5.083 5 20 JKBD Cc1ccc(C)c(C(=O)c2ccccc2C(=O)O[C@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c1 844149100 LWGFKHNUQXTQGS-MRXNPFEDSA-N 480.904 5.280 5 20 JKBD C[C@@H](Nc1ccc(C(=O)N2CCC[C@H](Oc3ccc(C4CC4)cn3)C2)cc1[N+](=O)[O-])c1ccccn1 858034282 YHJAGLFPMMBGSZ-GCJKJVERSA-N 487.560 5.119 5 20 JKBD O=C(O[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1)c1cc2cc([N+](=O)[O-])ccc2o1 917262750 BOOUBDNTHKNDEN-OAQYLSRUSA-N 495.831 5.439 5 20 JKBD O=C(CCOCc1ccccc1)Oc1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2Cl)cc1 918144789 HRTBCXLNVJBUHO-UHFFFAOYSA-N 454.866 5.013 5 20 JKBD O=C(C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)NCCSC(F)(F)F 918591318 RNTFUULMKLZXAR-SDNWHVSQSA-N 467.494 5.504 5 20 JKBD Cc1ccc(NC(=O)[C@H](OC(=O)c2ccc(-c3cnco3)cc2)c2ccccc2)c([N+](=O)[O-])c1 919499312 WHWOYBZDZGVDIJ-HSZRJFAPSA-N 457.442 5.095 5 20 JKBD CC(=O)Nc1ccc(F)c(C(=O)Nc2cc(Cl)c([N+](=O)[O-])cc2OCc2ccccc2)c1 919682431 LBYUQLAXSCNHFL-UHFFFAOYSA-N 457.845 5.177 5 20 JKBD COc1cc(C(=O)Nc2ccc3nc(SC)sc3c2)c([N+](=O)[O-])cc1OCc1cscn1 919880205 CBQFGWRCRUIGKN-UHFFFAOYSA-N 488.572 5.223 5 20 JKBD C[C@H](Nc1ccc(C(=O)OCC(=O)c2cccc3ccccc23)cc1[N+](=O)[O-])c1ccccn1 920547592 OTQFBUITMWXPSI-KRWDZBQOSA-N 455.470 5.356 5 20 JKBD O=C(COC(=O)C1(c2cccc(F)c2)CCCCC1)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 920664185 VYQVBTITLYTQNM-UHFFFAOYSA-N 468.403 5.137 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)Nc1ccc(C2(NC(=O)c3ccc4cccnc4n3)CCC2)cc1 1790771127 RJCRLYYTOYAVLQ-UHFFFAOYSA-N 499.502 5.047 5 20 JKBD Cc1cc(C(=O)NC2(c3ccc(NC(=O)/C=C/c4ccccc4[N+](=O)[O-])cc3)CCC2)cnc1C 1792315744 XZVDKGNNUVOUEK-MDWZMJQESA-N 470.529 5.068 5 20 JKBD CC[C@@H](C)[C@@H](C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CSc1ccccc1[N+](=O)[O-])c1ccccc1 1802183273 PPZLZUDFMNEIDO-RCCQWWGCSA-N 495.645 5.155 5 20 JKBD CC(C)=CCCC(=O)N1CC[C@@H](CNC(=O)c2cc3cc([N+](=O)[O-])ccc3s2)[C@@H]1c1cccnc1 1812303821 ORHPPBGOGJBNHS-DFBJGRDBSA-N 492.601 5.271 5 20 JKBD CC1=CC[C@H](C(=O)N2CCCC[C@H]2c2cc(NC(=O)C3(c4cccc([N+](=O)[O-])c4)CCC3)n[nH]2)CC1 1820841169 PXUMOMPYZXGUTG-CVDCTZTESA-N 491.592 5.178 5 20 JKBD C[C@@H]1CCC[C@@H]1C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cc3cc([N+](=O)[O-])ccc3s2)n[nH]1 1821610226 WJMSMGXJDFCXHO-DKSSEZFCSA-N 481.578 5.275 5 20 JKBD CC(C)[C@H](C(=O)N1CCCC[C@H]1C1CCN(C(=O)/C=C/c2ccc([N+](=O)[O-])o2)CC1)c1ccccc1 1824235568 LXECHXWOUOROGB-JSWUZGHSSA-N 493.604 5.261 5 20 JKBD Cc1cc(Cl)c(Cl)cc1C(=O)N1CCC([C@H]2CCCCN2C(=O)c2ccc([N+](=O)[O-])[nH]2)CC1 1829835355 VUEGHUXKNAJHSW-HXUWFJFHSA-N 493.391 5.085 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cccc(Cl)c2)CC1 1829973033 SMGZZWYHNXTEES-JOCHJYFZSA-N 487.959 5.243 5 20 JKBD CCCCC[C@H](C)C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2ccc([N+](=O)[O-])c(OC)c2)CC1 1832696650 DAMPMOLZWOBJGX-UGKGYDQZSA-N 473.614 5.053 5 20 JKBD C[C@@H](Sc1nnc(-c2cccnc2)n1Cc1ccccc1)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 17664545 ZWOCKTQKBMLGDE-MRXNPFEDSA-N 485.529 5.200 5 20 JKBD CC(C)N(Cc1nnc(-c2cccc([N+](=O)[O-])c2)o1)C(=S)Nc1ccc(OC(F)(F)F)cc1 18143035 NVDAGJKJSSBMBY-UHFFFAOYSA-N 481.456 5.151 5 20 JKBD Cn1ccnc1[C@@H](NC(=O)c1ccc(NCc2ccccc2)c([N+](=O)[O-])c1)c1ccc(Cl)cc1 28946994 GBWRERQIFRAPLB-QHCPKHFHSA-N 475.936 5.113 5 20 JKBD Cc1sc2nc(S[C@@H](C)C(=O)Nc3ccc([N+](=O)[O-])cc3Cl)n(C(C)C)c(=O)c2c1C 36821081 GCKRZDCUEIGNCC-LBPRGKRZSA-N 480.999 5.337 5 20 JKBD Cc1sc(NC(=O)CCCc2nc(-c3ccc(F)cc3)no2)nc1-c1cccc([N+](=O)[O-])c1 195704332 MIYFDUUDYPNOCJ-UHFFFAOYSA-N 467.482 5.177 5 20 JKBD COc1ccccc1[C@H](C)CC(=O)N1CCN(Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)CC1 482752885 OIMDQKRXVPJJDW-LJQANCHMSA-N 479.602 5.170 5 20 JKBD CCOc1cc([N+](=O)[O-])c(C(=O)Nc2cccc(Cl)c2Sc2nc(C)cs2)cc1OC 499241727 BWSADPXODITPPS-UHFFFAOYSA-N 479.967 5.824 5 20 JKBD CN(C(=O)C1CCN(c2ccccc2[N+](=O)[O-])CC1)[C@@H]1CCSc2ccc(Br)cc21 504565483 GPIBXULSAZETFU-GOSISDBHSA-N 490.423 5.269 5 20 JKBD CCOC(=O)c1c(NC(=O)c2ccc(N[C@@H](C)c3ccccn3)c([N+](=O)[O-])c2)sc(C)c1C 506219683 RVUFAZALMIVBIW-AWEZNQCLSA-N 468.535 5.270 5 20 JKBD C[C@H](Nc1ccc(C(=O)NCCc2ccccc2C(F)(F)F)cc1[N+](=O)[O-])c1ccccn1 507870783 BMSUHIHIIPUGTR-HNNXBMFYSA-N 458.440 5.154 5 20 JKBD CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)Cc1csc(COc2ccc(Cl)cc2)n1 509699066 PVKNAHAWXMBMBF-UHFFFAOYSA-N 459.955 5.263 5 20 JKBD CC(C)N(Cc1ccc(-c2ccccc2F)s1)C(=O)c1ccc(-n2cncn2)c([N+](=O)[O-])c1 510322753 VWSASDGKGZBPMB-UHFFFAOYSA-N 465.510 5.094 5 20 JKBD COCCN(C(=O)c1ccc(N(C)c2ccccc2)nc1)c1nc(-c2ccc([N+](=O)[O-])cc2)cs1 514424039 HFWVMRJSFGUFOL-UHFFFAOYSA-N 489.557 5.174 5 20 JKBD CCCN(C(=O)c1cc(C(=O)OC)cc([N+](=O)[O-])c1)c1nc(-c2ccc(Cl)cc2Cl)cs1 514472113 LTOYPLQUZYJVSU-UHFFFAOYSA-N 494.356 5.869 5 20 JKBD C[C@H](Sc1nnc(-c2ccccc2)n1[C@H](C)c1ccccc1)C(=O)Nc1ccc([N+](=O)[O-])cc1 515488824 YBXWLMNGFJZVAM-MSOLQXFVSA-N 473.558 5.582 5 20 JKBD CS(=O)(=O)c1ccc(N[C@H](c2ccccc2)c2ccc(Br)cc2F)c([N+](=O)[O-])c1 515554474 JEVIIODSNRBGOV-HXUWFJFHSA-N 479.327 5.101 5 20 JKBD COc1cc(CN(C)c2ccc([N+](=O)[O-])c(C(=O)N3CCCC3)c2)ccc1OCc1ccccc1 515606518 VDSLJBIBDNSAMS-UHFFFAOYSA-N 475.545 5.055 5 20 JKBD COc1ccc(OC)c([C@@H]2CCCN2C(=O)COc2ccc(-c3ccccc3)cc2[N+](=O)[O-])c1 516786534 NXDUFTAVEHUCPS-QFIPXVFZSA-N 462.502 5.022 5 20 JKBD C[C@H](Nc1ccc(C(=O)N2CC=C(c3cccc4ccccc34)CC2)cc1[N+](=O)[O-])c1ccccn1 521759673 XUIHSWZGHQEEIK-FQEVSTJZSA-N 478.552 6.246 5 20 JKBD O=C(NCCCN1CCCCCC1=O)c1ccccc1Sc1ccc(C(F)(F)F)cc1[N+](=O)[O-] 603452360 ZMMBTFBFFGWQJC-UHFFFAOYSA-N 495.523 5.287 5 20 JKBD COCCN(C(=O)c1sc2cc(F)ccc2c1Cl)c1nc(-c2ccc([N+](=O)[O-])cc2)cs1 603461272 KNLGKAQHUGMVER-UHFFFAOYSA-N 491.953 6.019 5 20 JKBD O=C(Cc1ccccc1[N+](=O)[O-])N(C[C@H]1CCCO1)c1nc(-c2ccc(Cl)cc2Cl)cs1 603463234 SFBQVVCSRJIYAN-MRXNPFEDSA-N 492.384 5.780 5 20 JKBD CN(C)c1ccccc1NC(=O)C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1 603568159 JKBHMGHCBCTCPB-OBGWFSINSA-N 458.543 5.840 5 20 JKBD O=C(Nc1cc([N+](=O)[O-])ccc1OC(F)F)c1cccnc1Sc1ccc(Br)cc1 603639088 NPGGOCCGXGXVEV-UHFFFAOYSA-N 496.289 5.757 5 20 JKBD COc1ccc(CSc2nnc([C@@H](C)N3CCCCC3)n2-c2ccccc2)cc1[N+](=O)[O-] 603722419 MKUGRRMODIIKOP-QGZVFWFLSA-N 453.568 5.023 5 20 JKBD CCCC(=O)Nc1cccc(NC(=O)c2ccccc2C(=O)c2ccc(SC)c([N+](=O)[O-])c2)c1 603969915 AUGVRFLRMUOBDU-UHFFFAOYSA-N 477.542 5.539 5 20 JKBD O=C(c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1)N1C[C@@H](C(F)(F)F)C[C@H](C(F)(F)F)C1 604258186 UZJFGIRNWQWTHX-STQMWFEESA-N 496.791 6.243 5 20 JKBD O=C(c1ccc(Sc2nc3ccccc3s2)c([N+](=O)[O-])c1)N1CCC[C@@H]1CN1CCCC1 608813096 WSXYLIRBZNOAGK-QGZVFWFLSA-N 468.604 5.056 5 20 JKBD COc1cccc(N2CC[C@H](CNC(=O)c3ccc(Oc4ccc(Cl)cc4[N+](=O)[O-])cc3)C2)c1 608826137 CIDAAHSALHPAGP-QGZVFWFLSA-N 481.936 5.305 5 20 JKBD O=C(Cc1ccccc1[N+](=O)[O-])Nc1ccccc1OCc1ncc(-c2cccc(Cl)c2)o1 608851297 ZXCZLXYIZZOFEX-UHFFFAOYSA-N 463.877 5.663 5 20 JKBD O=C(C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1)N(Cc1ccco1)c1ccccc1 611994346 PZBGPXUJRLFTMW-UHFFFAOYSA-N 473.451 5.656 5 20 JKBD Cc1ccc(-c2csc(NC(=O)c3cccc(N4C(=O)c5ccccc5C4=O)c3)n2)cc1[N+](=O)[O-] 619729336 LSBLNYRQFNUUDQ-UHFFFAOYSA-N 484.493 5.080 5 20 JKBD COC(=O)c1coc(COC(=O)C/C(=C/c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)c1 726634975 NKSFURLGSAXPAU-YBEGLDIGSA-N 478.482 5.258 5 20 JKBD Cc1csc(Sc2ccc(C(=O)Nc3ccc(OCc4cccnc4)cc3)cc2[N+](=O)[O-])n1 728496558 HRDPDCXYMKSSHF-UHFFFAOYSA-N 478.555 5.737 5 20 JKBD O=C(CSc1nnc(COc2ccc(Cl)cc2Cl)o1)Nc1cc(Cl)ccc1[N+](=O)[O-] 745941965 NUYMPMLPTBZWNP-UHFFFAOYSA-N 489.724 5.248 5 20 JKBD COc1cccc(Cc2cnc(NC(=O)c3csc(-c4cccc([N+](=O)[O-])c4)n3)s2)c1 747633078 DMURIVJPUOJGTH-UHFFFAOYSA-N 452.517 5.027 5 20 JKBD CC(=O)Nc1cccc([C@@H](C)N(Cc2ccccc2)C(=O)c2ccc(Br)c([N+](=O)[O-])c2)c1 841838364 ACQFKTZNFIGJJJ-MRXNPFEDSA-N 496.361 5.719 5 20 JKBD CC1=C(C(=O)Nc2ccc(F)cc2)[C@H](c2ccc([N+](=O)[O-])o2)NC(=S)N1c1ccccc1Cl 887570861 JILUDZKUOFIPLW-FQEVSTJZSA-N 486.912 5.329 5 20 JKBD C[C@@H](OC(=O)c1ccc(NC(=O)Nc2ccccc2)cc1)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 913268313 ZNAZBQMGWGCDHU-OAHLLOKOSA-N 473.445 5.207 5 20 JKBD COc1ccc([N+](=O)[O-])cc1NC(=O)[C@H](C)OC(=O)c1sc2cccc(Cl)c2c1Cl 913326795 FDCAURCCYOQEGU-VIFPVBQESA-N 469.302 5.309 5 20 JKBD C[C@@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)OCC(=O)Nc1cc(Cl)c(Cl)cc1Cl 916523183 NPIJQIXHXXNMLZ-SECBINFHSA-N 463.726 5.218 5 20 JKBD C[C@@H](Sc1cc(Cl)ccc1Cl)C(=O)OCc1nnc(-c2ccc([N+](=O)[O-])cc2)o1 917327025 DSZWOAMLIBAJGD-SNVBAGLBSA-N 454.291 5.176 5 20 JKBD COc1ccccc1OCCN(C)C(=O)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1 917815012 NLKLFNQOYCKYMS-UHFFFAOYSA-N 456.882 5.200 5 20 JKBD Cc1cc(NC(=O)c2ccc(F)cc2Cl)sc1C(=O)OCc1csc([N+](=O)[O-])c1 919158130 SORDVQHCKDOQKA-UHFFFAOYSA-N 454.888 5.428 5 20 JKBD C[C@@H](OC(=O)CCc1ccc2ccccc2c1)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 919552745 BYYSBACCPGXKMV-CQSZACIVSA-N 460.408 5.270 5 20 JKBD CC(C)(C)c1ccc(N2CCC(NC(=O)Cn3c4ccccc4c(=O)c4ccccc43)CC2)cc1 919768135 WACPPQOMYDWZRO-UHFFFAOYSA-N 467.613 5.237 5 20 JKBD C[C@@H](Nc1ccc(C(=O)Oc2ccc(OCc3ccncc3)cc2)cc1[N+](=O)[O-])c1ccccn1 920104846 FGUADEBOLQYMGK-GOSISDBHSA-N 470.485 5.356 5 20 JKBD Cc1ccc(CC(=O)O[C@@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Br)c2ccccc2)s1 920665734 HQGSJTNZFKKJDI-HXUWFJFHSA-N 489.347 5.193 5 20 JKBD C[C@@H](OC(=O)c1cnc(-c2ccccc2F)s1)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 920698525 JWAPDGLRGQKNQK-SNVBAGLBSA-N 483.399 5.060 5 20 JKBD Cc1oc(C(C)(C)C)cc1C(=O)Nc1ccc(C2(NC(=O)c3ccc([N+](=O)[O-])[nH]3)CCC2)cc1 1787390863 XUTPWAOTPWFGOT-UHFFFAOYSA-N 464.522 5.183 5 20 JKBD CC(C)n1nccc1C(=O)Nc1ccc(C2(NC(=O)Cc3ccc(Cl)cc3[N+](=O)[O-])CCC2)cc1 1789796940 AYVBMXGAALVUBI-UHFFFAOYSA-N 495.967 5.016 5 20 JKBD O=C(/C=C/C1CCCC1)NC1(c2ccc(NC(=O)c3cc([N+](=O)[O-])cc4c3OCC4)cc2)CCC1 1790045050 BWZLCPNCLMHPAR-IZZDOVSWSA-N 475.545 5.024 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)Nc1ccc(C2(NC(=O)c3cc4ccoc4cn3)CCC2)cc1 1790772136 GOSKQGNSYRPIKM-UHFFFAOYSA-N 488.475 5.245 5 20 JKBD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)/C=C/c1ccccc1[N+](=O)[O-])c1ccc(-c2ccccc2)cc1 1804345656 HTGSPCHQEPFNJV-BOXNIABESA-N 481.552 5.227 5 20 JKBD O=C(Cc1ccc(Cl)cc1[N+](=O)[O-])N1CCCC2(CCN(C(=O)c3ccc4occc4c3)CC2)C1 1805485570 FJSDNQUKVGKYDB-UHFFFAOYSA-N 495.963 5.082 5 20 JKBD CC1(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)Cc3ccc(Cl)cc3[N+](=O)[O-])n[nH]2)CCCCC1 1814845557 BDQSCVNQWFZJRH-LJQANCHMSA-N 487.988 5.177 5 20 JKBD Cc1cc(C(=O)N2CCCC[C@H]2c2cc(NC(=O)c3cc4cc([N+](=O)[O-])ccc4s3)n[nH]2)c(C)o1 1821609600 IGVFZFCVFREVQA-IBGZPJMESA-N 493.545 5.362 5 20 JKBD Cc1ccc(C(=O)N2CCCC[C@H]2C2CCN(C(=O)c3cc(Cl)cc([N+](=O)[O-])c3C)CC2)nc1C 1825621255 YELUNDCYKCUFJV-QHCPKHFHSA-N 499.011 5.116 5 20 JKBD C[C@H](OC(=O)COc1ccccc1-c1ccccc1)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 10593849 XMXIPIQLYMXYSY-HNNXBMFYSA-N 488.418 5.230 5 20 JKBD CC(=O)N(c1ccc(C)c(C)c1)c1nc(COC(=O)c2ccc(Cl)cc2[N+](=O)[O-])cs1 10748347 SUEWASWOLRLSNS-UHFFFAOYSA-N 459.911 5.363 5 20 JKBD C[C@@H](OC(=O)CCc1ncc(-c2ccc(Cl)cc2)o1)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl 12257952 QXBSNAFCXYGVIU-GFCCVEGCSA-N 478.288 5.060 5 20 JKBD Cc1cc(SCC(=O)O[C@@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)c(C)cc1Br 17483388 JSZKMRNFMGNSBF-ZDUSSCGKSA-N 492.351 5.421 5 20 JKBD CCOc1cc([N+](=O)[O-])c(C(=O)Nc2nc(-c3ccc4c(c3)CCCC4)cs2)cc1OC 19200794 JUDRSRGLHBKCKR-UHFFFAOYSA-N 453.520 5.257 5 20 JKBD COc1cc(C(=O)Nc2cc3c(cc2F)CCC(=O)N3)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 32047870 HDMDHUGCHPWLGW-UHFFFAOYSA-N 485.855 5.325 5 20 JKBD Cc1ccccc1N(C(=O)CSc1ccc(C(N)=O)cc1[N+](=O)[O-])c1nc2ccccc2s1 104671412 BFCVQXNCRGJQOO-UHFFFAOYSA-N 478.555 5.069 5 20 JKBD CN(C)CCCN(Cc1ccc(Cl)c(Cl)c1)C(=O)C1CCN(c2ccccc2[N+](=O)[O-])CC1 109020675 QVWMZDJRLKFNCC-UHFFFAOYSA-N 493.435 5.099 5 20 JKBD C[C@@H](Nc1ccc(C(=O)NCc2ccc(CN3CCCC[C@H]3C)cc2)cc1[N+](=O)[O-])c1ccccn1 302979510 JJIDPSDTTMVSQL-NHCUHLMSSA-N 487.604 5.467 5 20 JKBD Cc1ccc([N+](=O)[O-])cc1C(=O)N[C@H](c1ccccc1)c1ccc2nc(C(F)(F)F)[nH]c2c1 303079510 UABZIGWILIEHBW-HXUWFJFHSA-N 454.408 5.318 5 20 JKBD COc1cc(C(=O)NCCc2sc(C)nc2C)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 303404459 RYWNPMOCENTXCE-UHFFFAOYSA-N 461.927 5.095 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)NC[C@@H](c2ccccc2Cl)c2c[nH]c3ccccc23)cc1SC 482320827 XNAUIRRDFBIYFY-SFHVURJKSA-N 495.988 6.022 5 20 JKBD O=C(Nc1ccccc1Oc1cccc(F)c1)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-] 490229900 KRIFSZKBCMGOOM-UHFFFAOYSA-N 450.344 5.720 5 20 JKBD O=C(Nc1ccccc1C(=O)N1CCCN(CC2CCCCC2)CC1)c1ccc([N+](=O)[O-])cc1Cl 497982637 IVIQDVZUQWIZFA-UHFFFAOYSA-N 499.011 5.229 5 20 JKBD Cc1c(Cl)cc(S(=O)(=O)N(C)c2ccccc2C(=O)Nc2ccccc2Cl)cc1[N+](=O)[O-] 498959001 WRUWXJFRODMVRO-UHFFFAOYSA-N 494.356 5.287 5 20 JKBD C[C@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)Nc1ccc(CC(=O)N2CCCc3ccccc32)cc1 503449237 SQTSSQFBXQJZBF-KRWDZBQOSA-N 493.947 5.176 5 20 JKBD C[C@@H](Nc1ccc(C(=O)N2CCN([C@H](C)c3ccccc3Cl)CC2)cc1[N+](=O)[O-])c1ccccn1 506160133 MPMWHEGAPXCFAY-RTBURBONSA-N 493.995 5.335 5 20 JKBD CSc1ccc(C(=O)c2ccccc2C(=O)NCC2(c3ccccc3)CCOCC2)cc1[N+](=O)[O-] 509447116 BHPOURJNAJPHNR-UHFFFAOYSA-N 490.581 5.026 5 20 JKBD COc1ccc2c(C)cc3nnc(SCc4cc(OC)c(OC(F)F)cc4[N+](=O)[O-])n3c2c1 514876635 KZJXIWPZNVRWKK-UHFFFAOYSA-N 476.461 5.010 5 20 JKBD CC(C)N(Cc1ccc(-c2cccc(F)c2)s1)C(=O)CSc1ccc(C(N)=O)cc1[N+](=O)[O-] 518717262 KHSUFEYUUPFXEM-UHFFFAOYSA-N 487.578 5.091 5 20 JKBD NC(=O)c1ccc(SCC(=O)Nc2ccc(Oc3ccccc3C(F)(F)F)cc2)c([N+](=O)[O-])c1 519976877 LZMAPRXEUFFAIR-UHFFFAOYSA-N 491.447 5.236 5 20 JKBD O=C(NCCc1ccc([N+](=O)[O-])cc1)Nc1ccc2c(c1)CCC(=O)N2Cc1ccc(Cl)cc1 521062500 NTLIMAOLTGYIIE-UHFFFAOYSA-N 478.936 5.092 5 20 JKBD O=C(Nc1nnc(SCc2ccc(F)cc2)s1)c1csc(-c2ccc([N+](=O)[O-])cc2)n1 522636563 AJPLXEFUPTVJHF-UHFFFAOYSA-N 473.536 5.254 5 20 JKBD Cn1c(SCc2nnc(-c3c(Cl)cccc3Cl)o2)nc2cc3ccccc3cc2c1=O 523949678 PNADQZIDXLEXRA-UHFFFAOYSA-N 469.353 5.736 5 20 JKBD CC(C)c1nccn1Cc1cccc(NC(=O)CCNc2ccc(C(F)(F)F)cc2[N+](=O)[O-])c1 603927068 NKDCYIHLWMXOQE-UHFFFAOYSA-N 475.471 5.423 5 20 JKBD Cc1c(NC(=O)c2ccccc2)cccc1N[C@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 603954680 DDCYEEVNRKDBTN-OAHLLOKOSA-N 486.450 5.613 5 20 JKBD c1ccc(-c2c(P(C3CCCCC3)C3CCCCC3)c3c4ccccc4c2c2ccccc23)cc1 642772118 LWFFMNARAVWLQF-UHFFFAOYSA-N 474.628 10.024 5 20 JKBD O=C(COc1ccc([N+](=O)[O-])c(F)c1)Nc1ccccc1OCc1ncc(-c2cccc(Cl)c2)o1 726763910 KTWFOZMEESDGLT-UHFFFAOYSA-N 497.866 5.639 5 20 JKBD CC(C)N(Cc1nnc(-c2cccc([N+](=O)[O-])c2)o1)C(=O)[C@H](C)Oc1cc(Cl)cc(Cl)c1 727064293 TUZWKHMZCLMAIF-ZDUSSCGKSA-N 479.320 5.156 5 20 JKBD O=C(CSc1ccccc1C(=O)Nc1ccc([N+](=O)[O-])c(Cl)c1)NCC1CCCCC1 727712604 XTBUXWAMETYKFZ-UHFFFAOYSA-N 461.971 5.289 5 20 JKBD Cc1csc(Sc2c(Cl)cccc2NC(=O)c2cc([N+](=O)[O-])ccc2N2CCOCC2)n1 748516115 GROJKWBIMHKFON-UHFFFAOYSA-N 490.994 5.253 5 20 JKBD CC(C)Cn1cc([C@H]2N(Cc3ccc(-c4cccc([N+](=O)[O-])c4)o3)CC23CCOCC3)cn1 849479744 UDBTZQPFOSJWNK-XMMPIXPASA-N 450.539 5.061 5 20 JKBD O=C(O[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1)c1nc(-c2ccccc2)cs1 919121202 MQJFLOJHCWSLHM-NRFANRHFSA-N 493.928 5.909 5 20 JKBD Cc1ccc(CC(=O)NC2(c3ccc(NC(=O)C4CCC(F)(F)CC4)cc3)CCC2)cc1[N+](=O)[O-] 1786244862 QBSMUBRKCDYYON-UHFFFAOYSA-N 485.531 5.405 5 20 JKBD O=C(NC1(c2ccc(NC(=O)[C@@H](F)c3ccccc3)cc2)CCC1)c1cccc(F)c1[N+](=O)[O-] 1786613316 LLUSUULVXDDHPL-NRFANRHFSA-N 465.456 5.192 5 20 JKBD CO[C@H](C(=O)Nc1ccc(C2(NC(=O)CCc3cccc([N+](=O)[O-])c3)CCC2)cc1)c1ccccc1 1787849933 CNIPXWJDXAIVGA-SANMLTNESA-N 487.556 5.049 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)NC1(c2ccc(NC(=O)c3cnc(Cl)s3)cc2)CCC1 1789863715 YFONIEXOLAWVFF-UHFFFAOYSA-N 488.928 5.214 5 20 JKBD COc1ccc(Cl)cc1C(=O)Nc1ccc(C2(NC(=O)c3ccc(O)c([N+](=O)[O-])c3)CCC2)cc1 1790345287 RAXSVZMDAZTQEG-UHFFFAOYSA-N 495.919 5.024 5 20 JKBD Cc1ncc(C(=O)NC2(c3ccc(NC(=O)C4(c5cccc([N+](=O)[O-])c5)CCC4)cc3)CCC2)s1 1790476006 RUIJBHUSKCTZMJ-UHFFFAOYSA-N 490.585 5.229 5 20 JKBD Cc1ccc(F)c(C(=O)Nc2ccc(C3(NC(=O)/C=C/c4ccc([N+](=O)[O-])o4)CCC3)cc2)c1 1790658353 XKPGMRDNACGHQU-DHZHZOJOSA-N 463.465 5.096 5 20 JKBD C/C(=C\c1ccc(C)o1)C(=O)NC1(c2ccc(NC(=O)c3nc4cc([N+](=O)[O-])ccc4[nH]3)cc2)CCC1 1790827344 KNEZFILYJDJLNL-JQIJEIRASA-N 499.527 5.224 5 20 JKBD O=C(CC[C@@H]1CCOC1)Nc1ccc(C2(NC(=O)c3cc4cc([N+](=O)[O-])ccc4s3)CCC2)cc1 1792025879 IHXQLOMVWXSOHO-QGZVFWFLSA-N 493.585 5.374 5 20 JKBD O=C([C@@H]1CCC[C@@H]2CCCC[C@@H]21)N1CCC([C@H]2CCCCN2C(=O)Cc2cccc([N+](=O)[O-])c2)CC1 1823679564 OSZXQUNBTHBQDV-WOTGAKFBSA-N 495.664 5.364 5 20 JKBD Cc1ccc(CC(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3ccc(Cl)cc3)CC2)cc1[N+](=O)[O-] 1830366793 ZQSLSSHEUAHEIT-HSZRJFAPSA-N 483.996 5.033 5 20 JKBD O=C(c1cc2ccoc2s1)N1CCC([C@H]2CCCCN2C(=O)c2ccc([N+](=O)[O-])cc2F)CC1 1830494999 LUJRKXGBKVTWDZ-HXUWFJFHSA-N 485.537 5.089 5 20 JKBD CC[C@H](C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cccc(F)c2[N+](=O)[O-])CC1)c1ccccc1 1830615736 BKEODPZIPKKNQF-URXFXBBRSA-N 481.568 5.161 5 20 JKBD O=C(CSC(c1ccccc1)c1ccccc1)Nc1cc2c(cc1[N+](=O)[O-])OCCCO2 10965159 PEHBETOCKORZSP-UHFFFAOYSA-N 450.516 5.217 5 20 JKBD O=C(Nc1ccc(NC(=O)c2ccco2)cc1C(F)(F)F)c1ccc(Br)c([N+](=O)[O-])c1 14367459 ISXHMHGGUOOJCL-UHFFFAOYSA-N 498.211 5.474 5 20 JKBD O=C(Cn1c2ccccc2c(=O)c2ccccc21)Nc1cc(Cl)ccc1OCC(F)(F)F 22615502 NDFNWZOHBJXIES-UHFFFAOYSA-N 460.839 5.388 5 20 JKBD CCCCn1c(SCc2nc(-c3cccc([N+](=O)[O-])c3)no2)nc2sc(C)c(C)c2c1=O 31838077 LBJGOAHOPRNDBX-UHFFFAOYSA-N 471.564 5.125 5 20 JKBD Cc1ccc(-n2ncc(C(=O)Nc3cc([N+](=O)[O-])ccc3OC(F)F)c2C2CC2)cc1Cl 302992679 XSVPXSJFUOWXMC-UHFFFAOYSA-N 462.840 5.473 5 20 JKBD CCc1cccc2c(C3CCN(C(=O)c4cc(SC)c(OC)cc4[N+](=O)[O-])CC3)c[nH]c12 303213217 SEJCKRHNVVRIMO-UHFFFAOYSA-N 453.564 5.389 5 20 JKBD COc1cc(C(=O)NC[C@H]2CCCO[C@@H]2c2ccccc2)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 409572637 CMHOTTCLUVZBHH-KBMIEXCESA-N 496.947 5.947 5 20 JKBD CC(=O)NCC1CCN(C(=O)c2c3c(nc4ccccc24)/C(=C/c2ccc([N+](=O)[O-])cc2)CCC3)CC1 483132089 VSHDFLPPGLXXGD-OQKWZONESA-N 498.583 5.008 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)Nc2ccc(Oc3cccc(Br)c3)nc2)cc1SC 483551681 KPXAWFYIIGIPEQ-UHFFFAOYSA-N 490.335 5.527 5 20 JKBD O=C(Nc1cccc(COc2ccc3c(c2)OCO3)c1)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-] 502093441 YCCSQSANVIXGJL-UHFFFAOYSA-N 490.390 5.096 5 20 JKBD C[C@@H](c1cccc(C(F)(F)F)c1)N(C)C(=O)c1ccc(N[C@H](C)c2ccccn2)c([N+](=O)[O-])c1 506180093 TWXRVDOIVSJPHZ-CVEARBPZSA-N 472.467 6.015 5 20 JKBD Cc1ccc(C(=O)Nc2ccccc2)cc1NC(=O)c1ccc(N[C@@H](C)c2ccccn2)c([N+](=O)[O-])c1 508875823 SRGHEDHCXQIYIR-IBGZPJMESA-N 495.539 5.976 5 20 JKBD CC(C)CNC(=O)c1ccc(NC(=O)c2ccc(N3CCC[C@@H](C)C3)c([N+](=O)[O-])c2)cc1Cl 515665483 NOWKUFVCTSNMCW-MRXNPFEDSA-N 472.973 5.123 5 20 JKBD Cc1cc(NC(=O)Cc2csc(-c3ccc(Cl)s3)n2)n(-c2ccc([N+](=O)[O-])cc2)n1 517780765 JDMRMAWZQBHERI-UHFFFAOYSA-N 459.940 5.109 5 20 JKBD C[C@@H](Nc1ccc(C(=O)N(CCc2ccccc2F)C2CCCC2)cc1[N+](=O)[O-])c1ccccn1 519884898 MPBXZJMNGCPMNP-LJQANCHMSA-N 476.552 5.930 5 20 JKBD CCN(C[C@H]1CCCO1)C(=O)C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1 520107397 NMJBWFONLLWBFJ-WORNYLJVSA-N 451.548 5.163 5 20 JKBD O=C(Cc1csc(-c2ccc(C(F)(F)F)cc2)n1)Nc1cc2c(cc1[N+](=O)[O-])OCCCO2 591741863 ZECUXBYWGUXSPL-UHFFFAOYSA-N 479.436 5.080 5 20 JKBD CCOc1cc(/C=C2/CCn3c2nc2ccc([N+](=O)[O-])cc2c3=O)ccc1OCc1ccccc1 603781370 OABACQZZKAJNHP-ZHZULCJRSA-N 469.497 5.227 5 20 JKBD Cc1ccc(NC(=O)c2ccc(N[C@@H](c3ccc(Cl)cc3)c3nccn3C)c([N+](=O)[O-])c2)cc1 608971849 UQZIWLPMDXWHAO-QHCPKHFHSA-N 475.936 5.744 5 20 JKBD CC(C)(C)c1csc(CNC(=O)C/C(=C/c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)n1 609190569 GWCPNQGXSMNXNR-ATVHPVEESA-N 492.626 6.206 5 20 JKBD CC1CCC(OC2CCN(C(=O)c3ccc(N4C[C@@H](C)C[C@@H](C)C4)c([N+](=O)[O-])c3)CC2)CC1 609374196 IVMRAZIKWFKDNR-UKPMAZGWSA-N 457.615 5.277 5 20 JKBD CCn1cc(NC(=S)/C(=C(/O)c2ccc([N+](=O)[O-])cc2)[n+]2ccc(Cc3ccccc3)cc2)cn1 726180172 WYIDKBUIHSEPCT-UHFFFAOYSA-O 486.577 5.013 5 20 JKBD O=C(OCC[C@@H]1CCCCN1C(=O)Cc1coc(-c2ccc(Cl)cc2)n1)c1cccc([N+](=O)[O-])c1 729325205 QQRPBMACLIPOTJ-NRFANRHFSA-N 497.935 5.074 5 20 JKBD C[C@@H](OC(=O)c1c(Cl)cccc1[N+](=O)[O-])C(=O)Nc1ccccc1Sc1ccccc1 730643940 XEEIQOWMLLMOCB-CQSZACIVSA-N 456.907 5.583 5 20 JKBD Cc1ccc(Sc2ccc(C(=O)N3CCC([C@@H](O)c4ccc(F)cc4)CC3)cc2[N+](=O)[O-])cc1 731057046 TVFJIOXUHNWZBB-VWLOTQADSA-N 480.561 5.779 5 20 JKBD CC(C)(C)OC(=O)N1CCC[C@H]1C1CCN(C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)CC1 742507678 PZEZUMCWOHKMOW-SFHVURJKSA-N 459.568 5.061 5 20 JKBD CC(=O)N(c1nc(COC(=O)Cn2ccc3cc([N+](=O)[O-])ccc32)cs1)c1ccc(C)cc1C 744616580 SPNYXYMNMXIBJS-UHFFFAOYSA-N 478.530 5.051 5 20 JKBD Cn1c(CSc2nc3ccccc3s2)nnc1Sc1ccc(C(F)(F)F)cc1[N+](=O)[O-] 799857774 XNGZWFWUCPBEDD-UHFFFAOYSA-N 483.522 5.795 5 20 JKBD O=C1CC[C@@H](c2noc(-c3ccc(NCc4ccccc4)c([N+](=O)[O-])c3)n2)CN1CC1CCCC1 856582757 VGEZFATWIICOPP-OAQYLSRUSA-N 475.549 5.153 5 20 JKBD COc1cc(NCc2ccc(Cl)cc2[N+](=O)[O-])c(C(=O)N2[C@@H](C)CCC[C@@H]2C)cc1OC 864003279 HSOIEPMUDCZOHE-GJZGRUSLSA-N 461.946 5.281 5 20 JKBD CC(C)N(Cc1nnc(-c2cccc([N+](=O)[O-])c2)o1)C(=O)c1ccc(Oc2ccccc2)cc1 864244770 MPQTUXGZPOAQLJ-UHFFFAOYSA-N 458.474 5.488 5 20 JKBD COc1cccc(/C=C(/CC(=O)Nc2cc([N+](=O)[O-])c(F)cc2F)c2nc3ccccc3s2)c1 897464705 PPVDJMTXJIUSMN-DHDCSXOGSA-N 481.480 6.061 5 20 JKBD COc1cc(-c2nc(-c3ccc(Oc4ccccc4)nc3)no2)c([N+](=O)[O-])cc1OC(F)F 904449480 MPUJNMUESWZHRD-UHFFFAOYSA-N 456.361 5.109 5 20 JKBD CC(C)(C)OC(=O)NCc1ccc(-c2noc(Cn3c4ccccc4c(=O)c4ccccc43)n2)cc1 904717127 PUGUKCYOPYLVQF-UHFFFAOYSA-N 482.540 5.278 5 20 JKBD CCc1cc[n+](/C(C(=S)Nc2ccc3c(c2)OC(F)(F)O3)=C(/O)c2ccc([N+](=O)[O-])cc2)cc1 920397460 VFLGGPIZCTYCCB-UHFFFAOYSA-O 486.476 5.090 5 20 JKBD O=C(NC1(c2ccc(NC(=O)[C@H]3C[C@@H]3C3CC3)cc2)CCC1)c1cccc([N+](=O)[O-])c1Br 1786055935 IXZKUWOUQMTODD-MOPGFXCFSA-N 498.377 5.151 5 20 JKBD Cc1cc[nH]c1C(=O)Nc1ccc(C2(NC(=O)c3cccc(Br)c3[N+](=O)[O-])CCC2)cc1 1787102907 JODTYCNTIHNLFW-UHFFFAOYSA-N 497.349 5.055 5 20 JKBD O=C(NC1(c2ccc(NC(=O)c3ccoc3C(F)(F)F)cc2)CCC1)c1ccc([N+](=O)[O-])cc1F 1788727629 XHCJRLLTOHDWJR-UHFFFAOYSA-N 491.397 5.407 5 20 JKBD Cc1cc(C(=O)NC2(c3ccc(NC(=O)c4ccccc4Cl)cc3)CCC2)ncc1[N+](=O)[O-] 1790224318 PZZOBLZRAWQFJD-UHFFFAOYSA-N 464.909 5.013 5 20 JKBD CC(F)(F)C(C)(C)C(=O)NC1(c2ccc(NC(=O)c3cccc(F)c3[N+](=O)[O-])cc2)CCC1 1790699924 UMZKVLDWOZFQFX-UHFFFAOYSA-N 463.456 5.163 5 20 JKBD COc1cc(C(=O)NC2(c3ccc(NC(=O)c4cccc5ccncc45)cc3)CCC2)ccc1[N+](=O)[O-] 1790862083 KKHFWRRNMGAPES-UHFFFAOYSA-N 496.523 5.213 5 20 JKBD O=C(/C=C/c1ccccc1[N+](=O)[O-])Nc1ccc(C2(NC(=O)CS[C@@H]3CCCCO3)CCC2)cc1 1792317652 AUSYWZOMXFNMHO-FFODHNNBSA-N 495.601 5.002 5 20 JKBD CC(C)(C)CCCCCC(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cc(O)cc([N+](=O)[O-])c2)n[nH]1 1821262829 CPZIEHWBPCNHJC-OAQYLSRUSA-N 485.585 5.326 5 20 JKBD Cc1ccc(C(=O)N2CCC([C@@H]3CCCCN3C(=O)c3cc4cc([N+](=O)[O-])ccc4s3)CC2)cn1 1831059127 DIXHCEZDUIAALI-QFIPXVFZSA-N 492.601 5.060 5 20 JKBD O=C(c1cc(F)ccc1Cl)N1CCC([C@H]2CCCCN2C(=O)/C=C/c2ccccc2[N+](=O)[O-])CC1 1832905246 SSQQONZDRVRGFJ-OXHGWOFKSA-N 499.970 5.334 5 20 JKBD CCn1c(S[C@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2C(F)(F)F)nnc1-c1cccc(Cl)c1 9822376 MBNKVQMVEGXUGE-LLVKDONJSA-N 499.902 5.665 5 20 JKBD CSc1ccc([N+](=O)[O-])c(C(=O)Nc2cccc(S(=O)(=O)Nc3ccccc3Cl)c2)c1 16200712 ZHTOHCJSFXWLFU-UHFFFAOYSA-N 477.951 5.023 5 20 JKBD C[C@@H](OC(=O)c1cc(-c2ccc(F)cc2)nc2ccccc12)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 17529654 VWNIJIURZQWWSM-OAHLLOKOSA-N 484.443 5.917 5 20 JKBD CCOc1ccc(Oc2ccc(Cl)cc2NC(=O)c2cc(OC)c(OCC)cc2[N+](=O)[O-])cc1 28246308 CFXHLEAUIRNXNT-UHFFFAOYSA-N 486.908 6.099 5 20 JKBD C[C@H]1CN(Cc2ccccc2NC(=O)c2ccc(NCc3ccccc3)c([N+](=O)[O-])c2)C[C@H](C)O1 117731953 UQIPSVJHOWQAMX-PMACEKPBSA-N 474.561 5.068 5 20 JKBD C[C@@H](Nc1ccc(C(=O)Nc2ccc(C(=O)N3CCCC[C@H]3C)cc2)cc1[N+](=O)[O-])c1ccccn1 303007864 OCZSABKQBQGLBL-RTBURBONSA-N 487.560 5.430 5 20 JKBD COc1cc(C(=O)Nc2cc(NC(=O)C3CC3)ccc2C)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 481945927 OOONRFFDVBKHQU-UHFFFAOYSA-N 495.919 5.958 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)Nc2sc3c(c2-c2nc4ccccc4[nH]2)CCCC3)cc1SC 482210321 JPMBVWYKDBSUBO-UHFFFAOYSA-N 494.598 6.061 5 20 JKBD CCS(=O)(=O)c1ccc2oc(/C=C\c3ccc(OC)c(OCc4ccc([N+](=O)[O-])cc4)c3)nc2c1 483468577 KRGYZBKTZRLRDJ-QPEQYQDCSA-N 494.525 5.288 5 20 JKBD COc1cc(C(=O)NC(C)(C)Cc2ccccc2Cl)c([N+](=O)[O-])cc1OCc1cscn1 485893697 GMRLAKPNNUYGGB-UHFFFAOYSA-N 475.954 5.043 5 20 JKBD Cc1ccc(Sc2ccc(C(=O)N(C)Cc3nccn3CC(F)(F)F)cc2[N+](=O)[O-])cc1 486475545 XVJJPPFKOJKPNX-UHFFFAOYSA-N 464.469 5.085 5 20 JKBD O=C(c1nn(-c2cc(C(F)(F)F)ccc2Cl)c2c1CCC2)N1CCc2cc([N+](=O)[O-])ccc21 498318704 CKHFYEGAMYLFPF-UHFFFAOYSA-N 476.842 5.144 5 20 JKBD CNC(=O)c1ccc(Cl)c(NC(=O)c2ccc(NCc3ccccc3Cl)c([N+](=O)[O-])c2)c1 500258673 HOQDUASPMRDEQA-UHFFFAOYSA-N 473.316 5.126 5 20 JKBD C[C@@H](Nc1ccc(C(=O)N2CCC[C@@H]2c2cccc(Cl)c2)cc1[N+](=O)[O-])c1ccccn1 507407291 VAVWFSUTBLSGSQ-OPAMFIHVSA-N 450.926 5.794 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Br)[C@@H](Nc1ccc2scnc2c1)c1ccccc1 507890493 CLQGWVOZBQWURC-FQEVSTJZSA-N 483.347 5.759 5 20 JKBD CC(C)(C)c1ccc(Oc2ccc(CNC3CCN(C(=O)c4ccncc4)CC3)cc2[N+](=O)[O-])cc1 507896544 PBXUAJFOGVCLLF-UHFFFAOYSA-N 488.588 5.474 5 20 JKBD Cc1ccc(Sc2ccc(CN[C@H](CN3CCN(C)CC3)c3ccccc3)cc2[N+](=O)[O-])cc1 518783765 WNCURVREFXEKFM-RUZDIDTESA-N 476.646 5.133 5 20 JKBD Cc1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2Sc2ccccc2)cc1NC(=O)c1ccncc1 520745644 VEUYRCXTGBAGSI-UHFFFAOYSA-N 484.537 5.954 5 20 JKBD O=C(NC1CCN(C2CC2)CC1)c1c2c(nc3ccccc13)/C(=C\c1cccc([N+](=O)[O-])c1)CCC2 590988761 KYTSIXAXYXBCTK-JZJYNLBNSA-N 482.584 5.377 5 20 JKBD COc1cc(CNc2ccc(N=S3(=O)CCCC3)cc2)c([N+](=O)[O-])cc1OCC(F)(F)F 600851746 MWZWEBNMEKFKRL-UHFFFAOYSA-N 473.473 5.050 5 20 JKBD CCOc1ccc([C@H](CNC(=O)c2csc([N+](=O)[O-])c2)c2c[nH]c3ccccc23)cc1OC 603752256 DFRWWMSJJZWVBC-SFHVURJKSA-N 465.531 5.107 5 20 JKBD O=C(Nc1cc([N+](=O)[O-])ccc1OC(F)F)c1ccc(COc2ccc(Br)cc2)o1 603755576 KFOFVDQMHJWRFG-UHFFFAOYSA-N 483.221 5.383 5 20 JKBD O=C(Nc1cc([N+](=O)[O-])ccc1OC(F)F)c1cccnc1Oc1ccc(F)cc1Br 603784752 MLEOBIVWZUHFFY-UHFFFAOYSA-N 498.211 5.537 5 20 JKBD C[C@H](NC(=O)NCc1ccccc1-c1ccc(CN2CCCC2)cc1)c1cccc([N+](=O)[O-])c1 604130478 KTZDOXWESPOMCW-FQEVSTJZSA-N 458.562 5.418 5 20 JKBD Cc1ccc(NC(=O)c2ccccc2Sc2ccc(C(F)(F)F)cc2[N+](=O)[O-])cc1C(N)=O 608948120 WKQQPVLQDJGLSU-UHFFFAOYSA-N 475.448 5.424 5 20 JKBD O=C(Nc1ccccc1)c1ccc(Cl)c(NC(=O)c2cc3ccccc3c3cccnc23)c1 643153568 YBIZCGZVHSMFTB-UHFFFAOYSA-N 451.913 6.546 5 20 JKBD C[C@H](OC(=O)c1ccc(N2CCCC2)c([N+](=O)[O-])c1)c1ccccc1NC(=O)c1ccccc1 748020205 CWLWCSBXRJFKQC-SFHVURJKSA-N 459.502 5.365 5 20 JKBD Cc1ccc(NC(=O)C(=Cc2ccc([N+](=O)[O-])c(O)c2)C(=O)Nc2ccc(C)cc2C)c(C)c1 748147154 FMWPMNBYYMUICK-UHFFFAOYSA-N 459.502 5.195 5 20 JKBD Cc1c(C(=O)Nc2cc(-c3nnc4n3CCCCC4)ccc2Cl)cc([N+](=O)[O-])c(C)c1[N+](=O)[O-] 748616758 AJGUHXZYOQARMG-UHFFFAOYSA-N 484.900 5.010 5 20 JKBD O=C(Nc1cc(Cl)ccc1Cl)[C@@H]1CCCCN1C(=O)c1cc([N+](=O)[O-])ccc1Cl 751246518 MXVIXOXVHFJOBT-KRWDZBQOSA-N 456.713 5.188 5 20 JKBD CC1=C(C(=O)Nc2cccc(Cl)c2)[C@@H](c2ccc([N+](=O)[O-])o2)NC(=O)N1Cc1cccs1 812984290 WAYBNSYDHFGIIK-LJQANCHMSA-N 472.910 5.082 5 20 JKBD COc1ccc([C@H](CNC(=O)c2cc([N+](=O)[O-])ccc2N2CCCC2)c2c[nH]c3ccccc23)cc1 912617271 OBOUBELSMQXGOS-DEOSSOPVSA-N 484.556 5.247 5 20 JKBD C[C@H](NC(=O)c1cc(Cl)ccc1[N+](=O)[O-])c1cccc(NC(=O)Cc2ccccc2F)c1 916074895 RBZFRJVXNKNUOO-AWEZNQCLSA-N 455.873 5.060 5 20 JKBD C[C@H](NC(=O)c1cc([N+](=O)[O-])ccc1N1CCCC1)c1ccc(NC(=O)c2ccc(F)cc2)cc1 918677913 VMZUHTYXPWEDKJ-KRWDZBQOSA-N 476.508 5.077 5 20 JKBD COc1cc(C(=O)OCC(=O)c2sc3ccccc3c2C)c([N+](=O)[O-])cc1OCc1cscn1 920652650 MEHUNCNBAVJRQI-UHFFFAOYSA-N 498.538 5.202 5 20 JKBD O=C(Oc1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2Cl)cc1)c1cc(Br)cs1 921275786 CVCUKTRGTAOUSO-UHFFFAOYSA-N 481.711 5.544 5 20 JKBD CCc1cc(C(=O)Nc2ccc(C3(NC(=O)/C=C/c4ccccc4[N+](=O)[O-])CCC3)cc2)cc(C)n1 1788838412 PTPMQYGKNLMYDU-NTEUORMPSA-N 484.556 5.322 5 20 JKBD COc1cccc(Cl)c1C(=O)NC1(c2ccc(NC(=O)c3ccc(O)c([N+](=O)[O-])c3)cc2)CCC1 1790620674 IUQSFUOSAGNWSO-UHFFFAOYSA-N 495.919 5.024 5 20 JKBD Cc1cc(CCCC(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cc4ccccc4o2)C3)c([N+](=O)[O-])cc1F 1793403173 GDVUKPHPYQEXND-WKCHPHFGSA-N 493.535 5.063 5 20 JKBD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2cc(F)cc([N+](=O)[O-])c2)[nH]n1)[C@@H]1CCC[C@H]2CCCC[C@@H]21 1818930901 DJGQUISICRNXDT-QSABTFIQSA-N 497.571 5.369 5 20 JKBD CC[C@@H](C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cc(F)cc([N+](=O)[O-])c2)CC1)c1ccccc1 1830613938 IZRLHSDGZKEGIR-JWQCQUIFSA-N 481.568 5.161 5 20 JKBD Cc1ccc2[nH]c(C(=O)N3CCC([C@@H]4CCCCN4C(=O)c4cccc(F)c4[N+](=O)[O-])CC3)cc2c1 1830620732 FILAWYTXJSLSQI-DEOSSOPVSA-N 492.551 5.071 5 20 JKBD O=C(c1ccc([N+](=O)[O-])cc1F)N1CCC([C@@H]2CCCCN2C(=O)c2ccc3ccoc3c2)CC1 1830913687 YIOWNVADVSDLEP-QHCPKHFHSA-N 479.508 5.027 5 20 JKBD O=C(CSc1ccccc1)N1CCC([C@H]2CCCCN2C(=O)/C=C/c2ccccc2[N+](=O)[O-])CC1 1832903000 JPBNTJUZEZOUBL-XIQMRYHBSA-N 493.629 5.020 5 20 JKBD Cc1c(C(=O)Nc2nnc(SCc3c(Cl)cccc3Cl)s2)cccc1[N+](=O)[O-] 14582321 FTFFEUOULGOESY-UHFFFAOYSA-N 455.348 5.606 5 20 JKBD C[C@H](Sc1nn(-c2ccc(Cl)cc2)c(=S)s1)C(=O)Nc1ccc(F)c([N+](=O)[O-])c1 21683188 QLOFYJDCQSDEIA-VIFPVBQESA-N 470.960 5.483 5 20 JKBD Cc1nc2cc(N[C@@H](C(=O)Nc3ccc([N+](=O)[O-])cc3Br)c3ccccc3)ccc2o1 21794640 WFINIOFSZUTPAL-OAQYLSRUSA-N 481.306 5.599 5 20 JKBD C[C@@H](Sc1nnc(-c2ccc(Cl)cc2)n1Cc1ccco1)C(=O)Nc1ccc([N+](=O)[O-])cc1 23600702 DPACRMFKCJEOMV-CQSZACIVSA-N 483.937 5.267 5 20 JKBD COc1cc(C(=O)Nc2ccc(Cc3nc4ccccc4s3)cc2)c([N+](=O)[O-])cc1OC(F)F 24826881 IUPBZVLBJRAKDG-UHFFFAOYSA-N 485.468 5.658 5 20 JKBD O=C(CCSc1nnc(-c2ccc(Cl)cc2)n1Cc1ccccc1)Nc1ccccc1[N+](=O)[O-] 26369566 VVSJJJJXXADTGS-UHFFFAOYSA-N 493.976 5.676 5 20 JKBD O=C(OCc1nnc(-c2ccc([N+](=O)[O-])cc2)o1)c1cc(-c2ccccc2Cl)nc2ccccc12 28614454 WJGBHCRSHMBNKM-UHFFFAOYSA-N 486.871 5.870 5 20 JKBD COc1ccc([C@@H](Cc2ccc(F)cc2)NC(=O)Cn2c3ccccc3c(=O)c3ccccc32)cc1 72040249 KDBCWXLHIRVPMC-AREMUKBSSA-N 480.539 5.403 5 20 JKBD CC(=O)N(c1cccc(C(F)(F)F)c1)c1nc(COC(=O)/C=C\c2ccc([N+](=O)[O-])cc2)cs1 207290195 SJVAJCTZWHBIHR-YFHOEESVSA-N 491.447 5.511 5 20 JKBD O=C(CSc1ccc(C(F)(F)F)cc1[N+](=O)[O-])NCc1ccc(Oc2cccnc2)c(F)c1 409466155 PSVOYYLIYCMHMT-UHFFFAOYSA-N 481.427 5.349 5 20 JKBD CC1CCN(c2ccc(C(=O)Nc3nnc(SCc4ccccc4)s3)cc2[N+](=O)[O-])CC1 409593783 FABAQJVKUFYTNY-UHFFFAOYSA-N 469.592 5.227 5 20 JKBD COc1cc(C(=O)Nc2cc(NC(=O)C(C)C)ccc2C)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 479170063 ODTDVASZFCTRFG-UHFFFAOYSA-N 497.935 6.204 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)N2CCCC[C@H]2C(=O)Nc2ccc(Cl)c(Cl)c2)cc1SC 482722327 HMSNXDXLBLTBCI-INIZCTEOSA-N 498.388 5.266 5 20 JKBD O=C(Nc1ccc(OCc2cccc(F)c2)c(F)c1)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-] 483863395 HBUQILDYWVZBOL-UHFFFAOYSA-N 482.361 5.645 5 20 JKBD O=C(C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)Nc1ccc(Cn2cccn2)cc1 486579218 KDZOWMNJETXIKV-LTGZKZEYSA-N 495.564 6.019 5 20 JKBD CC(C)CNC(=O)c1ccc(NC(=O)c2csc(-c3ccc([N+](=O)[O-])cc3)n2)cc1Cl 496593461 PRRBZVNBMHGVSP-UHFFFAOYSA-N 458.927 5.010 5 20 JKBD O=C(Cc1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1)Nc1ccc(-c2csnn2)cc1 504100769 PEVFNDQIVDQDLT-UHFFFAOYSA-N 482.525 5.147 5 20 JKBD CCCN(C(=O)CCCn1c(=O)oc2cc([N+](=O)[O-])ccc21)[C@@H](C)c1cc2ccccc2o1 507488356 AREMPZKOSLKXGR-INIZCTEOSA-N 451.479 5.029 5 20 JKBD O=C(Nc1nc(-c2ccccc2Cl)cs1)c1ccc([N+](=O)[O-])cc1I 508925983 UPZQGMQPKHYMKA-UHFFFAOYSA-N 485.690 5.229 5 20 JKBD Cc1nc2ccccc2c(-c2ccccc2)c1CC(=O)Nc1cc([N+](=O)[O-])ccc1OC(F)F 515215281 UUPIROULVHYIRM-UHFFFAOYSA-N 463.440 5.901 5 20 JKBD COCCN(C(=O)c1ccc(Br)cc1C)c1nc(-c2ccc([N+](=O)[O-])cc2)cs1 515609868 ZEEQKOTTWIPLPA-UHFFFAOYSA-N 476.352 5.082 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Cl)[C@@H](NCc1ccc(N2CCCCCC2)nc1)c1ccccc1 515761509 IIGCDFLGVNEVOU-VWLOTQADSA-N 493.995 5.493 5 20 JKBD O=C(Nc1ccc(CCC(=O)N2CCCC2)cc1)c1ccc(Nc2ccccc2)c([N+](=O)[O-])c1 516229858 WUKDELJNUXGJIL-UHFFFAOYSA-N 458.518 5.146 5 20 JKBD CCCC(=O)Nc1cccc(CNCc2cn(-c3ccccc3)nc2-c2ccc([N+](=O)[O-])cc2)c1 520203198 NZKMKOUJDNHRHS-UHFFFAOYSA-N 469.545 5.476 5 20 JKBD COc1ccc(CNCc2cn(-c3ccccc3)nc2-c2cc3ccccc3o2)cc1[N+](=O)[O-] 520214387 AKFOZJYWZOMVSS-UHFFFAOYSA-N 454.486 5.492 5 20 JKBD C[C@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)Nc1ccc(Br)cc1Br 521274925 TWCLPNJQQSGXER-QMMMGPOBSA-N 478.524 5.179 5 20 JKBD CN(C(=O)c1c2c(nc3ccccc13)/C(=C\c1cccc([N+](=O)[O-])c1)CCC2)c1nccs1 603619359 PTVIVIHAPKRVHR-VKAVYKQESA-N 456.527 5.753 5 20 JKBD CCOc1ccc([C@@H](NC(=O)c2cc(OC)c(OC(F)F)cc2[N+](=O)[O-])c2ccccc2)cc1 603623053 NQZONTFQTKLVBP-QFIPXVFZSA-N 472.444 5.123 5 20 JKBD COc1ccc(C(=O)C2CCN(C(=O)c3cc([N+](=O)[O-])ccc3Oc3ccccc3)CC2)cc1 603785090 QTPQGAAEPIVZJO-UHFFFAOYSA-N 460.486 5.131 5 20 JKBD CN(CCCCCc1cc(-c2cccc(F)c2)n[nH]1)C(=O)c1cc2cc([N+](=O)[O-])ccc2o1 604194204 BMQXALVWHFVCQD-UHFFFAOYSA-N 450.470 5.355 5 20 JKBD CCOc1ccc(NC(=O)c2ccc(N3CCC(C)CC3)c([N+](=O)[O-])c2)c(C(F)(F)F)c1 604448410 LOZMFZNLHFYDIP-UHFFFAOYSA-N 451.445 5.501 5 20 JKBD COc1ccc([C@H](Cc2ccccc2C)N[C@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2C)cc1OC 604474116 PMHSZHAWRKQWNN-XXBNENTESA-N 477.561 5.129 5 20 JKBD COc1ccc(-c2csc(NC(=O)c3csc(-c4cccc([N+](=O)[O-])c4)n3)n2)cc1F 604516987 KUSJJDUGFYCXIU-UHFFFAOYSA-N 456.480 5.242 5 20 JKBD COc1ccc(-c2ccc(CN[C@H](C)c3cccc(OCc4ccccn4)c3)o2)c([N+](=O)[O-])c1 608836185 VJMHPZFJEACHKR-GOSISDBHSA-N 459.502 5.688 5 20 JKBD Cc1ccc(NC(=O)c2ccc(N(C)CC(=O)Nc3c(Cl)cccc3Cl)c([N+](=O)[O-])c2)cc1 608971814 RRZUWWNQAXWBFG-UHFFFAOYSA-N 487.343 5.537 5 20 JKBD Cc1c(NC(=O)c2ccc(N[C@@H](C)c3ccccn3)c([N+](=O)[O-])c2)cccc1OCC(F)(F)F 609022815 XXUMKMHVTCRNLG-HNNXBMFYSA-N 474.439 5.665 5 20 JKBD Cc1ccc([N+](=O)[O-])cc1NC(=O)[C@@H](C)SCc1nc(O)c2c(-c3ccccc3)csc2n1 610842037 BDHZLJVLEPGILG-CQSZACIVSA-N 480.571 5.541 5 20 JKBD C[C@H](NCc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1)C(=O)Nc1cccc(N2CCCC2)c1 726605452 DLJRICJQQCHDGS-INIZCTEOSA-N 468.941 5.225 5 20 JKBD CSCc1ccc(NC(=O)c2ccccc2NC(=O)c2ccc([N+](=O)[O-])cc2Cl)cc1 727411586 JKVHPECZILWAPU-UHFFFAOYSA-N 455.923 5.616 5 20 JKBD Cc1c(NC(=O)c2cc([N+](=O)[O-])ccc2N2CCC(C)CC2)cccc1OCC(F)(F)F 727717585 CPOKZIYPHZSVEV-UHFFFAOYSA-N 451.445 5.333 5 20 JKBD O=C(CSc1nnc(-c2ccc3ccccc3c2)o1)N(CC1CC1)c1ccc(Cl)c([N+](=O)[O-])c1 728165456 KPNDQRPYZGUTCE-UHFFFAOYSA-N 494.960 5.987 5 20 JKBD Cc1nc(-c2ccc(NC(=O)c3ccccc3NC(=O)c3ccc([N+](=O)[O-])cc3Cl)cc2)cs1 728194454 RPVNYYCJUVPQBD-UHFFFAOYSA-N 492.944 6.185 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)O[C@@H](C)C(=O)Nc2ccc(Cl)cc2C(F)(F)F)cc1SC 728657266 PDHJLFBPHQKCOU-VIFPVBQESA-N 492.859 5.182 5 20 JKBD C[C@H](Nc1ccc(C(=O)Oc2ccc(-c3noc(C4CC4)n3)cc2)cc1[N+](=O)[O-])c1ccccn1 729220793 LFLQOLHZTNNXOW-HNNXBMFYSA-N 471.473 5.310 5 20 JKBD O=C(Cc1ccccc1C(F)(F)F)Oc1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2Cl)cc1 729304307 BHHVTXJHMKGJGT-UHFFFAOYSA-N 478.810 5.667 5 20 JKBD CCOc1ccc([C@H](NC(=O)c2cc([N+](=O)[O-])ccc2Br)C(C)C)cc1OCC 750601883 LTUJXRIVLZDVIT-HXUWFJFHSA-N 465.344 5.282 5 20 JKBD C[C@@H]1C[C@H]1c1ccc(CCC(=O)Oc2ccc(NC(=O)c3cc([N+](=O)[O-])ccc3Cl)cc2)o1 783505086 DWJIAZNMZFXGNY-AUUYWEPGSA-N 468.893 5.755 5 20 JKBD CC(=O)N[C@H](CC(=O)Nc1cc(Cl)c([N+](=O)[O-])cc1OCc1ccccc1)c1ccc(C)cc1 822219473 HIPUKDYIDJHUJH-OAQYLSRUSA-N 481.936 5.342 5 20 JKBD COc1ccccc1-c1nnc(S[C@@H](C(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)c2ccccc2)o1 849210506 MPWBPZYDLCOXOW-HXUWFJFHSA-N 496.932 5.779 5 20 JKBD CCC(CC)c1cc[n+](/C(C(=S)N[C@@H](C)c2ccccc2)=C(/O)c2ccc([N+](=O)[O-])cc2)cc1 917611385 BQVLQAZKLXSNPI-IBGZPJMESA-O 476.622 6.348 5 20 JKBD Cc1onc(-c2c(Cl)cccc2Cl)c1C(=O)OCCNC(=O)c1ccc([N+](=O)[O-])cc1Cl 920148856 OFVNFJZTKMHLFT-UHFFFAOYSA-N 498.706 5.105 5 20 JKBD C[C@H](OC(=O)[C@@H]1CCCN(C(=O)c2ccc(Cl)c(Cl)c2)C1)c1ccc([N+](=O)[O-])cc1 920157425 GOSIOYNOZVTWSG-XJKSGUPXSA-N 451.306 5.058 5 20 JKBD Cc1cnc(Cl)c(C(=O)Nc2ccc(C3(NC(=O)Cc4cc(F)ccc4[N+](=O)[O-])CCC3)cc2)c1 1787567582 KHXFBFCYSMXSPX-UHFFFAOYSA-N 496.926 5.081 5 20 JKBD Cn1ccc2cccc(C(=O)Nc3ccc(C4(NC(=O)Cc5cccc([N+](=O)[O-])c5)CCC4)cc3)c21 1789059128 PJXLGGLMMKSOOL-UHFFFAOYSA-N 482.540 5.077 5 20 JKBD O=C(NC1(c2ccc(NC(=O)c3ccc([N+](=O)[O-])cc3F)cc2)CCC1)c1ccc(C(F)(F)F)[nH]1 1790621720 DWLFXSGYMWXFAN-UHFFFAOYSA-N 490.413 5.142 5 20 JKBD COc1cc(C(=O)Nc2ccc(C3(NC(=O)[C@@H](C)c4cccs4)CCC3)cc2)ccc1[N+](=O)[O-] 1792165964 VAGDGWKQAJVSFS-INIZCTEOSA-N 479.558 5.216 5 20 JKBD Cc1c(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)[C@@H]2CCC[C@@H]3CCCC[C@H]32)cc(Cl)cc1[N+](=O)[O-] 1797875055 OEBZKNHVFXYUPS-MCAKUDAQSA-N 488.028 5.415 5 20 JKBD O=C(Nc1cc([C@H]2CCCCN2C(=O)C2(c3cccc([N+](=O)[O-])c3)CCC2)[nH]n1)C1(F)CCCCC1 1818881657 KBBICTMYXBMZHC-OAQYLSRUSA-N 497.571 5.104 5 20 JKBD O=C(CCc1cccc([N+](=O)[O-])c1)N1CCC([C@H]2CCCCN2C(=O)c2sccc2Cl)CC1 1829443352 MQPHRXCJHLLEAP-OAQYLSRUSA-N 490.025 5.176 5 20 JKBD O=C([C@@H]1C[C@H]1C1CC1)N1CCC([C@H]2CCCCN2C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)CC1 1831060293 QSDHATZFFUXHFS-BHDDXSALSA-N 481.618 5.089 5 20 JKBD CC1=CC[C@H](C(=O)N2CCC([C@@H]3CCCCN3C(=O)c3cc4cc([N+](=O)[O-])ccc4s3)CC2)CC1 1831061582 WTFVKRLUQIMTDF-REWPJTCUSA-N 495.645 5.789 5 20 JKBD O=C(c1cc2cccc(F)c2s1)N1CC2(CCCN2C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)C1 1845738916 POXYXZSKGYWBIP-UHFFFAOYSA-N 495.557 5.294 5 20 JKBD C[C@H](Sc1nnc(Nc2ccccc2F)s1)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl 10316188 UCMJDKYFFWIKFW-VIFPVBQESA-N 453.908 5.102 5 20 JKBD CC(=O)Nc1ccc(NC(=O)c2ccccc2Sc2ccc(C(F)(F)F)cc2[N+](=O)[O-])cc1 16019601 XJLIFQQALSMOPY-UHFFFAOYSA-N 475.448 5.976 5 20 JKBD CC(C)OCc1c(C(=O)NCCNc2ccc(C(F)(F)F)cc2[N+](=O)[O-])oc2ccccc12 16496590 TUYOHHIFOPTOTC-UHFFFAOYSA-N 465.428 5.127 5 20 JKBD C[C@H](c1ccccc1)N(C)C(=O)C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1 25617883 SEYJWGSKVAMJFC-TVJQZGFISA-N 457.555 6.355 5 20 JKBD CCc1cccc(C)c1NC(=O)COC(=O)c1cc([N+](=O)[O-])ccc1Sc1nc(C)cs1 28810006 FFVAXACNYGMQLH-UHFFFAOYSA-N 471.560 5.177 5 20 JKBD O=C(C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)NCc1cc(F)cc(F)c1 30482465 IZWCROJNHGZFFF-MFOYZWKCSA-N 465.481 5.730 5 20 JKBD O=C(Cn1c2ccccc2c(=O)c2ccccc21)N[C@H](Cn1cnc2ccccc21)c1ccc(F)cc1 69633696 ULDPHBIXBDUQLH-RUZDIDTESA-N 490.538 5.201 5 20 JKBD CCCCCC(=O)NC1CCN(C(=O)c2cc([N+](=O)[O-])ccc2Sc2ccccc2)CC1 498487841 WALHBTATVWNHJM-UHFFFAOYSA-N 455.580 5.047 5 20 JKBD C[C@@H](Nc1ccc(C(=O)NCCSc2ccc(Cl)cc2)cc1[N+](=O)[O-])c1ccccn1 506025888 IKCGSEACASKMCW-OAHLLOKOSA-N 456.955 5.338 5 20 JKBD COc1cc([C@H](C)NCc2ccc(Oc3ccc(F)cc3)c([N+](=O)[O-])c2)cc(OC)c1OC 508100538 GFKXDYLNUXPWPT-HNNXBMFYSA-N 456.470 5.403 5 20 JKBD COc1cc(C(=O)N[C@@H](CC(C)C)c2ccccc2)c([N+](=O)[O-])cc1OCc1cscn1 512583347 SAZCYBNLKOYWAC-IBGZPJMESA-N 455.536 5.156 5 20 JKBD C[C@H](Sc1nc(-c2ccco2)nc2ccccc12)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 514486751 YTMPZWRWCPRLPG-LBPRGKRZSA-N 488.447 5.936 5 20 JKBD O=C(Cc1ccc([N+](=O)[O-])cc1)N(c1ccc(Cl)c(Cl)c1)c1nc2ccccc2s1 603007061 WXRVDFPYGYOBER-UHFFFAOYSA-N 458.326 6.419 5 20 JKBD COc1ccc([N+](=O)[O-])cc1NC(=O)c1ccc(OCc2ccc(Br)s2)c(OC)c1 603637434 FXHZZKOQMMZCAG-UHFFFAOYSA-N 493.335 5.267 5 20 JKBD C[C@H](c1ccccc1)n1c(SCCC(=O)Nc2ccccc2[N+](=O)[O-])nnc1-c1ccccc1 603917469 SFHHHDPCMIIXAV-GOSISDBHSA-N 473.558 5.584 5 20 JKBD O=C(NC1CCCCC1)c1cc(NC(=O)C2CCN(c3ccccc3[N+](=O)[O-])CC2)ccc1Cl 604025996 VTIQYWSVTUMUSS-UHFFFAOYSA-N 484.984 5.166 5 20 JKBD Cc1nn(CCC(=O)Nc2ccc(Oc3ccccc3C(F)(F)F)c(F)c2)c(C)c1[N+](=O)[O-] 608806444 JQHPVRFRJWVNSW-UHFFFAOYSA-N 466.391 5.387 5 20 JKBD Cc1sc(NC(=O)c2cccc(C(=O)N(C)c3ccccc3)c2)nc1-c1cccc([N+](=O)[O-])c1 609216413 IFPFBDAIDAQORB-UHFFFAOYSA-N 472.526 5.556 5 20 JKBD C[C@H](OC(=O)[C@@H](OC1CCCC1)c1ccccc1)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 727017386 PETPAUQWAIIUFO-XOBRGWDASA-N 480.439 5.184 5 20 JKBD CN(Cc1ccccc1)C(=O)N1CCC(C(=O)OCc2nc3ccccc3c3ccccc23)CC1 727556690 BXDQOYVAMRYBIA-UHFFFAOYSA-N 467.569 5.395 5 20 JKBD C[C@@H]1CN(c2ccc(NC(=O)c3ccc(N[C@H](C)c4ccccn4)c([N+](=O)[O-])c3)cc2)C[C@@H](C)O1 747390979 WNQJMWWPVQXCOP-GUDVDZBRSA-N 475.549 5.029 5 20 JKBD CC(C)N(Cc1nnc(-c2cccc([N+](=O)[O-])c2)o1)C(=O)c1ccc2[nH]c3c(c2c1)C[C@H](C)CC3 864242366 CMYJXVOKJLARFU-MRXNPFEDSA-N 473.533 5.302 5 20 JKBD Cc1nc(C(C)C)sc1C(=O)O[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1 915505630 QOLYFMUJPARWKU-SFHVURJKSA-N 473.938 5.673 5 20 JKBD C[C@H](Cc1ccccc1Cl)NC(=O)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 917167754 YRPHADASXLPUPH-CQSZACIVSA-N 469.891 5.231 5 20 JKBD CC(C)N(Cc1nnc(-c2cccc([N+](=O)[O-])c2)o1)C(=O)c1ccc(-c2ccccc2Cl)o1 917205801 MWXRDUBMIZRFDF-UHFFFAOYSA-N 466.881 5.609 5 20 JKBD CC(=O)N(c1ccc(Cl)cc1)c1nc(/C=C2\N=C(c3ccc([N+](=O)[O-])c(C)c3)OC2=O)cs1 917601241 OKPNEUHLTHOWBC-ZDLGFXPLSA-N 482.905 5.042 5 20 JKBD COc1ccc(COC(=O)c2cc3ccccc3cc2OCc2c(C)noc2C)cc1[N+](=O)[O-] 918819866 HCDRJERDMGGZQM-UHFFFAOYSA-N 462.458 5.297 5 20 JKBD Cc1ccn(-c2ccc(C(=O)O[C@H](C(=O)Nc3ccc([N+](=O)[O-])cc3Cl)c3ccccc3)cc2)n1 919185229 NLMKTMLEEPZDRZ-QHCPKHFHSA-N 490.903 5.279 5 20 JKBD CN(CCCCCc1cc(-c2ccccc2)n[nH]1)C(=O)c1cc([N+](=O)[O-])ccc1N1CCCC1 919846840 RQNAVPVYSCTORT-UHFFFAOYSA-N 461.566 5.070 5 20 JKBD C[C@@H](Nc1ccc(C(=O)OCc2cc(=O)oc3cc4c(cc23)CCC4)cc1[N+](=O)[O-])c1ccccn1 920544588 DGEJKVHFJZSQPC-MRXNPFEDSA-N 485.496 5.115 5 20 JKBD O=C(/C=C/c1ccc([N+](=O)[O-])o1)Nc1ccc(C2(NC(=O)C34CC(C(F)(F)F)(C3)C4)CCC2)cc1 1786205728 OTPAOUFMQCXEGM-SOFGYWHQSA-N 489.450 5.068 5 20 JKBD CC(C)(C)OCC(=O)Nc1ccc(C2(NC(=O)c3cc4cc([N+](=O)[O-])ccc4s3)CCC2)cc1 1786639514 MVXZENIKNZQFBR-UHFFFAOYSA-N 481.574 5.372 5 20 JKBD Cc1ccc(CC(=O)NC2(c3ccc(NC(=O)c4c(F)ccnc4Cl)cc3)CCC2)cc1[N+](=O)[O-] 1786990810 DWMNGFIVKOBPSY-UHFFFAOYSA-N 496.926 5.081 5 20 JKBD Cc1cnc(Cl)c(C(=O)Nc2ccc(C3(NC(=O)c4cc([N+](=O)[O-])c(O)cc4C)CCC3)cc2)c1 1787568438 WBAGTYLJXQLPGF-UHFFFAOYSA-N 494.935 5.027 5 20 JKBD O=C(NC1(c2ccc(NC(=O)c3cccc4cnccc34)cc2)CCC1)c1ccc([N+](=O)[O-])cc1F 1789328156 UCLSXFHVVXZCSH-UHFFFAOYSA-N 484.487 5.344 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)NC1(c2ccc(NC(=O)c3cncc4cnccc34)cc2)CCC1 1790010589 DHGRUIBPVFNLLU-UHFFFAOYSA-N 499.502 5.047 5 20 JKBD Cc1cc(C(=O)NC2(c3ccc(NC(=O)c4cc5cc([N+](=O)[O-])ccc5s4)cc3)CCC2)c[nH]1 1791011182 NATWJVSMFIJQJB-UHFFFAOYSA-N 474.542 5.508 5 20 JKBD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc([N+](=O)[O-])cc1F)c1cc2c(Cl)cccc2s1 1800352419 NDNZDCSJGSFSEV-BTTYYORXSA-N 487.940 5.168 5 20 JKBD O=C(c1ccc(Cl)c(C(F)(F)F)c1)N1CCC2(CCCN(C(=O)c3ccc([N+](=O)[O-])o3)C2)CC1 1804651053 FLSUFPILNMDCOS-UHFFFAOYSA-N 499.873 5.019 5 20 JKBD Cc1c(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)[C@@H]3CCC(F)(F)C3)n[nH]2)cc(Cl)cc1[N+](=O)[O-] 1814389902 YFPKQWRVJKEBBR-CXAGYDPISA-N 495.914 5.021 5 20 JKBD Cc1cc2cccc(C(=O)Nc3cc([C@@H]4CCCCN4C(=O)/C=C/c4ccccc4[N+](=O)[O-])[nH]n3)c2[nH]1 1818653942 PVQURUYHXKOVJB-OTOIZHKDSA-N 498.543 5.127 5 20 JKBD O=C(/C=C/c1ccccc1[N+](=O)[O-])N1CCC([C@@H]2CCCCN2C(=O)c2ccc(Cl)cc2F)CC1 1823900021 CDDKCLJLLZRNTG-HDFUYHJRSA-N 499.970 5.334 5 20 JKBD C[C@H](Sc1ccccc1)C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cccc(F)c2[N+](=O)[O-])CC1 1824392710 ROMJWJWVPHZJBE-MBSDFSHPSA-N 499.608 5.148 5 20 JKBD O=C(COC(=O)c1ccccc1C(=O)c1ccc(Cl)c([N+](=O)[O-])c1)Nc1ccc(F)cc1Cl 11029344 GZVSPEQUNWCXDG-UHFFFAOYSA-N 491.258 5.067 5 20 JKBD Cc1ccc(C)c(NC(=O)[C@H](OC(=O)Cn2c3ccccc3c(=O)c3ccccc32)c2ccccc2)c1 11276445 SOKLKMFAEHJETJ-SSEXGKCCSA-N 490.559 5.695 5 20 JKBD CC(C)c1ccccc1NC(=O)[C@@H](C)Oc1ccc2c(-c3ccc([N+](=O)[O-])cc3)cc(=O)oc2c1 15370827 XSJTUNFQIQDUAH-QGZVFWFLSA-N 472.497 5.898 5 20 JKBD Cc1nc(-c2cccc(Cl)c2)sc1C(=O)OCC(=O)Nc1ccc([N+](=O)[O-])cc1Cl 17955992 NYEIAGIQGQGLLI-UHFFFAOYSA-N 466.302 5.129 5 20 JKBD Cc1ccc(C(=O)C2CCN(C(=O)c3ccc(NCc4ccccc4)c([N+](=O)[O-])c3)CC2)c(C)c1 24452461 YWVOFZJEJZETRF-UHFFFAOYSA-N 471.557 5.559 5 20 JKBD COc1ccccc1-n1c(SCCC(=O)Nc2ccccc2[N+](=O)[O-])nnc1-c1cccs1 26364641 DYKCMVVJEXAIIP-UHFFFAOYSA-N 481.559 5.034 5 20 JKBD COC(=O)c1ccccc1C(=O)c1ccc(NCc2ccc(Br)s2)c([N+](=O)[O-])c1 26726208 NYLRTFGCEOTNJG-UHFFFAOYSA-N 475.320 5.049 5 20 JKBD Cc1cnc2c(S(=O)(=O)Oc3ccc(NC(=O)c4cc([N+](=O)[O-])ccc4Cl)cc3)cccc2c1 29377043 SXTDYWYLFFYQRK-UHFFFAOYSA-N 497.916 5.125 5 20 JKBD C[C@H](Nc1ccc(C(=O)N(C)Cc2ccc(Br)cc2)cc1[N+](=O)[O-])c1ccccn1 108756625 RTAXQCFQKMFPMM-HNNXBMFYSA-N 469.339 5.198 5 20 JKBD O=C(NCC1(c2ccccc2)CCC1)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 247333218 PMPRJMZWSYLTMD-UHFFFAOYSA-N 461.484 5.068 5 20 JKBD Cc1ccc(-c2cc(NC(=O)c3ccc(S(C)(=O)=O)c([N+](=O)[O-])c3)nc(-c3ccccc3)c2)cc1 301905367 GUWTWRQJXDVHIA-UHFFFAOYSA-N 487.537 5.288 5 20 JKBD CC(=O)Nc1ccc(Cl)cc1NC(=O)c1ccc(N[C@H](C)c2ccccn2)c([N+](=O)[O-])c1 303001041 OFJOPLAUEFADIZ-CYBMUJFWSA-N 453.886 5.027 5 20 JKBD COCCN(C(=O)c1ccc(Sc2nc(C)cs2)c([N+](=O)[O-])c1)c1nc2ccccc2s1 477840140 BTFLLQHDYDFIGX-UHFFFAOYSA-N 486.600 5.414 5 20 JKBD O=C(NCCc1nccs1)c1ccccc1Sc1ccc(C(F)(F)F)cc1[N+](=O)[O-] 497336964 TUPMECOZOSBOBD-UHFFFAOYSA-N 453.467 5.194 5 20 JKBD CCn1c(S[C@H](C)C(=O)Nc2c(C)nn(-c3ccccc3)c2C)nc2cc3ccccc3cc2c1=O 498098447 OHRFXLHFWXMTQZ-LJQANCHMSA-N 497.624 5.491 5 20 JKBD COc1ccc([C@@H](C)NC(=O)C/C(=C\c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)cc1 498854581 JZWHOQWIRYXHHA-FABDANFUSA-N 473.554 6.021 5 20 JKBD Cc1cc(C)c2c(-c3ccccc3)nc(S[C@H](C)c3nnc(-c4ccc([N+](=O)[O-])cc4)o3)n2n1 501631251 UKLJVDRVFPKNSK-MRXNPFEDSA-N 472.530 5.825 5 20 JKBD C[C@H](Nc1ccc(C(=O)Nc2ccccc2C(=O)N2CCCCC2)cc1[N+](=O)[O-])c1ccccn1 506004744 HELJJSAZXLFZAY-SFHVURJKSA-N 473.533 5.041 5 20 JKBD C[C@H](OC[C@@H](O)COc1ccc(NC(=O)c2cccc([N+](=O)[O-])c2)cc1)c1ccc(Cl)cc1 506337295 IXCQTWHDUJGKAO-KSFYIVLOSA-N 470.909 5.018 5 20 JKBD COCCN(C(=O)[C@H]1CCC[C@@H](C(F)(F)F)C1)c1nc(-c2ccc([N+](=O)[O-])cc2)cs1 515159545 KYMZAEQAQVUJNF-LSDHHAIUSA-N 457.474 5.066 5 20 JKBD C[C@H](N[C@H](C)c1cccc(NC(=O)Cc2ccccc2F)c1)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl 515523533 OGAWTDDBPUZMKL-CVEARBPZSA-N 498.942 5.246 5 20 JKBD O=C(N[C@H](c1ccccc1)C(F)(F)F)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 518279630 IRQUNSAZZYKDBB-GOSISDBHSA-N 475.389 5.250 5 20 JKBD O=C(Nc1cccc(OCc2cccc(F)c2)c1)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-] 603999057 SGTZUVHXJYRZTE-UHFFFAOYSA-N 464.371 5.506 5 20 JKBD Cc1nc(CNC(=O)C/C(=C\c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)nc2ccccc12 608809170 WLYCRIGLSWTIAM-XMHGGMMESA-N 495.564 5.703 5 20 JKBD Cc1ccccc1-c1nc(C(=O)N2CCN(c3ccc(C(F)(F)F)cc3[N+](=O)[O-])CC2)cs1 608931821 WKYSZLOBHPYVIG-UHFFFAOYSA-N 476.480 5.008 5 20 JKBD Cc1cc(NC(=O)Cc2cn(-c3ccccc3)nc2-c2ccc([N+](=O)[O-])cc2)ccc1C(=O)NC(C)C 609409122 XUYWMVBIVQILBZ-UHFFFAOYSA-N 497.555 5.075 5 20 JKBD CN(C(=O)CSc1nc2sc3c(c2c(=O)n1C1CCCC1)CCCC3)c1ccc([N+](=O)[O-])cc1 619668444 KPLPUKVLUIREFQ-UHFFFAOYSA-N 498.630 5.115 5 20 JKBD C[C@H](OC(=O)c1cc([N+](=O)[O-])ccc1Br)C(=O)Nc1ccccc1Oc1ccccc1 725985238 JDLGWQUIUGMOBX-AWEZNQCLSA-N 485.290 5.334 5 20 JKBD Cc1ccc(/C(O)=C(/C(=S)Nc2c(Cl)ccc(C)c2Cl)[n+]2cccc(O)c2)cc1[N+](=O)[O-] 728559095 XXZIKMOBQSUXBQ-UHFFFAOYSA-O 491.376 5.835 5 20 JKBD COc1ccc([N+](=O)[O-])c(C(=O)Nc2ccc(NC(=O)OC(C)(C)C)cc2C(F)(F)F)c1 729655586 UGGHNJVGCVFMRI-UHFFFAOYSA-N 455.389 5.222 5 20 JKBD COc1cc(C(=O)OCc2ccc(Br)cc2C)c([N+](=O)[O-])cc1OCc1cscn1 748489611 RRBHUNXRQHOLSA-UHFFFAOYSA-N 493.335 5.067 5 20 JKBD C[C@@H](OC(=O)C1(c2cccc(F)c2)CCCC1)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 755855182 ZYKLIRWNJNKHNK-CYBMUJFWSA-N 468.403 5.135 5 20 JKBD Cc1ccccc1-c1cc(C(=O)O[C@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2)c2cnn(C(C)C)c2n1 827238257 KFRWWJBXWUOBJJ-QGZVFWFLSA-N 487.516 5.080 5 20 JKBD CCN(CC)Cc1csc(NC(=O)c2ccccc2C(=O)c2ccc(SC)c([N+](=O)[O-])c2)n1 844132816 YEEQQEXNSLJISB-UHFFFAOYSA-N 484.603 5.098 5 20 JKBD Cc1c(C(=O)Oc2ccc(NC(=O)c3cc([N+](=O)[O-])ccc3Cl)cc2)cnn1-c1ccccc1F 844259121 CQECUNIFKDQCKT-UHFFFAOYSA-N 494.866 5.353 5 20 JKBD O=C(Nc1cc2c(cc1NCc1c(Br)cccc1[N+](=O)[O-])OCCO2)c1cccs1 864007643 OAHSGEMKGVKSCL-UHFFFAOYSA-N 490.335 5.054 5 20 JKBD CCCOc1ccccc1Oc1ncccc1CNC(=O)c1ccc(Br)c([N+](=O)[O-])c1 916483353 KJUMZENHZCDKPK-UHFFFAOYSA-N 486.322 5.263 5 20 JKBD CC(C)N(Cc1nnc(-c2cccc([N+](=O)[O-])c2)o1)C(=O)[C@@H](C)Sc1cc(Cl)ccc1Cl 917590736 ATLJRNBEVYXDKI-CYBMUJFWSA-N 495.388 5.869 5 20 JKBD O=C(Cc1cc(F)ccc1[N+](=O)[O-])NC1(c2ccc(NC(=O)c3scnc3C3CC3)cc2)CCC1 1787186920 HABFECQGJSEDRN-UHFFFAOYSA-N 494.548 5.058 5 20 JKBD C[C@H](Sc1cccs1)C(=O)NC1(c2ccc(NC(=O)c3cc(O)cc([N+](=O)[O-])c3)cc2)CCC1 1790755974 KMZFIWOFLXCSAW-HNNXBMFYSA-N 497.598 5.290 5 20 JKBD COc1c(Cl)cccc1C(=O)NC1(c2ccc(NC(=O)c3cc(O)cc([N+](=O)[O-])c3)cc2)CCC1 1790757154 ANASSMRPAJXSAG-UHFFFAOYSA-N 495.919 5.024 5 20 JKBD O=C(CC1CCCC1)N[C@H]1CCc2nc(NC(=O)c3cc4cc([N+](=O)[O-])ccc4s3)sc2C1 1824424500 BKVQUSLRBLOFRA-HNNXBMFYSA-N 484.603 5.072 5 20 JKBD C/C(=C\c1cccs1)C(=O)N1CCC([C@@H]2CCCCN2C(=O)Cc2cc(F)ccc2[N+](=O)[O-])CC1 1832885176 KEJLQXYCGUNALX-ZGSOLVRCSA-N 499.608 5.061 5 20 JKBD Cc1c(Cl)cccc1-n1c(S[C@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2)nnc1-c1ccncc1 10318173 AQXHWEFGJUUCGZ-OAHLLOKOSA-N 494.964 5.319 5 20 JKBD C[C@H](OC(=O)c1ccc([N+](=O)[O-])cc1Cl)C(=O)N(Cc1ccccc1)Cc1ccccc1 11028926 QLBIPXDOVOYOHK-KRWDZBQOSA-N 452.894 5.023 5 20 JKBD C[C@H](Sc1nnc(-c2ccc(F)cc2)n1Cc1ccccc1)C(=O)Nc1ccc(F)c([N+](=O)[O-])c1 21684684 QJUZTZHOXNJHKE-HNNXBMFYSA-N 495.511 5.299 5 20 JKBD Cc1occc1C(=O)Nc1cc(NC(=O)c2cc([N+](=O)[O-])ccc2Sc2ccccc2)ccc1F 479717734 KDOUTAQAKFABRX-UHFFFAOYSA-N 491.500 6.291 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)Nc2cc(-c3cccc(C)c3)nn2-c2ccccc2)cc1SC 481964012 CJYKRKGVSSRGMW-UHFFFAOYSA-N 474.542 5.739 5 20 JKBD COc1cc(CSc2nnc(-c3c(C)cc(C)cc3C)o2)c([N+](=O)[O-])cc1OC(F)F 483244273 UQRYPMTXCZRWRQ-UHFFFAOYSA-N 451.451 5.472 5 20 JKBD Cc1ccc(CN(C(=O)C2CCN(c3ccccc3[N+](=O)[O-])CC2)c2ccc3c(c2)OCCO3)s1 485349872 JSMCTXQNIKYZLR-UHFFFAOYSA-N 493.585 5.186 5 20 JKBD CC(=O)Nc1ccc(Br)cc1NC(=O)c1ccc(N[C@@H](C)c2ccccn2)c([N+](=O)[O-])c1 506167757 XFHARIPALBSQMD-ZDUSSCGKSA-N 498.337 5.136 5 20 JKBD COc1ccccc1NC(=O)c1ccc(NC(=O)N(Cc2ccc([N+](=O)[O-])cc2)C(C)C)cc1 510047823 CIWBORALUXNRKE-UHFFFAOYSA-N 462.506 5.298 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Cl)[C@@H](NCc1cc(Br)cs1)c1ccccc1 515521164 ICTPKOLMVPVEIU-SFHVURJKSA-N 480.771 5.542 5 20 JKBD Cc1ccc(CN2CCSCC2)cc1NC(=O)c1ccc(N[C@@H](C)c2ccccn2)c([N+](=O)[O-])c1 522204656 KGPLJBOLNXAFDJ-IBGZPJMESA-N 491.617 5.272 5 20 JKBD O=C(Nc1ccccc1)Nc1ccc(NC(=O)c2csc(-c3ccc([N+](=O)[O-])cc3)n2)cc1 522672198 UIVXEGWIFYHFBL-UHFFFAOYSA-N 459.487 5.615 5 20 JKBD CC(C)CCSc1ccc(C(=O)N[C@H](c2nc(-c3cccnc3)no2)C(C)C)cc1[N+](=O)[O-] 524379051 PPRYKRUTTMVAKB-FQEVSTJZSA-N 469.567 5.305 5 20 JKBD O=C(c1nc(-c2cccs2)n(-c2cccc(C(F)(F)F)c2)n1)N1CCc2ccc([N+](=O)[O-])cc21 591604696 NIYXIYNHAVEGND-UHFFFAOYSA-N 485.447 5.126 5 20 JKBD CCOC(=O)c1cc(C(=O)N(CCc2ccccc2)c2nc3ccccc3s2)cc([N+](=O)[O-])c1 602760856 RFOJWBOMPKJWCP-UHFFFAOYSA-N 475.526 5.271 5 20 JKBD Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)c1ccc(NS(=O)(=O)c2ccc(F)c(Cl)c2)cc1 603501398 MYCOMTNOLDDTLE-UHFFFAOYSA-N 477.901 5.057 5 20 JKBD CC(C)COC[C@H](NCc1ccc(-c2ccc([N+](=O)[O-])cc2Br)o1)c1ccco1 608837280 YJAMZTXEXTWAHP-IBGZPJMESA-N 463.328 5.714 5 20 JKBD COc1ccc([N+](=O)[O-])c(C(=O)Nc2ccc(Oc3ccnc4cc(Cl)ccc34)c(F)c2)c1 609066142 KAJUAJKEAXUHGW-UHFFFAOYSA-N 467.840 5.989 5 20 JKBD COc1ccc(CN(Cc2ccc(OC)cc2)C(=O)c2ccc(SC)c([N+](=O)[O-])c2)cc1 609130178 JLUXCEMHHFLFSX-UHFFFAOYSA-N 452.532 5.177 5 20 JKBD O=C(Nc1ccnn1Cc1ccc(Cl)cc1Cl)C1CCN(c2ccccc2[N+](=O)[O-])CC1 610429604 OXBDVDSKGXICTF-UHFFFAOYSA-N 474.348 5.002 5 20 JKBD CCOc1ccc([C@@H](NC(=O)C2CCN(c3ccccc3[N+](=O)[O-])CC2)C(C)C)cc1OCC 611994328 NRYQVIIHNZYIBP-VWLOTQADSA-N 469.582 5.122 5 20 JKBD O=C(Cn1c2ccccc2c(=O)c2ccccc21)N[C@@H]1C[C@@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1 642158031 OFMXQDVGWIZMJO-FICVDOATSA-N 470.413 5.180 5 20 JKBD Cc1sc(C(=O)Nc2ccc3nc(NC(=O)c4cc([N+](=O)[O-])c(C)s4)ccc3c2)cc1[N+](=O)[O-] 728151343 ZDDSYTBOKPZKKZ-UHFFFAOYSA-N 497.514 5.296 5 20 JKBD Cc1ccc(C)c(NC(=O)[C@@H](OC(=O)c2csc(-c3ccc([N+](=O)[O-])cc3)n2)c2ccccc2)c1 747954674 CTXFURSRLIKENG-QHCPKHFHSA-N 487.537 5.872 5 20 JKBD O=C(COC(=O)c1csc(-c2cccc([N+](=O)[O-])c2)n1)Nc1ccccc1Oc1ccccc1 747961966 CUFXVIPBPWNOER-UHFFFAOYSA-N 475.482 5.306 5 20 JKBD C[C@H](OC(=O)c1cc([N+](=O)[O-])ccc1N1CCCC1)C(=O)Nc1ccccc1-c1ccccc1 846285431 SUQGWSJVSDAVSZ-SFHVURJKSA-N 459.502 5.046 5 20 JKBD C[C@H](OC(=O)/C=C\c1ccccc1OC(F)(F)F)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 914944103 YWELYLRXVUGHIC-WDDYJBPVSA-N 492.328 5.096 5 20 JKBD O=C(NCc1ccccc1F)c1cc(NC(=O)c2cc([N+](=O)[O-])ccc2Cl)ccc1Cl 916088003 VWBOBFCPMHWQGE-UHFFFAOYSA-N 462.264 5.223 5 20 JKBD CC(C)N(Cc1nnc(-c2cccc([N+](=O)[O-])c2)o1)C(=O)c1ccc(-c2ccc(F)cc2)o1 917205986 RASNOCUGDZIMBP-UHFFFAOYSA-N 450.426 5.095 5 20 JKBD O=C(Nc1ccccc1C(=O)NCCc1ccc(Cl)s1)c1ccc([N+](=O)[O-])cc1Cl 918595347 QROLXOHWVNWQAB-UHFFFAOYSA-N 464.330 5.188 5 20 JKBD Cc1ccc([N+](=O)[O-])cc1NC(=O)COC(=O)c1ccsc1NC(=O)c1ccc(C(C)C)cc1 919400075 MVHVSGAPGPXRRP-UHFFFAOYSA-N 481.530 5.136 5 20 JKBD C[C@H](OC(=O)CCCc1ccc(Cl)c(Cl)c1)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 919487943 AVEDMLTXWVIAAR-LBPRGKRZSA-N 450.278 5.579 5 20 JKBD C[C@@H](C(=O)NC1(c2ccc(NC(=O)/C=C/c3ccc([N+](=O)[O-])o3)cc2)CCC1)c1ccccc1 1786208051 HYVNVHLEWKFQQP-QIXNEVBVSA-N 459.502 5.139 5 20 JKBD O=C(CCc1cccc([N+](=O)[O-])c1)Nc1ccc(C2(NC(=O)c3ccc4ncoc4c3)CCC2)cc1 1786599807 ALRVMLDFQXKWGU-UHFFFAOYSA-N 484.512 5.117 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)[C@H]3CCCCC3(F)F)CCC2)cc1)c1cc([N+](=O)[O-])cc2c1OCC2 1790044128 AJGBVUBBSHSKBL-OAQYLSRUSA-N 499.514 5.103 5 20 JKBD Cc1ccc(CC(=O)Nc2ccc(C3(NC(=O)c4cc(C(C)C)no4)CCC3)cc2)cc1[N+](=O)[O-] 1790525478 YMPDTAGPOACFAM-UHFFFAOYSA-N 476.533 5.005 5 20 JKBD Cc1ocnc1C(=O)NC1(c2ccc(NC(=O)c3cc4cc([N+](=O)[O-])ccc4s3)cc2)CCC1 1791010361 KJDLXPSEOJXTMY-UHFFFAOYSA-N 476.514 5.167 5 20 JKBD COc1cc(C(=O)NC2(c3ccc(NC(=O)[C@]4(C)CC=CCC4)cc3)CCC2)cc([N+](=O)[O-])c1OC 1791992966 YFYYFVBDJKYDSF-AREMUKBSSA-N 493.560 5.106 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1[nH]c2c(Cl)cccc2c1C 1796703704 IQMQQLHOIJGMGB-MUJYYYPQSA-N 498.942 5.051 5 20 JKBD O=C(c1cc(F)cc([N+](=O)[O-])c1)N1CCC2(CCCN(C(=O)c3cc4ccc(Cl)cc4[nH]3)C2)CC1 1804750095 PQEHEPJERKIEJI-UHFFFAOYSA-N 498.942 5.027 5 20 JKBD O=C(Nc1cc([C@H]2CCCCN2C(=O)CCc2cccc([N+](=O)[O-])c2)[nH]n1)c1cc(F)cc(Cl)c1 1823207669 ABYOJEQNKDTGLI-OAQYLSRUSA-N 499.930 5.049 5 20 JKBD Cc1c(C(=O)N2CCC([C@@H]3CCCCN3C(=O)CC(C)(C)C)CC2)cc(Cl)cc1[N+](=O)[O-] 1826338080 MXSLEFCPKFXDSK-FQEVSTJZSA-N 464.006 5.226 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)N1CCCC[C@@H]1C1CCN(C(=O)[C@@H](C)c2ccccc2)CC1 1830729560 QYXMZJLPESDORU-MHECFPHRSA-N 481.568 5.079 5 20 JKBD CC1=CC[C@H](C(=O)N2CCC([C@@H]3CCCCN3C(=O)c3c(F)ccc([N+](=O)[O-])c3C)CC2)CC1 1830734003 TXCDNRGKCZUSRG-REWPJTCUSA-N 471.573 5.022 5 20 JKBD C[C@H](CC(=O)N1CCC([C@H]2CCCCN2C(=O)Cc2cc(F)ccc2[N+](=O)[O-])CC1)c1ccccc1 1832888065 BSMLXWKBMILRQK-CJFMBICVSA-N 495.595 5.090 5 20 JKBD Cc1ccc(NC(=O)[C@H](C)Oc2ccc3c(-c4ccc([N+](=O)[O-])cc4)cc(=O)oc3c2)c(C)c1 15370804 TUTVVIZYHJJEDD-KRWDZBQOSA-N 458.470 5.391 5 20 JKBD C[C@@H](OC(=O)c1cc2cc(Cl)ccc2o1)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 18751144 LUAZZRBZVQMWGK-SECBINFHSA-N 456.760 5.197 5 20 JKBD CC(=O)Nc1cccc(N[C@@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Br)c2ccccc2)c1 23865217 LHOOFVALGHDJMB-OAQYLSRUSA-N 483.322 5.108 5 20 JKBD NC(=O)Cc1ccc(NC(=O)c2c3c(nc4ccccc24)/C(=C/c2ccc([N+](=O)[O-])cc2)CCC3)cc1 32045076 AVLXMMGLSHRVSB-CAPFRKAQSA-N 492.535 5.300 5 20 JKBD O=C(N[C@H](CN1CCCC1=O)c1ccccc1)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1 108920166 SJZLTCQKWKMARX-OAQYLSRUSA-N 479.920 5.134 5 20 JKBD O=C(Cc1cccs1)Nc1ccccc1NC(=O)c1csc(-c2ccc([N+](=O)[O-])cc2)n1 409977991 HMSXLMIPLHTAIM-UHFFFAOYSA-N 464.528 5.213 5 20 JKBD Cc1nc(SCc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)n([C@@H](C)[C@@H]2C[C@H]3CC[C@H]2C3)c1C 485044188 HRTHWVDJHMCQIG-DUPRYPCISA-N 453.568 5.748 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)N2CCC(N(C)Cc3cccc(C(F)(F)F)c3)CC2)cc1SC 486712942 IQJRQHJCHHQLEH-UHFFFAOYSA-N 497.539 5.081 5 20 JKBD O=C(NC[C@@H]1CCCN(Cc2cccs2)C1)c1cc([N+](=O)[O-])ccc1Sc1ccccc1 494312859 DKBQNQIHZSZBIP-SFHVURJKSA-N 467.616 5.450 5 20 JKBD CCOc1cc([N+](=O)[O-])c(C(=O)Nc2ccc(S[C@@H](C)CC)cc2C(F)(F)F)cc1OC 499594068 FQCMPMOMTBHNMY-LBPRGKRZSA-N 472.485 6.164 5 20 JKBD CCOc1cc(C(=O)Nc2ccc(S[C@H](C)CC)cc2C(F)(F)F)c([N+](=O)[O-])cc1OC 499600810 ZPRHTFYREQKTND-GFCCVEGCSA-N 472.485 6.164 5 20 JKBD COC(=O)c1cc(C(C)C)ccc1NC(=O)c1ccc(N[C@@H](C)c2ccccn2)c([N+](=O)[O-])c1 505164209 LXJVMHPSVNZYMT-INIZCTEOSA-N 462.506 5.325 5 20 JKBD C[C@@H](Nc1ccc(C(=O)N(Cc2ccccc2C(F)(F)F)C2CC2)cc1[N+](=O)[O-])c1ccccn1 506152997 KFPNOJAUDAMJOK-MRXNPFEDSA-N 484.478 5.987 5 20 JKBD CCN(Cc1cccc(NC(=O)c2ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])c(OC)c2)c1)C(C)=O 509368803 JHTUGLNWVWWKBK-UHFFFAOYSA-N 497.935 5.670 5 20 JKBD C[C@H](Sc1nnc(-c2ccccc2)n1[C@H](C)c1ccccc1)C(=O)Nc1ccccc1[N+](=O)[O-] 515488140 VKSSYCHTWOPRLY-MSOLQXFVSA-N 473.558 5.582 5 20 JKBD COc1ccc(Br)cc1-c1nc(CS(=O)(=O)[C@H](C)c2cccc([N+](=O)[O-])c2)cs1 518480839 FGGMNFGSRWINEE-GFCCVEGCSA-N 497.392 5.165 5 20 JKBD COc1cc(C(=O)Nc2cc(C)nn2-c2cc(C(F)(F)F)ccc2Cl)ccc1[N+](=O)[O-] 522249708 UZBFKSIWDYKSRV-UHFFFAOYSA-N 454.792 5.022 5 20 JKBD CC(C)Cc1ccc(C(=O)C2CCN(c3cnn(-c4ccc([N+](=O)[O-])cc4)c(=O)c3Cl)CC2)cc1 522621349 VXMMCWCEFAKJSZ-UHFFFAOYSA-N 494.979 5.092 5 20 JKBD C[C@H](Nc1ccc(C(=O)Nc2ccc(-c3n[nH]c(C4CC4)n3)cc2)cc1[N+](=O)[O-])c1ccccn1 523569293 QPTBBKSELCLKBI-HNNXBMFYSA-N 469.505 5.078 5 20 JKBD C[C@@H](c1cccc(NC(=O)c2cc([N+](=O)[O-])ccc2Sc2ccccc2)c1)N1CCOCC1 524553434 LYGZTPRRHCILTP-SFHVURJKSA-N 463.559 5.392 5 20 JKBD O=C(Cc1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1)N1CCC[C@@H]1c1ccc(O)cc1 604485272 IGXUDGBIOOOSDZ-RUZDIDTESA-N 468.513 5.059 5 20 JKBD COc1cc(CNCc2c(C)cc(Br)cc2C)c([N+](=O)[O-])cc1OCC(F)(F)F 604532615 DMFOXWJZSYJXFQ-UHFFFAOYSA-N 477.277 5.214 5 20 JKBD O=C(Nc1cnn(-c2ccncc2)c1)c1cc([N+](=O)[O-])ccc1Sc1ccc(Cl)cc1 608901017 QTPBJACWELXUSJ-UHFFFAOYSA-N 451.895 5.232 5 20 JKBD C[C@@H](Nc1ccc(C(=O)Nc2nc(-c3ccc4c(c3)CCO4)cs2)cc1[N+](=O)[O-])c1ccccn1 609113102 VIMGMJFKXYUQTM-OAHLLOKOSA-N 487.541 5.474 5 20 JKBD C[C@@H](NC(=O)N(C)CCCCCc1cc(-c2ccc(F)cc2)n[nH]1)c1cccc([N+](=O)[O-])c1 609211762 UDLPFBBGMFWBAI-QGZVFWFLSA-N 453.518 5.239 5 20 JKBD CC(C)c1nnc(COC(=O)c2ccccc2Sc2ccc(C(F)(F)F)cc2[N+](=O)[O-])o1 726987684 ASEDREVXYPTCIN-UHFFFAOYSA-N 467.425 5.628 5 20 JKBD Cc1c(C(=O)N(C)CCCCCc2cc(-c3cccc(F)c3)no2)cc([N+](=O)[O-])c(C)c1[N+](=O)[O-] 748638543 KPBJNXPMIDKUNN-UHFFFAOYSA-N 484.484 5.399 5 20 JKBD O=C(COC(=O)/C=C\c1ccc2ccc(Cl)cc2n1)Nc1ccc(C(F)(F)F)cc1[N+](=O)[O-] 912872408 AZDGAMSYRWBQKQ-VURMDHGXSA-N 479.798 5.010 5 20 JKBD Cc1ccnc2sc(C(=O)O[C@@H](C)C(=O)Nc3ccc([N+](=O)[O-])cc3C(F)(F)F)c(C)c12 914918747 MVVAJRRPUVUENT-NSHDSACASA-N 467.425 5.024 5 20 JKBD Cc1cccc(C)c1NC(=O)CCCOC(=O)c1ccc(N2CCC[C@@H](C)C2)c([N+](=O)[O-])c1 916590149 BVCDDSCUTUVHHE-QGZVFWFLSA-N 453.539 5.024 5 20 JKBD Cc1ccc[n+](/C(C(=S)Nc2c(C(C)C)cccc2C(C)C)=C(/O)c2ccc([N+](=O)[O-])cc2)c1 917610089 GUUJDCNIXLUIAD-UHFFFAOYSA-O 476.622 6.761 5 20 JKBD C[C@@H]1CCCCN1C(=O)c1ccc(NC(=O)c2ccc(Br)c([N+](=O)[O-])c2)cc1Cl 917761703 IOXJYYNEIAIFOD-GFCCVEGCSA-N 480.746 5.278 5 20 JKBD COc1ccc(-c2noc(CCCC(=O)Oc3ccc(-c4ccccc4)cc3[N+](=O)[O-])n2)cc1 920330787 NVVMPSRLCVAHOR-UHFFFAOYSA-N 459.458 5.249 5 20 JKBD O=C(CSCc1nc(O)c2c3c(sc2n1)CCC3)Oc1ccc(-c2ccccc2)cc1[N+](=O)[O-] 920331358 YORFQDGSDUWAHA-UHFFFAOYSA-N 493.566 5.300 5 20 JKBD Cc1c(C(=O)O[C@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2C(F)(F)F)sc2ccc(F)cc12 920552082 HJFGZZIFGJCTJC-SNVBAGLBSA-N 470.400 5.460 5 20 JKBD CCCN(C(=O)c1cc([N+](=O)[O-])ccc1C)c1cccc(NC(=O)c2cc([N+](=O)[O-])ccc2C)c1 921280655 IMTOWIXWMZJZOU-UHFFFAOYSA-N 476.489 5.429 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)c3cc(Cl)nc4ccccc34)CCC2)cc1)c1ccc([N+](=O)[O-])o1 1785748759 GAIUIDUTNYECKU-UHFFFAOYSA-N 490.903 5.451 5 20 JKBD O=C(NC1(c2ccc(NC(=O)c3ccc([N+](=O)[O-])o3)cc2)CCC1)c1ccc(-c2cccnc2)cc1 1785751206 SXRNREMADUCKPM-UHFFFAOYSA-N 482.496 5.311 5 20 JKBD Cn1c(CC(=O)NC2(c3ccc(NC(=O)/C=C/c4ccc([N+](=O)[O-])o4)cc3)CCC2)cc2ccccc21 1786205564 GTPRNIIHBXCFJT-ACCUITESSA-N 498.539 5.070 5 20 JKBD O=C(NC1(c2ccc(NC(=O)c3ccc([N+](=O)[O-])cc3F)cc2)CCC1)c1ccc2cnccc2c1 1790622295 RSHQYVXHHUNYAG-UHFFFAOYSA-N 484.487 5.344 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)Nc1ccc(C2(NC(=O)c3ccc4ncncc4c3)CCC2)cc1 1790772100 CZKZQTUPTBREJC-UHFFFAOYSA-N 499.502 5.047 5 20 JKBD CC[C@H](C)[C@@H](C(=O)N1CCCC2(CCN(C(=O)c3cccc(F)c3[N+](=O)[O-])CC2)C1)c1ccccc1 1809162367 MLFIDMXLPPVHKM-GBXCKJPGSA-N 495.595 5.409 5 20 JKBD Cc1cscc1C(=O)Nc1cc([C@@H]2CCCCN2C(=O)C2(c3cccc([N+](=O)[O-])c3)CCC2)[nH]n1 1818241269 RUZPMZBBJGQSPM-NRFANRHFSA-N 493.589 5.116 5 20 JKBD Cc1c(C(=O)N2CCCC[C@H]2c2cc(NC(=O)c3ccccc3F)n[nH]2)cc(Cl)cc1[N+](=O)[O-] 1820413097 DMZWXJGDFGLVIA-IBGZPJMESA-N 485.903 5.039 5 20 JKBD Cc1c(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)c3ccccc3F)n[nH]2)cc(Cl)cc1[N+](=O)[O-] 1820413098 DMZWXJGDFGLVIA-LJQANCHMSA-N 485.903 5.039 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cc3ccoc3s2)[nH]n1 1821284501 XBNCJPBPIIDIPV-KRWDZBQOSA-N 497.508 5.193 5 20 JKBD C/C(=C\c1cccs1)C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cccc(F)c2[N+](=O)[O-])CC1 1823718087 AFYAJGLXEGBDGQ-QWYDYZLZSA-N 485.581 5.132 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)N1CCCC[C@@H]1C1CCN(C(=O)[C@@H]2C[C@H]2c2ccccc2)CC1 1830728408 CAUKUVHXNKSWKA-SGIRGMQISA-N 493.579 5.079 5 20 JKBD C[C@H](CC(=O)N1CCCC[C@H]1C1CCN(C(=O)Cc2cc([N+](=O)[O-])ccc2F)CC1)c1ccccc1 1831504368 RLDSPPSQPAOSQN-IBVKSMDESA-N 495.595 5.090 5 20 JKBD CCOC(=O)Nc1ccc(C(=O)O[C@@H](C(=O)Nc2ccc(C)cc2[N+](=O)[O-])c2ccccc2)cc1 10702033 MCILBLJEHPJBRK-JOCHJYFZSA-N 477.473 5.008 5 20 JKBD Cc1cc(C)nc(Sc2ccc(NC(=O)c3ccc(Cn4nc(C)c([N+](=O)[O-])c4C)cc3)cc2)n1 11287626 FZWLHYHBIQRRDI-UHFFFAOYSA-N 488.573 5.267 5 20 JKBD Cc1ccc(S(C)(=O)=O)cc1NC(=O)c1ccc(Sc2nc3ccccc3s2)c([N+](=O)[O-])c1 15815249 LINRPFHAUYJLAV-UHFFFAOYSA-N 499.595 5.320 5 20 JKBD O=C(C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)Nc1ccc2c(c1)OCCO2 16020057 QNOMSYUQALVYHH-LGMDPLHJSA-N 473.510 5.545 5 20 JKBD COC(=O)CCCN(C)C(=O)c1c2c(nc3ccccc13)/C(=C/c1cccc([N+](=O)[O-])c1)CCC2 29440393 UIRWEKBMXIOUHF-KNTRCKAVSA-N 473.529 5.045 5 20 JKBD O=C(Cn1c2ccccc2c(=O)c2ccccc21)N(Cc1cccs1)c1ccc(F)cc1F 71945553 JIMFETHCPDYRCV-UHFFFAOYSA-N 460.505 5.728 5 20 JKBD Cc1nnc(COC(=O)c2c3c(nc4ccccc24)/C(=C/c2ccc([N+](=O)[O-])cc2)CCC3)o1 102065143 JUKHDNBTKBODJF-GHRIWEEISA-N 456.458 5.068 5 20 JKBD COc1ccc(/C=C2\N=C(S/C=C\c3ccc([N+](=O)[O-])o3)N(c3cccc(OC)c3)C2=O)cc1 214748649 MXJPHGJPOQJMAA-MWQUPTALSA-N 477.498 5.353 5 20 JKBD COc1ccc(-c2nnc(SCC(=O)c3cccc([N+](=O)[O-])c3)n2CCc2ccccc2)cc1 216804565 JEMXYCIGOKOGIG-UHFFFAOYSA-N 474.542 5.080 5 20 JKBD CC(=O)Nc1ccc(C)c(NC(=O)c2ccc(Sc3nc4ccccc4s3)c([N+](=O)[O-])c2)c1 479122087 QHVSEBIBAIDSAJ-UHFFFAOYSA-N 478.555 5.875 5 20 JKBD Cc1csc(Sc2ccc(C(=O)Nc3ccccc3NC(=O)N3CCCC3)cc2[N+](=O)[O-])n1 485126610 SCTTXRNTDVRMFN-UHFFFAOYSA-N 483.575 5.391 5 20 JKBD Cc1ccc(C(=O)N2C[C@H](C)C[C@@H](C)C2)cc1NC(=O)c1csc(-c2cccc([N+](=O)[O-])c2)n1 498777446 BPOAWJCIZBHDNP-HZPDHXFCSA-N 478.574 5.397 5 20 JKBD Cc1cnn(Cc2cc(F)ccc2F)c1NC(=O)c1ccc(N2C[C@@H](C)C[C@H](C)C2)c([N+](=O)[O-])c1 502689150 HMYLJBWDFVLAFN-HOTGVXAUSA-N 483.519 5.161 5 20 JKBD Cn1cc(C(=O)Nc2ccc(Br)c(C(F)(F)F)c2)c(-c2ccc([N+](=O)[O-])cc2)n1 506116274 TWHXTPOWTJRNPP-UHFFFAOYSA-N 469.217 5.029 5 20 JKBD O=C(C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)NCc1ccc2ccccc2n1 514502463 IEWMTULHNGRWOB-HKWRFOASSA-N 480.549 6.000 5 20 JKBD Cc1cc(C)nc(NC(=O)c2c3c(nc4ccccc24)/C(=C\c2cccc([N+](=O)[O-])c2)CCC3)n1 514981874 NMVBBUJPSRLZOK-RGEXLXHISA-N 465.513 5.679 5 20 JKBD C[C@H](c1ccccn1)N(C)C(=O)C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1 520088336 NFLGYYWFWDNYCS-VXNZKSKFSA-N 458.543 5.750 5 20 JKBD C[C@H]1CN(c2ccc(N[C@@H](C(=O)Nc3ccc([N+](=O)[O-])cc3Cl)c3ccccc3)cn2)C[C@@H](C)O1 559912730 DPHMVTHAPYQSOZ-XVTZWQNCSA-N 495.967 5.049 5 20 JKBD COc1cccc([C@@H]2CCCN2C(=O)C/C(=C/c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)c1 590671060 LRNOPIPBKHRSNR-CCOQBKANSA-N 499.592 6.508 5 20 JKBD CCOc1cc(NC(=O)N[C@@H](C)c2nc3ccccc3n2C(F)F)c([N+](=O)[O-])cc1OCC 603651260 CXLHXQQXBUFNNH-LBPRGKRZSA-N 463.441 5.020 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Cl)[C@@H](NC[C@@H]1CCCN(Cc2ccccc2)C1)c1ccccc1 604474094 HIWWNBYVPYXQGC-LVXARBLLSA-N 493.007 5.430 5 20 JKBD Cc1nc(NC(=O)Cn2ccc3cc([N+](=O)[O-])ccc32)sc1-c1nc2ccccc2n1C(F)F 604477122 HTRJPYYNXRPNGG-UHFFFAOYSA-N 482.472 5.365 5 20 JKBD C[C@H](Nc1ccc(C(=O)NCCc2c[nH]c3cc(Cl)ccc23)cc1[N+](=O)[O-])c1ccccn1 604487025 KUTRAKUBPGHPQL-HNNXBMFYSA-N 463.925 5.270 5 20 JKBD CC1CCN(c2ccc(C(=O)Nc3ccc(NC(=O)c4cccs4)cc3)cc2[N+](=O)[O-])CC1 604533688 OSLHRJMXIUNPPE-UHFFFAOYSA-N 464.547 5.397 5 20 JKBD O=[N+]([O-])c1ccc(-c2ccc(CNCc3cccc(OCc4ccccn4)c3)o2)c(Br)c1 608835945 BDUXZOONPJDQEV-UHFFFAOYSA-N 494.345 5.881 5 20 JKBD Cc1ccc2nc([C@@H]3CCCN(C(=O)c4ccc(N[C@@H](C)c5ccccn5)c([N+](=O)[O-])c4)C3)[nH]c2c1 608986980 PCPKFJSGNCWJTC-AZUAARDMSA-N 484.560 5.367 5 20 JKBD C[C@@H](OC(=O)CSc1nnc(-c2ccc(Cl)cc2)n1Cc1ccco1)c1cccc([N+](=O)[O-])c1 811809425 RFMRCAXEZZUYDN-OAHLLOKOSA-N 498.948 5.545 5 20 JKBD COc1ccc(-n2cnnc2S[C@H](C(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)c2ccccc2)cc1 849186546 YRBCQRLHRRWPLL-NRFANRHFSA-N 495.948 5.310 5 20 JKBD CC(C)N(C)Cc1cc(O[C@@H]2CCN(C(=O)c3cc([N+](=O)[O-])ccc3SC3CCCC3)C2)ccn1 856653816 PHAVJGMFUGYQLB-JOCHJYFZSA-N 498.649 5.158 5 20 JKBD Cc1ccc(NC(=O)[C@@H](OC(=O)c2nc(-c3ccco3)sc2C)c2ccccc2)c([N+](=O)[O-])c1 913307089 AXTVMRYGGZYONJ-NRFANRHFSA-N 477.498 5.465 5 20 JKBD CC(C)[C@H](OC(=O)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-])C(=O)Nc1ccccc1Cl 919195442 HJYMIMYPPJQVKW-KRWDZBQOSA-N 474.819 5.009 5 20 JKBD C[C@@H](OC(=O)[C@@H](C)Sc1ccccc1Cl)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 919507664 VKPYOMHESHSLDT-GHMZBOCLSA-N 476.860 5.318 5 20 JKBD CC(C)(C)OC(=O)NC[C@@H]1CCCN(C(=O)c2cc([N+](=O)[O-])ccc2Sc2ccccc2)C1 920750357 ZKCFTTSFDWMBCB-KRWDZBQOSA-N 471.579 5.123 5 20 JKBD O=C(CCc1cccc([N+](=O)[O-])c1)Nc1ccc(C2(NC(=O)c3cccnc3Cl)CCC2)cc1 1786599342 YSUJIRCXBYCOQR-UHFFFAOYSA-N 478.936 5.024 5 20 JKBD O=C(Cc1ccc([N+](=O)[O-])cc1F)NC1(c2ccc(NC(=O)c3cccc4cccnc34)cc2)CCC1 1788912979 BKSMFIRUKQWRFY-UHFFFAOYSA-N 498.514 5.273 5 20 JKBD COc1cc(C(=O)NC2(c3ccc(NC(=O)c4ccc5occc5c4)cc3)CCC2)ccc1[N+](=O)[O-] 1789051194 DGMWXLCDJSRQBI-UHFFFAOYSA-N 485.496 5.411 5 20 JKBD O=C(CSc1ccccc1[N+](=O)[O-])NC1(c2ccc(NC(=O)c3cc(Cl)ccn3)cc2)CCC1 1789721954 DGVOEADJPUQCNY-UHFFFAOYSA-N 496.976 5.183 5 20 JKBD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc2cc([N+](=O)[O-])ccc2s1)c1ccccc1C1CC1 1801208954 YBNPXIAXVNBDET-REPLKXPHSA-N 475.570 5.253 5 20 JKBD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C1(c2cccc(Cl)c2)CCCC1)c1cccc(F)c1[N+](=O)[O-] 1802186929 GOBVERSAOPHWNR-ACDBMABISA-N 499.970 5.151 5 20 JKBD Cc1cc(CCCC(=O)N2CCCC[C@@H]2C2CCN(C(=O)[C@@]3(C)C[C@@H]3C)CC2)c([N+](=O)[O-])cc1F 1824369877 AVSVQAVWXJZFFQ-OPWBJGKSSA-N 487.616 5.031 5 20 JKBD Cc1oc(C(C)(C)C)cc1C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2ccc([N+](=O)[O-])cc2F)CC1 1825951628 UVKUXGGJIPEKRS-HSZRJFAPSA-N 499.583 5.480 5 20 JKBD O=C(/C=C/c1ccccc1[N+](=O)[O-])N1CCC([C@@H]2CCCCN2C(=O)Cc2ccccc2Cl)CC1 1826477279 XAPBIDKSQLOJCC-BYUVYSIJSA-N 496.007 5.124 5 20 JKBD CC(C)(C)CCCCCC(=O)N1CCC([C@@H]2CCCCN2C(=O)c2ccc([N+](=O)[O-])[nH]2)CC1 1829835723 HWECHFQPYPSCMZ-NRFANRHFSA-N 460.619 5.153 5 20 JKBD COc1cc(C(=O)Nc2ccccc2N2CCCC2=O)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 15614915 JEILSGZZFSWTAX-UHFFFAOYSA-N 481.892 5.428 5 20 JKBD C[C@@H](Sc1nnc(-c2ccc(OC(F)F)cc2)o1)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 17670923 SPNXDAXSBBLAOU-SNVBAGLBSA-N 461.406 5.150 5 20 JKBD Cn1c(SCC(=O)Nc2cc(Cl)ccc2[N+](=O)[O-])nnc1-c1ccc(C(C)(C)C)cc1 21991961 ZTASREDUWKAIGX-UHFFFAOYSA-N 459.959 5.072 5 20 JKBD Cc1c(NC(=O)[C@@H](C)Sc2nnc(-c3ccc(C(C)(C)C)cc3)n2C)cccc1[N+](=O)[O-] 23998440 GTHUAMNIQHVEHA-OAHLLOKOSA-N 453.568 5.116 5 20 JKBD C[C@@H](Sc1nc2ccccc2n1C(F)F)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 25980826 OAMHHPJMWCTLFN-SECBINFHSA-N 460.384 5.478 5 20 JKBD COc1ccc(CCNC(=O)C/C(=C/c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)cc1 29561402 RMCBZDRGLREWGI-SILNSSARSA-N 473.554 5.503 5 20 JKBD C[C@H](Nc1cccc(COc2cccc(F)c2)c1)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 30449404 CFPZDVBDCJATFG-AWEZNQCLSA-N 477.414 5.771 5 20 JKBD CC(C)NC(=O)Nc1ccc(NC(=O)c2ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])cc2)cc1 31021369 GFMSDNJVAZGJNF-UHFFFAOYSA-N 468.897 5.823 5 20 JKBD CCN(CC)CCn1ccc2cc(NC(=O)Cn3c4ccccc4c(=O)c4ccccc43)ccc21 72050749 VDXPAUGJEWLYDX-UHFFFAOYSA-N 466.585 5.090 5 20 JKBD CC(C)[C@H](NC(=O)Cn1c2ccccc2c(=O)c2ccccc21)c1cccc(C(F)(F)F)c1 72081247 FHWZXKYIYXHJHU-DEOSSOPVSA-N 452.476 5.687 5 20 JKBD CCN(C(=O)Cc1ccc(NC(=O)[C@@H](C)Sc2ccc([N+](=O)[O-])cc2)cc1)c1ccccc1 108042438 LTADSSSUCOYPMH-GOSISDBHSA-N 463.559 5.310 5 20 JKBD COc1ccc(NC(=O)Cn2ccc3cc([N+](=O)[O-])ccc32)cc1NC(=O)c1ccc(Cl)cc1F 109319904 GGOMIUOVMLDGJV-UHFFFAOYSA-N 496.882 5.242 5 20 JKBD COc1ccc(CN(Cc2ccccc2)C(=O)C2CCN(c3ccccc3[N+](=O)[O-])CC2)cc1 491755472 BMMDETDWJKJTKH-UHFFFAOYSA-N 459.546 5.049 5 20 JKBD C[C@H](Sc1nnc(-c2ccc(F)cc2)c2ccccc12)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 501187028 OURWGLFUHTYHRC-AWEZNQCLSA-N 473.489 6.247 5 20 JKBD Cc1nc(NC(=O)c2ccc(N[C@H](C)c3ccccn3)c([N+](=O)[O-])c2)sc1Cc1cccc(F)c1 507421710 FQSPXDXSKOIYLQ-OAHLLOKOSA-N 491.548 5.910 5 20 JKBD O=[N+]([O-])c1cc(CNC2CCN(Cc3ccccn3)CC2)ccc1Oc1ccccc1Cl 509608786 NMEBTVIYSJTFSY-UHFFFAOYSA-N 452.942 5.190 5 20 JKBD C[C@@H](Nc1ccc(C(=O)N[C@H](c2ccc(F)cc2)c2cccs2)cc1[N+](=O)[O-])c1ccccn1 516162048 APGPYYSHDSAKAC-VOIUYBSRSA-N 476.533 5.883 5 20 JKBD C[C@@H]1C[C@@H](C)CN(c2ccc(C(=O)Nc3cc4c(cc3Cl)OCCCO4)cc2[N+](=O)[O-])C1 518124641 VWXRHXORAQAHJO-HUUCEWRRSA-N 459.930 5.144 5 20 JKBD COc1ccc(CNc2ccnn2Cc2ccc(C)s2)cc1OCc1ccc([N+](=O)[O-])cc1 520221155 SUNVQZIAZCZHPK-UHFFFAOYSA-N 464.547 5.409 5 20 JKBD C[C@H](NC(=O)C(=O)Nc1ccc(Oc2ccccc2C(F)(F)F)cc1)c1cccc([N+](=O)[O-])c1 520652382 WSXGISXYFPHMGO-AWEZNQCLSA-N 473.407 5.222 5 20 JKBD COc1cc(C(=O)NC[C@@H](c2ccccc2Cl)c2c[nH]c3ccccc23)c([N+](=O)[O-])cc1OC 603464071 HEMXEAWKUABFCV-SFHVURJKSA-N 479.920 5.309 5 20 JKBD Cc1ccccc1-n1ncc(C(=O)Nc2nc(-c3ccc(C)c([N+](=O)[O-])c3)cs2)c1C(F)(F)F 603567357 ACZVNBZTAVQTPR-UHFFFAOYSA-N 487.463 5.792 5 20 JKBD O=C(Nc1ccccc1SCC(F)(F)F)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-] 603734612 CITLBUADKYUBSS-UHFFFAOYSA-N 454.348 5.443 5 20 JKBD Cc1ccc(C(=O)N(Cc2ccccc2[N+](=O)[O-])CC(F)(F)F)cc1NC(=O)c1ccccc1F 603741238 LMFHOTLELSCMQI-UHFFFAOYSA-N 489.425 5.499 5 20 JKBD O=C(Nc1cnn(C[C@@H]2CCCO2)c1)c1cc([N+](=O)[O-])ccc1Sc1ccc(Cl)cc1 604097337 ICGCRGQIDYWCJG-KRWDZBQOSA-N 458.927 5.027 5 20 JKBD COc1cc2c(cc1OC)[C@H](c1cccs1)N(C(=O)N[C@@H](C)c1cccc([N+](=O)[O-])c1)CC2 604126284 LMOBZLHSDNQFRV-NPMXOYFQSA-N 467.547 5.092 5 20 JKBD O=C(c1cc2cc([N+](=O)[O-])ccc2o1)N1CCC[C@H](c2nc(-c3ccc(Cl)cc3)no2)C1 608817296 AQOBLHVUFPOPPA-AWEZNQCLSA-N 452.854 5.064 5 20 JKBD C[C@@H](NCc1ccc(-c2ccc([N+](=O)[O-])cc2Br)o1)c1cccc(N2CCCC2=O)c1 608836413 FQLCIRNBPHKPRU-OAHLLOKOSA-N 484.350 5.595 5 20 JKBD C[C@@H](c1cccc([N+](=O)[O-])c1)S(=O)(=O)Cc1csc(-c2ccc(C(F)(F)F)cc2)n1 609251490 GLQXOXYCOXJROU-LBPRGKRZSA-N 456.467 5.413 5 20 JKBD CCn1c(SCC(=O)N(CC2CC2)c2ccc(Cl)c([N+](=O)[O-])c2)nnc1-c1cccc(C)c1 728164877 ARYVQFSRQGUOGK-UHFFFAOYSA-N 485.997 5.370 5 20 JKBD COc1cc(C(=O)Nc2ccc(NC(=O)OC(C)(C)C)cc2C(F)(F)F)c([N+](=O)[O-])cc1OC 729658011 TUUBFBGFUHQMCZ-UHFFFAOYSA-N 485.415 5.230 5 20 JKBD O=C(OCc1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[C@@H](Oc1ccc(F)cc1Cl)c1ccccc1 730609324 DCIRWADFLOKCGA-NRFANRHFSA-N 483.839 5.301 5 20 JKBD CCOc1ccc(N(C(=O)COc2ccc([N+](=O)[O-])c(F)c2)c2nc3ccccc3s2)cc1 745739099 UCAWXTGIDOLPRW-UHFFFAOYSA-N 467.478 5.486 5 20 JKBD Cc1ccc(-c2noc([C@@H](C)OC(=O)c3csc(-c4cccc([N+](=O)[O-])c4)n3)n2)cc1F 747961622 GRRGTTOWZUZBOT-GFCCVEGCSA-N 454.439 5.134 5 20 JKBD Cc1ccc(-c2csc(NC(=O)c3ccc(CNC(=O)OC(C)(C)C)cc3)n2)cc1[N+](=O)[O-] 800593505 LAQHLAYJTSUTGG-UHFFFAOYSA-N 468.535 5.304 5 20 JKBD COc1c([N+](=O)[O-])cc(N[C@@H](C)c2nc3ccccc3n2C(F)F)c([N+](=O)[O-])c1Br 836459972 WNRZKWLOUVLPIE-QMMMGPOBSA-N 486.229 5.192 5 20 JKBD Cc1ccc(/C(O)=C(/C(=S)Nc2cccc(C(C)C)c2)[n+]2cccc(O)c2)cc1[N+](=O)[O-] 917614796 IPOZNGQPEMAFDB-UHFFFAOYSA-O 450.540 5.343 5 20 JKBD O=C(COC(=O)CCOc1ccccc1[N+](=O)[O-])Nc1c(Cl)c(Cl)cc(Cl)c1Cl 919491173 BTZRMGFSYFLCDB-UHFFFAOYSA-N 482.103 5.159 5 20 JKBD C[C@@H](OC(=O)[C@@H]1CCCN(C(=O)c2ccc(Cl)c(Cl)c2)C1)c1ccc([N+](=O)[O-])cc1 920157423 GOSIOYNOZVTWSG-CZUORRHYSA-N 451.306 5.058 5 20 JKBD C[C@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)O[C@H](C)C(=O)Nc1ccccc1-c1ccccc1 920777326 CHORTCDJJKOIRE-CVEARBPZSA-N 468.893 5.253 5 20 JKBD O=C(Nc1ccccc1C(=O)Nc1cccc(C(F)(F)F)c1)c1cc([N+](=O)[O-])ccc1Cl 920819616 DOUIQJZPPQLSSK-UHFFFAOYSA-N 463.799 5.772 5 20 JKBD CCOC(=O)c1c(NC(=O)/C=C\c2ccc([N+](=O)[O-])cc2)sc(C(=O)Nc2ccccc2)c1C 927209172 XZEAPSJOHDPMLM-KAMYIIQDSA-N 479.514 5.046 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)c3ccncc3-c3ccccc3)CCC2)cc1)c1ccc([N+](=O)[O-])o1 1785750140 VCZWXKUTPVRLGS-UHFFFAOYSA-N 482.496 5.311 5 20 JKBD CC(C)c1cc(C(=O)Nc2ccc(C3(NC(=O)Cc4ccc(Cl)cc4[N+](=O)[O-])CCC3)cc2)n[nH]1 1790126573 SRYYUYBJQIEMJF-UHFFFAOYSA-N 495.967 5.085 5 20 JKBD CC(C)[C@H](C(=O)Nc1cc([C@@H]2CCCCN2C(=O)/C=C/c2ccc([N+](=O)[O-])o2)[nH]n1)c1ccccc1 1814928139 BRZJAUZESZCRSH-SBNLUSQCSA-N 491.548 5.056 5 20 JKBD Cc1cc2[nH]c(C(=O)N3CCCC[C@H]3C3CCN(C(=O)c4cccc(F)c4[N+](=O)[O-])CC3)cc2s1 1830890283 SWABKKLHCMQSLN-NRFANRHFSA-N 498.580 5.132 5 20 JKBD C[C@H](C(=O)N1CCCC[C@H]1C1CCN(C(=O)CSc2ccccc2[N+](=O)[O-])CC1)c1ccccc1 1832897619 GJIKNMSIYIJZDX-REWPJTCUSA-N 495.645 5.110 5 20 JKBD C[C@H](OC(=O)c1ccccc1OCc1ccccc1)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl 10863954 QPKYDMAMUJVCML-HNNXBMFYSA-N 454.866 5.011 5 20 JKBD CC(C)c1ccc(CSc2nnc(SCC(=O)Nc3ccc([N+](=O)[O-])cc3Cl)s2)cc1 21462300 KDFYCDNWDJJKCW-UHFFFAOYSA-N 495.051 6.246 5 20 JKBD CCc1cccc(CC)c1-n1c(SCC(=O)Nc2ccccc2[N+](=O)[O-])nnc1-c1cccnc1 28388439 MWVLETCXLBMQIF-UHFFFAOYSA-N 488.573 5.093 5 20 JKBD C[C@H](NC(=O)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1)c1ccccc1OC(F)F 29138056 ALUSDGVRNMVFRV-ZDUSSCGKSA-N 487.425 5.309 5 20 JKBD O=C(Nc1ccccc1)c1nnc(/C(Cl)=C\c2ccc(-c3ccc([N+](=O)[O-])cc3Cl)o2)s1 210161053 UGUSGFSSBXINFD-GZTJUZNOSA-N 487.324 6.349 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)Nc2ccc(Oc3ccc(F)cc3)c3ccncc23)cc1SC 484395436 GIBNCTVHUOXEJB-UHFFFAOYSA-N 479.489 6.057 5 20 JKBD O=C1c2ccccc2N[C@@H](c2ccc(Oc3ccc(F)cc3)c([N+](=O)[O-])c2)N1Cc1cccnc1 489289144 NHYHXKMLQPOSHI-RUZDIDTESA-N 470.460 5.688 5 20 JKBD Cc1csc(Sc2ccc(C(=O)Nc3ccc(CS(=O)(=O)C(C)C)cc3)cc2[N+](=O)[O-])n1 497782725 LUBIPQXQROEBIZ-UHFFFAOYSA-N 491.616 5.086 5 20 JKBD CCN(c1ccc(C(=O)N(CCOC)c2nc(-c3ccc([N+](=O)[O-])cc3)cs2)cc1)C(C)C 499316316 NKLYWCULRRMLHA-UHFFFAOYSA-N 468.579 5.246 5 20 JKBD Cc1nc(C(F)(F)F)ccc1C(=O)N1CCN(Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)CC1 500737170 ABPGVSJCYUYHSR-UHFFFAOYSA-N 490.507 5.004 5 20 JKBD COc1ccc(CSCC(=O)N[C@H](C)c2sc(-c3ccc(C)cc3)nc2C)cc1[N+](=O)[O-] 502511658 MWMWFKDTARAFKI-OAHLLOKOSA-N 471.604 5.454 5 20 JKBD C[C@@H](Nc1ccc(C(=O)Nc2ccc(I)cc2)cc1[N+](=O)[O-])c1ccccn1 505995872 KZUXYRFQXOWLRD-CYBMUJFWSA-N 488.285 5.020 5 20 JKBD O=C(C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)NCCc1cn2c(n1)CCCC2 506844764 OLDOTYQMFVJGPD-XDJHFCHBSA-N 487.585 5.027 5 20 JKBD Cc1nnc(Sc2ccc(NC(=O)c3cc([N+](=O)[O-])ccc3Sc3ccccc3)c(C)c2)s1 509289625 NOFWIRXGSDKBGP-UHFFFAOYSA-N 494.623 6.618 5 20 JKBD O=C(Cn1c2ccccc2c(=O)c2ccccc21)Nc1c(-c2cccs2)nc2ccccn12 509835947 RVAKHRLPSZEDQR-UHFFFAOYSA-N 450.523 5.170 5 20 JKBD COc1ccc(NC(=O)c2cc(OCC(F)(F)F)ccc2[N+](=O)[O-])cc1Cc1ccccc1 512157058 AZMRVQCFVUCCCS-UHFFFAOYSA-N 460.408 5.388 5 20 JKBD COc1cc(C(=O)N[C@@H](c2ccc(F)cc2)C(C)(C)C)c([N+](=O)[O-])cc1OCc1cscn1 512177760 IBSSVSFEAYLCAG-NRFANRHFSA-N 473.526 5.295 5 20 JKBD C[C@@H](c1ccccc1)n1c(SCc2nc(-c3cccc([N+](=O)[O-])c3)no2)nc2ccccc2c1=O 514487733 IJOPAIWDZZXZNP-INIZCTEOSA-N 485.525 5.256 5 20 JKBD Cc1ccc(C(=O)N(C)c2ccc([N+](=O)[O-])cc2)cc1NC(=O)c1ccc(Br)cc1 515098226 VESCCMWYVLRXFC-UHFFFAOYSA-N 468.307 5.195 5 20 JKBD CCCCc1ccc([C@@H](NC(=O)C(=O)Nc2cccc([N+](=O)[O-])c2C)c2cccs2)cc1 515142683 KTIWWJXPEYLOEX-JOCHJYFZSA-N 451.548 5.152 5 20 JKBD C[C@H](NC(=O)C(=O)Nc1cc(Cl)ccc1Sc1ccccc1)c1cccc([N+](=O)[O-])c1 516049353 ZAEORUGSIIGNIB-AWEZNQCLSA-N 455.923 5.215 5 20 JKBD C[C@H](NCc1ccc(-c2ccccc2[N+](=O)[O-])s1)c1cc(F)ccc1N1CCN(C)CC1 520214581 LLQACRNSZSEBHS-KRWDZBQOSA-N 454.571 5.065 5 20 JKBD CCOc1cc(CNCc2ccccc2C)ccc1OCc1cc([N+](=O)[O-])cc2c1OCOC2 520955804 ULJTWKOGXPYGMC-UHFFFAOYSA-N 464.518 5.037 5 20 JKBD C[C@@H](Nc1ccc(C(=O)N2CCc3c(ccc(Cl)c3Cl)C2)cc1[N+](=O)[O-])c1ccccn1 523207494 IEBPBABSZKEIJW-CQSZACIVSA-N 471.344 5.668 5 20 JKBD CN(Cc1cccc(F)c1)C(=O)C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1 603469413 CKSMAHSKMLPLLX-UYRXBGFRSA-N 461.518 5.933 5 20 JKBD COc1ccc([N+](=O)[O-])cc1NC(=O)N(C)Cc1cn(-c2ccccc2)nc1-c1ccccc1 603642879 DHBBYWCHPJWXIK-UHFFFAOYSA-N 457.490 5.120 5 20 JKBD CSc1ccc([N+](=O)[O-])c(C(=O)Nc2ccc(NC(=O)c3ccoc3)cc2C(F)(F)F)c1 603762107 UOYNCOFQCUCXCK-UHFFFAOYSA-N 465.409 5.433 5 20 JKBD CC(=O)Nc1ccc(S[C@@H](C)C(=O)Nc2nc(-c3ccc(C)c([N+](=O)[O-])c3)cs2)cc1 603952165 HTXGEALDRVCGAJ-ZDUSSCGKSA-N 456.549 5.104 5 20 JKBD COc1cc(C(=O)Nc2nc(C)c(Cc3ccccc3)s2)c([N+](=O)[O-])cc1OCc1cscn1 604384818 CPPSZJVKTSPXCC-UHFFFAOYSA-N 496.570 5.247 5 20 JKBD CN(Cc1ccsc1)[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Br)c1ccccc1 604474904 ZVMAQUNJWBRNML-LJQANCHMSA-N 460.353 5.231 5 20 JKBD CC[C@@H](C(=O)N1CCC(NCc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)CC1)c1ccccc1 608837013 USKLQUWPJQXPMM-XMMPIXPASA-N 463.603 5.598 5 20 JKBD COc1cccc(Oc2ccc(NC(=O)Cn3c4ccccc4c(=O)c4ccccc43)cc2)c1 615116856 ARMZAFFZFINXMV-UHFFFAOYSA-N 450.494 5.594 5 20 JKBD CCc1cccc[n+]1/C(C(=S)Nc1ccccc1-c1ccccc1)=C(/O)c1ccc(C)c([N+](=O)[O-])c1 725764121 QULQUVZHVLSOSM-UHFFFAOYSA-O 496.612 6.743 5 20 JKBD Cc1ccc(/C(O)=C(/C(=S)N[C@H](C)c2cccs2)[n+]2ccc3c(c2)CCCC3)cc1[N+](=O)[O-] 726577858 BKKFBIAIWLKAKM-QGZVFWFLSA-O 480.635 5.693 5 20 JKBD Cn1ccnc1-c1cccc(NC(=O)c2ccccc2NC(=O)c2ccc([N+](=O)[O-])cc2Cl)c1 727799099 KJNUBUUDCGDHTA-UHFFFAOYSA-N 475.892 5.153 5 20 JKBD C[C@H](Oc1ccccc1Cc1ccccc1)C(=O)O[C@H](C)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 728352027 WGAGZJDOOHGLNN-MSOLQXFVSA-N 473.485 5.307 5 20 JKBD CCCOc1nc2ccccc2cc1/C=C/C(=O)O[C@H](C)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 746114866 XZJFTGMWHGLPNF-QSOAKEGCSA-N 474.473 5.299 5 20 JKBD CC(C)(C)c1ccc(C(=O)Nc2ccccc2NC(=O)c2cc([N+](=O)[O-])ccc2Br)cc1 751088768 GAWISXXUWAGHDI-UHFFFAOYSA-N 496.361 6.159 5 20 JKBD O=C(c1ccc(NCc2ccccc2Cl)c([N+](=O)[O-])c1)N(CC(F)(F)F)c1ccccn1 751107138 JLECVGZZTGMUDP-UHFFFAOYSA-N 464.831 5.464 5 20 JKBD O=[N+]([O-])c1ccc(I)c(-c2nc(-c3ccc(Oc4ccccc4)nc3)no2)c1 904448044 SKFJJPRYGBNRBV-UHFFFAOYSA-N 486.225 5.104 5 20 JKBD O=C1/C(=C/c2ccc(-c3ccc([N+](=O)[O-])cc3Cl)o2)c2ccccc2C(=O)N1Cc1ccccn1 915852994 XKJGWCCPWQCQOS-HYARGMPZSA-N 485.883 5.626 5 20 JKBD Cc1cc(C)c2cc(C(=O)O[C@@H](C)C(=O)Nc3ccc([N+](=O)[O-])cc3C(F)(F)F)sc2n1 917351429 VBCWGOGSEHYNTA-NSHDSACASA-N 467.425 5.024 5 20 JKBD CC(=O)Nc1ccc(S[C@H](C)C(=O)Nc2cc(Cl)c([N+](=O)[O-])cc2OCc2ccccc2)cc1 917610850 XBTPHXZHKVQZKF-OAHLLOKOSA-N 499.976 5.905 5 20 JKBD Cc1ccc2c(COC(=O)c3ccc(N[C@H](C)c4ccccn4)c([N+](=O)[O-])c3)cc(=O)oc2c1C 920543759 AKCWNZDUFMLMQL-QGZVFWFLSA-N 473.485 5.243 5 20 JKBD COc1ccc(-c2nc(COC(=O)c3ccc(N[C@@H](C)c4ccccn4)c([N+](=O)[O-])c3)co2)cc1 920548776 SKNAGEWKCSMAFL-INIZCTEOSA-N 474.473 5.184 5 20 JKBD C[C@H]1CCC[C@H]1C(=O)NC1(c2ccc(NC(=O)Cn3ccc4ccc([N+](=O)[O-])cc43)cc2)CCC1 1786277838 WWQHDBYTJWULJW-FDDCHVKYSA-N 474.561 5.120 5 20 JKBD O=C(CCc1ccc[nH]1)Nc1ccc(C2(NC(=O)C3(c4cccc([N+](=O)[O-])c4)CCC3)CCC2)cc1 1788191617 ODSRRJQWGNVYJA-UHFFFAOYSA-N 486.572 5.112 5 20 JKBD O=C(NC1(c2ccc(NC(=O)c3nc[nH]c3[N+](=O)[O-])cc2)CCC1)c1ccc(-c2ccccc2)cc1 1788612947 DHVJMHDSGMSNMS-UHFFFAOYSA-N 481.512 5.046 5 20 JKBD Cc1ccc(SCC(=O)Nc2ccc(C3(NC(=O)c4cc(C)c([N+](=O)[O-])cn4)CCC3)cc2)cc1 1789107962 HFADFQXVEXRCSZ-UHFFFAOYSA-N 490.585 5.147 5 20 JKBD CC1=CC[C@H](C(=O)Nc2ccc(C3(NC(=O)c4cc(N(C)C)ccc4[N+](=O)[O-])CCC3)cc2)CC1 1789115638 ZZJGFFPLOMWRGH-IBGZPJMESA-N 476.577 5.155 5 20 JKBD Cc1cc(CC(=O)NC2(c3ccc(NC(=O)c4cc5cc([N+](=O)[O-])ccc5s4)cc3)CCC2)on1 1791010969 LHKHQRKOOWWYPM-UHFFFAOYSA-N 490.541 5.096 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)c3ccc([N+](=O)[O-])o3)CCC2)cc1)c1ccc(F)c(C(F)(F)F)c1 1792171469 OUZOGXOTTKZOEU-UHFFFAOYSA-N 491.397 5.407 5 20 JKBD Cc1c(Cl)ccc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)CCc2cccc([N+](=O)[O-])c2)c1Cl 1793945094 GMFBPKXMIBJCAK-BCDXTJNWSA-N 490.387 5.095 5 20 JKBD CC[C@H](C)[C@H](C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1c(F)ccc([N+](=O)[O-])c1C)C2)c1ccccc1 1795575135 WIGHSKSYTGXHOQ-YPEAGQFRSA-N 481.568 5.124 5 20 JKBD O=C(Nc1cc([C@H]2CCCCN2C(=O)CCc2ccccc2Cl)[nH]n1)c1cc(F)cc([N+](=O)[O-])c1 1821165180 HCZQSLPGBYWCTI-OAQYLSRUSA-N 499.930 5.049 5 20 JKBD C[C@H](OC(=O)CSc1ccc([N+](=O)[O-])cc1)c1nc(-c2cccc(C(F)(F)F)c2)no1 11647780 KYGRUGNSSZRCQT-NSHDSACASA-N 453.398 5.060 5 20 JKBD Cc1csc(N(C(=O)C2CCN(c3ccc(C(F)(F)F)cc3[N+](=O)[O-])CC2)c2ccccc2)n1 24007130 CWZUJFGJAVXAFX-UHFFFAOYSA-N 490.507 5.960 5 20 JKBD c1ccc2c(c1)nc(CSc1nnc(-c3c[nH]c4ccccc34)n1C[C@H]1CCCO1)c1ccccc12 26042309 QQJKMAUJIYZMRA-LJQANCHMSA-N 491.620 6.599 5 20 JKBD COc1ccc(-c2cc3[nH]c(/C(Cl)=C/c4ccc(O)c([N+](=O)[O-])c4)nc(=O)c3s2)cc1 28621560 ZODSIGAWSBZRLH-ZSOIEALJSA-N 455.879 5.011 5 20 JKBD O=[N+]([O-])c1cccc(-c2noc(CSc3nnc(-c4cccs4)n3-c3ccccc3)n2)c1 31841092 RLKQTXDZHDAETB-UHFFFAOYSA-N 462.516 5.246 5 20 JKBD O=C(/C=C/c1ccc([N+](=O)[O-])cc1)Nc1ccc(NC(=O)c2ccc(F)cc2)cc1C(F)(F)F 71919400 JALREFQYSWYLFO-KGVSQERTSA-N 473.382 5.657 5 20 JKBD CCCN(C(=O)c1ccc(N[C@@H](C)c2ccccn2)c([N+](=O)[O-])c1)[C@@H](C)C(=O)Nc1ccccc1 109891213 AKUGTTUTOPEOCC-OALUTQOASA-N 475.549 5.042 5 20 JKBD CCn1c(S[C@@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)nc2cc3ccccc3cc2c1=O 115200003 PWMKDMMVFFYTIP-AWEZNQCLSA-N 473.514 5.381 5 20 JKBD CC[C@H](NC(=O)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])c(OC)c1)c1nc(C)cs1 303183605 DJPDYKWJTLDWFH-HNNXBMFYSA-N 461.927 5.695 5 20 JKBD CC(=O)NCC1CCN(C(=O)c2c3c(nc4ccccc24)/C(=C\c2cccc([N+](=O)[O-])c2)CCC3)CC1 483132996 YINQEAKGJJLFLN-JWGURIENSA-N 498.583 5.008 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)Nc2cc(CC(C)(C)C)nn2-c2ccccc2)cc1SC 483498156 KLNAIWPOVLKNLU-UHFFFAOYSA-N 454.552 5.352 5 20 JKBD O=C(c1cc(Cl)ccc1Br)N(Cc1ccccc1[N+](=O)[O-])CC(F)(F)F 486067447 HCLKSOINNZWGEV-UHFFFAOYSA-N 451.626 5.215 5 20 JKBD CCc1ccc(-c2nc(CC(=O)N(Cc3ccccc3[N+](=O)[O-])CC(F)(F)F)cs2)cc1 486138082 YLCITGQADYPNBE-UHFFFAOYSA-N 463.481 5.414 5 20 JKBD O=C(NCc1ccc(NC(=O)c2ccc([N+](=O)[O-])cc2Cl)cc1)c1ccc(Br)cc1 502493464 IAPJPHLOFMQMJE-UHFFFAOYSA-N 488.725 5.193 5 20 JKBD C[C@@H](NC(=O)c1ccc(Sc2nc3ccccc3s2)c([N+](=O)[O-])c1)c1nnc2n1CCCCC2 502798436 KIKHGJRHGJFBGC-CQSZACIVSA-N 494.602 5.165 5 20 JKBD CCOc1cccc2cc([C@@H](C)NC(=O)c3ccc(Cn4nc(C)c([N+](=O)[O-])c4C)cc3)oc12 503159724 KXTGDSLTTKIKHJ-OAHLLOKOSA-N 462.506 5.092 5 20 JKBD C[C@@H](Nc1ccc(C(=O)NCc2ccc(OCC(F)(F)F)cc2)cc1[N+](=O)[O-])c1ccccn1 507155167 MYZUFXITPYQRQH-OAHLLOKOSA-N 474.439 5.034 5 20 JKBD Cc1sc(CNC(=O)Cn2c3ccccc3c(=O)c3ccccc32)nc1-c1ccc(Cl)cc1 507874852 NZLHFPOTGNNSJV-UHFFFAOYSA-N 473.985 5.556 5 20 JKBD COc1cc([C@@H](C)NCc2ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])cc2)cc(OC)c1OC 508104527 RDOGGJQCCFILHP-OAHLLOKOSA-N 472.925 5.917 5 20 JKBD CCOc1cc(CN[C@H]2CC(C)(C)Cc3oc(C)cc32)ccc1OCCn1c([N+](=O)[O-])cnc1C 509570340 HRUQGWRSSHNLLT-NRFANRHFSA-N 482.581 5.282 5 20 JKBD COc1cc(C(=O)Nc2ccccc2Cc2ccccc2)c([N+](=O)[O-])cc1OCc1cscn1 512399290 INIBZWXJLSVDBP-UHFFFAOYSA-N 475.526 5.482 5 20 JKBD CC(C)CCN(Cc1ccc(Cl)c(Cl)c1)C(=O)c1ccc(-n2cncn2)c([N+](=O)[O-])c1 515738521 IDDCVFOLGOANPJ-UHFFFAOYSA-N 462.337 5.171 5 20 JKBD COc1cccc(C[C@@H]2CCCN2C(=O)c2ccc(Sc3nc(C)cs3)c([N+](=O)[O-])c2)c1 516528218 NAIYBWWDLKJDRZ-SFHVURJKSA-N 469.588 5.367 5 20 JKBD COc1ccc([C@@H](C)N[C@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Br)c2ccccc2)cc1 521153043 JPJAUBQVIDNSQB-QRQCRPRQSA-N 484.350 5.397 5 20 JKBD Cc1ccc(-c2ccncc2)cc1NC(=O)c1ccc(N[C@H](C)c2ccccn2)c([N+](=O)[O-])c1 522395130 RXWYVUABAZCKBQ-GOSISDBHSA-N 453.502 5.786 5 20 JKBD CCOc1cc(NC(=O)NCc2ccc(Oc3cccc(F)c3)nc2)c([N+](=O)[O-])cc1OCC 523350275 VBWGVLBRLSZDMA-UHFFFAOYSA-N 470.457 5.040 5 20 JKBD O=C(Nc1ccc(Oc2ccnc3cc(Cl)ccc23)c(F)c1)c1cc2c(cc1[N+](=O)[O-])OCO2 524390452 MBOSAGXYRLDREI-UHFFFAOYSA-N 481.823 5.709 5 20 JKBD COC(=O)C1CCN(C(=O)c2c3c(nc4ccccc24)/C(=C\c2cccc([N+](=O)[O-])c2)CCC3)CC1 590851446 MRZOMBDLJRCSRI-SILNSSARSA-N 485.540 5.045 5 20 JKBD Cc1nn(Cc2ccc(C(=O)Nc3cccc(-c4nnc5n4CCCCC5)c3C)cc2)c(C)c1[N+](=O)[O-] 603962440 XUCQRXOMKZTUIG-UHFFFAOYSA-N 499.575 5.002 5 20 JKBD Cc1cc(NC(=O)c2ccc(F)cc2Cl)sc1C(=O)Nc1ccc([N+](=O)[O-])c(Cl)c1 727710483 VETHEAFJWVGDDA-UHFFFAOYSA-N 468.293 5.915 5 20 JKBD C[C@H](OC(=O)C[C@H](c1ccccc1)C(F)(F)F)C(=O)Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1 728655021 TXPVOLWFQJWZJN-SUMWQHHRSA-N 493.463 5.325 5 20 JKBD Cc1nc(CSc2ccccc2C(=O)OC[C@@H]2CCCN2C(=O)c2ccccc2[N+](=O)[O-])cs1 730703223 HRHDKHQMZURBNW-SFHVURJKSA-N 497.598 5.114 5 20 JKBD C[C@@H](OC(=O)c1csc(-c2ccc([N+](=O)[O-])cc2)n1)C(=O)NC(c1ccccc1)c1ccccc1 747958640 QPUCVJLIAJQVEQ-QGZVFWFLSA-N 487.537 5.169 5 20 JKBD Cc1nc(NC(=O)c2cc([N+](=O)[O-])ccc2Br)sc1Cc1cccc(Cl)c1 751093776 ROSGRNPLUJNMPW-UHFFFAOYSA-N 466.744 5.619 5 20 JKBD CC(C)N(C(=O)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1)c1ccc(N2CCOCC2)cc1 751180871 KWANWIAALHCERJ-UHFFFAOYSA-N 495.963 5.932 5 20 JKBD CC(C)n1ncc2cc(C(=O)O[C@H](C(=O)Nc3ccc(Cl)c([N+](=O)[O-])c3)c3ccccc3)cnc21 811623373 JGMFGURQKQQMOG-NRFANRHFSA-N 493.907 5.111 5 20 JKBD C[C@H](Sc1nnc(-c2ccncc2)n1Cc1ccccc1)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl 843536939 MBEIVGMJGKDABG-HNNXBMFYSA-N 494.964 5.069 5 20 JKBD COc1cc(C(=O)Oc2cc(Cl)cc(Cl)c2)c([N+](=O)[O-])cc1OCc1cscn1 919984930 PRPFFYYBSBOIFE-UHFFFAOYSA-N 455.275 5.165 5 20 JKBD O=C(Cc1ccc(Cl)cc1[N+](=O)[O-])Nc1ccc(C2(NC(=O)[C@@H]3CCCSC3)CCC2)cc1 1786115908 LHQRMKXXCBUQDX-QGZVFWFLSA-N 488.009 5.068 5 20 JKBD O=C(/C=C/c1ccc([N+](=O)[O-])o1)Nc1ccc(C2(NC(=O)[C@@H]3C[C@@H]3c3ccccc3)CCC2)cc1 1786208075 IZZVGPNHOXJWBY-RMGDVBNVSA-N 471.513 5.139 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)c3ccc4scnc4c3)CCC2)cc1)c1cc(F)cc([N+](=O)[O-])c1 1790697905 YAXDORUGYIBSFC-UHFFFAOYSA-N 490.516 5.405 5 20 JKBD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CCC1CCCC1)c1cc2cc([N+](=O)[O-])ccc2s1 1795419429 UTHLPAUAAXHWMB-REPLKXPHSA-N 455.580 5.032 5 20 JKBD Cc1cccc(Cl)c1C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2ccc([N+](=O)[O-])cc2F)n[nH]1 1821052461 LJQZTFAJQBENNB-IBGZPJMESA-N 485.903 5.039 5 20 JKBD O=C(c1cccc(F)c1[N+](=O)[O-])N1CCC([C@H]2CCCCN2C(=O)c2cc3ccoc3s2)CC1 1827413702 OOWQROZKPAXKSB-LJQANCHMSA-N 485.537 5.089 5 20 JKBD Cc1ccc(C(=O)N2CCC([C@@H]3CCCCN3C(=O)c3ccc([N+](=O)[O-])cc3F)CC2)cc1Cl 1830493606 XXLQXUGZKNZIDM-QHCPKHFHSA-N 487.959 5.243 5 20 JKBD COc1ccc(OC)c(NC(=O)[C@@H](C)Sc2nc3ccccc3c3nc4ccccc4n23)c1 8760712 DUPYNNCSWBPRED-OAHLLOKOSA-N 458.543 5.172 5 20 JKBD O=C(c1ccc(NS(=O)(=O)c2ccc(Cl)c([N+](=O)[O-])c2)cc1)N1CCC[C@H]1c1ccccc1 9894955 GCMNHRITTDCIBQ-NRFANRHFSA-N 485.949 5.026 5 20 JKBD CC(=O)N(c1nc(COC(=O)/C=C/c2ccc([N+](=O)[O-])cc2)cs1)c1c(C)cc(C)cc1C 10757912 RAIUSJXUZGBWNP-JXMROGBWSA-N 465.531 5.418 5 20 JKBD Cn1c(SCc2nc(-c3ccc(C(F)(F)F)cc3)no2)nc2cc3ccccc3cc2c1=O 25618967 WZWIRJTZTRTGKM-UHFFFAOYSA-N 468.460 5.448 5 20 JKBD Cc1c(NC(=O)[C@H](C)Sc2ncc(-c3ccccc3)n2C[C@H]2CCCO2)cccc1[N+](=O)[O-] 28752011 MMTIRXRNOJFRJR-PKOBYXMFSA-N 466.563 5.065 5 20 JKBD Cc1c(NC(=O)[C@@H](C)SCc2nc(=O)c3c(-c4ccccc4)csc3[nH]2)cccc1[N+](=O)[O-] 30057797 GGBPYZZRRSUBDV-CQSZACIVSA-N 480.571 5.129 5 20 JKBD Cc1c(C(=O)Nc2nc(-c3cc(Cl)sc3Cl)cs2)nnn1-c1cccc([N+](=O)[O-])c1 31889559 NIZNQKRYBAFDEL-UHFFFAOYSA-N 481.346 5.228 5 20 JKBD C[C@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)N[C@H](C)c1ccc(NC(=O)c2ccc(F)cc2)cc1 71988246 QJFVBXCEIUFAIQ-CVEARBPZSA-N 467.522 5.344 5 20 JKBD CC[C@@H](NC(=O)c1ccc(N[C@@H](C)c2ccccn2)c([N+](=O)[O-])c1)c1ccccc1OC(F)F 108779491 BCHYMMUUFLXCLZ-MAUKXSAKSA-N 470.476 5.645 5 20 JKBD CCC(C)(C)NC(=O)c1ccc(NC(=O)c2ccc(N[C@@H](C)c3ccccn3)c([N+](=O)[O-])c2)cc1 108883030 SLJGSZHQXAYJCJ-KRWDZBQOSA-N 475.549 5.334 5 20 JKBD O=C(/C=C\c1cnc2ccccc2n1)O[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1 207447259 DGAIXJKQJUIYKU-VGLXENQISA-N 488.887 5.128 5 20 JKBD Cc1cc(O[C@@H](C)c2ccccc2)ccc1NC(=O)C1CCN(c2ccccc2[N+](=O)[O-])CC1 303187941 LXPULOGNFOXRQD-FQEVSTJZSA-N 459.546 5.898 5 20 JKBD NC(=O)[C@@H](Sc1nc2ccccc2c2nc3ccccc3n12)c1ccc(Br)cc1 303256245 GUWHODRDGSRZRU-IBGZPJMESA-N 463.360 5.117 5 20 JKBD O=C(NCCOc1ccccc1-c1ccccc1)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-] 501697097 JYMGLIXCPFWKFP-UHFFFAOYSA-N 460.408 5.012 5 20 JKBD COc1ccc(CCNC(=O)c2cc([N+](=O)[O-])ccc2Sc2ccccc2)cc1OC(F)F 506337697 HMAMQGKFDNUTNQ-UHFFFAOYSA-N 474.485 5.329 5 20 JKBD C[C@@H](Nc1cccc(NC(=O)c2ccccc2)c1)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 511022092 LLICRFYXOMJJMX-CQSZACIVSA-N 472.423 5.305 5 20 JKBD Cc1ccc(C(=O)Nc2cccc(C(F)(F)F)c2)cc1NC(=O)NCc1ccccc1[N+](=O)[O-] 520451844 YHYQRDWEHMFJCL-UHFFFAOYSA-N 472.423 5.496 5 20 JKBD COc1cc(C(=O)Nc2cc(CC(C)(C)C)nn2-c2ccccc2)c([N+](=O)[O-])cc1OC(F)F 522213146 VFAUFRIVIRRSBV-UHFFFAOYSA-N 474.464 5.231 5 20 JKBD CC1CCN(c2ccc(C(=O)N[C@H](C)c3nc4ccccc4n3C(F)F)cc2[N+](=O)[O-])CC1 590478048 KHYJOMTYOFXEJE-OAHLLOKOSA-N 457.481 5.067 5 20 JKBD CC(=O)Nc1cccc([C@H](C)N(Cc2ccccc2)C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)c1 591353865 MLLZPOJXPGGKIN-KRWDZBQOSA-N 473.554 6.172 5 20 JKBD O=C(NCc1cccc(C(F)(F)F)c1)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 603460832 AOUSJNXGBJHAPS-UHFFFAOYSA-N 475.389 5.165 5 20 JKBD O=C(CCS(=O)(=O)C1CCCC1)Nc1cc([N+](=O)[O-])ccc1Nc1cccc(C(F)(F)F)c1 603731025 SRWNNOFTZJDWQT-UHFFFAOYSA-N 485.484 5.043 5 20 JKBD COc1cc(C(=O)N2CCO[C@H](c3ccccc3F)C2)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 608963603 UNAXQLWTICLSRU-QHCPKHFHSA-N 486.883 5.402 5 20 JKBD COc1ccc(NC(=O)c2ccc(-n3ccnc3)c([N+](=O)[O-])c2)cc1OCc1ccc2ccccc2n1 609067175 ZZOHNOLCIOMWLD-UHFFFAOYSA-N 495.495 5.169 5 20 JKBD C[C@H](NCc1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1)c1cccc(NS(C)(=O)=O)c1 725849068 FZARMHKFPUPSMR-HNNXBMFYSA-N 475.954 5.263 5 20 JKBD Cc1ccc(Br)cc1NC(=O)CNCc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1 726605603 GGZWHIFBNNWXFR-UHFFFAOYSA-N 478.730 5.307 5 20 JKBD COc1ccc(-c2cnc(CCC(=O)N(CC3CC3)c3ccc(Cl)c([N+](=O)[O-])c3)o2)cc1 728165031 GUJWYWJFFBVDEZ-UHFFFAOYSA-N 455.898 5.288 5 20 JKBD Cc1ccc(-c2nc(C)c(C(=O)OCc3nnc(-c4ccc([N+](=O)[O-])cc4)o3)s2)c(C)c1 746597170 MFTCBLKLNZHCOI-UHFFFAOYSA-N 450.476 5.051 5 20 JKBD Cc1sc2nc([C@H](C)OC(=O)c3ccc(N4CCC(C)CC4)c([N+](=O)[O-])c3)nc(O)c2c1C 783322691 GABYWYBKBFQUPB-AWEZNQCLSA-N 470.551 5.076 5 20 JKBD Cc1ccccc1-c1noc(COc2ccc3c(-c4ccc([N+](=O)[O-])cc4)cc(=O)oc3c2)n1 850697772 ZRPOXWGXUZEAFG-UHFFFAOYSA-N 455.426 5.306 5 20 JKBD Cc1c(C(=O)N(Cc2nnc(-c3cccc([N+](=O)[O-])c3)o2)C(C)C)oc2ccc(Br)cc12 864242810 RTTJEKAKICBVBM-UHFFFAOYSA-N 499.321 5.513 5 20 JKBD O=C(Nc1ccc(OC(=O)c2ccccc2SCc2cscn2)cc1)c1cccc([N+](=O)[O-])c1 879460264 ZRIXAWQMYILLEA-UHFFFAOYSA-N 491.550 5.815 5 20 JKBD COc1ccc(CSC2=N/C(=C/c3ccccc3)C(=O)N2c2ccc(F)cc2)cc1[N+](=O)[O-] 915792083 KUIDSPBCAVYVPZ-DEDYPNTBSA-N 463.490 5.420 5 20 JKBD O=C(Nc1cc([N+](=O)[O-])c(F)cc1F)c1cccnc1Oc1ccc(F)cc1Br 916135315 QILWHMGOOHNORE-UHFFFAOYSA-N 468.185 5.214 5 20 JKBD COC(=O)Nc1cccc(NC(=O)C/C(=C/c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)c1 917706487 OPYBBVQJEVKUPM-LGMDPLHJSA-N 488.525 5.952 5 20 JKBD O=C(Nc1ccc(-c2ccccc2)cc1F)c1cc([N+](=O)[O-])ccc1I 918563727 ZKQLONXCCUUXGZ-UHFFFAOYSA-N 462.218 5.258 5 20 JKBD Cc1noc([C@H](C)OC(=O)C/C(=C\c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)n1 926630694 IBUHRWWCNIARPW-XDUBLRSXSA-N 450.476 5.131 5 20 JKBD O=C(NC1(c2ccc(NC(=O)c3ccc([N+](=O)[O-])o3)cc2)CCC1)c1ccc(OCC2CC2)c(F)c1 1785752253 BJARPRVCIYMAFP-UHFFFAOYSA-N 493.491 5.177 5 20 JKBD CC(C)c1nc(C(=O)Nc2ccc(C3(NC(=O)Cc4ccc(Cl)cc4[N+](=O)[O-])CCC3)cc2)co1 1787025198 SBVCWJVPAPBERL-UHFFFAOYSA-N 496.951 5.350 5 20 JKBD Cc1cnc(Cl)c(C(=O)Nc2ccc(C3(NC(=O)c4cc(F)cc([N+](=O)[O-])c4)CCC3)cc2)c1 1787568334 OUBQJCZYEMPYPV-UHFFFAOYSA-N 482.899 5.152 5 20 JKBD O=C(Cc1cccc([N+](=O)[O-])c1)NC1(c2ccc(NC(=O)C3(C(F)(F)F)CCC3)cc2)CCC1 1787936401 HCYXLNCJUPWPQS-UHFFFAOYSA-N 475.467 5.004 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)c3ccc([N+](=O)[O-])cc3F)CCC2)cc1)c1cc2cccnc2s1 1788971322 LOPOSQFAYIVACS-UHFFFAOYSA-N 490.516 5.405 5 20 JKBD Cc1cc(O)c([N+](=O)[O-])cc1C(=O)Nc1ccc(C2(NC(=O)c3cc4ccccc4o3)CCC2)cc1 1790805710 AXUXHOQHSHTLOD-UHFFFAOYSA-N 485.496 5.417 5 20 JKBD O=C(/C=C/c1ccccc1[N+](=O)[O-])NC1(c2ccc(NC(=O)c3cc4ccoc4cn3)cc2)CCC1 1790833553 IXSDCBJYNJPBFA-IZZDOVSWSA-N 482.496 5.197 5 20 JKBD O=C(NC1(c2ccc(NC(=O)c3c[nH]c4c(Cl)cccc34)cc2)CCC1)c1ccc([N+](=O)[O-])[nH]1 1790959143 SHRMALXGOYABAF-UHFFFAOYSA-N 477.908 5.119 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)NC1(c2ccc(NC(=O)[C@H](C)Cc3ccccn3)cc2)CCC1 1791767589 OENVOYXYZZYNIA-QGZVFWFLSA-N 490.535 5.064 5 20 JKBD O=C(NC1(c2ccc(NC(=O)c3ccc(C(F)(F)F)cc3F)cc2)CCC1)c1ccc([N+](=O)[O-])[nH]1 1792171714 YFUJVCBIYRUKRN-UHFFFAOYSA-N 490.413 5.142 5 20 JKBD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(Cl)cc1F)c1cc2cc([N+](=O)[O-])ccc2s1 1792725847 YANCIJQSIYZXNT-MUJYYYPQSA-N 487.940 5.168 5 20 JKBD O=C(/C=C/c1ccccc1[N+](=O)[O-])N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(Cl)c(F)c(Cl)c1 1800708800 HPGWEGHGUIFNBZ-ORIYUZMUSA-N 492.334 5.006 5 20 JKBD O=C(NC[C@@H]1CCN(C(=O)C2CCCCC2)[C@H]1c1cccnc1)c1cc2cc([N+](=O)[O-])ccc2s1 1812304764 SDHVHDCNBGGPRD-CYFREDJKSA-N 492.601 5.104 5 20 JKBD CC(C)(C)CCCCCC(=O)NC[C@@H]1CCN(C(=O)c2cc(F)cc([N+](=O)[O-])c2)[C@@H]1c1cccnc1 1812808292 GNTCMAYFKFEWDI-NBGIEHNGSA-N 498.599 5.445 5 20 JKBD Cc1ccc(C(=O)Nc2cc([C@H]3CCCCN3C(=O)c3ccc([N+](=O)[O-])cc3F)[nH]n2)cc1Cl 1814590379 DMERNCYNVUNTJU-HXUWFJFHSA-N 485.903 5.039 5 20 JKBD O=C(Nc1cc([C@H]2CCCCN2C(=O)CCc2cccc([N+](=O)[O-])c2)[nH]n1)c1cccc2ccccc12 1818451068 SKTLPPSMTYUIGS-RUZDIDTESA-N 497.555 5.410 5 20 JKBD O=C(CSc1ccccc1[N+](=O)[O-])N1CCC([C@@H]2CCCCN2C(=O)/C=C/c2ccsc2)CC1 1825302767 OQYMAIAAOWCOQX-SHBDEGQCSA-N 499.658 5.082 5 20 JKBD O=C(/C=C/c1ccccc1[N+](=O)[O-])N1CCC([C@@H]2CCCCN2C(=O)c2ccccc2Cl)CC1 1829896124 HVRQTMWLTFAGTF-OTOIZHKDSA-N 481.980 5.195 5 20 JKBD O=C(c1cccc(Cl)c1)N1CCC([C@H]2CCCCN2C(=O)/C=C/c2ccccc2[N+](=O)[O-])CC1 1832904624 OGCWAWJIKMVTKF-HRBBJJPOSA-N 481.980 5.195 5 20 JKBD C[C@H]1CCC[C@H](C)N1C(=O)COc1ccc(C(=O)Nc2nc(-c3cccc([N+](=O)[O-])c3)cs2)cc1 14376799 RMFCRIMDKLVQCW-IRXDYDNUSA-N 494.573 5.139 5 20 JKBD C[C@H](OC(=O)c1ccc(NCc2ccccc2)c([N+](=O)[O-])c1)C(=O)Nc1ccccc1Cl 16748739 LIDUEJKSDIGPDO-HNNXBMFYSA-N 453.882 5.044 5 20 JKBD Cc1c(NC(=O)[C@@H](C)Sc2nnc(-c3cccs3)n2Cc2ccccc2)cccc1[N+](=O)[O-] 21642326 UAKODOARCGQDHB-MRXNPFEDSA-N 479.587 5.391 5 20 JKBD Cc1occc1-c1nnc(SCc2nc(-c3cccc([N+](=O)[O-])c3)no2)n1-c1ccccc1 31844024 KOEOQSQGDBJOSL-UHFFFAOYSA-N 460.475 5.086 5 20 JKBD CCOc1cc(C(=O)Nc2cc(-c3cccc(C)c3)nn2Cc2ccccc2)c([N+](=O)[O-])cc1OC 219248693 WPYHRJWPRJCRDP-UHFFFAOYSA-N 486.528 5.475 5 20 JKBD Cc1ccc(C(=O)Nc2nc(-c3ccc(C)c([N+](=O)[O-])c3)cs2)cc1NC(=O)c1ccco1 302921384 MJGMFSUFWPEFNE-UHFFFAOYSA-N 462.487 5.433 5 20 JKBD C[C@H](NC(=O)c1cc([N+](=O)[O-])ccc1Sc1ccc(Cl)cc1)c1ccc(NC(N)=O)cc1 480218016 OKYJEHYOWUIRLC-ZDUSSCGKSA-N 470.938 5.381 5 20 JKBD COc1cc(C(=O)Nc2ccc(F)cc2-c2ccc(Cl)cc2)c([N+](=O)[O-])cc1OC(F)F 485677229 LCWXRTZAKZVBKH-UHFFFAOYSA-N 466.799 5.917 5 20 JKBD O=C(c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1)N1CCCN(C(=O)c2ccsc2)CC1 490692803 FDJFGEUZLGGARO-UHFFFAOYSA-N 485.949 5.090 5 20 JKBD Cn1cc(C(=O)Nc2ccc(NCc3ccccc3)c(Cl)c2)c(-c2ccc([N+](=O)[O-])cc2)n1 497527486 YDXWKNOZOWWXEO-UHFFFAOYSA-N 461.909 5.513 5 20 JKBD CN(C(=O)Cn1c2ccccc2c(=O)c2ccccc21)[C@H]1CCSc2ccc(Br)cc21 504579526 MYNDGFRTWLNLKO-FQEVSTJZSA-N 493.426 5.613 5 20 JKBD O=C(c1c2c(nc3ccccc13)/C(=C\c1cccc([N+](=O)[O-])c1)CCC2)N1CCCn2nccc21 509203457 QATAUFBYNWUTDK-MNDPQUGUSA-N 465.513 5.267 5 20 JKBD CCCN(C(=O)c1cc(OC)c(OCc2cscn2)cc1[N+](=O)[O-])[C@H]1CCc2ccccc21 512404178 QVLIWWIRVFXEGP-FQEVSTJZSA-N 467.547 5.179 5 20 JKBD Cc1[nH]nc(C(=O)NC[C@H](c2ccccc2)c2c(-c3ccccc3)[nH]c3ccccc23)c1[N+](=O)[O-] 522222745 JSCDEYMBNSUPTI-OAQYLSRUSA-N 465.513 5.337 5 20 JKBD O=C1c2ccccc2N[C@H](c2csc(-c3cccc([N+](=O)[O-])c3)n2)N1c1ccc2c(c1)OCCO2 602759476 KWZPEJLDWGYEMJ-QHCPKHFHSA-N 486.509 5.261 5 20 JKBD O=C(Nc1ccc2nc3n(c(=O)c2c1)CCC3)c1cc([N+](=O)[O-])ccc1Sc1ccc(Cl)cc1 603621505 YPSDLWMYWIQJKL-UHFFFAOYSA-N 492.944 5.308 5 20 JKBD Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)c1sc(NC(=O)c2ccc(F)cc2Cl)cc1C 603778225 DJFZKEKDBYFVDK-UHFFFAOYSA-N 461.902 5.879 5 20 JKBD CCOC(=O)c1cc(C(=O)N(c2cccc(C(F)(F)F)c2)[C@@H](C)C2CC2)cc([N+](=O)[O-])c1 603964377 HFDAECTYGQSZRF-ZDUSSCGKSA-N 450.413 5.236 5 20 JKBD O=C(c1csc(-c2cccc([N+](=O)[O-])c2)n1)N(Cc1ccc2c(c1)OCO2)C1CCCC1 604517418 DWFKDKYZKXJVGK-UHFFFAOYSA-N 451.504 5.032 5 20 JKBD Cc1cc(OCc2cccc(F)c2)ccc1NC(=O)C1CCN(c2ccccc2[N+](=O)[O-])CC1 609064500 AAHLAFIKHXJOSX-UHFFFAOYSA-N 463.509 5.476 5 20 JKBD COc1ccc(NC(=O)CSc2ccc([N+](=O)[O-])cc2)cc1OCc1ccc2ccccc2n1 609066566 QQXOVTOFTWQBTO-UHFFFAOYSA-N 475.526 5.461 5 20 JKBD COC1CCN(c2ccc(NC(=O)c3cc(SC)ccc3[N+](=O)[O-])cc2C(F)(F)F)CC1 728010475 ABAXXJVYTKYOEO-UHFFFAOYSA-N 469.485 5.203 5 20 JKBD CC(C)(C)OC(=O)NCc1ccc2c(c1)CCCN2C(=O)c1cc2cc([N+](=O)[O-])ccc2s1 731022705 LXUQGOJLPQAEPK-UHFFFAOYSA-N 467.547 5.427 5 20 JKBD CCOc1ccc(OC(C)(C)C(=O)Oc2ccc(NC(=O)c3cccc([N+](=O)[O-])c3)cc2)cc1 743886378 ZBFGJYPJWWKRTI-UHFFFAOYSA-N 464.474 5.009 5 20 JKBD CCCOc1nc2ccccc2cc1/C=C\C(=O)O[C@@H](C)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 746114863 XZJFTGMWHGLPNF-DDKJEQMHSA-N 474.473 5.299 5 20 JKBD COc1ccc(NC(=O)[C@@H](C)Sc2ncc(-c3ccccc3)n2CC(F)(F)F)c([N+](=O)[O-])c1 748031776 PQOHKPAAVQAHMD-CYBMUJFWSA-N 480.468 5.149 5 20 JKBD COc1ccccc1CN(Cc1cccs1)C(=O)c1cc([N+](=O)[O-])ccc1Br 750602547 GGUDTRGOAOGNQJ-UHFFFAOYSA-N 461.337 5.270 5 20 JKBD CC(=O)Nc1cccc([C@@H](C)N(Cc2ccccc2)C(=O)c2cc([N+](=O)[O-])ccc2Br)c1 751072183 LKEUAAKEHIMCKM-MRXNPFEDSA-N 496.361 5.719 5 20 JKBD C[C@H](Nc1ccc(-c2nc(-c3cccc(C(F)(F)F)c3)no2)cc1[N+](=O)[O-])c1ccccn1 904315694 UESNFMBNRCYBID-ZDUSSCGKSA-N 455.396 5.899 5 20 JKBD CC(C)C(=O)Nc1cccc(NC(=O)c2ccccc2NC(=O)c2ccc([N+](=O)[O-])cc2Cl)c1 914759778 VPONUDRMKYTSCM-UHFFFAOYSA-N 480.908 5.347 5 20 JKBD C[C@@H](c1ccccc1)n1c(SCC(=O)Nc2ccc(F)c([N+](=O)[O-])c2)nnc1-c1ccccc1 917253978 BMRYVCDIMQDLGN-INIZCTEOSA-N 477.521 5.333 5 20 JKBD C[C@@H](Nc1ccc(C(=O)Nc2cccc(C3SCCS3)c2)cc1[N+](=O)[O-])c1ccccn1 919691505 CFAPYCBTEHXMAN-OAHLLOKOSA-N 466.588 5.894 5 20 JKBD CC(C)N(Cc1ccc([N+](=O)[O-])cc1)Cn1nc(CN2CCCCC2)n(Cc2ccccc2)c1=S 919950687 PCIDYUPBYNNOPY-UHFFFAOYSA-N 494.665 5.225 5 20 JKBD O=C(NC1(c2ccc(NC(=O)c3n[nH]cc3[N+](=O)[O-])cc2)CCC1)c1ccc(-c2ccccc2)cc1 1789694022 UMOVELCBTUDJEE-UHFFFAOYSA-N 481.512 5.046 5 20 JKBD O=C(NC1(c2ccc(NC(=O)c3ccc([N+](=O)[O-])c4c3OCO4)cc2)CCC1)c1cccc(Cl)c1 1790096750 WAFQFQCXGUOQNS-UHFFFAOYSA-N 493.903 5.038 5 20 JKBD Cc1ccc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cc(Cl)cc([N+](=O)[O-])c2C)C3)cc1Cl 1792733024 AUNYQGUTAJDLTD-BCDXTJNWSA-N 476.360 5.084 5 20 JKBD O=C(C1CC2(CCC2)C1)N1CCC([C@@H]2CCCCN2C(=O)C2(c3cccc([N+](=O)[O-])c3)CCC2)CC1 1830295340 PSHPMZVLWWZMNT-VWLOTQADSA-N 493.648 5.217 5 20 JKBD CC(C)[C@@H](C(=O)N1CCCC12CN(C(=O)c1cc3cc([N+](=O)[O-])ccc3s1)C2)c1ccccc1 1841407474 GDCYGRHPLPFWCX-HSZRJFAPSA-N 477.586 5.066 5 20 JKBD Cc1csc(Sc2ccc(C(=O)N3CCC[C@@H](C(=O)Nc4ccccc4)C3)cc2[N+](=O)[O-])n1 17822641 SMVVHGNXQWUJHO-QGZVFWFLSA-N 482.587 5.002 5 20 JKBD Cc1cccc(-n2ccnc2S[C@@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2C(F)(F)F)c1C 21609518 AODBOCFVTABIEO-AWEZNQCLSA-N 464.469 5.535 5 20 JKBD Cc1noc(C)c1CCNC(=O)c1c2c(nc3ccccc13)/C(=C/c1cccc([N+](=O)[O-])c1)CCC2 410303764 SKFONUMMUIISMI-HMMYKYKNSA-N 482.540 5.597 5 20 JKBD CCOc1cc(NC(=O)c2cc(C(C)C)nc3c2c(C)nn3C(C)(C)C)c([N+](=O)[O-])cc1OCC 478078171 GUTBWQPOLGOTJA-UHFFFAOYSA-N 483.569 5.576 5 20 JKBD CN(C)c1ncccc1CNC(=O)c1ccccc1Sc1ccc(C(F)(F)F)cc1[N+](=O)[O-] 479012542 PDWDBBUHMGPJIN-UHFFFAOYSA-N 476.480 5.156 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)N[C@H](Cc2ccc(Cl)cc2)c2ccccc2)cc1SC 483322674 NGDFYNRJFWVFOQ-LJQANCHMSA-N 456.951 5.693 5 20 JKBD O=C(Nc1nnc(SCc2ccccc2)s1)c1csc(-c2cccc([N+](=O)[O-])c2)n1 496447550 MRNBZFRKBRLNKA-UHFFFAOYSA-N 455.546 5.114 5 20 JKBD Cc1cccc(N2C(=O)N[C@@H](CCC(=O)Nc3c4ccccc4n4c(C)nc5ccccc5c34)C2=O)c1 503148111 HOVZUUPYGVPZBC-QHCPKHFHSA-N 491.551 5.101 5 20 JKBD Cc1sc(NC(=O)c2cnn(-c3ccc(F)cc3F)c2C)nc1-c1cccc([N+](=O)[O-])c1 515622050 GPPGURVMOQCEPG-UHFFFAOYSA-N 455.446 5.051 5 20 JKBD CS(=O)(=O)c1cc(C(=O)Nc2ccc(Sc3ccc(Cl)cc3)cc2)cc([N+](=O)[O-])c1 518626484 BMVROCIKSRKLNF-UHFFFAOYSA-N 462.936 5.055 5 20 JKBD CCOc1cc(CN[C@@H](C)c2nc(C)cs2)ccc1OCc1cc([N+](=O)[O-])cc2c1OCOC2 520218531 IEQMZWQWTOSJFD-INIZCTEOSA-N 485.562 5.055 5 20 JKBD CCN(C(=O)[C@@H](C)Sc1ccc([N+](=O)[O-])cc1)[C@@H](c1cccnc1)c1ccc(F)c(F)c1 520502819 WRGAVIUPZFEBQU-IVZQSRNASA-N 457.502 5.387 5 20 JKBD CC(C)(C)OCc1cccc(CNC(=O)C2CCN(c3ccc(C(F)(F)F)cc3[N+](=O)[O-])CC2)c1 522415443 GURMJSZXIFJVEE-UHFFFAOYSA-N 493.526 5.462 5 20 JKBD COc1ccccc1N1CCC(NC(=O)c2ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])cc2)CC1 522630132 BWHYMYYGXPYOII-UHFFFAOYSA-N 481.936 5.448 5 20 JKBD COc1cccc(CNC(=O)C/C(=C\c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)c1 603454257 CCRQIGSNLWCRPZ-CPNJWEJPSA-N 459.527 5.460 5 20 JKBD O=C(NCc1cccc(OCc2ccccn2)c1)c1ccc(NCc2ccccc2)c([N+](=O)[O-])c1 603672998 FLKWAYFPKDLIKC-UHFFFAOYSA-N 468.513 5.111 5 20 JKBD Cc1cc(C)n(-c2ccc(CNC(=O)c3cc([N+](=O)[O-])ccc3Sc3ccc(Cl)cc3)cn2)n1 603921354 SYGHCNXKNXRGAJ-UHFFFAOYSA-N 493.976 5.527 5 20 JKBD CC(C)Oc1ccccc1[C@@H](C)N[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1 603954776 HXFJVRFPSVDZPB-OSPHWJPCSA-N 467.953 6.066 5 20 JKBD CC(C)Oc1ccccc1[C@H](C)N[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1 603954779 HXFJVRFPSVDZPB-XDHUDOTRSA-N 467.953 6.066 5 20 JKBD Cc1csc(Sc2ccc(C(=O)NCc3cc(-c4ccccc4)on3)cc2[N+](=O)[O-])n1 604563732 WEVYCPLICQXMFQ-UHFFFAOYSA-N 452.517 5.096 5 20 JKBD Cn1c(=O)oc2cc(NC(=O)c3cc([N+](=O)[O-])ccc3Sc3ccc(Cl)cc3)ccc21 609107291 KINKTZPFOFXLLY-UHFFFAOYSA-N 455.879 5.097 5 20 JKBD CCC[C@@H](NC(=O)C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)c1ccccn1 609179954 XSJRPWREQGKWKO-BENYOCTQSA-N 472.570 6.188 5 20 JKBD CC(=O)N(c1nc(COC(=O)c2ccc([N+](=O)[O-])cc2C)cs1)c1c(C)cc(C)cc1Cl 725987672 MXGKGKJCBBGTLV-UHFFFAOYSA-N 473.938 5.672 5 20 JKBD C[C@H](NC(=O)Nc1ccc(N2C[C@@H](C)O[C@H](C)C2)c(C(F)(F)F)c1)c1cccc([N+](=O)[O-])c1 728130132 MAGJDJLHJVFHEX-KFWWJZLASA-N 466.460 5.110 5 20 JKBD Cc1ccc(-c2nc(C)c([C@H](C)NC(=O)c3cc([N+](=O)[O-])ccc3Br)s2)cc1 730761395 ILUKLFZYAVGERO-LBPRGKRZSA-N 460.353 5.589 5 20 JKBD CCOc1cc(NC(=O)N2CCC(c3cc4ccccc4[nH]3)CC2)c([N+](=O)[O-])cc1OCC 744754893 CYXGVOWWELWMGH-UHFFFAOYSA-N 452.511 5.285 5 20 JKBD Cc1c(NC(=O)[C@@H](C)OC(=O)Cc2csc(-c3ccc(Cl)cc3Cl)n2)cccc1[N+](=O)[O-] 747258909 NSPHBRWXPFSJDY-GFCCVEGCSA-N 494.356 5.446 5 20 JKBD O=C(Nc1cc2c(cc1Sc1ccccc1)OCCO2)c1cc([N+](=O)[O-])ccc1Br 751229855 CMTWRPQVFKYZER-UHFFFAOYSA-N 487.331 5.532 5 20 JKBD O=C(OCc1cc([N+](=O)[O-])cc2c1OCOC2)C1(c2cccc(C(F)(F)F)c2)CCCC1 792714778 JDCNLPMGNTXLQV-UHFFFAOYSA-N 451.397 5.035 5 20 JKBD COc1ccc(CSCc2nc(-c3cccnc3Oc3ccccc3)no2)cc1[N+](=O)[O-] 904452638 KUVDEKFZRJKSIX-UHFFFAOYSA-N 450.476 5.274 5 20 JKBD CN(Cc1ccccc1[N+](=O)[O-])Cn1nc(Nc2ccc(OC(F)(F)F)cc2)sc1=S 914783475 FGECRUQKIAXJEV-UHFFFAOYSA-N 471.486 5.314 5 20 JKBD Cc1ccc(C)c(NC(=S)Nc2ccc(NS(=O)(=O)c3ccc(C)c([N+](=O)[O-])c3)cc2)c1 916119933 AGOZVNCBJQZLPP-UHFFFAOYSA-N 470.576 5.130 5 20 JKBD Cc1cccc(C(C)C)c1NC(=O)[C@H](C)OC(=O)c1ccc(N[C@@H](C)c2ccccn2)c([N+](=O)[O-])c1 920544880 MYLADRKKTAHFFN-OALUTQOASA-N 490.560 5.779 5 20 JKBD O=C(/C=C/c1ccc([N+](=O)[O-])o1)Nc1ccc(C2(NC(=O)[C@@H](F)c3ccccc3)CCC2)cc1 1786205777 QCHDDEMSYWEVDE-BWSGXRDBSA-N 463.465 5.046 5 20 JKBD COc1cc(CC(=O)NC2(c3ccc(NC(=O)c4ccc5occc5c4)cc3)CCC2)ccc1[N+](=O)[O-] 1789049198 BBFQXYXMJNBLPJ-UHFFFAOYSA-N 499.523 5.340 5 20 JKBD O=C(NC1(c2ccc(NC(=O)c3ccc([N+](=O)[O-])[nH]3)cc2)CCC1)c1cccc(-c2ccccc2)n1 1790186300 LERKFDPAXUEZND-UHFFFAOYSA-N 481.512 5.046 5 20 JKBD Cc1ccc(CC(=O)Nc2ccc(C3(NC(=O)c4cccc5ccncc45)CCC3)cc2)cc1[N+](=O)[O-] 1790525483 YQABWRNEVQMRAW-UHFFFAOYSA-N 494.551 5.442 5 20 JKBD Cc1c(C(=O)Nc2ccc(C3(NC(=O)[C@H]4C[C@@]4(F)Cl)CCC3)cc2)cc(Cl)cc1[N+](=O)[O-] 1790774759 QSYPQSXLMJKBQU-VGSWGCGISA-N 480.323 5.229 5 20 JKBD O=C(/C=C/c1ccccc1[N+](=O)[O-])Nc1ccc(C2(NC(=O)c3n[nH]c4c(F)cccc34)CCC2)cc1 1792317697 GQIUMMYWJVJYKU-NTEUORMPSA-N 499.502 5.071 5 20 JKBD O=C(/C=C/c1ccccc1[N+](=O)[O-])Nc1ccc(C2(NC(=O)c3nccc4occc34)CCC2)cc1 1792317734 LAYIFPAPONQTOM-IZZDOVSWSA-N 482.496 5.197 5 20 JKBD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccccc1Oc1ccccc1)c1ccc([N+](=O)[O-])cc1F 1799551154 AHXYQNJENSDPLP-REPLKXPHSA-N 489.503 5.092 5 20 JKBD Cc1ccc(C(=O)N2CCCC[C@H]2C2CCN(C(=O)c3cccc(F)c3[N+](=O)[O-])CC2)cc1Cl 1823909605 DOFQKWMKBCHFPJ-QFIPXVFZSA-N 487.959 5.243 5 20 JKBD Cc1ccsc1C(=O)N1CCC([C@@H]2CCCCN2C(=O)Cc2ccc(Cl)cc2[N+](=O)[O-])CC1 1824160131 DMWSYNZNJBNWQN-FQEVSTJZSA-N 490.025 5.094 5 20 JKBD C[C@@H]1CCC[C@@H]1C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)CC1 1828485971 DZGRXZSJROHZCA-VOQZNFBZSA-N 483.634 5.479 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2ccccc2Cl)CC1 1830733220 JKNTXQSLNPGEOL-JOCHJYFZSA-N 487.959 5.243 5 20 JKBD CCC[C@H]1CC[C@H](C(=O)N2CCC([C@@H]3CCCCN3C(=O)c3ccc([N+](=O)[O-])c(OC)c3)CC2)CC1 1832698135 UJHIJEQBECBROP-SSPYTLHUSA-N 499.652 5.443 5 20 JKBD O=C(c1cc2ccccc2o1)N1CCC([C@@H]2CCCCN2C(=O)/C=C/c2ccccc2[N+](=O)[O-])CC1 1832906878 HFWLTDKXKRKVIE-OTOIZHKDSA-N 487.556 5.288 5 20 JKBD O=C(CSc1nnc(-c2ccccc2Cl)n1C1CCCC1)Nc1ccc(F)c([N+](=O)[O-])c1 8989029 NXAJEAXVMYWRGQ-UHFFFAOYSA-N 475.933 5.492 5 20 JKBD CCn1c(S[C@H](C)C(=O)Nc2cc([N+](=O)[O-])ccc2Cl)nnc1-c1cccc(Cl)c1 9822086 XRWNICZSJWROLF-LLVKDONJSA-N 466.350 5.299 5 20 JKBD O=C(CSc1ncnc2sc(-c3ccccc3)cc12)Nc1cc2c(cc1[N+](=O)[O-])OCCCO2 11974754 CIZGNTLCNSOIGC-UHFFFAOYSA-N 494.554 5.159 5 20 JKBD O=C(Nc1ccc(NC(=O)C2CC2)cc1)c1cc([N+](=O)[O-])ccc1Sc1ccc(Cl)cc1 12216952 GTSXYPCMHQNKEZ-UHFFFAOYSA-N 467.934 6.000 5 20 JKBD CC(=O)Nc1ccc(NC(=O)c2ccc(Sc3ccc(C)cc3)c([N+](=O)[O-])c2)c(C(F)(F)F)c1 14120126 LFWWDXSJCRXSEX-UHFFFAOYSA-N 489.475 6.284 5 20 JKBD COc1ccc([C@H]2Nc3ccccc3C(=O)N2Cc2ccco2)cc1OCc1ccc([N+](=O)[O-])cc1 15248864 GFUCFZKRPZPZMX-SANMLTNESA-N 485.496 5.542 5 20 JKBD CCCCCn1c(SCC(=O)Nc2c(C)cccc2[N+](=O)[O-])nc2sc3c(c2c1=O)CCC3 21120772 QTHKHWRIESSXQX-UHFFFAOYSA-N 486.619 5.084 5 20 JKBD Cc1ccc(C)c(-n2ccnc2S[C@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2C(F)(F)F)c1 21649369 ALWGFDLRMNXUJM-CQSZACIVSA-N 464.469 5.535 5 20 JKBD C[C@H](Sc1ncc(-c2ccccc2)n1C[C@@H]1CCCO1)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl 22239517 AEAQRIWXDMTUTO-YJBOKZPZSA-N 486.981 5.410 5 20 JKBD COc1ccc(C)cc1NC(=O)[C@H](OC(=O)c1cc(Cl)ccc1[N+](=O)[O-])c1ccccc1 23515092 CLLOPUXHAPOYHM-OAQYLSRUSA-N 454.866 5.102 5 20 JKBD C[C@@H](OC(=O)c1ccc(NCc2ccccc2)c([N+](=O)[O-])c1)C(=O)Nc1ncc(Cl)cc1Cl 23642758 ZISCAZCIRBOPIU-CYBMUJFWSA-N 489.315 5.093 5 20 JKBD COc1ccccc1Nc1nnc(SCc2cc(OC)c(OC(F)F)cc2[N+](=O)[O-])s1 24966294 HJHQHOFQLDDJDD-UHFFFAOYSA-N 470.479 5.101 5 20 JKBD CCOc1cc([N+](=O)[O-])c(C(=O)Nc2nc(-c3ccc(OC)c(Cl)c3)cs2)cc1OC 28251520 YYWFZFJCSIVGJX-UHFFFAOYSA-N 463.899 5.040 5 20 JKBD COc1ccccc1-n1c(SCc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)nnc1-c1cccs1 29815856 KBRVWQKJIWQGKK-UHFFFAOYSA-N 492.542 5.255 5 20 JKBD O=C(Cn1c2ccccc2c(=O)c2ccccc21)Nc1cc(Br)ccc1Br 31950322 OSJBXKWWDZPLSK-UHFFFAOYSA-N 486.163 5.318 5 20 JKBD COc1cc(/C=C(\Cl)c2nc(O)c3c(-c4ccc(C)cc4)csc3n2)cc([N+](=O)[O-])c1O 69263208 JSKDAKMOOVDHLQ-CHHVJCJISA-N 469.906 5.732 5 20 JKBD C[C@@H](Nc1ccc(C(=O)N2CCC[C@@H](c3nc4ccccc4o3)C2)cc1[N+](=O)[O-])c1ccccn1 108781264 WTUWXZGXZIUXMQ-IEBWSBKVSA-N 471.517 5.324 5 20 JKBD CCOc1ccc(Oc2ccc(C(F)(F)F)cc2NC(=O)CCn2cc([N+](=O)[O-])cn2)cc1 109394778 RTIRIBWCJFAIBB-UHFFFAOYSA-N 464.400 5.030 5 20 JKBD COc1ccc(CSCC(=O)Nc2cc(C(=O)Nc3ccccc3)ccc2C)cc1[N+](=O)[O-] 483211157 FZBOZESJLSPBEK-UHFFFAOYSA-N 465.531 5.036 5 20 JKBD O=C(N[C@H](c1ccccc1)c1ccncc1)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1 486853052 PPDXTCADOVTNJE-XMMPIXPASA-N 459.889 5.955 5 20 JKBD CC(C)N(Cc1cccnc1)C(=O)c1ccc(Sc2nc3ccccc3s2)c([N+](=O)[O-])c1 488638175 ALJTZQKPBJISTJ-UHFFFAOYSA-N 464.572 5.802 5 20 JKBD CCOC(=O)CC1CCN(C(=O)c2cc([N+](=O)[O-])ccc2Sc2ccc(Cl)cc2)CC1 497905072 NWLPATMKCWKPRQ-UHFFFAOYSA-N 462.955 5.205 5 20 JKBD Cc1c(NC(=O)c2ccc(N3C[C@@H](C)C[C@@H](C)C3)c([N+](=O)[O-])c2)cccc1C(=O)Nc1ccccc1 498468421 YUQLSEIPNMLBJB-KDURUIRLSA-N 486.572 5.890 5 20 JKBD O=C(NCc1ccccc1-c1ccc(Cn2ccnc2)cc1)C1CCN(c2ccccc2[N+](=O)[O-])CC1 504760768 VKKBDNIHKQBRSY-UHFFFAOYSA-N 495.583 5.039 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Cl)[C@H](N[C@@H](c1ccccc1)c1ccco1)c1ccccc1 510650314 ZMAMUZBTJKVSIR-BJKOFHAPSA-N 461.905 5.900 5 20 JKBD Cc1ccc(NC(=O)c2ccccc2)cc1NC(=O)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-] 514577473 BRHABSRXAWPFCQ-UHFFFAOYSA-N 473.407 5.349 5 20 JKBD CN(C[C@@H]1CCCOC1)C(=O)C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1 517409407 YBIBQCIHAKJRIF-UZNZLNSGSA-N 451.548 5.020 5 20 JKBD CC(C)c1cc(NC(=O)c2ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])cc2)n(-c2ncccn2)n1 517483751 BUYXLTUGPUUGRQ-UHFFFAOYSA-N 478.896 5.392 5 20 JKBD C[C@H](Nc1ccc(C(=O)Nc2ccc(-c3nnc4n3CCCC4)cc2)cc1[N+](=O)[O-])c1ccccn1 518229761 VVGSOEGASNJMQU-KRWDZBQOSA-N 483.532 5.010 5 20 JKBD CO[C@H](C)c1cccc(NC(=O)c2ccc(C(=O)Nc3cccc([C@@H](C)OC)c3)c([N+](=O)[O-])c2)c1 524357906 VXECLCJVVADZEM-IAGOWNOFSA-N 477.517 5.514 5 20 JKBD Cc1cnn([C@H]2CCCc3ccccc32)c1NC(=O)[C@@H](C)Oc1ccc(Cl)cc1[N+](=O)[O-] 524377916 XUJLPVRSOQAFNO-BEFAXECRSA-N 454.914 5.085 5 20 JKBD Cc1ccc(S(=O)(=O)Nc2ccc(NC(=O)c3ccc(Cl)cc3Cl)cc2)cc1[N+](=O)[O-] 603501791 IFLYVNRRJROMQR-UHFFFAOYSA-N 480.329 5.263 5 20 JKBD CC(C)n1ncc2c(C(=O)N(Cc3ccccc3[N+](=O)[O-])CC(F)(F)F)cc(C3CC3)nc21 603613856 UNMRZVAQNZAYLP-UHFFFAOYSA-N 461.444 5.003 5 20 JKBD COCCN(C(=O)c1cccc(OCC(C)C)c1)c1nc(-c2ccc([N+](=O)[O-])cc2)cs1 603820189 GITANMBEZJTLTP-UHFFFAOYSA-N 455.536 5.046 5 20 JKBD COc1ccc([C@@H](NCC(=O)Nc2nc(-c3cccc([N+](=O)[O-])c3)cs2)c2ccccc2)cc1 611565374 TZTVMPHAWSCBMI-DEOSSOPVSA-N 474.542 5.045 5 20 JKBD CCOc1cc(NC(=O)c2ccc(-n3nc(C)c(Cl)c3C)cc2)c([N+](=O)[O-])cc1OCC 619212719 DQBKIAAAWDBMFK-UHFFFAOYSA-N 458.902 5.100 5 20 JKBD Cc1oc(-c2ccsc2)nc1CC(=O)Oc1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2Cl)cc1 726911864 SNCNLKJRZZUSIV-UHFFFAOYSA-N 497.916 5.674 5 20 JKBD CCc1cc[n+](/C(C(=S)Nc2ccc(OC)c(Cl)c2)=C(/O)c2ccc(C)c([N+](=O)[O-])c2)cc1 726962012 NJPGAEKVQBTZKO-UHFFFAOYSA-O 484.985 5.738 5 20 JKBD CC1=C(C(=O)Nc2cccc(C)c2C)[C@H](c2ccc([N+](=O)[O-])cc2)NC(=O)N1Cc1cccs1 732038533 JXHBWACRCDNFQL-QHCPKHFHSA-N 476.558 5.452 5 20 JKBD C[C@@H]([C@H]1C[C@H]2CC[C@H]1C2)n1c(SCC(=O)Nc2cc([N+](=O)[O-])ccc2F)nnc1-c1ccco1 848592763 MNPUJMWHJFCNBM-QBYUYEEZSA-N 485.541 5.313 5 20 JKBD O=C(c1ccc([N+](=O)[O-])s1)N1CCC[C@@H]1c1nc(-c2ccc(COc3ccccc3)cc2)no1 904447941 OGHRTDHFHAMTMD-LJQANCHMSA-N 476.514 5.263 5 20 JKBD O=C(Nc1cccc(Cl)c1)c1ccccc1NC(=O)C1CCN(c2ccccc2[N+](=O)[O-])CC1 912605643 HJYCCTPTPXJYDJ-UHFFFAOYSA-N 478.936 5.356 5 20 JKBD Cc1ccc(/C(O)=C(/C(=S)N[C@@H]2C[C@H]3CC[C@H]2C3)[n+]2ccc3c(c2)CCCC3)cc1[N+](=O)[O-] 912843511 KWQYPZSXEBKKQG-LQBOVUBWSA-O 464.611 5.059 5 20 JKBD Cc1ccc([N+](=O)[O-])c(OCCC(=O)O[C@@H](C)C(=O)Nc2c(Cl)cc(Cl)cc2Cl)c1 915443102 WKCHJRROHLUPIO-NSHDSACASA-N 475.712 5.203 5 20 JKBD O=C(/C=C\c1ccc([N+](=O)[O-])cc1)Nc1ccc(NC(=O)c2ccccc2F)cc1C(F)(F)F 915871219 YGQWVLNAODTIMY-GHXNOFRVSA-N 473.382 5.657 5 20 JKBD COc1cc(C(=O)Nc2ccccc2SC[C@H]2CC2(Cl)Cl)c([N+](=O)[O-])cc1OC(F)F 917750138 FRZNNTCBPDEKKN-SNVBAGLBSA-N 493.315 5.743 5 20 JKBD Cc1oc2cc(OS(=O)(=O)c3ccc([N+](=O)[O-])cc3Cl)ccc2c(=O)c1-c1ccccc1 917855124 OMHJJAUCXVQFBI-UHFFFAOYSA-N 471.874 5.098 5 20 JKBD COc1cc(-c2ccccc2)sc1C(=O)O[C@@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 919459918 YJWLWUARKHZDKA-LBPRGKRZSA-N 494.447 5.535 5 20 JKBD COc1cc(COC(=O)c2csc(-c3ccc(Cl)s3)n2)c([N+](=O)[O-])cc1OC(F)F 920675833 RRXANYSDPFKQPQ-UHFFFAOYSA-N 476.866 5.400 5 20 JKBD C[C@H](Nc1ccc(C(=O)O[C@@H](c2ccccc2)c2ccncc2)cc1[N+](=O)[O-])c1ccccn1 920772478 NKHYLZSNLNTZFR-BVZFJXPGSA-N 454.486 5.504 5 20 JKBD Cc1ccc(/C(O)=C(/C(=S)NCC2CCC2)[n+]2ccc(Cc3ccccc3)cc2)cc1[N+](=O)[O-] 1322380612 GHXBFAZMRVLMND-UHFFFAOYSA-O 474.606 5.382 5 20 JKBD Cc1cc(C(=O)Nc2ccc(C3(NC(=O)c4cccc(-c5cnco5)c4)CCC3)cc2)ncc1[N+](=O)[O-] 1788766675 PEVMOUDBDOXWEH-UHFFFAOYSA-N 497.511 5.015 5 20 JKBD O=C(NC1(c2ccc(NC(=O)c3cc4cc(F)ccc4s3)cc2)CCC1)c1ccc([N+](=O)[O-])o1 1789288381 GHMVNAOXZPMASN-UHFFFAOYSA-N 479.489 5.603 5 20 JKBD O=C(CSc1ccccc1[N+](=O)[O-])NC1(c2ccc(NC(=O)c3ccccc3)cc2)CCC1 1790212847 ABHORLVLAJKGHL-UHFFFAOYSA-N 461.543 5.135 5 20 JKBD O=C(/C=C/c1ccc([N+](=O)[O-])o1)NC1(c2ccc(NC(=O)[C@@H]3C[C@@H]3c3ccccc3)cc2)CCC1 1791526501 BOTYZKLYXHWGLC-RMGDVBNVSA-N 471.513 5.139 5 20 JKBD Cc1c(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)/C=C/c2cc4ccccc4o2)C3)cc(Cl)cc1[N+](=O)[O-] 1800711717 SKOZBRYXTVDCIR-PMPZAWEISA-N 493.947 5.268 5 20 JKBD CCCOc1ccc(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3cc(F)cc([N+](=O)[O-])c3)CC2)cc1 1830102834 MNQXIZBZTHHPCW-RUZDIDTESA-N 497.567 5.070 5 20 JKBD Cc1ccc(CC(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3c[nH]c(C(C)(C)C)c3)CC2)cc1[N+](=O)[O-] 1830362530 AWMGAZJHEOJXLX-HSZRJFAPSA-N 494.636 5.005 5 20 JKBD Cc1ccc(Cl)cc1NC(=O)COC(=O)c1ccccc1C(=O)c1ccc(Cl)c([N+](=O)[O-])c1 11029333 IOSVMARFBPAIPV-UHFFFAOYSA-N 487.295 5.237 5 20 JKBD O=c1nc(/C(Cl)=C/c2ccc(-c3ccc([N+](=O)[O-])cc3Br)o2)[nH]c2ccccc12 16441388 ILUVNGDUDDZHLH-YBEGLDIGSA-N 472.682 5.591 5 20 JKBD Cc1nc(-c2ccccc2)c(C(=O)O[C@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2C(F)(F)F)s1 18765556 OQHNTCWLBPQRCF-LLVKDONJSA-N 479.436 5.230 5 20 JKBD C[C@@H](Sc1nnc(-c2ccc(C(C)(C)C)cc2)n1C)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl 21138244 GOQUZYUASNDWNG-CYBMUJFWSA-N 473.986 5.461 5 20 JKBD C[C@H](Sc1nc2nn(-c3ccccc3)c(=O)c-2c2n1CCCCC2)c1cccc([N+](=O)[O-])c1 21245994 AHDNICXXIUEURO-INIZCTEOSA-N 461.547 5.022 5 20 JKBD Cc1sc(C(=O)Nc2cccc(S(=O)(=O)Nc3cccc(C(F)(F)F)c3)c2)cc1[N+](=O)[O-] 31940384 NGULVDHVVXNJQO-UHFFFAOYSA-N 485.465 5.037 5 20 JKBD C[C@H](Nc1ccc(C(=O)N[C@H](C)Cc2cccc(Br)c2)cc1[N+](=O)[O-])c1ccccn1 195676479 AXBLXNBQJLVYFX-CVEARBPZSA-N 483.366 5.286 5 20 JKBD Cn1cnnc1Sc1ccc(C(=O)N2CCC[C@@H]2c2ccc(Cl)c(Cl)c2)cc1[N+](=O)[O-] 487836940 GCHSBWFMMFSFJF-MRXNPFEDSA-N 478.361 5.159 5 20 JKBD COCCOc1cccc(N[C@@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2ccccc2)c1 511020636 YWIXPSOKEFGYEG-JOCHJYFZSA-N 455.898 5.065 5 20 JKBD CN(Cc1ccccc1[N+](=O)[O-])C(=O)[C@H](Oc1ccccc1Br)c1ccccc1 514568557 BRBFXVJTMFCQQV-OAQYLSRUSA-N 455.308 5.136 5 20 JKBD CN(Cc1cn(-c2ccccc2)nc1-c1cccs1)C(=O)c1cc2cccc([N+](=O)[O-])c2[nH]1 515724185 TZUCXIXLWNAUEK-UHFFFAOYSA-N 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481.537 6.164 5 20 JKBD C[C@@H](Nc1ccc(C(=O)NCc2ccc(-c3nc4ccccc4s3)o2)cc1[N+](=O)[O-])c1ccccn1 506089153 ZYEOJYDUEIVPIQ-MRXNPFEDSA-N 499.552 5.963 5 20 JKBD O=C(C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)Nc1ccccc1N1CCCC1=O 512345999 JYGFTFTZMSZXLG-MNDPQUGUSA-N 498.564 5.901 5 20 JKBD CCN(CC)C(=O)COc1cccc(NC(=O)c2cc([N+](=O)[O-])ccc2Sc2ccccc2)c1 512438076 ZNAILXNBSPWJJP-UHFFFAOYSA-N 479.558 5.246 5 20 JKBD COc1ccc(CN(C)C)cc1NC(=O)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])c(OC)c1 515030460 KCJKLVNKXXUJNU-UHFFFAOYSA-N 485.924 5.372 5 20 JKBD Cc1cc(C(=O)Nc2cc([N+](=O)[O-])ccc2OC(F)F)c2ccc(Br)cc2n1 515704918 DAXRRPOIOYKMIM-UHFFFAOYSA-N 452.211 5.068 5 20 JKBD CC(=O)Nc1cccc(OCCNCc2ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])cc2)c1 520215316 ZRYQGEYHLHMHTG-UHFFFAOYSA-N 455.898 5.168 5 20 JKBD CO[C@@H](C)C(=O)Nc1cccc(NC(=O)c2ccc(Sc3ccc(C)cc3)c([N+](=O)[O-])c2)c1 520449107 HJGDZTJDNUPCBF-INIZCTEOSA-N 465.531 5.280 5 20 JKBD Cc1ccc(C(C)C)c(Oc2ccc(CNCc3ccnc(N4CCN(C)CC4)c3)cc2[N+](=O)[O-])c1 520948913 GKPKIUJGNPMPGV-UHFFFAOYSA-N 489.620 5.256 5 20 JKBD CSc1ccc(C(=O)c2ccccc2C(=O)Nc2ccc(NC(=O)C(C)C)cc2)cc1[N+](=O)[O-] 600886037 KBFQVEJDNUKNMZ-UHFFFAOYSA-N 477.542 5.395 5 20 JKBD COCCN(C(=O)c1cc2ccc(F)cc2s1)c1nc(-c2ccc([N+](=O)[O-])cc2)cs1 604468224 HHHGXDDZXPBEAZ-UHFFFAOYSA-N 457.508 5.365 5 20 JKBD CO[C@H](C)c1cccc(NC(=O)Cc2cn(-c3ccccc3)nc2-c2ccc([N+](=O)[O-])cc2)c1 608874938 HQUYFQLVPBBCOD-GOSISDBHSA-N 456.502 5.336 5 20 JKBD O=C(CCC(=O)c1ccc2ccc3cccc4ccc1c2c34)NCc1cccnc1N1CCOCC1 727754331 ODYLCNHALOQAEN-UHFFFAOYSA-N 477.564 5.095 5 20 JKBD CCOc1ccc([C@H](CNC(=O)c2cc(Cl)ccc2[N+](=O)[O-])c2c[nH]c3ccccc23)cc1OC 747709944 SBUTZZPMPQKQGH-FQEVSTJZSA-N 493.947 5.699 5 20 JKBD COc1cccc(NC(=O)[C@@H](OC(=O)c2csc(-c3cccc([N+](=O)[O-])c3)n2)c2ccccc2)c1 747962745 JOQPBVYMJQDKRV-QFIPXVFZSA-N 489.509 5.264 5 20 JKBD Cc1ccc(NC(=O)[C@H](C)Oc2ccc3c(-c4ccc([N+](=O)[O-])cc4)cc(=O)oc3c2)c(F)c1 851958728 IULIMYSRPVHKQN-HNNXBMFYSA-N 462.433 5.222 5 20 JKBD O=[N+]([O-])c1ccc(/C=C(/Cc2nc(Cc3cccs3)no2)c2nc3ccccc3s2)cc1 904344869 UVFZNBVTXNKMAJ-VBKFSLOCSA-N 460.540 6.023 5 20 JKBD CCc1ccccc1NC(=O)[C@@H](C)OC(=O)c1cc([N+](=O)[O-])ccc1Oc1ccc(OC)cc1 915250741 XXYWDUBOBFQFSI-MRXNPFEDSA-N 464.474 5.142 5 20 JKBD Cc1ccc(C(=O)O[C@@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)cc1NC(=O)c1ccccc1F 915515921 DPLKJFOROZAPDA-AWEZNQCLSA-N 499.882 5.132 5 20 JKBD C[C@H](NC(=O)c1ccccc1SCC(=O)NC1CCCCCCC1)c1cccc([N+](=O)[O-])c1 917701967 SDQKQIXQWWLAPT-SFHVURJKSA-N 469.607 5.407 5 20 JKBD Cc1ccc(CCC(=O)Nc2ccc(C3(NC(=O)c4c(F)ccc([N+](=O)[O-])c4C)CCC3)cc2)cn1 1786839279 XNDBCSAPGNZJIL-UHFFFAOYSA-N 490.535 5.126 5 20 JKBD Cc1cc(O)c([N+](=O)[O-])cc1C(=O)NC1(c2ccc(NC(=O)c3scnc3C3CC3)cc2)CCC1 1787186528 QKDZJCIUWOAZAV-UHFFFAOYSA-N 492.557 5.004 5 20 JKBD CCN(CC)[C@H](C(=O)Nc1ccc(C2(NC(=O)c3ccc([N+](=O)[O-])o3)CCC2)cc1)c1ccccc1 1791127518 YOZLCCOHWNGDCB-DEOSSOPVSA-N 490.560 5.019 5 20 JKBD O=C(Cc1ccc([N+](=O)[O-])cc1F)Nc1ccc(C2(NC(=O)C[C@H]3C[C@@H]4CC[C@H]3C4)CCC2)cc1 1791183931 QVKKJLQZSCRGCD-WSTZPKSXSA-N 479.552 5.237 5 20 JKBD O=C(CSc1ccccc1[N+](=O)[O-])Nc1ccc(C2(NC(=O)c3ccc(F)s3)CCC2)cc1 1791521245 CCUMYOTYVPEVSR-UHFFFAOYSA-N 485.562 5.335 5 20 JKBD Cc1cccc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cc(Cl)cc([N+](=O)[O-])c2C)c1Cl 1800713634 XMGJPVQJYIXTON-BJWYYQGGSA-N 476.360 5.084 5 20 JKBD O=C(CCc1cccc([N+](=O)[O-])c1)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc2c1oc1ccccc12 1801202178 QUHAFXDFZBTCDN-WKCHPHFGSA-N 497.551 5.379 5 20 JKBD Cc1cc(CCCC(=O)Nc2cc([C@H]3CCCCN3C(=O)c3ccsc3)[nH]n2)c([N+](=O)[O-])cc1F 1815071467 TYJHFWKMOKUZMO-HXUWFJFHSA-N 499.568 5.156 5 20 JKBD O=C(CCC1CCCC1)N1CCC([C@H]2CCCCN2C(=O)Cn2ccc3ccc([N+](=O)[O-])cc32)CC1 1824371800 YDYGCKPCVXSDGW-RUZDIDTESA-N 494.636 5.140 5 20 JKBD CC(C)CCC(=O)N1CCC([C@H]2CCCCN2C(=O)c2cccc(Br)c2[N+](=O)[O-])CC1 1830697556 HJNFZGWGGUVQCT-HXUWFJFHSA-N 494.430 5.027 5 20 JKBD Cc1cc(C)c(NC(=O)CN(C)C(=O)c2ccc(Sc3nc(C)cs3)c([N+](=O)[O-])c2)c(C)c1 15621980 JCCAQMNYVCXBLZ-UHFFFAOYSA-N 484.603 5.147 5 20 JKBD CCCCn1c(-c2ccc(Cl)cc2)nn(CCC(=O)Nc2cccc([N+](=O)[O-])c2C)c1=S 15661228 NJWMIHCISFKURT-UHFFFAOYSA-N 473.986 5.780 5 20 JKBD CC(C)N(Cc1nnc(-c2cccc([N+](=O)[O-])c2)o1)C(=O)COc1ccccc1-c1ccccc1 16014888 UUWDMMAQBRYIDH-UHFFFAOYSA-N 472.501 5.128 5 20 JKBD CCOC(=O)c1sc(-c2ccc(OC)cc2)cc1NC(=O)c1cc(SC)ccc1[N+](=O)[O-] 26867380 IDQAYCSUCZGBRX-UHFFFAOYSA-N 472.544 5.483 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)Nc2cc(C(=O)N3C[C@@H](C)C[C@@H](C)C3)ccc2C)cc1SC 482785240 YWRIRCVMQQGYHR-GASCZTMLSA-N 471.579 5.004 5 20 JKBD CC(C)c1nc(-c2ccccc2NC(=O)c2ccc(N3C[C@H](C)C[C@@H](C)C3)c([N+](=O)[O-])c2)n[nH]1 492615425 WJEPNEYHAUUZGS-IAGOWNOFSA-N 462.554 5.238 5 20 JKBD COc1cc(C(=O)N(Cc2cccc(C(F)(F)F)c2)C(C)C)c([N+](=O)[O-])cc1OC(F)F 500396873 KWLQTWWCHTVAPH-UHFFFAOYSA-N 462.371 5.274 5 20 JKBD CCOc1cc([N+](=O)[O-])c(C(=O)Nc2cc(C(=O)Nc3ccccc3)ccc2Cl)cc1OC 502714559 GJWNUTJJCVQMBN-UHFFFAOYSA-N 469.881 5.160 5 20 JKBD CCOc1cc2c(cc1NC(=O)c1ccc(N[C@H](C)c3ccccn3)c([N+](=O)[O-])c1)O[C@H](C)C2 506099986 XWTZVRZNLZHBMT-HZPDHXFCSA-N 462.506 5.137 5 20 JKBD Cc1cccc(C(=O)Nc2cccc(NC(=O)Nc3cccc(C(F)(F)F)c3)c2)c1[N+](=O)[O-] 510296816 FNDSGRXWXQEHBB-UHFFFAOYSA-N 458.396 5.818 5 20 JKBD CN(C)C(=O)c1ccc(Cl)c(NC(=O)c2ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])cc2)c1 512331809 KVLCRIIQFAEKTK-UHFFFAOYSA-N 474.300 5.648 5 20 JKBD COc1cc(CNC2CCN(Cc3ccc(F)c(F)c3)CC2)ccc1OCc1ccc([N+](=O)[O-])cc1 513632716 STZLIAXBDYEHPB-UHFFFAOYSA-N 497.542 5.215 5 20 JKBD CCOc1cc(C(=O)N2CC[C@H](C)Sc3ccc(C(F)(F)F)cc32)c([N+](=O)[O-])cc1OC 515699566 HTKXGWFEFQEDKI-LBPRGKRZSA-N 470.469 5.552 5 20 JKBD O=C(C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)N1CCC[C@@H]1c1ccsc1 516071421 HAAKRXNMADCTLG-PGPKDTDWSA-N 475.595 6.560 5 20 JKBD COc1cc(C(=O)NCc2nc(C)c3ccccc3n2)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 522548044 DEMHZRPJZMBHEW-UHFFFAOYSA-N 478.892 5.231 5 20 JKBD C[C@@H](NCc1ccc(-c2ccc([N+](=O)[O-])cc2)o1)c1ccc(NC(=O)c2ccc(F)cc2)cc1 549171910 TWXWMDLKZXOOPA-QGZVFWFLSA-N 459.477 6.097 5 20 JKBD CC(C)(C)c1ccc(Oc2ccc(CNCc3nncn3-c3ccccc3)cc2[N+](=O)[O-])cc1 603633221 RHOCLUHCMMZIBV-UHFFFAOYSA-N 457.534 5.555 5 20 JKBD COc1cc([C@H](C)NC(=O)c2cc(OCC(F)(F)F)ccc2[N+](=O)[O-])ccc1OC1CCCC1 603695260 BMKIGVOULRNGOY-AWEZNQCLSA-N 482.455 5.357 5 20 JKBD COc1cc(/C=C(/CC(=O)O)c2nc3ccccc3s2)ccc1OCc1ccc([N+](=O)[O-])cc1 603781507 OYILWZLIHVZLOR-PDGQHHTCSA-N 476.510 5.807 5 20 JKBD CC1CCN(c2ccc(C(=O)N(C)CCCc3cc(-c4ccc(F)cc4)n[nH]3)cc2[N+](=O)[O-])CC1 603922051 XUIJUXLUCSNVDX-UHFFFAOYSA-N 479.556 5.065 5 20 JKBD C[C@H](Nc1ccc(C(=O)N2C[C@@H](C(F)(F)F)C[C@@H](C(F)(F)F)C2)cc1[N+](=O)[O-])c1ccccn1 604310683 CXYXTUIEEYHQDE-AEGPPILISA-N 490.404 5.366 5 20 JKBD COc1ccc([N+](=O)[O-])cc1NC(=O)[C@@H](C)N[C@H](C)c1sc(-c2ccc(C)cc2)nc1C 609353447 QHKNRVYBDATQEM-GDBMZVCRSA-N 454.552 5.022 5 20 JKBD O=C(Cn1c2ccccc2c(=O)c2ccccc21)Nc1ccc(Cl)c(C(=O)NC2CCCCC2)c1 615191819 QSGWBOQGIFQADG-UHFFFAOYSA-N 487.987 5.509 5 20 JKBD O=C(c1ccc(NCc2ccccc2)c([N+](=O)[O-])c1)N1CCO[C@H](c2ccccc2Br)C1 725729178 OJMFYJDZYOQJSD-QHCPKHFHSA-N 496.361 5.183 5 20 JKBD COc1ccc(CN(C)C(=O)c2ccccc2NC(=O)c2ccc([N+](=O)[O-])cc2Cl)cc1C 728530167 DUKYCNYSHYAQNW-UHFFFAOYSA-N 467.909 5.090 5 20 JKBD C[C@@H](Sc1nc(-c2ccco2)nc2ccccc12)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl 811804922 FTXGGNAHFXMPCC-GFCCVEGCSA-N 454.895 5.571 5 20 JKBD CCOc1ccc(C(=O)O[C@H](C)C(=O)N2c3ccccc3Sc3ccccc32)cc1[N+](=O)[O-] 856716800 ZNFVCZIKDIXYRV-OAHLLOKOSA-N 464.499 5.368 5 20 JKBD O=C(Nc1ccc(Cl)c(-c2nnc3n2CCCCC3)c1)c1cc([N+](=O)[O-])ccc1N1CCCCC1 891806103 VJTPPQQDHPQQIH-UHFFFAOYSA-N 494.983 5.476 5 20 JKBD C[C@H](OC(=O)c1cc(Cl)ccc1Br)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 913344756 KBKXWWQNJKJEPC-QMMMGPOBSA-N 495.635 5.214 5 20 JKBD C[C@@H](OC(=O)c1ccccc1SC(F)(F)F)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 914946401 FHGBLJPYTLOCLJ-SECBINFHSA-N 482.358 5.410 5 20 JKBD COc1ccc(Oc2ccc([N+](=O)[O-])cc2C(=O)O[C@@H](C)c2nnc(-c3ccc(C)cc3)o2)cc1 915442094 MESFGLGJJZNUSA-INIZCTEOSA-N 475.457 5.672 5 20 JKBD Cc1ccc(NC(=O)[C@H](OC(=O)c2sc(C(C)C)nc2C)c2ccccc2)c([N+](=O)[O-])c1 915505944 UICYXHFRZBOYLP-LJQANCHMSA-N 453.520 5.328 5 20 JKBD COC(=O)Nc1cccc(N[C@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Br)c2ccccc2)c1 917938238 IWBSPFCAYNUNHY-FQEVSTJZSA-N 499.321 5.328 5 20 JKBD Cc1nc(-c2cccs2)c(CC(=O)N2CCCC[C@@H]2CCOC(=O)c2cccc([N+](=O)[O-])c2)s1 918636547 XFPMOGJHANBIBU-GOSISDBHSA-N 499.614 5.259 5 20 JKBD Cc1c(COC(=O)C[C@@H](NC(=O)c2ccccc2Cl)c2ccccc2)cccc1[N+](=O)[O-] 918798274 VXMZULKHRXQKSQ-OAQYLSRUSA-N 452.894 5.161 5 20 JKBD Cc1cccc(OC[C@H](C)NC(=O)c2ccccc2NC(=O)c2ccc([N+](=O)[O-])cc2Cl)c1 919853904 VJNKYXUEAISMPE-INIZCTEOSA-N 467.909 5.006 5 20 JKBD O=C(Nc1ccccc1C(=O)NC[C@H]1CCCO[C@H]1c1ccccc1)c1ccc([N+](=O)[O-])cc1Cl 920297748 RZBJCRKBTMNUST-KOSHJBKYSA-N 493.947 5.398 5 20 JKBD Cc1nc([N+](=O)[O-])c(Br)n1CC(=O)N(c1ccc(Nc2ccccc2)cc1)C(C)C 920750969 QGOYZCRWYQBTGC-UHFFFAOYSA-N 472.343 5.047 5 20 JKBD CC(C)Oc1cccc(CC(=O)Oc2ccc(NC(=O)c3cc([N+](=O)[O-])ccc3Cl)cc2)c1 920999100 NGGCBINDZHCJSV-UHFFFAOYSA-N 468.893 5.436 5 20 JKBD Cc1cc(C(=O)NC2(c3ccc(NC(=O)c4ccc([N+](=O)[O-])o4)cc3)CCC2)nc2ccccc12 1785748827 JWCCDKCNEWSCOL-UHFFFAOYSA-N 470.485 5.106 5 20 JKBD CCOc1ccccc1C(=O)NC1(c2ccc(NC(=O)/C=C/c3ccc([N+](=O)[O-])o3)cc2)CCC1 1786207898 RNSGBVBKUMZIEZ-WYMLVPIESA-N 475.501 5.048 5 20 JKBD Cc1ccc(CC(=O)Nc2ccc(C3(NC(=O)c4onc5ccccc45)CCC3)cc2)cc1[N+](=O)[O-] 1790525140 CSJWFTOQQGHPGC-UHFFFAOYSA-N 484.512 5.035 5 20 JKBD Cc1cc(C(=O)NC2(c3ccc(NC(=O)CSc4ccccc4[N+](=O)[O-])cc3)CCC2)c(C)n1C 1791522388 NYRXUUBZRSSEGZ-UHFFFAOYSA-N 492.601 5.090 5 20 JKBD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2sc3ccccc3c2Cl)[nH]n1)c1ccc([N+](=O)[O-])[nH]1 1820364705 FLWGWWJIQJWQMT-HNNXBMFYSA-N 498.952 5.134 5 20 JKBD O=C(Nc1cc([C@@H]2CCCCN2C(=O)Cc2ccsc2)[nH]n1)c1cc2cc([N+](=O)[O-])ccc2s1 1821609490 GAMDCJJKGWFMIQ-SFHVURJKSA-N 495.586 5.143 5 20 JKBD O=C(Cc1ccc(Cl)cc1[N+](=O)[O-])N1CCCC[C@@H]1C1CCN(C(=O)C2(F)CCCCC2)CC1 1824160279 AZLALJVEGLCBAQ-OAQYLSRUSA-N 494.007 5.083 5 20 JKBD Cc1ccc(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3cc(F)cc([N+](=O)[O-])c3)CC2)c(Cl)c1 1832607413 JPNDWHIIJKUGNL-HSZRJFAPSA-N 487.959 5.243 5 20 JKBD O=C(c1ccc(C2CC2)cc1)N1CCC([C@H]2CCCCN2C(=O)/C=C/c2ccccc2[N+](=O)[O-])CC1 1832904806 XEBCEPHMDXPNAP-ZUSJUXBOSA-N 487.600 5.419 5 20 JKBD O=C(COC(=O)c1cc([N+](=O)[O-])ccc1Sc1ccc(Cl)cc1)Nc1cccnc1Cl 9032251 ZXLHOIRPEKMNLP-UHFFFAOYSA-N 478.313 5.243 5 20 JKBD Cc1oc2cc(OS(=O)(=O)c3ccccc3[N+](=O)[O-])ccc2c(=O)c1-c1ccccc1Cl 14099886 ADTWKJLSLNDXGE-UHFFFAOYSA-N 471.874 5.098 5 20 JKBD C[C@@H](Sc1nnc(-c2cccs2)n1C1CC1)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 17271045 LGERCIVLVZTSPE-SNVBAGLBSA-N 483.497 5.388 5 20 JKBD O=C(/C=C/c1ccc2ccccc2n1)O[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1 20974714 MJOAWYMIZUHBKZ-VXIGYJSRSA-N 487.899 5.733 5 20 JKBD COc1ccc([N+](=O)[O-])cc1CSc1nnc(-c2ccccc2OC)n1CCc1ccccc1 21368103 ODNFMYFVDJZASE-UHFFFAOYSA-N 476.558 5.406 5 20 JKBD Cc1occc1-c1nnc(S[C@@H](C)C(=O)Nc2ccc(F)c([N+](=O)[O-])c2)n1-c1ccccc1 22100462 SVDPTKSFGOFEKJ-AWEZNQCLSA-N 467.482 5.002 5 20 JKBD C[C@@H]1C[C@@H](C)CN(c2ccc(C(=O)N(C)CC(=O)Nc3c(Cl)cccc3Cl)cc2[N+](=O)[O-])C1 24860323 MHVFWUIYYPRDBE-HUUCEWRRSA-N 493.391 5.095 5 20 JKBD CCOc1cc(C(=O)Nc2nc(-c3ccc(Br)cc3)cs2)c([N+](=O)[O-])cc1OC 26769449 AJYFKZXDYPBWAJ-UHFFFAOYSA-N 478.324 5.140 5 20 JKBD CCOCc1ccc(CNC(=O)C/C(=C/c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)cc1 30480032 DXSQRNSMDMVEOG-JCMHNJIXSA-N 487.581 5.988 5 20 JKBD Cc1nn(Cc2ccc(C(=O)N(C)[C@@H](C)c3ccc(Cl)cc3Cl)cc2)c(C)c1[N+](=O)[O-] 31335901 SUFHSSYXKFTMSQ-AWEZNQCLSA-N 461.349 5.596 5 20 JKBD C[C@@H](Sc1nc(CCC2CCCC2)n[nH]1)C(=O)Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1 36800320 KUBZYVPFGZEAQL-CYBMUJFWSA-N 472.596 5.079 5 20 JKBD O=C(Nc1ccccc1N1CCCC1)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 71794233 DKPBEOMVKGNAAA-UHFFFAOYSA-N 462.472 5.069 5 20 JKBD Cc1ccc(C(=O)N(C)c2ccc(OC(=O)c3csc(-c4ccc([N+](=O)[O-])cc4)n3)cc2)cc1 215706917 XYWJHTDOKTVLPD-UHFFFAOYSA-N 473.510 5.523 5 20 JKBD COCCN(C(=O)c1ccc(OC2CCCC2)c(OC)c1)c1nc(-c2ccc([N+](=O)[O-])cc2)cs1 410147458 BHRLZWFJEVLLED-UHFFFAOYSA-N 497.573 5.342 5 20 JKBD Cc1noc(C)c1CCNC(=O)c1c2c(nc3ccccc13)/C(=C/c1ccc([N+](=O)[O-])cc1)CCC2 410300158 GZXCVPHFFBBOBF-CAPFRKAQSA-N 482.540 5.597 5 20 JKBD CCOc1cc([N+](=O)[O-])c(C(=O)Nc2nc(-c3ccc(OC(C)C)cc3)cs2)cc1OC 490128778 AAWRXRMDZSFFNP-UHFFFAOYSA-N 457.508 5.165 5 20 JKBD COc1cc([C@H](C)NC(=O)c2csc(-c3cccc([N+](=O)[O-])c3)n2)ccc1OCc1ccncc1 498601210 QZKBPAYJHXCFAQ-INIZCTEOSA-N 490.541 5.192 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Cl)[C@@H](N[C@H](c1ccccc1)c1ccco1)c1ccccc1 510650318 ZMAMUZBTJKVSIR-RPWUZVMVSA-N 461.905 5.900 5 20 JKBD CC(C)[C@@H](CNC(=O)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1)Nc1ccccc1 514939634 TZQOSJWXQHXAFY-HXUWFJFHSA-N 478.515 5.083 5 20 JKBD COc1cc(C(=O)Nc2ccc(Oc3ccc(C(F)(F)F)cc3)nc2)c([N+](=O)[O-])cc1OC 517844165 KRBZMOYPNHSPNQ-UHFFFAOYSA-N 463.368 5.070 5 20 JKBD CC(C)N(C)CC1CCN(C(=O)C/C(=C\c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)CC1 519920926 JGBFXYWREFMEPW-CJLVFECKSA-N 492.645 5.714 5 20 JKBD O=C(Cc1coc(-c2ccc(Cl)cc2)n1)N(Cc1ccccc1[N+](=O)[O-])CC(F)(F)F 521533053 GGVRAKASQHHJNW-UHFFFAOYSA-N 453.804 5.037 5 20 JKBD O=[N+]([O-])c1cc(Br)ccc1Sc1nnc(-c2ccccc2Br)o1 524161551 BJQXKZFTKVTAHZ-UHFFFAOYSA-N 457.103 5.321 5 20 JKBD Cc1nn(Cc2ccc(C(=O)Nc3cc(-c4ccoc4)nn3-c3ccccc3)cc2)c(C)c1[N+](=O)[O-] 604518301 BWKFIXLQEIBLLM-UHFFFAOYSA-N 482.500 5.154 5 20 JKBD C[C@H](Sc1nc2cc3ccccc3cc2c(=O)n1C)C(=O)N[C@@H](C)c1cc2ccccc2o1 622146056 HPVHJTXOJNRAQQ-HOTGVXAUSA-N 457.555 5.191 5 20 JKBD O=C(COC(=O)Cc1csc(-c2cccc(C(F)(F)F)c2)n1)Nc1ccc(Cl)cc1[N+](=O)[O-] 725969622 OHSXMPJANQLUIY-UHFFFAOYSA-N 499.854 5.115 5 20 JKBD Cc1cc[n+](/C(C(=S)Nc2c(Cl)ccc(C)c2Cl)=C(/O)c2ccc(C)c([N+](=O)[O-])c2)cc1 728558793 RXUIVCIEDJPFOJ-UHFFFAOYSA-O 489.404 6.438 5 20 JKBD O=C(COC(=O)c1sc2cc(Br)ccc2c1Cl)Nc1ccccc1[N+](=O)[O-] 729873064 UGKSYLSLKQANKA-UHFFFAOYSA-N 469.700 5.021 5 20 JKBD CN(Cc1cc([N+](=O)[O-])ccc1Cl)C(=O)c1ccc(NCc2ccccc2)c([N+](=O)[O-])c1 772462248 VTMXEHIESFJSQC-UHFFFAOYSA-N 454.870 5.041 5 20 JKBD Cc1cc([N+](=O)[O-])ccc1NC(=O)CSc1nnc(Nc2ccc(SC(F)F)cc2)s1 811819408 QJTCNEQYIDDKLU-UHFFFAOYSA-N 483.547 5.544 5 20 JKBD CCc1ccc(N(C(C)=O)c2nc(COC(=O)CSc3ccccc3[N+](=O)[O-])cs2)cc1 819011678 VQAILWYYWIEUTA-UHFFFAOYSA-N 471.560 5.134 5 20 JKBD COc1ccc(Br)cc1-c1nc(COC(=O)CSc2ccccc2[N+](=O)[O-])cs1 819040578 NIWRRVITQMJAKB-UHFFFAOYSA-N 495.376 5.325 5 20 JKBD C[C@H](OC(=O)/C=C\c1ccc(-c2ccc(F)cc2)s1)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 842099939 JRGMHMNASYYBKT-FZDNWWAKSA-N 465.462 5.830 5 20 JKBD COc1cc(CNc2ccc([C@@H](O)C(F)(F)F)cc2)c([N+](=O)[O-])cc1OCc1ccccc1 864043178 GYJXNXFHWFXZGY-JOCHJYFZSA-N 462.424 5.390 5 20 JKBD COc1ccc(CSCc2nc(-c3ccc(Cn4cnc5ccccc54)cc3)no2)cc1[N+](=O)[O-] 904472423 JEWJULHEVHAMOO-UHFFFAOYSA-N 487.541 5.485 5 20 JKBD COc1ccccc1-c1nnc(SCc2cc(F)ccc2[N+](=O)[O-])n1CCc1ccccc1 915789939 WAAAHFAFVHGFJP-UHFFFAOYSA-N 464.522 5.536 5 20 JKBD COC(=O)Nc1ccc(NC(=O)C/C(=C\c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)cc1 916475433 PPEDZEKOXPXDHN-SAPNQHFASA-N 488.525 5.952 5 20 JKBD COc1ccc(NC(=O)c2ccc(Cl)c([N+](=O)[O-])c2)cc1NC(=O)c1ccc(Cl)cc1F 917788072 WBVOCJHOORTOGN-UHFFFAOYSA-N 478.263 5.554 5 20 JKBD Cc1cc(-c2ccccc2)ccc1NC(=O)c1cc([N+](=O)[O-])ccc1I 918563607 XSCVGYOOAFTRMO-UHFFFAOYSA-N 458.255 5.427 5 20 JKBD Cc1cccc(NC(=O)[C@@H](OC(=O)c2ccc(N[C@H](C)c3ccccn3)c([N+](=O)[O-])c2)C(C)C)c1C 920543467 FEAIEMDWBNRNPL-CLOONOSVSA-N 490.560 5.600 5 20 JKBD O=C(NC1(c2ccc(NC(=O)c3cccc(F)c3[N+](=O)[O-])cc2)CCC1)c1ccc(C(F)(F)F)[nH]1 1790700931 CIJSQCFKWMGFRG-UHFFFAOYSA-N 490.413 5.142 5 20 JKBD Cc1ncc(C(=O)NC2(c3ccc(NC(=O)c4cc(Cl)cc([N+](=O)[O-])c4C)cc3)CCC2)s1 1790774564 MUBXRPGLDBFFEM-UHFFFAOYSA-N 484.965 5.383 5 20 JKBD O=C(NC1(c2ccc(NC(=O)c3cccc4ccoc34)cc2)CCC1)c1ccc([N+](=O)[O-])cc1F 1790956351 BVYWLFKTDRKURF-UHFFFAOYSA-N 473.460 5.542 5 20 JKBD O=C(Cc1ccc([N+](=O)[O-])cc1F)Nc1ccc(C2(NC(=O)[C@@H](F)c3ccccc3)CCC2)cc1 1791184329 OOUDHIPVHDWBQL-DEOSSOPVSA-N 479.483 5.121 5 20 JKBD O=C(Nc1cc([C@@H]2CCCCN2C(=O)CCc2cccc([N+](=O)[O-])c2)[nH]n1)c1cc2ccoc2s1 1817822562 ADGUENIRZRQUMS-IBGZPJMESA-N 493.545 5.064 5 20 JKBD Cc1c(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)c3ccccc3F)[nH]n2)cc(Cl)cc1[N+](=O)[O-] 1821294680 ULYSPAQWFNBQGG-IBGZPJMESA-N 485.903 5.039 5 20 JKBD Cc1ccc(-c2cc(C(=O)N3CCCC[C@@H]3C3CCN(C(=O)c4ccc([N+](=O)[O-])o4)CC3)c[nH]2)cc1 1825423214 WXTGXYZGYXSLOK-HSZRJFAPSA-N 490.560 5.038 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)N1CCC([C@@H]2CCCCN2C(=O)C2(C(F)(F)F)CCC2)CC1 1826762783 AAHPSLJASVGFAW-IBGZPJMESA-N 499.505 5.008 5 20 JKBD C/C(=C\c1cccs1)C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cc(F)cc([N+](=O)[O-])c2)CC1 1830613248 VXOOHJZYAKJUMF-GNBRFLJNSA-N 485.581 5.132 5 20 JKBD O=C(c1cc2ccccc2o1)N1CCC([C@H]2CCCCN2C(=O)c2cccc(F)c2[N+](=O)[O-])CC1 1830622178 SPYNAQSXULYUAY-OAQYLSRUSA-N 479.508 5.027 5 20 JKBD O=C(c1cc(F)cc(Cl)c1)N1CCC([C@@H]2CCCCN2C(=O)/C=C/c2ccccc2[N+](=O)[O-])CC1 1832903475 DVSUXGMCLUPEMW-YVSHKSEASA-N 499.970 5.334 5 20 JKBD C[C@@H](Sc1nnc(-c2ccc(Cl)cc2)n1C)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 9532141 MPICDSAGBBRXLM-SNVBAGLBSA-N 485.875 5.182 5 20 JKBD Cc1c(Cl)cccc1-n1c(S[C@@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2)nnc1-c1ccncc1 10318172 AQXHWEFGJUUCGZ-HNNXBMFYSA-N 494.964 5.319 5 20 JKBD COc1ccc(-c2cc(C(=O)Nc3cc4c(cc3[N+](=O)[O-])OCCCO4)c3ccccc3n2)cc1 10963896 SMMZGWMXCHUZDW-UHFFFAOYSA-N 471.469 5.232 5 20 JKBD Cc1ccccc1-c1cc(C(=O)O[C@@H](C)C(=O)Nc2ccccc2[N+](=O)[O-])c2cnn(C(C)C)c2n1 14362368 XSEJXLVZTXDNPG-KRWDZBQOSA-N 487.516 5.080 5 20 JKBD COc1ccc(NC(=O)[C@@H](C)OC(=O)c2cc(-c3cccs3)nc3ccccc23)c([N+](=O)[O-])c1 16911743 HESYPUGHJPSIOI-CQSZACIVSA-N 477.498 5.064 5 20 JKBD COc1cc(/C=C(\Cl)c2nc3sc(-c4ccccc4)cc3c(=O)[nH]2)cc([N+](=O)[O-])c1O 18065236 SQRWGMWYZAJESD-AUWJEWJLSA-N 455.879 5.011 5 20 JKBD CCOc1cc(C(=O)Nc2nc(-c3ccc4c(c3)CCCC4)cs2)c([N+](=O)[O-])cc1OC 18080886 PWIRIDZGKQUDKR-UHFFFAOYSA-N 453.520 5.257 5 20 JKBD CC(C)n1c(S[C@@H](C)C(=O)Nc2cc([N+](=O)[O-])ccc2Cl)nc2cc(Cl)ccc2c1=O 24966636 NGNSYJRVWCFWBG-NSHDSACASA-N 481.361 5.312 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Cl)[C@H](NCC1(c2ccccc2)CCOCC1)c1ccccc1 30507552 JYYVEMVIXIRHPI-XMMPIXPASA-N 479.964 5.266 5 20 JKBD CC(C)N(C[C@H](O)COc1cccc2ccccc12)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl 97529235 KFSITYPPPJRJAL-SFHVURJKSA-N 457.914 5.084 5 20 JKBD Cc1cc(N2CCSCC2)ccc1NC(=O)c1ccc(N[C@@H](C)c2ccccn2)c([N+](=O)[O-])c1 215767357 HVBFYJUMAXAFIB-SFHVURJKSA-N 477.590 5.277 5 20 JKBD O=C1CCCc2cc(N[C@@H](C(=O)Nc3ccc([N+](=O)[O-])cc3Cl)c3ccccc3)ccc2N1 488564605 DTHFIISDLGRBAH-HSZRJFAPSA-N 464.909 5.315 5 20 JKBD COc1cc([C@@H]2Nc3ccccc3C(=O)N2Cc2cccnc2)ccc1OCc1ccc([N+](=O)[O-])cc1 489291663 ROFVNCVALQWWCA-HHHXNRCGSA-N 496.523 5.344 5 20 JKBD Cc1cc(C(=O)N2CCC[C@@H](C)C2)ccc1NC(=O)c1csc(-c2ccc([N+](=O)[O-])cc2)n1 495547879 NELHLJZVNSYBFU-OAHLLOKOSA-N 464.547 5.151 5 20 JKBD CC[C@@H](C)Sc1ccc(NC(=O)Cn2c(=O)oc3cc([N+](=O)[O-])ccc32)c(C(F)(F)F)c1 499531465 TVWSLNXUGUMYBY-LLVKDONJSA-N 469.441 5.051 5 20 JKBD O=C(C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1)N1CCC[C@@H]1c1cccc(Cl)c1 502989745 IJBXVHWAKFLTRY-LJQANCHMSA-N 481.902 5.847 5 20 JKBD Cc1cc(C)n(-c2cccc(NC(=O)c3ccc(N[C@@H](C)c4ccccn4)c([N+](=O)[O-])c3)c2)n1 507053725 PHFDCMBJDUZALL-SFHVURJKSA-N 456.506 5.218 5 20 JKBD CC(C)c1noc(CCC(=O)Nc2cc([N+](=O)[O-])ccc2Nc2cccc(C(F)(F)F)c2)n1 512197828 CPRRCJYTRVRTKX-UHFFFAOYSA-N 463.416 5.435 5 20 JKBD CC(C)OCc1c(C(=O)N2CCN(c3ccc(C(F)(F)F)cc3[N+](=O)[O-])CC2)oc2ccccc12 514517916 AZPGSNXOQAIIDL-UHFFFAOYSA-N 491.466 5.247 5 20 JKBD CN(Cc1ccccc1[N+](=O)[O-])C(=O)N[C@@H](c1ccccc1)c1ccc(Br)cc1 518920845 QOSWIDVOMKJQQX-NRFANRHFSA-N 454.324 5.288 5 20 JKBD CCn1c2ccccc2c2cc(NC(=O)c3cc(OC)c(OC(F)F)cc3[N+](=O)[O-])ccc21 585689278 HKCCFOBVQKBDGC-UHFFFAOYSA-N 455.417 5.585 5 20 JKBD O=C(Nc1cc(Cl)ccc1OCC(F)(F)F)C1CCN(c2ccccc2[N+](=O)[O-])CC1 593240013 XEVSZRFIKZCMQA-UHFFFAOYSA-N 457.836 5.044 5 20 JKBD CCOc1cc([N+](=O)[O-])c(C(=O)Nc2ncc(Cc3ccc(C(F)(F)F)cc3)s2)cc1OC 602225628 MEXQMKSCUUAIQN-UHFFFAOYSA-N 481.452 5.321 5 20 JKBD CC(=O)Nc1cc(NC(=O)C/C(=C/c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)ccc1F 602246700 PLXLUXLOKVXWJM-ATVHPVEESA-N 490.516 5.871 5 20 JKBD O=C(Nc1cc([N+](=O)[O-])ccc1OC(F)F)c1ccc(Oc2cccc(Br)c2)nc1 603755611 OWAASTZLBKJJCA-UHFFFAOYSA-N 480.221 5.398 5 20 JKBD COc1cc2c(cc1OC)CN(Cc1ccccc1NC(=O)c1cc3cc([N+](=O)[O-])ccc3o1)CC2 604471561 NSOYCNJIJURHEZ-UHFFFAOYSA-N 487.512 5.169 5 20 JKBD COc1cccc(N2CC[C@@H](NC(=O)c3ccc(Oc4ccc(Cl)cc4[N+](=O)[O-])c(OC)c3)C2)c1 609106322 KKSAZTURBKTOCW-GOSISDBHSA-N 497.935 5.066 5 20 JKBD CC(C)(C)OC(=O)N1CCc2cc(NC(=O)CSc3ccc(C(F)(F)F)cc3[N+](=O)[O-])ccc21 726511855 ZYCPHBPJNFUGAG-UHFFFAOYSA-N 497.495 5.642 5 20 JKBD O=C(Cn1c2ccccc2c(=O)c2ccccc21)Nc1cccc(CC[C@@H](O)c2ccccc2)c1 727762010 GBDBWCHIOAXLKL-MUUNZHRXSA-N 462.549 5.460 5 20 JKBD Cc1cc(O[C@H](C)c2ccccc2)ccc1NC(=O)c1cc([N+](=O)[O-])ccc1Br 728011625 OFKINJUEMUQSIJ-OAHLLOKOSA-N 455.308 6.058 5 20 JKBD CCCc1nc(COC(=O)c2ccccc2NC(=O)c2ccc([N+](=O)[O-])cc2Cl)cs1 728319326 PKDHVLSYCSQDSL-UHFFFAOYSA-N 459.911 5.267 5 20 JKBD CC(=O)N(c1nc(COC(=O)c2c(Cl)cccc2[N+](=O)[O-])cs1)c1cccc(C)c1C 730643148 LXUFFTBVFCOINA-UHFFFAOYSA-N 459.911 5.363 5 20 JKBD C[C@H](OC(=O)c1cccc(OC2CCCC2)c1)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 731262033 MNDHXHXQWQRYHI-ZDUSSCGKSA-N 466.412 5.119 5 20 JKBD Cc1ccnn1-c1ccc(C(=O)O[C@@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2ccccc2)cc1 749960237 QCYXERGFFXPKPI-HSZRJFAPSA-N 490.903 5.279 5 20 JKBD Cc1cc(C(=O)N2CCC[C@@H]2c2nc(-c3ccc(Oc4ccc(F)cc4)nc3)no2)ccc1[N+](=O)[O-] 904508049 MTLGJDHVXUDYEH-OAQYLSRUSA-N 489.463 5.257 5 20 JKBD Cc1oc(-c2cccs2)nc1C(=O)Oc1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2Cl)cc1 915811367 QRNRCALEGAYHCU-UHFFFAOYSA-N 483.889 5.745 5 20 JKBD COc1ccc(NC(=O)c2cc(OCC(F)(F)F)ccc2[N+](=O)[O-])cc1OC1CCCC1 915845183 YYMQQQOGOGAMSF-UHFFFAOYSA-N 454.401 5.118 5 20 JKBD O=C(Nc1cc(Cl)c([N+](=O)[O-])cc1OCc1ccccc1)c1ccc(NC(=O)C2CC2)cc1 916827776 XSDRTHMYFVJQEN-UHFFFAOYSA-N 465.893 5.428 5 20 JKBD CC(=O)N(c1ccc(C)cc1)c1nc(/C=C2/N=C(c3ccc(Cl)c([N+](=O)[O-])c3)OC2=O)cs1 917601046 LDOVBZMZVZEGHF-VCHYOVAHSA-N 482.905 5.042 5 20 JKBD CCC(CC)c1cc[n+](/C(C(=S)N[C@H](C)c2ccccc2)=C(/O)c2cccc([N+](=O)[O-])c2)cc1 917614679 XUXOTVJXBDOINS-LJQANCHMSA-O 476.622 6.348 5 20 JKBD CN(C(=O)Cc1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2N2CCCCC2)cc1)c1ccccc1 917780112 FNLKCRVCLYDLCF-UHFFFAOYSA-N 472.545 5.043 5 20 JKBD O=C(Nc1ccc(F)c([N+](=O)[O-])c1)c1ccc(NC(=O)c2cccc(Br)c2)cc1 918554237 PFEJNVJSIKZCOS-UHFFFAOYSA-N 458.243 5.001 5 20 JKBD C[C@@H](OC(=O)CCOc1cccc(Cl)c1Cl)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 919414167 CHKQBIDHPZCNEC-SNVBAGLBSA-N 495.237 5.260 5 20 JKBD CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)c1ccc(N[C@@H](C)c2ccccn2)c([N+](=O)[O-])c1 919869076 IKDAPKGBJGYIQQ-KRWDZBQOSA-N 463.494 5.122 5 20 JKBD O=C(/C=C/C1CC1)NC1(c2ccc(NC(=O)Cc3cc(Br)ccc3[N+](=O)[O-])cc2)CCC1 1786072452 XNABGLNFRXYWPL-NYYWCZLTSA-N 498.377 5.000 5 20 JKBD O=C(CCc1cccc([N+](=O)[O-])c1)Nc1ccc(C2(NC(=O)CCC(F)(F)F)CCC2)cc1 1786600071 IBYIRDOYWATNQR-UHFFFAOYSA-N 463.456 5.004 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)c3ccc([N+](=O)[O-])o3)CCC2)cc1)c1cc2cc(F)c(F)cc2[nH]1 1789229525 MCZGFLDYJPEBSV-UHFFFAOYSA-N 480.427 5.009 5 20 JKBD O=C(Cc1cccc([N+](=O)[O-])c1)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(-c2ccc(Cl)cc2)o1 1796962139 NCBMPVMQJDMIHY-WKCHPHFGSA-N 493.947 5.003 5 20 JKBD CC(C)[C@@H](C(=O)N1CCCC[C@H]1C1CCN(C(=O)Cc2cccc([N+](=O)[O-])c2)CC1)c1ccccc1 1824237115 YEJZPVOLVHLDRG-XTEPFMGCSA-N 491.632 5.197 5 20 JKBD Cc1cc(CCCC(=O)N2CCC([C@@H]3CCCCN3C(=O)[C@@]3(C)C[C@H]3C)CC2)c([N+](=O)[O-])cc1F 1830216702 SIRHISHZNMQALL-HEXNQTKTSA-N 487.616 5.031 5 20 JKBD CC(C)=CCCC(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cc(Cl)cc([N+](=O)[O-])c2C)CC1 1830257730 VGWGBLRVLRFLRV-JOCHJYFZSA-N 476.017 5.536 5 20 JKBD COc1ccc(N2C(=O)/C(=C\c3cccs3)N=C2S/C=C/c2ccc([N+](=O)[O-])o2)cc1Cl 8704704 YYVQWEQUJBIZPE-WJISXQBPSA-N 487.946 6.059 5 20 JKBD COc1cc(C(=O)NCc2ccc(Oc3ccc(F)cc3)cc2)c([N+](=O)[O-])cc1OC(F)F 11915655 FWZGINYLDFPOAA-UHFFFAOYSA-N 462.380 5.066 5 20 JKBD Cc1cccc(-c2nnc([C@H](C)OC(=O)c3ccccc3C(=O)c3ccc(Cl)c([N+](=O)[O-])c3)o2)c1 17528578 MHCPYKDQPCPVLU-HNNXBMFYSA-N 491.887 5.756 5 20 JKBD O=C(C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1)N(Cc1ccco1)Cc1cccs1 18093499 RTHLVSPDEVCREW-UHFFFAOYSA-N 493.507 5.714 5 20 JKBD CN(Cc1cn(Cc2ccccc2Cl)nc1-c1ccccc1)C(=O)Cc1ccccc1[N+](=O)[O-] 19617476 UQSBGOYKWNXCIO-UHFFFAOYSA-N 474.948 5.361 5 20 JKBD O=C(Nc1ccc(CN2CCCC2)cc1)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 28163896 CWXUTGAYIJXZQD-UHFFFAOYSA-N 476.499 5.065 5 20 JKBD COc1ccc(-n2c(SCc3nnc(-c4ccc([N+](=O)[O-])cc4)o3)nc3ccccc32)cc1 72020610 AWYQVIJKUFAIBI-UHFFFAOYSA-N 459.487 5.285 5 20 JKBD O=C(c1ccc(-n2ccnc2)c([N+](=O)[O-])c1)N(Cc1ccc(Cl)c(Cl)c1)Cc1ccccn1 72052688 JBOVNFBWUUCGDF-UHFFFAOYSA-N 482.327 5.325 5 20 JKBD COc1ccc(N2C(=O)/C(=C/c3cccs3)N=C2S/C=C\c2ccc([N+](=O)[O-])o2)cc1Cl 96936390 YYVQWEQUJBIZPE-JYSANEKESA-N 487.946 6.059 5 20 JKBD C[C@@H](Nc1ccc(C(=O)N2CCC[C@H]2c2nc3ccccc3s2)cc1[N+](=O)[O-])c1ccccn1 108753513 JAHUBARREMWZRF-IERDGZPVSA-N 473.558 5.750 5 20 JKBD C[C@@H](Nc1ccc(C(=O)N2CCC(c3c[nH]c4ncccc34)CC2)cc1[N+](=O)[O-])c1ccccn1 108830626 IFCKYQISQCPORI-QGZVFWFLSA-N 470.533 5.059 5 20 JKBD COc1cc(C(=O)N[C@H](c2nc(C3CC3)no2)C(C)C)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 110699917 XPYZXGHLIXVHSU-FQEVSTJZSA-N 486.912 5.437 5 20 JKBD C[C@H](Nc1ccc(C(=O)Nc2cccc(C(=O)N3CCCCC3)c2)cc1[N+](=O)[O-])c1ccccn1 410085347 ICISZXQRVYYTHF-SFHVURJKSA-N 473.533 5.041 5 20 JKBD COc1ccc(CSCC(=O)N[C@@H](C)c2sc(-c3ccc(C)cc3)nc2C)cc1[N+](=O)[O-] 502511657 MWMWFKDTARAFKI-HNNXBMFYSA-N 471.604 5.454 5 20 JKBD Cc1ccc(C(=O)Nc2cccc(CNc3ccc([N+](=O)[O-])c(C(=O)N4CCCC4)c3)c2)cc1 510742878 KHXFEPKEICXKTL-UHFFFAOYSA-N 458.518 5.004 5 20 JKBD Cc1cc(NC(=O)c2ccc(C)c(NC(=O)c3ccccc3F)c2)n(-c2ccc([N+](=O)[O-])cc2)n1 515216291 LCUYPIAFGJTZPW-UHFFFAOYSA-N 473.464 5.041 5 20 JKBD COc1cc(F)cc2sc(NC(=O)c3ccc(N[C@@H](C)c4ccccn4)c([N+](=O)[O-])c3)nc12 520468936 OFPSSZKXAHYXOG-LBPRGKRZSA-N 467.482 5.173 5 20 JKBD O=C(CCn1cc([N+](=O)[O-])cn1)Nc1ccc(Oc2ccccc2Br)c(Cl)c1 521712921 NJDPIRDBZDEICO-UHFFFAOYSA-N 465.691 5.028 5 20 JKBD O=C(Nc1ccc(N2CCOCC2)c2ccncc12)c1cc([N+](=O)[O-])ccc1Sc1ccccc1 590654723 YIDUXOKTQPTTRT-UHFFFAOYSA-N 486.553 5.383 5 20 JKBD COc1cc(C(=O)Nc2ncnc3oc(C)c(C)c23)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 591274997 INJXHHQUZWBWFA-UHFFFAOYSA-N 468.853 5.454 5 20 JKBD Cc1nn(Cc2ccc(C(=O)N[C@@H]3C[C@@H](C(F)(F)F)C[C@@H](C(F)(F)F)C3)cc2)c(C)c1[N+](=O)[O-] 603573150 UVZDQVVFIZRUAJ-FVQHAEBGSA-N 492.420 5.096 5 20 JKBD O=C1CCc2cc([N+](=O)[O-])c(NCc3cn(Cc4ccccc4)nc3-c3ccccc3)cc2N1 603845150 IAZZHPHMNAJSIB-UHFFFAOYSA-N 453.502 5.003 5 20 JKBD COc1ccc([C@H](Cc2ccc(F)cc2)NC(=O)c2cc(OC)c(OC(F)F)cc2[N+](=O)[O-])cc1 604456858 PMYBIZABCDKOFJ-IBGZPJMESA-N 490.434 5.066 5 20 JKBD O=C(CCc1ccccc1OC(F)(F)F)N(Cc1ccccc1[N+](=O)[O-])CC(F)(F)F 608937448 XTZAVPLINFJCOM-UHFFFAOYSA-N 450.335 5.017 5 20 JKBD COCCOc1ccc(F)cc1NC(=O)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])c(OC)c1 608945774 AINTTZXCOYGMDR-UHFFFAOYSA-N 490.871 5.466 5 20 JKBD O=C(c1cc([N+](=O)[O-])ccc1Sc1ccc(Cl)cc1)N1CCCN(Cc2cscn2)CC1 608966989 CMRVWVDCTKFBFY-UHFFFAOYSA-N 489.022 5.204 5 20 JKBD C[C@@H](NC(=O)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1)C(C)(C)c1ccccc1 609063937 TWCMIRFPDZFBSJ-MRXNPFEDSA-N 463.500 5.313 5 20 JKBD CCC[C@H](NC(=O)N1CCN(Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)CC1)c1ccccn1 609150578 BHUUAQZQAHDIOP-QFIPXVFZSA-N 479.606 5.087 5 20 JKBD Cc1ccc(/C(O)=C(/C(=S)Nc2ccccc2-c2ccccc2)[n+]2ccccc2)cc1[N+](=O)[O-] 725763301 JFTBQDKVYZUZOR-UHFFFAOYSA-O 468.558 6.181 5 20 JKBD Cc1ccc(C)c(NC(=O)[C@H](OC(=O)c2cc([N+](=O)[O-])ccc2Br)c2ccccc2)c1 725985288 JTAZYYLDVPUJEY-OAQYLSRUSA-N 483.318 5.511 5 20 JKBD COC[C@@H](C)n1c(SCC(=O)OCc2nc3ccccc3c3ccccc23)nnc1-c1ccccc1 726023281 YPPWZWDSJAQYRC-LJQANCHMSA-N 498.608 5.689 5 20 JKBD CC(C)OCc1c(C(=O)N2CCN(c3ccc([N+](=O)[O-])cc3C(F)(F)F)CC2)oc2ccccc12 727329808 PTFNBBZNODQDHH-UHFFFAOYSA-N 491.466 5.247 5 20 JKBD CCCO[C@H]1CCCN(C(=O)c2cc([N+](=O)[O-])ccc2N2CCC(Cc3ccccc3)CC2)CC1 730990419 WJVOFFATRMYEQP-VWLOTQADSA-N 479.621 5.475 5 20 JKBD Cc1cccc(-c2nnc([C@H](C)OC(=O)c3ccc(N4CCC(C)CC4)c([N+](=O)[O-])c3)o2)c1 745931651 YTYOUBLYHIBFCS-KRWDZBQOSA-N 450.495 5.108 5 20 JKBD CN(C)Cc1ccc(CN(C)C(=O)c2ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])cc2)cc1 750582313 WXDAWDOHULGXCP-UHFFFAOYSA-N 453.926 5.374 5 20 JKBD Cc1ccc(NC(=O)[C@H](OC(=O)c2cc(C(C)C)nc3onc(C)c23)c2ccccc2)c([N+](=O)[O-])c1 813364236 KUMPIZRRCBZNOE-HSZRJFAPSA-N 488.500 5.408 5 20 JKBD Cc1csc(Sc2ccc(C(=O)O[C@H](C)C(=O)Nc3ccc(F)cc3Cl)cc2[N+](=O)[O-])n1 849119907 AGJUYSILDKVGDX-LLVKDONJSA-N 495.941 5.487 5 20 JKBD O=C(COc1ccccc1C(=O)Nc1ccc(F)c([N+](=O)[O-])c1)Nc1ccc(SC(F)F)cc1 913185213 IWILPKUTJZULOS-UHFFFAOYSA-N 491.447 5.318 5 20 JKBD CCN(c1ccccc1)S(=O)(=O)c1ccc(Cl)c(C(=O)Nc2cc([N+](=O)[O-])c(C)cc2C)c1 913418998 BNAXNGKVUKKABH-UHFFFAOYSA-N 487.965 5.333 5 20 JKBD O=C1CCCc2cc(C(=O)O[C@H](C(=O)Nc3ccc([N+](=O)[O-])cc3Cl)c3ccccc3)ccc2N1 915436647 MNTBMKPDWVYYJM-QHCPKHFHSA-N 493.903 5.060 5 20 JKBD O=[N+]([O-])c1ccc(NC(=S)N(Cc2ccc(Br)cc2)c2ccc(F)cc2F)cc1 917586895 BTVGGVADILLUKI-UHFFFAOYSA-N 478.318 6.039 5 20 JKBD COc1ccc(NC(=O)c2c(NC(=O)c3cc(OC)ccc3[N+](=O)[O-])sc3c2CCCC3)cc1 920275915 SOSASABIQGLXLC-UHFFFAOYSA-N 481.530 5.057 5 20 JKBD O=C(OCC[C@H]1CCCCN1C(=O)c1cnc(-c2ccccc2F)s1)c1cccc([N+](=O)[O-])c1 920291180 VXXRFRBNZGADTQ-QGZVFWFLSA-N 483.521 5.099 5 20 JKBD Cc1ccc(-c2nc(COC(=O)c3ccc(N[C@@H](C)c4ccccn4)c([N+](=O)[O-])c3)cs2)o1 920543655 HFSZCFCFQYQSGG-HNNXBMFYSA-N 464.503 5.545 5 20 JKBD O=C(Cc1cccc([N+](=O)[O-])c1)Nc1ccc(C2(NC(=O)c3cc(-c4ccccc4)on3)CCC2)cc1 1785791925 NSMXILDULZIVEM-UHFFFAOYSA-N 496.523 5.240 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)c3n[nH]cc3[N+](=O)[O-])CCC2)cc1)c1ccccc1Oc1ccccc1 1790228954 FTNMAHRJZDSSDG-UHFFFAOYSA-N 497.511 5.172 5 20 JKBD O=C(/C=C/c1ccccc1[N+](=O)[O-])Nc1ccc(C2(NC(=O)c3n[nH]c4cccc(F)c34)CCC2)cc1 1792317249 GWNDYICOWRUWSJ-NTEUORMPSA-N 499.502 5.071 5 20 JKBD CC[C@H](C)[C@H](C(=O)N1CCCC2(CCN(C(=O)c3cc(F)cc([N+](=O)[O-])c3)CC2)C1)c1ccccc1 1809163527 RTMZIXUTDPUPOS-CPJSRVTESA-N 495.595 5.409 5 20 JKBD O=C(Nc1cc([C@@H]2CCCCN2C(=O)/C=C/c2ccccc2[N+](=O)[O-])[nH]n1)c1cc(F)ccc1Cl 1821126390 QJCDLBYSWJYAHY-MAIVGLDJSA-N 497.914 5.130 5 20 JKBD CCCCC[C@@H](C)C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2ccc([N+](=O)[O-])c(OC)c2)CC1 1832696641 DAMPMOLZWOBJGX-KNQAVFIVSA-N 473.614 5.053 5 20 JKBD COc1cc(C(=O)N2CCCC[C@H]2C2CCN(C(=O)c3ccc(C)cc3Cl)CC2)ccc1[N+](=O)[O-] 1832697540 PDGHATOALRVVMY-QFIPXVFZSA-N 499.995 5.112 5 20 JKBD CC(C)[C@H]1CC[C@H](C(=O)N2CC3(CCCN3C(=O)c3cc4cc([N+](=O)[O-])ccc4s3)C2)CC1 1845739506 HPCLDVPMUCEPSJ-IYARVYRRSA-N 469.607 5.089 5 20 JKBD CC(C)(C)CCCCCC(=O)N1CCCC12CN(C(=O)c1cc(Br)ccc1[N+](=O)[O-])C2 1846086966 CTFXQEAEDLJWDC-UHFFFAOYSA-N 494.430 5.171 5 20 JKBD C[C@@H](NCC(c1ccccc1)c1ccccc1)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 11046254 YJRKLKWAXXQXMO-MRXNPFEDSA-N 457.452 5.362 5 20 JKBD C[C@H](OC(=O)CCc1ncc(-c2ccc(Cl)cc2)o1)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl 12259020 FHGHDXNGTCYECW-LBPRGKRZSA-N 478.288 5.060 5 20 JKBD NC(=O)c1ccc(NC(=O)c2c3c(nc4ccccc24)/C(=C/c2cccc([N+](=O)[O-])c2)CCC3)cc1 14215398 CDTIUSUQLACEIV-XDJHFCHBSA-N 478.508 5.371 5 20 JKBD O=C(Cn1c2ccccc2c(=O)c2ccccc21)Nc1nc(-c2ccc(Br)s2)cs1 14809489 MXNWFRMETCAQOC-UHFFFAOYSA-N 496.411 5.741 5 20 JKBD O=C(Nc1ccccc1F)C(=Cc1ccc(Cl)c([N+](=O)[O-])c1)C(=O)Nc1ccccc1F 16441666 STLLIVIMVMPSGL-UHFFFAOYSA-N 457.820 5.187 5 20 JKBD CCn1c(S[C@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)nnc1-c1ccc(C(C)(C)C)cc1 17710885 KELFENGZLAPOTD-OAHLLOKOSA-N 478.578 6.074 5 20 JKBD O=C(C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1)N(Cc1ccccc1F)C1CC1 18213822 RLWUVXVWMTVHCP-UHFFFAOYSA-N 465.447 5.160 5 20 JKBD COc1ccc(C)cc1NC(=O)[C@@H](OC(=O)c1cc(Cl)ccc1[N+](=O)[O-])c1ccccc1 23515089 CLLOPUXHAPOYHM-NRFANRHFSA-N 454.866 5.102 5 20 JKBD CCCCCn1nc(C(=O)Nc2nc(-c3ccc(C)c([N+](=O)[O-])c3)cs2)c2ccccc2c1=O 105349985 JIKCARQCHWBFMU-UHFFFAOYSA-N 477.546 5.179 5 20 JKBD Cc1ccc(OCc2nc(CC(=O)Nc3nc(-c4cccc([N+](=O)[O-])c4)c(C)s3)cs2)cc1 195704068 TUPSMFLOSPZEER-UHFFFAOYSA-N 480.571 5.552 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)Nc2cc(C(F)(F)F)ccc2N2CCCC2)cc1SC 481952888 NLXDQRLLBCXJGT-UHFFFAOYSA-N 455.458 5.197 5 20 JKBD O=C(C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)NCC[C@H]1C(=O)Nc2ccccc21 491196368 QVYPFGFBUUHDIY-BKBDBRRMSA-N 498.564 5.377 5 20 JKBD COc1ccccc1N1CCC(N[C@@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2ccccc2)CC1 493859059 BYZIDJPJQSYHAP-RUZDIDTESA-N 494.979 5.195 5 20 JKBD COc1cc(C(=O)N(Cc2ccc(C(F)(F)F)cc2)C2CC2)c([N+](=O)[O-])cc1OC(F)F 498536381 LNXRHTJLDZJIHM-UHFFFAOYSA-N 460.355 5.028 5 20 JKBD O=C(Nc1cccc(OCc2cscn2)c1)c1cc([N+](=O)[O-])ccc1Sc1ccccc1 505058120 PVOLYMZQKMFQAH-UHFFFAOYSA-N 463.540 6.034 5 20 JKBD Cc1cccc(-c2nnc(-c3ccc(C(=O)N(Cc4ccccc4[N+](=O)[O-])CC(F)(F)F)cc3)o2)c1 514448748 SCBZOCJQHPQYHF-UHFFFAOYSA-N 496.445 5.825 5 20 JKBD O=C(c1ccn(-c2cccc([N+](=O)[O-])c2)n1)N(CCc1ccccc1)c1nc2ccccc2s1 517305968 HJJDYMXFOGUZQJ-UHFFFAOYSA-N 469.526 5.280 5 20 JKBD Cn1ccnc1[C@@H](NCc1ccc(Oc2ccc(F)cc2)c([N+](=O)[O-])c1)c1ccc(Cl)cc1 521821501 ZSTFTHLZQWTEPL-QHCPKHFHSA-N 466.900 5.792 5 20 JKBD Cc1c(NC(=O)c2csc(-c3cccc([N+](=O)[O-])c3)n2)cccc1-c1nnc2n1CCCCC2 522102410 MEPKDRFTCRSJRZ-UHFFFAOYSA-N 474.546 5.264 5 20 JKBD Cc1nn(CCC(=O)N2C[C@@H](c3ccccc3Cl)c3c([nH]c4ccccc34)[C@H]2C)c(C)c1[N+](=O)[O-] 523226875 JXSCCXVGGSIIOW-UZLBHIALSA-N 491.979 5.668 5 20 JKBD O=[N+]([O-])c1ccccc1S(=O)(=O)Nc1nc2nc(-c3cccs3)cc(C(F)(F)F)c2s1 524297707 UQQALBWUJLIZHV-UHFFFAOYSA-N 486.478 5.148 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Cl)[C@H](NCc1cc2ccccc2s1)c1ccccc1 560865776 JENJZVKGMMEMIX-JOCHJYFZSA-N 451.935 5.933 5 20 JKBD O=C(N[C@@H](c1ccccc1)c1ccc2nc(C(F)(F)F)[nH]c2c1)c1c[nH]c2cc([N+](=O)[O-])ccc12 592952589 DUWRKLCLFQZCJU-NRFANRHFSA-N 479.418 5.491 5 20 JKBD Cc1cc(-c2cc(C(=O)Nc3cc([N+](=O)[O-])ccc3OC(F)F)c3c(C)noc3n2)c(C)o1 603638794 UUKQMAAVCILALA-UHFFFAOYSA-N 458.377 5.170 5 20 JKBD COc1cc(C(=O)Nc2cc(C(C)(C)C)nn2-c2cccc(C)c2)c([N+](=O)[O-])cc1OC(F)F 603740192 VPQXYNKVUMFJHH-UHFFFAOYSA-N 474.464 5.249 5 20 JKBD Cc1ccc(NC(=O)c2ccccc2)cc1NC(=O)c1ccc(N2CCC[C@@H](C)C2)c([N+](=O)[O-])c1 603909455 AJMMVWBCWNLMCL-GOSISDBHSA-N 472.545 5.644 5 20 JKBD CC(C)NC(=O)c1ccc(Cl)c(NC(=O)c2ccc(N3C[C@H](C)C[C@@H](C)C3)c([N+](=O)[O-])c2)c1 603975397 YFURPYAIJKODDE-HZPDHXFCSA-N 472.973 5.121 5 20 JKBD C[C@H]1CN(C(=O)c2c3c(nc4ccccc24)/C(=C/c2ccc([N+](=O)[O-])cc2)CCC3)CCCO1 608946512 QLUBEKASFGPBAC-CSRGTXSUSA-N 457.530 5.271 5 20 JKBD O=C(c1ccccc1Sc1ccc(C(F)(F)F)cc1[N+](=O)[O-])N1CCC[C@H](c2ncc[nH]2)C1 609025591 TVBPJGOZPKJJNK-AWEZNQCLSA-N 476.480 5.508 5 20 JKBD O=C(Nc1cccc(OC(F)F)c1)c1ccc(C(=O)Nc2cccc(OC(F)F)c2)c([N+](=O)[O-])c1 609044964 XGEXIYLJDBERKD-UHFFFAOYSA-N 493.369 5.302 5 20 JKBD O=C(c1c2c(nc3ccccc13)/C(=C\c1ccc([N+](=O)[O-])cc1)CCC2)N1CCC[C@@H](n2ccnc2)C1 609131168 JJPCPTUNQSPRNI-FLVWFLKISA-N 493.567 5.694 5 20 JKBD COc1ccccc1OCc1ccc(C(=O)N(CC2CC2)c2ccc(Cl)c([N+](=O)[O-])c2)o1 728166259 YRPCDNRJMBKLMB-UHFFFAOYSA-N 456.882 5.486 5 20 JKBD C[C@H](OC(=O)COC(c1ccccc1)c1ccccc1)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 746241233 FAROCYUTKWMGQF-KRWDZBQOSA-N 459.458 5.055 5 20 JKBD Cc1c(C(=O)Nc2ccccc2SC[C@@H]2CC2(Cl)Cl)cc([N+](=O)[O-])c(C)c1[N+](=O)[O-] 748624898 UMCYRIHPUUOQQG-LBPRGKRZSA-N 470.334 5.658 5 20 JKBD COc1ccccc1Oc1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2Br)cc1F 751106594 AWJGDDFCBQECOR-UHFFFAOYSA-N 461.243 5.550 5 20 JKBD CC(=O)N1CCc2c(sc3nc4c(c(-c5ccc(C)cc5)c23)CN(c2ccc([N+](=O)[O-])cc2)CC4)C1 753916835 FPZKXDJLHPHVPH-UHFFFAOYSA-N 498.608 5.647 5 20 JKBD O=C(C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)OCc1nc(C2CC2)no1 913389038 WRXDFRABAJWBCP-LFIBNONCSA-N 462.487 5.139 5 20 JKBD COc1ccc(Oc2ccc([N+](=O)[O-])cc2C(=O)O[C@H](C)C(=O)N2CCC[C@H]2c2cccs2)cc1 915443116 YRJFBOUOSMJGNH-IERDGZPVSA-N 496.541 5.366 5 20 JKBD Cc1nccn1-c1ccc(NC(=O)C/C(=C\c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)cn1 918588041 OWNBWGLHYQDWDY-XMHGGMMESA-N 496.552 5.663 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)c3ccc([N+](=O)[O-])o3)CCC2)cc1)c1csc(-c2ccccc2)n1 1788834329 FZNIFDDEVMYQCV-UHFFFAOYSA-N 488.525 5.373 5 20 JKBD O=C(C[C@@H]1CCCCO1)NC1(c2ccc(NC(=O)c3cc4cc([N+](=O)[O-])ccc4s3)cc2)CCC1 1791011176 MTNAIUSUTZMEOK-NRFANRHFSA-N 493.585 5.516 5 20 JKBD O=C(Cc1cc(F)ccc1[N+](=O)[O-])Nc1ccc(C2(NC(=O)c3cccc4cccnc34)CCC2)cc1 1792308761 IXQVUTZLRJZQFN-UHFFFAOYSA-N 498.514 5.273 5 20 JKBD CC[C@H](C)[C@@H](C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)/C=C/c1ccccc1[N+](=O)[O-])C2)c1ccccc1 1795575208 UOMNVJARSAUSCR-WFCXNERKSA-N 475.589 5.076 5 20 JKBD Cc1c(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)CC2CCC(C)(C)CC2)cc(Cl)cc1[N+](=O)[O-] 1800234595 YXVCJJCSDRINTH-ACDBMABISA-N 476.017 5.415 5 20 JKBD Cc1c(C(=O)N2CC[C@@H](CNC(=O)C3(C)CCCCC3)[C@H]2c2cccnc2)cc(Cl)cc1[N+](=O)[O-] 1813006580 YCGSAFFGUYGVME-WMZHIEFXSA-N 499.011 5.242 5 20 JKBD Cc1cc(O)c([N+](=O)[O-])cc1C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cccc3ccccc23)n[nH]1 1818454432 WZWMGTLJYDABML-QFIPXVFZSA-N 499.527 5.105 5 20 JKBD Cc1ccc2[nH]c(C(=O)N3CCCC[C@@H]3c3cc(NC(=O)/C=C/c4ccccc4[N+](=O)[O-])n[nH]3)cc2c1 1823505096 VJFWORCWFRJNHU-IYNHSRRRSA-N 498.543 5.127 5 20 JKBD Cc1ccc(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)CSc3ccccc3[N+](=O)[O-])CC2)cc1F 1829968383 KCNZYFIEIFCHDS-JOCHJYFZSA-N 499.608 5.068 5 20 JKBD O=C(c1ccc2occc2c1)N1CCC([C@H]2CCCCN2C(=O)c2ccc([N+](=O)[O-])cc2F)CC1 1830497031 WCDSFIVADMOBRP-HSZRJFAPSA-N 479.508 5.027 5 20 JKBD Cc1cccc2[nH]c(C(=O)N3CCC([C@@H]4CCCCN4C(=O)c4cccc(F)c4[N+](=O)[O-])CC3)cc12 1830622307 WUZPHGMWMXPJBR-DEOSSOPVSA-N 492.551 5.071 5 20 JKBD Cc1nn(-c2ccccc2)c2sc(C(=O)O[C@H](C)c3nnc(-c4ccc([N+](=O)[O-])cc4)o3)cc12 17529580 HXWOPFPPYLZQHY-CQSZACIVSA-N 475.486 5.272 5 20 JKBD C[C@H](c1ccccc1)n1c(SCc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)nc2ccccc2c1=O 29876466 JDDPSNZVTLMJGP-MRXNPFEDSA-N 485.525 5.256 5 20 JKBD CCOc1ccc([C@@H](NC(=O)Cn2c3ccccc3c(=O)c3ccccc32)c2ccccc2)cc1 71891964 STJZLJVCWIODQP-LJAQVGFWSA-N 462.549 5.459 5 20 JKBD O=[N+]([O-])c1ccc(-c2nnc(CSc3nc(-c4ccccc4)c(-c4ccccc4)[nH]3)o2)cc1 79404033 KJGMZZBLBHFUQC-UHFFFAOYSA-N 455.499 5.994 5 20 JKBD COc1ccc(Br)cc1-c1nc(COC(=O)/C=C\c2ccc([N+](=O)[O-])cc2)cs1 104581834 VNCSMLWOFORXQS-WTKPLQERSA-N 475.320 5.246 5 20 JKBD O=C(O[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1)c1ccc(-c2cnco2)cc1 108117869 LTGUSERKEOFXCC-JOCHJYFZSA-N 477.860 5.440 5 20 JKBD CC(=O)N(c1ccc(C)cc1)c1nc(COc2ccc([N+](=O)[O-])cc2C(F)(F)F)cs1 488993392 MKILIRKCEQOLOA-UHFFFAOYSA-N 451.426 5.642 5 20 JKBD CCCN1CCC(CNC(=O)C/C(=C\c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)CC1 500219220 VTBKCFGWBXZLDA-LTGZKZEYSA-N 478.618 5.373 5 20 JKBD Cc1cc(NC(=O)c2ccccc2Cl)sc1C(=O)N1c2ccc([N+](=O)[O-])cc2C[C@@H]1C 504300285 VJFAXTUWNSFLLC-ZDUSSCGKSA-N 455.923 5.462 5 20 JKBD COc1cccc([C@H](CNc2cc3c(cc2[N+](=O)[O-])CCC(=O)N3)c2c[nH]c3ccccc23)c1OC 506819656 BUXNAJTXXBIUND-FQEVSTJZSA-N 486.528 5.222 5 20 JKBD O=C(Nc1cccc(Cl)c1Oc1cccnc1)c1ccc([N+](=O)[O-])cc1I 508568795 KJSHLDCTBBLNSS-UHFFFAOYSA-N 495.660 5.292 5 20 JKBD Cc1nc(-c2ccc(CCNC(=O)Nc3cc([N+](=O)[O-])ccc3OC(F)F)s2)cs1 510835486 UESUUISTBHFWEQ-UHFFFAOYSA-N 454.480 5.054 5 20 JKBD COc1ccc([C@H](NC(=O)c2ccc(Cn3nc(C)c([N+](=O)[O-])c3C)cc2)c2ccc(C)cc2)cc1 512869303 QEJWYTISCADCRW-AREMUKBSSA-N 484.556 5.293 5 20 JKBD COc1ccc([C@H]2CCCN2C(=O)C/C(=C/c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)cc1 515004962 KTIRXZJFIILAKX-WUOJVWERSA-N 499.592 6.508 5 20 JKBD COc1cc(CNCc2csc(Br)c2)ccc1OCc1ccc([N+](=O)[O-])cc1 518274481 KBCPAFSPZUAOLL-UHFFFAOYSA-N 463.353 5.296 5 20 JKBD CCOc1cccc([C@H](C)N[C@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Br)c2ccccc2)c1 521726186 LNVWLYPOKZDNDM-HJPURHCSSA-N 498.377 5.787 5 20 JKBD C[C@H](Nc1ccc(NC(=O)c2cc([N+](=O)[O-])cc(S(C)(=O)=O)c2)cc1Cl)c1ccccc1 524141017 CNGZUGCEVDXGMK-AWEZNQCLSA-N 473.938 5.077 5 20 JKBD O=C(C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)N1CCC[C@@H]1c1ccccc1 590683046 YQKRMEIEONCTRL-VKCJIPKCSA-N 469.566 6.499 5 20 JKBD CCNC(=O)c1cccc(NC(=O)C/C(=C\c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)c1 603390380 YWRXLBXAZCTMMK-XMHGGMMESA-N 486.553 5.524 5 20 JKBD Cc1nc(-c2ccc(NC(=O)CSc3ccc(C(F)(F)F)cc3[N+](=O)[O-])cc2)oc1C 603940056 QINIKAKVNQCRBK-UHFFFAOYSA-N 451.426 5.616 5 20 JKBD Cn1ncc(C(=O)Nc2cc([N+](=O)[O-])ccc2Nc2cccc(C(F)(F)F)c2)c1C(F)F 608932403 HFSUWCHOWLFKGJ-UHFFFAOYSA-N 455.343 5.281 5 20 JKBD Cc1ccc(Sc2ccc(C(=O)N3CCCN(C(=O)CC4CCCC4)CC3)cc2[N+](=O)[O-])cc1 609346895 ZKPXKLXIYFIIDS-UHFFFAOYSA-N 481.618 5.309 5 20 JKBD Cc1ccc(-c2csc(NC(=O)c3ccccc3CS(=O)(=O)c3ccccc3)n2)cc1[N+](=O)[O-] 609407555 QTPKZGPBTJDOSE-UHFFFAOYSA-N 493.566 5.253 5 20 JKBD CC(=O)N(c1nc(/C=C(/c2ccncc2)c2ccc([N+](=O)[O-])cc2)cs1)c1ccc(F)cc1F 610414019 HUIVSDUPUBBBNP-FYJGNVAPSA-N 478.480 5.998 5 20 JKBD O=C(CCC(=O)c1ccc2ccc3cccc4ccc1c2c34)NCc1cccc(N2CCOC2=O)c1 727755504 XCBNYOKGPYUOLE-UHFFFAOYSA-N 476.532 5.820 5 20 JKBD Cc1c(C(=O)Nc2ccc(C(=O)N3CCCC[C@H]3C)c(Cl)c2)cc([N+](=O)[O-])c(C)c1[N+](=O)[O-] 748624577 UATNPBKBXJXUHL-GFCCVEGCSA-N 474.901 5.040 5 20 JKBD Cc1ccc(N2C(=O)CC[C@@H](C(=O)Nc3cc([N+](=O)[O-])c(F)cc3F)[C@H]2c2cccs2)cc1 825487358 APQGVBZYJMKBGK-QRQCRPRQSA-N 471.485 5.366 5 20 JKBD COc1ccc(CNc2ccc(N=S(C)(C)=O)cc2)cc1OCc1ccc([N+](=O)[O-])cc1 864013173 LXUHYKBUTZTYIP-UHFFFAOYSA-N 455.536 5.154 5 20 JKBD O=C(Nc1ccc(OS(=O)(=O)c2ccc(F)cc2Cl)cc1)c1cc([N+](=O)[O-])ccc1Cl 906487210 PKZVNTFQRYEFKV-UHFFFAOYSA-N 485.276 5.061 5 20 JKBD Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)Oc1ccc(C(=O)Nc2ccccc2C(C)C)cc1 912651993 HROATBVFRVLADM-UHFFFAOYSA-N 454.504 5.047 5 20 JKBD CN(Cc1cc([N+](=O)[O-])ccc1Cl)C(=O)[C@H]1CCCN(C(=O)c2ccc(Cl)c(Cl)c2)C1 914849797 ZAZPLSFEVYJNSU-AWEZNQCLSA-N 484.767 5.066 5 20 JKBD CN1CCCN(c2ccc(NC(=O)c3cc([N+](=O)[O-])ccc3Sc3ccccc3)cc2)CC1 916452782 DASXVAWTXXDUMD-UHFFFAOYSA-N 462.575 5.140 5 20 JKBD CCC(CC)(Cc1nc2ccccc2s1)C(=O)OCc1nc(-c2cccc([N+](=O)[O-])c2)no1 919109260 NMRPPPPIWBMWNY-UHFFFAOYSA-N 466.519 5.347 5 20 JKBD Cc1ccc(NC(=O)[C@H](OC(=O)Cc2nc(-c3cccs3)oc2C)c2ccccc2)c([N+](=O)[O-])c1 919248186 FIFLJWVQUBVFAL-HSZRJFAPSA-N 491.525 5.394 5 20 JKBD O=C(Nc1cccc(NC(=O)c2cc([N+](=O)[O-])cc([N+](=O)[O-])c2)c1)Nc1cccc(C(F)(F)F)c1 919871613 WLHKPHCTTKWPNW-UHFFFAOYSA-N 489.366 5.418 5 20 JKBD O=C(CNc1ccccc1[N+](=O)[O-])OCC(=O)N1c2ccccc2Sc2ccc(Cl)cc21 920604972 SZPGSCJZNHHWAH-UHFFFAOYSA-N 469.906 5.033 5 20 JKBD Cc1cc2cc(C(=O)NC3(c4ccc(NC(=O)c5ccc([N+](=O)[O-])o5)cc4)CCC3)ccc2[nH]1 1785751045 JYAZAXXYNJTCSV-UHFFFAOYSA-N 458.474 5.039 5 20 JKBD O=C(/C=C/c1ccc([N+](=O)[O-])o1)Nc1ccc(C2(NC(=O)c3cccc(-c4cnco4)c3)CCC2)cc1 1786207849 NUPPBWNDCUNWPK-PKNBQFBNSA-N 498.495 5.304 5 20 JKBD O=C(NC1(c2ccc(NC(=O)[C@H](F)c3ccccc3)cc2)CCC1)c1cc(F)cc([N+](=O)[O-])c1 1786613342 MNFBATQUNHFBOC-JOCHJYFZSA-N 465.456 5.192 5 20 JKBD Cc1oc(C(C)(C)C)cc1C(=O)Nc1ccc(C2(NC(=O)c3ccc([N+](=O)[O-])o3)CCC2)cc1 1787389103 FKSZBHMYQLGAIP-UHFFFAOYSA-N 465.506 5.448 5 20 JKBD CC(C)[C@@H](C(=O)NC1(c2ccc(NC(=O)c3ccc([N+](=O)[O-])[nH]3)cc2)CCC1)c1ccccc1 1790183432 DCOSECJSNQAGHR-HSZRJFAPSA-N 460.534 5.110 5 20 JKBD O=C(Cc1cccc([N+](=O)[O-])c1)N1CCCC2(CCN(C(=O)c3cc(Cl)sc3Cl)CC2)C1 1804753185 OVRKGJGKWBLGRP-UHFFFAOYSA-N 496.416 5.051 5 20 JKBD O=C(/C=C/c1ccc([N+](=O)[O-])o1)N1CCC([C@@H]2CCCCN2C(=O)[C@@H]2CCC[C@H]3CCCC[C@@H]32)CC1 1828456721 VTNMGEKHERNSLF-LBECIZGWSA-N 497.636 5.427 5 20 JKBD Cc1c(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)/C=C/c3ccoc3)CC2)cc(Cl)cc1[N+](=O)[O-] 1830734444 LBTBHOBSBQBDHT-IOUFHMPJSA-N 485.968 5.096 5 20 JKBD O=C(c1cc(F)cc([N+](=O)[O-])c1)N1CCC([C@@H]2CCCCN2C(=O)c2ccc(C3CC3)cc2)CC1 1830749580 FKLURVQHZLMTPL-VWLOTQADSA-N 479.552 5.158 5 20 JKBD O=C(c1cc2ccsc2[nH]1)N1CCC([C@H]2CCCCN2C(=O)/C=C/c2ccccc2[N+](=O)[O-])CC1 1832904793 WZGHQTKHOFMXMS-HYGBKTPJSA-N 492.601 5.084 5 20 JKBD CC(=O)Nc1ccc(C2=N/C(=C\c3ccc(Oc4ccccc4Cl)c([N+](=O)[O-])c3)C(=O)O2)cc1 15189594 KIQDIHXIGUMZFN-UNOMPAQXSA-N 477.860 5.343 5 20 JKBD Cc1csc(Sc2ccc(C(=O)O[C@H](C)c3nnc(-c4cccs4)o3)cc2[N+](=O)[O-])n1 17715755 WCBNDIRXEACUFX-LLVKDONJSA-N 474.545 5.540 5 20 JKBD COc1ccc([N+](=O)[O-])cc1CSC1=N/C(=C\c2ccccc2)C(=O)N1c1ccc(F)cc1 21368373 SUPXUMLBGIVPBQ-BKUYFWCQSA-N 463.490 5.420 5 20 JKBD C[C@H](OC(=O)C[C@H](NC(=O)c1ccccc1Cl)c1ccccc1)c1cccc([N+](=O)[O-])c1 21673039 VNHFYVGDABZFNR-AOMKIAJQSA-N 452.894 5.414 5 20 JKBD COc1cc(CSc2nnc(-c3ccccc3Br)o2)c([N+](=O)[O-])cc1OC(F)F 24979580 HTCKKTAZIVLZDH-UHFFFAOYSA-N 488.266 5.310 5 20 JKBD O=C(N[C@H](c1ccc(Cl)cc1)c1cccs1)C1CCN(c2ccccc2[N+](=O)[O-])CC1 107958047 FLJSPDMHOHUTEB-JOCHJYFZSA-N 455.967 5.432 5 20 JKBD Cc1nnc(SCc2c(C(=O)N[C@@H](C)c3cccc([N+](=O)[O-])c3)oc3ccccc23)s1 109712167 ADKMHPDVEPLIKL-LBPRGKRZSA-N 454.533 5.284 5 20 JKBD COc1cc(/C=C\c2ccc3cccc([N+](=O)[O-])c3n2)ccc1OCC(=O)Nc1ccccc1Cl 208124645 AKPAKPSOXHAGGG-XFXZXTDPSA-N 489.915 5.993 5 20 JKBD CC(=O)Nc1ccc(NC(=O)c2ccc(SCCC(C)C)c([N+](=O)[O-])c2)c(C(F)(F)F)c1 247954392 SACHPJZWHKQZHN-UHFFFAOYSA-N 469.485 5.963 5 20 JKBD COc1ccc(-c2nn(-c3ccccc3)cc2C(=O)Nc2cccc([N+](=O)[O-])c2C)c(OC)c1 481320153 GHIXROCSYAUJMC-UHFFFAOYSA-N 458.474 5.025 5 20 JKBD CCN(C(=O)Cc1ccc(NC(=O)c2cc(SC)c(OC)cc2[N+](=O)[O-])cc1)c1ccccc1 483404429 IUTJCMUYXFNSSR-UHFFFAOYSA-N 479.558 5.173 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)Nc2ccc(OCc3cccc(F)c3)cc2C)cc1SC 484308538 OUXAYRZSWXSGPR-UHFFFAOYSA-N 456.495 5.604 5 20 JKBD C[C@@H](NC(=O)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1)c1ccc(OC(F)F)cc1 490589994 NDKGQRZHBXZPIP-CYBMUJFWSA-N 487.425 5.309 5 20 JKBD Cc1csc(Sc2ccc(C(=O)Nc3ccc(C(=O)NCC(C)C)cc3C)cc2[N+](=O)[O-])n1 495640586 QXFGVUWGHHIPKV-UHFFFAOYSA-N 484.603 5.457 5 20 JKBD CN(CC(=O)Nc1ccc(Cl)c(C(F)(F)F)c1)C(=O)c1csc(-c2ccc([N+](=O)[O-])cc2)n1 497353498 JNABCTBAONFURF-UHFFFAOYSA-N 498.870 5.101 5 20 JKBD Cc1nn(Cc2ccc(C(=O)N(Cc3ccccc3C(F)(F)F)C3CC3)cc2)c(C)c1[N+](=O)[O-] 498355809 RJSXLIOEJCSUBG-UHFFFAOYSA-N 472.467 5.280 5 20 JKBD O=[N+]([O-])c1ccc(CN[C@@H](c2ccc(F)cc2)c2ccccc2I)cc1 504245477 WDQQXXHHXKQAJZ-FQEVSTJZSA-N 462.262 5.218 5 20 JKBD CCc1cc(Sc2nnc(-c3cccnc3)n2Cc2ccccc2)nc(-c2ccc([N+](=O)[O-])cc2)n1 507113082 ZCFALIWSGMUECY-UHFFFAOYSA-N 495.568 5.467 5 20 JKBD C[C@H]1CCCN(c2ccc(C(=O)N3CCC(c4nc5ccccc5s4)CC3)cc2[N+](=O)[O-])C1 514301510 OZABRUPZXXYUQG-KRWDZBQOSA-N 464.591 5.461 5 20 JKBD CCN(CC(=O)Nc1c(Cl)cccc1Cl)C(=O)c1cc2ccccc2c2cccnc12 515115390 BWMQNEYJKZZDPU-UHFFFAOYSA-N 452.341 5.796 5 20 JKBD Cc1c(NC(=O)c2ccccc2)cccc1NC(=O)C1CCN(c2ccccc2[N+](=O)[O-])CC1 516132131 FPABDBCUIYQLHD-UHFFFAOYSA-N 458.518 5.011 5 20 JKBD CCC[C@@H](NC(=O)c1ccc(Sc2nncn2C)c([N+](=O)[O-])c1)c1cccc(C(F)(F)F)c1 524016907 UAHOLRDVJHSAOG-MRXNPFEDSA-N 479.484 5.165 5 20 JKBD CC1CCN(c2ccc(C(=O)NCc3cccc(COCc4ccco4)c3)cc2[N+](=O)[O-])CC1 603882451 XBYBPBNJYUMOKC-UHFFFAOYSA-N 463.534 5.071 5 20 JKBD CC(C)Oc1cccc([C@@H](C)N[C@@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2ccccc2)c1 604044816 COGGTZRTXSFUDM-MZNJEOGPSA-N 467.953 6.066 5 20 JKBD COCCOc1cc([N+](=O)[O-])c(C(=O)N2CCCC[C@@H]2c2ccc(C(F)(F)F)cc2)cc1OC 608851452 VBGJMKIBKIHKAI-GOSISDBHSA-N 482.455 5.015 5 20 JKBD COc1ccc(CC[C@H]2CCCCN2C(=O)c2cc([N+](=O)[O-])ccc2Br)cc1OC 726150359 KLZSZCHXDXDRBZ-MRXNPFEDSA-N 477.355 5.002 5 20 JKBD Cc1ccc(NC(=O)[C@H](OC(=O)Cc2c[nH]c3cccc(C)c23)c2ccccc2)c([N+](=O)[O-])c1 729013476 YUOIIOVXEPMKEG-RUZDIDTESA-N 457.486 5.159 5 20 JKBD CC(C)c1ncc(Cl)c(C(=O)Nc2cc(Cl)c([N+](=O)[O-])cc2OCc2ccccc2)n1 743608336 WEPLYXMPRXTISD-UHFFFAOYSA-N 461.305 5.646 5 20 JKBD O=C(OCC(=O)N1c2ccccc2Sc2ccccc21)c1csc(-c2ccc([N+](=O)[O-])cc2)n1 747958399 KDLOYTWFXOKRBC-UHFFFAOYSA-N 489.534 5.705 5 20 JKBD CCCn1c(C)cc(-c2csc(NC(=O)c3cc([N+](=O)[O-])c(C)c([N+](=O)[O-])c3C)n2)c1C 748608863 YLTDELLQLWWZJL-UHFFFAOYSA-N 457.512 5.324 5 20 JKBD CC(=O)N(c1nc(COC(=O)c2cc([N+](=O)[O-])c(C)c([N+](=O)[O-])c2C)cs1)c1ccc(C)cc1C 748946346 GNSSQWAUBINQBH-UHFFFAOYSA-N 498.517 5.235 5 20 JKBD CC[C@@H](C(=O)Oc1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2Cl)cc1)c1c(C)noc1C 751305954 MSOXOIDBFOEPFF-QGZVFWFLSA-N 457.870 5.205 5 20 JKBD CCc1ccc(N(C(C)=O)c2nc(COC(=O)[C@@H](C)Sc3ccc([N+](=O)[O-])cc3)cs2)cc1 916522511 APWSQGSOJJFXOI-OAHLLOKOSA-N 485.587 5.522 5 20 JKBD C[C@H](OC(=O)c1cc([N+](=O)[O-])ccc1Oc1ccccc1)C(=O)N1CCC[C@H]1c1cccs1 919191526 GCWBLIDQZKMBSW-JXFKEZNVSA-N 466.515 5.358 5 20 JKBD Cc1ccc(NC(=O)[C@H](OC(=O)c2cnc(C(C)(C)C)s2)c2ccccc2)c([N+](=O)[O-])c1 920692172 NHBQWWISVFPHRR-LJQANCHMSA-N 453.520 5.194 5 20 JKBD O=C(NC1(c2ccc(NC(=O)C3CCC(F)(F)CC3)cc2)CCC1)c1ccc([N+](=O)[O-])cc1F 1786244735 MVIYTQOATDFBBH-UHFFFAOYSA-N 475.467 5.307 5 20 JKBD O=C(CCC1CCCC1)Nc1ccc(C2(NC(=O)c3nc4cc([N+](=O)[O-])ccc4[nH]3)CCC2)cc1 1787619640 SVPZAGQUBWYYPL-UHFFFAOYSA-N 475.549 5.189 5 20 JKBD O=C(Cc1ccc([N+](=O)[O-])cc1F)NC1(c2ccc(NC(=O)c3cc4ccsc4[nH]3)cc2)CCC1 1790876779 GGLGYCMXTZFSFT-UHFFFAOYSA-N 492.532 5.267 5 20 JKBD O=C(Cc1ccc([N+](=O)[O-])cc1F)Nc1ccc(C2(NC(=O)c3cccc4ncccc34)CCC2)cc1 1791184041 MUSMOUSHMPLCMF-UHFFFAOYSA-N 498.514 5.273 5 20 JKBD CCCCC[C@H](C)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc2cc([N+](=O)[O-])ccc2s1 1801206798 IOCVRVNLBOXESC-KANFNMMFSA-N 457.596 5.278 5 20 JKBD O=C(Cc1cccc([N+](=O)[O-])c1)N1CCCC2(CCN(C(=O)c3ccc4occ(Cl)c4c3)CC2)C1 1804753253 UOKUPWHTCYIDRF-UHFFFAOYSA-N 495.963 5.082 5 20 JKBD O=C(CC1CCCC1)NC[C@H]1CCN(C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)[C@H]1c1cccnc1 1806196028 WPNXHNXTMUFICH-CLOONOSVSA-N 492.601 5.104 5 20 JKBD O=C([C@@H]1C[C@H]1C1CC1)N1CCC([C@@H]2CCCCN2C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)CC1 1831060292 QSDHATZFFUXHFS-BDTNDASRSA-N 481.618 5.089 5 20 JKBD O=C(CSc1nnc(-c2ccco2)n1C1CCCCC1)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 10015307 DMCTWBHQUWEUOF-UHFFFAOYSA-N 495.483 5.701 5 20 JKBD Cc1ccc(NC(=O)[C@@H](Sc2nnc(-c3cccs3)n2C)c2ccccc2)c([N+](=O)[O-])c1 10709410 NSSUNCQZSDBMQD-IBGZPJMESA-N 465.560 5.232 5 20 JKBD C[C@@H](Sc1nc2cc3ccccc3cc2c(=O)n1C)C(=O)Nc1ccccc1C(F)(F)F 18591078 HNEUATQVWCUHCI-CYBMUJFWSA-N 457.477 5.225 5 20 JKBD Cc1cccc(NC(=O)[C@H]2CCCN(C(=O)c3ccc(Oc4ccc(Cl)cc4[N+](=O)[O-])cc3)C2)n1 108864819 POBXKGSZDYPLPB-SFHVURJKSA-N 494.935 5.235 5 20 JKBD O=C(Cn1c2ccccc2c(=O)c2ccccc21)Nc1nnc(SCc2ccc(Cl)cc2)s1 115464979 QQRCWCPKSVAXLN-UHFFFAOYSA-N 493.013 5.591 5 20 JKBD COc1ccc(Br)cc1[C@H]1CCCN1C(=O)c1csc(-c2ccc([N+](=O)[O-])cc2)n1 303126358 OHQVRWHKBUQRHB-GOSISDBHSA-N 488.363 5.467 5 20 JKBD C[C@@H](Cn1ccnc1)NC(=O)c1c2c(nc3ccccc13)/C(=C/c1ccc([N+](=O)[O-])cc1)CCC2 481312780 RXDRPENXRAKLIP-XTFSCAMASA-N 467.529 5.035 5 20 JKBD CN(CCCc1cc(-c2ccccc2)n[nH]1)C(=O)c1ccc(NCc2ccccc2)c([N+](=O)[O-])c1 486651775 MSVCZUZPQUUUPV-UHFFFAOYSA-N 469.545 5.302 5 20 JKBD Cc1csc(Sc2ccc(C(=O)N3CCC[C@@H](CN4CCCCCC4)C3)cc2[N+](=O)[O-])n1 487836806 FGHQKLPUUKLAOF-SFHVURJKSA-N 474.652 5.239 5 20 JKBD COc1cc(CN(C)C(=O)c2csc(-c3ccc([N+](=O)[O-])cc3)n2)ccc1OCc1ccccc1 495500881 CUEVJENODLLIRH-UHFFFAOYSA-N 489.553 5.578 5 20 JKBD COc1ccc([C@@H](C)NC(=O)C/C(=C/c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)cc1F 503212731 QHIUAEVILDUPKV-YZYPPFLQSA-N 491.544 6.160 5 20 JKBD Cc1sc(NC(=O)Cc2csc(NC(=O)c3ccccc3F)n2)nc1-c1cccc([N+](=O)[O-])c1 515626692 ZFAKGCAYCQBFJI-UHFFFAOYSA-N 497.533 5.056 5 20 JKBD COc1cc(C(=O)N2C[C@@H]3CCCN3c3ccccc32)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 516129487 OMJRZGPMXSHQIC-SFHVURJKSA-N 479.920 5.678 5 20 JKBD Cc1cnn([C@H]2CCCc3ccccc32)c1NC(=O)Cn1c2ccccc2c(=O)c2ccccc21 519037670 KUGZEBXDOKBYQW-SANMLTNESA-N 462.553 5.224 5 20 JKBD O=C(Nc1ccc(-c2nnc3n2CCCC3)cc1)c1ccc(NCc2ccccc2)c([N+](=O)[O-])c1 521329898 SGPRLRAALQWSFQ-UHFFFAOYSA-N 468.517 5.054 5 20 JKBD O=C(Nc1ccccc1)c1ccc(NC(=O)c2ccc(NCc3ccccc3)c([N+](=O)[O-])c2)cc1 521813694 NQMIZFMUXRIZJX-UHFFFAOYSA-N 466.497 5.712 5 20 JKBD O=C(Nc1ccccc1NC(=O)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-])c1cccs1 523997214 QBMMCNGFUCTDLR-UHFFFAOYSA-N 465.409 5.102 5 20 JKBD CCOc1cc(CNCc2cc(F)ccc2F)ccc1OCc1cc([N+](=O)[O-])cc2c1OCOC2 566351082 JSKMKLMERHMYOM-UHFFFAOYSA-N 486.471 5.007 5 20 JKBD CC(=O)Nc1ccc(CNC(=O)c2ccccc2Sc2ccc(C(F)(F)F)cc2[N+](=O)[O-])cc1 591855672 UJYYITILRJUEQJ-UHFFFAOYSA-N 489.475 5.653 5 20 JKBD O=C(Nc1ccc(-c2nccs2)cc1)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 603436059 FKVZNEJQWBHYHK-UHFFFAOYSA-N 476.480 5.592 5 20 JKBD COc1cccc(OC)c1OC1CCN(C(=O)c2ccc(Nc3ccccc3)c([N+](=O)[O-])c2)CC1 603927861 JYYIYUUTWPFILE-UHFFFAOYSA-N 477.517 5.039 5 20 JKBD COc1ccccc1CCN(C)C(=O)C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1 609182339 PVMNWHNLXRIRQB-FXBPSFAMSA-N 487.581 5.845 5 20 JKBD C[C@H](NCc1ccc(Oc2ccccc2Cl)c([N+](=O)[O-])c1)c1ccc2c(c1)CC(=O)N2C 728302841 YWQHGFJPFRHZQM-HNNXBMFYSA-N 451.910 5.410 5 20 JKBD Cc1ccc(Cl)c(NC(=S)/C(=C(/O)c2ccc([N+](=O)[O-])cc2)[n+]2cc(O)ccc2C)c1Cl 728558463 LREHXDFDWLETQN-UHFFFAOYSA-O 491.376 5.835 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)O[C@H](C)c2cccc(NC(=O)c3ccccc3)c2)cc1SC 728650329 XCTPBMNFTZBWOX-OAHLLOKOSA-N 466.515 5.496 5 20 JKBD C[C@H](Cc1ccc(Cl)cc1Cl)C(=O)O[C@H](C)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 730636388 VKCBJTDEAGZULZ-VXGBXAGGSA-N 450.278 5.435 5 20 JKBD O=C(NO[C@H]1CCCCO1)c1c2c(nc3ccccc13)/C(=C\c1cccc([N+](=O)[O-])c1)CCC2 749620356 RFDSUFBWZAHRCX-BEHCEJKESA-N 459.502 5.208 5 20 JKBD O=C(Nc1nc(-c2cc(Cl)sc2Cl)cs1)c1cc([N+](=O)[O-])ccc1Br 751061864 HYNWEEJHKVPMJE-UHFFFAOYSA-N 479.164 6.101 5 20 JKBD O=C(COC(=O)/C=C\c1ccc2ccc(Cl)cc2n1)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 912873807 RVRISAMDOGGNSL-YVMONPNESA-N 479.798 5.010 5 20 JKBD COc1cc(C(=O)OCc2nnc(C(C)(C)C)o2)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 914892732 HQVFNOMNYIJLNK-UHFFFAOYSA-N 461.858 5.087 5 20 JKBD COc1c([N+](=O)[O-])cc(N[C@@H](C)c2cccc(OC(F)F)c2)c([N+](=O)[O-])c1Br 917070917 UKQHYNQWRZXDQB-QMMMGPOBSA-N 462.203 5.049 5 20 JKBD Cc1cc(O[C@H](C)C(=O)O[C@@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2C(F)(F)F)ccc1C(C)C 919406748 FEUGEBRCOTYRKH-LSDHHAIUSA-N 482.455 5.383 5 20 JKBD COc1ccc(NC(=O)[C@H](C)Oc2ccc(Cl)cc2[N+](=O)[O-])cc1NC(=O)OC(C)(C)C 920766328 WFWQXUNPLOSJFZ-LBPRGKRZSA-N 465.890 5.010 5 20 JKBD Cc1cccc(C(=O)NC2(c3ccc(NC(=O)c4ccc([N+](=O)[O-])o4)cc3)CCC2)c1Cl 1785751569 JSHCXWUXGQKIJW-UHFFFAOYSA-N 453.882 5.211 5 20 JKBD O=C(CC1CCCC1)Nc1ccc(C2(NC(=O)Cn3ccc4ccc([N+](=O)[O-])cc43)CCC2)cc1 1787613983 FMASIKVSSYWWKA-UHFFFAOYSA-N 474.561 5.264 5 20 JKBD O=C(Cc1ccc([N+](=O)[O-])cc1F)NC1(c2ccc(NC(=O)c3ccnc4ccccc34)cc2)CCC1 1788890693 FOGCBMCNSYRXFO-UHFFFAOYSA-N 498.514 5.273 5 20 JKBD Cc1ccc(/C=C/C(=O)Nc2ccc(C3(NC(=O)c4ccc([N+](=O)[O-])o4)CCC3)cc2)s1 1791834224 WTHPGBYKLAZWPB-PKNBQFBNSA-N 451.504 5.019 5 20 JKBD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc2cc([N+](=O)[O-])ccc2s1)c1cc2ccccc2o1 1801206684 HXGLWDXMBKNPSX-BCDXTJNWSA-N 475.526 5.121 5 20 JKBD Cc1cc(CCCC(=O)N2CCCC[C@H]2c2cc(NC(=O)[C@H]3CC=CCC3)n[nH]2)c([N+](=O)[O-])cc1F 1820825475 IECPUYXRLWMKHP-AVRDEDQJSA-N 497.571 5.137 5 20 JKBD O=C(c1cc(O)cc([N+](=O)[O-])c1)N1CCC([C@@H]2CCCCN2C(=O)c2cc3sccc3s2)CC1 1828553838 NSOQESFSXKUGSE-IBGZPJMESA-N 499.614 5.124 5 20 JKBD CC[C@H](C)CC(=O)N1CCC([C@H]2CCCCN2C(=O)C2(c3cccc([N+](=O)[O-])c3)CCC2)CC1 1830291221 JABBJEKYAOMLED-GBXCKJPGSA-N 469.626 5.072 5 20 JKBD Cc1cccc(Cl)c1C(=O)N1CCCC[C@H]1C1CCN(C(=O)/C=C/c2ccc([N+](=O)[O-])o2)CC1 1830593847 MLOLYRZCLZWLCF-DJGBTNNQSA-N 485.968 5.096 5 20 JKBD CC(C)n1ncc2c(C(=O)O[C@@H](C)C(=O)Nc3ccc([N+](=O)[O-])cc3Cl)cc(-c3ccco3)nc21 11041494 DNRISFHAEVGXDQ-ZDUSSCGKSA-N 497.895 5.018 5 20 JKBD COc1cc(Cl)c(C)cc1NC(=O)[C@@H](C)Sc1nc2cc3ccccc3cc2c(=O)n1C 18591177 PZPBTVBSYOTSLU-CQSZACIVSA-N 467.978 5.176 5 20 JKBD CCOc1cc(C(=O)Nc2nc(-c3cc(Cl)ccc3Cl)cs2)c([N+](=O)[O-])cc1OC 26770015 BEFLYKLLODSEMJ-UHFFFAOYSA-N 468.318 5.685 5 20 JKBD C[C@@H](OC(=O)Cc1coc2ccc3ccccc3c12)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl 28937233 FCGSZWDRWJYTOX-CYBMUJFWSA-N 452.850 5.261 5 20 JKBD C[C@@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccc(Cl)c(C(=O)NC2CCCCC2)c1 59827639 CVQUQXBAGPLECB-CQSZACIVSA-N 461.971 5.430 5 20 JKBD CCOc1ccc(-c2nc(CC(=O)Nc3nc(-c4cccc([N+](=O)[O-])c4)cs3)cs2)cc1 71860746 FEODNEINJSNBOT-UHFFFAOYSA-N 466.544 5.422 5 20 JKBD C[C@H](NC(=O)c1ccc(N[C@H](C)c2ccccn2)c([N+](=O)[O-])c1)c1ccc(NC(=O)C2CC2)cc1 108783607 FKWFLVHJJLUTRN-DLBZAZTESA-N 473.533 5.002 5 20 JKBD Cc1nc(COc2ccc(F)cc2)sc1C(=O)Nc1nc(-c2cccc([N+](=O)[O-])c2)c(C)s1 195704155 GJFRGDQDTABXNV-UHFFFAOYSA-N 484.534 5.762 5 20 JKBD O=C(Nc1cc(-c2cccc([N+](=O)[O-])c2)n[nH]1)c1cnn(-c2cccc(C(F)(F)F)c2)c1C1CC1 303255263 OBLJDQGXVNNCRH-UHFFFAOYSA-N 482.422 5.319 5 20 JKBD COCc1cccc(CNC(=O)C/C(=C/c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)c1 482362029 BPUWWWSLMJXMEH-STZFKDTASA-N 473.554 5.598 5 20 JKBD COc1ccc(CSCC(=O)Nc2ccc(Oc3ccncc3)c(Cl)c2)cc1[N+](=O)[O-] 504769195 DUMGXBOZAUMCSX-UHFFFAOYSA-N 459.911 5.316 5 20 JKBD COc1cc(C(=O)NCc2ccccc2-n2ccnc2)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 509072437 YKCRYZHBOQZMEE-UHFFFAOYSA-N 478.892 5.165 5 20 JKBD COc1cc(C(=O)NCC2(c3ccccc3)CCOCC2)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 509448146 FCPZWADXPDOKQK-UHFFFAOYSA-N 496.947 5.527 5 20 JKBD O=C(Cc1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1)Nc1ccc(-c2nccs2)cc1 513828921 RZVNHVCTBFDGJG-UHFFFAOYSA-N 481.537 5.752 5 20 JKBD COc1ccc([N+](=O)[O-])cc1NC(=O)c1ccc(OCc2ccc(Br)cc2)c(OC)c1 603732650 PPDPEJLPZXHVON-UHFFFAOYSA-N 487.306 5.206 5 20 JKBD CC(=O)Nc1cccc2c1CCN(C(=O)c1ccc(NCc3ccccc3Cl)c([N+](=O)[O-])c1)C2 604191372 JCDPDNXIAOAIKI-UHFFFAOYSA-N 478.936 5.017 5 20 JKBD Cc1ccc(N(C(=O)c2ccc(N[C@@H](C)c3ccccn3)c([N+](=O)[O-])c2)C2CCCCC2)nc1 609375670 KJZXQWCZVREYJZ-IBGZPJMESA-N 459.550 5.846 5 20 JKBD COC1CCN(c2ccc(NC(=O)c3cc4cc([N+](=O)[O-])ccc4o3)cc2C(F)(F)F)CC1 728009645 LMNZXABJJKONKA-UHFFFAOYSA-N 463.412 5.227 5 20 JKBD CC(C)N(Cc1nnc(-c2cccc([N+](=O)[O-])c2)o1)C(=O)[C@H]1C[C@H]1c1cccc2ccccc12 730740503 SCNRAKFPLQDWMQ-GOTSBHOMSA-N 456.502 5.339 5 20 JKBD CC(C)N(Cc1nnc(-c2cccc([N+](=O)[O-])c2)o1)C(=O)[C@@H]1C[C@H]1c1cccc2ccccc12 730740505 SCNRAKFPLQDWMQ-XZOQPEGZSA-N 456.502 5.339 5 20 JKBD CN(C[C@@H]1CCCN(C(=O)c2cc([N+](=O)[O-])ccc2Oc2ccccc2)C1)C(=O)OC(C)(C)C 744341470 HQZPQBYCYULMHK-SFHVURJKSA-N 469.538 5.106 5 20 JKBD O=c1nc(/C(Cl)=C\c2ccc(-c3ccccc3[N+](=O)[O-])o2)[nH]c2cc(C(F)(F)F)ccc12 746015531 YOCRJUMHFTUNIA-XNTDXEJSSA-N 461.783 5.847 5 20 JKBD O=C(Nc1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2Br)c(C(F)(F)F)c1)c1ccoc1 751086218 HKVXIQZKFQBVEU-UHFFFAOYSA-N 498.211 5.474 5 20 JKBD CN(C)c1ccc([C@@H](CNC(=O)c2c[nH]c3cc([N+](=O)[O-])ccc23)c2c[nH]c3ccccc23)cc1 769046706 LAKSLLBIBYQTJO-JOCHJYFZSA-N 467.529 5.185 5 20 JKBD CC(=O)N(c1ccc(C(F)(F)F)cc1)c1nc(COc2cc(F)ccc2[N+](=O)[O-])cs1 919675785 CLGBNOXEZKWOJX-UHFFFAOYSA-N 455.389 5.473 5 20 JKBD O=[N+]([O-])c1ccc(/C(O)=C(/C(=S)Nc2ccc3c(c2)CCC3)[n+]2ccc3c(c2)CCCC3)cc1 920395046 DDRFOVXLQPURPK-UHFFFAOYSA-O 472.590 5.573 5 20 JKBD O=C(Cn1ccc2ccc([N+](=O)[O-])cc21)Nc1ccc(C2(NC(=O)[C@H]3CCC(F)(F)C3)CCC2)cc1 1786275963 RBRSIXSFVHLBBA-SFHVURJKSA-N 496.514 5.119 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)[C@H]3C[C@@H]3c3ccccc3)CCC2)cc1)c1cc([N+](=O)[O-])cc2c1OCC2 1790045595 YCYNGHQUQWTDOF-RPWUZVMVSA-N 497.551 5.081 5 20 JKBD O=C(C[C@H]1C[C@@H]2CC[C@H]1C2)Nc1ccc(C2(NC(=O)c3cc(F)cc([N+](=O)[O-])c3)CCC2)cc1 1791325417 IGBBBBZKAZPQNR-FGTMMUONSA-N 465.525 5.308 5 20 JKBD O=C(CSc1ccccc1[N+](=O)[O-])Nc1ccc(C2(NC(=O)CC3CCC3)CCC2)cc1 1791523228 NOSGHSFICMFJLD-UHFFFAOYSA-N 453.564 5.011 5 20 JKBD O=C(c1ccccc1C1CC1)N1CCC([C@@H]2CCCCN2C(=O)/C=C/c2ccccc2[N+](=O)[O-])CC1 1832904833 XVKIVQFLKKMPJJ-BOMYWPOKSA-N 487.600 5.419 5 20 JKBD COc1ccc([N+](=O)[O-])cc1NC(=O)[C@@H](C)Sc1nnc(-c2ccccc2)n1-c1ccc(F)cc1 10212531 RKJVWLHWAIORFE-OAHLLOKOSA-N 493.520 5.110 5 20 JKBD C[C@H](OC(=O)c1ccccc1C(=O)c1ccc(Cl)c([N+](=O)[O-])c1)C(=O)NCCC1=CCCCC1 11029241 OXHAEBLOCVIKPS-INIZCTEOSA-N 484.936 5.031 5 20 JKBD COC(=O)c1ccc(NC(=O)C/C(=C/c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)s1 15193576 RRASCHYEAVISIR-QINSGFPZSA-N 479.539 5.622 5 20 JKBD COc1ccc(CN(C)[C@@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2ccccc2)c(OC)c1 16591014 OKGSDWQOWZGCQD-HSZRJFAPSA-N 469.925 5.077 5 20 JKBD CCn1c(S[C@H](C)C(=O)NCc2ccc(Cl)cc2)nc2cc3ccccc3cc2c1=O 18467391 HTCKEIZJDOYMMV-OAHLLOKOSA-N 451.979 5.020 5 20 JKBD C[C@H](OC(=O)C1CCN(c2ccccc2[N+](=O)[O-])CC1)C(=O)Nc1ccccc1-c1ccccc1 24761872 QLMBLFOGAUKFAV-IBGZPJMESA-N 473.529 5.049 5 20 JKBD CCN(Cc1cc(Br)ccc1F)C(=O)Cn1c2ccccc2c(=O)c2ccccc21 58700547 PWKDUIUTPAKKLR-UHFFFAOYSA-N 467.338 5.105 5 20 JKBD CSc1ccc([N+](=O)[O-])c(C(=O)Nc2ccc(NC(=O)c3ccc(F)cc3)cc2C(F)(F)F)c1 69643982 WDVCPMOYWGTDOP-UHFFFAOYSA-N 493.438 5.979 5 20 JKBD COc1ccc(-c2nc(C)c(C(=O)O[C@@H](C)c3nnc(-c4ccc([N+](=O)[O-])cc4)o3)s2)cc1OC 105091825 CEDYVQKHBVVXJL-ZDUSSCGKSA-N 496.501 5.012 5 20 JKBD Cc1ccc(-c2csc(NC(=O)CCCc3nc(-c4cccs4)no3)n2)cc1[N+](=O)[O-] 106284811 LZOPXJSESXXHRT-UHFFFAOYSA-N 455.521 5.100 5 20 JKBD C[C@@H](Nc1ccc(C(=O)Nc2ncc(Cc3ccccc3F)s2)cc1[N+](=O)[O-])c1ccccn1 108831917 NMBSUJFRKQMYLO-OAHLLOKOSA-N 477.521 5.602 5 20 JKBD O=C(c1csc(-c2ccc3c(c2)OCO3)n1)N(CC1CC1)c1ccc(Cl)c([N+](=O)[O-])c1 112523918 FTXNMJJOGRRMRX-UHFFFAOYSA-N 457.895 5.157 5 20 JKBD CCCNC(=O)c1cccc(NC(=O)c2ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])c(OC)c2)c1 478341059 MAUPPWPEQVYQEU-UHFFFAOYSA-N 483.908 5.441 5 20 JKBD O=C(NC1CCN(Cc2ccc(F)c(F)c2)CC1)c1cc([N+](=O)[O-])ccc1Sc1ccccc1 489180004 OSFSSRFVVVVRLN-UHFFFAOYSA-N 483.540 5.419 5 20 JKBD COCCN(C(=O)c1csc(-c2ccc([N+](=O)[O-])cc2)n1)[C@@H](C)c1cccc(C(F)(F)F)c1 500297720 CSLXIMSGJWHOJU-AWEZNQCLSA-N 479.480 5.587 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Cl)[C@H](c1ccccc1)N1CCc2c(cnn2-c2ccccc2)C1 502020966 GKNKIUHTNKJMSH-VWLOTQADSA-N 487.947 5.172 5 20 JKBD COc1ccc(N(C(=O)c2ccc(N[C@H](C)c3ccccn3)c([N+](=O)[O-])c2)C(C)C)cc1F 509823204 YJUUWGQTEXPYIS-MRXNPFEDSA-N 452.486 5.366 5 20 JKBD Cc1ccccc1C1(CN[C@@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2ccccc2)CCOCC1 513183562 MNNXPNYIAQBOTO-RUZDIDTESA-N 493.991 5.574 5 20 JKBD Cc1ccc(-c2csc(NC(=O)c3c(-c4c(F)cccc4Cl)noc3C)n2)cc1[N+](=O)[O-] 515164261 SQHHDNAHJYPWRY-UHFFFAOYSA-N 472.885 6.035 5 20 JKBD C[C@H](NC(=O)CSc1ccc(C(F)(F)F)cc1[N+](=O)[O-])c1ccc(OCC(F)(F)F)cc1 517875214 XWWAROGILQUYKE-NSHDSACASA-N 482.402 5.524 5 20 JKBD Cn1ccnc1[C@@H](NCc1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1)c1ccccc1 520208743 HCORQTNIBKWQNZ-SANMLTNESA-N 464.529 5.060 5 20 JKBD Cc1cc(C(=O)N2CCC[C@H]2C(=O)Nc2nc(-c3ccco3)c(-c3ccco3)s2)ccc1[N+](=O)[O-] 521915379 UZGRNQNHRVPFPT-KRWDZBQOSA-N 492.513 5.123 5 20 JKBD CN1CCC(Nc2ccccc2NC(=O)c2ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])cc2)CC1 555338928 PUPXJINZMSZEAS-UHFFFAOYSA-N 480.952 5.799 5 20 JKBD CCOc1cc(NC(=O)c2cc(C3CC3)nc3onc(C(C)C)c23)c([N+](=O)[O-])cc1OCC 603734039 WHUKJMJFQVUQQM-UHFFFAOYSA-N 454.483 5.182 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Cl)[C@H](NC1CCN(Cc2ccc(F)cc2)CC1)c1ccccc1 604044525 UEQPAAMXQGQQSJ-RUZDIDTESA-N 496.970 5.321 5 20 JKBD C[C@@H]1CCCN(c2ccc(C(=O)N3C[C@H](C(F)(F)F)C[C@@H](C(F)(F)F)C3)cc2[N+](=O)[O-])C1 604257586 IFFGIOGXUBNOMD-BPLDGKMQSA-N 467.410 5.034 5 20 JKBD COc1cc([N+](=O)[O-])ccc1S(=O)(=O)Nc1ccc(Oc2ccccc2)cc1C(F)(F)F 604465567 VWRDJUKSTKLVRW-UHFFFAOYSA-N 468.409 5.215 5 20 JKBD C[C@@H]1C[C@@H](C)CN(c2ccc(C(=O)Nc3cc(C(=O)N4CCCCC4)ccc3Cl)cc2[N+](=O)[O-])C1 608872498 HALBCNRETMEOCE-QZTJIDSGSA-N 499.011 5.609 5 20 JKBD O=C(c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1)N1CCO[C@@H](c2cccc(F)c2)C1 608964973 POJCDWRNZBQHQF-JOCHJYFZSA-N 456.857 5.393 5 20 JKBD CCOc1cc([N+](=O)[O-])c(C(=O)Nc2ccc(OCc3cccc(C)c3)cc2C)cc1OC 609228348 QWHGIWSRYJLSKA-UHFFFAOYSA-N 450.491 5.450 5 20 JKBD CCOc1ccc([C@H](CNC(=O)c2c[nH]c3cc([N+](=O)[O-])ccc23)c2c[nH]c3ccccc23)cc1OC 610927495 RDFQHBFGHKWBHL-NRFANRHFSA-N 498.539 5.527 5 20 JKBD C[C@@H](NCc1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1)c1cccc(NS(C)(=O)=O)c1 725849069 FZARMHKFPUPSMR-OAHLLOKOSA-N 475.954 5.263 5 20 JKBD COc1ccc(NC(=O)c2csc(-c3ccc([N+](=O)[O-])cc3)n2)cc1NC(=O)OC(C)(C)C 747640002 ZAPWLIXQLIZDRK-UHFFFAOYSA-N 470.507 5.326 5 20 JKBD CC(C)N(C(=O)Cn1cnc(-c2ccc([N+](=O)[O-])cc2)n1)c1ccc(Nc2ccccc2)cc1 750823953 BIWAOVCVYVAWOU-UHFFFAOYSA-N 456.506 5.039 5 20 JKBD CCOc1ccc(NC(=O)c2ccc(NC(=O)c3cc([N+](=O)[O-])ccc3Br)cc2)cc1 751043875 RVGCGCINEYYSJJ-UHFFFAOYSA-N 484.306 5.261 5 20 JKBD C[C@@H](OC(=O)c1ccccc1NC(=O)c1ccc([N+](=O)[O-])cc1Cl)C(=O)NCCC1=CCCCC1 847375843 XBTWDVLWYHGPPT-MRXNPFEDSA-N 499.951 5.053 5 20 JKBD COc1ccc(CNc2ccc([C@H](O)C(F)(F)F)cc2)cc1OCc1ccc([N+](=O)[O-])cc1 864043196 HMRKEFXLPRFTFB-QFIPXVFZSA-N 462.424 5.390 5 20 JKBD Cc1cc(C)c(NC(=O)CCCOC(=O)Cn2c3ccccc3c(=O)c3ccccc32)c(C)c1 913292650 YTOZFGJZGPTOEG-UHFFFAOYSA-N 456.542 5.042 5 20 JKBD CCOc1cc(C(=O)O[C@@H](C(=O)Nc2cc(Cl)ccc2Cl)C(C)C)c([N+](=O)[O-])cc1OC 915373950 PULSPWOEACYDBH-LJQANCHMSA-N 485.320 5.129 5 20 JKBD CCC(CC)c1cc[n+](/C(C(=S)Nc2ccc3ccccc3c2)=C(/O)c2cccc([N+](=O)[O-])c2)cc1 917610708 SNPAYGIWXVFQEB-UHFFFAOYSA-O 498.628 7.262 5 20 JKBD Cc1ccc(/C(O)=C(/C(=S)Nc2ccc(Cl)cc2Cl)[n+]2cc(O)ccc2C)cc1[N+](=O)[O-] 920485447 RAHROIFGQMLACX-UHFFFAOYSA-O 491.376 5.835 5 20 JKBD CC(=O)N(c1nc(COC(=O)c2cc(C)cc([N+](=O)[O-])c2)cs1)c1c(C)cc(C)cc1C 920901590 WDSBHJVUJDNCDM-UHFFFAOYSA-N 453.520 5.327 5 20 JKBD O=C(/C=C/C1CC1)Nc1ccc(C2(NC(=O)c3cc(Br)ccc3[N+](=O)[O-])CCC2)cc1 1786160939 ODMGJSBYNFIFLQ-NYYWCZLTSA-N 484.350 5.071 5 20 JKBD COc1c(Cl)cccc1C(=O)NC1(c2ccc(NC(=O)c3cc(C)c([N+](=O)[O-])cn3)cc2)CCC1 1788767443 OGWUVRGPTNPPQV-UHFFFAOYSA-N 494.935 5.022 5 20 JKBD O=C(/C=C/c1ccccc1[N+](=O)[O-])NC1(c2ccc(NC(=O)CCCc3cccnc3)cc2)CCC1 1791954316 KZDLUBKNRZUDCW-LFIBNONCSA-N 484.556 5.160 5 20 JKBD Cc1ccc2cc(C(=O)N3CCCC[C@H]3c3cc(NC(=O)c4ccc([N+](=O)[O-])o4)n[nH]3)sc2c1 1814312928 UXPPPKUXUSEWQF-INIZCTEOSA-N 479.518 5.054 5 20 JKBD CCC[C@H]1CC[C@H](C(=O)N2CCC([C@@H]3CCCCN3C(=O)c3ccc([N+](=O)[O-])o3)CC2)CC1 1823617662 HYUOFJMCPBEWLO-JBACZVJFSA-N 459.587 5.028 5 20 JKBD CCCc1ccc(C(=O)N2CCCC[C@H]2C2CCN(C(=O)c3ccc([N+](=O)[O-])c(OC)c3)CC2)cc1 1830106018 MNVWMAQPGHPUJL-DEOSSOPVSA-N 493.604 5.103 5 20 JKBD Cc1cccc(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3cc(F)cc([N+](=O)[O-])c3)CC2)c1Cl 1832602869 GKULOOFTVCPCPQ-JOCHJYFZSA-N 487.959 5.243 5 20 JKBD CCCCn1c(SCC(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)nnc1-c1ccc(OC)cc1 9483546 DOWAPQJEKXJTCD-UHFFFAOYSA-N 475.958 5.046 5 20 JKBD CSc1ccc(C(=O)c2ccccc2C(=O)OCc2cc(=O)oc3cc(C)ccc23)cc1[N+](=O)[O-] 10154674 NZPZFJAFHQBKDA-UHFFFAOYSA-N 489.505 5.320 5 20 JKBD COc1ccc(NC(=O)[C@@H](Sc2nc3cc4ccccc4cc3c(=O)n2C)c2ccccc2)cc1 16133156 VMDMWCICTUQHAB-VWLOTQADSA-N 481.577 5.567 5 20 JKBD COc1ccc(-c2nnc(SCC(=O)N3CCc4cc([N+](=O)[O-])ccc43)n2C2CCCCC2)cc1 16549338 YUXRZOIEMCWEEB-UHFFFAOYSA-N 493.589 5.049 5 20 JKBD O=C(COC(=O)C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)Nc1ccccc1F 18494019 KUZLELNXYVEHIN-LGMDPLHJSA-N 491.500 5.456 5 20 JKBD Cc1occc1-c1nnc(S[C@H](C)C(=O)Nc2ccc(F)c([N+](=O)[O-])c2)n1Cc1ccccc1 21684860 DSXKNYZPCBEZME-OAHLLOKOSA-N 481.509 5.061 5 20 JKBD Cc1c(NC(=O)[C@H](C)Sc2nnc(-c3ccc(F)cc3)n2-c2ccccc2)cccc1[N+](=O)[O-] 23510389 RRZTXBDGVAUGIJ-INIZCTEOSA-N 477.521 5.409 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Cl)[C@@H](c1ccccc1)N1CCO[C@@H](c2ccc(F)cc2)C1 29537988 AHXIMDJPWGBEAI-DHIUTWEWSA-N 469.900 5.141 5 20 JKBD CC(C)c1ccc(N(C(=O)Cn2c(=O)oc3cc([N+](=O)[O-])ccc32)c2nc3ccccc3s2)cc1 69834848 IUFXIAAZZFIEKD-UHFFFAOYSA-N 488.525 5.601 5 20 JKBD CCCOc1cc(NC(=O)c2cc(F)ccc2Br)c([N+](=O)[O-])cc1OCCC 71812989 RPVHIUVHQPYOLN-UHFFFAOYSA-N 455.280 5.326 5 20 JKBD Cc1ccc(-c2csc(NC(=O)Cc3csc(-n4c(C)ccc4C)n3)n2)cc1[N+](=O)[O-] 195610422 GWXVDIJYCNDSAH-UHFFFAOYSA-N 453.549 5.072 5 20 JKBD Cc1cc(C)c(NC(=O)CNCc2ccc(-c3ccc([N+](=O)[O-])cc3Br)o2)c(C)c1 409524359 XRJUSQVQPAUICP-UHFFFAOYSA-N 472.339 5.271 5 20 JKBD O=C(Cc1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1)N1CCCCC[C@@H]1c1ccncc1 479276131 FVNKPGFDJICPBJ-AREMUKBSSA-N 481.556 5.529 5 20 JKBD NC(=O)c1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2Sc2ccc(Cl)cc2)cc1Cl 482305253 SHKVCAFHBCBVMA-UHFFFAOYSA-N 462.314 5.404 5 20 JKBD C[C@H]1C[C@@H](C)CN(c2ccc(C(=O)Nc3cc(Cl)ccc3C(=O)N3CCCC3)cc2[N+](=O)[O-])C1 485311627 HSUVOELNCSBSDP-CALCHBBNSA-N 484.984 5.219 5 20 JKBD CC(=O)Nc1cccc(Nc2nnc(S[C@@H](C)c3nnc(-c4ccc([N+](=O)[O-])cc4)o3)s2)c1 497330538 ZYKVAWLKWOTGKO-NSHDSACASA-N 483.535 5.052 5 20 JKBD C[C@H](SCc1ncc(-c2ccc(Cl)cc2)o1)C(=O)N1c2ccc([N+](=O)[O-])cc2C[C@H]1C 504375722 AXOWVUYCMHICJQ-KGLIPLIRSA-N 457.939 5.503 5 20 JKBD CC(C)c1nc(C(=O)N2c3ccc([N+](=O)[O-])cc3C[C@@H]2C)nn1-c1c(Cl)cccc1Cl 504393629 IHFQLWWXLCTDAR-LBPRGKRZSA-N 460.321 5.197 5 20 JKBD O=C(C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)NCc1ccnc(-n2cccn2)c1 505568569 LJZRPIWJNLLVNB-XSFVSMFZSA-N 496.552 5.032 5 20 JKBD C[C@H](Nc1ccc(C(=O)N(C)[C@@H](C)c2cccc(C(F)(F)F)c2)cc1[N+](=O)[O-])c1ccccn1 506180094 TWXRVDOIVSJPHZ-HOTGVXAUSA-N 472.467 6.015 5 20 JKBD Cc1ccccc1-n1nc(C)c(CN(C)C(=O)c2ccc(N[C@H](C)c3ccccn3)c([N+](=O)[O-])c2)c1C 508258538 UILBAJHIHXVRQK-HXUWFJFHSA-N 498.587 5.546 5 20 JKBD CCCOc1ccc(Cl)cc1NC(=O)[C@H](NC(=O)c1ccc([N+](=O)[O-])cc1Cl)C(C)C 511116882 SZOLQALQTOGRKW-LJQANCHMSA-N 468.337 5.084 5 20 JKBD C[C@@H]1CCC[C@@H](C)N1C(=O)c1cc(Cl)ccc1NC(=O)c1ccn(-c2cccc([N+](=O)[O-])c2)n1 512346997 MNZDAVTUNHBCRC-HZPDHXFCSA-N 481.940 5.089 5 20 JKBD CCN(Cc1ccc(-c2ccc(C(F)(F)F)cc2)o1)C(=O)C(=O)Nc1cc([N+](=O)[O-])ccc1C 518554225 SKPCUIIVBXAJTI-UHFFFAOYSA-N 475.423 5.169 5 20 JKBD COc1cc(C(=O)NCc2ccccc2-c2ccc(Cl)cc2)c([N+](=O)[O-])cc1OC(F)F 524210343 XLJFBBHTWKJISY-UHFFFAOYSA-N 462.836 5.455 5 20 JKBD COc1cccc([C@@H]2CCCN2C(=O)C/C(=C\c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)c1 590671061 LRNOPIPBKHRSNR-JYACYGOOSA-N 499.592 6.508 5 20 JKBD Cc1ccc(-n2c(SCc3nnc(-c4ccc([N+](=O)[O-])cc4)o3)nnc2-c2ccccn2)c(C)c1 603917844 HLDQGTLZSLDDIZ-UHFFFAOYSA-N 485.529 5.197 5 20 JKBD O=C(C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1)N1CCCCC[C@@H]1c1ccccc1 603969379 OENABVLLTKPPLY-OAQYLSRUSA-N 475.511 5.974 5 20 JKBD CC[C@H](Nc1ccc(S(=O)(=O)Nc2ccc(C)cc2C)cc1[N+](=O)[O-])c1nc(C)cs1 609193319 AZXPIECQHHGJJC-KRWDZBQOSA-N 460.581 5.341 5 20 JKBD CC(=O)Nc1ccc(-c2csc(NC(=O)c3ccc(N4CCC[C@@H](C)C4)c([N+](=O)[O-])c3)n2)c(F)c1 619213866 HEFICVKRTICHLK-CQSZACIVSA-N 497.552 5.304 5 20 JKBD COc1cc([N+](=O)[O-])ccc1NC(=O)CNc1ccc(OCc2cccc(C(F)(F)F)c2)cc1 728053261 YMHSNXPCSHVMQX-UHFFFAOYSA-N 475.423 5.252 5 20 JKBD O=C(Nc1ccc2c(c1)CCC(=O)N2Cc1ccc(Cl)cc1)c1cc([N+](=O)[O-])ccc1Cl 743714852 ZNNHPUONYSHOIE-UHFFFAOYSA-N 470.312 5.633 5 20 JKBD O=C(Cc1csc(-c2cccs2)n1)Oc1ccc2c(-c3ccc([N+](=O)[O-])cc3)cc(=O)oc2c1 743919157 YSUXFXQGRNPQAL-UHFFFAOYSA-N 490.518 5.701 5 20 JKBD COc1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2Br)cc1NC(=O)c1cccc(F)c1 751089495 XHCAZSULEPLLQV-UHFFFAOYSA-N 488.269 5.010 5 20 JKBD O=C(OCc1nnc(-c2ccccc2Cl)o1)c1ccc(NCc2ccccc2)c([N+](=O)[O-])c1 846718883 DIWZBCRJGCSGHQ-UHFFFAOYSA-N 464.865 5.267 5 20 JKBD Cc1ccccc1CNc1ccc(C(=O)O[C@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)cc1 915481580 UVTSYUPESUVNMK-QGZVFWFLSA-N 458.474 5.483 5 20 JKBD COc1cc(C(=O)OCc2cccc(C(=O)N(C)C)c2)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 918953338 QTCKZPGRMNPDSN-UHFFFAOYSA-N 484.892 5.108 5 20 JKBD Cc1cc(C(=O)O[C@@H](C)C(=O)Nc2cc([N+](=O)[O-])ccc2Cl)c2ccc(Br)cc2n1 919522304 DENRUJVUOODRTK-NSHDSACASA-N 492.713 5.051 5 20 JKBD CCCc1nc(COC(=O)C/C(=C/c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)no1 920513579 KBNGOVKKEQDXLL-VBKFSLOCSA-N 464.503 5.214 5 20 JKBD CSCC[C@H](NC(=O)c1ccc(Cl)c([N+](=O)[O-])c1)C(=O)OCc1csc2ccccc12 920824495 SGUUVFASPNJTRI-KRWDZBQOSA-N 478.979 5.058 5 20 JKBD O=C(Cc1cccc([N+](=O)[O-])c1)NC1(c2ccc(NC(=O)c3ccc4c(c3)CCCC4=O)cc2)CCC1 1789038943 WKWKHUAITXUSLS-UHFFFAOYSA-N 497.551 5.104 5 20 JKBD COc1ccc(CC(=O)Nc2ccc(C3(NC(=O)c4ccc5occc5c4)CCC3)cc2)c([N+](=O)[O-])c1 1790571412 UZHPTTNNAVSQEV-UHFFFAOYSA-N 499.523 5.340 5 20 JKBD Cc1nocc1C(=O)NC1(c2ccc(NC(=O)c3cc4cc([N+](=O)[O-])ccc4s3)cc2)CCC1 1791010837 GQKAPEMHIUKNMD-UHFFFAOYSA-N 476.514 5.167 5 20 JKBD COc1c(Cl)cccc1C(=O)Nc1ccc(C2(NC(=O)c3cc(C)c([N+](=O)[O-])cn3)CCC2)cc1 1792148127 IRXDICPUSRMKQK-UHFFFAOYSA-N 494.935 5.022 5 20 JKBD Cc1cc(CCCC(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cc4ccoc4s2)C3)c([N+](=O)[O-])cc1F 1793402337 VUJXUJWEGKXQKT-REPLKXPHSA-N 499.564 5.125 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2ccc3occc3c2)n[nH]1 1818707616 NDCNSARWEPOKDN-FQEVSTJZSA-N 491.479 5.131 5 20 JKBD O=C(Nc1cc([C@@H]2CCCCN2C(=O)C2(c3cccc([N+](=O)[O-])c3)CCC2)[nH]n1)C1CC2(CCC2)C1 1823052909 IMYBKZDGANMTBU-QFIPXVFZSA-N 491.592 5.012 5 20 JKBD Cc1cc(C)c(C(=O)N2CCC([C@@H]3CCCCN3C(=O)/C=C/c3ccc([N+](=O)[O-])o3)CC2)c(C)c1 1824279864 ZXBZBIWNIKRIRA-WCYCAPIHSA-N 479.577 5.060 5 20 JKBD Cc1ccncc1C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)CC1 1827901675 AJHRMOZTXVXKPW-JOCHJYFZSA-N 492.601 5.060 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2ccc3ccoc3c2)CC1 1830729232 KQXLLTJRUGNRAU-HSZRJFAPSA-N 493.535 5.336 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2ccc(Cl)cc2)CC1 1830733209 IMWUMVVJDKDSOI-QFIPXVFZSA-N 487.959 5.243 5 20 JKBD O=C(c1ccc([N+](=O)[O-])o1)N1CC[C@H]2[C@@H]1CCN2C(=O)c1ccccc1Oc1cccc2ccccc12 1847170612 UVQUAFYRMMYLAX-VXKWHMMOSA-N 497.507 5.263 5 20 JKBD c1ccc2c(c1)C[C@@H]1OC(c3cccc4cc5cccc(C6=N[C@@H]7c8ccccc8C[C@@H]7O6)c5nc34)=N[C@H]21 1988188149 YIRZYKKAMFZDNI-TUXGATLDSA-N 493.566 6.274 5 20 JKBD CCn1c(SCc2cc([N+](=O)[O-])cc3c2OCOC3)nc2scc(-c3cccs3)c2c1=O 9750749 ZHUPCVKCUVWDPX-UHFFFAOYSA-N 487.584 5.273 5 20 JKBD CCOc1cc(/C=C(/C(=O)OCC(=O)Nc2cc(Cl)ccc2[N+](=O)[O-])c2ccccc2)ccc1O 10910237 WMLZPDCTOYAWIF-XDHOZWIPSA-N 496.903 5.075 5 20 JKBD COc1cc(C(=O)Nc2ccc3c(c2)OCCO3)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 16019916 NEIYSNUTFQMTMW-UHFFFAOYSA-N 456.838 5.073 5 20 JKBD COc1cccc(N2CCN(C(=O)c3ccc(Oc4ccc(Cl)cc4[N+](=O)[O-])c(OC)c3)CC2)c1 24575507 DSGMDXQZIQHXBR-UHFFFAOYSA-N 497.935 5.020 5 20 JKBD Cc1cc(N2CCOCC2)ccc1NC(=O)c1ccc(NCc2ccccc2Cl)c([N+](=O)[O-])c1 33186684 VLPWJSMONHYPGM-UHFFFAOYSA-N 480.952 5.258 5 20 JKBD CCOc1ccc(-c2nc(C(=O)N(Cc3ccccc3[N+](=O)[O-])CC(F)(F)F)cs2)cc1 59253279 AZLZLFPJELNBNH-UHFFFAOYSA-N 465.453 5.322 5 20 JKBD CSc1ccc([N+](=O)[O-])c(C(=O)NCc2cccc(NC(=O)Nc3cccc(C)c3)c2)c1 108583215 ZTDQGXGKJPLQSE-UHFFFAOYSA-N 450.520 5.199 5 20 JKBD COc1cc([C@H](C)NC(=O)c2cc(SC)c(OC)cc2[N+](=O)[O-])ccc1OC1CCCC1 482896281 IHVSRAVNHDFQII-AWEZNQCLSA-N 460.552 5.146 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Br)[C@H](NCCc1cc(F)cc(F)c1)c1ccccc1 500388200 TWBNAHYUUZRYEB-OAQYLSRUSA-N 490.304 5.148 5 20 JKBD CCN(C(=O)c1ccn(-c2ccc([N+](=O)[O-])cc2)n1)[C@@H]1CCSc2ccc(Br)cc21 504642313 NQQRGQAXORHGTK-LJQANCHMSA-N 487.379 5.242 5 20 JKBD CC(=O)Nc1ccc(Br)cc1NC(=O)c1ccc(N[C@H](C)c2ccccn2)c([N+](=O)[O-])c1 506167756 XFHARIPALBSQMD-CYBMUJFWSA-N 498.337 5.136 5 20 JKBD Cc1noc([C@@H]2CCCN(C(=O)c3ccccc3Sc3ccc(C(F)(F)F)cc3[N+](=O)[O-])C2)n1 509138742 MQOUAGCWPWTVIT-CQSZACIVSA-N 492.479 5.476 5 20 JKBD CCOc1cc([N+](=O)[O-])c(C(=O)Nc2cc3c(cc2Sc2ccccc2)OCCO3)cc1OC 509265713 BDQXFKKMZGJKNS-UHFFFAOYSA-N 482.514 5.177 5 20 JKBD Cc1cc(NC(=O)N[C@@H](CC(=O)OC(C)C)c2ccccc2[N+](=O)[O-])ccc1Oc1cccnc1 512771411 VJSWCHNKQWLZSI-NRFANRHFSA-N 478.505 5.295 5 20 JKBD Cc1ccc(NC(=O)c2ccccc2)cc1NC(=O)[C@@H](C)Oc1ccc(Cl)cc1[N+](=O)[O-] 518831726 VUZBNUNABKUYLP-OAHLLOKOSA-N 453.882 5.215 5 20 JKBD CC[C@@H](C)NC(=O)c1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2Sc2ccccc2)c(C)c1 519049838 JBVCKFCQYBRKEZ-QGZVFWFLSA-N 463.559 5.835 5 20 JKBD COc1cc(C(=O)Nc2ccc(F)cc2C(F)(F)F)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 524392103 VXFZSEPOKJHGNO-UHFFFAOYSA-N 484.789 6.459 5 20 JKBD CC(C)OC(=O)C[C@@H](NC(=O)Nc1c(C(C)C)cccc1C(C)C)c1ccccc1[N+](=O)[O-] 603643837 UVPJCFVVNSRDDH-OAQYLSRUSA-N 455.555 6.046 5 20 JKBD COc1cccc(C[C@H]2CCCN2C(=O)c2ccc(N[C@H](C)c3ccccn3)c([N+](=O)[O-])c2)c1 604310434 MFUAFGTZXIRMDG-WIYYLYMNSA-N 460.534 5.019 5 20 JKBD C[C@@H](SCc1cc([N+](=O)[O-])cc2c1OCOC2)c1nc(O)c2c(-c3ccco3)csc2n1 619555037 NDLNOMYDQUXVLM-LLVKDONJSA-N 471.516 5.426 5 20 JKBD O=C(COc1ccccc1C(=O)Nc1ccc([N+](=O)[O-])cc1F)Nc1ccc(SC(F)F)cc1 726915392 JCPGBBGHXQFRCB-UHFFFAOYSA-N 491.447 5.318 5 20 JKBD Cc1c(C(=O)Nc2ccc3nc(NC(=O)c4cccc([N+](=O)[O-])c4C)ccc3c2)cccc1[N+](=O)[O-] 728151346 ZFDFHIDJTOMRQI-UHFFFAOYSA-N 485.456 5.173 5 20 JKBD C[C@@H](OC(=O)c1ccccc1OCc1cccs1)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl 730617469 HQXMUVRAYAFCLY-CYBMUJFWSA-N 460.895 5.073 5 20 JKBD O=C(Nc1ccc(OCc2ccccc2F)cc1)c1cc([N+](=O)[O-])ccc1I 747397890 RHUNWCIKIFTNBU-UHFFFAOYSA-N 492.244 5.170 5 20 JKBD O=C(OCc1cc(-c2ccccc2)on1)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 749551263 KQJZCSUAQXWCPR-UHFFFAOYSA-N 475.423 5.228 5 20 JKBD CSc1ccccc1NC(=O)[C@@H](C)Oc1ccc2c(-c3ccc([N+](=O)[O-])cc3)cc(=O)oc2c1 844161151 YCUFAWHIJJMFRO-OAHLLOKOSA-N 476.510 5.496 5 20 JKBD CC(C)C(=O)Nc1ccc(NC(=O)c2ccccc2NC(=O)c2ccc([N+](=O)[O-])cc2Cl)cc1 864372158 IPNITXSRKIICNV-UHFFFAOYSA-N 480.908 5.347 5 20 JKBD CC(C)(C)c1csc(NC(=O)c2ccccc2NC(=O)c2ccc([N+](=O)[O-])cc2Cl)n1 903134553 CPHYUSNVBDVIMJ-UHFFFAOYSA-N 458.927 5.507 5 20 JKBD O=[N+]([O-])c1ccc(N2CCCCC2)c(-c2nc(-c3ccc(-n4cnc5ccccc54)nc3)no2)c1 904487981 PBZSNCIHGYWODJ-UHFFFAOYSA-N 467.489 5.036 5 20 JKBD C[C@H](Nc1ccc(-c2nc(-c3ccc(Br)cc3)no2)cc1[N+](=O)[O-])c1ccccn1 904717836 RRGXSYBSSQRMPA-ZDUSSCGKSA-N 466.295 5.642 5 20 JKBD COc1cccc([C@H](CNC(=O)c2cc(Cl)ccc2[N+](=O)[O-])c2c[nH]c3ccccc23)c1OC 912663952 DACSBIDMMJYKAN-FQEVSTJZSA-N 479.920 5.309 5 20 JKBD Cc1csc(Sc2ccc(C(=O)Oc3ccc(NC(=O)C4CC4)cc3)cc2[N+](=O)[O-])n1 917051146 AXZITZQUABNNNM-UHFFFAOYSA-N 455.517 5.079 5 20 JKBD COc1ccc(CSCC(=O)Nc2ccccc2SC[C@H]2CC2(Cl)Cl)cc1[N+](=O)[O-] 917752454 VPOBEMIZZZPEGR-CQSZACIVSA-N 487.430 5.761 5 20 JKBD Cc1nc(-c2cccc(NC(=O)c3ccccc3NC(=O)c3ccc([N+](=O)[O-])cc3Cl)c2)no1 920747085 HKSLJSYBTJDDRZ-UHFFFAOYSA-N 477.864 5.111 5 20 JKBD O=C(NC1(c2ccc(NC(=O)c3cc(Br)ccc3[N+](=O)[O-])cc2)CCC1)c1ccco1 1790663668 JRMWUFOTXCSNLL-UHFFFAOYSA-N 484.306 5.012 5 20 JKBD O=C(Cc1ccc([N+](=O)[O-])cc1F)Nc1ccc(C2(NC(=O)c3ccc4cc[nH]c4c3)CCC2)cc1 1791184073 NSCQCSJSLAJGJU-UHFFFAOYSA-N 486.503 5.206 5 20 JKBD CCOc1cccc(C(=O)NC2(c3ccc(NC(=O)c4ccc([N+](=O)[O-])c(OC)c4)cc3)CCC2)c1 1792165877 SOEYCCHQBPKNET-UHFFFAOYSA-N 489.528 5.064 5 20 JKBD Cc1ccc(CCC(=O)N2CCCC[C@H]2C2CCN(C(=O)c3cccc(F)c3[N+](=O)[O-])CC2)cc1F 1824456883 IYKKGWKSVZSIGM-DEOSSOPVSA-N 499.558 5.048 5 20 JKBD O=C(c1cc2sccc2[nH]1)N1CCC([C@H]2CCCCN2C(=O)CCc2cccc([N+](=O)[O-])c2)CC1 1824841128 AZQNDHGTZYNSGG-HSZRJFAPSA-N 494.617 5.004 5 20 JKBD O=C(c1cc2cc([N+](=O)[O-])ccc2s1)N1CCC([C@H]2CCCCN2C(=O)CCc2ccco2)CC1 1825251697 YYJQVPMNGJGJEZ-JOCHJYFZSA-N 495.601 5.269 5 20 JKBD Cc1cc(C)nc(C(=O)N2CCCC[C@H]2C2CCN(C(=O)c3cc(Cl)cc([N+](=O)[O-])c3C)CC2)c1 1827320687 ZVHHWIMEVWYGMI-QHCPKHFHSA-N 499.011 5.116 5 20 JKBD CC[C@@H](C(=O)N1CCC([C@H]2CCCCN2C(=O)Cc2cc(F)ccc2[N+](=O)[O-])CC1)c1ccccc1 1832887809 YMGPAMHVIJHQSG-JWQCQUIFSA-N 495.595 5.090 5 20 JKBD Cc1ccc(NC(=O)[C@@H](Sc2nnc(-c3cccc(Cl)c3)n2N)c2ccccc2)c([N+](=O)[O-])c1 11309008 HGFFCNAEBLPYJX-FQEVSTJZSA-N 494.964 5.001 5 20 JKBD COc1cc(NC(=O)c2cc([N+](=O)[O-])ccc2Sc2ccc(Cl)cc2)cc(OC)c1OC 16642982 UVDQJNCSBXMACI-UHFFFAOYSA-N 474.922 5.678 5 20 JKBD O=C(OCc1nnc(-c2ccc([N+](=O)[O-])cc2)o1)c1ccccc1OCc1ccc(Cl)cc1 28614618 BHICDPVYONGHQS-UHFFFAOYSA-N 465.849 5.234 5 20 JKBD CCn1c(SCc2nc(-c3cccc([N+](=O)[O-])c3)no2)nnc1-c1ccc(C(C)(C)C)cc1 31843821 XYKOUUMDNYWPFN-UHFFFAOYSA-N 464.551 5.513 5 20 JKBD O=C(Nc1ccc(NC(=O)c2ccc(Cl)c([N+](=O)[O-])c2)c(C(F)(F)F)c1)c1ccc(F)cc1 69611171 JMUDGNQYQDJNGZ-UHFFFAOYSA-N 481.789 5.911 5 20 JKBD C[C@@H](Nc1ccc(C(=O)N[C@H](c2ccccc2)c2ccccn2)cc1[N+](=O)[O-])c1ccccn1 108754791 WAANRSACGNEDQF-IQGLISFBSA-N 453.502 5.077 5 20 JKBD CCOc1cc(CNCc2ccc(Cl)cc2)ccc1OCc1cc([N+](=O)[O-])cc2c1OCOC2 409618689 QPWGSKLPLQYNCN-UHFFFAOYSA-N 484.936 5.382 5 20 JKBD O=C(Cn1c(=O)oc2cc([N+](=O)[O-])ccc21)Nc1ccccc1-c1ccc(-c2ccccc2)cc1 410036914 DYBYRIIZAPTZBD-UHFFFAOYSA-N 465.465 5.475 5 20 JKBD CC(=O)Nc1ccc(CNC(=O)C/C(=C\c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)cc1 476573816 XXQCHURMERLZQA-XSFVSMFZSA-N 486.553 5.410 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)Nc2ccc(Cl)cc2NC(=O)c2ccco2)cc1SC 482960808 HXIUUHCUTWZOGS-UHFFFAOYSA-N 461.883 5.076 5 20 JKBD CC1CCN(C(=O)c2ccccc2NC(=O)c2ccc(NCc3ccccc3)c([N+](=O)[O-])c2)CC1 490722291 LLEICXQWGVLBCZ-UHFFFAOYSA-N 472.545 5.331 5 20 JKBD COc1ccccc1CN(Cc1cccs1)C(=O)c1csc(-c2ccc([N+](=O)[O-])cc2)n1 496536073 OUAZCLGNYDSOCP-UHFFFAOYSA-N 465.556 5.631 5 20 JKBD COc1cc(C(=O)N(Cc2ccc(Cl)c(Cl)c2)Cc2ccccn2)c([N+](=O)[O-])cc1OC 499648691 JMWHHHAOOODEFL-UHFFFAOYSA-N 476.316 5.156 5 20 JKBD CCCOc1cc(NC(=O)N(C)Cc2nc3ccccc3s2)c([N+](=O)[O-])cc1OCCC 515220933 WCVBWHVHBUEIQP-UHFFFAOYSA-N 458.540 5.446 5 20 JKBD Cc1sc(NC(=O)c2nn(Cc3ccccc3)c(=O)c3ccccc23)nc1-c1cccc([N+](=O)[O-])c1 515625719 CNSFGLWHLMJFMR-UHFFFAOYSA-N 497.536 5.037 5 20 JKBD CC(C)N(Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1)Cc1ccc(-c2ccccc2F)s1 516308111 IOUQBQSRQYGEMK-UHFFFAOYSA-N 452.511 5.923 5 20 JKBD CCOc1ccc(Oc2ccccc2NC(=O)c2cc(OCC(F)(F)F)ccc2[N+](=O)[O-])cc1 518173663 PTCCTKDCSRITNA-UHFFFAOYSA-N 476.407 5.979 5 20 JKBD CC[C@H](C)NC(=O)c1cccc(CNCc2ccc(Oc3ccc(F)cc3)c([N+](=O)[O-])c2)c1 518764216 BXRITZVJECCJTK-KRWDZBQOSA-N 451.498 5.344 5 20 JKBD O=C(C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)NCc1ccc2c(c1)OCCO2 600864517 KLNXXNUYBGTSNQ-UYRXBGFRSA-N 487.537 5.223 5 20 JKBD O=C(C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)Nc1ccc2c(c1)OCCCO2 602092942 BIXHBJYGFKYJQZ-NBVRZTHBSA-N 487.537 5.935 5 20 JKBD O=C(c1cnn(-c2cccc(C(F)(F)F)c2)c1C(F)(F)F)N1CCc2ccc([N+](=O)[O-])cc21 603446406 HJJDQALGIOKORH-UHFFFAOYSA-N 470.329 5.021 5 20 JKBD C[C@H]1C[C@@H](C)CN(c2ccc(C(=O)Nc3ccc4nc([C@H]5CCCO5)[nH]c4c3)cc2[N+](=O)[O-])C1 604480821 LXNQBPDYUDOBHT-VBURHUQHSA-N 463.538 5.057 5 20 JKBD C[C@H](Nc1cnn(-c2ccc([N+](=O)[O-])cc2)c(=O)c1Cl)c1cccc(NC(=O)c2ccccc2)c1 608830592 IIIKVWLPSIYMHZ-INIZCTEOSA-N 489.919 5.220 5 20 JKBD C[C@@H](NCc1ccc(-c2ccc([N+](=O)[O-])cc2Br)o1)c1ccc(-n2cncn2)cc1 608835457 IQLHOIMLAFBQLQ-CQSZACIVSA-N 468.311 5.049 5 20 JKBD COc1cc(Br)c(CNCc2ccc(Oc3ccc(F)cc3)c([N+](=O)[O-])c2)cc1OC 609223751 ULVZJQFTZOLWTE-UHFFFAOYSA-N 491.313 5.596 5 20 JKBD CN(C)C1CCN(C(=O)c2c3c(nc4ccccc24)/C(=C\c2cccc([N+](=O)[O-])c2)CCC3)CC1 609417100 HPDSXGFIGKTFAK-JZJYNLBNSA-N 470.573 5.186 5 20 JKBD Cc1cc[n+](/C(C(=S)Nc2ccccc2-c2ccccc2)=C(/O)c2ccc(C)c([N+](=O)[O-])c2)cc1 725764156 RNDVSDFVEPNYGM-UHFFFAOYSA-O 482.585 6.489 5 20 JKBD COc1cc(C(=O)NCc2ccc([C@H](C)O)cc2)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 726195557 UMQVJXDHZYCWCQ-AWEZNQCLSA-N 456.882 5.032 5 20 JKBD CCOc1cccc(NC(=S)/C(=C(/O)c2ccc(C)c([N+](=O)[O-])c2)[n+]2cccc(C)c2)c1 743052624 PGBXTEAJIUNGNK-UHFFFAOYSA-O 450.540 5.221 5 20 JKBD O=C(COc1ccc([N+](=O)[O-])c(F)c1)OCC(=O)N1c2ccccc2Sc2ccc(Cl)cc21 746606288 IXTJHRUPAOHPCM-UHFFFAOYSA-N 488.880 5.139 5 20 JKBD CCOc1cc([N+](=O)[O-])c(C(=O)O[C@@H](C)c2ccc(NC(=O)c3ccccc3)cc2)cc1OC 748014442 NYGWZPAEFMOBHR-INIZCTEOSA-N 464.474 5.172 5 20 JKBD CC(C)N(Cc1nnc(-c2cccc([N+](=O)[O-])c2)o1)C(=O)c1cc(Cl)ccc1Br 913125203 JZZBEHBCTBIBRM-UHFFFAOYSA-N 479.718 5.112 5 20 JKBD C[C@@H](OC(=O)[C@@H](C)Sc1ccc([N+](=O)[O-])cc1)C(=O)Nc1c(Cl)cc(Cl)cc1Cl 916522715 JPYILOSFHKPATG-NXEZZACHSA-N 477.753 5.606 5 20 JKBD Cc1csc(C(=O)NC2(c3ccc(NC(=O)/C=C/c4ccc([N+](=O)[O-])o4)cc3)CCC2)c1 1786205520 AOIIPHHAQRZXLX-VQHVLOKHSA-N 451.504 5.019 5 20 JKBD C[C@H]1CC[C@H](C(=O)NC2(c3ccc(NC(=O)c4nc5cc([N+](=O)[O-])ccc5[nH]4)cc3)CCC2)CC1 1790828163 WMQZKAPYOVIFRV-QAQDUYKDSA-N 475.549 5.045 5 20 JKBD O=C(CCc1cccc([N+](=O)[O-])c1)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc2c(Cl)cccc2s1 1797646647 ISYNPHDWYQHBNO-BCDXTJNWSA-N 498.004 5.348 5 20 JKBD CC[C@H](C(=O)N1CCC2(CCCN(C(=O)Cc3ccc(Cl)cc3[N+](=O)[O-])C2)CC1)c1ccccc1 1805480343 JDMGEGYETREIJV-QHCPKHFHSA-N 498.023 5.216 5 20 JKBD CCC[C@H]1CC[C@H](C(=O)NC[C@@H]2CCN(C(=O)c3cccc(F)c3[N+](=O)[O-])[C@@H]2c2cccnc2)CC1 1812789704 MTTFXTWLGBTDGY-OEEHMVQOSA-N 496.583 5.055 5 20 JKBD CC(C)(C)CCCCCC(=O)NC[C@H]1CCN(C(=O)c2ccc([N+](=O)[O-])cc2F)[C@@H]1c1cccnc1 1812808743 IDNHUZPLZYSOLT-CJFMBICVSA-N 498.599 5.445 5 20 JKBD Cc1ccc(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)c3ccc([N+](=O)[O-])cc3F)[nH]n2)c(Cl)c1 1823186344 JUKFWNUUMHQTTG-FQEVSTJZSA-N 485.903 5.039 5 20 JKBD CC(C)c1ccc(C(=O)N2CCCC[C@H]2c2cc(NC(=O)Cc3cc(F)ccc3[N+](=O)[O-])n[nH]2)cc1 1823487251 AJHNVZPVDYHLAS-QHCPKHFHSA-N 493.539 5.129 5 20 JKBD CCc1ccc(C(=O)N2CCC([C@H]3CCCCN3C(=O)c3cc(Cl)cc([N+](=O)[O-])c3C)CC2)cn1 1830735168 ZXVKVVHXLLUEFR-HSZRJFAPSA-N 499.011 5.061 5 20 JKBD Cc1c(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)[C@H]3CC=CCC3)CC2)cc(Cl)cc1[N+](=O)[O-] 1830735228 IBYYYQFNPUADGS-SIKLNZKXSA-N 474.001 5.146 5 20 JKBD O=C(c1cccc2ccncc12)N1CCC([C@@H]2CCCCN2C(=O)/C=C/c2ccccc2[N+](=O)[O-])CC1 1832904855 ZBEDNMVKWWDFCZ-GIPLCNRYSA-N 498.583 5.090 5 20 JKBD Cc1ccc(NC(=O)[C@@H](Sc2nnc(-c3ccccc3C)o2)c2ccccc2)c([N+](=O)[O-])c1 10015582 OIZUPOPIPJRULE-NRFANRHFSA-N 460.515 5.734 5 20 JKBD COc1cc(CSc2nnc(-c3ccc(OC(F)F)cc3)o2)c([N+](=O)[O-])cc1OC(F)F 10532644 JWBREAHKPGXCDG-UHFFFAOYSA-N 475.376 5.149 5 20 JKBD CCOc1ccc([C@@H](C)N[C@@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Br)c2ccccc2)cc1 11707808 ZATCFHCSYAKQMW-WAIKUNEKSA-N 498.377 5.787 5 20 JKBD CC(C)OC(=O)C[C@H](NC(=O)c1ccc(C2SCCCS2)cc1)c1ccccc1[N+](=O)[O-] 12861483 CWTGJTZYJSKBCV-IBGZPJMESA-N 474.604 5.276 5 20 JKBD O=c1c2ccc(C(F)(F)F)cc2nc2n1CC/C2=C\c1ccc(-c2ccccc2[N+](=O)[O-])o1 15189360 CPJHDNRWMBSDDJ-ACCUITESSA-N 453.376 5.528 5 20 JKBD Fc1cccc(-n2c(SCc3nc4ccccc4c4ccccc34)nnc2N2CCOCC2)c1 17948168 ZGSPTGMBNZEDMO-UHFFFAOYSA-N 471.561 5.237 5 20 JKBD C[C@H](Sc1ncc(-c2ccccc2)n1C[C@H]1CCCO1)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl 22239519 AEAQRIWXDMTUTO-MAUKXSAKSA-N 486.981 5.410 5 20 JKBD CC(C)CCSc1ccc(C(=O)N[C@@H](c2cccc(F)c2)c2nccn2C)cc1[N+](=O)[O-] 23780335 ZECWEYOEAAAHPC-NRFANRHFSA-N 456.543 5.125 5 20 JKBD CCOc1cc(C(=O)Nc2nc(-c3cccc(C(F)(F)F)c3)cs2)c([N+](=O)[O-])cc1OC 29013467 RQJQHGVPYYCCRG-UHFFFAOYSA-N 467.425 5.397 5 20 JKBD C[C@@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccc(Cl)c(-c2nnc3n2CCCCC3)c1 29711138 FXKMEUBFNXGDKV-CQSZACIVSA-N 471.970 5.352 5 20 JKBD C[C@H](Nc1ccc(C(=O)Nc2ccc(CCN3CCCC3)cc2)cc1[N+](=O)[O-])c1ccccn1 108917045 UBXMOBRBDFSIIE-IBGZPJMESA-N 459.550 5.054 5 20 JKBD C[C@@H](Nc1cccc(COCCc2ccccc2)c1)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl 109169772 XAMMXUUUHRXCFW-QGZVFWFLSA-N 453.926 5.447 5 20 JKBD Cc1ccc(C)c(Sc2ccc(NC(=O)Cn3nc(-c4cccc([N+](=O)[O-])c4)ccc3=O)cc2)c1 195741428 UTRSLBCLBBTKLK-UHFFFAOYSA-N 486.553 5.225 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)Nc2cc(C(C)(C)C)nn2-c2ccccc2C)cc1SC 482783970 WKGGJVAJGUCPRK-UHFFFAOYSA-N 454.552 5.369 5 20 JKBD CCOc1ccccc1CN(C)C(=O)Cc1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1 489705642 ARNCJUYSBQCUPG-UHFFFAOYSA-N 470.529 5.047 5 20 JKBD CC[C@@H](NCc1ccc(Oc2ccccc2Cl)c([N+](=O)[O-])c1)c1nnc2n1CCCCC2 518279197 ZWQOVEJMHTXTIJ-GOSISDBHSA-N 455.946 5.599 5 20 JKBD COc1c(Br)cc(Cl)cc1NC(=O)[C@H](C)Oc1ccc(Cl)cc1[N+](=O)[O-] 518830576 SOKVMECAUBJXOE-QMMMGPOBSA-N 464.099 5.079 5 20 JKBD COC(=O)Cc1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2Sc2ccc(Cl)cc2)cc1 520414798 ZKWKRXXCAGFYHT-UHFFFAOYSA-N 456.907 5.367 5 20 JKBD COc1cc(C(=O)Nc2ccnn2Cc2cccc(Cl)c2Cl)c([N+](=O)[O-])cc1OC(F)F 585708004 RZGMKXAXARHMDP-UHFFFAOYSA-N 487.246 5.009 5 20 JKBD CCN(C[C@@H]1CCOC1)C(=O)c1c2c(nc3ccccc13)/C(=C/c1ccc([N+](=O)[O-])cc1)CCC2 604431460 ODQLDQAQTBOCRR-PVKQIQIRSA-N 471.557 5.519 5 20 JKBD CCOc1ccc(C(=O)N2CCC(NCc3ccc(-c4ccc([N+](=O)[O-])cc4)s3)CC2)cc1 608836474 KFXFQGCGRSGSOP-UHFFFAOYSA-N 465.575 5.116 5 20 JKBD CSc1ccc([N+](=O)[O-])c(C(=O)N2c3ccccc3CC[C@H]2C(=O)Nc2ccccc2C)c1 608872834 RPHIHUPQRYDXEV-QHCPKHFHSA-N 461.543 5.225 5 20 JKBD CN1CCN(C(=O)C/C(=C\c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)Cc2ccccc21 609036053 CSAHVAWMWREEKL-LTGZKZEYSA-N 484.581 5.614 5 20 JKBD Cc1ccc(NC(=O)[C@H](OC(=O)c2csc(C(C)(C)C)n2)c2ccccc2)c([N+](=O)[O-])c1 726685686 CUELIZOGPQWTMS-LJQANCHMSA-N 453.520 5.194 5 20 JKBD CC(C)c1ncc(Cl)c(C(=O)O[C@@H](C(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)c2ccccc2)n1 744676973 WCIRTHNRIBDEEJ-LJQANCHMSA-N 489.315 5.352 5 20 JKBD CCCOc1nc2ccccc2cc1/C=C/C(=O)O[C@@H](C)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 746114864 XZJFTGMWHGLPNF-ISBHARSQSA-N 474.473 5.299 5 20 JKBD Cc1c(C(=O)O[C@@H](C)C(=O)Nc2ccccc2Oc2ccccc2)cc([N+](=O)[O-])c(C)c1[N+](=O)[O-] 748952105 VGLNXHPDLYQUGQ-INIZCTEOSA-N 479.445 5.096 5 20 JKBD CCCOc1ccc(-c2nc(C(=O)O[C@@H](C)C(=O)Nc3ccc([N+](=O)[O-])cc3Cl)cs2)cc1 750273629 CFZORPRYVRJNNK-ZDUSSCGKSA-N 489.937 5.345 5 20 JKBD C[C@H](Oc1ccc(Cl)cc1[N+](=O)[O-])c1nc(-c2ccc(CNC(=O)OC(C)(C)C)cc2)no1 904715596 HNHSUTLUACUZAY-ZDUSSCGKSA-N 474.901 5.463 5 20 JKBD Cc1ccc(NS(=O)(=O)c2ccc(Cl)c(C(=O)Nc3cccc([N+](=O)[O-])c3C)c2)cc1C 913412987 DPWAWKJGEWRNRC-UHFFFAOYSA-N 473.938 5.227 5 20 JKBD CC(C)c1cccc(NC(=S)/C(=C(/O)c2cccc([N+](=O)[O-])c2)[n+]2ccc(C(C)(C)C)cc2)c1 917614334 BQLSMHLJSJJEPN-UHFFFAOYSA-O 476.622 6.627 5 20 JKBD C[C@@H](Nc1ccc(C(=O)Nc2nc3ccc(Br)cc3s2)cc1[N+](=O)[O-])c1ccccn1 919678749 HZLLGLYVGHZBAF-GFCCVEGCSA-N 498.362 5.787 5 20 JKBD CC(=O)N(c1ccc(C(F)(F)F)cc1)c1nc(COC(=O)c2cc(C)cc([N+](=O)[O-])c2)cs1 920899240 BFHVRMCSQVONQY-UHFFFAOYSA-N 479.436 5.420 5 20 JKBD O=C(NC1(c2ccc(NC(=O)c3cc4[nH]ccc4s3)cc2)CCC1)c1cc(F)cc([N+](=O)[O-])c1 1789104827 YMPUBAIFWIDOEN-UHFFFAOYSA-N 478.505 5.338 5 20 JKBD O=C(NC1(c2ccc(NC(=O)c3cc(F)ccc3Cl)cc2)CCC1)c1ccc([N+](=O)[O-])o1 1790668263 XDYPZCJXEMSRKX-UHFFFAOYSA-N 457.845 5.042 5 20 JKBD Cc1ccc(CCC(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cc4cc([N+](=O)[O-])ccc4s2)C3)cc1 1801766428 HMFZVPOBNYCTGO-WKCHPHFGSA-N 477.586 5.003 5 20 JKBD CC(C)[C@@H](C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cccc(F)c2[N+](=O)[O-])[nH]n1)c1ccccc1 1814931831 QPRQWCVJOATSQG-JTHBVZDNSA-N 493.539 5.203 5 20 JKBD O=C(c1ccc([N+](=O)[O-])cc1F)N1CCC([C@@H]2CCCCN2C(=O)c2cccc3ccoc23)CC1 1830990646 HADPZTXVWUZMHQ-QHCPKHFHSA-N 479.508 5.027 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)N1CC2(CCCN2C(=O)c2sc3ccccc3c2Cl)C1 1843711042 ZCYAQZQIVHMXDV-UHFFFAOYSA-N 487.940 5.041 5 20 JKBD Cc1ccc(-c2nnc(S[C@@H](C)C(=O)Nc3ccc([N+](=O)[O-])cc3C(F)(F)F)o2)cc1C 10844694 SJBRFVBBIXRDMZ-LBPRGKRZSA-N 466.441 5.400 5 20 JKBD Cc1cccc(C(=O)Nc2ccc(NS(=O)(=O)c3c(Cl)cccc3Cl)cc2)c1[N+](=O)[O-] 11325465 MKJICNDBHIZAKO-UHFFFAOYSA-N 480.329 5.263 5 20 JKBD C[C@@H](Sc1nnc(-c2ccc(F)cc2)c2ccccc12)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl 20854421 SDGSRTNKLRVRJH-CYBMUJFWSA-N 482.924 6.117 5 20 JKBD C[C@@H](Sc1nnc(C2CC2)n1-c1ccccc1)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 21366366 AJRHGSBUABHTEA-GFCCVEGCSA-N 477.468 5.191 5 20 JKBD COCCn1c(S[C@@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)nc2cc(Cl)ccc21 32881410 ZGMUYZLZGKICQC-NSHDSACASA-N 469.350 5.017 5 20 JKBD O=C(C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)NC[C@H]1Cc2ccccc2O1 33117786 LSLOFVHTOZPCFP-CNSVBDKNSA-N 471.538 5.255 5 20 JKBD C[C@H](Sc1nnc2c(Cl)cc(C(F)(F)F)cn12)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl 36798307 OYLLNHYSPQBQAO-ZETCQYMHSA-N 480.255 5.082 5 20 JKBD CSc1ccc(-c2csc(NC(=O)Cn3c4ccccc4c(=O)c4ccccc43)n2)cc1 45748619 GTKWAIIEGGITBH-UHFFFAOYSA-N 457.580 5.639 5 20 JKBD O=C(Nc1ccccc1C(=O)NCCCc1c[nH]c2ccccc12)c1ccc([N+](=O)[O-])cc1Cl 78662383 WGMLFVRTVZFUNX-UHFFFAOYSA-N 476.920 5.344 5 20 JKBD O=c1c2ccccc2nc(SCc2nc(-c3cccc([N+](=O)[O-])c3)no2)n1C1CCCCC1 105965480 STSPVRFYQYQVJO-UHFFFAOYSA-N 463.519 5.152 5 20 JKBD O=C(NC[C@H]1CCCO1)c1cccc(CNCc2ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])cc2)c1 302955789 CZJUSGXMIHMACB-HSZRJFAPSA-N 495.963 5.239 5 20 JKBD Cc1nc(-c2ccccc2)sc1[C@H](C)N[C@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 303025410 PTMIIEMVOYINMH-GXTWGEPZSA-N 478.496 5.723 5 20 JKBD O=C(Nc1ccc(-n2cccn2)nc1)c1ccccc1Sc1ccc(C(F)(F)F)cc1[N+](=O)[O-] 477208629 SXFQANKFGZSNJD-UHFFFAOYSA-N 485.447 5.598 5 20 JKBD Cc1ccc(NC(=O)C2CC2)cc1NC(=O)Cc1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1 481920493 MWBLHFKNBNTHHX-UHFFFAOYSA-N 495.539 5.286 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)Nc2nc(C)c(Cc3ccccc3Cl)s2)cc1SC 482785776 ZZWHOOUDNZZTRA-UHFFFAOYSA-N 463.968 5.587 5 20 JKBD O=C(C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)NCCC(=O)N1CCCCCC1 498530564 WHJITAJRDYFXCD-LVZFUZTISA-N 492.601 5.044 5 20 JKBD CCOc1cc([N+](=O)[O-])c(C(=O)Nc2nc(-c3sccc3Br)cs2)cc1OC 500710933 FWULJDROWZAAHR-UHFFFAOYSA-N 484.353 5.202 5 20 JKBD CC(=O)N(c1ccc(C(F)(F)F)cc1)c1nc(COc2ccc(C)cc2[N+](=O)[O-])cs1 505903030 LZRGELWKGHPPKK-UHFFFAOYSA-N 451.426 5.642 5 20 JKBD COc1cc(C(=O)Nc2nc(-c3ccc(C)cc3)cs2)c([N+](=O)[O-])cc1OCc1cscn1 511642251 WLHLULBPDPNGIA-UHFFFAOYSA-N 482.543 5.323 5 20 JKBD COc1cc(C(=O)Nc2cc(NC(=O)c3cccc(C(F)(F)F)c3)ccc2C)ccc1[N+](=O)[O-] 512172183 KKWCVRZQIAQXRK-UHFFFAOYSA-N 473.407 5.435 5 20 JKBD COCCN(C(=O)CSc1cccc(C(F)(F)F)c1)c1nc(-c2ccc([N+](=O)[O-])cc2)cs1 515327731 HWORLGSUILVEDZ-UHFFFAOYSA-N 497.520 5.509 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Cl)[C@@H](NCc1ccc(F)cc1C(F)(F)F)c1ccccc1 515518281 CFGCQHHDAWSYAC-FQEVSTJZSA-N 481.833 5.876 5 20 JKBD CC(=O)N(c1ccc(Cl)cc1)c1nc(/C=C\c2nc3cc([N+](=O)[O-])ccc3s2)cs1 515598808 BQBOIPJFRHSYON-WTKPLQERSA-N 456.936 6.169 5 20 JKBD CCOc1cc(CN[C@H]2CCc3c(C)cccc32)ccc1OCc1cc([N+](=O)[O-])cc2c1OCOC2 518275875 WUNVBRLEGTWIQH-VWLOTQADSA-N 490.556 5.525 5 20 JKBD COc1ccc(Sc2ccc(NC(=O)c3ccc(-n4cncn4)c([N+](=O)[O-])c3)cc2Cl)cc1 519059217 PSKGQBGXHCAWTM-UHFFFAOYSA-N 481.921 5.241 5 20 JKBD COc1ccc(-c2nnc(Sc3ccc(Br)cc3[N+](=O)[O-])n2Cc2ccco2)cc1 524161597 FRMZCGNZIFBPEH-UHFFFAOYSA-N 487.335 5.417 5 20 JKBD O=C(C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)N1CCC[C@H]1c1cccs1 603451597 INCROFYZWZOPDA-TXOBRMIJSA-N 475.595 6.560 5 20 JKBD CCCOc1cc(NC(=O)N2CCCCC[C@H]2c2ccncc2)c([N+](=O)[O-])cc1OCCC 603660096 LKNQKDZWAMZWEK-FQEVSTJZSA-N 456.543 5.717 5 20 JKBD COc1ccccc1NS(=O)(=O)c1cc([N+](=O)[O-])ccc1N[C@H](C)c1cccc(OC(F)F)c1 603858498 INLNZMDZLKUHOG-CQSZACIVSA-N 493.488 5.179 5 20 JKBD COc1cc([C@@H](C)Nc2ccc([N+](=O)[O-])c(C(=O)N3CCCC3)c2)ccc1OC1CCCC1 603943470 IKXWDFWZTZHLNI-QGZVFWFLSA-N 453.539 5.334 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Cl)[C@H](NCc1ccccc1OCC(F)(F)F)c1ccccc1 604046672 JKWUAQUTSAMZCS-OAQYLSRUSA-N 493.869 5.659 5 20 JKBD C[C@H](NC(=O)c1cc([N+](=O)[O-])ccc1Sc1ccc(Cl)cc1)c1ccc2nc(O)[nH]c2c1 604243983 NWLORTMYWRSUFN-LBPRGKRZSA-N 468.922 5.472 5 20 JKBD C[C@H](NC(=O)C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)c1ccc2nc(O)[nH]c2c1 604244095 UHPVXZHOVJPKLP-BRYHAGSVSA-N 499.552 5.595 5 20 JKBD Cc1ccc(Sc2ccc(C(=O)Nc3ccccc3N3CCC(C(N)=O)CC3)cc2[N+](=O)[O-])cc1 604530977 BWIKQSFRGUQVSY-UHFFFAOYSA-N 490.585 5.008 5 20 JKBD O=[N+]([O-])c1ccc(-c2nn(-c3ccccc3)cc2CN[C@H](CC(F)(F)F)c2ccccc2)cc1 608836067 IAOLMLWMONZKIA-HSZRJFAPSA-N 466.463 6.231 5 20 JKBD Cc1csc(Sc2ccc(NC(=O)c3cn(C)nc3-c3ccc([N+](=O)[O-])cc3)c(C)c2)n1 608848087 WTSJZSPXEUSDJL-UHFFFAOYSA-N 465.560 5.472 5 20 JKBD CSc1ccc(C(=O)c2ccccc2C(=O)N2CCCO[C@H](c3ccccc3)C2)cc1[N+](=O)[O-] 609230885 RYVSBHCYRMZSKJ-QHCPKHFHSA-N 476.554 5.152 5 20 JKBD COc1ccc(CN(CC(F)(F)F)C(=O)CSc2ccc(C(F)(F)F)cc2[N+](=O)[O-])cc1 610637824 ZBDCXIUHFUTDJW-UHFFFAOYSA-N 482.402 5.305 5 20 JKBD CCc1cccc[n+]1/C(C(=S)Nc1ccc(OC(C)C)cc1)=C(/O)c1ccc([N+](=O)[O-])cc1 726573723 CXFKRJZOLTZCOG-UHFFFAOYSA-O 464.567 5.555 5 20 JKBD COC(=O)c1sc2ccccc2c1COC(=O)c1csc(-c2ccc([N+](=O)[O-])cc2)n1 726812525 HANDKHYGKOUYDT-UHFFFAOYSA-N 454.485 5.077 5 20 JKBD CC1CCN(c2ccc([N+](=O)[O-])cc2C(=O)Nc2ccc(Sc3nncn3C)c(Cl)c2)CC1 749618116 VQXBIYHESLYHFC-UHFFFAOYSA-N 486.985 5.017 5 20 JKBD O=C(OCc1nnc(-c2ccc([N+](=O)[O-])cc2)o1)/C(=C\c1ccc(Cl)cc1)c1ccc(F)cc1 768133082 IJGKWEDHYLGYDP-BKUYFWCQSA-N 479.851 5.721 5 20 JKBD COc1ccc(NC(=O)c2ccc(NCc3c(Br)cccc3[N+](=O)[O-])cc2)cc1 863988179 DEGYRUMJFJHUAV-UHFFFAOYSA-N 456.296 5.230 5 20 JKBD CN(C)c1ccc(NC(=O)C/C(=C/c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)cc1 875540575 BJSJDYZBNVCGGN-SDXDJHTJSA-N 458.543 5.840 5 20 JKBD O=C(Nc1ccc(OC[C@H](O)COc2ccc3ccccc3c2)cc1)c1cc([N+](=O)[O-])ccc1Cl 912076725 XMDNFUMBXOKCGK-NRFANRHFSA-N 492.915 5.472 5 20 JKBD C[C@H](NCc1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1)c1ccc2c(c1)CCC(=O)N2 915683204 PDEPYZMLFUDEMZ-HNNXBMFYSA-N 451.910 5.776 5 20 JKBD COCCN(C(=O)c1c(C)oc2ccc(OC)cc12)c1nc(-c2ccc([N+](=O)[O-])cc2)cs1 916097507 IZDNPDURNBCSNH-UHFFFAOYSA-N 467.503 5.075 5 20 JKBD Cc1cccc(-c2nn(-c3ccc(F)cc3)cc2C(=O)Nc2cc([N+](=O)[O-])c(F)cc2F)c1 918563379 MLYYQIUBYXDRAO-UHFFFAOYSA-N 452.392 5.426 5 20 JKBD CCOC(=O)N(C)c1ccc(NC(=O)c2ccc(Sc3nc(C)cs3)c([N+](=O)[O-])c2)cc1 919769932 JKOQJHXMLLUNDU-UHFFFAOYSA-N 472.548 5.356 5 20 JKBD Cc1ccc(NC(=O)c2cccc(C(F)(F)F)c2)cc1NC(=O)/C=C/c1ccc([N+](=O)[O-])cc1 920844521 FALUYORYNDQUTH-XYOKQWHBSA-N 469.419 5.826 5 20 JKBD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1c(F)cccc1Cl)c1cc2cc([N+](=O)[O-])ccc2s1 1799544177 VKOHWIJICXKXPO-QDMKHBRRSA-N 487.940 5.168 5 20 JKBD O=C(/C=C/c1ccc([N+](=O)[O-])o1)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc2c1oc1ccccc12 1801202101 KEONTEHOGDDCOD-LTYMNLCQSA-N 485.496 5.052 5 20 JKBD CC1(C)CCC(CC(=O)Nc2cc([C@H]3CCCCN3C(=O)Cc3cc(F)ccc3[N+](=O)[O-])[nH]n2)CC1 1820979675 SYZCASVDLHSWHM-JOCHJYFZSA-N 499.587 5.298 5 20 JKBD C/C(=C\c1cccs1)C(=O)N1CCCC[C@H]1C1CCN(C(=O)Cc2cc([N+](=O)[O-])ccc2F)CC1 1823714870 LUMFFHMVKYXXQZ-UFIOJNINSA-N 499.608 5.061 5 20 JKBD Cc1cc(C(=O)N2CCC([C@H]3CCCCN3C(=O)C3(c4cccc([N+](=O)[O-])c4)CCC3)CC2)c(C)o1 1830291617 QQFSKJSWZSGOTL-RUZDIDTESA-N 493.604 5.160 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)N1CCCC[C@H]1C1CCN(C(=O)C2(c3ccccc3)CC2)CC1 1830729310 DNRXMDQNBQQNRF-DEOSSOPVSA-N 493.579 5.007 5 20 JKBD C[C@H](Sc1nnc(Cc2ccccc2)n1-c1ccccc1)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 12105883 AFQYQILUOSCSJZ-KRWDZBQOSA-N 484.541 5.670 5 20 JKBD O=[N+]([O-])c1cc2c(c(CSc3nnc(Nc4cccc(Br)c4)s3)c1)OCOC2 16698843 PRJIUXGTJLBPMJ-UHFFFAOYSA-N 481.353 5.111 5 20 JKBD CCCn1c(S[C@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)nc2sc3c(c2c1=O)CCC3 17541502 AYPOWGTWXGTKSQ-GFCCVEGCSA-N 483.575 5.168 5 20 JKBD COc1cc(C(=O)NC[C@@H](c2ccco2)N2CCCC2)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 17702238 VOHUBBJMFWTLCA-IBGZPJMESA-N 485.924 5.209 5 20 JKBD O=C(CSc1nnc(-c2ccc(F)cc2)c2ccccc12)N1CCc2ccc([N+](=O)[O-])cc21 21860736 ZJNHPAADNXWUNM-UHFFFAOYSA-N 460.490 5.026 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)Nc2ccc(OCc3ccccn3)c(Cl)c2)cc1SC 483548258 BFOHUGSDBJKMCE-UHFFFAOYSA-N 459.911 5.205 5 20 JKBD O=C(Nc1ccc(Cl)c(C(=O)NC2CCCCC2)c1)c1csc(-c2ccc([N+](=O)[O-])cc2)n1 496614244 YBJAFLMJDAKHKT-UHFFFAOYSA-N 484.965 5.687 5 20 JKBD Cc1nc(-c2ccccc2)sc1[C@H](C)NC(=O)c1ccc(N[C@H](C)c2ccccn2)c([N+](=O)[O-])c1 507543275 ATDTZFIHUDHPDF-SJORKVTESA-N 487.585 6.086 5 20 JKBD O=C(Nc1ccc(CNCc2ccc(Oc3ccc(F)cc3)c([N+](=O)[O-])c2)cc1)c1ccncc1 507942931 VSLOLNJHTVAIRW-UHFFFAOYSA-N 472.476 5.463 5 20 JKBD CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccc(Br)cc1Br 509081184 GWXKNECBJMFAAA-UHFFFAOYSA-N 471.149 5.562 5 20 JKBD Cc1ccc(Sc2ccc(C(=O)N3CCC[C@@H](OCC(F)(F)F)C3)cc2[N+](=O)[O-])cc1 515623198 CYDYGUUIWKXLDM-MRXNPFEDSA-N 454.470 5.238 5 20 JKBD COc1cc(C(=O)N2CCC(c3c(C)[nH]c4ccccc34)CC2)c([N+](=O)[O-])cc1OC(F)F 516002324 LFSLRIOYSWONLH-UHFFFAOYSA-N 459.449 5.014 5 20 JKBD CCn1c(SCC(=O)N[C@H](c2ccccc2)c2nccs2)nc2cc3ccccc3cc2c1=O 518127548 DFRKQKQUKYRXID-HSZRJFAPSA-N 486.622 5.024 5 20 JKBD CCC(=O)Nc1ccc(N[C@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Br)c2ccccc2)cc1 520741036 IQEIEZIXHFQWLW-QFIPXVFZSA-N 497.349 5.498 5 20 JKBD O=C(Nc1cc(Cl)ccc1Cl)[C@@H]1CCCCN1C(=O)c1ccc(Cl)cc1[N+](=O)[O-] 522508509 HQLDZBSFSJYRCY-INIZCTEOSA-N 456.713 5.188 5 20 JKBD Cc1cc(C(=O)N2CCCC[C@@H]2C)ccc1NC(=O)c1ccc(NCc2ccccc2)c([N+](=O)[O-])c1 553380273 LLZNAAZPEJDBOR-FQEVSTJZSA-N 486.572 5.782 5 20 JKBD O=C1c2ccccc2N[C@@H](c2ccc(Oc3cccc([N+](=O)[O-])c3)cc2)N1Cc1cccnc1 602757357 JZJVLHAPCCSPKP-RUZDIDTESA-N 452.470 5.549 5 20 JKBD COc1cc(C(=O)Nc2cccc(Cn3cccn3)c2)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 603571085 LPKKTPGIEGIDLG-UHFFFAOYSA-N 478.892 5.546 5 20 JKBD CC(C)n1c(SCc2nc(-c3ccc([N+](=O)[O-])cc3)no2)nnc1-c1ccc(Cl)cc1Cl 603748351 MCSJMTFBKYQXCP-UHFFFAOYSA-N 491.360 6.083 5 20 JKBD Cc1cc(NC(=O)CSc2nnc(-c3ccc4ccccc4c3)o2)n(-c2ccc([N+](=O)[O-])cc2)n1 603953592 RSBALMMLRCKRAV-UHFFFAOYSA-N 486.513 5.023 5 20 JKBD C[C@@H](Nc1cnn(-c2ccc([N+](=O)[O-])cc2)c(=O)c1Cl)c1cccc(NC(=O)c2ccccc2)c1 608830593 IIIKVWLPSIYMHZ-MRXNPFEDSA-N 489.919 5.220 5 20 JKBD CSCC[C@H](NC(=O)c1ccc(Sc2ccc(C)cc2)c([N+](=O)[O-])c1)c1nnc2ccccn12 611197020 SANRZNSLTVUEOJ-IBGZPJMESA-N 493.614 5.321 5 20 JKBD CC(=O)CCc1ccc(OCc2cccc(C(=O)Nc3cc([N+](=O)[O-])c(F)cc3F)c2)cc1 727301122 CWNFEEGGQKDWNO-UHFFFAOYSA-N 454.429 5.226 5 20 JKBD CCOC(=O)Cc1csc(NC(=O)CCC(=O)c2ccc3ccc4cccc5ccc2c3c45)n1 727765536 JJSYFIBHQCGPOQ-UHFFFAOYSA-N 470.550 5.748 5 20 JKBD Cc1c(C(=O)Nc2ccc3c(c2)CCCN3C(=O)OC(C)(C)C)cc([N+](=O)[O-])c(C)c1[N+](=O)[O-] 729413588 RGDGQFBZZSVUAL-UHFFFAOYSA-N 470.482 5.060 5 20 JKBD COc1cc(C(=O)OCC(=O)c2ccc3c(c2)COC3)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 746555031 SROJMZHORBELNZ-UHFFFAOYSA-N 483.860 5.119 5 20 JKBD CCc1cccc(CC)c1NC(=O)[C@@H](C)OC(=O)c1csc(-c2ccc([N+](=O)[O-])cc2)n1 747957212 LIKHNNGPBNGDLG-CQSZACIVSA-N 453.520 5.027 5 20 JKBD Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)Oc1ccc(C(=O)Nc2scnc2-c2ccccc2)cc1 749357954 BWSUOLRHLQNNCT-UHFFFAOYSA-N 495.538 5.047 5 20 JKBD COc1cc(CN(C)C(=O)c2cc([N+](=O)[O-])ccc2N2CCCC2)ccc1OCc1ccccc1 753023627 XJZARESDIMODEH-UHFFFAOYSA-N 475.545 5.055 5 20 JKBD Cc1nc(COC(=O)c2c3c(nc4ccccc24)/C(=C\c2cccc([N+](=O)[O-])c2)CCC3)no1 783148616 GLXOAFGZCVLJCP-ATVHPVEESA-N 456.458 5.068 5 20 JKBD O=C(Nc1ccccc1C(=O)Nc1nnc(C2CCCCC2)s1)c1ccc([N+](=O)[O-])cc1Cl 783681642 OFTJLBVOMUPAKX-UHFFFAOYSA-N 485.953 5.652 5 20 JKBD CCOc1cc(NC(=O)c2ccccc2SCc2cc(C)no2)c([N+](=O)[O-])cc1OCC 790626748 AJSUHNWCHXFXTN-UHFFFAOYSA-N 457.508 5.233 5 20 JKBD CN(C)c1ccc(C(=O)c2ccccc2C(=O)OCc2coc(-c3ccc(F)cc3)n2)cc1[N+](=O)[O-] 888298515 ONTJBASTOJIQHS-UHFFFAOYSA-N 489.459 5.043 5 20 JKBD CC(C)(C)OC(=O)NC1(c2noc(-c3csc(-c4ccc([N+](=O)[O-])cc4)n3)n2)CCCC1 904416343 OJKNASNNBWVRDI-UHFFFAOYSA-N 457.512 5.062 5 20 JKBD CC(C)(C)OC(=O)Nc1cccc(C(=O)N(Cc2ccccc2[N+](=O)[O-])CC(F)(F)F)c1 915864877 GAQVGDYCDZNPJT-UHFFFAOYSA-N 453.417 5.147 5 20 JKBD O=C(Nc1cccc(C(=O)Oc2ccc(NC(=O)c3cc([N+](=O)[O-])ccc3Cl)cc2)c1)NC1CC1 917520860 WPHLMRCFZUBMNI-UHFFFAOYSA-N 494.891 5.004 5 20 JKBD O=C(OCc1nc(-c2ccc([N+](=O)[O-])cc2)no1)/C(=C\c1ccc(F)cc1)c1cccs1 918833073 JNMHOLLDQWDIDC-PDGQHHTCSA-N 451.435 5.129 5 20 JKBD Cc1nc(CSc2ccccc2C(=O)OCc2nc(-c3ccc([N+](=O)[O-])cc3)no2)cs1 918938034 DUKZNWGQJNUMCE-UHFFFAOYSA-N 468.516 5.059 5 20 JKBD CC(=O)N(c1ccc(C)cc1)c1nc(COC(=O)Cn2c3ccccc3c(=O)c3ccccc32)cs1 919055877 RPQQTWROTSVMOA-UHFFFAOYSA-N 497.576 5.348 5 20 JKBD C[C@@H](Nc1ccc(C(=O)Oc2ccc(NC(=O)c3ccco3)cc2)cc1[N+](=O)[O-])c1ccccn1 920111608 OMEONTPLRZKYGF-MRXNPFEDSA-N 472.457 5.227 5 20 JKBD CN(C)c1ccc([N+](=O)[O-])cc1C(=O)NC1(c2ccc(NC(=O)C[C@H]3C[C@@H]4CC[C@H]3C4)cc2)CCC1 1791325557 MRKIIMABNYWVBI-HSALFYBXSA-N 490.604 5.235 5 20 JKBD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc2cc([N+](=O)[O-])ccc2s1)[C@@H]1C[C@@H]1c1ccc(F)cc1 1801206214 VSCBEDNTYZLTMU-MGFHSNFOSA-N 493.560 5.004 5 20 JKBD O=C(/C=C/c1ccc([N+](=O)[O-])o1)Nc1cc([C@@H]2CCCCN2C(=O)[C@@H]2CCC[C@@H]3CCCC[C@H]32)[nH]n1 1814967790 MXVVFNVFNAJTOT-DIWOXLPOSA-N 495.580 5.223 5 20 JKBD O=C(/C=C/C1CCCCC1)N1CCC([C@H]2CCCCN2C(=O)c2cc(F)cc([N+](=O)[O-])c2)CC1 1830618046 JHGHVSGVISODPE-HBRDYDSTSA-N 471.573 5.104 5 20 JKBD Cc1ccc(/C=C/C(=O)N2CCC([C@@H]3CCCCN3C(=O)c3cccc(F)c3[N+](=O)[O-])CC2)s1 1830622080 CCYRZGBATDJOFQ-NEQMZLFVSA-N 485.581 5.051 5 20 JKBD Cc1c(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3ccccc3F)CC2)cc(Cl)cc1[N+](=O)[O-] 1830736277 UWUNDVQDLZJFSE-JOCHJYFZSA-N 487.959 5.243 5 20 JKBD Cc1ccc(C(=O)N2CCC([C@H]3CCCCN3C(=O)CSc3ccccc3[N+](=O)[O-])CC2)cc1F 1831777348 QMPQGKFNQMHGKF-JOCHJYFZSA-N 499.608 5.068 5 20 JKBD CC(=O)N(c1ccc(C)c(C)c1)c1nc(COC(=O)c2ccc(Cl)c([N+](=O)[O-])c2)cs1 11025133 LYGNKBBGQCGLRF-UHFFFAOYSA-N 459.911 5.363 5 20 JKBD COc1ccc(NC(=O)[C@@H](C)Sc2ncnc3sc(-c4ccccc4)cc23)c([N+](=O)[O-])c1 16763169 RKDOQLYVDHQYHA-CYBMUJFWSA-N 466.544 5.394 5 20 JKBD COc1ccc(-n2c(S/C=C/c3ccc([N+](=O)[O-])o3)nnc2-c2ccccc2OC)cc1 106912466 PSJFYHNAKWDRDO-BUHFOSPRSA-N 450.476 5.216 5 20 JKBD CC(C)n1ncc2c(C(=O)OCc3nc(-c4ccc([N+](=O)[O-])cc4)no3)cc(-c3cccs3)nc21 108803977 UTHMUCKWUNAQBR-UHFFFAOYSA-N 490.501 5.056 5 20 JKBD O=C(c1ccn(-c2ccc([N+](=O)[O-])cc2)n1)N1CCC(c2nc3cc(Cl)ccc3s2)CC1 109277713 CKWGVFZMVJQGDX-UHFFFAOYSA-N 467.938 5.063 5 20 JKBD O=C(Cn1ccc2cc([N+](=O)[O-])ccc21)Nc1ccc(NC(=O)c2ccoc2)cc1C(F)(F)F 109320778 MCEIBIQKIIZNNR-UHFFFAOYSA-N 472.379 5.052 5 20 JKBD O=C(Nc1ncn(Cc2ccc(Br)cc2)n1)c1cc2ccccc2c2cccnc12 109554225 OOAMZYWKHFDWJK-UHFFFAOYSA-N 458.319 5.043 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)N[C@H](c2ccc3c(c2)CCCC3)c2cccs2)cc1SC 112529920 JXZYMYVHDLEGHC-HSZRJFAPSA-N 468.600 5.785 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)N(Cc2ccccc2)[C@H](C)c2cccc(NC(C)=O)c2)cc1SC 482028340 YOBGZDUTLSZUIR-QGZVFWFLSA-N 493.585 5.687 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)Nc2ccc3[nH]c(-c4ccc(F)cc4)nc3c2)cc1SC 482821863 XJPUQXRZNPGFDD-UHFFFAOYSA-N 452.467 5.260 5 20 JKBD Cc1nnc(Sc2ccc(NC(=O)c3ccc(Cn4nc(C)c([N+](=O)[O-])c4C)cc3)c(C)c2)s1 505870743 BGKYNRILIDJJAI-UHFFFAOYSA-N 494.602 5.328 5 20 JKBD C[C@@H](Nc1ccc(C(=O)NCc2ccc(OCc3ccccn3)cc2)cc1[N+](=O)[O-])c1ccccn1 507400510 GHKSZLKGXVGCCS-LJQANCHMSA-N 483.528 5.067 5 20 JKBD Cc1ccc(C(=O)Nc2cccc(CNC(=O)Nc3cc([N+](=O)[O-])ccc3OC(F)F)c2)cc1 511541784 UHIGQGHEWSDXNO-UHFFFAOYSA-N 470.432 5.079 5 20 JKBD CCOc1cc(C(=O)Nc2cc(-c3ccccc3)nn2-c2ccccc2)c([N+](=O)[O-])cc1OC 514740615 FTKXRPIGKUOYFR-UHFFFAOYSA-N 458.474 5.107 5 20 JKBD CCOc1cc([N+](=O)[O-])c(C(=O)Nc2ccc(NC(=O)Nc3ccc(Cl)cc3)cc2)cc1OC 516800341 HKNPJUZSHFWSIX-UHFFFAOYSA-N 484.896 5.552 5 20 JKBD Cc1ccc(S(=O)(=O)Nc2ccc(NC(=O)Nc3ccc([N+](=O)[O-])cc3Cl)cc2)cc1 518522566 GQMUGSGSNFDYPE-UHFFFAOYSA-N 460.899 5.001 5 20 JKBD COCc1nc(C(=O)Nc2cc([N+](=O)[O-])ccc2Nc2cccc(C(F)(F)F)c2)cs1 519946451 IYRPWTRDKLZNAW-UHFFFAOYSA-N 452.414 5.212 5 20 JKBD C[C@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)Nc1ccc(C(=O)N(C)C2CCCCC2)cc1 520389655 BTTYZLNJNITOSY-HNNXBMFYSA-N 459.930 5.059 5 20 JKBD COc1ccc(COCc2cccc(NC(=O)Cn3c4ccccc4c(=O)c4ccccc43)c2)cc1 521377048 AHYMUKUQFFJQMS-UHFFFAOYSA-N 478.548 5.519 5 20 JKBD C[C@@H](Nc1ccc(C(=O)NC(C)(C)c2cccc(C(F)(F)F)c2)cc1[N+](=O)[O-])c1ccccn1 550496056 ZUYJNHUHSHNOCR-OAHLLOKOSA-N 472.467 5.847 5 20 JKBD CCCc1noc2nc(C3CC3)cc(C(=O)N(Cc3ccccc3[N+](=O)[O-])CC(F)(F)F)c12 603741835 APHHQRKFODNZBZ-UHFFFAOYSA-N 462.428 5.166 5 20 JKBD O=C(NCc1csc2ccccc12)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 603907106 JBUCPVDRDRFRGB-UHFFFAOYSA-N 463.481 5.361 5 20 JKBD O=C(C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1)N1CCC(Cc2cccc(F)c2)CC1 603927872 AEMGOJLAGOXTED-UHFFFAOYSA-N 493.501 5.450 5 20 JKBD CCOC(=O)c1cc(C(=O)Nc2ccc(C(=O)N(C)C3CCCCC3)c(Cl)c2)cc([N+](=O)[O-])c1 603982248 BORCTLVRGXXFCV-UHFFFAOYSA-N 487.940 5.082 5 20 JKBD O=C(c1ccc(N2CCCC2)c([N+](=O)[O-])c1)N(Cc1cccnc1)c1ccc(Br)cc1 603990044 HAGVSPUGCBEIMP-UHFFFAOYSA-N 481.350 5.200 5 20 JKBD CCOc1cc(C(=O)Nc2ccc(NC(=O)OC(C)(C)C)cc2C(F)(F)F)c([N+](=O)[O-])cc1OC 729655097 FXOXMWBQINNZRV-UHFFFAOYSA-N 499.442 5.620 5 20 JKBD Cc1cc(C(=O)[C@@H](C)OC(=O)c2csc(-c3ccc([N+](=O)[O-])cc3)n2)c(C)n1Cc1ccco1 747954658 CMXOMVWICLQTQL-MRXNPFEDSA-N 479.514 5.206 5 20 JKBD C[C@@H](Nc1ccc(C(=O)Oc2ccccc2Oc2ccccn2)cc1[N+](=O)[O-])c1ccccn1 748675697 NWYBNJGXMONAKD-QGZVFWFLSA-N 456.458 5.569 5 20 JKBD CCCOc1cc(NC(=O)c2cc([N+](=O)[O-])ccc2Br)c([N+](=O)[O-])cc1OCCC 751072832 XFEWLUJWNDKRDN-UHFFFAOYSA-N 482.287 5.095 5 20 JKBD CC(C)Cn1cc([C@@H]2N(Cc3ccc(-c4cccc([N+](=O)[O-])c4)o3)CC23CCOCC3)cn1 849479743 UDBTZQPFOSJWNK-DEOSSOPVSA-N 450.539 5.061 5 20 JKBD Cc1cc(C)n([C@@H](C)C(=O)Nc2ccc(NCc3ccc(Cl)cc3[N+](=O)[O-])cc2Cl)n1 864007285 FTSQZBMURHRSCI-AWEZNQCLSA-N 462.337 5.527 5 20 JKBD COc1ccc([C@@H](CNC(=O)c2cc([N+](=O)[O-])ccc2N2CCCC2)c2c[nH]c3ccccc23)cc1 912617273 OBOUBELSMQXGOS-XMMPIXPASA-N 484.556 5.247 5 20 JKBD O=C(O[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1)c1cc2cc([N+](=O)[O-])ccc2o1 917262749 BOOUBDNTHKNDEN-NRFANRHFSA-N 495.831 5.439 5 20 JKBD COc1cc(NC(=O)c2ccccc2Cl)c(C(=O)OCc2cc(F)ccc2[N+](=O)[O-])cc1OC 918825755 QZGFRTQSRWPLHP-UHFFFAOYSA-N 488.855 5.014 5 20 JKBD Cc1nc(-c2ccc(Cl)s2)sc1C(=O)O[C@H](C)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 921103769 PNKRPUSUNDRFHY-SNVBAGLBSA-N 476.923 5.710 5 20 JKBD Cc1nc(-c2ccc(Cl)s2)sc1C(=O)OCc1nnc(-c2ccc([N+](=O)[O-])cc2)o1 921104919 ZOFYJZYHYHQMLF-UHFFFAOYSA-N 462.896 5.149 5 20 JKBD COc1ccc(-c2nc(CC(=O)OCc3nc4ccccc4c4ccccc34)cs2)cc1OC 921294019 CXFJEEHQUBUHMM-UHFFFAOYSA-N 470.550 5.815 5 20 JKBD O=C(NC1(c2ccc(NC(=O)c3ccc(Cl)cc3F)cc2)CCC1)c1ccc([N+](=O)[O-])o1 1785942267 ZSJMONKHEFRHQY-UHFFFAOYSA-N 457.845 5.042 5 20 JKBD O=C(Cc1cccc([N+](=O)[O-])c1)NC1(c2ccc(NC(=O)c3cccc4cnccc34)cc2)CCC1 1789324143 GUPMYMYVBDPOAK-UHFFFAOYSA-N 480.524 5.133 5 20 JKBD O=C(Cc1cccc([N+](=O)[O-])c1)NC1(c2ccc(NC(=O)[C@H]3C[C@@H]3c3ccccc3)cc2)CCC1 1791528300 YFXOAXAEVZPXNG-RPBOFIJWSA-N 469.541 5.075 5 20 JKBD O=C(NC1(c2ccc(NC(=O)[C@H]3C[C@H]3c3ccccc3)cc2)CCC1)c1cc([N+](=O)[O-])cc2c1OCC2 1791533984 PKMWOGIQWPIFAB-ZEQRLZLVSA-N 497.551 5.081 5 20 JKBD CC(C)c1ccc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)C2(c3cccc([N+](=O)[O-])c3)CCC2)cc1 1800040224 ACZSTKWCUXDXLM-BKFWDETESA-N 475.589 5.092 5 20 JKBD COc1cc(Cl)cc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)c1 1801208369 AROFIKVOTCKQKT-BCDXTJNWSA-N 499.976 5.037 5 20 JKBD CC(C)[C@H](C(=O)N1CCCC2(CCN(C(=O)c3ccc([N+](=O)[O-])cc3F)CC2)C1)c1ccccc1 1805624009 XZYFFTYBRIXRMG-DEOSSOPVSA-N 481.568 5.019 5 20 JKBD O=C(NC[C@@H]1CCN(C(=O)CCC2CCC2)[C@@H]1c1cccnc1)c1cc2cc([N+](=O)[O-])ccc2s1 1812304931 XIZGORJOABCZFK-UQBPGWFLSA-N 492.601 5.104 5 20 JKBD O=C(c1cc2[nH]ccc2s1)N1CCC([C@@H]2CCCCN2C(=O)CCc2cccc([N+](=O)[O-])c2)CC1 1824839509 JNAAUJZKLFAKJA-QFIPXVFZSA-N 494.617 5.004 5 20 JKBD CC1(C)CCC(CC(=O)N2CCC([C@H]3CCCCN3C(=O)c3ccc(O)c([N+](=O)[O-])c3)CC2)CC1 1830490187 BNKZDJKSVRXKGE-JOCHJYFZSA-N 485.625 5.140 5 20 JKBD Cc1cccc(Cl)c1C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cc(F)cc([N+](=O)[O-])c2)CC1 1830595553 HJVFKTUTFHCMDE-JOCHJYFZSA-N 487.959 5.243 5 20 JKBD C[C@@H](OC(=O)c1ccc(COc2ccccc2)cc1)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl 9480558 ZWGWJPRYWXCHNU-OAHLLOKOSA-N 454.866 5.011 5 20 JKBD C[C@@H](OC(=O)COc1ccccc1-c1ccccc1)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 10593850 XMXIPIQLYMXYSY-OAHLLOKOSA-N 488.418 5.230 5 20 JKBD CCOc1ccc(Oc2ccc(Cl)cc2NC(=O)COc2ccc(C=O)cc2[N+](=O)[O-])cc1 11642271 PBPWHIGPCPMXNP-UHFFFAOYSA-N 470.865 5.269 5 20 JKBD COc1ccc(NC(=O)[C@@H](C)Sc2nnc(-c3ccccc3)c3ccccc23)c([N+](=O)[O-])c1 16829624 QVCKVENAOHJYHN-OAHLLOKOSA-N 460.515 5.333 5 20 JKBD O=C(C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)Nc1cccc(N2CCCC2=O)c1 18092173 KEZAMPJLLAHUFP-CYVLTUHYSA-N 498.564 5.901 5 20 JKBD Cn1c(SCC(=O)Nc2ccc(OC(F)F)c(Cl)c2)nc2cc3ccccc3cc2c1=O 22253733 MLQGMTCJSNYUFT-UHFFFAOYSA-N 475.904 5.072 5 20 JKBD C[C@H](Sc1ncc(-c2ccccc2)n1CC(F)(F)F)C(=O)Nc1cccc([N+](=O)[O-])c1 109622067 XHLLNSWCWXOPLZ-ZDUSSCGKSA-N 450.442 5.140 5 20 JKBD O=C(Nc1cccc(CNC(=O)c2csc(-c3ccc([N+](=O)[O-])cc3)n2)c1)c1cccc(F)c1 496588333 BAUPCDUXRGHOPT-UHFFFAOYSA-N 476.489 5.040 5 20 JKBD O=C(CNC(=O)c1ccccc1Sc1ccc(C(F)(F)F)cc1[N+](=O)[O-])Nc1cccc(F)c1 497066381 RYLTYEQCWPKBKH-UHFFFAOYSA-N 493.438 5.272 5 20 JKBD Cn1cnnc1Sc1ccc(C(=O)N2CCC[C@H]2c2ccc(C(C)(C)C)cc2)cc1[N+](=O)[O-] 502729271 XIIKOMHEBVDTQR-IBGZPJMESA-N 465.579 5.149 5 20 JKBD O=C(Cc1csc(-c2cccc(C(F)(F)F)c2)n1)Nc1cc2c(cc1[N+](=O)[O-])OCCCO2 508783856 JYHCLUBFHHKMIP-UHFFFAOYSA-N 479.436 5.080 5 20 JKBD Cc1noc([C@H]2CCCN(C(=O)c3ccccc3Sc3ccc(C(F)(F)F)cc3[N+](=O)[O-])C2)n1 509138741 MQOUAGCWPWTVIT-AWEZNQCLSA-N 492.479 5.476 5 20 JKBD COc1ccc(NC(=O)CNc2ccccc2NC(=O)c2ccc(C(C)(C)C)cc2)c([N+](=O)[O-])c1 511085953 MQTXNTFHFRSGFA-UHFFFAOYSA-N 476.533 5.204 5 20 JKBD Cc1cc(N[C@@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2ccccc2)ccc1Oc1cccnc1 512519972 VTCREWPWSBKGSC-RUZDIDTESA-N 488.931 6.536 5 20 JKBD COc1ccc(Oc2ccc([N+](=O)[O-])cc2C(=O)N(C)Cc2ccccc2N2CCCC2)cc1 512587998 RTJPBUMEKLWHMX-UHFFFAOYSA-N 461.518 5.268 5 20 JKBD COc1ccc([C@@H](NC(=O)C2CCN(c3ccccc3[N+](=O)[O-])CC2)c2ccc(C)cc2)cc1 512880054 OIPAXNFPWBJCAF-SANMLTNESA-N 459.546 5.034 5 20 JKBD CN(Cc1nc2ccccc2[nH]1)C(=O)C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1 518795206 FRNVBMRZUCSCBC-JXAWBTAJSA-N 483.553 5.670 5 20 JKBD Cc1cc(C(=O)NC2CCCC2)ccc1NC(=O)c1ccc(N[C@@H](C)c2ccccn2)c([N+](=O)[O-])c1 520481692 AMJVSMWUFBAJIV-SFHVURJKSA-N 487.560 5.396 5 20 JKBD CN1CCC2(CC1)C[C@@H](NC(=O)c1ccc(Nc3ccccc3)c([N+](=O)[O-])c1)c1ccccc1O2 520496279 YCORRXUDVSPHFR-HSZRJFAPSA-N 472.545 5.056 5 20 JKBD CC(C)N1CCC[C@@H](CNC(=O)C/C(=C\c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)C1 521143241 RXQKWHQRWFAFKQ-LQOIVRHRSA-N 478.618 5.372 5 20 JKBD C[C@H](c1cccc(NC(=O)c2ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])cc2)c1)N1CCOCC1 521505428 OZZHYEQLHIPHNI-QGZVFWFLSA-N 481.936 5.686 5 20 JKBD CCOc1cc(NC(=O)N2CCc3c(ccc(Cl)c3Cl)C2)c([N+](=O)[O-])cc1OCC 523198751 RGVQHURIXOWIJJ-UHFFFAOYSA-N 454.310 5.289 5 20 JKBD CCN(C(=O)c1cc(OC)c(OC(F)F)cc1[N+](=O)[O-])C(c1ccccc1)c1ccccc1 603529461 COTNOWPTWHCSHF-UHFFFAOYSA-N 456.445 5.457 5 20 JKBD COc1ccc([C@H](Cc2ccc(F)cc2)N[C@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)cc1 604459754 IZEUCPFMMWLAIE-MWTRTKDXSA-N 462.481 5.427 5 20 JKBD CN(C)CCn1cc(NC(=O)c2c3c(nc4ccccc24)/C(=C\c2ccc([N+](=O)[O-])cc2)CCC3)cn1 608878897 KQIFNQUGWJOVCB-SILNSSARSA-N 496.571 5.030 5 20 JKBD O=C(C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)N1CCC[C@H](N2CCCC2)C1 609346254 WDQISEIVQDURTL-YEMUAQJGSA-N 476.602 5.222 5 20 JKBD CCOc1cc(NC(=O)c2sc(COc3ccc(Cl)cc3)nc2C)c([N+](=O)[O-])cc1OCC 619212834 KCMAVLQTIHMBLV-UHFFFAOYSA-N 491.953 5.642 5 20 JKBD CCOc1ccc(OCC)c(NC(=S)/C(=C(/O)c2ccc(C)c([N+](=O)[O-])c2)[n+]2ccc(C)cc2)c1 726961705 FPVKOVDYDJRMKV-UHFFFAOYSA-O 494.593 5.620 5 20 JKBD O=C(Nc1cc([N+](=O)[O-])c(F)cc1F)[C@@H](Oc1ccc(Br)cc1F)c1ccccc1 730471434 YBUUSNGRTAQWTI-IBGZPJMESA-N 481.224 5.533 5 20 JKBD Cc1ccc(-c2nc(C)c(C(=O)OCC(=O)Nc3cc([N+](=O)[O-])ccc3Cl)s2)c(C)c1 746597178 MIKRGOUJIGALLN-UHFFFAOYSA-N 459.911 5.092 5 20 JKBD CCCOc1ccc(Oc2ncccc2CNC(=O)c2cc([N+](=O)[O-])c(C)c([N+](=O)[O-])c2C)cc1 748622772 FXKNXGBQEQKDBY-UHFFFAOYSA-N 480.477 5.026 5 20 JKBD O=[N+]([O-])c1cc(C(F)(F)F)c(Cl)cc1Sc1nnc(-c2ccncc2)n1Cc1ccccc1 799771048 SJAIOLIBUDJXKJ-UHFFFAOYSA-N 491.882 6.120 5 20 JKBD COc1ccc2nc(C(=O)Oc3ccc4c(-c5ccc([N+](=O)[O-])cc5)cc(=O)oc4c3)ccc2c1 811950364 DBJWJQKMUGTXBS-UHFFFAOYSA-N 468.421 5.144 5 20 JKBD O=[N+]([O-])c1cc(S(=O)(=O)C(F)F)ccc1N1CCC[C@H]1c1ccc(F)c(C(F)(F)F)c1 864023649 XEIDQURZDPWYGP-AWEZNQCLSA-N 468.375 5.091 5 20 JKBD COc1ccc(-c2nc(Cc3noc(-c4csc(-c5cccc([N+](=O)[O-])c5)n4)n3)co2)cc1 904332287 PRANECLJZHHDJT-UHFFFAOYSA-N 461.459 5.023 5 20 JKBD COc1cc(C)ccc1Oc1ccc(NC(=O)c2ccc(Br)c([N+](=O)[O-])c2)cn1 915179237 ORQUZQCCLSFRCJ-UHFFFAOYSA-N 458.268 5.114 5 20 JKBD Cc1ccc(/C(O)=C(/C(=S)N[C@@H](C)c2ccccc2)[n+]2ccc(C(C)(C)C)cc2)cc1[N+](=O)[O-] 917613232 QLEMJFQTCAQACG-IBGZPJMESA-O 476.622 6.050 5 20 JKBD Cc1ccc(/C(O)=C(/C(=S)Nc2cccc(C(C)C)c2)[n+]2ccc3c(c2)CCCC3)cc1[N+](=O)[O-] 917614455 DJZYSPUJHKQOPF-UHFFFAOYSA-O 488.633 6.516 5 20 JKBD CC1CCN(c2ccc([N+](=O)[O-])cc2C(=O)Nc2ccccc2COCc2ccccc2)CC1 918631226 BLVFEFJMWNPIGF-UHFFFAOYSA-N 459.546 5.800 5 20 JKBD CC(C)(C)C[C@H](NC(=O)COC(=O)Cn1c2ccccc2c(=O)c2ccccc21)c1ccc(F)cc1 919056041 SOGNMKCZHCOXRK-QHCPKHFHSA-N 488.559 5.131 5 20 JKBD C[C@@H](OC(=O)c1ccc(SCc2ccccc2)cc1)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 919504349 LDRJPORULACLMK-MRXNPFEDSA-N 461.499 5.855 5 20 JKBD Cc1cc(C(=O)O[C@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)c2ccc(Br)cc2n1 919522256 BUTPHISLCWKDSC-GFCCVEGCSA-N 483.278 5.182 5 20 JKBD Cc1c(C(=O)COC(=O)c2ccc(N[C@@H](C)c3ccccn3)c([N+](=O)[O-])c2)oc2ccccc12 920548789 SSMGYHHYZRVVMY-INIZCTEOSA-N 459.458 5.257 5 20 JKBD C[C@H](OC(=O)c1cnc(-c2ccccc2F)s1)C(=O)Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1 920700931 CEFQLAGACRACAY-LBPRGKRZSA-N 498.517 5.165 5 20 JKBD O=C(Cc1cccc([N+](=O)[O-])c1)NC1(c2ccc(NC(=O)c3cc(-c4ccccc4)on3)cc2)CCC1 1785784468 USANVROHASQZHR-UHFFFAOYSA-N 496.523 5.240 5 20 JKBD O=C(Cc1noc2ccccc12)Nc1ccc(C2(NC(=O)CCc3cccc([N+](=O)[O-])c3)CCC2)cc1 1788168899 CSOBPHBXNNUWIW-UHFFFAOYSA-N 498.539 5.045 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)c3cccc4c3oc3ccccc34)CCC2)cc1)c1ccc([N+](=O)[O-])[nH]1 1790187077 WBMVWLIHKKVLQS-UHFFFAOYSA-N 494.507 5.884 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)c3ccc4ncccc4c3)CCC2)cc1)c1cc(F)cc([N+](=O)[O-])c1 1790696706 ZEIZUGCVWFTWBH-UHFFFAOYSA-N 484.487 5.344 5 20 JKBD Cc1cc(O)c([N+](=O)[O-])cc1C(=O)Nc1ccc(C2(NC(=O)c3cccc4cnccc34)CCC2)cc1 1790809516 NVOQCLPAKGXEGS-UHFFFAOYSA-N 496.523 5.219 5 20 JKBD Cc1cc(Cl)ccc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(Cl)cc([N+](=O)[O-])c1C 1800708689 AHNPNXZRJYWSEF-BCDXTJNWSA-N 476.360 5.084 5 20 JKBD O=C(/C=C/C1CCCCC1)N1CCC2(CCCN(C(=O)Cc3ccc(Cl)cc3[N+](=O)[O-])C2)CC1 1805485448 XIIZDHLXTTYYDQ-JXMROGBWSA-N 488.028 5.158 5 20 JKBD CC(C)(C)CCCCCC(=O)NC[C@@H]1CCN(C(=O)/C=C/c2ccc([N+](=O)[O-])o2)[C@H]1c1cccnc1 1812804572 OXAXNDWNVPBPIL-PYEYBSRVSA-N 496.608 5.299 5 20 JKBD CC[C@H](C)[C@@H](C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2ccc([N+](=O)[O-])o2)CC1)c1ccccc1 1823611625 MORZDZIFYGBDBD-KIVTUJJHSA-N 481.593 5.251 5 20 JKBD CC[C@@H](C(=O)N1CCCC[C@H]1C1CCN(C(=O)Cc2ccc([N+](=O)[O-])cc2F)CC1)c1ccccc1 1826317285 SFRVZBUYLPTYSN-RSXGOPAZSA-N 495.595 5.090 5 20 JKBD Cc1ccc(NC(=O)[C@H](Sc2nnc(-c3ccccc3Cl)n2N)c2ccccc2)c([N+](=O)[O-])c1 8646603 KIZHMXNKLNTAQH-HXUWFJFHSA-N 494.964 5.001 5 20 JKBD O=C(Nc1ccc(N[C@@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2ccccc2)cc1)C1CC1 10768793 NUEKREPNHUJHAW-JOCHJYFZSA-N 464.909 5.389 5 20 JKBD CC(=O)N(c1ccc(C)c(C)c1)c1nc(COC(=O)c2ccc([N+](=O)[O-])cc2Cl)cs1 11028618 MFJAWXAHEHEHNQ-UHFFFAOYSA-N 459.911 5.363 5 20 JKBD Cc1nc(COc2ccc(Cl)cc2)sc1C(=O)OCC(=O)Nc1cc([N+](=O)[O-])ccc1Cl 17733246 MQOOQHZTZPXQDZ-UHFFFAOYSA-N 496.328 5.041 5 20 JKBD C[C@@H](NC(=O)COC(=O)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1)c1cccs1 24772222 SVRGEUIIBLAJQB-CYBMUJFWSA-N 460.895 5.136 5 20 JKBD Cc1nc(-c2ccc(N[C@H](C)C(=O)Nc3ccc([N+](=O)[O-])cc3C(F)(F)F)cc2)cs1 28912576 QZILOIUVSDGWNL-LLVKDONJSA-N 450.442 5.485 5 20 JKBD COc1ccccc1Oc1ccc(N[C@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2C(F)(F)F)cc1 28912882 KVZRMRODBKKZFR-CQSZACIVSA-N 475.423 5.854 5 20 JKBD COc1cc(C(=O)N(Cc2ccncc2)C2CC2)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 58504333 MKXJZQCQEPPTNH-UHFFFAOYSA-N 453.882 5.249 5 20 JKBD O=C(Cn1c2ccccc2c(=O)c2ccccc21)N[C@H](COc1ccccc1F)c1ccccc1 59020310 NXBKYDWEMYYAEI-XMMPIXPASA-N 466.512 5.230 5 20 JKBD C[C@H](Nc1ccc(NC(=O)CNC(=O)c2c(Cl)cccc2[N+](=O)[O-])cc1Cl)c1ccccc1 303409033 UGJYXSRVPLXVOW-AWEZNQCLSA-N 487.343 5.443 5 20 JKBD O=C(N[C@@H](c1ccccc1)c1ccncc1)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1 486853051 PPDXTCADOVTNJE-DEOSSOPVSA-N 459.889 5.955 5 20 JKBD CSc1ccc(C(=O)c2ccccc2C(=O)N2CCC(OC3CCCC3)CC2)cc1[N+](=O)[O-] 503359975 GBOXMDSYAZRLOB-UHFFFAOYSA-N 468.575 5.112 5 20 JKBD C[C@H](Nc1ccc(C(=O)N[C@@H]2CCSc3ccc(Cl)cc32)cc1[N+](=O)[O-])c1ccccn1 506069121 BBAGMVZIQBLQHV-IFXJQAMLSA-N 468.966 5.783 5 20 JKBD C[C@H](Nc1ccc(C(=O)Nc2ccccc2NC(=O)c2ccccc2)cc1[N+](=O)[O-])c1ccccn1 506246541 PXAIALZKXOTGMF-SFHVURJKSA-N 481.512 5.668 5 20 JKBD C[C@H](Nc1ccc(C(=O)N(C)c2ccc(Br)cc2F)cc1[N+](=O)[O-])c1ccccn1 509699811 RLYHNYRUUFPVQL-ZDUSSCGKSA-N 473.302 5.341 5 20 JKBD O=[N+]([O-])c1ccc(-c2ccc(CNCc3ccn(-c4ccccc4)n3)o2)c(Br)c1 517547605 FSWZDYNLZULKNQ-UHFFFAOYSA-N 453.296 5.093 5 20 JKBD COc1cc(C(=O)Nc2cccc(NC(=O)[C@@H](C)OC)c2)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 518887321 JYELSPNPJAWPQX-CQSZACIVSA-N 499.907 5.275 5 20 JKBD C[C@@H](c1ccncc1)N(C)C(=O)C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1 520103658 CHBSSTIQNUEMNM-AWZALFRUSA-N 458.543 5.750 5 20 JKBD COc1cc(CNCc2ccc(-c3ccc([N+](=O)[O-])cc3Br)o2)ccc1OC(F)F 520954687 CUSZRFDDHJQGFC-UHFFFAOYSA-N 483.265 5.517 5 20 JKBD O=C(C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)N1CCC(N2CCCCC2)CC1 521182627 RFBURNNVVVGILD-DYTRJAOYSA-N 490.629 5.612 5 20 JKBD C[C@H](Nc1ccc2c(c1)CCC(=O)N2Cc1ccc(Cl)cc1)C(=O)Nc1ccc([N+](=O)[O-])cc1 521642239 SAFQCCWVSWIZAW-INIZCTEOSA-N 478.936 5.167 5 20 JKBD O=C(Nc1ccc(C(F)(F)F)cc1)c1ccc(C(=O)Nc2ccc(C(F)(F)F)cc2)c([N+](=O)[O-])c1 524353453 BERZPOHDFTVBFU-UHFFFAOYSA-N 497.351 6.137 5 20 JKBD Cc1ccc(NC(=O)[C@H](Sc2nnc(-c3ccoc3C)o2)c2ccccc2)c([N+](=O)[O-])c1 592947610 REKMVYUMIXVJEY-LJQANCHMSA-N 450.476 5.327 5 20 JKBD O=[N+]([O-])c1ccc(N2CCC[C@@H]2c2ccc(F)c(C(F)(F)F)c2)c(F)c1N1CCOCC1 600853323 USFZQVCOAHBLPS-MRXNPFEDSA-N 457.399 5.070 5 20 JKBD O=C(CCCc1ccc(Br)s1)N(Cc1ccccc1[N+](=O)[O-])CC(F)(F)F 603742169 LZHDXHYQTWTKRE-UHFFFAOYSA-N 465.291 5.333 5 20 JKBD CCCN(C(=O)NCCc1cc(OC)c(OC)cc1[N+](=O)[O-])[C@H](C)c1ccccc1Br 603802081 NVPHECPFPFZEPM-OAHLLOKOSA-N 494.386 5.100 5 20 JKBD CO[C@@H](C)c1cccc(NC(=O)Cc2cn(-c3ccccc3)nc2-c2ccc([N+](=O)[O-])cc2)c1 608874940 HQUYFQLVPBBCOD-SFHVURJKSA-N 456.502 5.336 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Cl)[C@H](c1ccccc1)N1CCO[C@@H](c2ccccc2F)C1 608976084 KOEQJHYYMPAHSS-PKTZIBPZSA-N 469.900 5.141 5 20 JKBD COc1cc(CN[C@H](C)c2nc3ccccc3n2C(F)F)ccc1OCc1ccc([N+](=O)[O-])cc1 609006672 PTBSENCLSIJIGD-MRXNPFEDSA-N 482.487 5.778 5 20 JKBD C[C@H]1CSc2ccc(Br)cc2[C@@H]1NC(=O)C1CCN(c2ccccc2[N+](=O)[O-])CC1 609192178 AVWKHUQSLABMFN-LHSJRXKWSA-N 490.423 5.173 5 20 JKBD COc1ccc([N+](=O)[O-])cc1NC(=O)[C@H](C)N[C@@H](C)c1sc(-c2ccc(C)cc2)nc1C 609353449 QHKNRVYBDATQEM-HOCLYGCPSA-N 454.552 5.022 5 20 JKBD C[C@H](N[C@H](C)c1cc(F)c(Cl)cc1Cl)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 610246672 UMFRPCUKCYAMNU-BDAKNGLRSA-N 468.234 5.737 5 20 JKBD O=C(COC(=O)c1cc(F)c(F)cc1[N+](=O)[O-])Nc1c(Cl)c(Cl)cc(Cl)c1Cl 725937758 UAPYGHZZIIHMGE-UHFFFAOYSA-N 474.030 5.282 5 20 JKBD O=C(Nc1ccc(NCc2c(Br)cccc2[N+](=O)[O-])c(C(F)(F)F)c1)c1ccco1 863995619 YOCWRXQXIROANC-UHFFFAOYSA-N 484.228 5.834 5 20 JKBD CC(C)N(Cc1nnc(-c2cccc([N+](=O)[O-])c2)o1)C(=O)c1ccc(COc2ccccc2)cc1 864243035 XTOJBIUXVXYQPH-UHFFFAOYSA-N 472.501 5.275 5 20 JKBD O=C(Nc1ccccc1C(=O)NCc1ccccc1C(F)(F)F)c1ccc([N+](=O)[O-])cc1Cl 914473694 CLPZDGISNVZYPG-UHFFFAOYSA-N 477.826 5.449 5 20 JKBD O=C(CCCOc1cccc(F)c1)Oc1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2Cl)cc1 918484144 TZIMDFFGMQMDDQ-UHFFFAOYSA-N 472.856 5.404 5 20 JKBD CC1CCN(c2ccc([N+](=O)[O-])cc2C(=O)N2C[C@H](C(F)(F)F)C[C@@H](C(F)(F)F)C2)CC1 918673542 YUYQMHNFXPCOTG-ZIAGYGMSSA-N 467.410 5.034 5 20 JKBD C[C@@H](Nc1ccc(C(=O)OCc2nnc(-c3ccc(Cl)cc3)o2)cc1[N+](=O)[O-])c1ccccn1 920546578 KZDMEMHLZFHJEI-CQSZACIVSA-N 479.880 5.223 5 20 JKBD Cc1cc(Cl)ccc1NC(=O)[C@H](C)OC(=O)c1ccc(N[C@@H](C)c2ccccn2)c([N+](=O)[O-])c1 920548159 QEVMJDFUGPZTCU-HOTGVXAUSA-N 482.924 5.309 5 20 JKBD C[C@H](OC(=O)CCSc1ccc(Br)cc1)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl 920582518 YFPWYWAVPPLMEM-NSHDSACASA-N 487.759 5.063 5 20 JKBD CC(C)[C@H](OC(=O)[C@@H](C)Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)Nc1ccccc1C(F)(F)F 920778147 KDJNYPAESFLTBH-XIKOKIGWSA-N 488.846 5.241 5 20 JKBD Cc1c(C(=O)NC2(c3ccc(NC(=O)c4cccnc4S)cc3)CCC2)cc(Cl)cc1[N+](=O)[O-] 1785849016 ZWORPIGPSPLBMP-UHFFFAOYSA-N 496.976 5.302 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)c3ccc([N+](=O)[O-])o3)CCC2)cc1)c1ccc(-c2ccccc2)nc1 1789954539 KXKUBACPTGLYPG-UHFFFAOYSA-N 482.496 5.311 5 20 JKBD COc1ccc(C(=O)NC2(c3ccc(NC(=O)c4cc(O)cc([N+](=O)[O-])c4)cc3)CCC2)cc1Cl 1790757527 SYMYWGMZDQEBGI-UHFFFAOYSA-N 495.919 5.024 5 20 JKBD CN(C)c1ccc([N+](=O)[O-])cc1C(=O)Nc1ccc(C2(NC(=O)[C@@]3(F)CCCC=C3F)CCC2)cc1 1790795270 PETXQCKNILHIQM-AREMUKBSSA-N 498.530 5.154 5 20 JKBD Cc1cccc(Cl)c1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc2cc([N+](=O)[O-])ccc2s1 1801206838 KUBRNSQGRLQWLI-BJWYYQGGSA-N 483.977 5.337 5 20 JKBD CC1(C(=O)NC[C@H]2CCN(C(=O)c3cc4cc([N+](=O)[O-])ccc4s3)[C@@H]2c2cccnc2)CCCC1 1802625752 TXRWEYGHOFCBPH-WZONZLPQSA-N 492.601 5.104 5 20 JKBD O=C(CCc1cccc([N+](=O)[O-])c1)N1CCCC2(CCN(C(=O)[C@@H]3CCC[C@H]4CCCC[C@H]43)CC2)C1 1806490071 GPTXRSQFEWTCEK-LGPLSSKUSA-N 495.664 5.365 5 20 JKBD CCCCC[C@H](C)C(=O)NC[C@H]1CCN(C(=O)CSc2ccccc2[N+](=O)[O-])[C@@H]1c1cccnc1 1812699623 BDOOEWRZVCNIMC-PIBDYAPNSA-N 498.649 5.004 5 20 JKBD Cc1c(C(=O)Nc2cc([C@H]3CCCCN3C(=O)c3ccc(F)cc3)[nH]n2)cc(Cl)cc1[N+](=O)[O-] 1821293977 MPVAXBJMHVIUHW-LJQANCHMSA-N 485.903 5.039 5 20 JKBD O=C(/C=C/c1ccccc1[N+](=O)[O-])Nc1cc([C@H]2CCCCN2C(=O)c2ccc3occc3c2)[nH]n1 1823505234 YGAQZGQVCKWBEL-XBFAEUMISA-N 485.500 5.083 5 20 JKBD Cc1c(Cl)cccc1C(=O)N1CCCC[C@H]1C1CCN(C(=O)Cc2cccc([N+](=O)[O-])c2)CC1 1823914240 KRELZYLAEWJSDR-DEOSSOPVSA-N 483.996 5.033 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)N1CCC([C@H]2CCCCN2C(=O)C2CCC(F)(F)CC2)CC1 1824328259 UWWAJNAYJSNXMK-OAQYLSRUSA-N 495.542 5.101 5 20 JKBD Cc1ccc(SCC(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3ccc([N+](=O)[O-])cc3F)CC2)cc1 1828344147 JSQAJIZLKIVYFX-XMMPIXPASA-N 499.608 5.068 5 20 JKBD CC1(C)CCC(CC(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3cc(O)cc([N+](=O)[O-])c3)CC2)CC1 1830423204 ILKFCUHASKAMSY-XMMPIXPASA-N 485.625 5.140 5 20 JKBD O=C(COC(=O)[C@@H](Sc1ccccc1)c1ccccc1)Nc1cc([N+](=O)[O-])ccc1Cl 10589865 HEFOWNJQNLDUNJ-NRFANRHFSA-N 456.907 5.264 5 20 JKBD CCc1ccccc1NC(=O)CN(C)C(=O)c1ccc(Sc2ccc(C)cc2)c([N+](=O)[O-])c1 15558452 LOGWIZSYVSAHHE-UHFFFAOYSA-N 463.559 5.328 5 20 JKBD Cc1sc2nc(S[C@H](C)c3nnc(-c4ccc([N+](=O)[O-])cc4)o3)n(C3CCCC3)c(=O)c2c1C 17721109 SULVZDPBPYYQJM-CQSZACIVSA-N 497.602 6.001 5 20 JKBD C[C@H](OC(=O)/C=C/c1cc(C(F)(F)F)ccc1Cl)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 17726574 IRPUSJBJVAWFID-VKJYCEFSSA-N 467.787 5.635 5 20 JKBD Cc1ccccc1-n1c(S[C@@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)nnc1-c1cccnc1 20753562 DNZWXMNBYXPXMH-HNNXBMFYSA-N 494.964 5.319 5 20 JKBD C[C@H](Sc1nnc(Nc2ccccc2)s1)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 21452212 HQXCWPFLNBEIGQ-JTQLQIEISA-N 469.470 5.328 5 20 JKBD COc1cc([N+](=O)[O-])ccc1NC(=O)CCSc1nnc(-c2ccccc2)n1-c1ccc(F)cc1 26361572 WEMGPALANJYOJY-UHFFFAOYSA-N 493.520 5.111 5 20 JKBD COc1ccccc1NS(=O)(=O)c1cc([N+](=O)[O-])ccc1N[C@H](C)c1ccccc1OC(F)F 26718508 BRBFMUXPYUDIMZ-CQSZACIVSA-N 493.488 5.179 5 20 JKBD O=C(CCCn1c(=O)oc2cc([N+](=O)[O-])ccc21)Nc1nc(-c2ccc(Cl)cc2Cl)cs1 26768087 NTGOZQQOJBKJLK-UHFFFAOYSA-N 493.328 5.352 5 20 JKBD Cc1ccc(-c2cc(C(=O)OCc3nnc(-c4ccc([N+](=O)[O-])cc4)o3)c3ccccc3n2)cc1 28614495 FFRMLEMKGVPEMF-UHFFFAOYSA-N 466.453 5.525 5 20 JKBD C[C@@H](Sc1nnc(-c2cccs2)n1Cc1ccccc1)C(=O)Nc1ccc([N+](=O)[O-])cc1 36802158 NAHDCBSUNFFBKK-OAHLLOKOSA-N 465.560 5.082 5 20 JKBD CCN1C/C(=C\c2ccc(-c3ccc([N+](=O)[O-])cc3)o2)c2nc3ccccc3c(C(=O)O)c2C1 208044780 ZNVAYROBBYAGLR-GHRIWEEISA-N 455.470 5.477 5 20 JKBD CN1C/C(=C\c2ccc(-c3cccc([N+](=O)[O-])c3)s2)c2nc3ccccc3c(C(=O)O)c2C1 489656098 UMHYBZAKBJXMGN-FOWTUZBSSA-N 457.511 5.556 5 20 JKBD C[C@H](Nc1ccc(C(=O)NCc2ccc(-n3cnc4ccccc43)cc2)cc1[N+](=O)[O-])c1ccccn1 490130694 NJMDOKFSTWGKAA-IBGZPJMESA-N 492.539 5.432 5 20 JKBD COc1cccc(NCc2nnc(SCC(=O)c3ccc([N+](=O)[O-])cc3)n2C2CCCCC2)c1 497429696 CZVAMHQRXYSDJJ-UHFFFAOYSA-N 481.578 5.287 5 20 JKBD O=C(C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)Nc1ccn(Cc2ccncc2)n1 499513469 VYSCOVYDGZZORI-HKWRFOASSA-N 496.552 5.414 5 20 JKBD O=C(Cc1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1)N(Cc1ccco1)C1CCCC1 499596801 KXVJHCAQIZTLDN-UHFFFAOYSA-N 470.529 5.554 5 20 JKBD Cn1cnnc1Sc1ccc(C(=O)N[C@H](c2ccc(F)cc2)c2ccccc2Cl)cc1[N+](=O)[O-] 502343445 FCGJAOSWWXFZRC-OAQYLSRUSA-N 497.939 5.186 5 20 JKBD COc1ccccc1C1(CN[C@@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2ccccc2)CC1 504434540 NPTPQYRBXZLTNV-HSZRJFAPSA-N 465.937 5.258 5 20 JKBD C[C@H](Nc1ccc(C(=O)N2CCC[C@H]2c2cccc(Cl)c2)cc1[N+](=O)[O-])c1ccccn1 507407286 VAVWFSUTBLSGSQ-AOMKIAJQSA-N 450.926 5.794 5 20 JKBD COc1ccc(Oc2ccc([N+](=O)[O-])cc2C(=O)N2CCC(OC3CCC(C)CC3)CC2)cc1 517438025 RPYPYHFJFAEHOV-UHFFFAOYSA-N 468.550 5.596 5 20 JKBD CCOc1ccc(NC(=O)c2ccc(N[C@H](C)c3ccccn3)c([N+](=O)[O-])c2)c(C(F)(F)F)c1 520401003 DIKWRDSLCPZSFX-CQSZACIVSA-N 474.439 5.833 5 20 JKBD CCOc1cc(C(=O)Nc2ccc(Sc3ccc(OC)cc3)cc2)c([N+](=O)[O-])cc1OC 524461042 GGLKGTIMXUOMQH-UHFFFAOYSA-N 454.504 5.414 5 20 JKBD CN(Cc1ccccc1[N+](=O)[O-])C(=O)c1cnn(-c2cccc(C(F)(F)F)c2)c1C(F)(F)F 603569063 RWYSREQBKAALNS-UHFFFAOYSA-N 472.345 5.090 5 20 JKBD COc1ccc(CSc2nnc(-c3ccncc3)n2-c2ccc(Cl)cc2)cc1[N+](=O)[O-] 603722644 NGZZCZXGHWZXTR-UHFFFAOYSA-N 453.911 5.192 5 20 JKBD C[C@@H](Nc1ccc(C(=O)N(C)Cc2ccc(C(F)(F)F)cc2)cc1[N+](=O)[O-])c1ccccn1 604295505 JWRFPIGXQNVYFN-OAHLLOKOSA-N 458.440 5.454 5 20 JKBD COc1cc(C(=O)Nc2ccc(Cl)c3ncccc23)c([N+](=O)[O-])cc1OCc1cscn1 604385582 IAZJJQPJPMXYOY-UHFFFAOYSA-N 470.894 5.093 5 20 JKBD COc1cc([C@@H](C)NC(=O)[C@@H](C)Oc2ccc(Cl)cc2[N+](=O)[O-])ccc1OC1CCCC1 604442623 MFSGLJKFRXGWCE-HUUCEWRRSA-N 462.930 5.223 5 20 JKBD C[C@@H](Nc1ccc(C(=O)Nc2cc(-c3cccc(Cl)c3)[nH]n2)cc1[N+](=O)[O-])c1ccccn1 604521996 BWIGUHMQPANSIT-CQSZACIVSA-N 462.897 5.459 5 20 JKBD C[C@@H](NCc1ccc(-c2ccccc2[N+](=O)[O-])o1)c1cc2c(cc1Br)OCCO2 608836398 CEGMBUZFGLIVLJ-CYBMUJFWSA-N 459.296 5.239 5 20 JKBD COc1cc(C(=O)NCC2(c3ccccc3)CCCCCC2)c([N+](=O)[O-])cc1OCc1cscn1 608963587 UIWQHLHWBPLVIP-UHFFFAOYSA-N 495.601 5.661 5 20 JKBD O=C(c1ccc(C(=O)N2CCC[C@@H]2C2CCCC2)c([N+](=O)[O-])c1)N1CCC[C@@H]1C1CCCC1 609044625 NQKUNXYECOBPEL-DHIUTWEWSA-N 453.583 5.184 5 20 JKBD Cc1cc(OCc2cccc(Cl)c2)ccc1NC(=O)c1cc2c(cc1[N+](=O)[O-])OCCO2 609062768 YXOOJDNXOVDUGH-UHFFFAOYSA-N 454.866 5.159 5 20 JKBD CCOc1cc(NC(=O)c2cnn(-c3cccc(C)c3)c2C(F)(F)F)c([N+](=O)[O-])cc1OCC 619728981 LLXKHNXKMHFDCS-UHFFFAOYSA-N 478.427 5.157 5 20 JKBD O=C(O[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Br)c1ccccc1)c1ccc2ncoc2c1 727194942 WANTVRIDXRWJCJ-HXUWFJFHSA-N 496.273 5.035 5 20 JKBD Cn1c(-c2ccc(NC(=O)c3cc([N+](=O)[O-])ccc3Br)cc2)nc2ccccc21 727352351 ZLGNRUUIZPMRAT-UHFFFAOYSA-N 451.280 5.163 5 20 JKBD COc1cc(C(=O)N[C@@H](Cn2ccnc2)C(C)(C)C)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 729343740 ZINDQOXZUFNNKT-NRFANRHFSA-N 472.929 5.090 5 20 JKBD CC(C)(C)OC(=O)Nc1ccc(NC(=O)c2cc(Cl)ccc2[N+](=O)[O-])c(C(F)(F)F)c1 729656440 BUZAEGATIRDNFN-UHFFFAOYSA-N 459.808 5.866 5 20 JKBD O=C(OCc1ccc([N+](=O)[O-])cc1)c1cnn(-c2ncc(C(F)(F)F)cc2Cl)c1C(F)F 730960805 WWLGLRNIQLKBCS-UHFFFAOYSA-N 476.745 5.142 5 20 JKBD CCc1ccccc1N(C(C)=O)c1nc(COC(=O)/C=C\c2ccc([N+](=O)[O-])cc2)cs1 798128232 SLJIVTYMLCKHQL-RAXLEYEMSA-N 451.504 5.055 5 20 JKBD C[C@@H](OC(=O)/C=C\c1ccc2ccc(Cl)cc2n1)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl 912870386 UUFDEMWFQZBDFJ-OJIASSBASA-N 460.273 5.033 5 20 JKBD O=C(Nc1cc([N+](=O)[O-])c(F)cc1F)c1cccnc1SCc1cccc(Br)c1 915284413 WSNVSYCVGBXUOO-UHFFFAOYSA-N 480.290 5.575 5 20 JKBD O=[N+]([O-])c1ccc(NC(=S)Nc2ccc(Cl)c(S(=O)(=O)Nc3ccccc3Cl)c2)cc1 916115776 XKHCVJGJXGROFV-UHFFFAOYSA-N 497.385 5.511 5 20 JKBD CCN(Cc1ccccc1NC(=O)c1ccc(N2CCCC2)c([N+](=O)[O-])c1)C(=O)OC(C)(C)C 918603056 IESLOFPWHANHRV-UHFFFAOYSA-N 468.554 5.204 5 20 JKBD O=C(Cc1cccc([N+](=O)[O-])c1)Nc1ccc(C2(NC(=O)[C@H]3CCCCC3(F)F)CCC2)cc1 1785791716 IMNLYWVGNLBWDE-OAQYLSRUSA-N 471.504 5.097 5 20 JKBD Cc1cc(O)c([N+](=O)[O-])cc1C(=O)NC1(c2ccc(NC(=O)CCCC(F)(F)F)cc2)CCC1 1786621340 HCGBLROADSAJFA-UHFFFAOYSA-N 479.455 5.089 5 20 JKBD Cc1ccc(-c2cc(C(=O)Nc3ccc(C4(NC(=O)c5ccc([N+](=O)[O-])o5)CCC4)cc3)c[nH]2)cc1 1787032504 RWHHKOJNPPNMMS-UHFFFAOYSA-N 484.512 5.553 5 20 JKBD COc1ccc(CC(=O)Nc2ccc(C3(NC(=O)c4cccc5cc[nH]c45)CCC3)cc2)c([N+](=O)[O-])c1 1790571222 IODITTWSZOGQOI-UHFFFAOYSA-N 498.539 5.075 5 20 JKBD O=C(NC1(c2ccc(NC(=O)c3ccc([N+](=O)[O-])cc3F)cc2)CCC1)c1cc2[nH]ccc2s1 1790622331 WSTXMIAOYOIZPQ-UHFFFAOYSA-N 478.505 5.338 5 20 JKBD O=C(Cc1ccc([N+](=O)[O-])cc1F)Nc1ccc(C2(NC(=O)C[C@@H]3C[C@@H]4CC[C@H]3C4)CCC2)cc1 1791183930 QVKKJLQZSCRGCD-HBFSDRIKSA-N 479.552 5.237 5 20 JKBD O=C(CSc1ccccc1[N+](=O)[O-])Nc1ccc(C2(NC(=O)c3ccsc3)CCC2)cc1 1791521462 KVLOCZFQGZCDDM-UHFFFAOYSA-N 467.572 5.196 5 20 JKBD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)/C=C/c1ccccc1[N+](=O)[O-])c1cc(Cl)c(Cl)cc1F 1804345781 JFYABOHMWGNJFO-PYNLGSQFSA-N 492.334 5.006 5 20 JKBD Cc1cc(C)cc(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)CSc3ccccc3[N+](=O)[O-])CC2)c1 1830012139 JQTCAHZQOVMKNM-HSZRJFAPSA-N 495.645 5.237 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)N1CCC([C@@H]2CCCCN2C(=O)[C@H]2C[C@H]2c2ccccc2)CC1 1831785617 BPLXPNMNSIMOTM-HWBMXIPRSA-N 493.579 5.079 5 20 JKBD Cc1ccc(-c2noc(COC(=O)c3ccccc3C(=O)c3ccc(Cl)c([N+](=O)[O-])c3)n2)cc1 11029133 FCCDVWXTYLQXMP-UHFFFAOYSA-N 477.860 5.195 5 20 JKBD Cc1cccc([N+](=O)[O-])c1NC(=O)CSc1nc2sc3c(c2c(=O)n1C1CCCC1)CCCC3 20888695 XREFNMOVPXWKHR-UHFFFAOYSA-N 498.630 5.399 5 20 JKBD CC(C)(C)c1ccccc1NC(=O)COC(=O)c1ccccc1C(=O)c1ccc(Cl)c([N+](=O)[O-])c1 23513458 BCICFQCCJKWXHD-UHFFFAOYSA-N 494.931 5.572 5 20 JKBD CCOc1cc(C(=O)NC[C@@H](c2ccc(OC)cc2)c2c[nH]c3ccccc23)c([N+](=O)[O-])cc1OC 36772496 WYJSURZLISSUFT-NRFANRHFSA-N 489.528 5.054 5 20 JKBD O=C(Nc1ccc(NCc2nc(-c3cccc([N+](=O)[O-])c3)no2)c(C(F)(F)F)c1)c1ccco1 109097580 NIABGJIXJRFMDJ-UHFFFAOYSA-N 473.367 5.121 5 20 JKBD O=c1c2ccccc2nc(SCc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)n1-c1cccc(Cl)c1 409819261 LBADLGIYDVAZGI-UHFFFAOYSA-N 491.916 5.290 5 20 JKBD CCN(Cc1ccc(C(=O)N(C)C)cc1)C(=O)c1cc([N+](=O)[O-])ccc1Sc1ccccc1 476419994 SRVJFUKLDHOSIV-UHFFFAOYSA-N 463.559 5.110 5 20 JKBD C[C@H](Nc1ccc(C(=O)Nc2ccnn2-c2cccc(Cl)c2)cc1[N+](=O)[O-])c1ccccn1 485946257 UEUSMPMSPOCSIT-HNNXBMFYSA-N 462.897 5.254 5 20 JKBD CN(Cc1ccc(F)c(F)c1)C(=O)C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1 489208733 WDGATUCSWJQEHU-PDGQHHTCSA-N 479.508 6.072 5 20 JKBD C[C@H]1CCCN(c2ccc(C(=O)N[C@H](C)c3nc4ccccc4n3C(F)F)cc2[N+](=O)[O-])C1 491396875 QMTDDJVOOBHUFC-LSDHHAIUSA-N 457.481 5.067 5 20 JKBD COc1ccc(NC(=O)c2ccc(N[C@@H](C)c3ccccn3)c([N+](=O)[O-])c2)cc1OCc1cccnc1 506235597 WOLXHNRMNCKEDV-SFHVURJKSA-N 499.527 5.398 5 20 JKBD CCOc1cc(C(=O)Nc2ccc(NC(=O)c3ccc(Cl)cc3)cc2)c([N+](=O)[O-])cc1OC 507651067 RIUJPRFSMFPDIB-UHFFFAOYSA-N 469.881 5.160 5 20 JKBD O=C(c1ccc([N+](=O)[O-])cc1I)N1CCc2sccc2[C@H]1c1cccs1 508795471 MHZLZLHJCUCPMI-KRWDZBQOSA-N 496.351 5.110 5 20 JKBD C[C@H](c1ccc2ccccc2c1)N(C(=O)c1ccc(Sc2nncn2C)c([N+](=O)[O-])c1)C1CC1 509866083 QFKKEJVEIWGBJL-MRXNPFEDSA-N 473.558 5.394 5 20 JKBD CC(C)N(Cc1ccc(Br)cc1)C(=O)C1CCN(c2ccccc2[N+](=O)[O-])CC1 510126266 ATARQVYDVIIXCX-UHFFFAOYSA-N 460.372 5.011 5 20 JKBD COc1ccc(CNC(=O)Nc2nc(-c3cccc(C(F)(F)F)c3)cs2)cc1[N+](=O)[O-] 515767514 LSOQJKYFCYWZMO-UHFFFAOYSA-N 452.414 5.067 5 20 JKBD COc1ccc([N+](=O)[O-])cc1NC(=O)N(C)CCCCCc1cc(-c2cccc(F)c2)n[nH]1 516076006 DONLJIMWTDZCST-UHFFFAOYSA-N 455.490 5.009 5 20 JKBD CCOc1ccc(N(C(=O)COc2ccc([N+](=O)[O-])c(OC)c2)c2nc3ccccc3s2)cc1 520562865 RRRPETRHMJYXBV-UHFFFAOYSA-N 479.514 5.356 5 20 JKBD CCOc1cc([N+](=O)[O-])c(C(=O)Nc2ccc(Oc3ccccc3)cc2C(F)(F)F)cc1OC 521378906 HVWNQGSMLVFWEP-UHFFFAOYSA-N 476.407 6.066 5 20 JKBD CC[C@H](NC(=O)c1ccccc1Sc1ccc(C(F)(F)F)cc1[N+](=O)[O-])c1nc(C)cs1 521490535 UGPKNIBSMYZQBY-HNNXBMFYSA-N 481.521 6.411 5 20 JKBD Cc1ccc(-c2csc(NC(=O)c3cc(Cl)ccc3I)n2)cc1[N+](=O)[O-] 603636664 MWZWEPYDJUZGCS-UHFFFAOYSA-N 499.717 5.537 5 20 JKBD COc1ccc(-c2nnc(SCc3csc([N+](=O)[O-])c3)n2C2CCCCC2)cc1OC 603938572 YZDLRPUWOBYWAM-UHFFFAOYSA-N 460.581 5.730 5 20 JKBD Cc1csc(Sc2ccc(C(=O)N3C[C@@H](C(F)(F)F)C[C@H](C(F)(F)F)C3)cc2[N+](=O)[O-])n1 604257540 GWRYKJJFZKKSEG-RYUDHWBXSA-N 499.458 5.714 5 20 JKBD Cc1cc(C(=O)N2CCCC[C@@H]2C)ccc1NC(=O)c1ccc(Cn2nc(C)c([N+](=O)[O-])c2C)cc1 604465726 FDVZAKQEUUFUPQ-SFHVURJKSA-N 489.576 5.032 5 20 JKBD Cn1cnnc1Sc1ccc(C(=O)N[C@@H](c2cccc(C(F)(F)F)c2)C(C)(C)C)cc1[N+](=O)[O-] 608898878 IXUSALXWMQODHJ-SFHVURJKSA-N 493.511 5.411 5 20 JKBD CCC[C@@H](NC(=O)C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)c1ccccn1 609179960 XSJRPWREQGKWKO-XGHSKXIFSA-N 472.570 6.188 5 20 JKBD CC(C)N(Cc1nnc(-c2cccc([N+](=O)[O-])c2)o1)C(=S)N[C@@H](C)c1ccc(Cl)cc1Cl 726449688 QWVXWOJTBRIJFM-ZDUSSCGKSA-N 494.404 5.798 5 20 JKBD C[C@@H](OC(=O)CCc1cccc(OC2CCCC2)c1)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 727891392 UWTZIMKDPPFJIF-MRXNPFEDSA-N 451.479 5.203 5 20 JKBD O=C(Nc1cc([N+](=O)[O-])c(F)cc1F)[C@H](Oc1ccc(F)cc1Br)c1ccccc1 730470201 BKMGANGEISLGFG-LJQANCHMSA-N 481.224 5.533 5 20 JKBD COc1cc(/C=C(/Cl)c2nc(=O)c3cc(Cl)ccc3[nH]2)ccc1OCc1ccc([N+](=O)[O-])cc1 730582721 FSQGHMNBBOAAJD-VXLYETTFSA-N 498.322 5.809 5 20 JKBD COc1cc(COC(=O)c2csc(-c3ccc([N+](=O)[O-])cc3)n2)cc(Cl)c1OC(F)F 747634959 QMTKTCASVSBCBW-UHFFFAOYSA-N 470.837 5.339 5 20 JKBD O=C(Nc1ccc(Cl)cc1Cl)[C@H]1CCCCN1C(=O)c1cc([N+](=O)[O-])ccc1Cl 915159701 UJKXBBLZVGICJY-QGZVFWFLSA-N 456.713 5.188 5 20 JKBD CCn1c(-c2ccccc2)nn(CN(Cc2ccccc2[N+](=O)[O-])CC(F)(F)F)c1=S 917451729 ZTFVORKCNVVWIH-UHFFFAOYSA-N 451.474 5.031 5 20 JKBD C[C@@H](OC(=O)c1cc2ccc(OCc3ccccc3)cc2[nH]1)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 920656903 CRQJHSWHYKRWGN-MRXNPFEDSA-N 484.468 5.623 5 20 JKBD C[C@@H](OC(=O)C1=NN(c2ccccc2)[C@@H](c2ccccc2)C1)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl 934167060 IYUBYJTXMNEOQD-WAIKUNEKSA-N 492.919 5.126 5 20 JKBD CC(C)O[C@@H](C)C(=O)Nc1ccc(C2(NC(=O)c3cc4cc([N+](=O)[O-])ccc4s3)CCC2)cc1 1789596952 KACQZRIYFMVLSB-INIZCTEOSA-N 481.574 5.371 5 20 JKBD CCC[C@H]1CC[C@H](C(=O)NC[C@@H]2CCN(C(=O)c3cc(F)cc([N+](=O)[O-])c3)[C@H]2c2cccnc2)CC1 1812790062 OTDUGAHCZQYRMX-DDLLOKISSA-N 496.583 5.055 5 20 JKBD O=C([C@@H]1CCC[C@@H]2CCCC[C@@H]21)N1CCC([C@@H]2CCCCN2C(=O)/C=C/c2ccc([N+](=O)[O-])o2)CC1 1824277104 PWOVFIIZVSYCNB-YWHRGTSXSA-N 497.636 5.427 5 20 JKBD Cc1oc(C(C)(C)C)cc1C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cccc(F)c2[N+](=O)[O-])CC1 1830615858 HHEIYVXLAWOYEW-QFIPXVFZSA-N 499.583 5.480 5 20 JKBD CC1CCN(c2ccc([N+](=O)[O-])cc2C(=O)O[C@H](C)C(=O)Nc2ccccc2C(F)(F)F)CC1 16925226 JVBMSSXQKICEAY-OAHLLOKOSA-N 479.455 5.034 5 20 JKBD COc1c([N+](=O)[O-])cc(NCc2ccc(-c3csc(C)n3)s2)c([N+](=O)[O-])c1Br 22019797 GUBAXIIUOWWVBJ-UHFFFAOYSA-N 485.341 5.380 5 20 JKBD Cc1cc(Oc2ncccn2)ccc1NC(=O)c1ccc(SCCC(C)C)c([N+](=O)[O-])c1 60106351 IDIGSFZBJRXOPM-UHFFFAOYSA-N 452.536 5.876 5 20 JKBD Cc1nn(Cc2ccc(C(=O)NCc3ccc(COCc4ccccc4)cc3)cc2)c(C)c1[N+](=O)[O-] 480375061 IBYQBCLUZHSRCC-UHFFFAOYSA-N 484.556 5.103 5 20 JKBD Cc1ccc(-c2nnc3n2CCCCC3)cc1NC(=O)c1csc(-c2cccc([N+](=O)[O-])c2)n1 496313562 PETLCDMVLOZNAW-UHFFFAOYSA-N 474.546 5.264 5 20 JKBD COc1ccc(I)c(NC(=O)c2cc([N+](=O)[O-])ccc2Oc2ccccc2)c1 497345385 XYKAIVLIJSGCHA-UHFFFAOYSA-N 490.253 5.253 5 20 JKBD CC[C@@H](C)n1c(SCC(=O)Nc2ccc([N+](=O)[O-])cc2Br)nnc1-c1ccccc1 504291077 RUVFEEHRVOHWSF-CYBMUJFWSA-N 490.383 5.318 5 20 JKBD COc1cc(C(=O)N(CCc2ccccc2F)C2CCCC2)c([N+](=O)[O-])cc1OCc1cscn1 512231085 WJRUEKNASWOBCU-UHFFFAOYSA-N 499.564 5.406 5 20 JKBD COCCOc1cc(C)ccc1NC(=O)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])c(OC)c1 515687209 JUPCIUCNJXVCEO-UHFFFAOYSA-N 486.908 5.635 5 20 JKBD Cc1cnc(-c2cccc(NC(=O)C3CCN(c4ccc(C(F)(F)F)cc4[N+](=O)[O-])CC3)c2)o1 517508720 UPQXMIBEQYYOJD-UHFFFAOYSA-N 474.439 5.432 5 20 JKBD CCOc1ccc(CNCc2ccc(-c3ccc([N+](=O)[O-])cc3Br)o2)cc1OC 521818556 YGVBASAIZIHMLQ-UHFFFAOYSA-N 461.312 5.314 5 20 JKBD Cc1cnn([C@H]2CCCc3ccccc32)c1NC(=O)[C@H](C)Oc1ccc(Cl)cc1[N+](=O)[O-] 524377919 XUJLPVRSOQAFNO-KXBFYZLASA-N 454.914 5.085 5 20 JKBD C[C@H](NCc1ccccc1CN1CCC(O)CC1)c1ccc(-c2ccccc2[N+](=O)[O-])s1 537401207 VKZVLRVNNSUIEZ-SFHVURJKSA-N 451.592 5.131 5 20 JKBD Cc1sc(NC(=O)CCCn2c(=O)oc3cc([N+](=O)[O-])ccc32)nc1-c1cccc(Cl)c1 582232523 WFOGSRPNSURDID-UHFFFAOYSA-N 472.910 5.007 5 20 JKBD O=C(Cc1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1)N[C@@H](c1cccs1)C1CC1 589328683 ISGDJPGMSJLHMQ-RUZDIDTESA-N 458.543 5.319 5 20 JKBD O=C(c1ccc(-c2cc(Cl)cc(Cl)c2)s1)N1CCN(C(=O)c2ccc([N+](=O)[O-])s2)CC1 603890684 ZENRXNLHUDHFHA-UHFFFAOYSA-N 496.397 5.290 5 20 JKBD Cc1cc(NC(=O)c2ccc(F)cc2Cl)sc1C(=O)N[C@H](C)c1cccc([N+](=O)[O-])c1 603966605 AZOVEHBGPNCHGU-GFCCVEGCSA-N 461.902 5.501 5 20 JKBD CN(C[C@H]1CCCO[C@H]1c1ccccc1)C(=O)c1ccc(NCc2ccccc2)c([N+](=O)[O-])c1 604519000 DHEHJGYLGPBEAY-BVAGGSTKSA-N 459.546 5.447 5 20 JKBD O=C(Nc1ccc(C(=O)Nc2cccnc2)c(Cl)c1)c1cc2cc([N+](=O)[O-])ccc2s1 608874322 CDWBCICEOBXEBE-UHFFFAOYSA-N 452.879 5.363 5 20 JKBD COc1ccc([N+](=O)[O-])cc1NC(=O)[C@H](C)N[C@H](C)c1sc(-c2ccc(C)cc2)nc1C 609353450 QHKNRVYBDATQEM-ZBFHGGJFSA-N 454.552 5.022 5 20 JKBD CC(C)(C)OC(=O)N1CCc2cc(NC(=O)c3csc(-c4cccc([N+](=O)[O-])c4)n3)ccc21 726508556 IVSWHOGTUJUMFO-UHFFFAOYSA-N 466.519 5.268 5 20 JKBD CC(C)N(Cc1nnc(-c2cccc([N+](=O)[O-])c2)o1)C(=O)c1cc(F)c(Cl)cc1Cl 744001429 JDCROGIBXRHCOS-UHFFFAOYSA-N 453.257 5.142 5 20 JKBD Cc1ccc(-c2nc(C(=O)N(Cc3nnc(-c4cccc([N+](=O)[O-])c4)o3)C(C)C)cs2)cc1 744001513 RKSCXUFGTSLFBP-UHFFFAOYSA-N 463.519 5.128 5 20 JKBD COc1cc2c(cc1OC)[C@H](c1cccs1)N(C(=O)c1cc(Cl)ccc1[N+](=O)[O-])CC2 863935603 QZNULHKGAICAFW-OAQYLSRUSA-N 458.923 5.115 5 20 JKBD Cc1ccc([N+](=O)[O-])c(OCCC(=O)OCC(=O)N2c3ccccc3Sc3ccccc32)c1 915440323 ZEYFMXKEYFPVED-UHFFFAOYSA-N 464.499 5.045 5 20 JKBD O=C(Nc1cccc(C(=O)Nc2ccc(F)c([N+](=O)[O-])c2)c1)c1ccc(Br)cc1 916105720 VQUPIFNTHSPLGG-UHFFFAOYSA-N 458.243 5.001 5 20 JKBD O=[N+]([O-])c1cccc(/C=C(/Cl)c2nc(O)c3cc(Br)cc(Br)c3n2)c1 916127341 OHXMOXXTYLVPMX-WLRTZDKTSA-N 485.519 5.506 5 20 JKBD C[C@@H](c1ccccc1)n1c(S[C@H](C)C(=O)Nc2ccc(F)c([N+](=O)[O-])c2)nnc1-c1ccccc1 917254087 GTSHPHXIXHVAON-DLBZAZTESA-N 491.548 5.721 5 20 JKBD O=C(Nc1cccc(OCc2cccc(F)c2)c1)c1cc([N+](=O)[O-])ccc1I 917792132 NIZVXYIVWLYJFF-UHFFFAOYSA-N 492.244 5.170 5 20 JKBD Cc1nc(-c2ccc(Cl)cc2)sc1C(=O)OCc1nc(-c2ccc([N+](=O)[O-])cc2)no1 918916959 WAWITMQADXGUBL-UHFFFAOYSA-N 456.867 5.087 5 20 JKBD CC(=O)N(c1ccc(F)cc1)c1nc(COC(=O)c2cc3cc([N+](=O)[O-])ccc3s2)cs1 918990447 JFQONMKRXAOGBT-UHFFFAOYSA-N 471.491 5.447 5 20 JKBD Cc1cccc(-c2nnc(-c3ccc(C(=O)OCc4nc(-c5ccc([N+](=O)[O-])cc5)no4)cc3)o2)c1 919056878 QWLMVAMYGDPXDS-UHFFFAOYSA-N 483.440 5.027 5 20 JKBD O=C(c1cc2cc([N+](=O)[O-])ccc2s1)N1CCC([C@@H]2CCCCN2C(=O)C2CC(F)(F)C2)CC1 1823855747 REGJXQQKTSKCGK-IBGZPJMESA-N 491.560 5.088 5 20 JKBD Cc1ccc(C(=O)N2CCC([C@@H]3CCCCN3C(=O)CCCc3cc(C)c(F)cc3[N+](=O)[O-])CC2)o1 1824369867 AOYOXAULQGCWTE-QHCPKHFHSA-N 499.583 5.200 5 20 JKBD O=C(Cc1ccc(Cl)cc1)N1CCC([C@@H]2CCCCN2C(=O)CCc2cccc([N+](=O)[O-])c2)CC1 1824839134 XZONSBJYZZURIE-VWLOTQADSA-N 498.023 5.043 5 20 JKBD O=C(c1ccc([N+](=O)[O-])cc1F)N1CCC([C@@H]2CCCCN2C(=O)c2cc3ccoc3s2)CC1 1827412930 AKLVEOUYTKRHAA-FQEVSTJZSA-N 485.537 5.089 5 20 JKBD CC1=C(C(=O)Nc2cc(C)on2)[C@H](c2ccc(Cl)c([N+](=O)[O-])c2)NC(=S)N1c1cccc(C)c1 10355403 GLIOWGWGZVDKGE-NRFANRHFSA-N 497.964 5.202 5 20 JKBD C[C@@H](OC(=O)c1ccccc1-c1ncc(-c2ccccc2)o1)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 19165248 SFRJUKBPIPRRST-MRXNPFEDSA-N 482.452 5.885 5 20 JKBD O=C(NCc1ccc(C(=O)N2CCCC2)cc1)c1cc([N+](=O)[O-])ccc1Sc1ccc(Cl)cc1 25326698 RQLUPSCBIGOSOR-UHFFFAOYSA-N 495.988 5.565 5 20 JKBD O=C(Nc1ccc(NC(=O)c2ccc([N+](=O)[O-])cc2Cl)c(C(F)(F)F)c1)c1ccc(F)cc1 71919397 BNDRWDLCEPMLCK-UHFFFAOYSA-N 481.789 5.911 5 20 JKBD Cc1cc(C(=O)N2CCC[C@@H]2C(=O)Nc2cccc(CO[C@@H]3CCC[C@H](C)C3)c2)ccc1[N+](=O)[O-] 72080487 NMTVSGYCWLYZKR-XYURVEJXSA-N 479.577 5.242 5 20 JKBD COc1ccc(NC(=O)c2cc3cc([N+](=O)[O-])ccc3s2)cc1NC(=O)c1ccc(Cl)cc1F 117554981 CFZSNTPKZLGMAN-UHFFFAOYSA-N 499.907 6.115 5 20 JKBD Cc1sc(NC(=O)c2cc(-c3cccs3)nc3c2c(C)nn3C)nc1-c1cccc([N+](=O)[O-])c1 195704211 LXWDTMUHQQHSAY-UHFFFAOYSA-N 490.570 5.598 5 20 JKBD CN(C(=O)c1ccc(NCc2ccccc2Cl)c([N+](=O)[O-])c1)c1nc2ccccc2s1 477336414 HSFKWCYLYDFVET-UHFFFAOYSA-N 452.923 5.747 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)NC[C@H]2CC3c4ccccc4C2c2ccccc23)cc1SC 481925417 YYLBPEYELLYHHT-IDLPSRMPSA-N 460.555 5.352 5 20 JKBD O=C(Nc1ncc(Cc2ccc(C(F)(F)F)cc2)s1)c1ccc(-n2ccnc2)c([N+](=O)[O-])c1 487587908 FLLQFYHJCLQRAQ-UHFFFAOYSA-N 473.436 5.099 5 20 JKBD O=C(CCOc1ccccc1[N+](=O)[O-])N(Cc1ccc(F)cc1)c1nc2ccccc2s1 501769150 NZRQOUJLLJXAIJ-UHFFFAOYSA-N 451.479 5.346 5 20 JKBD CCCOc1ccc(CNC(=O)C/C(=C\c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)cn1 502430063 JOZHMOZDBXIFLI-XSFVSMFZSA-N 488.569 5.635 5 20 JKBD Cc1ccc(C(C)C)c(Oc2ccc(CN[C@@H](C)c3ccc4c(c3)NC(=O)CO4)cc2[N+](=O)[O-])c1 504130546 LGAVYUDJZRJJHH-SFHVURJKSA-N 475.545 6.001 5 20 JKBD COc1cc(C(=O)NC2CCN(c3ccccc3)CC2)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 507634339 HMNODIYPHRWIMD-UHFFFAOYSA-N 481.936 5.448 5 20 JKBD Cn1ccnc1[C@H](NCc1ccc(Oc2ccccc2Cl)c([N+](=O)[O-])c1)c1ccc(Cl)cc1 509617138 ISYVOSYUYAIMGM-HSZRJFAPSA-N 483.355 6.307 5 20 JKBD Cc1ccc(C(C)C)c(Oc2ccc(CNC3CCN(Cc4ccccn4)CC3)cc2[N+](=O)[O-])c1 512824116 ZSPBDVSEQGELQZ-UHFFFAOYSA-N 474.605 5.968 5 20 JKBD O=C(Nc1cc(Cl)cc(Cl)c1)[C@H]1CCCN1C(=O)Nc1ccc([N+](=O)[O-])cc1Cl 516715900 OFBBYZQPNMNGDV-MRXNPFEDSA-N 457.701 5.190 5 20 JKBD O=C(Nc1ccc(-c2nc3ccccc3s2)cc1)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-] 518167347 DTZRFULNUMJKGC-UHFFFAOYSA-N 473.432 6.065 5 20 JKBD O=C(Nc1ccc(CCC(=O)N2CCCC2)cc1)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1 519011690 JIIVLXMLGKMDBI-UHFFFAOYSA-N 493.947 5.848 5 20 JKBD CC[C@@H](C)NC(=O)c1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2Oc2ccc(OC)cc2)c(C)c1 520593609 CRSRYCDCCSMXTR-QGZVFWFLSA-N 477.517 5.485 5 20 JKBD O=C(Nc1ccc(Oc2ccccc2)cc1C(F)(F)F)C1CCN(c2ccccc2[N+](=O)[O-])CC1 520678996 ZOGSLNBQWOPUNL-UHFFFAOYSA-N 485.462 6.261 5 20 JKBD COc1cc(C)ccc1Oc1ccc(NC(=O)c2csc(-c3cccc([N+](=O)[O-])c3)n2)cn1 522636573 KSLJWQNTMJHRIA-UHFFFAOYSA-N 462.487 5.475 5 20 JKBD Cc1ccc(S(=O)(=O)Nc2ccc(NC(=O)[C@@H]3CCC[C@@H](C(F)(F)F)C3)cc2)cc1[N+](=O)[O-] 603780473 DKRSUFDWQCYFLZ-HUUCEWRRSA-N 485.484 5.011 5 20 JKBD Cc1cc(NC(=O)c2ccc(F)cc2Cl)sc1C(=O)N(C)Cc1ccccc1[N+](=O)[O-] 603873294 XSMFQXFSQJWDQJ-UHFFFAOYSA-N 461.902 5.282 5 20 JKBD COc1ccc(-c2nn(Cc3ccccc3)cc2C(=O)N[C@@H](C)c2cccc([N+](=O)[O-])c2)cc1 603966203 FCPKZHRUIOWIKH-SFHVURJKSA-N 456.502 5.006 5 20 JKBD Cc1ccc(C(=O)N[C@H](C)c2cccc([N+](=O)[O-])c2)cc1NC(=O)c1ccc(Br)cc1 603966652 FKNJDHKSGFKREJ-OAHLLOKOSA-N 482.334 5.409 5 20 JKBD O=C(Nc1ccc(OC(=O)c2csc(-c3ccccc3Cl)n2)cc1)c1cccc([N+](=O)[O-])c1 727294979 IYULAGPKXHDKPY-UHFFFAOYSA-N 479.901 5.843 5 20 JKBD O=C(COC(=O)c1csc(-c2cccc([N+](=O)[O-])c2)n1)N[C@H](c1ccc(F)cc1)C1CCCC1 747955453 IFONHZRRFRUVQL-QFIPXVFZSA-N 483.521 5.062 5 20 JKBD COc1cc(COC(=O)Cn2c3ccccc3c(=O)c3ccccc32)cc(Cl)c1OC(F)F 892193954 IXMHMIIIDYGHGM-UHFFFAOYSA-N 473.859 5.162 5 20 JKBD O=[N+]([O-])c1cccc(-c2nccc(/C=C/c3csc(-c4cccc(Br)c4)n3)[n+]2[O-])c1 915987716 JNXWHDZKLYVJCA-BQYQJAHWSA-N 481.331 5.347 5 20 JKBD CC1=C(C(=O)Nc2cccc(F)c2)[C@H](c2ccc([N+](=O)[O-])cc2)NC(=S)N1c1ccccc1 917373306 CYSVVCNNFFSBBL-QFIPXVFZSA-N 462.506 5.082 5 20 JKBD CC(C)N(Cc1nnc(-c2cccc([N+](=O)[O-])c2)o1)C(=O)c1ccc(OCC2CCCCC2)cc1 919681145 NUXJNNOFYIHQIG-UHFFFAOYSA-N 478.549 5.655 5 20 JKBD Cc1c(Br)cc(C(=O)NC2(c3ccc(NC(=O)c4ccco4)cc3)CCC2)cc1[N+](=O)[O-] 1787272671 ZWHHIKSQRGDURB-UHFFFAOYSA-N 498.333 5.320 5 20 JKBD Cc1c(C(=O)NC2(c3ccc(NC(=O)CC4CCOCC4)cc3)CCC2)cc(Cl)cc1[N+](=O)[O-] 1787922995 ZNTHOKYWANJWTP-UHFFFAOYSA-N 485.968 5.121 5 20 JKBD O=C(/C=C/c1ccccc1[N+](=O)[O-])NC1(c2ccc(NC(=O)CS[C@@H]3CCCCO3)cc2)CCC1 1789550124 SPZQVMFTIYEGOF-FFODHNNBSA-N 495.601 5.002 5 20 JKBD O=C(/C=C/c1ccccc1[N+](=O)[O-])Nc1ccc(C2(NC(=O)c3ccc(Cl)cn3)CCC2)cc1 1792317432 PJEYRYUQTYIQNJ-AWNIVKPZSA-N 476.920 5.104 5 20 JKBD CC(C)[C@H](C(=O)N1CCCC2(CCN(C(=O)c3cccc(F)c3[N+](=O)[O-])CC2)C1)c1ccccc1 1805623526 PMEJHIMILBFZPK-QHCPKHFHSA-N 481.568 5.019 5 20 JKBD O=C(CCC1CCC1)Nc1cc([C@@H]2CCCCN2C(=O)C2(c3cccc([N+](=O)[O-])c3)CCC2)[nH]n1 1815051827 XFRKYSZWHQWQSC-QFIPXVFZSA-N 479.581 5.012 5 20 JKBD Cc1ccc(C)c(C(=O)N2CCCC[C@H]2c2cc(NC(=O)CSc3ccccc3[N+](=O)[O-])n[nH]2)c1 1822314996 KEOLCUXNEUYFCX-FQEVSTJZSA-N 493.589 5.033 5 20 JKBD Cc1c(C(=O)N2CCC([C@@H]3CCCCN3C(=O)C(C)(C)C(C)(F)F)CC2)cc(Cl)cc1[N+](=O)[O-] 1824632481 YYKYDBNWSWNWNW-IBGZPJMESA-N 499.986 5.471 5 20 JKBD Cc1oc(C(C)(C)C)cc1C(=O)N1CCCC[C@H]1C1CCN(C(=O)/C=C/c2ccc([N+](=O)[O-])o2)CC1 1825947059 FPAVBFIAXXXXPR-RCHCNPRSSA-N 497.592 5.333 5 20 JKBD Cc1c(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3ccc([N+](=O)[O-])o3)CC2)[nH]c2c(Cl)cccc12 1827517758 MXBRHUCMERMBMR-LJQANCHMSA-N 498.967 5.178 5 20 JKBD O=C(/C=C/C1CCCCC1)N1CCC([C@H]2CCCCN2C(=O)Cc2ccc([N+](=O)[O-])cc2F)CC1 1831295133 WHOJGUQGSIUUKN-QXJBOHEXSA-N 485.600 5.033 5 20 JKBD COc1cc(C(=O)N2CCCC[C@H]2C2CCN(C(=O)c3cccc(C)c3Cl)CC2)ccc1[N+](=O)[O-] 1832697194 HZMWCOIGMZQHCU-NRFANRHFSA-N 499.995 5.112 5 20 JKBD O=C(Nc1ccccc1)C1CCN(C(=O)c2ccc(NCc3ccccc3Cl)c([N+](=O)[O-])c2)CC1 9891719 ZKHNRNZLVHPJMY-UHFFFAOYSA-N 492.963 5.351 5 20 JKBD Cc1cc(C(=O)CCC(=O)Oc2ccc(NC(=O)c3cc([N+](=O)[O-])ccc3Cl)cc2)c(C)s1 15576332 CCVVUBFNMCQAFB-UHFFFAOYSA-N 486.933 5.747 5 20 JKBD CCN(CC)C(=O)c1ccc(CN[C@@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2ccccc2)cc1 30497000 QRRRPXRMKBVHLZ-XMMPIXPASA-N 494.979 5.200 5 20 JKBD COCCOc1cc(C)ccc1NC(=O)c1ccc(NCc2ccccc2Cl)c([N+](=O)[O-])c1 59780733 KDCHXKXVMNMRIQ-UHFFFAOYSA-N 469.925 5.446 5 20 JKBD COc1ccc([N+](=O)[O-])cc1NC(=O)c1ccccc1SCC(=O)NC12CC3CC(CC(C3)C1)C2 104729669 OEJFUHNYOOHYKB-UHFFFAOYSA-N 495.601 5.033 5 20 JKBD Cc1csc(Sc2ccc(C(=O)NC[C@H]3CCCO[C@@H]3c3ccccc3)cc2[N+](=O)[O-])n1 409556764 YFYXSOVKWXSHLZ-WIYYLYMNSA-N 469.588 5.409 5 20 JKBD CC(=O)NCC1CCN(C(=O)c2c3c(nc4ccccc24)/C(=C/c2cccc([N+](=O)[O-])c2)CCC3)CC1 483132995 YINQEAKGJJLFLN-CJLVFECKSA-N 498.583 5.008 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)N2CCC[C@H]2c2cc(Br)ccc2OC)cc1SC 483529618 OSVPXBHHTDRWQX-HNNXBMFYSA-N 481.368 5.074 5 20 JKBD Cc1csc(Sc2ccc(C(=O)N3CCC(Nc4ccc(F)cc4)CC3)cc2[N+](=O)[O-])n1 486498508 PBFGBSHCFPDTMC-UHFFFAOYSA-N 472.567 5.367 5 20 JKBD COc1ccc(C(=O)N2CCCCCC2)cc1NC(=O)c1ccc(N2CCC[C@@H](C)C2)c([N+](=O)[O-])c1 501697476 MNGSNSNIDRTAQY-LJQANCHMSA-N 494.592 5.108 5 20 JKBD C[C@H](Nc1ccc(C(=O)N[C@H](c2ccccc2)c2ccc(F)cc2)cc1[N+](=O)[O-])c1ccccn1 506178428 KHLHKAQUYWVHFZ-HFJWLAOPSA-N 470.504 5.821 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Br)[C@H](NC[C@@H]1CCOc2ccccc21)c1ccccc1 519490721 OLJOBCNGTQNNGF-GAJHUEQPSA-N 496.361 5.193 5 20 JKBD O=C(C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)N(C[C@H]1CCOC1)C1CC1 520406107 AEMFYABUFPUHEQ-ZJYZBMPFSA-N 463.559 5.163 5 20 JKBD Cc1nc(-c2ccc(F)cc2)sc1[C@@H](C)NC(=O)Cn1c2ccccc2c(=O)c2ccccc21 520540938 YKNRUBKWDSDUQG-MRXNPFEDSA-N 471.557 5.603 5 20 JKBD Cc1cc(O[C@H](C)c2ccccc2)ccc1NC(=O)CNC(=O)c1c(Cl)cccc1[N+](=O)[O-] 520822747 GGOREKBBVNQYCR-MRXNPFEDSA-N 467.909 5.065 5 20 JKBD O=C(Cn1ccc(=O)c2ccccc21)Nc1cc([N+](=O)[O-])ccc1Nc1cccc(C(F)(F)F)c1 521538596 UOPLYFJBJMZLMA-UHFFFAOYSA-N 482.418 5.311 5 20 JKBD O=C(c1c2c(nc3ccccc13)/C(=C\c1cccc([N+](=O)[O-])c1)CCC2)N1CCC[C@@H](c2ncc[nH]2)C1 524339994 KJHAVUSCYRYGEE-OYQOIYBLSA-N 493.567 5.763 5 20 JKBD CC(C)Oc1cccc([C@H](C)NC(=O)C2CCN(c3ccc(C(F)(F)F)cc3[N+](=O)[O-])CC2)c1 603903197 WIFRHLOMHADSHJ-INIZCTEOSA-N 479.499 5.495 5 20 JKBD O=C(Nc1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2Oc2ccccc2)cc1Cl)c1ccco1 604119284 JLEQORSEOZJQFU-UHFFFAOYSA-N 477.860 6.138 5 20 JKBD COc1cc(C(=O)N[C@@H]2CCOc3c(OC)cccc32)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 604570645 GTSRCSGJVZNBPZ-QGZVFWFLSA-N 484.892 5.311 5 20 JKBD COc1cc([C@@H](C)Nc2cnn(-c3ccc([N+](=O)[O-])cc3)c(=O)c2Cl)ccc1OC1CCCC1 608830981 VXEYHGJIZLVDKX-OAHLLOKOSA-N 484.940 5.297 5 20 JKBD Cn1cnnc1Sc1ccc(C(=O)N(Cc2cccc3ccccc23)C2CCCC2)cc1[N+](=O)[O-] 609064884 QSLUFBNDBWFWMG-UHFFFAOYSA-N 487.585 5.613 5 20 JKBD Cn1c(=O)oc2cc(NC(=O)C/C(=C\c3ccc([N+](=O)[O-])cc3)c3nc4ccccc4s3)ccc21 609107847 YBMTYNSRXKEJTL-FOWTUZBSSA-N 486.509 5.219 5 20 JKBD Cc1cc(OCc2cccc(Cl)c2)ccc1N[C@H](C)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 728064802 GBKVQYKXFUJCEC-MRXNPFEDSA-N 464.909 6.359 5 20 JKBD CCCc1noc2nc(C3CC3)cc(C(=O)N(CC3CC3)c3ccc(Cl)c([N+](=O)[O-])c3)c12 728166230 WWRBQQOBQYBRIM-UHFFFAOYSA-N 454.914 5.671 5 20 JKBD C[C@H](Nc1ccc(C(=O)Nc2ccccc2SC(=O)N(C)C)cc1[N+](=O)[O-])c1ccccn1 729247262 FUPDLCVUYIJXOI-HNNXBMFYSA-N 465.535 5.189 5 20 JKBD O=C(CCC(=O)c1ccc2ccc3cccc4ccc1c2c34)Nc1ccccc1CN1CCOCC1 729629267 VVZXXBVOVLWVHR-UHFFFAOYSA-N 476.576 6.018 5 20 JKBD Cc1ccc(/C=C\C(=O)O[C@@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)c(Br)c1 746170695 YYPLBNHFDFMMSE-SZNGSJQDSA-N 458.268 5.033 5 20 JKBD C[C@@H](OC(=O)c1csc(-c2cccc([N+](=O)[O-])c2)n1)C(=O)N[C@H](C)c1ccc(Cl)cc1Cl 747962893 VXOTZWYXLYBHPP-VXGBXAGGSA-N 494.356 5.448 5 20 JKBD O=[N+]([O-])c1ccc(/C=C(\Cl)c2nc(O)c3c(-c4ccccc4Cl)csc3n2)cc1O 748146716 LRGKXBIKDJDBBK-AUWJEWJLSA-N 460.298 6.068 5 20 JKBD Cc1c(-c2ccccc2)oc2c(C(=O)OCC3CCN(c4ccc([N+](=O)[O-])cn4)CC3)cccc2c1=O 750426808 PZWXMMQNMVGOMS-UHFFFAOYSA-N 499.523 5.145 5 20 JKBD COc1ccc([C@@H](NC(=O)c2cc([N+](=O)[O-])ccc2Br)c2ccc(F)cc2)cc1 751108252 OXOQZDQUFOULQL-FQEVSTJZSA-N 459.271 5.024 5 20 JKBD C[C@H](OC(=O)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1)c1nc(-c2ccccc2)no1 761642308 JVBHYVJYYMTAOK-AWEZNQCLSA-N 490.438 5.184 5 20 JKBD CC(C)(C)c1noc(CCCC(=O)Nc2cc(Cl)c([N+](=O)[O-])cc2OCc2ccccc2)n1 915139033 GFJAZWJEKFQHJA-UHFFFAOYSA-N 472.929 5.469 5 20 JKBD Cc1cccc(NC(=O)CSCC(=O)Nc2cc(Cl)c([N+](=O)[O-])cc2OCc2ccccc2)c1 916827371 GHMUYMYXAKQNFR-UHFFFAOYSA-N 499.976 5.446 5 20 JKBD Cc1ccc(NS(=O)(=O)c2ccc(Nc3ccc(NC(=O)C4CC4)cc3)c([N+](=O)[O-])c2)c(C)c1 917038025 IBNVBSMOPKJARD-UHFFFAOYSA-N 480.546 5.105 5 20 JKBD Cc1c(NC(=O)c2cc([N+](=O)[O-])ccc2N2CCCCC2)cccc1-c1nnc2n1CCCCC2 917676099 CCEVNFYBRSSJCD-UHFFFAOYSA-N 474.565 5.131 5 20 JKBD C[C@H](N[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Br)c1ccccc1)c1cccc([N+](=O)[O-])c1 917938102 FWTNLFZKNWIAQD-QKKBWIMNSA-N 499.321 5.296 5 20 JKBD C[C@@H](OC(=O)c1cc([N+](=O)[O-])ccc1Oc1ccccc1)C(=O)N1CCC[C@H]1c1cccs1 919191534 GCWBLIDQZKMBSW-UZLBHIALSA-N 466.515 5.358 5 20 JKBD CCSc1cc(C(=O)O[C@@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2ccccc2)ccn1 919733702 VQKLNRMFMZPLJY-HXUWFJFHSA-N 471.922 5.292 5 20 JKBD COc1cc(OC)cc(C(=O)c2c(NC(=O)c3cc(OC)ccc3[N+](=O)[O-])sc3c2CCCC3)c1 920277494 VTCAKAFFBTYTIQ-UHFFFAOYSA-N 496.541 5.044 5 20 JKBD Cc1sc2nc([C@@H](C)OC(=O)c3ccc(N[C@@H](C)c4ccccn4)c([N+](=O)[O-])c3)nc(O)c2c1C 920543358 BYLFHIRKZYHITC-UONOGXRCSA-N 493.545 5.408 5 20 JKBD Cc1ccc(CCNC(=O)c2ccccc2NC(=O)c2ccc([N+](=O)[O-])cc2Cl)c(C)c1 920887301 GYEQFCPIHJVNDX-UHFFFAOYSA-N 451.910 5.090 5 20 JKBD O=C(Nc1nnc(SCc2cccs2)s1)c1cc([N+](=O)[O-])ccc1N1CCCCC1 921200447 NYKWZIXDKPMZQS-UHFFFAOYSA-N 461.594 5.043 5 20 JKBD CCc1ccc(C(=O)NC2(c3ccc(NC(=O)Cc4ccc(Cl)cc4[N+](=O)[O-])cc3)CCC2)cn1 1786116142 ABFSFPFBKGLECA-UHFFFAOYSA-N 492.963 5.196 5 20 JKBD Cc1c(C(=O)NC2(c3ccc(NC(=O)CCN4CCCCC4)cc3)CCC2)cc(Cl)cc1[N+](=O)[O-] 1787790280 IQYUAKUUIOOISP-UHFFFAOYSA-N 499.011 5.180 5 20 JKBD O=C(NC1(c2ccc(NC(=O)c3cc4cc[nH]c4cc3Cl)cc2)CCC1)c1ccc([N+](=O)[O-])o1 1789074371 AFZOELOICSACFC-UHFFFAOYSA-N 478.892 5.384 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)c3c(Cl)cccc3Cl)CCC2)cc1)c1ccc([N+](=O)[O-])[nH]1 1790187265 OCNGUAWGGOWKRF-UHFFFAOYSA-N 473.316 5.291 5 20 JKBD Cc1ccc(CC(=O)Nc2ccc(C3(NC(=O)[C@]4(F)CCCC=C4F)CCC3)cc2)cc1[N+](=O)[O-] 1790523324 CSBUGHHQAMAGPD-SANMLTNESA-N 483.515 5.325 5 20 JKBD CSc1ccc(CC(=O)NC2(c3ccc(NC(=O)c4ccc(O)c([N+](=O)[O-])c4)cc3)CCC2)cc1 1790624095 VQVYZBNBNPXEQO-UHFFFAOYSA-N 491.569 5.013 5 20 JKBD O=C(CC1CC1)NC1(c2ccc(NC(=O)c3cc(F)cc([N+](=O)[O-])c3Br)cc2)CCC1 1790795340 BNQXVRNFJPLPDX-UHFFFAOYSA-N 490.329 5.044 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)C34CC(C3)C4)CCC2)cc1)c1cc2cc([N+](=O)[O-])ccc2s1 1791010341 IHBCNNUMRSUHHF-UHFFFAOYSA-N 461.543 5.357 5 20 JKBD O=C(c1ccc([N+](=O)[O-])o1)N1CCCC2(CCN(C(=O)c3sc4ccccc4c3Cl)CC2)C1 1804650728 JHBWQURLAWUXGB-UHFFFAOYSA-N 487.965 5.215 5 20 JKBD CC(C)CCC(=O)N1CCC([C@@H]2CCCCN2C(=O)c2ccc(Br)c([N+](=O)[O-])c2)CC1 1830522511 LACRBQUAZUDMQG-FQEVSTJZSA-N 494.430 5.027 5 20 JKBD O=C(Nc1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2Br)cc1Cl)c1ccco1 722595 SARRRQYYFLXBGC-UHFFFAOYSA-N 464.659 5.108 5 20 JKBD O=C(Cn1c2ccccc2c(=O)c2ccccc21)N[C@H](c1ccccc1)c1ccc(Cl)cc1 11250794 YCBMMURSPHVKAO-HHHXNRCGSA-N 452.941 5.714 5 20 JKBD CCOc1ccc([C@H](CNC(=O)c2ccc([N+](=O)[O-])cc2)c2c[nH]c3ccccc23)cc1OC 16176386 SZSOLHFGYQXGSA-NRFANRHFSA-N 459.502 5.045 5 20 JKBD CC(C)OCc1c(C(=O)O[C@@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)oc2ccccc12 17721788 AAKHYQRDBFLJGY-AWEZNQCLSA-N 451.435 5.234 5 20 JKBD COc1cc(CSc2nnc(-c3ccoc3C)n2-c2ccccc2)c([N+](=O)[O-])cc1OC(F)F 25025074 ZQLVLRRPRRWMND-UHFFFAOYSA-N 488.472 5.646 5 20 JKBD O=C(C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1)N1CCC[C@H]1Cc1ccccc1Cl 72021663 BUQVLQBSIGAFKI-IBGZPJMESA-N 495.929 5.717 5 20 JKBD Cc1nn(Cc2ccccc2)c(Cl)c1C(=O)Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1 72104920 YABYDALSCYUDLG-UHFFFAOYSA-N 453.911 5.177 5 20 JKBD O=C(CSc1nc2ccc([N+](=O)[O-])cc2s1)N1c2ccccc2Sc2ccccc21 253578753 YSNZPYNVPYQRNV-UHFFFAOYSA-N 451.554 6.126 5 20 JKBD O=C(Nc1cc(Cl)ccc1OC[C@@H]1CCCO1)c1csc(-c2cccc([N+](=O)[O-])c2)n1 303006206 IKBDWRVUXXKTJR-INIZCTEOSA-N 459.911 5.182 5 20 JKBD CCOc1cc(C(=O)Nc2nc3ccccc3n2CCCc2ccccc2)c([N+](=O)[O-])cc1OC 476764006 FUJADTUOOYCIKK-UHFFFAOYSA-N 474.517 5.237 5 20 JKBD O=C(NCc1ccccc1F)c1ccc(NC(=O)c2csc(-c3cccc([N+](=O)[O-])c3)n2)cc1 496242308 DKYUBXXSOSVICY-UHFFFAOYSA-N 476.489 5.040 5 20 JKBD CC(C)CCSc1ccc(C(=O)Nc2ccc(CS(=O)(=O)C(C)C)cc2)cc1[N+](=O)[O-] 497770767 BBRUESUNUVVAFO-UHFFFAOYSA-N 464.609 5.309 5 20 JKBD COc1cc(C(=O)Nc2nc3c(s2)CCCCCC3)c([N+](=O)[O-])cc1OCc1cscn1 511612196 UPTQSGQYWNMFSJ-UHFFFAOYSA-N 474.564 5.007 5 20 JKBD COc1cc(C(=O)N(C)[C@@H](C)c2ccccc2Cl)c([N+](=O)[O-])cc1OCc1cscn1 512432419 GAKIAQWEOXXFTG-ZDUSSCGKSA-N 461.927 5.126 5 20 JKBD COc1ccc(-c2[nH]c3ccccc3c2CCC(=O)NCc2ccc([N+](=O)[O-])cc2)c(OC)c1 512782117 DCEVECLBNALSDX-UHFFFAOYSA-N 459.502 5.009 5 20 JKBD C[C@H]1CCCN(CCCCNC(=O)C/C(=C\c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)C1 517094681 FIRSLELMXUJSSH-RWVGPTSPSA-N 492.645 5.764 5 20 JKBD O=C(CC1CCCC1)N1CCCN(C(=O)c2ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])cc2)CC1 517388727 FUXZMWZUUNUZNO-UHFFFAOYSA-N 485.968 5.295 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)NC2CCN(Cc3ccc(Cl)c(Cl)c3)CC2)cc1SC 517512989 IZVFDOILYVEFQY-UHFFFAOYSA-N 484.405 5.027 5 20 JKBD O=C(Nc1ccc(OCc2ccccn2)c(Cl)c1)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-] 520964603 BBUVJOBEGWUUBK-UHFFFAOYSA-N 481.814 5.416 5 20 JKBD O=C(Nc1ccc(Cc2nc3ccccc3s2)cc1)c1ccn(-c2ccc([N+](=O)[O-])cc2)n1 521385788 QZOPROIDUZTUJM-UHFFFAOYSA-N 455.499 5.233 5 20 JKBD Cc1cc(Br)cc2c1N(C(=O)c1ccc(N[C@H](C)c3ccccn3)c([N+](=O)[O-])c1)CCC2 524455012 AVYZWUOGSFOFNN-MRXNPFEDSA-N 495.377 5.827 5 20 JKBD Cc1nc(-c2cccs2)c(CC(=O)N(Cc2ccccc2[N+](=O)[O-])CC(F)(F)F)s1 603741870 BNZZLCSITSNNEP-UHFFFAOYSA-N 455.483 5.222 5 20 JKBD C[C@@H]1C[C@H]1c1ccc(CN[C@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Br)c2ccccc2)o1 604044524 TUZKRTDILDWIMD-KEQGGVEFSA-N 484.350 5.543 5 20 JKBD CCCOc1cc(NC(=O)c2cc3cnn(C(C)C)c3nc2C)c([N+](=O)[O-])cc1OCCC 619206457 CMBBDUFUBUAKSP-UHFFFAOYSA-N 455.515 5.059 5 20 JKBD Cc1cc[n+](/C(C(=S)NC23CC4CC(CC(C4)C2)C3)=C(/O)c2ccc(C)c([N+](=O)[O-])c2)cc1 725761500 INFLFLDWCIDHMN-UHFFFAOYSA-O 464.611 5.269 5 20 JKBD C[C@@H](NC(=S)/C(=C(/O)c1ccc([N+](=O)[O-])cc1)[n+]1cccc(O)c1)c1ccc(Cl)cc1Cl 726570663 QIXWGGRURPWNTR-CYBMUJFWSA-O 491.376 5.457 5 20 JKBD C[C@@H]1CN(c2ccc(NC(=O)c3ccc(NCc4ccccc4)c([N+](=O)[O-])c3)cc2)C[C@@H](C)O1 747435439 YDPKVJMVZNIFBS-RTBURBONSA-N 460.534 5.073 5 20 JKBD CC(=O)N(c1ccc(F)cc1)c1nc(COC(=O)c2csc(-c3cccc([N+](=O)[O-])c3)n2)cs1 747954789 GQUPNJHAIAXMTL-UHFFFAOYSA-N 498.517 5.356 5 20 JKBD CC[C@@H](C)c1ccccc1NC(=O)[C@@H](C)OC(=O)c1csc(-c2ccc([N+](=O)[O-])cc2)n1 747958814 VRDAZTCZTOXLQP-HUUCEWRRSA-N 453.520 5.416 5 20 JKBD CC(C)c1ccc(-c2nc(C(=O)OCC3CCN(c4ccc([N+](=O)[O-])cn4)CC3)cs2)cc1 750426697 HPCLIBCIJTYUBU-UHFFFAOYSA-N 466.563 5.310 5 20 JKBD Cc1ccc(-c2nnc([C@H](C)OC(=O)CCNc3ccc(C(F)(F)F)cc3[N+](=O)[O-])o2)cc1 750503787 SURSIYGBKFQQSS-ZDUSSCGKSA-N 464.400 5.078 5 20 JKBD O=[N+]([O-])c1cc(Cl)ccc1CNc1cccc(CS(=O)(=O)c2ccc(F)cc2F)c1 864011482 GDJAAERENGCZAH-UHFFFAOYSA-N 452.866 5.112 5 20 JKBD CC(C)N(Cc1nnc(-c2cccc([N+](=O)[O-])c2)o1)C(=O)c1cc2c3ccccc3n(C)c2s1 864242653 PIQQTDNKZWWPIY-UHFFFAOYSA-N 475.530 5.402 5 20 JKBD Cc1csc(Sc2ccc(C(=O)Nc3cc([N+](=O)[O-])ccc3OC(F)F)cc2[N+](=O)[O-])n1 915283622 VKWBPLXQMNFHAQ-UHFFFAOYSA-N 482.446 5.273 5 20 JKBD COc1ccc(N2C(=S)N[C@H](c3ccsc3)C(C(=O)Nc3ccc([N+](=O)[O-])cc3)=C2C)cc1 916167654 DVQDQRFWIKLUHV-OAQYLSRUSA-N 480.571 5.013 5 20 JKBD Cc1ccc(C(=O)N2C[C@H](C)C[C@@H](C)C2)cc1NC(=O)c1ccc(Br)c([N+](=O)[O-])c1 917741979 LSGASMOBPQBSBX-ZIAGYGMSSA-N 474.355 5.036 5 20 JKBD C[C@H](OC(=O)COc1ccc2cc(Br)ccc2c1)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 919381924 OWVCYQZHNBPDFJ-ZDUSSCGKSA-N 498.289 5.244 5 20 JKBD Cc1ccc(C(=O)NC2(c3ccc(NC(=O)Cn4ccc5ccc([N+](=O)[O-])cc54)cc3)CCC2)nc1C 1786275888 PHLLOBOJTUSVFG-UHFFFAOYSA-N 497.555 5.009 5 20 JKBD C/C(=C\c1ccc(C)o1)C(=O)Nc1ccc(C2(NC(=O)Cc3cccc([N+](=O)[O-])c3)CCC2)cc1 1789580863 BOHMRKULODNQIS-OBGWFSINSA-N 473.529 5.276 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)[C@@]3(F)CCCC=C3F)CCC2)cc1)c1cc([N+](=O)[O-])cc2c1OCC2 1790045488 RTMZDOPFYLJGLM-AREMUKBSSA-N 497.498 5.023 5 20 JKBD O=C(Cc1cccnc1)NC1(c2ccc(NC(=O)c3cc4cc([N+](=O)[O-])ccc4s3)cc2)CCC1 1791009874 BOFLIHPFPWMWNX-UHFFFAOYSA-N 486.553 5.195 5 20 JKBD Cc1ccc(C(=O)NC2(c3ccc(NC(=O)CSc4ccccc4[N+](=O)[O-])cc3)CCC2)cc1O 1791523471 SNRIXYHANGTNEF-UHFFFAOYSA-N 491.569 5.149 5 20 JKBD CC[C@H]1CC[C@H](C(=O)N2CCC([C@@H]3CCCCN3C(=O)Cc3cc([N+](=O)[O-])ccc3F)CC2)CC1 1824950156 ZKSAUECCNNGEIF-OWHZGTRUSA-N 487.616 5.113 5 20 JKBD O=C(CCc1cccc([N+](=O)[O-])c1)N1CCC([C@@H]2CCCCN2C(=O)c2cccc(Cl)c2)CC1 1829969326 AWODRKNMQCRQMG-DEOSSOPVSA-N 483.996 5.114 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)N1CCCC[C@H]1C1CCN(C(=O)/C=C/c2ccsc2)CC1 1830728274 HRUZTLHLFYKMPA-PABBZOGXSA-N 485.581 5.051 5 20 JKBD O=C(/C=C/c1ccccc1[N+](=O)[O-])N1CCC([C@@H]2CCCCN2C(=O)c2cc(F)cc(Cl)c2)CC1 1832628343 UGKCPTKQJOODMO-YVSHKSEASA-N 499.970 5.334 5 20 JKBD O=C(COC(=O)c1cc2c(s1)-c1ccccc1CC2)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 9814944 RHEKUNCDQXZLGG-UHFFFAOYSA-N 476.432 5.236 5 20 JKBD COc1cc(CSc2nnc(Nc3ccccc3F)s2)c([N+](=O)[O-])cc1OC(F)F 12719649 TVLDDDRUDPUASO-UHFFFAOYSA-N 458.443 5.231 5 20 JKBD O=C(OCC(=O)N(Cc1ccccc1)c1nc(-c2ccc(F)cc2)cs1)c1ccccc1[N+](=O)[O-] 14857903 YAGYWBOJFAUPCC-UHFFFAOYSA-N 491.500 5.248 5 20 JKBD CSc1ccc([N+](=O)[O-])c(C(=O)NC[C@H](c2ccccc2Cl)c2c[nH]c3ccccc23)c1 16205577 ZTAIELCTCDAAKA-LJQANCHMSA-N 465.962 6.013 5 20 JKBD COc1ccc(-c2nnc(SCc3nc4ccccc4c4ccccc34)n2C[C@@H]2CCCO2)cc1 20053002 JGBDTZMJOCKKBF-NRFANRHFSA-N 482.609 6.126 5 20 JKBD CCn1c(S[C@H](C)C(=O)Nc2c(C)cccc2C(C)C)nc2cc3ccccc3cc2c1=O 22178399 WNPDPONPJPAEHB-GOSISDBHSA-N 459.615 6.121 5 20 JKBD Cc1nc(-c2cccc(Cl)c2)sc1C(=O)O[C@@H](C)C(=O)Nc1cccc([N+](=O)[O-])c1C 26845966 LFHSRLAWUQPVDP-ZDUSSCGKSA-N 459.911 5.173 5 20 JKBD Cc1cc(C)c(NC(=O)COC(=O)c2cc([N+](=O)[O-])ccc2Sc2nc(C)cs2)c(Cl)c1 28873854 DEKACVNHEMZYAX-UHFFFAOYSA-N 491.978 5.577 5 20 JKBD C[C@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)N(Cc1ccccn1)c1ccc(Br)cc1 68734254 HUDBREHAXOCFKC-HNNXBMFYSA-N 472.364 5.466 5 20 JKBD O=C(CSc1ccc(C(F)(F)F)cc1[N+](=O)[O-])Nc1cc(Cl)ccc1C(=O)N1CCCC1 107649306 DIHDMSRLZRCVOB-UHFFFAOYSA-N 487.887 5.234 5 20 JKBD CCOc1cc(NC(=O)c2cnn(-c3cccc(C(F)(F)F)c3)c2C)c([N+](=O)[O-])cc1OCC 302968336 QLRNQURNFUSGNA-UHFFFAOYSA-N 478.427 5.157 5 20 JKBD Cc1ccc([N+](=O)[O-])cc1NC(=O)c1sc(-c2ccccc2)cc1OCC(=O)N1CCCCC1 410150261 LMFCGJXKJIUJTC-UHFFFAOYSA-N 479.558 5.275 5 20 JKBD COc1cc(C(=O)N2CCC(C(=O)c3ccc(CC(C)C)cc3)CC2)c([N+](=O)[O-])cc1OC(F)F 479739516 CRXDUFWFMDCACW-UHFFFAOYSA-N 490.503 5.138 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)N(C2CC2)[C@@H](C)c2cccc(C(F)(F)F)c2)cc1SC 482542533 HHGVXCUKDXNGHO-LBPRGKRZSA-N 454.470 5.710 5 20 JKBD C[C@H](Nc1ccc(C(=O)Nc2cc(Cl)ccc2OC[C@H]2CCCO2)cc1[N+](=O)[O-])c1ccccn1 509814312 SZFVEZXRXMJPJC-QFBILLFUSA-N 496.951 5.626 5 20 JKBD CCN(Cc1ccc(OCc2cccs2)c(OC)c1)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl 516273034 NIUKRFYUUNFWKL-UHFFFAOYSA-N 475.954 5.951 5 20 JKBD CO[C@H](C)C(=O)Nc1cccc(NC(=O)c2ccc(NCc3ccccc3Cl)c([N+](=O)[O-])c2)c1 518889376 BPCACOOIZSFOSV-OAHLLOKOSA-N 482.924 5.086 5 20 JKBD O=C(NCc1ccccc1-c1ccc(Cn2cccn2)cc1)C1CCN(c2ccccc2[N+](=O)[O-])CC1 519130191 IIWFJBRIYHYECJ-UHFFFAOYSA-N 495.583 5.039 5 20 JKBD CCCOc1cc(NC(=O)N2CCC[C@H]2c2nc3ccc(C)cc3[nH]2)c([N+](=O)[O-])cc1OCCC 519935058 SHSSBUDHUBUPRG-FQEVSTJZSA-N 481.553 5.726 5 20 JKBD O=C(Nc1ccc(=O)n(Cc2ccc(Cl)c(Cl)c2)c1)c1ccc(Cl)cc1[N+](=O)[O-] 521571433 FCPVFUMKQNONLQ-UHFFFAOYSA-N 452.681 5.017 5 20 JKBD Cc1csc(Sc2ccc(C(=O)NCCCc3nc(-c4ccncc4)cs3)cc2[N+](=O)[O-])n1 524103648 QGOYPUYGMDLZBN-UHFFFAOYSA-N 497.627 5.392 5 20 JKBD Cc1c(C(=O)Nc2cc([N+](=O)[O-])ccc2Nc2cccc(C(F)(F)F)c2)cnn1-c1ccccn1 603564917 OZPACORSHDMIDS-UHFFFAOYSA-N 482.422 5.499 5 20 JKBD Cc1ccc([N+](=O)[O-])cc1NC(=O)c1cccc(NC(=O)Cc2ccc(Br)cc2)c1 603637452 JTWJWRJJHDCERV-UHFFFAOYSA-N 468.307 5.099 5 20 JKBD CN(C[C@H]1CCCO[C@@H]1c1ccccc1)C(=O)c1ccc(NCc2ccccc2Cl)c([N+](=O)[O-])c1 604519118 MENLUPBBMXXWTO-ATIYNZHBSA-N 493.991 6.100 5 20 JKBD O=C(Nc1ccc(Cl)cc1Cl)[C@H]1CCCCN1C(=O)c1c[nH]c2ccc([N+](=O)[O-])cc12 604545999 AITHCOYBULUKNH-LJQANCHMSA-N 461.305 5.016 5 20 JKBD C[C@H](NCc1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1)c1cccc(N2CCCC2=O)c1 608836603 XRRKXWJTTAOUHW-FQEVSTJZSA-N 481.556 5.425 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)Nc2ccccc2C(=O)Nc2cccc(Cl)c2)cc1SC 728458817 KENHQDQLNKCJIV-UHFFFAOYSA-N 471.922 5.483 5 20 JKBD CC[C@@H](C)c1ccccc1NC(=O)[C@H](C)OC(=O)c1csc(-c2ccc([N+](=O)[O-])cc2)n1 747958812 VRDAZTCZTOXLQP-CABCVRRESA-N 453.520 5.416 5 20 JKBD O=C(Oc1cccc(C(=O)N2CCc3ccccc3C2)c1)c1csc(-c2ccc([N+](=O)[O-])cc2)n1 751180168 LXVMQVYELDCSFR-UHFFFAOYSA-N 485.521 5.136 5 20 JKBD Cc1cccc([N+](=O)[O-])c1NC(=O)COC(=O)CCN1c2ccccc2Sc2ccccc21 785461331 PVWOASABAFCQBN-UHFFFAOYSA-N 463.515 5.078 5 20 JKBD C[C@@H](OC(=O)c1cc(-c2ccccn2)nc2ccccc12)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 813388874 ICZYXADWCHJUMZ-OAHLLOKOSA-N 467.441 5.173 5 20 JKBD CC(C)n1cc(C(=O)Nc2cccc(Oc3ccc([N+](=O)[O-])cc3)c2)c(C2CCOCC2)n1 856643047 NJFSPUDHACRNIJ-UHFFFAOYSA-N 450.495 5.311 5 20 JKBD CC(C)(C)OC(=O)NC1(c2noc(-c3ccnc(-c4ccccc4)c3[N+](=O)[O-])n2)CCCC1 904417761 BTMVPEWGXFYJCS-UHFFFAOYSA-N 451.483 5.001 5 20 JKBD COc1cc(-c2nc(-c3ccc(Oc4ccc(F)cc4)nc3)no2)c([N+](=O)[O-])cc1OC(F)F 904507275 VBRKFCMZUWBKFG-UHFFFAOYSA-N 474.351 5.248 5 20 JKBD Cc1ccc(-c2nc(C(=O)O[C@@H](C(=O)Nc3ccc([N+](=O)[O-])cc3Cl)c3ccccc3)cs2)o1 915254514 FSICAIJVVAMUES-HXUWFJFHSA-N 497.916 5.810 5 20 JKBD O=C(O)c1ccc2c(=O)nc(/C(Cl)=C\c3ccc(Oc4ccc(F)cc4)c([N+](=O)[O-])c3)[nH]c2c1 916127305 LPYRNOJASZFLQE-RQZCQDPDSA-N 481.823 5.198 5 20 JKBD CC(=O)N(c1ccccc1)c1nc(COC(=O)c2cc(OCC(F)(F)F)ccc2[N+](=O)[O-])cs1 919196299 SXFRJAOZWYPAAG-UHFFFAOYSA-N 495.435 5.034 5 20 JKBD O=C(C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)N(CC(F)(F)F)C1CC1 920013980 LAXCOMQXTUDJDY-PTNGSMBKSA-N 461.465 5.689 5 20 JKBD CSCC[C@H](NC(=O)c1ccccc1Cl)C(=O)Oc1ccc(-c2ccccc2)cc1[N+](=O)[O-] 920330807 OGDTYANOCCRXGZ-FQEVSTJZSA-N 484.961 5.372 5 20 JKBD C[C@@H](Nc1ccc(C(=O)OCc2csc(-c3ccco3)n2)cc1[N+](=O)[O-])c1ccccn1 920549750 YOXKUFJDECBBDG-CQSZACIVSA-N 450.476 5.236 5 20 JKBD Cc1ccc(NC(=O)c2cccc(C(F)(F)F)c2)cc1NC(=O)/C=C\c1ccc([N+](=O)[O-])cc1 920844519 FALUYORYNDQUTH-WQLSENKSSA-N 469.419 5.826 5 20 JKBD O=C(/C=C/c1ccc([N+](=O)[O-])o1)NC1(c2ccc(NC(=O)C34CC(C(F)(F)F)(C3)C4)cc2)CCC1 1786459569 RILWTENRTNZBNA-SOFGYWHQSA-N 489.450 5.068 5 20 JKBD Cc1ccoc1C(=O)Nc1ccc(C2(NC(=O)c3cccc(Br)c3[N+](=O)[O-])CCC2)cc1 1788692867 APLCWPHTSJRYMZ-UHFFFAOYSA-N 498.333 5.320 5 20 JKBD O=C(NC1(c2ccc(NC(=O)c3cc4sccc4s3)cc2)CCC1)c1ccc([N+](=O)[O-])[nH]1 1789257289 SJYDFTYDHVUDMA-UHFFFAOYSA-N 466.544 5.261 5 20 JKBD C/C(=C\c1ccc(C)o1)C(=O)Nc1ccc(C2(NC(=O)c3cccc(F)c3[N+](=O)[O-])CCC2)cc1 1789585404 BNCTWXULCBCVSO-FOCLMDBBSA-N 477.492 5.487 5 20 JKBD CC1=CC[C@@H](C(=O)NC2(c3ccc(NC(=O)c4cc(N(C)C)ccc4[N+](=O)[O-])cc3)CCC2)CC1 1790055660 HPTDBHDAPVMLEI-LJQANCHMSA-N 476.577 5.155 5 20 JKBD COc1cc(C(=O)Nc2ccc(C3(NC(=O)[C@@]4(F)CCCC=C4F)CCC3)cc2)ccc1[N+](=O)[O-] 1792166398 PFLCYYRHSWOLSK-RUZDIDTESA-N 485.487 5.097 5 20 JKBD Cc1c(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2ccc(C(C)C)cc2)C3)cc(Cl)cc1[N+](=O)[O-] 1800711355 JWIJBIHBUPOTBX-WKCHPHFGSA-N 469.969 5.246 5 20 JKBD O=C(Nc1cc([C@H]2CCCCN2C(=O)/C=C/c2ccccc2[N+](=O)[O-])[nH]n1)c1ccc(C2CC2)cc1 1821307359 PRGMDIDMGOLXFS-DKUDOZJNSA-N 485.544 5.215 5 20 JKBD O=C(Nc1cc([C@H]2CCCCN2C(=O)c2sccc2F)[nH]n1)c1cc2cc([N+](=O)[O-])ccc2s1 1821612362 VVDUXQKXTJFJMF-MRXNPFEDSA-N 499.549 5.353 5 20 JKBD O=C(c1cc2cc([N+](=O)[O-])ccc2s1)N1CCC([C@@H]2CCCCN2C(=O)c2cccs2)CC1 1825778684 BKGVAMNGTDRRQT-IBGZPJMESA-N 483.615 5.418 5 20 JKBD O=C(/C=C/c1ccccc1[N+](=O)[O-])N1CCC([C@@H]2CCCCN2C(=O)c2ccc3ncccc3c2)CC1 1828034588 JCUMANAHAPMXBP-PUHSMXRQSA-N 498.583 5.090 5 20 JKBD CC[C@H]1CC[C@H](C(=O)N2CCC([C@H]3CCCCN3C(=O)c3cc([N+](=O)[O-])c(O)cc3C)CC2)CC1 1830790270 RLKXVYBQUOARIP-KJXAQDMKSA-N 485.625 5.059 5 20 JKBD Cc1nn(Cc2ccc(C(=O)NC[C@H](c3ccccc3)c3c[nH]c4ccccc34)cc2)c(C)c1[N+](=O)[O-] 10695612 YKQVNQIJJDYJKZ-RUZDIDTESA-N 493.567 5.500 5 20 JKBD COc1ccc(C(=O)OCc2csc(N(C(C)=O)c3cccc(C(F)(F)F)c3)n2)cc1[N+](=O)[O-] 11341800 DRZJAXXRDIHZFX-UHFFFAOYSA-N 495.435 5.120 5 20 JKBD CC(C)c1ccc([C@@H](NC(=O)c2ccc(Sc3nncn3C)c([N+](=O)[O-])c2)c2cccs2)cc1 15616515 KMQAFELQXGKRRQ-JOCHJYFZSA-N 493.614 5.579 5 20 JKBD Cc1ccc([N+](=O)[O-])cc1NC(=O)CSC1=N/C(=C\c2ccccc2)C(=O)N1c1ccc(F)cc1 23646960 RIVLVUSGTLTDTH-XKZIYDEJSA-N 490.516 5.158 5 20 JKBD O=[N+]([O-])c1cc(S(=O)(=O)Nc2ccccc2)ccc1NCc1cccc(COCc2ccco2)c1 29622721 STUUWDFEPAIWMQ-UHFFFAOYSA-N 493.541 5.318 5 20 JKBD CSc1ccc(C(=O)c2ccccc2C(=O)Nc2ccc(-n3ccnc3)c(F)c2)cc1[N+](=O)[O-] 117688675 YLGMHIUINVPUJF-UHFFFAOYSA-N 476.489 5.125 5 20 JKBD Cc1nc2ccccc2c2c(NC(=O)Cc3csc(NC(=O)c4ccco4)n3)c3ccccc3n12 486796405 MQWQKTYKVGTMCB-UHFFFAOYSA-N 481.537 5.432 5 20 JKBD CNC(=O)c1cc(NC(=O)c2ccc(NCc3ccccc3Cl)c([N+](=O)[O-])c2)ccc1Cl 489192595 BMQHHNHSRREVJN-UHFFFAOYSA-N 473.316 5.126 5 20 JKBD C[C@H]1CCCN(c2ccc(C(=O)Nc3ccccc3OC[C@H]3CCCCO3)cc2[N+](=O)[O-])C1 510010636 AUYITQJSZIYARH-AZUAARDMSA-N 453.539 5.031 5 20 JKBD C[C@@H](SCc1nc(O)c2c(-c3ccccc3)csc2n1)C(=O)Nc1ccc([N+](=O)[O-])cc1 514944629 YDFPTTIEORNQCL-CYBMUJFWSA-N 466.544 5.233 5 20 JKBD O=C(Cn1c2ccccc2c(=O)c2ccccc21)NC1CCN(Cc2ccc(Cl)c(Cl)c2)CC1 517515604 SHSBVHOQPHALEQ-UHFFFAOYSA-N 494.422 5.242 5 20 JKBD C[C@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)Nc1cccc(COCC(F)(F)C(F)F)c1 520390613 DJRKFYYQJVEBOA-NSHDSACASA-N 464.799 5.071 5 20 JKBD CCOC(=O)c1sc(-c2ccc(F)cc2)cc1NC(=O)c1cc(OC)c(OCC)cc1[N+](=O)[O-] 604562078 NOBVEYQUHXTTEB-UHFFFAOYSA-N 488.493 5.299 5 20 JKBD O=[N+]([O-])c1cc(Br)ccc1Sc1nnc(-c2cccc(Br)c2)o1 608855778 RKRUDHXXUSEHJR-UHFFFAOYSA-N 457.103 5.321 5 20 JKBD COc1ccc(NC(=O)c2ccc(N[C@H](C)c3ccccn3)c([N+](=O)[O-])c2)c(Br)c1 608899978 HJZROHNWRQHCBO-CYBMUJFWSA-N 471.311 5.186 5 20 JKBD Cc1ccc(NC(=O)c2cnn(-c3ncc(C(F)(F)F)cc3Cl)c2C(F)F)cc1[N+](=O)[O-] 609371849 OXKBDVYZFOZHGZ-UHFFFAOYSA-N 475.761 5.346 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Cl)[C@@H](Nc1ccc(N2CCOCC2)c(F)c1)c1ccccc1 728062254 LJIYUGYNGRLAIG-QHCPKHFHSA-N 484.915 5.016 5 20 JKBD C[C@@H](NC(=O)CC1(CC(=O)N[C@H](C)c2cccc([N+](=O)[O-])c2)CCCCC1)c1cccc([N+](=O)[O-])c1 729823991 CMXNKNHFMRTLDG-RTBURBONSA-N 496.564 5.288 5 20 JKBD C[C@@H](Sc1nc2cc(C(F)(F)F)ccc2s1)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 753855448 VFDOPTHBOGDJCM-SECBINFHSA-N 452.439 6.127 5 20 JKBD Cc1ccc(C23C[C@H]4C[C@@H](CC(C(=O)OCc5nnc(-c6ccc([N+](=O)[O-])cc6)o5)(C4)C2)C3)cc1 791145327 IEBFUJMRVMHSLD-HFCJMSRESA-N 473.529 5.535 5 20 JKBD COc1ccccc1-c1noc(Cc2cn(-c3ccccc3)nc2-c2ccc([N+](=O)[O-])cc2)n1 904270808 NOBRGKWTVVTBBU-UHFFFAOYSA-N 453.458 5.097 5 20 JKBD COc1c([N+](=O)[O-])cc(NCc2cccc(COCc3ccco3)c2)c([N+](=O)[O-])c1Br 915212663 KRLIAGRPBOTAFX-UHFFFAOYSA-N 492.282 5.196 5 20 JKBD COc1c([N+](=O)[O-])cc(NCc2ccc(Oc3cccnc3)c(F)c2)c([N+](=O)[O-])c1Br 920337615 SKVSWTPFWGPBFX-UHFFFAOYSA-N 493.245 5.213 5 20 JKBD C[C@@H](Cc1ccc(F)cc1)C(=O)Oc1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2Cl)cc1 920999510 UTRQADUIAXHXHU-AWEZNQCLSA-N 456.857 5.424 5 20 JKBD O=C(/C=C/c1ccoc1)NC1(c2ccc(NC(=O)Cc3ccc(Cl)cc3[N+](=O)[O-])cc2)CCC1 1786115116 VXMZXVLCQQXVFB-XNWCZRBMSA-N 479.920 5.231 5 20 JKBD O=C(NC1(c2ccc(NC(=O)[C@@H]3CCCCC3(F)F)cc2)CCC1)c1cc([N+](=O)[O-])cc2c1OCC2 1786466089 OWLUBJVKSMLWPF-NRFANRHFSA-N 499.514 5.103 5 20 JKBD Cc1c(Br)cc(C(=O)NC2(c3ccc(NC(=O)C(C)(F)F)cc3)CCC2)cc1[N+](=O)[O-] 1787933891 LKJUUGHDPZQNJZ-UHFFFAOYSA-N 496.308 5.069 5 20 JKBD CCCc1onc(C)c1C(=O)Nc1ccc(C2(NC(=O)c3cc(F)cc([N+](=O)[O-])c3)CCC2)cc1 1788778980 PBAXQGOXLJDHCE-UHFFFAOYSA-N 480.496 5.044 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)c3ccc([N+](=O)[O-])cc3F)CCC2)cc1)c1ccc2cc[nH]c2c1 1788913420 AVAPDQLBVUELPR-UHFFFAOYSA-N 472.476 5.277 5 20 JKBD Cc1ccc(SCC(=O)Nc2ccc(C3(NC(=O)/C=C/c4ccc([N+](=O)[O-])o4)CCC3)cc2)cc1 1789107213 PDJIZXWSYDPKDP-UKTHLTGXSA-N 491.569 5.436 5 20 JKBD C[C@@H](Sc1cccs1)C(=O)NC1(c2ccc(NC(=O)c3ccc(O)c([N+](=O)[O-])c3)cc2)CCC1 1790620013 RARLBQNOHVXRBJ-OAHLLOKOSA-N 497.598 5.290 5 20 JKBD CCOc1cccc(C(=O)NC2(c3ccc(NC(=O)c4cc(F)cc([N+](=O)[O-])c4)cc3)CCC2)c1 1790697658 KHHWNSOSCBXTMJ-UHFFFAOYSA-N 477.492 5.194 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)Nc1ccc(C2(NC(=O)c3cc(C(C)C)no3)CCC2)cc1 1790772213 IVXUOARMWPUSPA-UHFFFAOYSA-N 480.496 5.215 5 20 JKBD CC(C)c1ccc(CC(=O)Nc2ccc(C3(NC(=O)c4ccc([N+](=O)[O-])[nH]4)CCC3)cc2)cc1 1791394523 FXNGXVXZGZKKLZ-UHFFFAOYSA-N 460.534 5.037 5 20 JKBD Cc1c(C(=O)NC2(c3ccc(NC(=O)c4cc(F)c[nH]4)cc3)CCC2)cc(Cl)cc1[N+](=O)[O-] 1791473773 BDXMTRQSMZHBMT-UHFFFAOYSA-N 470.888 5.085 5 20 JKBD COc1ccc(C(=O)NC2(c3ccc(NC(=O)/C=C/c4ccccc4[N+](=O)[O-])cc3)CCC2)cc1 1792317423 OKOZRYQFWBODJT-CXUHLZMHSA-N 471.513 5.065 5 20 JKBD Cc1cccc2cc(C(=O)N3CCCC[C@@H]3C3CCN(C(=O)c4ccc([N+](=O)[O-])cc4F)CC3)[nH]c12 1828549410 JSFQGQWEEHRBHG-XMMPIXPASA-N 492.551 5.071 5 20 JKBD C[C@@H](OC(=O)c1ccc(NC2CC2)c([N+](=O)[O-])c1)C(=O)Nc1c(Cl)cc(Cl)cc1Cl 9868542 XUVXPGLUYODCHB-SECBINFHSA-N 472.712 5.313 5 20 JKBD C[C@@H](Sc1nnc(N2CCCC2)n1-c1cccc(Cl)c1)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 17897669 VHJMWZSKVDSUNE-CQSZACIVSA-N 497.968 5.332 5 20 JKBD Cc1ccc(NC(=O)[C@H](OC(=O)c2cc(Cl)ccc2[N+](=O)[O-])c2ccccc2)c([N+](=O)[O-])c1 23515086 PBXNMVZXFNQCES-HXUWFJFHSA-N 469.837 5.002 5 20 JKBD O=C(Cc1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1)N[C@@H](c1ccccc1)c1ccncc1 302684179 DFWZQAQJNNNGIR-NDEPHWFRSA-N 489.535 5.291 5 20 JKBD C[C@@H](Nc1ccc(C(=O)Nc2ccc(CCN3CCCCC3)cc2)cc1[N+](=O)[O-])c1ccccn1 410091541 SMKCZBSXJVHJJW-HXUWFJFHSA-N 473.577 5.444 5 20 JKBD COC(=O)C1(NC(=O)C/C(=C\c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)CCCCC1 489901533 RQBAKOWYXLBTJZ-OBGWFSINSA-N 479.558 5.127 5 20 JKBD CCOc1cc(C(=O)Nc2nc(-c3ccc(OC(C)C)cc3)cs2)c([N+](=O)[O-])cc1OC 490130394 LAPCCSLJBFJVLK-UHFFFAOYSA-N 457.508 5.165 5 20 JKBD CN(CCCCCc1cc(-c2cccc(F)c2)no1)C(=O)c1cc2cccc([N+](=O)[O-])c2[nH]1 499703350 UYYPLZNQTMOPBP-UHFFFAOYSA-N 450.470 5.355 5 20 JKBD CCNC(=O)c1ccc(NC(=O)c2ccccc2Sc2ccc(C(F)(F)F)cc2[N+](=O)[O-])cc1 501131851 QXNNHZWZECBVJS-UHFFFAOYSA-N 489.475 5.767 5 20 JKBD CCOc1ccc(C(=O)N(C)[C@H]2CCSc3ccc(Br)cc32)cc1[N+](=O)[O-] 504641352 DUDPEXHHGFROIW-HNNXBMFYSA-N 451.342 5.065 5 20 JKBD O=C(Nc1ccc(Oc2ccc(Cl)cc2)nc1)c1ccc([N+](=O)[O-])cc1I 508591251 YANUYASULBJUNM-UHFFFAOYSA-N 495.660 5.292 5 20 JKBD COCCNC(=O)c1ccc(NC(=O)c2ccc(Sc3ccc(C)cc3)c([N+](=O)[O-])c2)cc1Cl 515682556 AJPXKPVNYWCOHJ-UHFFFAOYSA-N 499.976 5.336 5 20 JKBD C[C@@H](Nc1cccc(COCc2ccco2)c1)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 515717831 XHCSGBYFPQMEJD-CQSZACIVSA-N 463.412 5.363 5 20 JKBD CN(Cc1ccccc1CNC(=O)Cn1c2ccccc2c(=O)c2ccccc21)C1CCCCC1 515980738 ZXYJOAVXVBHOFD-UHFFFAOYSA-N 467.613 5.236 5 20 JKBD O=C(CCCn1c(=O)oc2cc([N+](=O)[O-])ccc21)N[C@@H](Cc1ccccc1Cl)c1ccccc1 519494682 SLVBRQUOMJOUID-NRFANRHFSA-N 479.920 5.037 5 20 JKBD Cc1cc(C)n(-c2cccc(NC(=O)CSc3ccc(C(F)(F)F)cc3[N+](=O)[O-])c2)n1 603613800 VYHQTZMVUYIIQE-UHFFFAOYSA-N 450.442 5.147 5 20 JKBD O=C(CCOc1ccccc1[N+](=O)[O-])N[C@H](c1ccccc1)c1ccc2nc(C(F)(F)F)[nH]c2c1 603951115 BFOSTDNYBMLHBX-JOCHJYFZSA-N 484.434 5.165 5 20 JKBD Cn1ccnc1COc1ccc(NC(=O)c2ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])cc2)cc1 603965475 KIJMUGDHNFRCQL-UHFFFAOYSA-N 478.892 5.605 5 20 JKBD O=C(Nc1ccc2nc(-c3cccc(F)c3)[nH]c2c1)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-] 603982900 FPGPQZDMGAQMMA-UHFFFAOYSA-N 474.370 5.471 5 20 JKBD C[C@H](N[C@H](C)c1cccc([N+](=O)[O-])c1)C(=O)N1N=C(c2ccc(Cl)cc2)C[C@H]1c1ccco1 604044537 UTAUWMKZCBEDMQ-VVBPWWLESA-N 466.925 5.258 5 20 JKBD C[C@H](Nc1ccc(C(=O)Nc2nnc(-c3cccc(Cl)c3)s2)cc1[N+](=O)[O-])c1ccccn1 609021156 DNHVMTHYWJZORU-ZDUSSCGKSA-N 480.937 5.587 5 20 JKBD CCC(CC)c1cc[n+](/C(C(=S)Nc2cnn(CC)c2)=C(/O)c2cccc([N+](=O)[O-])c2)cc1 726179769 OGNUAXWJCNPRFI-UHFFFAOYSA-O 466.587 5.326 5 20 JKBD O=[N+]([O-])c1ccc(-c2ccc(CNCc3ccc(-n4ccnc4)cc3)o2)c(Br)c1 726606183 CFJSFGIEFGLSBB-UHFFFAOYSA-N 453.296 5.093 5 20 JKBD O=C1CCCCN1c1ccc(CNCc2ccc(-c3ccc([N+](=O)[O-])cc3Br)o2)cc1 726606353 HGUIKFONUROBMD-UHFFFAOYSA-N 484.350 5.424 5 20 JKBD O=C(Nc1ccccc1C(=O)NCCc1ccc2ccccc2n1)c1ccc([N+](=O)[O-])cc1Cl 744086404 ZUZOULFFOKJJNE-UHFFFAOYSA-N 474.904 5.021 5 20 JKBD O=C(Nc1nc(-c2cccc(C(F)(F)F)c2)cs1)c1cc([N+](=O)[O-])ccc1Br 751077907 RCQRLGOOXDMPCW-UHFFFAOYSA-N 472.242 5.752 5 20 JKBD C[C@@H](OC(=O)C12CC3C[C@](C)(C1)C[C@@](C)(C3)C2)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 763158920 ORQUGDCZVYNSGO-QHGKGWCTSA-N 468.472 5.480 5 20 JKBD O=C(COc1ccccc1C(=O)N1CCc2ccc([N+](=O)[O-])cc21)Nc1ccc(SC(F)F)cc1 834550093 MEHDBOKSVUOQAS-UHFFFAOYSA-N 499.495 5.130 5 20 JKBD O=C(c1ccc([N+](=O)[O-])s1)N1CCC[C@H]1c1nc(-c2ccc(OCc3ccccc3)cc2)no1 904426466 YEYTVFRNTSGLJA-IBGZPJMESA-N 476.514 5.263 5 20 JKBD C[C@H](OC(=O)/C=C\c1ccc2ccc(Cl)cc2n1)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl 912870387 UUFDEMWFQZBDFJ-PWWFUAJNSA-N 460.273 5.033 5 20 JKBD CC(C)c1noc([C@@H](C)OC(=O)C/C(=C/c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)n1 914897248 GHMPINJDCAQQFL-UHVIJJLKSA-N 478.530 5.946 5 20 JKBD O=C(Cn1ncc2ccc([N+](=O)[O-])cc21)N(Cc1ccccc1)c1nc(-c2ccc(F)cc2)cs1 918549810 LUNZYYLWXCBHEG-UHFFFAOYSA-N 487.516 5.441 5 20 JKBD COc1ccc(C(=O)NC2(c3ccc(NC(=O)/C=C/c4ccc([N+](=O)[O-])o4)cc3)CCC2)cc1Cl 1786208202 NEXRSBBVBCYSFS-DHZHZOJOSA-N 495.919 5.311 5 20 JKBD CC(C)=CCCC(=O)NC1(c2ccc(NC(=O)Cn3ccc4ccc([N+](=O)[O-])cc43)cc2)CCC1 1786277933 ZNBOKJHTIQUVMF-UHFFFAOYSA-N 474.561 5.430 5 20 JKBD O=C(NC1(c2ccc(NC(=O)[C@@H]3C[C@H]3c3ccc(Cl)cc3)cc2)CCC1)c1ccc([N+](=O)[O-])o1 1789151394 LCOHHJBNJYEPJF-VQTJNVASSA-N 479.920 5.393 5 20 JKBD COc1c(C(=O)Nc2ccc(C3(NC(=O)c4ccc([N+](=O)[O-])cc4F)CCC3)cc2)ccc(F)c1F 1790728542 RWUGKMREWUIUJX-UHFFFAOYSA-N 499.445 5.082 5 20 JKBD O=C(NC1(c2ccc(NC(=O)[C@H]3CCc4cccc(Cl)c43)cc2)CCC1)c1ccc([N+](=O)[O-])[nH]1 1791141475 MBRUHPZANGIFFS-SFHVURJKSA-N 478.936 5.054 5 20 JKBD O=C(/C=C/c1ccccc1[N+](=O)[O-])Nc1ccc(C2(NC(=O)c3cccc4ccncc34)CCC2)cc1 1792317452 RKTLLYOTYWWSMY-NTEUORMPSA-N 492.535 5.604 5 20 JKBD O=C(NC1(c2ccc(NC(=O)[C@]3(F)CCCC=C3F)cc2)CCC1)c1cc(F)cc([N+](=O)[O-])c1 1792378763 AFMXAERAMFTZSJ-DEOSSOPVSA-N 473.451 5.227 5 20 JKBD O=C(NC[C@H]1CCN(C(=O)CC2CCCC2)[C@@H]1c1cccnc1)c1cc2cc([N+](=O)[O-])ccc2s1 1812304458 IXYAXMXPJNMOQS-KBMIEXCESA-N 492.601 5.104 5 20 JKBD CC(C)c1ccc(C(=O)N2CCCC[C@H]2c2cc(NC(=O)c3cccc(F)c3[N+](=O)[O-])n[nH]2)cc1 1821173235 WIRMPHMRCIFOBQ-NRFANRHFSA-N 479.512 5.200 5 20 JKBD CC(F)(F)C(C)(C)C(=O)N1CCC([C@H]2CCCCN2C(=O)Cc2ccc(Cl)cc2[N+](=O)[O-])CC1 1824161960 SPJATBIBGUFJCH-LJQANCHMSA-N 499.986 5.092 5 20 JKBD CC(C)(C)CCCCCC(=O)N1CC2(CCCN2C(=O)c2cc(Br)ccc2[N+](=O)[O-])C1 1845364839 RZISWVYZRQTMNU-UHFFFAOYSA-N 494.430 5.171 5 20 JKBD CCc1cccc(C)c1NC(=O)COC(=O)c1ccccc1C(=O)c1ccc(Cl)c([N+](=O)[O-])c1 11029202 QKULMKVTSADSHE-UHFFFAOYSA-N 480.904 5.146 5 20 JKBD O=C(COC(=O)c1sc2cc(Cl)ccc2c1Cl)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 11397351 FPRZODJUZYTJDN-UHFFFAOYSA-N 493.246 5.931 5 20 JKBD COc1cc(COC(=O)c2ccc(C3SCCS3)cc2)c([N+](=O)[O-])cc1OC(F)F 12466566 UCYUMCNUDQFLFV-UHFFFAOYSA-N 457.476 5.040 5 20 JKBD COc1cc(C(=O)Nc2ccc(Sc3ccc(Br)cc3)cc2)c([N+](=O)[O-])cc1OC 14792980 AGUYRQHOVXBEFD-UHFFFAOYSA-N 489.347 5.778 5 20 JKBD Cc1ccc(-c2nnc(-c3ccc(C(=O)OCC(=O)Nc4ccc(Cl)cc4[N+](=O)[O-])cc3)o2)cc1 16287771 GKXNMFYKYMAZIC-UHFFFAOYSA-N 492.875 5.069 5 20 JKBD CCOc1ccccc1Nc1nnc(S[C@@H](C)C(=O)Nc2cc([N+](=O)[O-])ccc2Cl)s1 20882344 WJIGJXDMAZXUEJ-NSHDSACASA-N 479.971 5.361 5 20 JKBD Cc1nn(Cc2ccc(C(=O)Nc3cc(Cl)c(Cl)cc3Cl)cc2)c(C)c1[N+](=O)[O-] 26399613 FDMGMVAXUYKMKB-UHFFFAOYSA-N 453.713 5.669 5 20 JKBD Cc1nc2ccccc2n1CCNC(=O)C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1 30001991 MLBOYMUCDQCHLN-SILNSSARSA-N 497.580 5.610 5 20 JKBD CCOc1ccc(NC(=O)CSc2nnc(-c3cccs3)n2Cc2ccccc2)c([N+](=O)[O-])c1 36859534 VCDLSTJIOAIROL-UHFFFAOYSA-N 495.586 5.093 5 20 JKBD COc1ccc(NC(=O)Cc2sc(-c3ccccc3)nc2-c2cccs2)c([N+](=O)[O-])c1 57561505 CJBGEIVFMNNXLX-UHFFFAOYSA-N 451.529 5.637 5 20 JKBD O=C(Nc1sc2c(c1-c1nc3ccccc3[nH]1)CCCC2)c1cc([N+](=O)[O-])ccc1Cl 104690665 ITFHPXFYJAZJDG-UHFFFAOYSA-N 452.923 5.984 5 20 JKBD COc1ccc([N+](=O)[O-])cc1NC(=O)[C@H](C)Sc1ncc(-c2ccccc2)n1CC(F)(F)F 109621948 XBDGZFKZQKTRSO-ZDUSSCGKSA-N 480.468 5.149 5 20 JKBD Cc1cc(COc2ccc(C(=O)Nc3cc([N+](=O)[O-])c(C)cc3C)cc2Br)on1 520778266 MNGDEUQFDYNZMK-UHFFFAOYSA-N 460.284 5.102 5 20 JKBD Cc1occc1C(=O)Nc1cc(N[C@@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2C(F)(F)F)ccc1F 604044406 LXONUXUVWVVUSF-NSHDSACASA-N 494.401 5.346 5 20 JKBD Cc1sc(NC(=O)c2ccc(I)cc2Cl)nc1-c1cccc([N+](=O)[O-])c1 609057953 AVZHQRDJNDZDKZ-UHFFFAOYSA-N 499.717 5.537 5 20 JKBD Cn1nc(C(F)(F)F)c(-c2ccc(Cl)cc2)c1NC(=O)c1cc([N+](=O)[O-])ccc1Cl 727745831 RWZIVPRCAZZGOL-UHFFFAOYSA-N 459.211 5.573 5 20 JKBD C[C@H](Nc1ccc(C(=O)Nc2ccccc2NC(=O)OC(C)(C)C)cc1[N+](=O)[O-])c1ccccn1 727803704 QNPCJSUMWVXDCH-INIZCTEOSA-N 477.521 5.762 5 20 JKBD O=[N+]([O-])c1ccc2nc(Sc3nnc(CN4CCCC4)n3-c3ccc(Cl)cc3)sc2c1 731209039 QBDQMQPFQIUGPQ-UHFFFAOYSA-N 472.983 5.186 5 20 JKBD O=[N+]([O-])c1ccc2nc(/C(Cl)=C\c3cc(Br)c(O)c(Br)c3)[nH]c2c1 747117560 VFVOZYYHVXBYQZ-VZUCSPMQSA-N 473.508 5.439 5 20 JKBD Cc1cc2oc(=O)cc(COC(=O)c3csc(-c4cccc([N+](=O)[O-])c4)n3)c2cc1C(C)C 747962330 MQXCTSGZNAGBGY-UHFFFAOYSA-N 464.499 5.614 5 20 JKBD O=C(OCc1nc2ccccc2c2ccccc12)C1CCN(C(=O)CCc2ccccc2)CC1 915023635 JSKWWDAOAMOECS-UHFFFAOYSA-N 452.554 5.303 5 20 JKBD O=C(COC(=O)C1(c2cccc(Cl)c2)CCCC1)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 915516433 QCINNILGCZFXLQ-UHFFFAOYSA-N 470.831 5.261 5 20 JKBD C[C@@H](OC(=O)c1cc2ccccc2n1Cc1ccccc1F)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 919377868 UXCWNNANJULXHW-MRXNPFEDSA-N 486.459 5.705 5 20 JKBD C[C@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)OCC(=O)N1c2ccccc2Sc2ccccc21 920780002 WVHDYGQRBINPDI-AWEZNQCLSA-N 484.917 5.388 5 20 JKBD Cc1cc(C(=O)NC2(c3ccc(NC(=O)Cn4ccc5ccc([N+](=O)[O-])cc54)cc3)CCC2)c(C)o1 1786275499 JWQJIZJSSPARFL-UHFFFAOYSA-N 486.528 5.207 5 20 JKBD Cc1ccc(C(=O)Nc2ccc(C3(NC(=O)Cc4ccc(Cl)cc4[N+](=O)[O-])CCC3)cc2)o1 1786487783 AFEJJGQIOXJHKV-UHFFFAOYSA-N 467.909 5.140 5 20 JKBD Cc1cc(C(=O)NC2(c3ccc(NC(=O)c4c(F)ccc([N+](=O)[O-])c4C)cc3)CCC2)c(C)o1 1790770395 BROUOSLXQOURCR-UHFFFAOYSA-N 465.481 5.314 5 20 JKBD COc1cccc(Cl)c1C(=O)Nc1ccc(C2(NC(=O)c3cc(C)c([N+](=O)[O-])cn3)CCC2)cc1 1792146761 ORMYUJDJGMJFLD-UHFFFAOYSA-N 494.935 5.022 5 20 JKBD O=C(Nc1cc([C@H]2CCCCN2C(=O)CSc2ccccc2[N+](=O)[O-])[nH]n1)c1ccccc1Cl 1820427641 IYAYMQRHMFQEHD-GOSISDBHSA-N 499.980 5.070 5 20 JKBD O=C(c1cc(O)cc([N+](=O)[O-])c1)N1CCC([C@H]2CCCCN2C(=O)c2cccc3ccccc23)CC1 1828009750 LOADAYWOZGFKBB-AREMUKBSSA-N 487.556 5.001 5 20 JKBD Cc1cccc2cc(C(=O)N3CCCC[C@H]3C3CCN(C(=O)c4cccc(F)c4[N+](=O)[O-])CC3)[nH]c12 1828549988 ZZDKFQTWRNSBAN-QHCPKHFHSA-N 492.551 5.071 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cccc(Cl)c2)CC1 1830734137 ZCFBIFYSQYNYEJ-JOCHJYFZSA-N 487.959 5.243 5 20 JKBD CCCCC[C@@H](C)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cc(N(C)C)ccc2[N+](=O)[O-])CC1 1831467150 VFINIJFWKIBEPD-HYBUGGRVSA-N 486.657 5.111 5 20 JKBD CC(C)[C@H]1CC[C@H](C(=O)N2CCCC[C@@H]2C2CCN(C(=O)/C=C/c3ccc([N+](=O)[O-])o3)CC2)CC1 1831562294 MKEHRDHWZJSOSW-KJNAIEMCSA-N 485.625 5.283 5 20 JKBD CC(C)CCSc1ccc(C(=O)NC2CCN(C(=O)Nc3ccccc3)CC2)cc1[N+](=O)[O-] 12799700 MOYSQXKEXDWCCI-UHFFFAOYSA-N 470.595 5.159 5 20 JKBD O=C(Nc1cccc(C(F)(F)F)c1)c1cccc(NC(=O)c2ccc([N+](=O)[O-])cc2Cl)c1 14907678 LKLQOWHDAYCLRA-UHFFFAOYSA-N 463.799 5.772 5 20 JKBD Cc1ccc([N+](=O)[O-])cc1NC(=O)CSc1ncnc2scc(-c3ccc(F)cc3)c12 20992014 LDCJRVRWMZLGMK-UHFFFAOYSA-N 454.508 5.445 5 20 JKBD COc1ccc(-c2cc(C(=O)OCC(=O)Nc3ccc([N+](=O)[O-])cc3Cl)sc2C)cc1 23583030 JLNLUTDZTGPJLG-UHFFFAOYSA-N 460.895 5.089 5 20 JKBD CCc1ccccc1N(C(C)=O)c1nc(COC(=O)c2cc(Cl)ccc2[N+](=O)[O-])cs1 25018166 KWMNVEBNOIFXGW-UHFFFAOYSA-N 459.911 5.309 5 20 JKBD COc1ccc(C)cc1CC(=O)O[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1 26682631 ACNZSOFAGVLOAY-HSZRJFAPSA-N 468.893 5.031 5 20 JKBD O=C(Nc1ccnn1Cc1ccc(Br)cc1)c1cc2cc([N+](=O)[O-])ccc2s1 26790119 QJNIHRAGRWOAPS-UHFFFAOYSA-N 457.309 5.069 5 20 JKBD CCOCc1ccccc1CN[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Br)c1ccccc1 26996505 RCEJVXAFNXHOJQ-QHCPKHFHSA-N 498.377 5.363 5 20 JKBD CCN(Cc1cccc(NC(=O)c2ccc(NCc3ccccc3Cl)c([N+](=O)[O-])c2)c1)C(C)=O 27040225 YHCCTBSPZABZOY-UHFFFAOYSA-N 480.952 5.481 5 20 JKBD Cc1ccc(NC(=O)[C@H](Sc2nnc(C)n2Cc2ccccc2)c2ccccc2)c([N+](=O)[O-])c1 28609131 PEOLJNDDSJKIGY-HSZRJFAPSA-N 473.558 5.324 5 20 JKBD O=C(c1cc2cc(Br)ccc2o1)N(Cc1ccccc1[N+](=O)[O-])CC(F)(F)F 195611955 JMGPZZSZDGSVEE-UHFFFAOYSA-N 457.202 5.308 5 20 JKBD O=C(C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)NCc1ccnc(N2CCCC2)c1 483949669 ZOUHBOTXVYZKDX-QNGOZBTKSA-N 499.596 5.447 5 20 JKBD CN(Cc1ccccn1)C(=O)c1c2c(nc3ccccc13)/C(=C/c1ccc([N+](=O)[O-])cc1)CCC2 488612156 UGYKQTYIBAVMHJ-LVZFUZTISA-N 464.525 5.687 5 20 JKBD CC[C@H](C)Sc1ccc(NC(=O)c2ccc(N[C@@H](C)c3ccccn3)c([N+](=O)[O-])c2)c(C)c1 498446360 SQUMFIDFEUNVPJ-ROUUACIJSA-N 464.591 6.614 5 20 JKBD Cc1csc(Sc2ccc(C(=O)Nc3ccccc3CN3C[C@H](C)O[C@H](C)C3)cc2[N+](=O)[O-])n1 501480443 OIRVUOLIVMCPST-CALCHBBNSA-N 498.630 5.372 5 20 JKBD C[C@H](Nc1ccc(C(=O)N(C)[C@H](C)c2cccc(C(F)(F)F)c2)cc1[N+](=O)[O-])c1ccccn1 506180096 TWXRVDOIVSJPHZ-JKSUJKDBSA-N 472.467 6.015 5 20 JKBD COc1cc(CNCc2csc(-c3ccccc3)n2)c([N+](=O)[O-])cc1OCc1ccccc1 507944779 HSWJQYIBZYYTGF-UHFFFAOYSA-N 461.543 5.596 5 20 JKBD Cc1ccccc1-n1nc(C)c(CN(C)C(=O)c2ccc(N[C@@H](C)c3ccccn3)c([N+](=O)[O-])c2)c1C 508258536 UILBAJHIHXVRQK-FQEVSTJZSA-N 498.587 5.546 5 20 JKBD COc1ccc(NC(=O)c2ccc(N[C@H](C)c3ccccn3)c([N+](=O)[O-])c2)c(C(F)(F)F)c1 509183786 MCCNYLFRHNAWEZ-CYBMUJFWSA-N 460.412 5.443 5 20 JKBD C[C@H](NC[C@@H](c1ccccc1)c1c[nH]c2ccccc12)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 510297339 KCZBSECZZXDHJF-JTSKRJEESA-N 453.502 5.609 5 20 JKBD COc1cc(CN(C(=O)Nc2cc([N+](=O)[O-])ccc2OC(F)F)C2CC2)ccc1OC(F)F 510839216 UAFOOEREOHOWEO-UHFFFAOYSA-N 473.379 5.003 5 20 JKBD O=C(Nc1ccc(NC(=O)c2ccccc2F)cc1C(F)(F)F)c1csc([N+](=O)[O-])c1 514451978 KUXBVROKEWMHNX-UHFFFAOYSA-N 453.373 5.319 5 20 JKBD O=[N+]([O-])c1ccc(-c2ccc(CNCc3cccc(Cn4ccnc4)c3)o2)c(Br)c1 517538951 UMTKLRVXJWRLDV-UHFFFAOYSA-N 467.323 5.152 5 20 JKBD Cc1ccc(NC(=O)c2ccc(N[C@H](C)c3ccccn3)c([N+](=O)[O-])c2)cc1NC(=O)c1ccncc1 519173405 HFXNGVVWCJJOAK-GOSISDBHSA-N 496.527 5.371 5 20 JKBD O=C(Nc1ccc(-c2nc3ccccc3s2)cn1)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-] 521285336 OXFOTDZSFWFJBO-UHFFFAOYSA-N 474.420 5.460 5 20 JKBD O=C(Nc1cc2c(cc1[N+](=O)[O-])OCCCO2)c1cc(-c2ccc(F)cc2)nc2onc(C3CC3)c12 524100302 KJEVCEUSYKNKHV-UHFFFAOYSA-N 490.447 5.228 5 20 JKBD Cc1ccc(-c2csc(NC(=O)c3cnc4c(cnn4Cc4ccccc4)c3)n2)cc1[N+](=O)[O-] 591603600 ZFWFHNXNEHHRLA-UHFFFAOYSA-N 470.514 5.072 5 20 JKBD C[C@@H](c1ccccc1)n1c(SCc2cc([N+](=O)[O-])cc3c2OCOC3)nnc1-c1ccccc1 603917273 MHGWZWMQYRBUPQ-KRWDZBQOSA-N 474.542 5.621 5 20 JKBD Cc1cc(Oc2ncccn2)ccc1NC(=O)c1ccc(N2C[C@H](C)C[C@@H](C)C2)c([N+](=O)[O-])c1 604452389 UWQLLBKWLDEWKI-IAGOWNOFSA-N 461.522 5.220 5 20 JKBD O=C(CCCn1c(=O)oc2cc([N+](=O)[O-])ccc21)N(c1ccccc1)c1nc2ccccc2s1 604516091 FDDJDEGEJCDDMN-UHFFFAOYSA-N 474.498 5.258 5 20 JKBD Cc1cc(Br)cc2c1N(C(=O)c1csc(-c3cccc([N+](=O)[O-])c3)n1)CCC2 609102845 ZAADRZMFCFJQBA-UHFFFAOYSA-N 458.337 5.382 5 20 JKBD COc1ccccc1[C@@H](NCc1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1)c1nccn1C 726607252 LNYZFQUOZDFQLO-HHHXNRCGSA-N 494.555 5.069 5 20 JKBD COc1cc(C(=O)N2CCC(c3cc4ccccc4[nH]3)CC2)c([N+](=O)[O-])cc1OCc1cscn1 744036814 DVOJAZAUYILCAQ-UHFFFAOYSA-N 492.557 5.140 5 20 JKBD O=C(OCc1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[C@@H](Oc1ccc(Cl)cc1)c1ccccc1 744585881 GKRLVISVQZACSB-NRFANRHFSA-N 465.849 5.162 5 20 JKBD O=C(Oc1ccccc1Oc1ccccn1)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 748688443 WFQPESWONKOJQA-UHFFFAOYSA-N 487.434 5.623 5 20 JKBD C[C@H](OC(=O)c1cccnc1Nc1ccccc1F)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 769466540 LKFHRWSVSJXLDV-LBPRGKRZSA-N 492.385 5.075 5 20 JKBD Cc1nc2c(cnn2C(C)C)cc1C(=O)Oc1ccc2c(-c3ccc([N+](=O)[O-])cc3)cc(=O)oc2c1 790065077 HTTZYHASTOBUTQ-UHFFFAOYSA-N 484.468 5.221 5 20 JKBD O=C(CCc1ncc(-c2ccccc2)o1)Oc1ccc2c(-c3ccc([N+](=O)[O-])cc3)cc(=O)oc2c1 821892333 AHJCEOUSWZJWIW-UHFFFAOYSA-N 482.448 5.561 5 20 JKBD C[C@@H](OC(=O)CSc1ccccc1[N+](=O)[O-])C(=O)Nc1ccccc1Oc1ccccc1 856204493 ZQHLFTBOTSJRJG-MRXNPFEDSA-N 452.488 5.050 5 20 JKBD CCC(CC)(Cc1nc2ccccc2s1)C(=O)OCc1nnc(-c2ccc([N+](=O)[O-])cc2)o1 919109321 QOEKUWUTRAFQCQ-UHFFFAOYSA-N 466.519 5.347 5 20 JKBD CCOC(=O)c1c(-c2ccc(C)cc2C)csc1NC(=O)c1cc(OC)ccc1[N+](=O)[O-] 920275610 MRVMRYDUSMUFBB-UHFFFAOYSA-N 454.504 5.378 5 20 JKBD O=C(Cc1cccc([N+](=O)[O-])c1)NC1(c2ccc(NC(=O)c3ccc4cc[nH]c4c3)cc2)CCC1 1788911982 FOOUEMJMDRVVDH-UHFFFAOYSA-N 468.513 5.067 5 20 JKBD COc1ccc(Cl)cc1C(=O)NC1(c2ccc(NC(=O)c3cc(O)cc([N+](=O)[O-])c3)cc2)CCC1 1790756446 FRYWAAONTSKHBE-UHFFFAOYSA-N 495.919 5.024 5 20 JKBD CC(C)O[C@H](C)C(=O)NC1(c2ccc(NC(=O)c3cc4cc([N+](=O)[O-])ccc4s3)cc2)CCC1 1791010747 UYKKKJUUCILDSN-MRXNPFEDSA-N 481.574 5.371 5 20 JKBD O=C(CSc1ccccc1[N+](=O)[O-])Nc1ccc(C2(NC(=O)c3cc(C4CC4)on3)CCC2)cc1 1791521633 FTNMQTVDJBYDIL-UHFFFAOYSA-N 492.557 5.000 5 20 JKBD CC1(C)CCC(CC(=O)N2CCC3(CCCN(C(=O)Cc4cc([N+](=O)[O-])ccc4F)C3)CC2)CC1 1806657326 QRDNWPSANHBOOM-UHFFFAOYSA-N 487.616 5.114 5 20 JKBD CC(C)[C@H]1CC[C@H](C(=O)N2CCCC[C@@H]2c2cc(NC(=O)c3cc(F)cc([N+](=O)[O-])c3)n[nH]2)CC1 1821166802 FEFKJLCTPPBMPN-DRSNIGMVSA-N 485.560 5.225 5 20 JKBD O=C(Nc1cc([C@H]2CCCCN2C(=O)c2ccc(F)s2)[nH]n1)c1cc2cc([N+](=O)[O-])ccc2s1 1821610580 DSZWPRFFGMKQBU-OAHLLOKOSA-N 499.549 5.353 5 20 JKBD O=C(c1cc(Cl)c(F)c(Cl)c1)N1CCC([C@H]2CCCCN2C(=O)c2ccc([N+](=O)[O-])o2)CC1 1823615168 NCHAYWFCGKPUBZ-QGZVFWFLSA-N 498.338 5.181 5 20 JKBD Cc1cccc(C(=O)N2CCCC[C@H]2C2CCN(C(=O)CSc3ccccc3[N+](=O)[O-])CC2)c1F 1823904953 FEGJITUNHPTWTF-NRFANRHFSA-N 499.608 5.068 5 20 JKBD Cc1ccccc1C(=O)N1CCC([C@@H]2CCCCN2C(=O)Cc2ccc(Cl)cc2[N+](=O)[O-])CC1 1824160993 GUVLMOSTPYUBRX-QHCPKHFHSA-N 483.996 5.033 5 20 JKBD Cc1c(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)Cc3cccc([N+](=O)[O-])c3)CC2)oc2ccccc12 1828123734 JVDJGINWENOHAP-XMMPIXPASA-N 489.572 5.125 5 20 JKBD COc1cccc(C(=O)N2CCC([C@@H]3CCCCN3C(=O)c3cc(Cl)cc([N+](=O)[O-])c3C)CC2)c1 1830734304 CKXHSZAHVWFKHQ-QHCPKHFHSA-N 499.995 5.112 5 20 JKBD C[C@@H](C(=O)N1CCC([C@H]2CCCCN2C(=O)/C=C/c2ccccc2[N+](=O)[O-])CC1)c1ccccc1 1832906882 NUHVWECKBFRWCN-INGXWZIVSA-N 475.589 5.031 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)N1CCC([C@@H]2CCCCN2C(=O)[C@@]2(F)CCCC=C2F)CC1 1832983371 GZLVKJDAOSHPHI-NBGIEHNGSA-N 493.526 5.021 5 20 JKBD COc1ccc2cc(CN[C@H](C(=O)Nc3ccc([N+](=O)[O-])cc3Cl)c3ccccc3)ccc2c1 10180103 QHKQMESRXGALSR-VWLOTQADSA-N 475.932 5.880 5 20 JKBD COc1cc(N[C@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2ccccc2)ccc1N1CCCC1=O 10184785 ADEAMMLQUPSKTR-DEOSSOPVSA-N 494.935 5.176 5 20 JKBD Cc1nc2nc(C(F)(F)F)nn2c(C)c1CCC(=O)OCc1nc2ccccc2c2ccccc12 16256900 QKIYZLJKBPTJGZ-UHFFFAOYSA-N 479.462 5.137 5 20 JKBD COc1ccc2cc(/C=C/C(=O)O[C@@H](C)C(=O)Nc3ccc([N+](=O)[O-])cc3C(F)(F)F)ccc2c1 18019594 KKTUAVCNFGHQOQ-DEYRLNKFSA-N 488.418 5.359 5 20 JKBD CCCn1c(SCC(=O)Nc2ccc([N+](=O)[O-])cc2C(F)(F)F)nnc1-c1cccc(C)c1 23647823 CVWZVXOHNWJTLM-UHFFFAOYSA-N 479.484 5.321 5 20 JKBD CC(C)C(=O)Nc1ccc(CN[C@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2ccccc2)cc1 27024225 MMCIRNJCUMQCCD-QHCPKHFHSA-N 480.952 5.312 5 20 JKBD Cc1occc1C(=O)Nc1cc(NC(=O)c2ccc(N3CCC[C@H](C)C3)c([N+](=O)[O-])c2)ccc1F 46840256 DFPBRZTXROHMLK-HNNXBMFYSA-N 480.496 5.376 5 20 JKBD CCOc1ccc([C@@H](CNC(=O)c2cccc([N+](=O)[O-])c2C)c2c[nH]c3ccccc23)cc1OC 104969536 KVNKEXUSZXSVER-OAQYLSRUSA-N 473.529 5.354 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)N2CCCC[C@@H]2C(=O)Nc2cc(Cl)ccc2Cl)cc1SC 483665256 GOHJIMFYSPRHLU-MRXNPFEDSA-N 498.388 5.266 5 20 JKBD O=C(c1csc(-c2cccc([N+](=O)[O-])c2)n1)N(CCc1ccccc1)c1nc2ccccc2s1 496411562 MVMBLDFCYHWBNN-UHFFFAOYSA-N 486.578 6.218 5 20 JKBD C[C@@H](Sc1nnc(COc2ccc(Cl)cc2Cl)o1)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 501088746 YCRYBMMQEWVUBD-SNVBAGLBSA-N 494.316 5.767 5 20 JKBD CC1CCN(c2ccc(C(=O)Nc3cccc(OCc4cscn4)c3)cc2[N+](=O)[O-])CC1 504988094 HQYOPTYMCPDYQX-UHFFFAOYSA-N 452.536 5.119 5 20 JKBD C[C@H](NC(=O)c1ccc(Sc2nncn2C)c([N+](=O)[O-])c1)c1ccc(Oc2ccccc2)cc1 506340309 OUEAQLMQEDJCJJ-INIZCTEOSA-N 475.530 5.158 5 20 JKBD CCc1ccc(-c2csc(NC(=O)c3cc(OC)c(OCc4cscn4)cc3[N+](=O)[O-])n2)cc1 511650306 SGHOTLBZUZQGQX-UHFFFAOYSA-N 496.570 5.577 5 20 JKBD COc1ccc([C@@H](NC(=O)[C@H](C)Oc2ccc(Cl)cc2[N+](=O)[O-])c2ccc(F)cc2)cc1 520408818 SIBROFCVQVTGRU-FPTDNZKUSA-N 458.873 5.069 5 20 JKBD Cc1nccc(CNC(=O)c2c3c(nc4ccccc24)/C(=C/c2ccc([N+](=O)[O-])cc2)CCC3)n1 520477996 WDSOXTGLMNWCLC-XDJHFCHBSA-N 465.513 5.048 5 20 JKBD O=C(NC1CCN(C2CC2)CC1)c1c2c(nc3ccccc13)/C(=C\c1ccc([N+](=O)[O-])cc1)CCC2 590988786 UDLOWXQJHKQLDB-ZZEZOPTASA-N 482.584 5.377 5 20 JKBD C[C@H]1CSc2ccc(Br)cc2[C@@H]1NC(=O)Cn1c2ccccc2c(=O)c2ccccc21 591369821 KQZGDVCSKRZMSD-IZHWHUGBSA-N 493.426 5.517 5 20 JKBD COc1ccc(CNCC2(c3ccccc3)CCOCC2)cc1OCc1ccc([N+](=O)[O-])cc1 603633272 YAHXUYNQCDAMAP-UHFFFAOYSA-N 462.546 5.020 5 20 JKBD C[C@H](Sc1ccc(S(=O)(=O)N2CCCCCC2)cc1[N+](=O)[O-])c1nc(-c2cccs2)no1 604059849 NGMCVTBFRIIFEX-AWEZNQCLSA-N 494.620 5.124 5 20 JKBD Cc1ccc(Cc2nnc(NC(=O)c3ccc(N[C@@H](C)c4ccccn4)c([N+](=O)[O-])c3)s2)cc1 609381704 MVLIQEALVJHSKO-INIZCTEOSA-N 474.546 5.166 5 20 JKBD Cc1ccc(Sc2ccc(C(=O)OCc3nccn3CC(F)(F)F)cc2[N+](=O)[O-])cc1 727772535 AKLRNUFMGSALSF-UHFFFAOYSA-N 451.426 5.170 5 20 JKBD O=C(COC(=O)c1csc(-c2cccc([N+](=O)[O-])c2)n1)Nc1cc(C(F)(F)F)ccc1Cl 747963781 RZJSYRAOSITJGW-UHFFFAOYSA-N 485.827 5.186 5 20 JKBD CC(C)(C)c1cc(NC(=O)c2cc([N+](=O)[O-])ccc2Br)n(-c2ccc(F)cc2)n1 751082464 KRGOGVIQNMFJRD-UHFFFAOYSA-N 461.291 5.232 5 20 JKBD O=C(Nc1cccc(F)c1)c1cccc(NC(=O)c2cc([N+](=O)[O-])ccc2Br)c1 751099296 IQXBLNIEFMPWTB-UHFFFAOYSA-N 458.243 5.001 5 20 JKBD Cc1noc(C)c1COc1cc2ccccc2cc1C(=O)O[C@@H](C)C(=O)Nc1ccccc1[N+](=O)[O-] 775389992 WANPYTAZEWMFOH-KRWDZBQOSA-N 489.484 5.116 5 20 JKBD O=C(COC(=O)c1occc1CSc1ccccc1)Nc1ccc(C(F)(F)F)cc1[N+](=O)[O-] 792737483 QQHKRYKQXCVVKT-UHFFFAOYSA-N 480.420 5.294 5 20 JKBD CC(C)c1ccc(-c2nc(C(=O)O[C@@H](C)C(=O)Nc3cc([N+](=O)[O-])ccc3Cl)cs2)cc1 900232406 WBWUEVFEHXAKFW-ZDUSSCGKSA-N 473.938 5.679 5 20 JKBD C[C@@H](Oc1ccc(Cl)cc1[N+](=O)[O-])c1nc(C(C)(C)NC(=O)c2cccc(Cl)c2)no1 904595431 DJAGAVXLUPPRDV-LLVKDONJSA-N 465.293 5.090 5 20 JKBD COc1ccc(Oc2ccc([N+](=O)[O-])cc2C(=O)O[C@@H](C)C(=O)Nc2ccc(F)cc2Cl)cc1 915442763 SXQAVRAGVHTYCD-ZDUSSCGKSA-N 488.855 5.372 5 20 JKBD O=C(Nc1cc([N+](=O)[O-])ccc1F)c1ccc2c(c1)C(=O)N(c1ccc(Cl)c(Cl)c1)C2=O 916667023 FHENUCNOWXKDQD-UHFFFAOYSA-N 474.231 5.094 5 20 JKBD Cc1cc(=O)oc2cc(OCc3ccc(C(=O)N[C@H](C)c4cccc([N+](=O)[O-])c4)cc3)ccc12 917702464 VLFVDOFOQSODDS-QGZVFWFLSA-N 458.470 5.080 5 20 JKBD O=C(CSc1nnc(-c2ccc(Cl)cc2)n1Cc1ccco1)OCc1csc([N+](=O)[O-])c1 919044435 RCJLHADCLQIHQB-UHFFFAOYSA-N 490.950 5.045 5 20 JKBD Cc1ccc(NC(=O)[C@H](OC(=O)c2ccc(-c3ccccc3)nc2O)c2ccccc2)c([N+](=O)[O-])c1 919297891 KLMULEQQJFJFCX-XMMPIXPASA-N 483.480 5.208 5 20 JKBD C[C@@H](OC(=O)c1cc2cc([N+](=O)[O-])ccc2[nH]1)C(=O)N1c2ccccc2Sc2ccccc21 919514685 WEYNBMPTPKCDSA-CQSZACIVSA-N 459.483 5.451 5 20 JKBD CC(C)c1cc(C(=O)NC2(c3ccc(NC(=O)Cc4ccc(Cl)cc4[N+](=O)[O-])cc3)CCC2)on1 1786115898 KIJIIIYYMINFBU-UHFFFAOYSA-N 496.951 5.350 5 20 JKBD O=C(C[C@@H]1CCCCO1)Nc1ccc(C2(NC(=O)C3(c4cccc([N+](=O)[O-])c4)CCC3)CCC2)cc1 1786646230 FHRYIACOAXKHKA-DEOSSOPVSA-N 491.588 5.110 5 20 JKBD O=C(Cc1cc([N+](=O)[O-])ccc1F)Nc1ccc(C2(NC(=O)[C@H](F)c3ccccc3)CCC2)cc1 1786669917 MBODATYBNAKTBZ-XMMPIXPASA-N 479.483 5.121 5 20 JKBD COc1cc(C(=O)NC2(c3ccc(NC(=O)CCC4CCCC4)cc3)CCC2)cc([N+](=O)[O-])c1OC 1787619463 KQKXZPKAVGURAQ-UHFFFAOYSA-N 495.576 5.330 5 20 JKBD Cc1nc2cccc(C(=O)Nc3ccc(C4(NC(=O)c5ccc([N+](=O)[O-])o5)CCC4)cc3)c2s1 1788943836 CGMIHNIHIDARCH-UHFFFAOYSA-N 476.514 5.167 5 20 JKBD COc1ccc(C(=O)NC2(c3ccc(NC(=O)c4cc(O)cc([N+](=O)[O-])c4)cc3)CCC2)c(Cl)c1 1790757660 WBQZTOCRJAUPNN-UHFFFAOYSA-N 495.919 5.024 5 20 JKBD CCCc1onc(C)c1C(=O)NC1(c2ccc(NC(=O)c3c(F)ccc([N+](=O)[O-])c3C)cc2)CCC1 1790771090 QBUICIPVNOGJEV-UHFFFAOYSA-N 494.523 5.353 5 20 JKBD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C1CCC(c2ccc(Cl)cc2)CC1)c1ccc([N+](=O)[O-])o1 1793209012 HECLXZCMHKMUHC-SQUOGFPLSA-N 485.968 5.067 5 20 JKBD CC(C)(C)CCCCCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CCc1cccc([N+](=O)[O-])c1)C2 1801831175 PDMGCWBIYPOFRG-KOUNCHBCSA-N 457.615 5.162 5 20 JKBD Cc1c(C(=O)N2CC[C@H](CNC(=O)C3(C(C)C)CCC3)[C@H]2c2cccnc2)cc(Cl)cc1[N+](=O)[O-] 1813665829 LEYRJCWXPLYCHF-AUSIDOKSSA-N 499.011 5.098 5 20 JKBD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)[nH]n1)[C@H]1CC=CCC1 1820831041 ZQYXLEQOHXUEPN-KXBFYZLASA-N 479.562 5.195 5 20 JKBD CC(C)c1ccc(CC(=O)N2CCCC[C@@H]2c2cc(NC(=O)c3cccc(F)c3[N+](=O)[O-])n[nH]2)cc1 1821174696 KSIZBFXLWRNMCJ-JOCHJYFZSA-N 493.539 5.129 5 20 JKBD C/C(=C\c1ccc(C)o1)C(=O)N1CCCC[C@H]1c1cc(NC(=O)/C=C/c2ccccc2[N+](=O)[O-])n[nH]1 1823504396 KWCUAYIZARICSE-GQQZTTJISA-N 489.532 5.028 5 20 JKBD O=C(Nc1nc2c(s1)C[C@H](NC(=O)C1CC3(CCC3)C1)CC2)c1cc2cc([N+](=O)[O-])ccc2s1 1824427566 NYWKSMQOOMMWFN-OAHLLOKOSA-N 496.614 5.072 5 20 JKBD CC(C)(C)c1cc(C(=O)N2CCC([C@H]3CCCCN3C(=O)CCc3cccc([N+](=O)[O-])c3)CC2)c[nH]1 1824838660 MYINFQZJZXGEDE-XMMPIXPASA-N 494.636 5.087 5 20 JKBD C[C@H](C(=O)N1CCC([C@@H]2CCCCN2C(=O)CCc2cccc([N+](=O)[O-])c2)CC1)c1cccs1 1824842964 LNXZIGGAQJWQMI-CVDCTZTESA-N 483.634 5.012 5 20 JKBD CC[C@H](C(=O)N1CCCC[C@@H]1C1CCN(C(=O)Cc2ccc([N+](=O)[O-])cc2F)CC1)c1ccccc1 1826317284 SFRVZBUYLPTYSN-AZGAKELHSA-N 495.595 5.090 5 20 JKBD Cc1c(C(=O)N2CCC([C@H]3CCCCN3C(=O)CC(C)(C)C)CC2)cc(Cl)cc1[N+](=O)[O-] 1826338081 MXSLEFCPKFXDSK-HXUWFJFHSA-N 464.006 5.226 5 20 JKBD Cc1ccc([C@H](C)C(=O)N2CCCC[C@@H]2C2CCN(C(=O)Cc3cc(F)ccc3[N+](=O)[O-])CC2)cc1 1831528261 LZHWVAJMELNJKA-NBGIEHNGSA-N 495.595 5.008 5 20 JKBD O=C(c1ccccc1C1CC1)N1CCC([C@@H]2CCCCN2C(=O)Cc2cc(F)ccc2[N+](=O)[O-])CC1 1832888353 HCOOGKCZXBWTGO-VWLOTQADSA-N 493.579 5.087 5 20 JKBD COc1ccc(Nc2nnc(S[C@@H](C)C(=O)Nc3ccc([N+](=O)[O-])cc3C(F)(F)F)s2)cc1 10786645 VOQQRFSTJUKNCU-JTQLQIEISA-N 499.496 5.337 5 20 JKBD COc1cc(C(=O)Nc2ccc(NC(C)=O)c(Cl)c2)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 14123694 FHJMIIJJDCJAEK-UHFFFAOYSA-N 490.299 5.913 5 20 JKBD CN(c1ccc(Oc2ccc(C(F)(F)F)cc2[N+](=O)[O-])cc1)S(=O)(=O)c1cccs1 15169708 IBNLAJGVICLVGF-UHFFFAOYSA-N 458.439 5.293 5 20 JKBD O=C(CCc1nc(-c2ccsc2)no1)Nc1cc(Cl)c([N+](=O)[O-])cc1OCc1ccccc1 15587769 NNBXRAFEASJOEC-UHFFFAOYSA-N 484.921 5.510 5 20 JKBD Cc1ccc(NC(=O)c2ccc([N+](=O)[O-])cc2Cl)cc1S(=O)(=O)Nc1ccc(Cl)cc1 16498135 GEERUGKZMXWJKA-UHFFFAOYSA-N 480.329 5.263 5 20 JKBD CC[C@H]1c2ccsc2CCN1C(=O)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 16779045 BQOZBKWMZRTVSD-KRWDZBQOSA-N 467.513 5.428 5 20 JKBD C[C@@H](Sc1ncc(-c2ccccc2)n1C[C@H]1CCCO1)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl 22239518 AEAQRIWXDMTUTO-CRAIPNDOSA-N 486.981 5.410 5 20 JKBD Cc1nc(-c2cccc(NC(=O)c3ccccc3NC(=O)c3ccc([N+](=O)[O-])cc3Cl)c2)cs1 23003796 NQOFDZGFFBTVSJ-UHFFFAOYSA-N 492.944 6.185 5 20 JKBD Cc1nc2ccccc2c2c(NC(=O)C3CCN(C(=O)c4ccoc4)CC3)c3ccccc3n12 28406730 VJELATPUZYZMBF-UHFFFAOYSA-N 452.514 5.033 5 20 JKBD Cc1nn(Cc2ccc(C(=O)N(C)[C@H](C)c3ccc(Cl)cc3Cl)cc2)c(C)c1[N+](=O)[O-] 31335897 SUFHSSYXKFTMSQ-CQSZACIVSA-N 461.349 5.596 5 20 JKBD O=C(Cc1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1)Nc1cccc(Oc2cnccn2)c1 33137013 INIVNZLJBPERSF-UHFFFAOYSA-N 492.495 5.211 5 20 JKBD O=C(Nc1nc(-c2cc(Cl)sc2Cl)cs1)c1ccn(-c2cccc([N+](=O)[O-])c2)n1 476146573 IRVHXTVWWQFXTJ-UHFFFAOYSA-N 466.331 5.525 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)NCc2ccc(-c3nc4ccccc4s3)o2)cc1SC 482034002 AZZDSUBBOXLWMP-UHFFFAOYSA-N 455.517 5.125 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)N2CCCC[C@@H]2C(=O)Nc2ccc(Cl)cc2Cl)cc1SC 482990026 RMGMMXUCVZRXJA-MRXNPFEDSA-N 498.388 5.266 5 20 JKBD CSc1ccc(C(=O)c2ccccc2C(=O)Nc2ccc3c(c2)CCCC(=O)N3)cc1[N+](=O)[O-] 483866142 LAGWRRXHDWPDGD-UHFFFAOYSA-N 475.526 5.075 5 20 JKBD Cc1ccc(S(=O)(=O)Nc2ccc(NC(=O)c3cc4cccc(C)c4o3)cc2)cc1[N+](=O)[O-] 489935630 PMLJPCMFIXIMBN-UHFFFAOYSA-N 465.487 5.011 5 20 JKBD CCOc1cc([N+](=O)[O-])c(C(=O)Nc2sc3c(c2C(=O)c2ccco2)CC[C@@H](C)C3)cc1OC 503088899 VMWLUQHPOYNGHW-CYBMUJFWSA-N 484.530 5.265 5 20 JKBD CC(C)c1nc(C(=O)Nc2cc3c(cc2[N+](=O)[O-])OCCCO3)nn1-c1c(Cl)cccc1Cl 504360550 WRDUUEAYOQAKSF-UHFFFAOYSA-N 492.319 5.019 5 20 JKBD COc1cc(C(=O)N(C)Cc2ccc(C(C)(C)C)cc2)c([N+](=O)[O-])cc1OCc1cscn1 516668550 BAHNOLMAGDGBMF-UHFFFAOYSA-N 469.563 5.209 5 20 JKBD COc1ccc(C(=O)N2CCCC2)cc1NC(=O)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1 519874661 PTJRJXVZOQDHDN-UHFFFAOYSA-N 495.919 5.537 5 20 JKBD Cc1ccc(Sc2ccc(C(=O)N3CCC(C(=O)c4ccc(O)cc4)CC3)cc2[N+](=O)[O-])cc1 591596111 KXCXBIQHFCGYKP-UHFFFAOYSA-N 476.554 5.495 5 20 JKBD Cc1ccc(-c2nsc(NC(=O)C3CCN(c4ccc(C(F)(F)F)cc4[N+](=O)[O-])CC3)n2)s1 608945228 YCXGQJFMSGVCJX-UHFFFAOYSA-N 497.524 5.357 5 20 JKBD O=C(C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)N1CCC[C@@H](n2ccnc2)C1 609131692 VGVBXVPPILTXEK-CKNGIZQFSA-N 473.558 5.195 5 20 JKBD CS(=O)(=O)c1ccc(Sc2nnc(-c3ccc(Cl)cc3)n2-c2ccccc2)c([N+](=O)[O-])c1 619685608 YBLFRKWESVPBMA-UHFFFAOYSA-N 486.962 5.051 5 20 JKBD Cc1nn(CCC(=O)O[C@H](C(=O)Nc2cc(Cl)cc(Cl)c2)c2ccccc2)c(C)c1[N+](=O)[O-] 726649485 HUXOLXJLOGOKOH-NRFANRHFSA-N 491.331 5.028 5 20 JKBD C[C@H](SCc1nc(O)c2c(-c3ccccc3)csc2n1)C(=O)O[C@@H](C)c1cccc([N+](=O)[O-])c1 729758366 ITZHXRVSGJYDGH-GJZGRUSLSA-N 495.582 5.898 5 20 JKBD O=C(OCC(=O)N1N=C(c2ccc(Cl)cc2)C[C@H]1c1ccco1)c1c(Cl)cccc1[N+](=O)[O-] 730643416 BOIGYIBMUUTCHZ-SFHVURJKSA-N 488.283 5.029 5 20 JKBD O=C(COC(=O)c1csc(-c2ccc([N+](=O)[O-])cc2)n1)Nc1ccccc1-c1ccccc1 747958658 RLZWPPDNUOTMQZ-UHFFFAOYSA-N 459.483 5.181 5 20 JKBD O=C(C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)OCc1cn2ccccc2n1 748579016 GCMLVPUZUGNIMW-AQTBWJFISA-N 470.510 5.526 5 20 JKBD CC1=C(C(=O)Nc2ccc(F)cc2)[C@H](c2ccc(-c3ccc([N+](=O)[O-])cc3Cl)o2)NC(=S)N1 916190931 ZMIDRBARPZPWFI-FQEVSTJZSA-N 486.912 5.079 5 20 JKBD O=C(Nc1ccc(Oc2ncc(Cl)cc2Cl)cc1)c1cc([N+](=O)[O-])ccc1N1CCOCC1 916411470 XHAWALJYDGESSJ-UHFFFAOYSA-N 489.315 5.178 5 20 JKBD C[C@H](OC(=O)[C@H](C)Oc1ccc(C(C)(C)C)cc1)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 916535684 HVRCFYABSUTAFY-KBPBESRZSA-N 482.455 5.249 5 20 JKBD Cc1cc(S(=O)(=O)Oc2ccc(NC(=O)c3cc([N+](=O)[O-])ccc3Cl)cc2)c2ncccc2c1 917868663 XKBUYERUVGTYBS-UHFFFAOYSA-N 497.916 5.125 5 20 JKBD Cc1ccc(-c2cc(C(=O)O[C@H](C(=O)Nc3ccc([N+](=O)[O-])cc3Cl)c3ccccc3)n[nH]2)o1 919327049 XHIMOBSMDAXSKG-NRFANRHFSA-N 480.864 5.077 5 20 JKBD CC(C)[C@@H](OC(=O)c1ccc(N[C@H](C)c2ccccn2)c([N+](=O)[O-])c1)C(=O)Nc1ccccc1Cl 920545337 PXISNOLGCNSMGA-WAIKUNEKSA-N 496.951 5.636 5 20 JKBD CC(C)c1ccccc1NC(=O)[C@@H](C)OC(=O)c1ccc(N[C@@H](C)c2ccccn2)c([N+](=O)[O-])c1 920548788 SQEFVXMHZIKGAI-ZWKOTPCHSA-N 476.533 5.470 5 20 JKBD O=C(CCSCc1nc(O)c2c3c(sc2n1)CCCC3)Oc1cc(Cl)ccc1[N+](=O)[O-] 921140866 RSVACOJBWMKYCD-UHFFFAOYSA-N 479.967 5.066 5 20 JKBD O=C(NC1(c2ccc(NC(=O)c3nc[nH]c3[N+](=O)[O-])cc2)CCC1)c1cc2c(Cl)cccc2s1 1788612394 OJIJVQZJJYDBHW-UHFFFAOYSA-N 495.948 5.248 5 20 JKBD Cc1cc(CCCC(=O)Nc2cc([C@@H]3CCCCN3C(=O)[C@H]3CC=CCC3)[nH]n2)c([N+](=O)[O-])cc1F 1815072013 UUFXMJDCQRLGSQ-AVRDEDQJSA-N 497.571 5.137 5 20 JKBD O=C(c1cc2cc([N+](=O)[O-])ccc2s1)N1CCC([C@H]2CCCCN2C(=O)/C=C/c2ccco2)CC1 1825266967 AFZSZTLRPKSDCA-FGBWHXJSSA-N 493.585 5.349 5 20 JKBD O=C(c1cc2cc([N+](=O)[O-])ccc2s1)N1CCC([C@H]2CCCCN2C(=O)C2CCCCC2)CC1 1826282704 QXRDMVODSCRWAC-JOCHJYFZSA-N 483.634 5.623 5 20 JKBD Cc1c(C(=O)N2CCC([C@H]3CCCCN3C(=O)Cc3ccsc3)CC2)cc(Cl)cc1[N+](=O)[O-] 1827166847 OHRAFIJWOWDHOG-OAQYLSRUSA-N 490.025 5.094 5 20 JKBD Cc1c(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3cc(F)cc([N+](=O)[O-])c3)CC2)oc2ccccc12 1828128499 UCHGKSNUEZTMEF-HSZRJFAPSA-N 493.535 5.336 5 20 JKBD C[C@@H](CC(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cc(F)cc([N+](=O)[O-])c2)CC1)c1ccccc1 1831509005 GIHJHBLLLVXLET-UQBPGWFLSA-N 481.568 5.161 5 20 JKBD O=C(/C=C/c1ccccc1[N+](=O)[O-])N1CCC([C@@H]2CCCCN2C(=O)c2ccccc2C2CC2)CC1 1832558157 RURCKGHGFFXSAD-BOMYWPOKSA-N 487.600 5.419 5 20 JKBD O=C(CSc1nnc(-c2ccco2)n1C1CCCCC1)Nc1cc(Cl)ccc1[N+](=O)[O-] 10014923 NFSQTORBOHLKDJ-UHFFFAOYSA-N 461.931 5.336 5 20 JKBD COc1ccc(Nc2nnc(SCc3cc(OC)c(OC(F)F)cc3[N+](=O)[O-])s2)cc1 10395890 ZKLDYZRAQTZEAH-UHFFFAOYSA-N 470.479 5.101 5 20 JKBD O=C(Nc1cccc([N+](=O)[O-])c1)c1cc(S(=O)(=O)Nc2cccc(C(F)(F)F)c2)ccc1Cl 15408175 ADPQAJUNDDSRGE-UHFFFAOYSA-N 499.854 5.320 5 20 JKBD C[C@@H](Sc1nnc(-c2ccc(Cl)cc2)n1Cc1ccco1)C(=O)Nc1cccc([N+](=O)[O-])c1 21119498 JZYLMMHUWQNWAS-CQSZACIVSA-N 483.937 5.267 5 20 JKBD C[C@@H](N[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1)c1ccc(NC(=O)C2CC2)cc1 28346955 FMIAZXGNFMKWAY-VOIUYBSRSA-N 492.963 5.627 5 20 JKBD C[C@@H](Nc1ccc(C(=O)Nc2cccc(-c3nc4ccccc4[nH]3)c2)cc1[N+](=O)[O-])c1ccccn1 72016718 ABJMFBRLTDAJCW-QGZVFWFLSA-N 478.512 5.959 5 20 JKBD CN(C)c1ccc(C(=O)c2ccccc2C(=O)Nc2cccc(OCc3cccnc3)c2)cc1[N+](=O)[O-] 108197605 ILFSHQNCPFTOGF-UHFFFAOYSA-N 496.523 5.118 5 20 JKBD COc1ccc(CSCC(=O)N[C@@H](C)c2ccc(NC(=O)Nc3ccccc3)cc2)cc1[N+](=O)[O-] 108607590 WEKNMSASYFXDDH-KRWDZBQOSA-N 494.573 5.358 5 20 JKBD O=C(COc1ccc([N+](=O)[O-])c(F)c1)NC[C@@H](c1ccccc1Cl)c1c[nH]c2ccccc12 109393684 QRINNBKDPICEHZ-SFHVURJKSA-N 467.884 5.196 5 20 JKBD O=C1CCc2cc(NC(=O)c3ccccc3Sc3ccc(C(F)(F)F)cc3[N+](=O)[O-])ccc2N1 482548527 HFQKYXJLGDEGJJ-UHFFFAOYSA-N 487.459 5.902 5 20 JKBD COc1ccc(/C=C(/CC(=O)O)c2nc3ccccc3s2)cc1OCc1ccc([N+](=O)[O-])cc1 483416805 QUSWKKYEFYOPGW-PDGQHHTCSA-N 476.510 5.807 5 20 JKBD CC1CCN(c2ccc(C(=O)NCc3cn(-c4ccccc4)nc3-c3ccncc3)cc2[N+](=O)[O-])CC1 489929288 BDXLAUQXFXNXBZ-UHFFFAOYSA-N 496.571 5.009 5 20 JKBD C[C@@H](Nc1ccc(C(=O)Nc2ccccc2OCC(F)(F)F)cc1[N+](=O)[O-])c1ccccn1 506073072 PYLSFCYVNNCDAE-CQSZACIVSA-N 460.412 5.356 5 20 JKBD C[C@H]1CCCN(c2ccc(C(=O)N(C)c3ccc(Br)cc3F)cc2[N+](=O)[O-])C1 509703710 DSODXGZHBNCCBQ-ZDUSSCGKSA-N 450.308 5.009 5 20 JKBD COCCN(C(=O)c1cnc(-c2ccccc2F)s1)c1nc(-c2ccc([N+](=O)[O-])cc2)cs1 516336018 YGWYRIIGHPUYAO-UHFFFAOYSA-N 484.534 5.274 5 20 JKBD Cc1nc(NC(=O)c2cc3cccc([N+](=O)[O-])c3[nH]2)sc1-c1nc2ccccc2n1C(F)F 518227510 CHNMTNACICZKFX-UHFFFAOYSA-N 468.445 5.505 5 20 JKBD CN(CCCCCc1cc(-c2cccc(F)c2)no1)C(=O)c1cnn(-c2ccc([N+](=O)[O-])cc2)c1 521012475 MAEHOOFWJYRQBC-UHFFFAOYSA-N 477.496 5.060 5 20 JKBD COc1ccc(Oc2ccc([N+](=O)[O-])cc2C(=O)Nc2ccc3nc([C@@H]4CCCO4)[nH]c3c2)cc1 521951971 CNJRZEFUEUDWLK-QHCPKHFHSA-N 474.473 5.376 5 20 JKBD C[C@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)N1CCC[C@H](c2nc(-c3ccc(Cl)cc3)no2)C1 522506101 KNJLUXKZQDNIJM-HOCLYGCPSA-N 472.954 5.185 5 20 JKBD O=C(CCc1nnc(-c2cc3ccccc3o2)o1)Nc1ccc([N+](=O)[O-])cc1C(=O)c1ccccc1 523184608 NGQXXZKXEIMFLP-UHFFFAOYSA-N 482.452 5.193 5 20 JKBD Cc1ccnc(NC(=O)c2c3c(nc4ccccc24)/C(=C\c2ccc([N+](=O)[O-])cc2)CCC3)n1 602218437 YHMHWKVNIBJPKV-SDXDJHTJSA-N 451.486 5.371 5 20 JKBD C[C@@H]1CCC[C@@H](C)N1C(=O)c1cc(Cl)ccc1NC(=O)c1cc2cc([N+](=O)[O-])ccc2o1 603738377 YXNWVWWPJFBHFH-ZIAGYGMSSA-N 455.898 5.650 5 20 JKBD C[C@H](Nc1ccc(C(=O)NCCc2ccc(C(F)(F)F)cc2)cc1[N+](=O)[O-])c1ccccn1 604295512 MHCFBZWXBASQLR-HNNXBMFYSA-N 458.440 5.154 5 20 JKBD Cc1ccc(C(N)=O)cc1NC(=O)c1ccc(Sc2nc3ccccc3s2)c([N+](=O)[O-])c1 604497626 KCOYOAIUYRTQTD-UHFFFAOYSA-N 464.528 5.015 5 20 JKBD COc1ccc(NC(=O)c2ccc(Cl)c([N+](=O)[O-])c2)cc1OCc1ccc2ccccc2n1 728008822 HMRIYTABARKRLM-UHFFFAOYSA-N 463.877 5.636 5 20 JKBD O=C(O[C@@H](C(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1)c1ccccc1)c1ccc(C(F)(F)F)cn1 844420032 GZFHLXQWRVXDKF-GOSISDBHSA-N 479.798 5.199 5 20 JKBD C[C@H](NC(=O)OC(C)(C)C)c1ccc(NCc2c(Br)cccc2[N+](=O)[O-])cc1 864023906 SGKGDLUFDRVWCN-ZDUSSCGKSA-N 450.333 5.555 5 20 JKBD C[C@H](OC(=O)/C=C\c1ccc2ccc(Cl)cc2n1)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 912873974 RKNTZFJOXQFYRF-ZWXCPPHNSA-N 450.838 5.164 5 20 JKBD CCOC(=O)c1sc(NC(=O)c2cc(Cl)ccc2[N+](=O)[O-])c(C(=O)OC(C)(C)C)c1C 914449986 SGPHYABTKNGHGT-UHFFFAOYSA-N 468.915 5.002 5 20 JKBD CC(C)N(Cc1nnc(-c2cccc([N+](=O)[O-])c2)o1)C(=O)CCOc1ccc(Cl)c(Cl)c1 914713437 NGPWFQZFDMTZQI-UHFFFAOYSA-N 479.320 5.158 5 20 JKBD CC(=O)N(c1nc(COC(=O)CCOc2cc(C)ccc2[N+](=O)[O-])cs1)c1c(C)cc(C)cc1C 915439636 CGRKCYMGTDHVMG-UHFFFAOYSA-N 497.573 5.482 5 20 JKBD C[C@H](OC(=O)c1ccccc1NC(=O)c1ccccc1Br)c1cccc([N+](=O)[O-])c1 920157849 KNOFFLGWFSAZKT-AWEZNQCLSA-N 469.291 5.528 5 20 JKBD CSc1ccc(NC(=O)[C@H](C)OC(=O)c2ccc(N[C@H](C)c3ccccn3)c([N+](=O)[O-])c2)cc1 920548097 PTINEHNPTMXXOM-CVEARBPZSA-N 480.546 5.069 5 20 JKBD Cc1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2N2CCC(C)CC2)cc1NC(=O)c1ccncc1 921286843 TVOAPKDELOOGPT-UHFFFAOYSA-N 473.533 5.039 5 20 JKBD O=C(Cc1cccc([N+](=O)[O-])c1)NC1(c2ccc(NC(=O)c3ccc4occc4c3)cc2)CCC1 1789047904 UAKGXCYDHZWGAQ-UHFFFAOYSA-N 469.497 5.331 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)c3n[nH]cc3[N+](=O)[O-])CCC2)cc1)c1ccc(Oc2ccccc2)cc1 1790621228 RNVWJHHRBXMIKT-UHFFFAOYSA-N 497.511 5.172 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)[C@@H](F)c3ccccc3)CCC2)cc1)c1ccc([N+](=O)[O-])cc1F 1790622625 PPPGELUTCUFURV-QFIPXVFZSA-N 465.456 5.192 5 20 JKBD O=C(Cc1cc(F)ccc1[N+](=O)[O-])Nc1ccc(C2(NC(=O)C[C@H]3C[C@@H]4CC[C@H]3C4)CCC2)cc1 1792309256 IWXBPCVMMZXFKY-CEXWTWQISA-N 479.552 5.237 5 20 JKBD CC[C@@H](C)[C@H](C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)Cc1ccc(Cl)cc1[N+](=O)[O-])c1ccccc1 1793078095 GJEQFJBBLNYXIF-QZWMETGYSA-N 498.023 5.259 5 20 JKBD Cc1ccc([C@H](C)C(=O)N2CCCC[C@H]2C2CCN(C(=O)Cc3cc(F)ccc3[N+](=O)[O-])CC2)cc1 1831528259 LZHWVAJMELNJKA-CPJSRVTESA-N 495.595 5.008 5 20 JKBD CCOc1cc([N+](=O)[O-])c(C(=O)NC[C@H](c2ccccc2Cl)c2c[nH]c3ccccc23)cc1OC 15758543 QDOCRGJYWGKGRJ-LJQANCHMSA-N 493.947 5.699 5 20 JKBD COc1ccc(NC(=O)[C@H](C)Sc2nnc(-c3ccccc3)n2-c2ccc(F)cc2)c([N+](=O)[O-])c1 15813613 GHLGNHTVFFFOMS-HNNXBMFYSA-N 493.520 5.110 5 20 JKBD O=C(O[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1)c1ccc(Cl)cc1F 18807526 TUPJJMXRJREYGO-IBGZPJMESA-N 463.248 5.578 5 20 JKBD CC(C)c1cccc(C(C)C)c1NC(=O)COC(=O)c1cc([N+](=O)[O-])ccc1N1CCCC1 20866232 OKVABVQDNMBCJO-UHFFFAOYSA-N 453.539 5.237 5 20 JKBD CCn1c(S[C@@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)nc2cc3ccccc3cc2c1=O 22178022 FUQBXCCHMWGNJG-ZDUSSCGKSA-N 482.949 5.251 5 20 JKBD CCOc1ccc(Oc2ccccc2NC(=O)c2cc(OCC)c(OC)cc2[N+](=O)[O-])cc1 26770184 FOSIJJXRORVBBG-UHFFFAOYSA-N 452.463 5.445 5 20 JKBD COCc1ccc(CNC(=O)c2ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])c(OC)c2)cc1 46588198 YOSIYHXIHKCHCF-UHFFFAOYSA-N 456.882 5.126 5 20 JKBD CN(Cc1cn(-c2ccccc2)nc1-c1ccccc1)C(=O)C1CCN(c2ccccc2[N+](=O)[O-])CC1 482935289 TWIXPXDGRXRYPE-UHFFFAOYSA-N 495.583 5.323 5 20 JKBD O=C(C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)N1CCC[C@H]1c1ccncc1 485475585 NVKWLNQUFAJTRQ-OWFGXHLJSA-N 470.554 5.894 5 20 JKBD C[C@@H](N[C@H](Cc1cccc(F)c1)c1cccc(F)c1)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 488009027 SVGOUNLBAKYAQU-IVZQSRNASA-N 450.445 5.558 5 20 JKBD CCCN(CC(=O)Nc1ccc(Cl)cc1Cl)C(=O)c1csc(-c2ccc([N+](=O)[O-])cc2)n1 497362408 HJFHSBPWJVDLRX-UHFFFAOYSA-N 493.372 5.516 5 20 JKBD CSc1ccc([N+](=O)[O-])c(C(=O)Nc2ccc(Oc3ncc(Cl)cc3Cl)cc2)c1 500350659 UGRZGCVBLGIJGF-UHFFFAOYSA-N 450.303 6.063 5 20 JKBD COc1cc([C@@H](C)NC(=O)Cn2c3ccccc3c(=O)c3ccccc32)ccc1OCCC(C)C 501446190 BLDTZYAROCWLLM-HXUWFJFHSA-N 472.585 5.466 5 20 JKBD Cc1cc(C(=O)N2CCC(C)CC2)ccc1NC(=O)N(Cc1ccc([N+](=O)[O-])cc1)C(C)C 509260660 UEQMZIDYKSUQRO-UHFFFAOYSA-N 452.555 5.218 5 20 JKBD COc1cc(C(=O)Nc2cc(Cl)ccc2Cl)c([N+](=O)[O-])cc1OCc1cscn1 512658311 RARGRVAOOLMWPD-UHFFFAOYSA-N 454.291 5.198 5 20 JKBD COc1ccc([C@@H](NC(=O)c2cc(OCC(F)(F)F)ccc2[N+](=O)[O-])c2ccc(C)cc2)cc1 512939538 FIWJMICOTBEBQN-QFIPXVFZSA-N 474.435 5.372 5 20 JKBD O=C(C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)NCCn1cnc2ccccc21 520167822 CSQNGMGSLAGLJI-CYVLTUHYSA-N 483.553 5.301 5 20 JKBD COc1cc(C(=O)N[C@H](c2nnc3ccccn23)C(C)C)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 523565880 QGPPSPZSLWJUHK-QFIPXVFZSA-N 495.923 5.219 5 20 JKBD COc1ccc(NC(=O)N[C@@H](C)c2cccc([N+](=O)[O-])c2)cc1OCc1ccc2ccccc2n1 551395516 SSDRHERMRQKMKC-KRWDZBQOSA-N 472.501 5.613 5 20 JKBD CCCN(CC(=O)Nc1ccc(Cl)cc1Cl)[C@H](C)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 560868343 SVGDMXTZLHUVGJ-CYBMUJFWSA-N 478.336 5.363 5 20 JKBD C[C@@H]1C[C@@H](C)CN(c2ccc(C(=O)Nc3ccc(NC(=O)c4ccco4)c(Cl)c3)cc2[N+](=O)[O-])C1 604119250 HPVOTMDHHYHRQM-HZPDHXFCSA-N 496.951 5.828 5 20 JKBD Cc1ccc(NC(=O)c2ccc(N3CCC(C(=O)c4cc(F)ccc4F)CC3)c([N+](=O)[O-])c2)cc1 608972695 JYGVDTQFQDCYCW-UHFFFAOYSA-N 479.483 5.533 5 20 JKBD CCC[C@@H](NC(=O)Cc1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1)c1ccccn1 609179659 OSIWGZKDMGWSKE-XMMPIXPASA-N 455.518 5.043 5 20 JKBD O=C(c1cc2ccccc2c2cccnc12)N1CCC[C@H](c2nnc3ccc(C(F)(F)F)cn23)C1 613609910 KITCIOUWHTZVRK-KRWDZBQOSA-N 475.474 5.469 5 20 JKBD CC(C)(C)OC(=O)NC[C@H]1CCN(C(=O)c2cc([N+](=O)[O-])ccc2Sc2ccc(Cl)cc2)C1 725733343 MFFWPTVAMCYKOF-OAHLLOKOSA-N 491.997 5.386 5 20 JKBD COc1cc(C(=O)Oc2cccc(-c3nc(C)cs3)c2)c([N+](=O)[O-])cc1OCc1cscn1 726388634 ZTHBAOLHSXQPIG-UHFFFAOYSA-N 483.527 5.290 5 20 JKBD Cc1cc[n+](/C(C(=S)N[C@H](C)c2ccc(Cl)cc2Cl)=C(/O)c2ccc([N+](=O)[O-])cc2)cc1 726569992 FYGMWUSIKIIOJE-OAHLLOKOSA-O 489.404 6.060 5 20 JKBD O=C(CCC(=O)c1ccc2ccc3cccc4ccc1c2c34)NCc1ccc(N2CCCC2)nc1 727754321 NPNSTUXRPUDJKE-UHFFFAOYSA-N 461.565 5.859 5 20 JKBD Cc1ccc2oc(C(=O)O[C@@H](C(=O)Nc3ccc([N+](=O)[O-])cc3Cl)c3ccccc3)cc2n1 729725209 FNIXZZCXAPKTFZ-OAQYLSRUSA-N 465.849 5.235 5 20 JKBD COc1cc2[nH]c(/C(Cl)=C\c3ccc(-c4ccc([N+](=O)[O-])cc4)s3)nc(=O)c2cc1OC 818215311 GBKYVNBCHITVPY-CXUHLZMHSA-N 469.906 5.314 5 20 JKBD COc1cc(C(=O)Nc2cc([N+](=O)[O-])c(F)cc2F)ccc1OCc1ccc(Br)cc1 915837527 BIFZNEUQQOWGBZ-UHFFFAOYSA-N 493.260 5.475 5 20 JKBD O=C(Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1)c1ccc(-n2ccc(C(F)(F)F)n2)cc1 919976242 FNUYXTGQUCSVNP-UHFFFAOYSA-N 459.409 5.175 5 20 JKBD CC(C)N(Cc1nnc(-c2cccc([N+](=O)[O-])c2)o1)C(=O)CCc1ccc(-c2ccccc2)[nH]1 919982166 MWMQPXYJUWSZGG-UHFFFAOYSA-N 459.506 5.010 5 20 JKBD CC(C)[C@H](CN(Cc1ccc(Cl)c(Cl)c1)C(=S)Nc1ccc([N+](=O)[O-])cc1)N(C)C 920313753 ICUBKLWNSQLWPP-FQEVSTJZSA-N 469.438 5.687 5 20 JKBD Cc1ccccc1N1C(=O)/C(=C\c2cc([N+](=O)[O-])ccc2OC(F)F)c2ccccc2C1=O 920836692 JKHLQIOCYBTATF-UYRXBGFRSA-N 450.397 5.232 5 20 JKBD O=C(/C=C/c1ccc([N+](=O)[O-])o1)Nc1ccc(C2(NC(=O)Cc3ccc4ncccc4c3)CCC2)cc1 1786205544 DCZAJEDAJAAFSM-FMIVXFBMSA-N 496.523 5.126 5 20 JKBD COc1cccc(Cl)c1C(=O)NC1(c2ccc(NC(=O)/C=C/c3ccc([N+](=O)[O-])o3)cc2)CCC1 1786208290 XMCZUGPOWLKHOG-ZRDIBKRKSA-N 495.919 5.311 5 20 JKBD CCC[C@@H](C(=O)Nc1ccc(C2(NC(=O)/C=C/c3ccc([N+](=O)[O-])o3)CCC2)cc1)n1cccc1 1788597571 JLFLMRGBMPXCSD-SDNYCIMKSA-N 476.533 5.178 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)Nc1ccc(C2(NC(=O)c3onc4ccccc34)CCC2)cc1 1790772233 JJQDFGLXSCUACV-UHFFFAOYSA-N 488.475 5.245 5 20 JKBD Cc1cc2cc(C(=O)Nc3ccc(C4(NC(=O)c5cc(O)cc([N+](=O)[O-])c5)CCC4)cc3)ccc2[nH]1 1790988553 JRFJXMZTXBUAAT-UHFFFAOYSA-N 484.512 5.152 5 20 JKBD CC(F)(F)C(C)(C)C(=O)NC1(c2ccc(NC(=O)Cc3ccc([N+](=O)[O-])cc3F)cc2)CCC1 1791184350 PKSBCMWLBDUOPK-UHFFFAOYSA-N 477.483 5.092 5 20 JKBD CCc1ccnc(C(=O)NC2(c3ccc(NC(=O)CSc4ccccc4[N+](=O)[O-])cc3)CCC2)c1 1791522436 RPROPWMDLIVAMD-UHFFFAOYSA-N 490.585 5.092 5 20 JKBD CC(C)(C)c1ccc(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)c3ccc(O)c([N+](=O)[O-])c3)[nH]n2)s1 1818342830 BRNXATNOBNDEGR-INIZCTEOSA-N 497.577 5.002 5 20 JKBD CCCCC[C@H](C)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)Cn2ccc3ccc([N+](=O)[O-])cc32)[nH]n1 1822003110 YWNJUQOZSMQYBA-AVRDEDQJSA-N 494.596 5.181 5 20 JKBD O=C(c1ccc([N+](=O)[O-])cc1F)N1CCC([C@H]2CCCCN2C(=O)c2cccc3ccoc23)CC1 1830990641 HADPZTXVWUZMHQ-HSZRJFAPSA-N 479.508 5.027 5 20 JKBD COc1ccc(Nc2nnc(S[C@H](C)C(=O)Nc3ccc([N+](=O)[O-])cc3C(F)(F)F)s2)cc1 10786647 VOQQRFSTJUKNCU-SNVBAGLBSA-N 499.496 5.337 5 20 JKBD Cc1ccc(NC(=O)[C@@H](OC(=O)c2ccc(Cl)c([N+](=O)[O-])c2)c2ccccc2)c([N+](=O)[O-])c1 11025165 QIPKDQCOKGVZJX-FQEVSTJZSA-N 469.837 5.002 5 20 JKBD O=C1c2ccccc2N[C@H](c2ccc(-c3ccc([N+](=O)[O-])cc3Cl)o2)N1C[C@H]1CCCO1 15503657 MAFQAWYREHJBLF-QRQCRPRQSA-N 453.882 5.254 5 20 JKBD COc1cc([N+](=O)[O-])ccc1NC(=O)COC(=O)c1ccccc1-c1ncc(-c2ccc(C)cc2)o1 18753957 UBMWQKHDIFKRTK-UHFFFAOYSA-N 487.468 5.029 5 20 JKBD CC(C)OC(=O)C[C@H](NC(=O)c1sc2cc(F)ccc2c1Cl)c1ccccc1[N+](=O)[O-] 22187745 WPJOWZHUACUVCV-HNNXBMFYSA-N 464.902 5.415 5 20 JKBD O=C(Nc1cccc(/C=C/c2ccnc(-c3cccc([N+](=O)[O-])c3)[n+]2[O-])c1)c1ccccc1Cl 106116678 ZPBCSBUFJFPFMG-VAWYXSNFSA-N 472.888 5.366 5 20 JKBD O=C(Nc1ccc(Oc2ccc(Cl)cc2)nc1)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-] 108943099 ORPGSNJASMRUPY-UHFFFAOYSA-N 467.787 5.629 5 20 JKBD C[C@@H](Cc1cccc(Br)c1)NC(=O)c1ccc(N[C@H](C)c2ccccn2)c([N+](=O)[O-])c1 195676481 AXBLXNBQJLVYFX-JKSUJKDBSA-N 483.366 5.286 5 20 JKBD COc1cc(OCC(=O)Nc2ccc(N[C@H](C)c3ccccc3)c(Cl)c2)ccc1[N+](=O)[O-] 303029179 NSRSBZSWCGCRBN-OAHLLOKOSA-N 455.898 5.447 5 20 JKBD COc1cc(CN(C)C(=O)c2ccc(NCc3ccccc3)c([N+](=O)[O-])c2)ccc1SC 477840232 CMNKCBBICSEXRZ-UHFFFAOYSA-N 451.548 5.210 5 20 JKBD Cc1nc([N+](=O)[O-])cn1CCC(=O)NC[C@@H](c1ccc(Cl)cc1Cl)c1c[nH]c2ccccc12 488293536 QTYACLBSBOZSLA-SFHVURJKSA-N 486.359 5.226 5 20 JKBD Cc1ccc(NS(=O)(=O)c2ccc(N3CCC(OC4CCCCC4)CC3)c([N+](=O)[O-])c2)c(C)c1 496188187 NAJWGRFABLOWEQ-UHFFFAOYSA-N 487.622 5.331 5 20 JKBD CC[C@H](C)Sc1ccc(NC(=O)c2ccc([N+](=O)[O-])cc2I)c(C)c1 504648452 XZAUFXTZZUTNKX-LBPRGKRZSA-N 470.332 5.651 5 20 JKBD CCc1cc(Sc2nnc(-c3cccnc3)n2Cc2ccco2)nc(-c2ccc([N+](=O)[O-])cc2)n1 507111303 PEIVJUKYFNISKH-UHFFFAOYSA-N 485.529 5.060 5 20 JKBD O=C(Nc1ccc(NC(=O)c2ccc(N3CCCC3)c([N+](=O)[O-])c2)cc1)c1ccc(Cl)cc1 507613088 NTBLZPIDPOWJAF-UHFFFAOYSA-N 464.909 5.353 5 20 JKBD O=C(Cc1ccc(NC(=O)c2cc3ccccc3o2)cc1)Nc1cc([N+](=O)[O-])ccc1OC(F)F 512346285 LZYRNPRRBJSLPV-UHFFFAOYSA-N 481.411 5.376 5 20 JKBD CCOc1cc(C(=O)N[C@H](c2ccc(C(C)C)cc2)c2cccs2)c([N+](=O)[O-])cc1OC 512461145 AGOVPLFFAQJIHF-HSZRJFAPSA-N 454.548 5.706 5 20 JKBD CS(=O)(=O)c1ccccc1NC(=O)c1ccc(Sc2nc3ccccc3s2)c([N+](=O)[O-])c1 514526250 YKJHRSIEHXNORV-UHFFFAOYSA-N 485.568 5.012 5 20 JKBD CCOc1cc(NC(=O)c2c[nH]c3cc([N+](=O)[O-])ccc23)c(OCC)cc1NC(=O)c1ccccc1 515762661 JVZQBOPPCFVGLT-UHFFFAOYSA-N 488.500 5.378 5 20 JKBD Cc1cc(C(=O)N2CCCC[C@H]2C)ccc1NC(=O)c1cc([N+](=O)[O-])ccc1Sc1ccccc1 519077463 GOAOOADFEJYGJP-LJQANCHMSA-N 489.597 6.321 5 20 JKBD Cc1nc(-c2ccc(CNC(=O)CSc3ccc(C(F)(F)F)cc3[N+](=O)[O-])cc2)cs1 520006878 YKBDMRAJPYNFFU-UHFFFAOYSA-N 467.494 5.454 5 20 JKBD CC(=O)N1CCc2c(sc3nc(-c4ccc(F)cc4[N+](=O)[O-])cc(-c4ccc(C)cc4)c23)C1 543443931 AYHGYHLHOABJAH-UHFFFAOYSA-N 461.518 5.891 5 20 JKBD O=C(Nc1nc(-c2cccc(Cl)c2)cs1)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-] 603880907 WPXWOYQDJVBVGM-UHFFFAOYSA-N 457.817 5.565 5 20 JKBD O=[N+]([O-])c1cccc(-c2noc(CN[C@@H](c3ccccc3)c3ccc(Br)cc3F)n2)c1 604009354 DNWAWXFBUMBJJQ-NRFANRHFSA-N 483.297 5.426 5 20 JKBD O=C(Nc1cnn(C[C@H]2CCCO2)c1)c1ccccc1Sc1ccc(C(F)(F)F)cc1[N+](=O)[O-] 604243931 PGGQPCZDLSEMIA-MRXNPFEDSA-N 492.479 5.393 5 20 JKBD Cc1ccc(NC(=O)c2cccc(C(F)(F)F)c2)cc1NC(=O)COc1ccccc1[N+](=O)[O-] 604449370 IWHFXTHQXDGIJA-UHFFFAOYSA-N 473.407 5.192 5 20 JKBD COc1cc(C(=O)Nc2nnc(-c3ccc(C)cc3C)s2)c([N+](=O)[O-])cc1OCc1cscn1 604449563 JJJLXDLPQYGFCD-UHFFFAOYSA-N 497.558 5.027 5 20 JKBD COc1cccc(N2CC[C@H](NC(=O)c3ccc(Oc4ccc(Cl)cc4[N+](=O)[O-])c(OC)c3)C2)c1 609106329 KKSAZTURBKTOCW-SFHVURJKSA-N 497.935 5.066 5 20 JKBD CC1CCN(c2ccc(C(=O)Nc3ccc(OC(C)C)cc3C(F)(F)F)cc2[N+](=O)[O-])CC1 609189029 SHFFQHIMMDTGIW-UHFFFAOYSA-N 465.472 5.889 5 20 JKBD Cc1ccc(-c2nn(-c3ccccc3)cc2CN(C)C(=O)c2cc([N+](=O)[O-])cnc2C)cc1C 610869057 OFUPIWROQUYLNB-UHFFFAOYSA-N 455.518 5.040 5 20 JKBD Cc1cc(COc2ccc(C(=O)Nc3ccc([N+](=O)[O-])c(Cl)c3)cc2Br)no1 727712341 VLXZQRNVAYCCGZ-UHFFFAOYSA-N 466.675 5.138 5 20 JKBD C[C@@H](Nc1ccc(C(=O)NCCc2ccc(Br)cc2F)cc1[N+](=O)[O-])c1ccccn1 730971828 CQMLFLLKDZVMJN-CQSZACIVSA-N 487.329 5.037 5 20 JKBD Cc1c(C(=O)O[C@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)nnn1-c1ccc(-c2ccccc2)cc1 731265112 CCKPEEGPMOSGGS-QGZVFWFLSA-N 496.483 5.119 5 20 JKBD Cc1ncc([N+](=O)[O-])cc1C(=O)Nc1nc(-c2cc(C)n(Cc3ccccc3Cl)c2C)cs1 750719873 GDYHMKARKQCIJC-UHFFFAOYSA-N 481.965 5.794 5 20 JKBD CCCCC[C@@H](C)n1c(SCc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)nc2ccccc2c1=O 801024847 ZEDQDDMLZIPYTD-MRXNPFEDSA-N 479.562 5.788 5 20 JKBD O=C(c1ccc(Cl)c(NCc2ccc(Br)c([N+](=O)[O-])c2)c1)N1CCCCC1 864002969 AZJUWWXKIJSPKU-UHFFFAOYSA-N 452.736 5.249 5 20 JKBD CCc1ccc(N(C(C)=O)c2nc(COC(=O)[C@H](C)Sc3ccc([N+](=O)[O-])cc3)cs2)cc1 916522503 APWSQGSOJJFXOI-HNNXBMFYSA-N 485.587 5.522 5 20 JKBD C[C@@H](Cc1ccccc1Cl)NC(=O)c1ccccc1NC(=O)c1ccc([N+](=O)[O-])cc1Cl 918580345 OHVBYFZCNMGWKZ-AWEZNQCLSA-N 472.328 5.515 5 20 JKBD Cc1ccc(NC(=O)[C@@H](OC(=O)CCC(=O)c2ccc(F)cc2F)c2ccccc2)c([N+](=O)[O-])c1 919534728 XETGFUFQLXIGSX-DEOSSOPVSA-N 482.439 5.068 5 20 JKBD C[C@@H](Nc1ccc(C(=O)OCc2coc(-c3ccc(F)cc3)n2)cc1[N+](=O)[O-])c1ccccn1 920547409 NZLANYPRMRZEHR-OAHLLOKOSA-N 462.437 5.314 5 20 JKBD O=C(C1CCN(c2cc(Cl)c(C(F)(F)F)cc2[N+](=O)[O-])CC1)N1CCc2ccccc21 920759773 DVFDHBPWDFRKLD-UHFFFAOYSA-N 453.848 5.073 5 20 JKBD C[C@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)O[C@H](C)C(=O)Nc1ccc(Cl)cc1C(F)(F)F 920777758 GCCFZJQLBNGFJX-ZJUUUORDSA-N 495.237 5.258 5 20 JKBD O=C(NC1(c2ccc(NC(=O)c3ccc([N+](=O)[O-])[nH]3)cc2)CCC1)c1ccc(F)c(C(F)(F)F)c1 1790188579 WYAQPJCKWUYFKN-UHFFFAOYSA-N 490.413 5.142 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)c3cccc(-c4cnco4)c3)CCC2)cc1)c1ccc(O)c([N+](=O)[O-])c1 1790619222 STQCHGNCTAVEJI-UHFFFAOYSA-N 498.495 5.017 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)c3cc(C(F)(F)F)c[nH]3)CCC2)cc1)c1cc(F)cc([N+](=O)[O-])c1 1790696692 YOIJPPVRKYJBIE-UHFFFAOYSA-N 490.413 5.142 5 20 JKBD O=C(NC1(c2ccc(NC(=O)c3ccccc3N3CCCCC3)cc2)CCC1)c1ccc([N+](=O)[O-])o1 1790783993 WZTXWORBRQHNOW-UHFFFAOYSA-N 488.544 5.240 5 20 JKBD Cc1ccc(C(=O)Nc2ccc(C3(NC(=O)c4ccc([N+](=O)[O-])o4)CCC3)cc2)c(Cl)c1 1792111517 AGVNCIQHZCINOP-UHFFFAOYSA-N 453.882 5.211 5 20 JKBD O=C(c1cc2cc([N+](=O)[O-])ccc2s1)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)C13CCC(CC1)CC3)C2 1801208859 UMZRQWBJYHKDBW-IPMKCRKTSA-N 467.591 5.032 5 20 JKBD CC1(C)CCC(CC(=O)NC[C@@H]2CCN(C(=O)c3ccc([N+](=O)[O-])cc3F)[C@H]2c2cccnc2)CC1 1808903403 NDHUXIAHPBRCQM-CPJSRVTESA-N 496.583 5.055 5 20 JKBD CCCCCc1ccc(CC(=O)N2CCCC[C@@H]2c2cc(NC(=O)c3ccc([N+](=O)[O-])o3)n[nH]2)cc1 1814312249 KZWAPJCTFCZQRE-OAQYLSRUSA-N 493.564 5.192 5 20 JKBD O=C(c1cccc(F)c1Cl)N1CCC([C@H]2CCCCN2C(=O)c2cc(F)cc([N+](=O)[O-])c2)CC1 1830618382 YYYIRGNPFGROIF-OAQYLSRUSA-N 491.922 5.074 5 20 JKBD CCCCC[C@H](C)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)Cc2ccc([N+](=O)[O-])cc2F)CC1 1831467725 YIMMRINHZDMNPR-YADARESESA-N 475.605 5.113 5 20 JKBD C[C@H](C(=O)N1CCCC[C@@H]1C1CCN(C(=O)CSc2ccccc2[N+](=O)[O-])CC1)c1ccccc1 1832897617 GJIKNMSIYIJZDX-NZQKXSOJSA-N 495.645 5.110 5 20 JKBD O=C(c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1)N1CCN(Cc2cccs2)CC1 11239944 IWBHHOCSFNJPPM-UHFFFAOYSA-N 457.939 5.060 5 20 JKBD C[C@H](OC(=O)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1)C(=O)Nc1c(F)cccc1F 16906086 CRLJSHBOIPAWKB-LBPRGKRZSA-N 476.819 5.503 5 20 JKBD C[C@@H](Sc1nc2ccccc2c(=O)n1C1CCCC1)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 17664384 NGBMHBZTYDIDET-CQSZACIVSA-N 463.519 5.323 5 20 JKBD COCCN(C(=O)c1oc2ccc(F)cc2c1C)c1nc(-c2ccc([N+](=O)[O-])cc2)cs1 20677141 LNYFNFAKXSCXIV-UHFFFAOYSA-N 455.467 5.205 5 20 JKBD O=C(CSCc1ccc(Cl)cc1)Nc1c(Br)cc([N+](=O)[O-])cc1Br 20971611 PDTODAZWAYHARD-UHFFFAOYSA-N 494.592 5.645 5 20 JKBD Cc1cccc(-n2ccnc2S[C@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2C(F)(F)F)c1C 21609516 AODBOCFVTABIEO-CQSZACIVSA-N 464.469 5.535 5 20 JKBD Cc1c(NC(=O)[C@H](C)Sc2nc3ccc(Cl)cc3c(=O)n2CC(C)C)cccc1[N+](=O)[O-] 22054341 FZLZWYCQGIYQNO-AWEZNQCLSA-N 474.970 5.042 5 20 JKBD Cc1csc(Sc2ccc(C(=O)N3CCC([C@H](O)c4ccccc4)CC3)cc2[N+](=O)[O-])n1 23383464 XDHLOKBWKZJHLG-OAQYLSRUSA-N 469.588 5.097 5 20 JKBD CC(=O)N(c1nc(COC(=O)c2ccc([N+](=O)[O-])s2)cs1)c1c(C)cc(C)cc1Cl 25041263 VVFIHNCPUWIXQL-UHFFFAOYSA-N 465.940 5.425 5 20 JKBD COc1ccc(NC(=O)CCSc2nnc(-c3cccs3)n2Cc2ccccc2)c([N+](=O)[O-])c1 26220873 HIJCYYJRVCUBNV-UHFFFAOYSA-N 495.586 5.093 5 20 JKBD O=C1CCc2cc(F)c(NC(=O)c3cc([N+](=O)[O-])ccc3Sc3ccc(Cl)cc3)cc2N1 33217844 BLVIWWCNDJGSDS-UHFFFAOYSA-N 471.897 5.676 5 20 JKBD Cc1sc2nc(S[C@H](C)C(=O)Nc3ccc([N+](=O)[O-])cc3Cl)n(C(C)C)c(=O)c2c1C 36821082 GCKRZDCUEIGNCC-GFCCVEGCSA-N 480.999 5.337 5 20 JKBD Cc1cccc(COc2ccc(NC(=O)Cn3c4ccccc4c(=O)c4ccccc43)c(C)c2)c1 78554834 JZHJIIJJRKRGMG-UHFFFAOYSA-N 462.549 5.989 5 20 JKBD Cc1ccc(-c2csc(NC(=O)c3cccnc3SCc3c(C)noc3C)n2)cc1[N+](=O)[O-] 105353134 OKBUSGAOBIIVGD-UHFFFAOYSA-N 481.559 5.571 5 20 JKBD Cc1nc(-c2cccc(NC(=O)Cc3cn(-c4ccccc4)nc3-c3ccc([N+](=O)[O-])cc3)c2)oc1C 108851169 OPGRZXRQDXHJTI-UHFFFAOYSA-N 493.523 5.901 5 20 JKBD COc1cc(CN(C)C(=O)c2ccccc2C(=O)c2ccc(SC)c([N+](=O)[O-])c2)ccc1SC 477828667 QKLINUPZZJURNM-UHFFFAOYSA-N 496.610 5.550 5 20 JKBD O=C(Nc1ccc(Oc2ncc(Cl)cc2Cl)cc1)c1ccn(-c2cccc([N+](=O)[O-])c2)n1 485713259 ZFCRHGLVRRQOPN-UHFFFAOYSA-N 470.272 5.527 5 20 JKBD CC[C@@H](C)n1c(S[C@@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)nnc1-c1ccccc1 504312641 ABGWWEFZMNKSON-CABCVRRESA-N 450.524 5.728 5 20 JKBD Cc1nn(Cc2ccc(C(=O)N(Cc3ccc(Br)cc3)C(C)C)cc2)c(C)c1[N+](=O)[O-] 510094130 QKFCAKGNTYAJQT-UHFFFAOYSA-N 485.382 5.270 5 20 JKBD COc1cccc([C@@H](C)N[C@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Br)c2ccccc2)c1 511014598 MSERGHPFFUEAOQ-QRQCRPRQSA-N 484.350 5.397 5 20 JKBD CC(C)Oc1ccc([N+](=O)[O-])cc1CN1C(=O)[C@H](c2cccs2)N(Cc2ccccc2)C1=O 511082988 WGOXZXXAORCXQC-QFIPXVFZSA-N 465.531 5.149 5 20 JKBD COc1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2Sc2ccccc2)cc1OCc1ccncc1 512352467 MWRZVFCRTJWCMQ-UHFFFAOYSA-N 487.537 5.981 5 20 JKBD Cn1cc(C(=O)Nc2nc(-c3ccc(F)c(Cl)c3)cs2)c(-c2ccc([N+](=O)[O-])cc2)n1 512815099 PSOMAMNHJFSQEV-UHFFFAOYSA-N 457.874 5.164 5 20 JKBD C[C@H](Nc1ccc(C(=O)N2CCCC[C@H]2c2nc3ccccc3n2C)cc1[N+](=O)[O-])c1ccccn1 517751473 JOFCSGPLDCZWMZ-UUOWRZLLSA-N 484.560 5.417 5 20 JKBD Cc1nn(C)c2nc(-c3ccccc3)cc(C(=O)Nc3nc(-c4cccc([N+](=O)[O-])c4)cs3)c12 518191458 DGVLSEAFTAXVEQ-UHFFFAOYSA-N 470.514 5.228 5 20 JKBD Cc1nn(Cc2ccc(Cl)cc2)c2sc(C(=O)N3CCc4ccc([N+](=O)[O-])cc43)cc12 589980529 RIKOHGWSSOEUHK-UHFFFAOYSA-N 452.923 5.219 5 20 JKBD COc1ccc(CNC(=O)C/C(=C\c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)cc1OC 597994463 YWHWYGULSWJJJF-CPNJWEJPSA-N 489.553 5.469 5 20 JKBD NC(=O)Nc1cccc(NC(=O)C/C(=C/c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)c1 599770222 HLDDPDWGBAUZMA-VBKFSLOCSA-N 473.514 5.265 5 20 JKBD C[C@@H](CCO)n1c(C(F)(F)F)nc2cc(NCc3ccc(C(F)(F)F)cc3[N+](=O)[O-])ccc21 600860670 MPXLNWMNBMAPSP-NSHDSACASA-N 476.377 5.538 5 20 JKBD O=C(C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)NC[C@@H]1COc2ccccc2O1 603461301 SNEWFTWAEPTVOU-ITICKHJUSA-N 487.537 5.091 5 20 JKBD COc1cc(C(=O)NCc2cccc(CN(C)C)c2)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 603575874 BTFFTSYSELFTGK-UHFFFAOYSA-N 469.925 5.041 5 20 JKBD COC(=O)c1sc2[nH]c(/C=C/c3ccc(-c4ccc([N+](=O)[O-])cc4Cl)o3)nc(=O)c2c1C 603784843 TWJPVOZOKTYCBL-VMPITWQZSA-N 471.878 5.072 5 20 JKBD C[C@H](NC(=O)N(CCCN(C)C)Cc1ccc(Cl)c(Cl)c1)c1cccc([N+](=O)[O-])c1 609211757 SIVHUIHMKHRXQC-HNNXBMFYSA-N 453.370 5.126 5 20 JKBD C[C@@H]([C@@H]1C[C@H]2CC[C@H]1C2)n1c(SCC(=O)N(C)c2ccc([N+](=O)[O-])cc2)nnc1-c1ccco1 619816338 DRPKITYFGFLMSY-BOSXTWCSSA-N 481.578 5.199 5 20 JKBD CCOc1cc(NC(=O)N2CCC[C@@H]2c2ccccc2C(F)(F)F)c([N+](=O)[O-])cc1OCC 728116817 AHMOZPURNWJELI-QGZVFWFLSA-N 467.444 5.780 5 20 JKBD C[C@@H](Nc1ccc(C(=O)Nc2ccc(Oc3ccc(F)cc3)cn2)cc1[N+](=O)[O-])c1ccccn1 729379651 VJOVJSZBZONMHK-MRXNPFEDSA-N 473.464 5.742 5 20 JKBD CC(C)(C)OC(=O)Nc1ccc(F)c(NC(=O)c2csc(-c3ccc([N+](=O)[O-])cc3)n2)c1 747639679 PMRLZCLNPREBEJ-UHFFFAOYSA-N 458.471 5.457 5 20 JKBD CC(C)(C)C[C@H](NC(=O)COC(=O)c1csc(-c2ccc([N+](=O)[O-])cc2)n1)c1ccc(F)cc1 747955494 SMRXYACCFBIWHE-IBGZPJMESA-N 485.537 5.308 5 20 JKBD C[C@H](OC(=O)c1occc1CSc1ccccc1)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 792738867 YNQOCWZGDPTVID-AWEZNQCLSA-N 451.460 5.448 5 20 JKBD Cc1csc(SCc2ccccc2C(=O)Nc2nc(-c3cccc([N+](=O)[O-])c3)cs2)n1 871590153 HEKBLNGPZYTVFT-UHFFFAOYSA-N 468.585 6.028 5 20 JKBD CC(C)COc1ccc(N[C@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2C(F)(F)F)cc1Cl 914794378 ZKVRHLILUOCPQN-GFCCVEGCSA-N 459.852 5.741 5 20 JKBD COc1ccc(NC(=O)c2cc(OCC(F)(F)F)ccc2[N+](=O)[O-])cc1NC(=O)OC(C)(C)C 915857864 RFLSCPKPJCDMLN-UHFFFAOYSA-N 485.415 5.144 5 20 JKBD O=C(Nc1ccc(NC(=O)c2ccc(Cl)c([N+](=O)[O-])c2)c(C(F)(F)F)c1)c1ccccc1 915869576 CNWWITAIXNUKLI-UHFFFAOYSA-N 463.799 5.772 5 20 JKBD O=C(Cn1ccc2ccc([N+](=O)[O-])cc21)Nc1ccc(C2(NC(=O)c3ccsc3)CCC2)cc1 1786275908 PQCCOWWOSCNVRJ-UHFFFAOYSA-N 474.542 5.059 5 20 JKBD CN(C)c1ccc([N+](=O)[O-])c(C(=O)NC2(c3ccc(NC(=O)[C@H](F)c4ccccc4)cc3)CCC2)c1 1786614452 NQQBRKXGHMKZAQ-XMMPIXPASA-N 490.535 5.119 5 20 JKBD CNc1ccc(C(=O)Nc2ccc(C3(NC(=O)CSc4ccccc4[N+](=O)[O-])CCC3)cc2)cc1 1788002459 YWRRRNSQBYZTSS-UHFFFAOYSA-N 490.585 5.177 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)c3cccc4ccoc34)CCC2)cc1)c1cc(F)cc([N+](=O)[O-])c1 1790699496 RTIIZURGHOHLHR-UHFFFAOYSA-N 473.460 5.542 5 20 JKBD Cc1cc(C(=O)NC2(c3ccc(NC(=O)CSc4ccccc4[N+](=O)[O-])cc3)CCC2)ccc1O 1791523186 LQFDQHCZOXYZRB-UHFFFAOYSA-N 491.569 5.149 5 20 JKBD C[C@@H](C(=O)Nc1ccc(C2(NC(=O)c3nc4cc([N+](=O)[O-])ccc4[nH]3)CCC2)cc1)c1ccccc1 1792313485 YLUZWPGIRPBTKP-QGZVFWFLSA-N 483.528 5.023 5 20 JKBD CC(C)[C@@H](C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CCc1cccc([N+](=O)[O-])c1)c1ccc(Cl)cc1 1793943857 LUMBHAVFIKXRQK-ZGXDEKTJSA-N 498.023 5.259 5 20 JKBD COc1ccc(Cl)cc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cc3cc([N+](=O)[O-])ccc3s1)C2 1799777268 KDPRYWAVCFBTMG-BJWYYQGGSA-N 499.976 5.037 5 20 JKBD CC1(C)CCC(CC(=O)Nc2cc([C@@H]3CCCCN3C(=O)Cc3cccc([N+](=O)[O-])c3)[nH]n2)CC1 1820976556 APPIKVMJGSUUOM-QFIPXVFZSA-N 481.597 5.159 5 20 JKBD CNc1ccc(C(=O)N2CCCC[C@H]2C2CCN(C(=O)c3cc(Cl)cc([N+](=O)[O-])c3C)CC2)cc1 1826853368 MDFCNGJXRIBKQV-QHCPKHFHSA-N 499.011 5.145 5 20 JKBD O=C(C[C@H]1CCCCO1)N1CCC([C@H]2CCCCN2C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)CC1 1831059030 BCGDUKPUYPHHKK-FGZHOGPDSA-N 499.633 5.002 5 20 JKBD CC[C@H](C)CC(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)CC1 1831059937 LOAPNHHMUMQVHC-UWJYYQICSA-N 471.623 5.479 5 20 JKBD Cc1ncccc1C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)CC1 1831060315 ROTFXHOAOKNPIX-QFIPXVFZSA-N 492.601 5.060 5 20 JKBD O=C(c1ccc(O)cc1)N1CCC([C@@H]2CCCCN2C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)CC1 1831060664 DFYZPOMMIRUFEG-QFIPXVFZSA-N 493.585 5.062 5 20 JKBD O=C(OCc1ncc(-c2ccccc2)o1)c1ccccc1C(=O)c1ccc(Cl)c([N+](=O)[O-])c1 11029292 KLVYPJBZPLIURY-UHFFFAOYSA-N 462.845 5.491 5 20 JKBD Cc1ccc(NC(=O)[C@@H](OC(=O)c2csc(-c3ccccc3)n2)c2ccccc2)c([N+](=O)[O-])c1 17984163 JOLVPWZBTWYENR-QFIPXVFZSA-N 473.510 5.564 5 20 JKBD C[C@@H](OC(=O)c1ccccc1-c1ncc(-c2ccccc2)o1)C(=O)Nc1ccccc1[N+](=O)[O-] 19165085 VBNVKCVEJMCBJC-MRXNPFEDSA-N 457.442 5.101 5 20 JKBD CCn1c(SCC(=O)Nc2ccc(Br)cc2F)nc2cc3ccccc3cc2c1=O 22177798 HLWCRHBABGFLJI-UHFFFAOYSA-N 486.366 5.202 5 20 JKBD COc1ccccc1-n1c(S[C@@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2C)nnc1-c1cccs1 23341455 VUOKGVLAUMCCOI-HNNXBMFYSA-N 495.586 5.340 5 20 JKBD Cc1ccc(C(=O)C2CCN(C(=O)c3ccc(Sc4nc(C)cs4)c([N+](=O)[O-])c3)CC2)c(C)c1 24452502 HNEQHRQFBXETMM-UHFFFAOYSA-N 495.626 5.863 5 20 JKBD CC(C)c1ccc(CSc2nnc(SCC(=O)Nc3cc([N+](=O)[O-])ccc3F)s2)cc1 24495297 HCZXAAVIMMMNEY-UHFFFAOYSA-N 478.596 5.732 5 20 JKBD COc1cc(F)ccc1NC(=O)c1ccccc1Sc1ccc(C(F)(F)F)cc1[N+](=O)[O-] 26024271 RUYLFOCKFQMWQI-UHFFFAOYSA-N 466.412 6.165 5 20 JKBD C[C@@H](NC(=O)C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)c1ccc2c(c1)OCO2 27692038 SYCYDGYXCXMCGQ-BKAYVGFPSA-N 487.537 5.741 5 20 JKBD CS(=O)(=O)c1ccc(Sc2nnc(-c3ccccc3)n2-c2ccc(Cl)cc2)c([N+](=O)[O-])c1 31527941 MXMYAVIWWQVYNS-UHFFFAOYSA-N 486.962 5.051 5 20 JKBD CCOc1cc(C(=O)Nc2ncc(Cc3ccc(C)c(Cl)c3)s2)c([N+](=O)[O-])cc1OC 45869538 WVCMZERWYJSWHG-UHFFFAOYSA-N 461.927 5.264 5 20 JKBD Cc1cccc(NC(=O)Nc2cccc(CNC(=O)Cn3c4ccccc4c(=O)c4ccccc43)c2)c1 68708933 MQOWGEKAQODMHN-UHFFFAOYSA-N 490.563 5.424 5 20 JKBD COc1cc(C(=O)N[C@H](c2ccc(C(C)C)cc2)c2cccs2)c([N+](=O)[O-])cc1OC(F)F 115378822 MCHSBWLUCLEUKT-OAQYLSRUSA-N 476.501 5.909 5 20 JKBD CCn1c(SCc2csc(CC(=O)Nc3ccccc3)n2)nc2cc3ccccc3cc2c1=O 115876532 NGJORICGFSHTSZ-UHFFFAOYSA-N 486.622 5.500 5 20 JKBD COc1ccc(OC)c(-c2nn(-c3ccccc3)cc2C(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)c1 248176655 ATCUPVLXOJKYTQ-UHFFFAOYSA-N 478.892 5.370 5 20 JKBD CC[C@H](C)[C@@H](NC(=O)c1ccc(N[C@H](C)c2ccccn2)c([N+](=O)[O-])c1)c1nc2ccccc2[nH]1 410078164 QGLDFKXGBHXJAG-OBWXTZQISA-N 472.549 5.556 5 20 JKBD CC(=O)Nc1cccc(NC(=O)C/C(=C\c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)c1C 484277443 BUWRZKNWABWWGU-XMHGGMMESA-N 486.553 6.041 5 20 JKBD Cc1noc([C@H]2CCCN(C(=O)C/C(=C\c3ccc([N+](=O)[O-])cc3)c3nc4ccccc4s3)C2)n1 509150544 IICOJDGBDKUFRB-DYGKOUCMSA-N 489.557 5.233 5 20 JKBD CCOC(=O)c1cc(CC)sc1NC(=O)c1ccc(N[C@H](C)c2ccccn2)c([N+](=O)[O-])c1 512549192 NFGJFDOJPLLGPS-CQSZACIVSA-N 468.535 5.216 5 20 JKBD CC(C)[C@H](CNC(=O)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1)Nc1ccccc1 514939627 TZQOSJWXQHXAFY-FQEVSTJZSA-N 478.515 5.083 5 20 JKBD COc1ccc([C@@H]2Nc3cc(Cl)ccc3C(=O)N2C)cc1OCc1ccc([N+](=O)[O-])cc1 515598103 WMORZIAKGRMMKS-JOCHJYFZSA-N 453.882 5.032 5 20 JKBD C[C@H]1CCCCN1CCCNC(=O)C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1 518747917 QCSSLUATHFDFNR-AJNNJPABSA-N 478.618 5.516 5 20 JKBD COc1cc(CNCc2ccc(-n3cnc4ccccc43)cc2)c([N+](=O)[O-])cc1OCC(F)(F)F 518784990 DOBGCOWRYKMDHT-UHFFFAOYSA-N 486.450 5.173 5 20 JKBD CC(=O)NC[C@@H]1CCCN(C(=O)c2c3c(nc4ccccc24)/C(=C/c2ccc([N+](=O)[O-])cc2)CCC3)C1 519206626 LLPSMTOPMSYXMQ-IFRHDIGASA-N 498.583 5.008 5 20 JKBD COC(=O)[C@@H](c1ccc(Cl)c(Cl)c1)N(C)C(=O)c1csc(-c2ccc([N+](=O)[O-])cc2)n1 523419907 BKRJSCXWBWCHCQ-QGZVFWFLSA-N 480.329 5.011 5 20 JKBD CN(C)C(=O)C[C@H](NCc1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1)c1ccccc1 551229100 HVDIBFOTCIWJRP-NRFANRHFSA-N 453.926 5.350 5 20 JKBD CN1C/C(=C/c2ccc(-c3ccccc3[N+](=O)[O-])s2)c2nc3ccccc3c(C(=O)O)c2C1 589333569 PZLHHCVFWHHZKI-QINSGFPZSA-N 457.511 5.556 5 20 JKBD O=C(C1CCN(c2ccccc2[N+](=O)[O-])CC1)N1CCCC[C@@H]1c1ccc(C(F)(F)F)cc1 608850577 ASNUAJPLNLRBTA-HXUWFJFHSA-N 461.484 5.584 5 20 JKBD O=C(c1ccc(C(=O)N2CCC(c3ccccc3)CC2)c([N+](=O)[O-])c1)N1CCC(c2ccccc2)CC1 609043876 ATTCDBBAMURJOM-UHFFFAOYSA-N 497.595 5.634 5 20 JKBD COc1cc(CS(=O)(=O)Cc2ccc(C(C)C)cc2C(C)C)c([N+](=O)[O-])cc1OC(F)F 609224438 CZCRVRTZNWDPRV-UHFFFAOYSA-N 471.522 5.567 5 20 JKBD C[C@H](NCc1ccc(-c2ccc([N+](=O)[O-])cc2Br)o1)c1ccc2c(c1)CCC(=O)N2 726606869 DYAHJGBVRRQENZ-ZDUSSCGKSA-N 470.323 5.353 5 20 JKBD CC(=O)N(c1nc(COC(=O)c2c(Cl)cccc2[N+](=O)[O-])cs1)c1c(C)cc(C)cc1Cl 730645559 YFUJZGDZYVUQHD-UHFFFAOYSA-N 494.356 6.017 5 20 JKBD Cc1ccc(C(=O)N2C[C@H](C)C[C@@H](C)C2)cc1NC(=O)c1cc([N+](=O)[O-])ccc1Br 751093064 KDCKNMVIMPORPJ-ZIAGYGMSSA-N 474.355 5.036 5 20 JKBD Cc1nc(COC(=O)c2c3c(nc4ccccc24)/C(=C/c2ccc([N+](=O)[O-])cc2)CCC3)no1 783179883 PRHHJMOECBXAHF-GHRIWEEISA-N 456.458 5.068 5 20 JKBD CC(C)Cn1cc([C@H]2N(C(=O)c3cc([N+](=O)[O-])ccc3SC3CCCC3)CC23CCOCC3)cn1 849539524 VKRQZMPIQKXYCA-XMMPIXPASA-N 498.649 5.476 5 20 JKBD CN(Cc1ccc(Cl)s1)C(=O)c1ccccc1NC(=O)c1ccc([N+](=O)[O-])cc1Cl 916564661 ULBKZXZYQSURJZ-UHFFFAOYSA-N 464.330 5.488 5 20 JKBD O=C(Cc1cc([N+](=O)[O-])ccc1F)Nc1ccc(C2(NC(=O)c3ccc4cc[nH]c4c3)CCC2)cc1 1786671270 ZYJPUYGPLATGKQ-UHFFFAOYSA-N 486.503 5.206 5 20 JKBD O=C(NC1(c2ccc(NC(=O)c3cc(-c4ccccc4)no3)cc2)CCC1)c1ccc(O)c([N+](=O)[O-])c1 1789782153 MKDXGSXXNZLBBA-UHFFFAOYSA-N 498.495 5.017 5 20 JKBD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CCc1cccc([N+](=O)[O-])c1)c1ccc(-c2ccccc2)cc1 1793945077 FDXGNROMWQXAOQ-OOSCYNTBSA-N 483.568 5.146 5 20 JKBD Cc1c(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)[C@@H]2CCC[C@H]4CCCC[C@@H]42)C3)cc(Cl)cc1[N+](=O)[O-] 1800712169 YAKOQGIQMMRCFH-FKOZLKKJSA-N 488.028 5.415 5 20 JKBD Cc1ccc2cc(C(=O)N3[C@H]4CC[C@@H]3C[C@H](NC(=O)/C=C/c3ccccc3[N+](=O)[O-])C4)sc2c1 1801086091 SXXNPFGTOVQQKF-IKNLRRFCSA-N 475.570 5.083 5 20 JKBD CC[C@@H](C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc2cc([N+](=O)[O-])ccc2s1)c1ccccc1 1801206881 BENRDURFFPRFLN-XAPVIXHLSA-N 477.586 5.255 5 20 JKBD O=C(c1ccncc1-c1ccccc1)N1CC2(CCCN2C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)C1 1845739333 JUTAWUCHWZGFIU-UHFFFAOYSA-N 498.564 5.002 5 20 JKBD CC[C@H]1CCc2sc(-c3nnc(S[C@H](C)c4nnc(-c5ccc([N+](=O)[O-])cc5)o4)n3C)cc2C1 17717214 YGCQYWPHBYMQIP-KGLIPLIRSA-N 496.618 5.870 5 20 JKBD C[C@H](OC(=O)c1cccc(NC(=O)OC(C)(C)C)c1)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 18026454 WDQPGHYXLPAIJE-LBPRGKRZSA-N 497.426 5.145 5 20 JKBD Cc1ccccc1-n1c(S[C@@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)nnc1-c1ccncc1 20789053 KQRIDUJNPSDMFA-HNNXBMFYSA-N 494.964 5.319 5 20 JKBD O=C(Nc1ncc(Cc2ccc(Br)cc2)s1)c1ccc([N+](=O)[O-])cc1Cl 22191380 XZLFSJKMLVJNPE-UHFFFAOYSA-N 452.717 5.310 5 20 JKBD CCOc1ccc([C@H](CNC(=O)c2ccccc2[N+](=O)[O-])c2c[nH]c3ccccc23)cc1OC 24113572 XZGRDHHFFOKHEX-FQEVSTJZSA-N 459.502 5.045 5 20 JKBD CCn1c(SCCC(=O)Nc2ccc([N+](=O)[O-])cc2OC)nnc1-c1ccc(C(C)(C)C)cc1 26371492 UBRYACDYYCVCQL-UHFFFAOYSA-N 483.594 5.300 5 20 JKBD CCOc1cc([N+](=O)[O-])c(C(=O)NC[C@@H](c2ccc(OC)cc2)c2c[nH]c3ccccc23)cc1OC 105002318 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COc1ccccc1NC(=O)Nc1cc(NC(=O)c2ccc(SC)c([N+](=O)[O-])c2)ccc1OC 509434518 DSNWRKDMOMDFJA-UHFFFAOYSA-N 482.518 5.230 5 20 JKBD C[C@@H](Nc1ccc(C(=O)N2CCCc3cc(OC(F)F)ccc32)cc1[N+](=O)[O-])c1ccccn1 509653333 ACABRUNSOOLKGM-OAHLLOKOSA-N 468.460 5.357 5 20 JKBD CCCN(C(=O)c1cc(OC)c(OCc2cscn2)cc1[N+](=O)[O-])[C@H]1CCc2ccccc2C1 511383726 OKRYZOURBGPIAH-FQEVSTJZSA-N 481.574 5.049 5 20 JKBD CN(CC(=O)Nc1ccccc1)C(=O)c1ccc(Sc2nc3ccccc3s2)c([N+](=O)[O-])c1 514540559 BSMJQNCMTDAJKF-UHFFFAOYSA-N 478.555 5.066 5 20 JKBD CC[C@@H](NCc1ccc(-c2ccccc2[N+](=O)[O-])o1)c1ccccc1OCC(=O)N1CCCC1 518263580 ZGPRCXNYQVJEOO-JOCHJYFZSA-N 463.534 5.097 5 20 JKBD COc1cccc(OC)c1Oc1ccc(CNCc2ccc(-c3ccccc3[N+](=O)[O-])o2)cn1 520211538 XPNRTFFLHASZQQ-UHFFFAOYSA-N 461.474 5.349 5 20 JKBD Cc1nn(-c2ccccc2)cc1CCCNC(=O)c1ccc(N[C@@H](C)c2ccccn2)c([N+](=O)[O-])c1 551928000 CHBPEJMDVWAFOI-FQEVSTJZSA-N 484.560 5.020 5 20 JKBD COc1ccc(NC(=O)CSc2nnc(-c3ccco3)n2[C@@H](C)[C@@H]2C[C@H]3CC[C@H]2C3)c([N+](=O)[O-])c1 594534405 FWSWZYSPDJUTHN-OVWQWFNUSA-N 497.577 5.183 5 20 JKBD COCCN(C(=O)CSc1ccc(C)cc1C)c1nc(-c2ccc([N+](=O)[O-])cc2)cs1 603461417 PSASETIQWZIWLI-UHFFFAOYSA-N 457.577 5.107 5 20 JKBD CCOc1cc([N+](=O)[O-])c(C(=O)Nc2cc(-c3ccccc3OC)nn2-c2ccccc2)cc1OC 603760862 VICWVJSWCWCSEI-UHFFFAOYSA-N 488.500 5.116 5 20 JKBD O=C(C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1)N1CCC[C@H]1C1CCCCC1 603977367 UCGJLVOSQUYDQQ-IBGZPJMESA-N 453.505 5.401 5 20 JKBD O=C(C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1)N1CCC2(CCCCC2)CC1 608808581 ALNAPKLJFVKXDF-UHFFFAOYSA-N 453.505 5.403 5 20 JKBD O=[N+]([O-])c1ccc(-c2noc(CNc3cc4c(cc3Sc3ccccc3)OCCO4)n2)cc1 725795510 HESAPTACQNEVOY-UHFFFAOYSA-N 462.487 5.179 5 20 JKBD COc1cc(C(=O)OCc2csc(N(C(C)=O)c3c(C)cc(C)cc3C)n2)ccc1[N+](=O)[O-] 725944707 ARZMQYGFPVMZRV-UHFFFAOYSA-N 469.519 5.027 5 20 JKBD COc1ccc(C[C@H](N[C@H](C)C(=O)Nc2cc([N+](=O)[O-])ccc2Cl)c2ccccc2)cc1OC 727464515 TYVWSALCLNAARL-IERDGZPVSA-N 483.952 5.166 5 20 JKBD CCCS(=O)(=O)c1ccccc1S[C@@H](C)C(=O)N(CC1CC1)c1ccc(Cl)c([N+](=O)[O-])c1 730488755 PLODNVPYFDYQCX-HNNXBMFYSA-N 497.038 5.356 5 20 JKBD O=C(NCc1ccc2c(c1)OCO2)[C@@H](Sc1nc2ccc([N+](=O)[O-])cc2s1)c1ccccc1 896112873 PHDVHXYGCLXCTA-NRFANRHFSA-N 479.539 5.083 5 20 JKBD Cc1cc(C)n(Cc2cccc(-c3noc(-c4ccnc(-c5ccccc5)c4[N+](=O)[O-])n3)c2)n1 904524379 GJBOZNNSMHVYFO-UHFFFAOYSA-N 452.474 5.235 5 20 JKBD CCCn1cc(NC(=O)c2ccccc2Sc2ccc(C(F)(F)F)cc2[N+](=O)[O-])ccc1=O 919846417 MBYHKJUPWCHHKN-UHFFFAOYSA-N 477.464 5.589 5 20 JKBD O=C(NCCOC(=O)[C@@H](Sc1ccccc1)c1ccccc1)c1ccc([N+](=O)[O-])cc1Cl 920149167 TXXNQUFOCVELKJ-NRFANRHFSA-N 470.934 5.055 5 20 JKBD O=C(/C=C/c1ccc([N+](=O)[O-])o1)Nc1ccc(C2(NC(=O)c3cccc4cccnc34)CCC2)cc1 1786204765 QYYRDUXYPNVSAA-ACCUITESSA-N 482.496 5.197 5 20 JKBD CCOc1ccccc1C(=O)NC1(c2ccc(NC(=O)c3ccc([N+](=O)[O-])cc3F)cc2)CCC1 1790626508 YJUCOTMBIGILLP-UHFFFAOYSA-N 477.492 5.194 5 20 JKBD COc1cc(F)c(C(=O)NC2(c3ccc(NC(=O)c4cccc(F)c4[N+](=O)[O-])cc3)CCC2)c(F)c1 1790698496 BLTDGMUUSNAUDS-UHFFFAOYSA-N 499.445 5.082 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)[C@H]3CC3(F)F)CCC2)cc1)c1cc2cc([N+](=O)[O-])ccc2s1 1791010013 HSCISSYOXFGCNC-QGZVFWFLSA-N 471.485 5.212 5 20 JKBD CC(C)(C)c1ccc(C(=O)Nc2cc([C@H]3CCCCN3C(=O)c3cc(O)cc([N+](=O)[O-])c3)[nH]n2)s1 1818343523 ZIPITUYAMSMOPF-GOSISDBHSA-N 497.577 5.002 5 20 JKBD Cc1c(C(=O)N2CCCC[C@H]2c2cc(NC(=O)c3cccc(F)c3)n[nH]2)cc(Cl)cc1[N+](=O)[O-] 1820491002 ICIHCVKDFIKSKR-IBGZPJMESA-N 485.903 5.039 5 20 JKBD CC(C)(C)c1ccc(C(=O)N2CCC([C@H]3CCCCN3C(=O)c3ccc(O)c([N+](=O)[O-])c3)CC2)s1 1830488246 KOMNTUSUFSCOHQ-LJQANCHMSA-N 499.633 5.207 5 20 JKBD C[C@@H]1CCC[C@@H]1C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)CC1 1831061588 WUPYXDWCMGNBSG-WTNAPCKOSA-N 483.634 5.479 5 20 JKBD CCC(C)(C)C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cc(Br)ccc2[N+](=O)[O-])CC1 1831387162 IAMZOSWJYXXRFE-IBGZPJMESA-N 494.430 5.027 5 20 JKBD Cc1ccc([C@@H](C)C(=O)N2CCCC[C@H]2C2CCN(C(=O)Cc3ccc([N+](=O)[O-])cc3F)CC2)cc1 1831531615 YEOSZVKRJGRUNB-IBVKSMDESA-N 495.595 5.008 5 20 JKBD O=C(Nc1ccccc1-c1nc2ccccc2s1)c1ccc(Br)c([N+](=O)[O-])c1 14604058 NDWYQZOPIZLJDP-UHFFFAOYSA-N 454.305 5.886 5 20 JKBD C[C@H](Sc1ncnc2sc(-c3ccccc3)cc12)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 16048699 CDIHXRWYSJPKJO-ZDUSSCGKSA-N 461.528 6.170 5 20 JKBD C[C@@H](OC(=O)[C@@H](Sc1ccccc1)c1ccccc1)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 16614935 NEBPSCSJPOTIQS-IERDGZPVSA-N 461.499 5.783 5 20 JKBD Cc1noc(C)c1CSCC(=O)O[C@@H](C(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1)c1ccccc1 22621484 JCEITQAVPYEAKE-OAQYLSRUSA-N 489.937 5.009 5 20 JKBD O=C(Nc1ccccc1C(=O)Nc1cccc(C(F)(F)F)c1)c1ccc([N+](=O)[O-])cc1Cl 22990655 BPTSWTVTYZHKPX-UHFFFAOYSA-N 463.799 5.772 5 20 JKBD C[C@@H](c1nnc(SCc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)n1-c1ccccc1)N1CCCCC1 23223591 VKBARWIEDZJAGT-KRWDZBQOSA-N 491.577 5.065 5 20 JKBD CSc1ccc(C(=O)COC(=O)c2ccccc2NC(=O)c2ccc([N+](=O)[O-])cc2Cl)cc1 26908106 GOSCFGCDUZSGEP-UHFFFAOYSA-N 484.917 5.262 5 20 JKBD COc1ccc([C@H](C)N[C@@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2C(F)(F)F)cc1Br 30510219 NEKVYEOFJHIOFB-QWRGUYRKSA-N 490.276 5.063 5 20 JKBD O=C(Nc1ccccc1C(=O)Nc1cnc(-c2ccccc2)nc1)c1ccc([N+](=O)[O-])cc1Cl 247339478 RTRGTPZQYOFHNG-UHFFFAOYSA-N 473.876 5.210 5 20 JKBD COc1cc(CN(C)C(=O)C2CCN(c3ccc(C(F)(F)F)cc3[N+](=O)[O-])CC2)ccc1SC 303004862 PCERSENYLZPOCP-UHFFFAOYSA-N 497.539 5.219 5 20 JKBD COc1cc(C(=O)N2CCC[C@H]2CN2CCCCC2)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 303205793 PVJONSSETCHLIL-IBGZPJMESA-N 473.957 5.140 5 20 JKBD COc1ccc([C@H](NC(=O)c2ccc(Cl)cc2[N+](=O)[O-])c2ccccc2)cc1Br 487360305 ZQOMMKPYCQMCQV-HXUWFJFHSA-N 475.726 5.539 5 20 JKBD CC(=O)N[C@@H](C)CCc1ccc(C(=O)CSc2nc3ccccc3c3nc4ccccc4n23)cc1 495373682 HGXUIAUIKDXRQT-SFHVURJKSA-N 482.609 5.468 5 20 JKBD Cc1ccc(C(=O)N2C[C@H](C)C[C@@H](C)C2)cc1NC(=O)c1csc(-c2ccc([N+](=O)[O-])cc2)n1 498781442 RLMAFTADTVGLLD-HZPDHXFCSA-N 478.574 5.397 5 20 JKBD O=C(c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-])N1CCCc2cc(Br)cc(F)c21 502745490 RTHABACBQLSALQ-UHFFFAOYSA-N 477.208 5.031 5 20 JKBD O=C(Nc1cc([N+](=O)[O-])ccc1OC(F)F)[C@@H]1C[C@H]2CCCC[C@H]2N1C(=O)c1ccc(Cl)cc1 508927861 OVLUKKDLHMXAPU-ZMYBRWDISA-N 493.894 5.262 5 20 JKBD COc1cc(C(=O)N[C@@H]2CCCC[C@H]2c2ccccc2)c([N+](=O)[O-])cc1OCc1cscn1 512748704 JUMXHPFQACACQR-AZUAARDMSA-N 467.547 5.095 5 20 JKBD COc1ccc([C@@H](NC(=O)CSCc2ccc(OC)c([N+](=O)[O-])c2)c2ccc(C)cc2)cc1 512874409 NQWVCKSQMNLUER-VWLOTQADSA-N 466.559 5.059 5 20 JKBD O=C(c1ccc(Sc2nc3ccccc3s2)c([N+](=O)[O-])c1)N1CCC[C@@H]1c1cccnc1 514843302 MSPYEISLSUCSNS-GOSISDBHSA-N 462.556 5.728 5 20 JKBD O=C(N[C@@H]1CCSc2ccc(Cl)cc21)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 520664082 AOAQXKQVZITVHG-QGZVFWFLSA-N 499.942 5.837 5 20 JKBD Cc1ccc(C(=O)Nc2nc3ccc(NC(=O)c4cc([N+](=O)[O-])c(C)s4)cc3s2)s1 522573542 ALMHIXHFTKQPCV-UHFFFAOYSA-N 458.546 5.449 5 20 JKBD CC(C)[C@@H](NC(=O)c1ccc(Sc2nncn2C)c([N+](=O)[O-])c1)c1cccc(C(F)(F)F)c1 523269779 QBADQLRJIGLLGL-GOSISDBHSA-N 479.484 5.020 5 20 JKBD CCOc1cc(C(=O)Nc2ccc(N[C@@H](C)c3ccccc3)c(Cl)c2)c([N+](=O)[O-])cc1OC 524139634 REGLFTZZWJWLAM-HNNXBMFYSA-N 469.925 6.081 5 20 JKBD Cc1cc(Br)cc2c1N(C(=O)Cn1c3ccccc3c(=O)c3ccccc31)CCC2 590458784 OOAIHFHHSKEJNS-UHFFFAOYSA-N 461.359 5.205 5 20 JKBD C[C@@H]([C@@H]1C[C@H]2CC[C@H]1C2)n1c(SCC(=O)Nc2ccccc2[N+](=O)[O-])nnc1-c1ccco1 594533792 CQSOGTKEJIRIIC-QAETUUGQSA-N 467.551 5.174 5 20 JKBD Cc1ccc(C(=O)NCCNc2ccc(C(F)(F)F)cc2[N+](=O)[O-])cc1NC(=O)c1ccccc1 603593197 OHHKZUAQRDKILA-UHFFFAOYSA-N 486.450 5.016 5 20 JKBD O=C(Nc1cc([N+](=O)[O-])ccc1OC(F)F)c1ccc(CNC(=O)C23CC4CC(CC(C4)C2)C3)cc1 603638806 HBMZELFXKSVMFY-UHFFFAOYSA-N 499.514 5.281 5 20 JKBD CC[C@@H](C)c1ccc([C@H](NC(=O)C(=O)Nc2cccc([N+](=O)[O-])c2C)c2cccs2)cc1 603706278 WBXPKZAUTZBWGX-QRQCRPRQSA-N 451.548 5.323 5 20 JKBD C[C@@H]1CCN(C(=O)CCCn2c(=O)oc3cc([N+](=O)[O-])ccc32)c2cc(C(F)(F)F)ccc2S1 603961977 SEDZBPYLZFRIDN-CYBMUJFWSA-N 495.479 5.219 5 20 JKBD Cc1csc(Sc2ccc(C(=O)NC3CCN(Cc4ccc(F)cc4)CC3)cc2[N+](=O)[O-])n1 604175427 CXUUGVFEHWNHTJ-UHFFFAOYSA-N 486.594 5.044 5 20 JKBD O=C(O[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1)c1cnc(-c2ccccn2)s1 727890826 MYRAOZZXVNSQHJ-HXUWFJFHSA-N 494.916 5.304 5 20 JKBD CC[C@H](C)Oc1ccccc1/C=C/C(=O)N(Cc1nnc(-c2cccc([N+](=O)[O-])c2)o1)C(C)C 729825518 JEZRXNZUCPOFCZ-JKGDOXCYSA-N 464.522 5.273 5 20 JKBD O=C(Nc1ccc(OC(=O)c2c[nH]c3cc([N+](=O)[O-])ccc23)cc1)c1ccccc1Br 733036995 LKOFGTCKBQUHEX-UHFFFAOYSA-N 480.274 5.310 5 20 JKBD CC(C)(C)OC(=O)N1CCC[C@@H]1C1CCN(C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)CC1 742507677 PZEZUMCWOHKMOW-GOSISDBHSA-N 459.568 5.061 5 20 JKBD O=C(Nc1ccc(NS(=O)(=O)c2c(Cl)cccc2Cl)cc1)c1cc(F)ccc1[N+](=O)[O-] 751295046 KYTUQFLKTAQZBZ-UHFFFAOYSA-N 484.292 5.094 5 20 JKBD Cc1c(C(=O)NC2(c3ccc(NC(=O)C45CC(F)(C4)C5)cc3)CCC2)cc(Cl)cc1[N+](=O)[O-] 1786425175 WFCBLBZWLLYRHR-UHFFFAOYSA-N 471.916 5.197 5 20 JKBD CN(C)c1ccc([N+](=O)[O-])cc1C(=O)NC1(c2ccc(NC(=O)C(C)(C)C(C)(F)F)cc2)CCC1 1786454924 MABLAUFZYCIGGB-UHFFFAOYSA-N 488.535 5.090 5 20 JKBD O=C(/C=C/c1ccccc1[N+](=O)[O-])NC1(c2ccc(NC(=O)CS[C@H]3CCCCO3)cc2)CCC1 1789550126 SPZQVMFTIYEGOF-SXAZAVRTSA-N 495.601 5.002 5 20 JKBD CC(C)(C)CCCCCC(=O)NC1(c2ccc(NC(=O)c3n[nH]cc3[N+](=O)[O-])cc2)CCC1 1789691755 QEBOHMVTVVTTGB-UHFFFAOYSA-N 455.559 5.062 5 20 JKBD C[C@H](C(=O)Nc1cc([C@H]2CCCCN2C(=O)Cc2cccc([N+](=O)[O-])c2)[nH]n1)c1ccc(Cl)cc1 1814656223 RNYWVFFMDPGQOP-KSFYIVLOSA-N 495.967 5.010 5 20 JKBD CC(C)[C@H](C(=O)N1CCCC[C@@H]1C1CCN(C(=O)/C=C/c2ccc([N+](=O)[O-])o2)CC1)c1ccccc1 1824235578 LXECHXWOUOROGB-ZWDZFUMFSA-N 493.604 5.261 5 20 JKBD O=C(CCc1cccc([N+](=O)[O-])c1)N1CCC([C@H]2CCCCN2C(=O)c2ccc3occc3c2)CC1 1828255877 RYYXBSJOBUKQPM-RUZDIDTESA-N 489.572 5.207 5 20 JKBD O=C(/C=C/c1ccccc1[N+](=O)[O-])N1CCC([C@@H]2CCCCN2C(=O)[C@@H]2C[C@@H]2c2ccccc2)CC1 1831790033 FZVFBHMLMYEUIM-VOYQLMGGSA-N 487.600 5.031 5 20 JKBD O=C(O[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1)c1nc(Cl)ccc1Cl 9645025 NFHIHJYWZTYLTG-SFHVURJKSA-N 480.691 5.487 5 20 JKBD COc1ccccc1/C=C(/C(=O)O[C@@H](C)C(=O)Nc1cccc([N+](=O)[O-])c1C)c1ccccc1 23278405 VBCKPJFTYVDTMS-SAGAUJLNSA-N 460.486 5.023 5 20 JKBD CC(C)CC(=O)Nc1ccc(N[C@@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2ccccc2)cc1 25495046 BVWZZPIWNTXPCE-XMMPIXPASA-N 480.952 6.025 5 20 JKBD Cc1cc(C)n([C@H](C)C(=O)Nc2ccc(NC(=O)c3ccc(Cl)c([N+](=O)[O-])c3)cc2Cl)n1 72038702 FICMQSADPZCAJR-CYBMUJFWSA-N 476.320 5.167 5 20 JKBD COc1cc([N+](=O)[O-])ccc1OCc1csc(N(C(C)=O)c2c(C)cc(C)cc2Cl)n1 72068049 IEVIDNZPFMWRQX-UHFFFAOYSA-N 461.927 5.594 5 20 JKBD O=[N+]([O-])c1ccc(-c2nnc(CSc3nc4ccccc4c4nc5ccccc5n34)o2)cc1 72100238 CBDUBNYZZGUFDX-UHFFFAOYSA-N 454.471 5.286 5 20 JKBD CCCCn1c(-c2ccc(Cl)cc2)nn(CCC(=O)NCc2ccc([N+](=O)[O-])cc2)c1=S 108370102 KYSGXIUACNMTPU-UHFFFAOYSA-N 473.986 5.149 5 20 JKBD COc1cc(F)c(NC(=O)c2ccc(NCc3ccccc3Cl)c([N+](=O)[O-])c2)cc1OC 410030891 SHVSCGMNXAABHX-UHFFFAOYSA-N 459.861 5.269 5 20 JKBD CC(=O)Nc1ccc(C)c(NC(=O)C/C(=C/c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)c1 479116625 ANWGKNMXFCMLHY-UYRXBGFRSA-N 486.553 6.041 5 20 JKBD O=C(Nc1ccc(F)cc1-c1ccc(F)cc1)c1ccc([N+](=O)[O-])cc1I 485788627 PYMFVMLDQKQYAW-UHFFFAOYSA-N 480.208 5.397 5 20 JKBD C[C@@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)Nc1ccc(NC(=O)N2CCCCCC2)cc1 498504061 GVHUGRXNBMOORW-OAHLLOKOSA-N 460.918 5.062 5 20 JKBD Cc1cc(C)n(-c2ccccc2NC(=O)CSc2ccc(C(F)(F)F)cc2[N+](=O)[O-])n1 503653513 DYRUWAAXPCLILI-UHFFFAOYSA-N 450.442 5.147 5 20 JKBD COc1cccc([C@H](CNC(=O)Nc2cccc([N+](=O)[O-])c2C)c2c[nH]c3ccccc23)c1OC 503677961 WUXZBKQCTRNBMJ-FQEVSTJZSA-N 474.517 5.355 5 20 JKBD Cn1cc(C(=O)Nc2nc(-c3ccc(Br)s3)cs2)c(-c2ccc([N+](=O)[O-])cc2)n1 506165244 RYGQOLCTSHYDHJ-UHFFFAOYSA-N 490.364 5.195 5 20 JKBD O=C(CC1CCCC1)NCCNC(=O)c1ccccc1Sc1ccc(C(F)(F)F)cc1[N+](=O)[O-] 506577109 XMEUGNCCHITDHN-UHFFFAOYSA-N 495.523 5.191 5 20 JKBD O=C(Nc1nc(-c2ccc(Cl)s2)cs1)c1ccc([N+](=O)[O-])cc1I 508909537 WDTGHAPKMRPSRO-UHFFFAOYSA-N 491.719 5.290 5 20 JKBD CCN(CC)C(=O)c1ccc(CNCc2ccc(Oc3ccccc3Cl)c([N+](=O)[O-])c2)cc1 509617203 JJRYYTZVUKJFRW-UHFFFAOYSA-N 467.953 5.812 5 20 JKBD COC(=O)c1ccccc1C(=O)c1ccc(NC[C@H]2CCCO[C@@H]2c2ccccc2)c([N+](=O)[O-])c1 513201106 YBNZRCHHHBFCHP-FQRUVTKNSA-N 474.513 5.192 5 20 JKBD C[C@H](NC(=O)C(=O)Nc1ccc(Oc2ccc(Cl)cc2Cl)c(F)c1)c1cccc([N+](=O)[O-])c1 516737185 FNKAHZUHIIDWDW-LBPRGKRZSA-N 492.290 5.649 5 20 JKBD O=C(c1ccc(Sc2nc3ccccc3s2)c([N+](=O)[O-])c1)N1CC[C@@H](N2CCCCC2)C1 518087383 VSJUFOUGQLCBMY-QGZVFWFLSA-N 468.604 5.056 5 20 JKBD C[C@H](Nc1ccc(C(=O)Nc2ccc(CN3CCCC[C@@H]3C)cc2)cc1[N+](=O)[O-])c1ccccn1 518439354 NKBSKVKSUGVTAN-PMACEKPBSA-N 473.577 5.790 5 20 JKBD CC(C)(C)S(=O)(=O)Cc1ccc(NC(=O)c2ccc(Nc3ccccc3)c([N+](=O)[O-])c2)cc1 521382081 VFVAKORVDZBVEA-UHFFFAOYSA-N 467.547 5.304 5 20 JKBD Cc1cc(NC(=O)c2ccc(Cl)c(NC(=O)c3cccs3)c2)n(-c2ccc([N+](=O)[O-])cc2)n1 590771307 QKNSAVZDWMQCGY-UHFFFAOYSA-N 481.921 5.308 5 20 JKBD Cc1ccc(NC(=O)[C@@H](Sc2nnc(-c3ccc(F)cc3)n2C)c2ccccc2)c([N+](=O)[O-])c1 591886327 ZCPDODOBUZJHDQ-NRFANRHFSA-N 477.521 5.310 5 20 JKBD O=C(c1ccc(NCc2ccccc2)c([N+](=O)[O-])c1)N(C[C@@H]1CCCO1)c1nc2ccccc2s1 602758507 QARAOAHMNGSLFE-FQEVSTJZSA-N 488.569 5.642 5 20 JKBD O=C(C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)Nc1cccc(Cn2cccn2)c1 603571039 ALJIJQUPNXILNS-RCCKNPSSSA-N 495.564 6.019 5 20 JKBD O=[N+]([O-])c1ccc(-c2nn(-c3ccccc3)cc2CN[C@H](c2ccc(F)cc2)[C@@H]2CCCO2)cc1 608837183 XLLUDWKYDKQACL-AHKZPQOWSA-N 472.520 5.597 5 20 JKBD C[C@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccc(C(=O)Nc2cccnc2)c(Cl)c1 608874311 BRSWLDORCBRAOH-ZDUSSCGKSA-N 456.911 5.015 5 20 JKBD COc1ccccc1-c1nnc(Sc2ccc(C(=O)Nc3ccc(C)cc3)cc2[N+](=O)[O-])n1C 608972507 RAVLYOHDNMVJIQ-UHFFFAOYSA-N 475.530 5.111 5 20 JKBD C[C@H](OC(=O)c1cc([N+](=O)[O-])ccc1Br)C(=O)Nc1ccccc1-c1ccccc1 725986071 RKRNBIQQXWBUPF-AWEZNQCLSA-N 469.291 5.208 5 20 JKBD C[C@H](NC(=S)/C(=C(/O)c1cccc([N+](=O)[O-])c1)[n+]1ccccc1)c1ccc(Cl)cc1Cl 726570334 MIWIENFEDXQLSJ-AWEZNQCLSA-O 475.377 5.751 5 20 JKBD O=C(c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-])N(CC1CC1)c1ccc(Cl)c([N+](=O)[O-])c1 728165921 SDLKYKDHOZJORZ-UHFFFAOYSA-N 473.791 5.154 5 20 JKBD C[C@@H](OC(=O)c1cn(-c2ccccc2)nc1-c1ccccc1)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 745929373 AYYQYJYLZCWNGE-QGZVFWFLSA-N 481.468 5.416 5 20 JKBD C[C@@H](SCc1nc(O)c2c(-c3ccccc3)csc2n1)C(=O)O[C@H](C)c1ccccc1[N+](=O)[O-] 749053893 HOKKDLZPNFJARV-HUUCEWRRSA-N 495.582 5.898 5 20 JKBD C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)N1CCC(c2nc(C(C)(C)C)cs2)CC1 750068532 UTJROIDOLDHUSR-CYBMUJFWSA-N 450.992 5.209 5 20 JKBD O=C(Nc1cc([N+](=O)[O-])c(F)cc1F)[C@@H]1C[C@@H]2CCCC[C@H]2N1C(=O)c1ccc2ccccc2c1 751074174 UECDSKIPOGLARC-YJGRUCBDSA-N 479.483 5.438 5 20 JKBD C[C@H](Nc1ccc(-c2nc(C3(NC(=O)OC(C)(C)C)CCC3)no2)cc1[N+](=O)[O-])c1ccccn1 904558116 UEAAJKOVVHZXPR-HNNXBMFYSA-N 480.525 5.117 5 20 JKBD O=C(Cn1ncc2ccc([N+](=O)[O-])cc21)N(c1cccc(Cl)c1)c1nc2ccccc2s1 918541087 HMWWPPPRINKZNC-UHFFFAOYSA-N 463.906 5.573 5 20 JKBD COc1ccc(COC(=O)c2sc(NC(=O)c3ccc(F)cc3Cl)cc2C)cc1[N+](=O)[O-] 919158758 WUQCLILLYPSHPU-UHFFFAOYSA-N 478.885 5.375 5 20 JKBD C[C@H](Nc1ccc(C(=O)Oc2ccc(NC(=O)c3cccs3)cc2)cc1[N+](=O)[O-])c1ccccn1 919678984 JSVPMNXAFOLICV-INIZCTEOSA-N 488.525 5.696 5 20 JKBD C[C@H](NC(=O)COC(=O)c1ccc(N[C@H](C)c2ccccn2)c([N+](=O)[O-])c1)c1ccc2ccccc2c1 920543893 AYGBVYOMXKXTKF-RBUKOAKNSA-N 498.539 5.350 5 20 JKBD CCCc1noc(COC(=O)C/C(=C\c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)n1 926631208 MNUJZQVFVLTHHV-FOWTUZBSSA-N 464.503 5.214 5 20 JKBD O=C(/C=C/c1ccc([N+](=O)[O-])o1)Nc1ccc(C2(NC(=O)c3ccccc3Cl)CCC2)cc1 1786207759 MVYFCXFUQQZVBJ-ZRDIBKRKSA-N 465.893 5.302 5 20 JKBD CC(F)(F)C(C)(C)C(=O)Nc1ccc(C2(NC(=O)c3ccc([N+](=O)[O-])cc3F)CCC2)cc1 1786454863 LHILYPXWEHSXND-UHFFFAOYSA-N 463.456 5.163 5 20 JKBD O=C(Cc1cc([N+](=O)[O-])ccc1F)NC1(c2ccc(NC(=O)[C@H](F)c3ccccc3)cc2)CCC1 1786610844 FPBQMQKCDJAJSH-XMMPIXPASA-N 479.483 5.121 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)c3nc[nH]c3[N+](=O)[O-])CCC2)cc1)c1cc2c(Cl)cccc2s1 1789093346 YPPPLNSGEQBBID-UHFFFAOYSA-N 495.948 5.248 5 20 JKBD COc1cc(C(=O)NC2(c3ccc(NC(=O)c4cc5sccc5[nH]4)cc3)CCC2)ccc1[N+](=O)[O-] 1789370018 XEBFSKFNRKOTBL-UHFFFAOYSA-N 490.541 5.208 5 20 JKBD Cc1ccc(C(=O)Nc2ccc(C3(NC(=O)c4cc(Cl)cc([N+](=O)[O-])c4C)CCC3)cc2)c(C)n1 1789967014 QYOQYSOFTRAZTH-UHFFFAOYSA-N 492.963 5.630 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)c3ccccc3C(F)(F)F)CCC2)cc1)c1ccc([N+](=O)[O-])[nH]1 1790187235 KIVWTJJZFWFLDW-UHFFFAOYSA-N 472.423 5.003 5 20 JKBD CCOc1ccccc1C(=O)Nc1ccc(C2(NC(=O)Cc3cc(F)ccc3[N+](=O)[O-])CCC2)cc1 1790239904 DXKQSNRWRUKETN-UHFFFAOYSA-N 491.519 5.123 5 20 JKBD Cc1ccc(SCC(=O)NC2(c3ccc(NC(=O)c4ccc(O)c([N+](=O)[O-])c4)cc3)CCC2)cc1 1790620005 QSMWWCHQFZHXPJ-UHFFFAOYSA-N 491.569 5.149 5 20 JKBD CCc1ccc(C(=O)NC2(c3ccc(NC(=O)c4c(F)ccc([N+](=O)[O-])c4C)cc3)CCC2)cn1 1790771109 PROCYDBXQFDRBT-UHFFFAOYSA-N 476.508 5.061 5 20 JKBD CC(C)(C)CCCCCC(=O)N1CCC2(CCCN(C(=O)Cc3cccc([N+](=O)[O-])c3)C2)CC1 1804752853 UXQAOVUKSLLLOX-UHFFFAOYSA-N 471.642 5.365 5 20 JKBD O=C(Nc1cc([C@H]2CCCCN2C(=O)[C@H]2CC=CCC2)[nH]n1)c1cc2cc([N+](=O)[O-])ccc2s1 1821610681 IYCJZDSHJCYJND-HNAYVOBHSA-N 479.562 5.195 5 20 JKBD CC1=CC[C@H](C(=O)N2CCCC[C@@H]2C2CCN(C(=O)C3(c4cccc([N+](=O)[O-])c4)CCC3)CC2)CC1 1828348991 HZJSOIYDQQRMKT-JYFHCDHNSA-N 493.648 5.383 5 20 JKBD O=C(c1ccc(Cl)c(F)c1)N1CCC([C@@H]2CCCCN2C(=O)c2cccc(F)c2[N+](=O)[O-])CC1 1830621946 VARATNWREQPRRP-NRFANRHFSA-N 491.922 5.074 5 20 JKBD Cc1c(C(=O)N2CC3(CCCN3C(=O)c3ccc4occ(Cl)c4c3)C2)cc(Cl)cc1[N+](=O)[O-] 1844748582 KEJYKXFNBRUKTG-UHFFFAOYSA-N 488.327 5.087 5 20 JKBD COc1cc(C(=O)NCc2ccccc2CN(C)C)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 9917058 HOIMRHMHHMJOHF-UHFFFAOYSA-N 469.925 5.041 5 20 JKBD CCNc1ccc(C(=O)O[C@@H](C)C(=O)Nc2c(Cl)cc(Cl)cc2Cl)cc1[N+](=O)[O-] 10530957 QLWUYYHCAKVTQQ-VIFPVBQESA-N 460.701 5.171 5 20 JKBD Cc1nn(Cc2ccc(C(=O)N3CCC[C@@H](c4nc5ccccc5s4)C3)cc2)c(C)c1[N+](=O)[O-] 15020696 RVIGKSTUPNQLHU-HXUWFJFHSA-N 475.574 5.086 5 20 JKBD CCn1c(S[C@@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)nc2sc3c(c2c1=O)CCCC3 17670353 WNFFDONDKFJAEM-LBPRGKRZSA-N 483.575 5.168 5 20 JKBD CCOC(=O)c1c(NC(=O)/C=C/c2ccc([N+](=O)[O-])cc2)sc(C(=O)Nc2ccccc2)c1C 20160342 XZEAPSJOHDPMLM-SDNWHVSQSA-N 479.514 5.046 5 20 JKBD O=C(Nc1ccccc1NC(=O)c1ccc(NCc2ccccc2)c([N+](=O)[O-])c1)c1ccccc1 25871364 FRQOSGPEYLHCPP-UHFFFAOYSA-N 466.497 5.712 5 20 JKBD Cc1cccc(-c2nnc(S[C@@H](C)C(=O)Nc3cccc([N+](=O)[O-])c3C)n2Cc2ccco2)c1 26488496 VQAUSCXMAQAUJY-KRWDZBQOSA-N 477.546 5.231 5 20 JKBD CCn1c(SCc2nnc(C(=O)Nc3ccc(F)cc3)s2)nc2cc3ccccc3cc2c1=O 31747487 RUTIWKPKIBIICA-UHFFFAOYSA-N 491.573 5.105 5 20 JKBD COc1cc(C(=O)Nc2ccc(N3CCCC3=O)cc2)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 45811897 PUCHQTXUJTUASR-UHFFFAOYSA-N 481.892 5.428 5 20 JKBD O=C(Nc1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2Cl)c(C(F)(F)F)c1)c1ccccc1F 107813401 AAAHCGVBCVNYLQ-UHFFFAOYSA-N 481.789 5.911 5 20 JKBD C[C@H](Nc1ccc(C(=O)c2nccn2C)cc1[N+](=O)[O-])c1ccc(NC(=O)c2ccc(F)cc2)cc1 109306730 XHXMUJLWAIALDP-INIZCTEOSA-N 487.491 5.124 5 20 JKBD O=C(Nc1nnc(SCc2c(Cl)cccc2Cl)s1)c1n[nH]c2ccc([N+](=O)[O-])cc12 491525047 MYTOWAKRIVMCES-UHFFFAOYSA-N 481.346 5.174 5 20 JKBD CCCn1c2ccccc2c2nnc(S[C@H](C)c3nnc(-c4ccc([N+](=O)[O-])cc4)o3)nc21 495479668 KJFQHCCTFRDWMN-CYBMUJFWSA-N 461.507 5.201 5 20 JKBD Cc1cc(SC2CCCCC2)ccc1NC(=O)CSc1ccc(C(N)=O)cc1[N+](=O)[O-] 498470059 XWFCIFABNBIXNL-UHFFFAOYSA-N 459.593 5.158 5 20 JKBD C[C@@H](Nc1ccc(C(=O)N(C)[C@H](C)c2nc3ccccc3s2)cc1[N+](=O)[O-])c1ccccn1 504280406 PPYSBUIEPGXFOZ-HZPDHXFCSA-N 461.547 5.606 5 20 JKBD CCOc1ccc(-n2c(SCc3c(F)cccc3[N+](=O)[O-])nnc2-c2ccncc2)cc1 504542241 OJOMBFGNIQAORT-UHFFFAOYSA-N 451.483 5.068 5 20 JKBD COc1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2Sc2ccccc2)cc1OCc1cccnc1 515204067 ZAVATIRRTMRGOX-UHFFFAOYSA-N 487.537 5.981 5 20 JKBD CC(C)NC(=O)Nc1ccc(CNCc2cn(-c3ccccc3)nc2-c2ccc([N+](=O)[O-])cc2)cc1 520205869 IDXPNSVQEVMKOQ-UHFFFAOYSA-N 484.560 5.267 5 20 JKBD Cc1cc(C(=O)NC2CCCCC2)ccc1NC(=O)[C@@H](C)Oc1ccc(Cl)cc1[N+](=O)[O-] 520409937 GHTNYBLGINEJKV-OAHLLOKOSA-N 459.930 5.025 5 20 JKBD CSc1ccc(C(=O)c2ccccc2C(=O)Nc2nc(-c3ccncc3)cs2)cc1[N+](=O)[O-] 603454898 YDJJZJIGIIAELT-UHFFFAOYSA-N 476.539 5.319 5 20 JKBD COc1ccc(-n2c(SCc3nc(-c4cccc([N+](=O)[O-])c4)no3)nnc2-c2ccccc2)cc1 603562750 UHPIJBZRNQPGRU-UHFFFAOYSA-N 486.513 5.193 5 20 JKBD Cc1ccc(-c2cc(-c3nnc(SCc4ccc(C(N)=O)cc4[N+](=O)[O-])o3)c3ccccc3n2)cc1 603597326 LUVCOXYZYLSIIE-UHFFFAOYSA-N 497.536 5.560 5 20 JKBD COc1ccc(CSCC(=O)Nc2cc(C(F)(F)F)ccc2N2CCCC2)cc1[N+](=O)[O-] 604128382 XXLYAZHBKKRHEB-UHFFFAOYSA-N 469.485 5.094 5 20 JKBD COc1ccc(-c2ccc(CNC3C[C@H](C(F)(F)F)C[C@@H](C(F)(F)F)C3)o2)c([N+](=O)[O-])c1 608835921 YXEKFRAOCIPIFV-VXGBXAGGSA-N 466.378 5.863 5 20 JKBD C[C@H](NC(=O)c1ccc(C(=O)N[C@H](C)c2cc3ccccc3o2)c([N+](=O)[O-])c1)c1cc2ccccc2o1 609043650 GYLXBDONHZULPH-DLBZAZTESA-N 497.507 6.069 5 20 JKBD O=c1ccc(-c2cccc([N+](=O)[O-])c2)nn1CN1CCCC[C@H]1c1ccc(C(F)(F)F)cc1 726787245 PUCXDKPMOGPIOZ-NRFANRHFSA-N 458.440 5.022 5 20 JKBD C[C@@H]1CN(c2ccc(NC(=O)c3ccc([N+](=O)[O-])cc3Cl)cc2C(F)(F)F)C[C@@H](C)O1 728010746 JSUQUKZNPLVWBW-VXGBXAGGSA-N 457.836 5.133 5 20 JKBD COc1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2N2CCCC2)cc1OCc1ccc2ccccc2n1 728035763 LEBHIGABFCWSCI-UHFFFAOYSA-N 498.539 5.583 5 20 JKBD O=C(OC[C@H]1CCCN1C(=O)c1ccccc1[N+](=O)[O-])/C(=C\c1ccc(F)cc1)c1cccs1 730704147 NTCXHQAUMZHPHR-CBAAQYGVSA-N 480.517 5.184 5 20 JKBD C[C@@H](OC(=O)c1csc(-c2ccc(Cl)c(Cl)c2)n1)C(=O)Nc1ccc([N+](=O)[O-])cc1 744597549 VYPPWFZNXDYXCD-SNVBAGLBSA-N 466.302 5.209 5 20 JKBD CC[C@@H](C)Sc1ccc(NC(=O)c2cc([N+](=O)[O-])cc([N+](=O)[O-])c2C)c(C(F)(F)F)c1 748658720 WFJYFYLZONUBFE-SNVBAGLBSA-N 457.430 5.973 5 20 JKBD CC1CCN(c2ccc([N+](=O)[O-])cc2C(=O)N2CCC[C@H](c3nc(-c4cccc(F)c4)no3)C2)CC1 750658844 LSNGOGBWLOMFAV-IBGZPJMESA-N 493.539 5.040 5 20 JKBD O=C(OCc1nnc(-c2ccco2)o1)c1cc([N+](=O)[O-])ccc1Sc1ccc(Cl)cc1 780418231 UTDYCMSKZSYFAI-UHFFFAOYSA-N 457.851 5.399 5 20 JKBD COC(=O)c1sc2nc(/C(Cl)=C\c3ccc(-c4ccc([N+](=O)[O-])cc4)o3)nc(O)c2c1C 916152989 AVSLBEPSJQCFQC-NTEUORMPSA-N 471.878 5.397 5 20 JKBD O=C(Nc1ccc(S(=O)(=O)c2ccc(Br)cc2)cc1)c1cc([N+](=O)[O-])ccc1Cl 916440154 CPHIFVBFOIDUDA-UHFFFAOYSA-N 495.738 5.096 5 20 JKBD CC(=O)N(c1ccc(F)cc1)c1nc(COC(=O)c2ccc(C(C)(C)C)c([N+](=O)[O-])c2)cs1 919002316 YZKLQYYLNACWLZ-UHFFFAOYSA-N 471.510 5.530 5 20 JKBD CC(C)(C)c1ccc([C@H]2CCCN2C(=O)COC(=O)Cn2c3ccccc3c(=O)c3ccccc32)cc1 919055763 PHBYDCGSPMSNBR-RUZDIDTESA-N 496.607 5.359 5 20 JKBD CCN(Cc1ccc(C(F)(F)F)cc1)C(=O)c1ccc(N[C@H](C)c2ccccn2)c([N+](=O)[O-])c1 919709694 YOMJWDFVDWWDMZ-MRXNPFEDSA-N 472.467 5.844 5 20 JKBD O=C(CCc1cccc([N+](=O)[O-])c1)NC1(c2ccc(NC(=O)c3cccnc3Cl)cc2)CCC1 1785751939 RJFPNDSEFWIOSE-UHFFFAOYSA-N 478.936 5.024 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)[C@@H]3CCCCC3(F)F)CCC2)cc1)c1ccc([N+](=O)[O-])cc1F 1790622661 PYMGKVULZUSKKH-IBGZPJMESA-N 475.467 5.307 5 20 JKBD C[C@@H](Sc1ccccn1)C(=O)NC1(c2ccc(NC(=O)c3cc(F)cc([N+](=O)[O-])c3)cc2)CCC1 1790699420 OOJMYALTKYMYQC-MRXNPFEDSA-N 494.548 5.057 5 20 JKBD C[C@@H](C(=O)Nc1ccc(C2(NC(=O)/C=C/c3ccc([N+](=O)[O-])o3)CCC2)cc1)c1cccs1 1791815717 UPEOJDYUTWXARZ-PXUDHTSWSA-N 465.531 5.200 5 20 JKBD COc1cc(C(=O)NC2(c3ccc(NC(=O)C4(C(C)C)CCC4)cc3)CCC2)cc([N+](=O)[O-])c1OC 1792048369 SWWQGPLLOKWMLY-UHFFFAOYSA-N 495.576 5.186 5 20 JKBD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(Cl)c(F)c1)c1cc2cc([N+](=O)[O-])ccc2s1 1800339095 MCFMJNKUHBFHIJ-MUJYYYPQSA-N 487.940 5.168 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1[nH]c3c(Cl)cccc3c1C)C2 1800699578 ANWMRYVSVWGVPA-MUJYYYPQSA-N 498.942 5.051 5 20 JKBD Cc1csc(CCC(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)c1 1801206129 QLDUOJDPFATJGT-BCDXTJNWSA-N 483.615 5.064 5 20 JKBD Cc1cc(CCCC(=O)N2CCCC3(CCN(C(=O)c4cccc(F)c4)CC3)C2)c([N+](=O)[O-])cc1F 1805821511 UIXJDKDZJPYCTJ-UHFFFAOYSA-N 499.558 5.049 5 20 JKBD Cc1c(C(=O)N2CCC([C@@H]3CCCCN3C(=O)c3cc(F)cc([N+](=O)[O-])c3)CC2)oc2ccccc12 1830617354 MYJPSKVRZRALJG-QHCPKHFHSA-N 493.535 5.336 5 20 JKBD Cc1cccc(Cl)c1C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cccc(F)c2[N+](=O)[O-])CC1 1830620489 BZSSPJSFTZUHSC-OAQYLSRUSA-N 487.959 5.243 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)N1CCCC[C@@H]1C1CCN(C(=O)C[C@@H]2C[C@@H]3CC[C@H]2C3)CC1 1830729036 IVARUTZDQGOQTR-KDNSLJGTSA-N 485.600 5.102 5 20 JKBD Cc1cccc(C(=O)OCC(=O)Nc2c(Cl)c(Cl)cc(Cl)c2Cl)c1[N+](=O)[O-] 9022261 VSZOJMHQXVLHJO-UHFFFAOYSA-N 452.077 5.312 5 20 JKBD Cc1nc(-c2cccc(Cl)c2)sc1C(=O)OCc1nnc(-c2ccc([N+](=O)[O-])cc2)o1 17956035 ZHHOOMJADASTQW-UHFFFAOYSA-N 456.867 5.087 5 20 JKBD CCCN(C(=O)CCCn1c(=O)oc2cc([N+](=O)[O-])ccc21)[C@H](C)c1ccccc1Br 69640119 IOJPUHBKHXDUSX-OAHLLOKOSA-N 490.354 5.045 5 20 JKBD COc1cc(C(=O)NC[C@H](C)c2c(Cl)cccc2Cl)c([N+](=O)[O-])cc1OCc1cscn1 72077694 NVTQCFZHTKEUOH-LBPRGKRZSA-N 496.372 5.479 5 20 JKBD C[C@@H](NC(=O)c1cc([N+](=O)[O-])ccc1N1CCCC1)c1ccc(NC(=O)Nc2ccccc2)cc1 108601535 VCOLXDPDGRAHSY-GOSISDBHSA-N 473.533 5.330 5 20 JKBD COc1cc2c(cc1OC)[C@H](c1cccs1)N(C(=O)c1cc([N+](=O)[O-])ccc1Cl)CC2 301148596 UBDROQLIIOAXER-OAQYLSRUSA-N 458.923 5.115 5 20 JKBD Cc1ccc(Cl)cc1N1CCN(C(=O)c2ccc(N[C@H](C)c3ccccn3)c([N+](=O)[O-])c2)CC1 303044221 WWHZROOTISBHCC-GOSISDBHSA-N 479.968 5.087 5 20 JKBD Cc1csc(Sc2ccc(C(=O)Nc3ccc(Cl)c(C(=O)NC4CC4)c3)cc2[N+](=O)[O-])n1 488432194 DAHJJCDYOQYFQI-UHFFFAOYSA-N 488.978 5.309 5 20 JKBD CC(C)N(CC(=O)Nc1ccc(Cl)cc1C(F)(F)F)C(=O)CSc1ccc([N+](=O)[O-])cc1 504798435 XPMADWTZBHSXPW-UHFFFAOYSA-N 489.903 5.235 5 20 JKBD COc1ccc(OC)c([C@@H]2CCCN2C(=O)c2ccc(N[C@@H](C)c3ccccn3)c([N+](=O)[O-])c2)c1 506088043 TWSJOLYOTRYSQU-SBUREZEXSA-N 476.533 5.157 5 20 JKBD O=C1CCCN1c1cccc(CNCc2ccc(Oc3ccccc3Cl)c([N+](=O)[O-])c2)c1 509600411 JDUMVOBQKSAOKH-UHFFFAOYSA-N 451.910 5.457 5 20 JKBD O=C(C1CCN(c2ccccc2[N+](=O)[O-])CC1)N(Cc1cccs1)c1ccc(F)cc1F 511076581 PWCHIKOOBLTGCG-UHFFFAOYSA-N 457.502 5.384 5 20 JKBD CC(=O)N1CCC(CNC(=O)c2c3c(nc4ccccc24)/C(=C\c2cccc([N+](=O)[O-])c2)CCC3)CC1 521484038 BGIFZFGOOQTIOT-JWGURIENSA-N 498.583 5.008 5 20 JKBD COc1ccc(CSCC(=O)N2CCC(c3nc4cc(Cl)ccc4s3)CC2)cc1[N+](=O)[O-] 603566377 WCYFJSPSYBOCEY-UHFFFAOYSA-N 492.022 5.506 5 20 JKBD O=[N+]([O-])c1ccc(-c2ccc(CN[C@@H]3C[C@@H](C(F)(F)F)C[C@@H](C(F)(F)F)C3)s2)cc1 608835867 RAXYZRSOZUDYFE-WDNDVIMCSA-N 452.420 6.322 5 20 JKBD Cc1csc(Sc2ccc(NC(=O)c3ccn(-c4ccc([N+](=O)[O-])cc4)n3)c(C)c2)n1 608848233 GIAUQBJRAPXYAQ-UHFFFAOYSA-N 451.533 5.257 5 20 JKBD Cn1c(=O)oc2cc(NC(=O)c3ccccc3Sc3ccc(C(F)(F)F)cc3[N+](=O)[O-])ccc21 609107697 RHKLLPOIGVYZNT-UHFFFAOYSA-N 489.431 5.462 5 20 JKBD CCOc1cc(NC(=O)c2ccc(Oc3ccc(C(F)(F)F)cn3)cc2)c([N+](=O)[O-])cc1OCC 619212889 XONQVNIHXJMNCE-UHFFFAOYSA-N 491.422 5.851 5 20 JKBD Cc1ccc(C(C)C)c(Oc2ccc(CN[C@H](C)c3cccc(NS(C)(=O)=O)c3)cc2[N+](=O)[O-])c1 725849865 YMLNNKREQJBTBL-LJQANCHMSA-N 497.617 6.041 5 20 JKBD C[C@H](OC(=O)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1)c1cccc([N+](=O)[O-])c1 729626678 GMBATMKZWVWEOX-ZDUSSCGKSA-N 467.400 5.043 5 20 JKBD C[C@H](OC(=O)c1ccccc1OCc1cccs1)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl 730617470 HQXMUVRAYAFCLY-ZDUSSCGKSA-N 460.895 5.073 5 20 JKBD C[C@H](OC(=O)c1csc(-c2ccc([N+](=O)[O-])cc2)n1)C(=O)N[C@@H](C)c1ccc(Cl)cc1Cl 747955577 AUXRBLCQZVTFTH-RYUDHWBXSA-N 494.356 5.448 5 20 JKBD Cc1onc(-c2c(F)cccc2Cl)c1C(=O)O[C@H](C)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl 766589485 CZFIBOXVJVUDSL-SNVBAGLBSA-N 482.251 5.188 5 20 JKBD C[C@@H](Nc1ccc(-c2nc([C@H]3CCC(=O)N(CC4CCCC4)C3)no2)cc1[N+](=O)[O-])c1ccccn1 856577521 IARIZVKKLGPONK-XLIONFOSSA-N 490.564 5.109 5 20 JKBD Cc1cc(OCCCC(=O)N(Cc2nnc(-c3cccc([N+](=O)[O-])c3)o2)C(C)C)ccc1Cl 864244837 QCEGRZSSFCOKDA-UHFFFAOYSA-N 472.929 5.203 5 20 JKBD C[C@H](NC(=O)c1ccc(Cl)c([N+](=O)[O-])c1)c1cccc(NC(=O)Cc2ccccc2F)c1 916074700 XHLUUQAGLCYNNV-AWEZNQCLSA-N 455.873 5.060 5 20 JKBD CC1=C(C(=O)Nc2ccccc2C(F)(F)F)[C@@H](c2ccc(C(C)C)c([N+](=O)[O-])c2)NC(=S)N1 916191143 NUIPDYUXPPUFGB-LJQANCHMSA-N 478.496 5.169 5 20 JKBD CCCc1cc[n+](/C(C(=S)Nc2ccc(Cl)cc2)=C(/O)c2ccc([N+](=O)[O-])cc2)cc1 916204053 BOYCJHHMHNLZBE-UHFFFAOYSA-O 454.959 5.812 5 20 JKBD CCCCn1c(-c2ccc(Cl)cc2)nn(CCC(=O)NCc2ccccc2[N+](=O)[O-])c1=S 916423245 MITWRYSEZLGYCS-UHFFFAOYSA-N 473.986 5.149 5 20 JKBD O=C(Nc1ccc(CN2CCOC2=O)cc1)c1cc([N+](=O)[O-])ccc1Sc1ccc(Cl)cc1 917789403 KNCQQMVDUHABAU-UHFFFAOYSA-N 483.933 5.604 5 20 JKBD C[C@@H](SCc1ncc(-c2ccc(Cl)cc2)o1)C(=O)Nc1cc([N+](=O)[O-])c(F)cc1F 920026161 RXGQBYFNKRCFIR-SNVBAGLBSA-N 453.854 5.442 5 20 JKBD O=C(CCSCc1ccccn1)Oc1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2Cl)cc1 920080790 VLPKCEMUWYNQTJ-UHFFFAOYSA-N 471.922 5.124 5 20 JKBD Cc1ccc(CC(=O)NC2(c3ccc(NC(=O)c4coc(C(C)C)n4)cc3)CCC2)cc1[N+](=O)[O-] 1787028088 JHTQHQRYLYTQQC-UHFFFAOYSA-N 476.533 5.005 5 20 JKBD Cc1ccc2nc(C(=O)Nc3ccc(C4(NC(=O)c5ccc([N+](=O)[O-])o5)CCC4)cc3)ccc2c1 1788940530 VXNKFDYVOBGWJH-UHFFFAOYSA-N 470.485 5.106 5 20 JKBD O=C(NC1(c2ccc(NC(=O)c3cccc4cnccc34)cc2)CCC1)c1cc(F)cc([N+](=O)[O-])c1 1789328206 ZPFDLKAXDIHADG-UHFFFAOYSA-N 484.487 5.344 5 20 JKBD O=C(CCCCn1cccc1)Nc1ccc(C2(NC(=O)c3ccc([N+](=O)[O-])cc3F)CCC2)cc1 1789603768 BYZUFGDNSJYLGS-UHFFFAOYSA-N 478.524 5.154 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)c3cc(F)ccc3C(F)(F)F)CCC2)cc1)c1ccc([N+](=O)[O-])[nH]1 1790188285 AFBRAQAWTCKUEI-UHFFFAOYSA-N 490.413 5.142 5 20 JKBD CC[C@H](C)[C@H](C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CSc1ccccc1[N+](=O)[O-])C2)c1ccccc1 1795572701 MBBXKSMOAFOZIP-JHWNQOIGSA-N 495.645 5.155 5 20 JKBD CC[C@H](C)[C@@H](C(=O)N1CCCC2(CCN(C(=O)c3cc(F)cc([N+](=O)[O-])c3)CC2)C1)c1ccccc1 1809163529 RTMZIXUTDPUPOS-NBGIEHNGSA-N 495.595 5.409 5 20 JKBD O=C(NC[C@H]1CCN(C(=O)C2CCCCC2)[C@H]1c1cccnc1)c1cc2cc([N+](=O)[O-])ccc2s1 1812304765 SDHVHDCNBGGPRD-DVECYGJZSA-N 492.601 5.104 5 20 JKBD Cc1ccc2[nH]c(C(=O)N3CCC([C@H]4CCCCN4C(=O)c4cc(F)cc([N+](=O)[O-])c4)CC3)cc2c1 1830617420 OLVXZYHQIJZXBV-RUZDIDTESA-N 492.551 5.071 5 20 JKBD Cc1occc1C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)CC1 1831059045 BGTKYMFEHQBEEU-NRFANRHFSA-N 481.574 5.258 5 20 JKBD O=C(Nc1ccc(S(=O)(=O)C(F)F)cc1)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1 15998679 PXZDNRQNFSCFJK-UHFFFAOYSA-N 482.848 5.289 5 20 JKBD CSc1ccc([N+](=O)[O-])c(C(=O)Nc2ncc(Cc3cccc(C(F)(F)F)c3)s2)c1 29794002 KRJYJFJNBUINDK-UHFFFAOYSA-N 453.467 5.635 5 20 JKBD O=C(Nc1ccc(Br)cc1Br)c1cc([N+](=O)[O-])ccc1Br 45625893 FULUUZJCLQXZFB-UHFFFAOYSA-N 478.922 5.135 5 20 JKBD CN(C(=O)CSc1nnc(-c2ccccc2Cl)n1-c1ccccc1F)c1ccc([N+](=O)[O-])cc1 105328154 KCYWCNUMDXLTGM-UHFFFAOYSA-N 497.939 5.390 5 20 JKBD O=C(NCc1ccco1)Nc1ccc(NC(=O)c2ccc(NCc3ccccc3)c([N+](=O)[O-])c2)cc1 115543867 ISUVFXUHNISBPM-UHFFFAOYSA-N 485.500 5.374 5 20 JKBD CN(C(=O)Cc1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1 476833415 YIWHEZIRFLWZRR-UHFFFAOYSA-N 469.526 5.263 5 20 JKBD COc1cc(C(=O)Nc2cccc(NC(=O)c3cccc(C(F)(F)F)c3)c2)ccc1[N+](=O)[O-] 504774847 HPVQHTNECDEFTH-UHFFFAOYSA-N 459.380 5.127 5 20 JKBD C[C@H](NC(=O)c1ccc(N[C@H](C)c2ccccn2)c([N+](=O)[O-])c1)c1cccc(C(F)(F)F)c1 505996374 NZPGIZNVORYBCS-LSDHHAIUSA-N 458.440 5.673 5 20 JKBD Cc1csc(-c2ccc(NC(=O)c3ccc(NS(=O)(=O)c4cccc([N+](=O)[O-])c4)cc3)cc2)n1 506107337 QOSFMOYBJQYXJN-UHFFFAOYSA-N 494.554 5.080 5 20 JKBD Cc1ccc([C@H](CNC(=O)c2cc([N+](=O)[O-])ccc2Sc2ccccc2)N2CCCC2)o1 506357670 JCQUWJLUVMLSCY-NRFANRHFSA-N 451.548 5.214 5 20 JKBD CCCN1CCC(NC(=O)C/C(=C/c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)CC1 512923851 ZVOQAYJMASZQHC-MNDPQUGUSA-N 464.591 5.126 5 20 JKBD CCCCOc1ccc(-c2nnc(CSc3nc4cc5ccccc5cc4c(=O)n3C)o2)cc1 514563095 ZXRPQECLHUDPAW-UHFFFAOYSA-N 472.570 5.608 5 20 JKBD O=C(C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)N1CCC[C@@H]1c1ccccn1 516667715 QGPIHKLISLJBOF-WNLUNTPQSA-N 470.554 5.894 5 20 JKBD Cc1nc(-c2ccc(CNC(=O)c3ccc(N[C@@H](C)c4ccccn4)c([N+](=O)[O-])c3)cc2)cs1 520007746 SZWQETRFFVPPRR-INIZCTEOSA-N 473.558 5.525 5 20 JKBD COc1ccc([C@@H](Nc2ccc(C(=O)Nc3ccc(C)cc3)cc2[N+](=O)[O-])c2nccn2C)cc1 524171096 IBWZCMHQCVQUBP-XMMPIXPASA-N 471.517 5.099 5 20 JKBD CC1CCN(c2ccc(C(=O)N3CCC[C@@H]3c3nc4ccccc4s3)cc2[N+](=O)[O-])CC1 598672620 CHVWBUCRDYQIQA-HXUWFJFHSA-N 450.564 5.418 5 20 JKBD COc1ccc(NC(=O)C2CCN(c3ccc(C(F)(F)F)cc3[N+](=O)[O-])CC2)cc1Cl 598854274 RWDBPCCPKYSUAM-UHFFFAOYSA-N 457.836 5.131 5 20 JKBD COc1cccc([C@H](CNC(=O)c2ccc([N+](=O)[O-])cc2Cl)c2c[nH]c3ccccc23)c1OC 603470030 ILIFOLGJAJOJNO-FQEVSTJZSA-N 479.920 5.309 5 20 JKBD O=C(Nc1ccc(-n2cccn2)cc1C(F)(F)F)c1ccc(Nc2ccccc2)c([N+](=O)[O-])c1 609096959 RPIFDCUDMKDIMT-UHFFFAOYSA-N 467.407 5.795 5 20 JKBD O=C(C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)Nc1cnc(C2CC2)nc1 609127419 JLJPMVZWFUZMNL-GZTJUZNOSA-N 457.515 5.441 5 20 JKBD Cc1ccc(/C(O)=C(/C(=S)Nc2ccc(Cl)nc2)[n+]2ccc(C(C)(C)C)cc2)cc1[N+](=O)[O-] 727160492 SHFRQQWGPKEARH-UHFFFAOYSA-O 484.001 5.860 5 20 JKBD Cc1cc(O[C@H](C)c2ccccc2)ccc1NC(=O)c1cc([N+](=O)[O-])ccc1N1CCOCC1 728010394 IHWZDLYQQOCGGP-LJQANCHMSA-N 461.518 5.132 5 20 JKBD CC(=O)N(C)c1ccc(N[C@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Br)c2ccccc2)cc1 744264510 OUVLHRYCCSHALX-QFIPXVFZSA-N 497.349 5.132 5 20 JKBD O=C(O[C@H](C(=O)Nc1ccccc1)c1ccccc1)c1csc(-c2cccc([N+](=O)[O-])c2)n1 747962450 PXHANRIANYNJPI-NRFANRHFSA-N 459.483 5.255 5 20 JKBD O=C(COC(=O)/C=C\c1cc(C(F)(F)F)ccc1Cl)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 825212201 MACBWQJCCCKXMO-BHQIHCQQSA-N 496.747 5.481 5 20 JKBD CC(C)c1noc(COC(=O)C/C(=C\c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)n1 859007312 ZMUGDMUCYSOVDA-LFIBNONCSA-N 464.503 5.385 5 20 JKBD Cc1ccc(C(=O)Nc2ccc(F)c([N+](=O)[O-])c2)cc1NC(=O)c1ccc(Br)cc1 915281852 YGAXCSVUPVPAPH-UHFFFAOYSA-N 472.270 5.309 5 20 JKBD COc1ccc(Oc2ccc([N+](=O)[O-])cc2C(=O)O[C@H](C)c2nnc(-c3cccs3)o2)cc1 915443003 WHEDAZSZILVBLW-CYBMUJFWSA-N 467.459 5.425 5 20 JKBD O=C(O[C@H](C(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1)c1ccccc1)c1c(Cl)nc2ccccn12 919234243 BILHDJJUKHBWNJ-IBGZPJMESA-N 485.283 5.086 5 20 JKBD CC(C)c1ccccc1NC(=O)COC(=O)c1ccc(N[C@H](C)c2ccccn2)c([N+](=O)[O-])c1 920545137 FYFGBUKPCXJPBU-QGZVFWFLSA-N 462.506 5.082 5 20 JKBD Cc1cccc2sc(N(Cc3ccccc3)C(=O)COc3ccc([N+](=O)[O-])c(F)c3)nc12 921270290 RZUPTRSLHRIQAQ-UHFFFAOYSA-N 451.479 5.264 5 20 JKBD Cc1ccc(C(=O)NC2(c3ccc(NC(=O)Cc4ccc(Cl)cc4[N+](=O)[O-])cc3)CCC2)c(C)n1 1786116137 ZKVHFVOBOOXABY-UHFFFAOYSA-N 492.963 5.250 5 20 JKBD Cc1occc1C(=O)NC1(c2ccc(NC(=O)c3cccc([N+](=O)[O-])c3Br)cc2)CCC1 1790636466 GAEJLVVSIGCUKN-UHFFFAOYSA-N 498.333 5.320 5 20 JKBD CCOc1ccccc1C(=O)NC1(c2ccc(NC(=O)Cc3ccc([N+](=O)[O-])cc3F)cc2)CCC1 1791184587 ZHZYWLCCSHPABR-UHFFFAOYSA-N 491.519 5.123 5 20 JKBD COc1cc(C(=O)NC2(c3ccc(NC(=O)[C@@H](C)c4cccs4)cc3)CCC2)ccc1[N+](=O)[O-] 1791813463 AFFZMWCFZPTNIQ-INIZCTEOSA-N 479.558 5.216 5 20 JKBD Cc1ccc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cc(Cl)cc([N+](=O)[O-])c2C)C3)c(Cl)c1 1803630086 ONVLLJRWDDIZFG-BJWYYQGGSA-N 476.360 5.084 5 20 JKBD Cc1cc(C)nc(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3cc(Cl)cc([N+](=O)[O-])c3C)CC2)c1 1827320686 ZVHHWIMEVWYGMI-HSZRJFAPSA-N 499.011 5.116 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)N1CCCC[C@H]1C1CCN(C(=O)[C@]2(F)CCCC=C2F)CC1 1830731489 WKQANLWKIVFRJB-CPJSRVTESA-N 493.526 5.021 5 20 JKBD COc1cc(C(=O)NCCCn2cnc3ccccc32)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 15137632 BZANYNWQDNHSAU-UHFFFAOYSA-N 480.908 5.219 5 20 JKBD Cc1csc(Sc2ccc(C(=O)Nc3ccccc3I)cc2[N+](=O)[O-])n1 15418063 GVSJKEWFBNSGCS-UHFFFAOYSA-N 497.339 5.368 5 20 JKBD Cc1ccc(NC(=O)c2cc(Cl)ccc2[N+](=O)[O-])cc1S(=O)(=O)Nc1cccc(Cl)c1 15425311 VGEYMAMJXPQEPG-UHFFFAOYSA-N 480.329 5.263 5 20 JKBD O=C(Nc1ccc(OC(=O)c2cc(F)ccc2Br)cc1)c1cc([N+](=O)[O-])ccc1Cl 15602808 WULSCBHAPICIQQ-UHFFFAOYSA-N 493.672 5.621 5 20 JKBD Cc1ccc(-c2csc3ncnc(S[C@H](C)c4nnc(-c5ccc([N+](=O)[O-])cc5)o4)c23)cc1 16048715 UCUICOMEXUCVOB-CQSZACIVSA-N 475.555 6.478 5 20 JKBD COc1cc(C(=O)NC[C@H](c2ccco2)N2CCCC2)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 17702236 VOHUBBJMFWTLCA-LJQANCHMSA-N 485.924 5.209 5 20 JKBD O=C(Nc1cc(Cl)c([N+](=O)[O-])cc1OCc1ccccc1)c1cccc(N2CCCC2=O)c1 18081184 GNHMXMJGAHDTMG-UHFFFAOYSA-N 465.893 5.206 5 20 JKBD C[C@H](c1ccccc1)n1c(SCc2cc([N+](=O)[O-])cc3c2OCOC3)nc2ccccc2c1=O 20891044 BILLGDFDMYCZIG-MRXNPFEDSA-N 475.526 5.073 5 20 JKBD Cc1c(-c2ccccc2)sc(NC(=O)Cc2ccc([N+](=O)[O-])cc2)c1C(=O)N1CCCCC1 23271924 DKCSAOWQKJWBET-UHFFFAOYSA-N 463.559 5.439 5 20 JKBD O=C(CSc1cccc2cccc(Cl)c12)OCc1nnc(-c2ccc([N+](=O)[O-])cc2)o1 28614367 GFQZRILPDZLKQJ-UHFFFAOYSA-N 455.879 5.287 5 20 JKBD COCCOc1ccc(NC(=O)c2ccc(NCc3ccccc3Cl)c([N+](=O)[O-])c2)cc1 29211261 ULKGWZQKIJFQQC-UHFFFAOYSA-N 455.898 5.138 5 20 JKBD CCOc1cc(C(=O)Nc2cc(C)nn2-c2cc(C(F)(F)F)ccc2Cl)c([N+](=O)[O-])cc1OC 105585463 LMEQXFJIWOUGDD-UHFFFAOYSA-N 498.845 5.421 5 20 JKBD COc1cc(C(=O)Nc2nc3ccccc3n2CCCc2ccccc2)c([N+](=O)[O-])cc1OC(F)F 476765270 UGKSEOUPMNOLJL-UHFFFAOYSA-N 496.470 5.440 5 20 JKBD CS(=O)(=O)Cc1cccc(NC(=O)c2ccc(Sc3nc4ccccc4s3)c([N+](=O)[O-])c2)c1 478300722 GPWGBOGOHMQUTF-UHFFFAOYSA-N 499.595 5.153 5 20 JKBD Cc1nccn1CCCNC(=O)c1ccccc1Sc1ccc(C(F)(F)F)cc1[N+](=O)[O-] 509180427 QTHDLWBRSRMTBW-UHFFFAOYSA-N 464.469 5.090 5 20 JKBD O=C(C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)NCc1cccnc1-n1cccn1 509436651 OCVVVLNVAYPYDI-HKWRFOASSA-N 496.552 5.032 5 20 JKBD COc1cc(C(=O)Nc2ccc(Oc3cccnc3)c(C)c2)c([N+](=O)[O-])cc1OCc1cscn1 512165848 IASBOBKKVJPTEK-UHFFFAOYSA-N 492.513 5.387 5 20 JKBD Cc1cc(C)c(CNC(=O)c2c3c(nc4ccccc24)/C(=C\c2ccc([N+](=O)[O-])cc2)CCC3)c(O)n1 514329061 VWZIQPSMQALZEI-HKWRFOASSA-N 494.551 5.667 5 20 JKBD C[C@@H](c1cccnc1)N(C)C(=O)C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1 520103175 QIKPCTAWPSPLTN-TYSUYXETSA-N 458.543 5.750 5 20 JKBD CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)N[C@H]1CCCc2nc(-c3ccc(F)cc3)sc21 520611565 REBANBXGTQGMIH-NRFANRHFSA-N 468.554 5.855 5 20 JKBD COc1ccc([N+](=O)[O-])cc1NC(=O)c1cnn(-c2cccc(C(F)(F)F)c2)c1C(F)(F)F 603440615 LMRWCOGLGBBYSN-UHFFFAOYSA-N 474.317 5.079 5 20 JKBD COCCN(C(=O)c1cc2c(s1)CC[C@@H](C)C2)c1nc(-c2ccc([N+](=O)[O-])cc2)cs1 603461155 ANQAYOOTSMICHN-CQSZACIVSA-N 457.577 5.198 5 20 JKBD CC(C)OC(=O)C[C@H](NC(=O)Nc1c(C(C)C)cccc1C(C)C)c1ccccc1[N+](=O)[O-] 603643836 UVPJCFVVNSRDDH-NRFANRHFSA-N 455.555 6.046 5 20 JKBD Cc1ccc(S(=O)(=O)Nc2ccc(NC(=O)[C@H]3CCC[C@H](C(F)(F)F)C3)cc2)cc1[N+](=O)[O-] 603780472 DKRSUFDWQCYFLZ-GJZGRUSLSA-N 485.484 5.011 5 20 JKBD Cc1ccc(CN(C(=O)Cc2cn(-c3ccccc3)nc2-c2ccc([N+](=O)[O-])cc2)C2CC2)o1 603814030 AKLSZTWBYBSRIU-UHFFFAOYSA-N 456.502 5.083 5 20 JKBD CC(C)Oc1ncccc1CN[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Br)c1ccccc1 604045550 STSOCMGTHSNKEW-OAQYLSRUSA-N 499.365 5.009 5 20 JKBD C[C@H](Nc1ccc(C(=O)N2CCC(N3c4ccccc4C[C@@H]3C)CC2)cc1[N+](=O)[O-])c1ccccn1 604309608 VPFIDFMMCRBSIJ-PMACEKPBSA-N 485.588 5.219 5 20 JKBD C[C@H]1Cc2ccccc2N1C1CCN(C(=O)c2ccc(N[C@H](C)c3ccccn3)c([N+](=O)[O-])c2)CC1 604309610 VPFIDFMMCRBSIJ-VQTJNVASSA-N 485.588 5.219 5 20 JKBD COc1cc(CN[C@@H]2CCc3nc(-c4ccccc4)ncc3C2)ccc1OCc1ccc([N+](=O)[O-])cc1 608782227 VFXGCTIAKVFAKK-XMMPIXPASA-N 496.567 5.287 5 20 JKBD COc1c([N+](=O)[O-])cc(NCc2cccc(COC(C)(C)C)c2)c([N+](=O)[O-])c1Br 726182943 CEIABMLSEBXJDO-UHFFFAOYSA-N 468.304 5.201 5 20 JKBD CCOc1ccc(Br)cc1CN(C(=S)Nc1ccc([N+](=O)[O-])cc1)C1CC1 728794040 ZGHMZEKALRYUJZ-UHFFFAOYSA-N 450.358 5.117 5 20 JKBD COc1ccc(CSCC(=O)Oc2ccc(NC(=O)c3sccc3C)cc2)cc1[N+](=O)[O-] 729215584 KECSFNBGVDADIY-UHFFFAOYSA-N 472.544 5.064 5 20 JKBD C[C@@H](OC(=O)c1cn(Cc2ccccc2)nc1-c1ccccc1)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 746155144 YSJNJLYSSOOJIN-GOSISDBHSA-N 495.495 5.475 5 20 JKBD O=C(c1cc([N+](=O)[O-])ccc1N1CCC(Cc2ccccc2)CC1)N1CCC(N2CCCCC2)CC1 746517455 PNJMEWRYYLDYJU-UHFFFAOYSA-N 490.648 5.144 5 20 JKBD CC(C)[C@H](OC(=O)c1csc(-c2ccc([N+](=O)[O-])cc2)n1)C(=O)Nc1cc(Cl)ccc1Cl 747955766 XMUQLOVMKWMRBW-SFHVURJKSA-N 494.356 5.845 5 20 JKBD CC(=O)N(c1nc(COC(=O)c2cc(Cl)ccc2[N+](=O)[O-])cs1)c1c(C)cc(C)cc1C 754672302 KQXRBVYUEOLVQN-UHFFFAOYSA-N 473.938 5.672 5 20 JKBD C[C@@H](Sc1nc2ccc([N+](=O)[O-])cc2s1)c1nc(O)c2c(-c3ccco3)csc2n1 760107588 CQQHYUAWKNEJMN-SECBINFHSA-N 456.530 6.028 5 20 JKBD CCc1cccc(CC)c1NC(=O)[C@@H](C)OC(=O)c1cc([N+](=O)[O-])ccc1N1CCC(C)CC1 853804186 KZZQRHFHEPNBIQ-GOSISDBHSA-N 467.566 5.140 5 20 JKBD O=C(Nc1cc(Cl)c([N+](=O)[O-])cc1OCc1ccccc1)c1cccc(NC(=O)[C@@H]2CCCO2)c1 888564346 UZNHZKMIEWFHHJ-QFIPXVFZSA-N 495.919 5.197 5 20 JKBD Cc1ccc(/C(O)=C(/C(=S)N[C@@H]2C[C@H]3CC[C@H]2C3)[n+]2ccc(C(C)(C)C)cc2)cc1[N+](=O)[O-] 912844236 NYEGOUIACLBBJN-BBTUJRGHSA-O 466.627 5.478 5 20 JKBD Cc1ccc(-n2c(SCC(=O)Nc3cc(Cl)ccc3[N+](=O)[O-])nnc2-c2ccccn2)c(C)c1 917255879 INXCPHQVDVFTQJ-UHFFFAOYSA-N 494.964 5.239 5 20 JKBD C[C@@H](NC(=O)NC[C@@H](c1ccc(N(C)C)cc1)c1c[nH]c2ccccc12)c1cccc([N+](=O)[O-])c1 918169643 UBJHDXZKELSFNG-KOSHJBKYSA-N 471.561 5.334 5 20 JKBD COc1cc(C(=O)NC[C@H]2CCCC[C@@H]2C(C)(C)C)c([N+](=O)[O-])cc1OCc1cscn1 920042575 ZEWACZIAHYKAGN-QAPCUYQASA-N 461.584 5.221 5 20 JKBD C[C@H](Nc1ccc(C(=O)O[C@@H](C(=O)Nc2ccccc2)c2ccccc2)cc1[N+](=O)[O-])c1ccccn1 920544521 CELVUIBZPLQXQS-AFMDSPMNSA-N 496.523 5.700 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)c3ccc([N+](=O)[O-])[nH]3)CCC2)cc1)c1ccc(-c2ccccc2)nc1 1789958456 OKVIFMFQJXGYHU-UHFFFAOYSA-N 481.512 5.046 5 20 JKBD CN(C)c1ccc([N+](=O)[O-])c(C(=O)Nc2ccc(C3(NC(=O)[C@H](F)c4ccccc4)CCC3)cc2)c1 1790055093 XTVFAXJAVZITSG-XMMPIXPASA-N 490.535 5.119 5 20 JKBD Cc1cc(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)c3cc(Cl)cc([N+](=O)[O-])c3C)[nH]n2)c(C)o1 1816416106 CYTWSRWPBKYRHE-IBGZPJMESA-N 485.928 5.109 5 20 JKBD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)[nH]n1)c1ccccc1F 1820412204 QIEQGRZYZSHCPI-IBGZPJMESA-N 493.520 5.291 5 20 JKBD COc1cccc(C(=O)N2CCCC[C@H]2C2CCN(C(=O)c3cc(Cl)cc([N+](=O)[O-])c3C)CC2)c1 1829985969 BJKMEPNLCVSWJL-QHCPKHFHSA-N 499.995 5.112 5 20 JKBD CCCCC[C@@H](C)C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cc([N+](=O)[O-])ccc2N(C)C)CC1 1831465389 HYPAYUYUQKFBPT-YKSBVNFPSA-N 486.657 5.111 5 20 JKBD O=C(c1cc2cc([N+](=O)[O-])ccc2s1)N1CC2(CCCN2C(=O)c2c[nH]c3c(Cl)cccc23)C1 1845682898 HYQBMGRNNNYGBW-UHFFFAOYSA-N 494.960 5.075 5 20 JKBD O=C(CSc1nnc(-c2ccc(F)cc2)n1-c1ccccc1)Nc1ccc([N+](=O)[O-])cc1Cl 9998865 CCYOCHWPXBZRQT-UHFFFAOYSA-N 483.912 5.366 5 20 JKBD O=C(Nc1ccccc1Br)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 15349886 AWCGZQMITAQTOH-UHFFFAOYSA-N 472.261 5.231 5 20 JKBD O=C(CCn1ccc2ccccc21)Oc1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2Cl)cc1 15597317 AWZJEZFABRNYMH-UHFFFAOYSA-N 463.877 5.451 5 20 JKBD COc1cc(CCNC(=O)CCc2c(-c3ccc(F)cc3)[nH]c3ccccc23)c([N+](=O)[O-])cc1OC 16144027 JRALDGGIOBNPOA-UHFFFAOYSA-N 491.519 5.191 5 20 JKBD COc1cc(CSc2nnc(COc3ccc(Cl)cc3)o2)c([N+](=O)[O-])cc1OC(F)F 24974265 ZQVGHJANFAOLPD-UHFFFAOYSA-N 473.841 5.113 5 20 JKBD COc1cc(C(=O)Nc2ccc3c(c2)NC(=O)[C@@H](C)O3)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 27019087 PQIUUYQFOGXGFZ-GFCCVEGCSA-N 483.864 5.021 5 20 JKBD Cc1sc2nc(SCc3nc(-c4cccc([N+](=O)[O-])c4)no3)n(C3CCCC3)c(=O)c2c1C 45705457 BAZBNPCVUQJTNG-UHFFFAOYSA-N 483.575 5.440 5 20 JKBD COc1ccc(NC(=O)c2cccc(C)c2[N+](=O)[O-])cc1NC(=O)c1ccc(Cl)cc1F 59784228 CPTXSBRAZSWXKB-UHFFFAOYSA-N 457.845 5.209 5 20 JKBD O=C(Nc1ccc(Cl)c([N+](=O)[O-])c1)[C@H](Sc1nnc(N2CCCC2)s1)c1ccccc1 72016320 TUMRUMSILXRIOU-QGZVFWFLSA-N 475.983 5.172 5 20 JKBD O=C(Cn1c2ccccc2c(=O)c2ccccc21)Nc1nc(-c2ccc(F)c(Cl)c2)cs1 72029411 XKTDSAGOOVXIDK-UHFFFAOYSA-N 463.921 5.709 5 20 JKBD Cc1ccc(-c2nnc(S[C@H](C)C(=O)Nc3nc(-c4cccc([N+](=O)[O-])c4)cs3)o2)cc1 255941429 MCJDMMSMIBJZOP-CYBMUJFWSA-N 467.532 5.196 5 20 JKBD CC[C@@H](c1ccc(F)cc1)N(Cc1cccc(F)c1)C(=O)CCn1nc(C)c([N+](=O)[O-])c1C 303097282 AVHDKRKBFHNMQD-QFIPXVFZSA-N 456.493 5.257 5 20 JKBD O=C(Nc1ccc(OC(F)F)cc1OC(F)F)c1csc(-c2ccc([N+](=O)[O-])cc2)n1 498622709 UJPDPUGYTLHHNN-UHFFFAOYSA-N 457.361 5.173 5 20 JKBD C[C@@H](NC(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1cccc(NC(=O)Cc2ccccc2F)c1 502531004 RKTXAOGGMLWBQD-CQSZACIVSA-N 470.888 5.451 5 20 JKBD C[C@H](Nc1ccc(C(=O)N[C@H]2C[C@H]2c2ccccc2C(F)(F)F)cc1[N+](=O)[O-])c1ccccn1 505564225 DDFIQUALOYVRPR-LFRPXUGBSA-N 470.451 5.468 5 20 JKBD Cc1sc(NC(=O)c2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)nc1-c1ccc(Br)cc1 506000155 WQZIENLUXFMOPR-UHFFFAOYSA-N 498.362 5.442 5 20 JKBD COc1ccc([C@H]2CCCN2C(=O)c2ccc(N[C@@H](C)c3ccccn3)c([N+](=O)[O-])c2)cc1OC 506087090 SBULKRUWICCICV-HTAPYJJXSA-N 476.533 5.157 5 20 JKBD COc1cc(CN[C@@H]2CCSc3ccc(F)cc32)ccc1OCc1ccc([N+](=O)[O-])cc1 507952786 UOJIAFUAUKPWJO-OAQYLSRUSA-N 454.523 5.648 5 20 JKBD COc1cc([C@@H](C)NCc2ccc(Oc3ccccc3Cl)c([N+](=O)[O-])c2)cc(OC)c1OC 508104518 RCSZDMIURKGQML-OAHLLOKOSA-N 472.925 5.917 5 20 JKBD O=C(C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)NCc1cccnc1-n1cccn1 509436652 OCVVVLNVAYPYDI-HMMYKYKNSA-N 496.552 5.032 5 20 JKBD COc1ccccc1Oc1ccc(NC(=O)c2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)cc1F 510272967 UJDDFZSDHIRCRJ-UHFFFAOYSA-N 462.437 5.188 5 20 JKBD C[C@H](NC(=O)Nc1ccc(NC(=O)c2ccoc2)cc1C(F)(F)F)c1cccc([N+](=O)[O-])c1 510344540 WXDVGMUEXRNKRP-LBPRGKRZSA-N 462.384 5.342 5 20 JKBD Cc1nn(C)c(C(=O)NC[C@@H](c2ccccc2)c2c(-c3ccccc3)[nH]c3ccccc23)c1[N+](=O)[O-] 512395652 YTFJPUZAYCNSNR-QFIPXVFZSA-N 479.540 5.347 5 20 JKBD CC(=O)CCc1ccc(OCc2cccc(C(=O)Nc3cc(-c4cccc([N+](=O)[O-])c4)[nH]n3)c2)cc1 515376025 UCDRNJYNWIAFPJ-UHFFFAOYSA-N 484.512 5.338 5 20 JKBD C[C@H]1C[C@H](C)CN(c2ccc(C(=O)Nc3cc4c(cc3Cl)OCCCO4)cc2[N+](=O)[O-])C1 518124640 VWXRHXORAQAHJO-GJZGRUSLSA-N 459.930 5.144 5 20 JKBD COc1cc(C(=O)N2CCn3c2nc2ccccc23)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 590566174 FXWVYEMRRCJRPC-UHFFFAOYSA-N 464.865 5.059 5 20 JKBD CCOc1ccc(N(C(=O)CSc2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)cc1 602016299 BNDBZTBMDULMGN-UHFFFAOYSA-N 465.556 6.060 5 20 JKBD C[C@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)Nc1cc(-c2nnc3n2CCCCC3)ccc1Cl 604446802 VHWPELIOFKSBBB-ZDUSSCGKSA-N 490.347 5.293 5 20 JKBD O=C(CSc1ccnc2ccccc12)Nc1c(Br)cc([N+](=O)[O-])cc1Br 609150761 LAGVPVDPBZXZKD-UHFFFAOYSA-N 497.168 5.399 5 20 JKBD O=C(COC(=O)CCc1ccc(Cl)c(Cl)c1)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 725981583 WQYHESIGNVZRIL-UHFFFAOYSA-N 465.211 5.035 5 20 JKBD COc1ccc(NC(=O)c2cc([N+](=O)[O-])c(C)c([N+](=O)[O-])c2)cc1OCc1ccc2ccccc2n1 728009152 RBHCCBUAZPYRNB-UHFFFAOYSA-N 488.456 5.200 5 20 JKBD O=C(CSCc1coc(-c2ccccc2)n1)N(CC1CC1)c1ccc(Cl)c([N+](=O)[O-])c1 728164911 CDEOKAGQGAPWPH-UHFFFAOYSA-N 457.939 5.580 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)OCC(=O)N2CCC[C@@H]2c2ccc(Cl)c(Cl)c2)cc1SC 728649589 NBXBZUBOPSYZFP-MRXNPFEDSA-N 499.372 5.153 5 20 JKBD O=C(O[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1)c1cnc(C2CC2)s1 729773432 NTAJBQDCLRFKLS-SFHVURJKSA-N 457.895 5.119 5 20 JKBD Cc1ccc(C(=O)N[C@H](CC(=O)N(C)Cc2cc([N+](=O)[O-])ccc2Cl)c2ccccc2)cc1 729830086 VVFHSIQXDIGLPG-HSZRJFAPSA-N 465.937 5.076 5 20 JKBD CC(C)N(Cc1nnc(-c2cccc([N+](=O)[O-])c2)o1)C(=O)Cc1coc2ccc3ccccc3c12 864242569 KKKYQAXNJZHMSM-UHFFFAOYSA-N 470.485 5.524 5 20 JKBD Cc1nn(Cc2ccc(-c3nc(-c4cccnc4Oc4ccccc4)no3)cc2)c(C)c1[N+](=O)[O-] 904453584 QZHSWYUZSBGEST-UHFFFAOYSA-N 468.473 5.361 5 20 JKBD COc1cc(C(=O)O[C@H](C)c2nc(C(C)C)no2)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 914893701 VIOMBLBSPJOLJR-GFCCVEGCSA-N 461.858 5.474 5 20 JKBD COc1ccc(Oc2ccc([N+](=O)[O-])cc2C(=O)O[C@H](C)C(=O)Nc2ccccc2Cl)cc1 915442651 OGLUKNBQGAXLGI-CQSZACIVSA-N 470.865 5.233 5 20 JKBD Cc1ccc(C(=O)O[C@H](C)C(=O)Nc2cc([N+](=O)[O-])ccc2Cl)cc1NC(=O)c1ccccc1F 915517690 TXAICQWYNCJXAB-CQSZACIVSA-N 499.882 5.132 5 20 JKBD CCOc1cc(C(=O)NCCCN2c3ccccc3Sc3ccccc32)c([N+](=O)[O-])cc1OC 917103787 PLXRXLATUDEVNQ-UHFFFAOYSA-N 479.558 5.425 5 20 JKBD O=C(Nc1cc(Cl)c([N+](=O)[O-])cc1OCc1ccccc1)c1ccn(-c2cccc([N+](=O)[O-])c2)n1 918554218 OFQVFCQUUGMQOV-UHFFFAOYSA-N 493.863 5.173 5 20 JKBD COc1cc(C(=O)OCc2cccc3ccccc23)c([N+](=O)[O-])cc1OCc1cscn1 920652075 IHQXXQZXEXCIDI-UHFFFAOYSA-N 450.472 5.149 5 20 JKBD COc1ccc(/C=C\C(=O)Oc2ccc(NC(=O)c3cc([N+](=O)[O-])ccc3Cl)cc2)cc1 923481700 BCQVGJBWUPJDCQ-PQMHYQBVSA-N 452.850 5.128 5 20 JKBD Cc1cc(CCCC(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2ccc(Cl)s2)C3)c([N+](=O)[O-])cc1F 1793402296 UIZVQEHPDVWQMQ-BJWYYQGGSA-N 493.988 5.032 5 20 JKBD CC[C@@H](C)[C@H](C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)Cc1ccc(Cl)cc1[N+](=O)[O-])C2)c1ccccc1 1795568505 RECCKPURUAGHIR-QZWMETGYSA-N 498.023 5.259 5 20 JKBD Cc1c(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)Cc2ccc4ccccc4c2)C3)cc(Cl)cc1[N+](=O)[O-] 1800710100 QVKGMSVPNZVCJA-NUNAXRQHSA-N 491.975 5.204 5 20 JKBD C[C@@H](C(=O)N1CCCC2(CCN(C(=O)c3cccc(F)c3[N+](=O)[O-])CC2)C1)c1ccc(Cl)cc1 1805198675 QVTFRSCPBQHKKR-QGZVFWFLSA-N 487.959 5.036 5 20 JKBD Cc1cc(Cl)ccc1C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cc(F)cc([N+](=O)[O-])c2)[nH]n1 1814593344 JWVXFDSGAPRKKE-HXUWFJFHSA-N 485.903 5.039 5 20 JKBD CC(C)c1ccc(CC(=O)Nc2cc([C@H]3CCCCN3C(=O)c3cc(F)cc([N+](=O)[O-])c3)[nH]n2)cc1 1822138003 ICXDPUSZLSBYMD-HSZRJFAPSA-N 493.539 5.129 5 20 JKBD Cc1ccc(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3cc(Cl)cc([N+](=O)[O-])c3C)CC2)o1 1824684571 CIEWPTJFLTWCCZ-HXUWFJFHSA-N 473.957 5.005 5 20 JKBD CCC[C@H](C(=O)N1CCCC[C@H]1C1CCN(C(=O)/C=C/c2ccccc2[N+](=O)[O-])CC1)n1cccc1 1827635135 XOAJCCATBIPENW-FDYGDTCYSA-N 492.620 5.071 5 20 JKBD Cc1ccc([C@H](C)C(=O)N2CCC([C@@H]3CCCCN3C(=O)c3ccc([N+](=O)[O-])cc3F)CC2)cc1 1830498490 XIQIHKOBUKCTEI-DFBJGRDBSA-N 481.568 5.079 5 20 JKBD Cc1ccc(CC(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3cc4cc([N+](=O)[O-])ccc4s3)CC2)o1 1832333539 YPQMYXZIBIULBA-JOCHJYFZSA-N 495.601 5.187 5 20 JKBD Cc1cc(O)c([N+](=O)[O-])cc1C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2ccccc2C2CC2)CC1 1832556349 XBWKQTSYQHMXLE-DEOSSOPVSA-N 491.588 5.033 5 20 JKBD O=C(c1ccc2occ(Cl)c2c1)N1CC2(CCCN2C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)C1 1845739390 RKGNHEKLVMCXDJ-UHFFFAOYSA-N 495.944 5.340 5 20 JKBD CCn1c(S[C@H](C)C(=O)Nc2cc([N+](=O)[O-])ccc2Cl)nnc1-c1ccc(Cl)cc1 9071428 VXDOBXXMRVBXMH-LLVKDONJSA-N 466.350 5.299 5 20 JKBD O=C(C1CCN(c2ccccc2[N+](=O)[O-])CC1)N1CCC(c2nc3cc(Cl)ccc3s2)CC1 10235571 FMUAGKYLHVYDFG-UHFFFAOYSA-N 485.009 5.481 5 20 JKBD CN(Cc1nc2ccccc2s1)[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1 15515056 WIWVQZHAFLCNPE-JOCHJYFZSA-N 466.950 5.670 5 20 JKBD CCCCn1c(S[C@@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)nc2sc(C)c(C)c2c1=O 17653519 WWPLAIYWQHDSTQ-AWEZNQCLSA-N 485.591 5.686 5 20 JKBD C[C@@H](OC(=O)COc1ccc2oc3ccccc3c2c1)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 17717815 JWRTYDICTNPZCV-CQSZACIVSA-N 459.414 5.227 5 20 JKBD CC(C)N(Cc1nnc(-c2cccc([N+](=O)[O-])c2)o1)C(=S)Nc1ccc(Cl)c(Cl)c1 18142922 ADHWBKHKPWLCQH-UHFFFAOYSA-N 466.350 5.559 5 20 JKBD C[C@@H](NC[C@@H](c1ccccc1)c1c[nH]c2ccccc12)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl 19623270 ZEAXLOZOUSTQJP-UZLBHIALSA-N 462.937 5.478 5 20 JKBD Cc1noc(C)c1CSCC(=O)O[C@H](C(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1)c1ccccc1 22621487 JCEITQAVPYEAKE-NRFANRHFSA-N 489.937 5.009 5 20 JKBD CCn1c(SCC(=O)Nc2c(C)nn(-c3ccccc3)c2C)nc2cc3ccccc3cc2c1=O 24891691 QRKCXSLATREBDS-UHFFFAOYSA-N 483.597 5.103 5 20 JKBD Cc1cc([N+](=O)[O-])ccc1NC(=O)CCSc1nnc(-c2ccc(C(C)(C)C)cc2)n1C 26371471 HFXLIPFDNLWHOS-UHFFFAOYSA-N 453.568 5.117 5 20 JKBD Cc1cc2nnc(S[C@@H](C)C(=O)Nc3nc(-c4cccc([N+](=O)[O-])c4)cs3)n2c2ccccc12 32535149 QQUJCPSIDRFQRI-AWEZNQCLSA-N 490.570 5.342 5 20 JKBD COc1ccc(-c2nnc(S[C@@H](C(=O)Nc3ccc(C)cc3[N+](=O)[O-])c3ccccc3)n2C)cc1 36855628 FKISZSZPNDDCOP-JOCHJYFZSA-N 489.557 5.179 5 20 JKBD O=C(Nc1nc(-c2cc(Cl)sc2Cl)cs1)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-] 476143010 HAFJPGJPTWKSFD-UHFFFAOYSA-N 498.291 6.280 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)Nc2cc(C)nn2-c2ccccc2C(F)(F)F)cc1SC 482105574 PBXQLECGLDBYIF-UHFFFAOYSA-N 466.441 5.091 5 20 JKBD COCCn1cc(NC(=O)c2c3c(nc4ccccc24)/C(=C\c2cccc([N+](=O)[O-])c2)CCC3)cn1 486665412 PKJXTOBRCLPBGI-RGEXLXHISA-N 483.528 5.115 5 20 JKBD COc1ccc([N+](=O)[O-])cc1C(=O)Nc1nc(-c2ccc(OC(F)F)cc2OC(F)F)cs1 494011778 LEDBERODKHYCBK-UHFFFAOYSA-N 487.387 5.182 5 20 JKBD C[C@H](NC(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccc(NC(=O)Nc2ccccc2)cc1 502670543 QGQFTNMRLYDPKO-AWEZNQCLSA-N 453.886 5.775 5 20 JKBD COc1ccc(C[C@@H](NC(=O)N(Cc2ccc([N+](=O)[O-])cc2)C(C)C)c2ccccc2)cc1OC 509697890 MSQHJJVLQWXOBI-XMMPIXPASA-N 477.561 5.516 5 20 JKBD C[C@@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)N(Cc1cccnc1)c1ccc(Br)cc1 515628067 ZCCXWAAFNKDDRB-OAHLLOKOSA-N 472.364 5.466 5 20 JKBD C[C@H]1CN(c2ccccc2NC(=O)c2ccc(NCc3ccccc3)c([N+](=O)[O-])c2)C[C@@H](C)O1 515926155 IVTVPDFAQUDZIB-KDURUIRLSA-N 460.534 5.073 5 20 JKBD COc1cc(CN(C)C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)ccc1OCc1ccccc1 516272427 HORJBYKARMITFC-UHFFFAOYSA-N 455.898 5.500 5 20 JKBD COC(=O)c1c(F)cccc1NC(=O)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])c(OC)c1 517164044 UAZLOTWVOIIFIS-UHFFFAOYSA-N 474.828 5.227 5 20 JKBD COc1ccc([C@@H](CNC(=O)c2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)c2c[nH]c3ccccc23)cc1 517555236 KLHMSLMZTAZMKB-HSZRJFAPSA-N 495.539 5.047 5 20 JKBD COc1cccc(OC)c1Oc1ccc(CNCc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)cn1 520955777 RQSSGTZUBVTIKQ-UHFFFAOYSA-N 461.474 5.349 5 20 JKBD CCOc1ccc(CN(C(=O)c2ccc(N[C@H](C)c3ccccn3)c([N+](=O)[O-])c2)C(C)C)cc1 554094149 JULOQTMLUQMRJA-LJQANCHMSA-N 462.550 5.612 5 20 JKBD Cc1c(C(=O)Nc2ccccc2-c2nc3ccccc3s2)nnn1-c1cccc([N+](=O)[O-])c1 603565865 YNYPZLKKZKRXHH-UHFFFAOYSA-N 456.487 5.013 5 20 JKBD CC1CCN(c2ccc(C(=O)N3C[C@@H](C(F)(F)F)C[C@H](C(F)(F)F)C3)cc2[N+](=O)[O-])CC1 604258285 WXQIATFCDYGJDD-GJZGRUSLSA-N 467.410 5.034 5 20 JKBD O=C(CC1CCN(C(=O)c2cc([N+](=O)[O-])ccc2Sc2ccccc2)CC1)NC1CCCC1 604396612 FHGHRFAPNCRSQV-UHFFFAOYSA-N 467.591 5.047 5 20 JKBD Cc1ccc(SCCNC(=O)C2CCN(c3ccc(C(F)(F)F)cc3[N+](=O)[O-])CC2)cc1 604480408 RYRCWCPBSYEQNV-UHFFFAOYSA-N 467.513 5.047 5 20 JKBD CCOc1cccc2cc([C@@H](C)Nc3cnn(-c4ccc([N+](=O)[O-])cc4)c(=O)c3Cl)oc12 608830370 LHIHUNBXAXNGOD-CYBMUJFWSA-N 454.870 5.112 5 20 JKBD C[C@H](Nc1ccc(C(=O)Nc2cc(Br)ccc2Cl)cc1[N+](=O)[O-])c1ccccn1 608946036 VPQHSBMOZYRDCM-LBPRGKRZSA-N 475.730 5.831 5 20 JKBD O=[N+]([O-])c1ccc(Sc2nnc(-c3c[nH]c4ccccc34)n2C[C@H]2CCCO2)c2ccncc12 619671265 ODGNOWZKACBKDJ-OAHLLOKOSA-N 472.530 5.213 5 20 JKBD O=C(Nc1ccc(OC(=O)c2cnc(Cc3ccc(F)cc3)s2)cc1)c1cccc([N+](=O)[O-])c1 727062884 AEDSVLJHIVXUPC-UHFFFAOYSA-N 477.473 5.253 5 20 JKBD O=C(c1ccc(-n2cc(Br)cn2)cc1)N(CC1CC1)c1ccc(Cl)c([N+](=O)[O-])c1 728165408 JAWZBTPCAIAYDC-UHFFFAOYSA-N 475.730 5.253 5 20 JKBD O=C(c1cc(-c2ccncc2)nc2ccccc12)N(CC1CC1)c1ccc(Cl)c([N+](=O)[O-])c1 728166374 FUDIJOQWYOBCMO-UHFFFAOYSA-N 458.905 5.915 5 20 JKBD O=C1c2ccccc2C(=O)N1Cc1cccc(C(=O)N(CC2CC2)c2ccc(Cl)c([N+](=O)[O-])c2)c1 728167370 UZAZRCJIBOBRGM-UHFFFAOYSA-N 489.915 5.101 5 20 JKBD COc1cc(NC(=O)c2csc(-c3ccc([N+](=O)[O-])cc3)n2)ccc1NC(=O)OC(C)(C)C 747640376 RFKXYOZMGZRTKI-UHFFFAOYSA-N 470.507 5.326 5 20 JKBD O=C(NCc1cn(-c2ccccc2)nc1-c1ccccc1)c1cc([N+](=O)[O-])ccc1Br 750600997 GRAKPBRNFJPPGE-UHFFFAOYSA-N 477.318 5.140 5 20 JKBD O=[N+]([O-])c1cc(C(F)(F)F)c(Cl)cc1Sc1nnc(-c2cccnc2)n1Cc1ccccc1 799773357 WWAWFDLCYPIJOX-UHFFFAOYSA-N 491.882 6.120 5 20 JKBD C[C@H](Sc1ccc([N+](=O)[O-])cc1)c1nc(-c2cccc(Cn3cnc4ccccc43)c2)no1 904489180 CSJLDMHFXMWBJB-INIZCTEOSA-N 457.515 5.896 5 20 JKBD Cc1nc(-c2ccccc2)[nH]c1C(=O)Oc1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2Cl)cc1 916951803 IOWFFJHORPJTCB-UHFFFAOYSA-N 476.876 5.418 5 20 JKBD O=C(NCc1nc(C2CC2)no1)c1c2c(nc3ccccc13)/C(=C/c1ccc([N+](=O)[O-])cc1)CCC2 917765313 CUFHMBGWCBNVFM-NBVRZTHBSA-N 481.512 5.210 5 20 JKBD CCCOc1ccccc1Oc1ncccc1CNC(=O)c1cc([N+](=O)[O-])ccc1N1CCCC1 918622885 KSTIUFKACMEAPP-UHFFFAOYSA-N 476.533 5.101 5 20 JKBD Cc1c([N+](=O)[O-])cc(C(=O)OCC(=O)Nc2c(Cl)c(Cl)cc(Cl)c2Cl)cc1[N+](=O)[O-] 919228378 PUFXPAJRDARYPO-UHFFFAOYSA-N 497.074 5.221 5 20 JKBD C[C@@H](Nc1ccc(C(=O)Oc2cccc(NC(=O)c3ccccc3)c2)cc1[N+](=O)[O-])c1ccccn1 920115873 NSUAQPRCJWWLMN-GOSISDBHSA-N 482.496 5.634 5 20 JKBD CC(C)COC(=O)Nc1cccc(N[C@@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2ccccc2)c1 920422023 PQNYPYGPTLYPQA-HSZRJFAPSA-N 496.951 6.245 5 20 JKBD CC(C)(C)Oc1ccc(C(=O)NC2(c3ccc(NC(=O)c4ccc([N+](=O)[O-])o4)cc3)CCC2)cc1 1785750935 AOCNKEBSPYRGHT-UHFFFAOYSA-N 477.517 5.427 5 20 JKBD CCN(CC)[C@H](C(=O)NC1(c2ccc(NC(=O)c3ccc([N+](=O)[O-])o3)cc2)CCC1)c1ccccc1 1785751095 OUBDPJIOQUCBCY-DEOSSOPVSA-N 490.560 5.019 5 20 JKBD Cc1cc(Cl)ccc1C(=O)Nc1ccc(C2(NC(=O)c3ccc([N+](=O)[O-])o3)CCC2)cc1 1785947797 UFTVJZUAZSWTRF-UHFFFAOYSA-N 453.882 5.211 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)c3ccc([N+](=O)[O-])c4c3OCO4)CCC2)cc1)c1cccc(Cl)c1 1790265534 NTFSSPCYHLNIJO-UHFFFAOYSA-N 493.903 5.038 5 20 JKBD Cc1ncsc1C(=O)NC1(c2ccc(NC(=O)c3cc(Cl)cc([N+](=O)[O-])c3C)cc2)CCC1 1790773728 GRYUVPOAGQSFTI-UHFFFAOYSA-N 484.965 5.383 5 20 JKBD COc1cc(Cl)cc(C(=O)Nc2ccc(C3(NC(=O)c4cc(O)cc([N+](=O)[O-])c4)CCC3)cc2)c1 1792149085 OWSLSNXXQYAAAK-UHFFFAOYSA-N 495.919 5.024 5 20 JKBD O=C(Cc1cccc([N+](=O)[O-])c1)Nc1cc([C@H]2CCCCN2C(=O)c2cc3sccc3s2)[nH]n1 1814375794 VVPMVFURIMZKEO-QGZVFWFLSA-N 495.586 5.143 5 20 JKBD CC(C)[C@H]1CC[C@H](C(=O)Nc2cc([C@@H]3CCCCN3C(=O)c3cc(F)cc([N+](=O)[O-])c3)[nH]n2)CC1 1822103825 HJYCUTFSULIMNT-HOIFWPIMSA-N 485.560 5.225 5 20 JKBD O=C(/C=C/c1ccccc1[N+](=O)[O-])Nc1cc([C@H]2CCCCN2C(=O)c2ccc(Cl)s2)[nH]n1 1823501704 XUEDTXQNCKCPBC-VGMNTSGFSA-N 485.953 5.052 5 20 JKBD Cc1c(Cl)cccc1C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cccc(F)c2[N+](=O)[O-])CC1 1823915616 FXMKIWRJXUGWMN-QFIPXVFZSA-N 487.959 5.243 5 20 JKBD O=C(/C=C/c1ccco1)N1CCC([C@H]2CCCCN2C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)CC1 1831059601 IQPYILZADDKUFY-FGBWHXJSSA-N 493.585 5.349 5 20 JKBD C[C@@H](C(=O)N1CCCC[C@@H]1C1CCN(C(=O)CCc2cccc([N+](=O)[O-])c2)CC1)c1cccs1 1832137699 BZNPQJPDHJCSSY-AUSIDOKSSA-N 483.634 5.012 5 20 JKBD COc1cc(C(=O)N2CCCC[C@H]2C2CCN(C(=O)c3ccc(C4CC4)cc3)CC2)ccc1[N+](=O)[O-] 1832696357 XKMBMKZQJLDTRW-DEOSSOPVSA-N 491.588 5.028 5 20 JKBD O=C(O[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1)c1ccc(Cl)s1 9484368 APVUJIQORHWIPJ-KRWDZBQOSA-N 451.287 5.500 5 20 JKBD C[C@@H](Sc1ncnc2scc(-c3ccc(F)cc3)c12)C(=O)Nc1ccccc1[N+](=O)[O-] 21751130 XGVJRGNRBHKNAD-GFCCVEGCSA-N 454.508 5.525 5 20 JKBD C[C@@H](Sc1ncc(-c2ccccc2)n1C[C@@H]1CCCO1)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl 29072025 FQUHECQNZUNQKD-QAPCUYQASA-N 486.981 5.410 5 20 JKBD Cc1ccc(Sc2ccc(C(=O)N3CCC([C@@H](O)c4ccccc4)CC3)cc2[N+](=O)[O-])cc1 29193556 YUZKYWWPIYDKFF-VWLOTQADSA-N 462.571 5.640 5 20 JKBD C[C@H]1Oc2ccc(NC(=O)c3ccc(Sc4nc5ccccc5s4)c([N+](=O)[O-])c3)cc2NC1=O 29993794 FNCIYEFVRLLKQN-GFCCVEGCSA-N 492.538 5.327 5 20 JKBD C[C@@H]1CCC[C@@H](OCc2cccc(NC(=O)Cn3c4ccccc4c(=O)c4ccccc43)c2)C1 72046319 DOVKSVGTSUSCSL-NFBKMPQASA-N 454.570 5.889 5 20 JKBD CC(C)S(=O)(=O)Cc1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2Sc2ccccc2)cc1 497777626 TZYNPXSIZUYAHS-UHFFFAOYSA-N 470.572 5.322 5 20 JKBD C[C@H](Nc1ccc(C(=O)N2CCO[C@H](c3ccccc3Cl)C2)cc1[N+](=O)[O-])c1ccccn1 505137112 QCZWHOHCMLTQID-HJPURHCSSA-N 466.925 5.030 5 20 JKBD COc1ccc([C@H]2CCCN2C(=O)c2ccc(N[C@H](C)c3ccccn3)c([N+](=O)[O-])c2)cc1OC 506087095 SBULKRUWICCICV-VGOFRKELSA-N 476.533 5.157 5 20 JKBD CCc1cc(Sc2nnc(COc3ccc(Cl)cc3)o2)nc(-c2ccc([N+](=O)[O-])cc2)n1 507133869 GMYFPJUYWFXLFL-UHFFFAOYSA-N 469.910 5.381 5 20 JKBD COc1cc(C(=O)Nc2ccc(Oc3ccc(Cl)cc3Cl)c(F)c2)c([N+](=O)[O-])cc1OC 510266088 BDHGEWOWFRMEJB-UHFFFAOYSA-N 481.263 6.103 5 20 JKBD O=C(Nc1cc(Cl)ccc1Cl)[C@H]1CCCCN1C(=O)c1cc2cc([N+](=O)[O-])ccc2s1 522269047 GYEXNBAPNGINJQ-QGZVFWFLSA-N 478.357 5.750 5 20 JKBD CC(C)NC(=O)c1ccc(Cl)c(NC(=O)c2cc([N+](=O)[O-])ccc2NCc2ccccc2)c1 524296046 CIHDDHFMZXOUGD-UHFFFAOYSA-N 466.925 5.251 5 20 JKBD CCOc1ccc(Oc2ccc(Cl)cc2NC(=O)c2ccc(S(C)(=O)=O)c([N+](=O)[O-])c2)cc1 600818611 JPOLUQBKEHKGMK-UHFFFAOYSA-N 490.921 5.095 5 20 JKBD COc1cc(C(=O)Nc2cc(C(C)(C)C)nn2-c2ccccc2C)c([N+](=O)[O-])cc1OC(F)F 603638399 QPADRJHVFIAOTD-UHFFFAOYSA-N 474.464 5.249 5 20 JKBD CCCS(=O)(=O)Nc1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2Sc2ccccc2)cc1 604441292 NWYGRVUUOCLAAQ-UHFFFAOYSA-N 471.560 5.150 5 20 JKBD Cc1ccc(CN2CCSCC2)cc1NC(=O)CSc1ccc(C(F)(F)F)cc1[N+](=O)[O-] 604537632 NJVYJSNDYCEQSY-UHFFFAOYSA-N 485.553 5.202 5 20 JKBD O=C(CC1CCCC1)NC1CCN(C(=O)c2cc([N+](=O)[O-])ccc2Sc2ccccc2)CC1 609426927 AYWKZQCSLAKZBM-UHFFFAOYSA-N 467.591 5.047 5 20 JKBD CCOc1cc(NC(=O)c2cnn(-c3ccc(C)cc3)c2C(F)(F)F)c([N+](=O)[O-])cc1OCC 619728969 GPANHDPRIIRAKX-UHFFFAOYSA-N 478.427 5.157 5 20 JKBD CCCN(CCC)C(=O)c1cccc(C(=O)N(CC2CC2)c2ccc(Cl)c([N+](=O)[O-])c2)c1 728468884 BAMHJBLDPAHUTL-UHFFFAOYSA-N 457.958 5.567 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)Nc2ccc(N3C[C@H](C)O[C@H](C)C3)c(C(F)(F)F)c2)cc1SC 728475440 PANXGYUOGFFNOL-BETUJISGSA-N 499.511 5.210 5 20 JKBD O=C(OCc1ccc2ccccc2n1)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 729628192 UYCIVSDUKKJQEZ-UHFFFAOYSA-N 459.424 5.122 5 20 JKBD C[C@H](OC(=O)c1cn(C)nc1-c1ccc([N+](=O)[O-])cc1)c1ccccc1NC(=O)c1ccccc1 748019136 JUWLSZTUGLRUHO-KRWDZBQOSA-N 470.485 5.166 5 20 JKBD Cc1ccc(C2=CCN(C(=O)C3CCN(c4ccc(C(F)(F)F)cc4[N+](=O)[O-])CC3)CC2)cc1 762279711 ZZOAPFFQOKDBOY-UHFFFAOYSA-N 473.495 5.454 5 20 JKBD O=[N+]([O-])c1ccc(/C=C(\Cc2nc(Cc3ccncc3)no2)c2nc3ccccc3s2)cc1 904933844 RZVDDWUYKDFWLF-QGOAFFKASA-N 455.499 5.357 5 20 JKBD CC(C)(C)Cc1noc2nc(C3CC3)cc(C(=O)OCC(=O)Nc3cc(Cl)ccc3[N+](=O)[O-])c12 915581851 NKDFXEKHRSQOJT-UHFFFAOYSA-N 486.912 5.046 5 20 JKBD O=[N+]([O-])c1ccc(NC(=S)Nc2ccc(Cl)c(S(=O)(=O)Nc3ccc(Cl)cc3)c2)cc1 916115668 QBKZKOITSBQERQ-UHFFFAOYSA-N 497.385 5.511 5 20 JKBD O=C(Nc1cccc(C(=O)Nc2cc([N+](=O)[O-])c(F)cc2F)c1)c1ccc(Br)cc1 916135393 XSSAQIQFNBTPBE-UHFFFAOYSA-N 476.233 5.140 5 20 JKBD COc1ccc(N[C@@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Br)c2ccccc2)cc1F 917935418 HFJPPJMUFAIZBT-HXUWFJFHSA-N 474.286 5.297 5 20 JKBD CSc1nc(-c2ccc(F)cc2)nc(C)c1C(=O)O[C@@H](C)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 919183109 COABCWZROKQJNU-ZDUSSCGKSA-N 495.492 5.189 5 20 JKBD Cc1ccc(-c2cc(C(=O)O[C@@H](C(=O)Nc3ccc([N+](=O)[O-])cc3Cl)c3ccccc3)n[nH]2)o1 919327051 XHIMOBSMDAXSKG-OAQYLSRUSA-N 480.864 5.077 5 20 JKBD Cc1cc(CCCC(=O)N2CCCC3(CCN(C(=O)C4CC(C)(C)C4)CC3)C2)c([N+](=O)[O-])cc1F 1805821028 DYQYZKHJBDDFMN-UHFFFAOYSA-N 487.616 5.032 5 20 JKBD Cc1cc(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)CC3CCC(C)(C)CC3)CC2)ncc1[N+](=O)[O-] 1827829773 ZTCHYQJSXHUBIK-HSZRJFAPSA-N 484.641 5.138 5 20 JKBD O=C(/C=C/c1ccc([N+](=O)[O-])o1)N1CCC([C@@H]2CCCCN2C(=O)c2csc3c2CCCC3)CC1 1828565603 NGPRFRNIPJVMQX-RCHCNPRSSA-N 497.617 5.075 5 20 JKBD O=C(CSc1ccc2ccccc2n1)Nc1c(Br)cc([N+](=O)[O-])cc1Br 10962726 GXDNMXKCKPTRQC-UHFFFAOYSA-N 497.168 5.399 5 20 JKBD O=C(Nc1cccc([N+](=O)[O-])c1)c1ccc(-n2nc(SCc3ccccc3)sc2=S)cc1 15389897 DBJQAKBVZYAGLS-UHFFFAOYSA-N 480.596 6.116 5 20 JKBD C[C@H](OC(=O)C(c1ccccc1)c1ccccc1)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 20989071 BCMDODLIZBUHFU-HNNXBMFYSA-N 472.419 5.316 5 20 JKBD CCOc1ccc(NC(=O)c2ccc(NC(=O)[C@H](C)Sc3ccc([N+](=O)[O-])cc3)cc2)cc1 22596405 LYVFHTTYSNBISE-INIZCTEOSA-N 465.531 5.365 5 20 JKBD CCc1cccc(CC)c1NC(=O)COc1ccc2c(-c3ccc([N+](=O)[O-])cc3)cc(=O)oc2c1 28609962 VNWGPMNDWATGDM-UHFFFAOYSA-N 472.497 5.511 5 20 JKBD CC1CCN(c2ccc(C(=O)Nc3ccc(-n4cccn4)cc3C(F)(F)F)cc2[N+](=O)[O-])CC1 31967602 XJAIHAGJRLLDPH-UHFFFAOYSA-N 473.455 5.288 5 20 JKBD Cc1ccc(NC(=O)[C@@H](Sc2nc3ccccc3c(=O)n2C(C)C)c2ccccc2)c([N+](=O)[O-])c1 36855550 XXPFRTGYILYWKJ-QHCPKHFHSA-N 488.569 5.666 5 20 JKBD C[C@H](Nc1ccc(C(=O)N[C@H](c2ccccc2)c2ccccn2)cc1[N+](=O)[O-])c1ccccn1 108754788 WAANRSACGNEDQF-AVRWGWEMSA-N 453.502 5.077 5 20 JKBD COc1cc2c(cc1OC)[C@H](c1cccs1)N(C(=O)c1ccc(NC3CC3)c([N+](=O)[O-])c1)CC2 255944253 SSFALXDJFSRVNK-XMMPIXPASA-N 479.558 5.036 5 20 JKBD O=C(CSCc1cc(-c2cccs2)on1)N(Cc1ccccc1[N+](=O)[O-])CC(F)(F)F 488625363 JFPHBWNTZLIVPY-UHFFFAOYSA-N 471.482 5.136 5 20 JKBD O=C(C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)NCc1cccc(OC(F)F)c1 497017978 NYUNYMVCXKSFSS-PDGQHHTCSA-N 495.507 6.053 5 20 JKBD Cc1ccc(-c2nc(C)c([C@@H](C)NC(=O)C3CCN(c4ccccc4[N+](=O)[O-])CC3)s2)cc1 502481745 NRHLFEDWBLOSRS-QGZVFWFLSA-N 464.591 5.429 5 20 JKBD COc1ccc(NC(=O)c2ccc(N[C@@H](C)c3ccccn3)c([N+](=O)[O-])c2)c(C(F)(F)F)c1 509183787 MCCNYLFRHNAWEZ-ZDUSSCGKSA-N 460.412 5.443 5 20 JKBD O=C(Nc1ccc(CCC(=O)N2CCCC2)cc1)c1cc([N+](=O)[O-])ccc1NCc1ccccc1 511446229 OKBODTMHTBICDN-UHFFFAOYSA-N 472.545 5.014 5 20 JKBD CC(C)N(Cc1cccs1)C(=O)Cc1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1 512701649 SCJTUCFOJYXXRE-UHFFFAOYSA-N 460.559 5.489 5 20 JKBD COc1ccc2c(c1)CN(C(=O)C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc3ccccc3s1)CC2 512829975 YIBKGMCPVWDGFW-XSFVSMFZSA-N 485.565 5.729 5 20 JKBD O=C(CCSc1nnc(-c2ccncc2)n1-c1ccc(Cl)cc1)Nc1ccccc1[N+](=O)[O-] 514350434 AQIBJUFGXFJVGX-UHFFFAOYSA-N 480.937 5.012 5 20 JKBD CCCC(=O)Nc1ccc(CNC(=O)c2ccc(Sc3nc(C)cs3)c([N+](=O)[O-])c2)cc1 514574683 PLENUYPEBVCSBF-UHFFFAOYSA-N 470.576 5.180 5 20 JKBD O=C(CSc1ccccc1C(=O)Nc1cc([N+](=O)[O-])ccc1OC(F)F)NCC1CCCCC1 515098081 DKMZXTFHJDZVKN-UHFFFAOYSA-N 493.532 5.237 5 20 JKBD C[C@@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)Nc1ccccc1-c1n[nH]c(-c2ccccc2)n1 518831650 PBMZPFYCTJQWCG-CQSZACIVSA-N 463.881 5.106 5 20 JKBD COCCOc1c(Cl)cccc1NC(=O)c1ccc(N2C[C@H](C)C[C@@H](C)C2)c([N+](=O)[O-])c1 520006083 HJWHGFBYYWYIGK-HZPDHXFCSA-N 461.946 5.008 5 20 JKBD C[C@H](NCc1ccc(N(C)c2ccccc2)c([N+](=O)[O-])c1)c1ccc(NC(=O)NC2CC2)cc1 521818399 KGLZECYSXHTROB-SFHVURJKSA-N 459.550 5.497 5 20 JKBD Cc1ccc(NC(=O)c2cccc(C(F)(F)F)c2)cc1NC(=O)c1c[nH]c2ccc([N+](=O)[O-])cc12 524162151 JTYKHBVLFQIGAN-UHFFFAOYSA-N 482.418 5.908 5 20 JKBD COc1cc(C(=O)Nc2cc(-c3ccc(C)cc3)nn2-c2ccccc2)c([N+](=O)[O-])cc1OC(F)F 585719943 RJYPMDPPBCLEKD-UHFFFAOYSA-N 494.454 5.618 5 20 JKBD O=C(c1ccccc1)c1ccc(N2CCC(C(=O)c3cc(F)ccc3F)CC2)c([N+](=O)[O-])c1 603861942 HTNHNUBXGIKISF-UHFFFAOYSA-N 450.441 5.203 5 20 JKBD COc1ccc(CNCc2ccc(-c3ccc([N+](=O)[O-])cc3Br)o2)cc1OC(F)F 608835848 ZMPVYTWYTZEFKU-UHFFFAOYSA-N 483.265 5.517 5 20 JKBD C[C@H](Nc1ccc(C(=O)Nc2cc(F)ccc2N2CCCCC2)cc1[N+](=O)[O-])c1ccccn1 608874409 NZZVZCGJFOSWIC-KRWDZBQOSA-N 463.513 5.545 5 20 JKBD C[C@H](Nc1ccc(C(=O)NC2(c3cccc(C(F)(F)F)c3)CC2)cc1[N+](=O)[O-])c1ccccn1 608948808 YSQKLXRMHRPOQR-HNNXBMFYSA-N 470.451 5.601 5 20 JKBD O=C(c1cc([N+](=O)[O-])ccc1Sc1ccccc1)N1CCO[C@@H](c2ccc(F)c(F)c2)C1 608965178 SWILWJWSNXKTFQ-OAQYLSRUSA-N 456.470 5.238 5 20 JKBD CCOc1cc([N+](=O)[O-])c(C(=O)Nc2ccc(O[C@H](C)c3ccccc3)cc2C)cc1OC 609066800 JJWGNGCYZAYBNO-QGZVFWFLSA-N 450.491 5.703 5 20 JKBD O=C(c1cc([N+](=O)[O-])ccc1Oc1ccccc1)N1CCC(c2nc(-c3ccccc3)no2)CC1 609141575 CEWXIUXQDRIXEZ-UHFFFAOYSA-N 470.485 5.457 5 20 JKBD C[C@H](OC(=O)[C@@H]1C[C@H]1c1ccc2ccccc2c1)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 731272238 BEOPDJGZXGLQMQ-FASAQXTFSA-N 472.419 5.441 5 20 JKBD O=C(Nc1ccc(C(=O)Nc2cc([N+](=O)[O-])c(F)cc2F)cc1)c1ccc(Br)cc1 916375255 QYQMDMDKEDMVAW-UHFFFAOYSA-N 476.233 5.140 5 20 JKBD COc1ccc([N+](=O)[O-])c(C(=O)Nc2sc(C)c(-c3ccccc3)c2C(=O)OC(C)C)c1 920279171 TWTBTQRCSKYIFX-UHFFFAOYSA-N 454.504 5.458 5 20 JKBD Cc1cc(C)n(-c2ccc(C(=O)Oc3ccc(NC(=O)c4cc([N+](=O)[O-])ccc4Cl)cc3)cc2)n1 923460936 UQYACESNXNYHKO-UHFFFAOYSA-N 490.903 5.522 5 20 JKBD CCCCSc1ccc([N+](=O)[O-])cc1C(=O)N1CCc2c(ncn2CCc2ccccc2)C1 929071294 VKUJTWWVLONUAT-UHFFFAOYSA-N 464.591 5.125 5 20 JKBD O=C(CCc1cnc2ccccc2c1)NC1(c2ccc(NC(=O)c3ccc([N+](=O)[O-])o3)cc2)CCC1 1785748483 IFHJUOQIIFLZQV-UHFFFAOYSA-N 484.512 5.117 5 20 JKBD O=C(Cc1cccc([N+](=O)[O-])c1)Nc1ccc(C2(NC(=O)c3ccc4ccoc4c3)CCC2)cc1 1785795266 IMBRAVHZGZNGJA-UHFFFAOYSA-N 469.497 5.331 5 20 JKBD O=C(CCc1ccc[nH]1)NC1(c2ccc(NC(=O)c3cc4cc([N+](=O)[O-])ccc4s3)cc2)CCC1 1791010957 KGNKOWNTLWJHRA-UHFFFAOYSA-N 488.569 5.518 5 20 JKBD CCCCC[C@H](C)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)CSc2ccccc2[N+](=O)[O-])n[nH]1 1822313052 KAWZMDOYUHAFEZ-PKOBYXMFSA-N 487.626 5.319 5 20 JKBD CC[C@@H](C(=O)N1CCC([C@@H]2CCCCN2C(=O)Cc2cc([N+](=O)[O-])ccc2F)CC1)c1ccccc1 1824946800 QINMEMAAVBYASS-RSXGOPAZSA-N 495.595 5.090 5 20 JKBD CCc1cccc(C)c1Nc1nnc(S[C@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)s1 16681116 KJDOJQZHIYSZHL-CYBMUJFWSA-N 468.564 5.964 5 20 JKBD O=C(Nc1ccccc1C(=O)NCc1ccc(OC(F)(F)F)cc1)c1ccc([N+](=O)[O-])cc1Cl 26064242 BJEXVZUHASTFEX-UHFFFAOYSA-N 493.825 5.329 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Br)[C@@H](NCc1cc(F)cc(F)c1)c1ccccc1 26996362 LECKFSXJAQXUMK-FQEVSTJZSA-N 476.277 5.105 5 20 JKBD Cn1ccnc1[C@@H](NC(=O)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1)c1ccccc1F 29999172 AEGZZJYVGSDDIL-QFIPXVFZSA-N 480.883 5.433 5 20 JKBD COC(=O)c1ccc(CN(C)C(=O)c2ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])c(OC)c2)cc1 30516433 IXKOJVYJVBJHIH-UHFFFAOYSA-N 484.892 5.108 5 20 JKBD C[C@H](Sc1nnc(-c2cccnc2)n1Cc1ccccc1)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl 36788102 PAGQYPDAYKMPFB-HNNXBMFYSA-N 494.964 5.069 5 20 JKBD Cc1csc(Sc2ccc(C(=O)N(Cc3ccco3)c3ccccn3)cc2[N+](=O)[O-])n1 302937174 JVQJGRJOLVYMFN-UHFFFAOYSA-N 452.517 5.346 5 20 JKBD COCc1cccc(CNC(=O)C/C(=C\c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)c1 482362023 BPUWWWSLMJXMEH-KGENOOAVSA-N 473.554 5.598 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)N2c3ccccc3CC[C@H]2C(=O)Nc2ccccc2C)cc1SC 483669267 GMHQCJLKBUUYNL-NRFANRHFSA-N 491.569 5.234 5 20 JKBD CCOc1cc([N+](=O)[O-])c(C(=O)Nc2ccc3nc(-c4cc(F)ccc4F)[nH]c3c2)cc1OC 486446711 OLWVPTCYRGDMPD-UHFFFAOYSA-N 468.416 5.076 5 20 JKBD Cc1cccc2[nH]cc(CCNC(=O)Cc3cn(-c4ccccc4)nc3-c3ccc([N+](=O)[O-])cc3)c12 487386532 IHBVUEKDSOVBJI-UHFFFAOYSA-N 479.540 5.139 5 20 JKBD CC(C)(C)N1CCC(NC(=O)c2ccccc2Sc2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 489811300 QPFFOBJOZJECDR-UHFFFAOYSA-N 481.540 5.758 5 20 JKBD Cc1c(NC(=O)c2cc([N+](=O)[O-])ccc2Oc2ccccc2)cccc1C(=O)Nc1ccccc1 498451396 GXMBCSHJRSASEV-UHFFFAOYSA-N 467.481 6.200 5 20 JKBD C[C@H](Sc1nnc(COc2ccc(Cl)cc2Cl)o1)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 501088745 YCRYBMMQEWVUBD-JTQLQIEISA-N 494.316 5.767 5 20 JKBD Cc1ccc(-c2nc(C)c([C@@H](C)NC(=O)c3cn(C)nc3-c3ccc([N+](=O)[O-])cc3)s2)cc1 502447610 TYUMOROZZLZCOY-OAHLLOKOSA-N 461.547 5.227 5 20 JKBD CN1CCC(CN(C)C(=O)c2c3c(nc4ccccc24)/C(=C\c2cccc([N+](=O)[O-])c2)CCC3)CC1 505721755 XFCOIEUVZPMUKF-XLNRJJMWSA-N 484.600 5.434 5 20 JKBD C[C@@H](Nc1ccc(C(=O)N(C)Cc2c(Cl)cccc2Cl)cc1[N+](=O)[O-])c1ccccn1 506205511 RUWAMCGJUKYXSO-CQSZACIVSA-N 459.333 5.742 5 20 JKBD O=C(Nc1ccccc1COc1ccccc1)c1ccc([N+](=O)[O-])cc1I 508753679 IRMSHFJJKKUOSC-UHFFFAOYSA-N 474.254 5.031 5 20 JKBD C[C@@H](Nc1ccc(C(=O)Nc2ccc(OC(F)F)c3ncccc23)cc1[N+](=O)[O-])c1ccccn1 509136342 IKFLIKLYLUYRFY-CQSZACIVSA-N 479.443 5.565 5 20 JKBD COc1ccc(CNC(=O)Nc2cccc(NC(=O)c3cccc(C(F)(F)F)c3)c2)cc1[N+](=O)[O-] 509851708 HYHPQPGAIMRHQL-UHFFFAOYSA-N 488.422 5.196 5 20 JKBD O=C(Nc1ccc(CCC(=O)N2CCCC2)cc1)c1cc([N+](=O)[O-])ccc1Oc1ccccc1 510209433 PQICOJNZRYTEHK-UHFFFAOYSA-N 459.502 5.194 5 20 JKBD Cc1nn(C)c(C(=O)N2C[C@H](c3ccccc3Cl)c3c([nH]c4ccccc34)[C@H]2C)c1[N+](=O)[O-] 512291909 DUOKABIYALADEN-RHSMWYFYSA-N 463.925 5.120 5 20 JKBD COc1ccc(CNC(=O)C/C(=C/c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)cc1F 512301024 BFFAZVZXCLLOSH-PDGQHHTCSA-N 477.517 5.599 5 20 JKBD CC(=O)N(c1ccc(C)cc1)c1nc(COc2ccc(-c3ccccc3)cc2[N+](=O)[O-])cs1 516786237 WSXPCRSOMZDWDI-UHFFFAOYSA-N 459.527 6.290 5 20 JKBD Cc1ccc(C(=O)Nc2cccc(C(F)(F)F)c2)cc1NCc1nc(-c2cccc([N+](=O)[O-])c2)no1 519946407 DTBSTZZVTYYJRH-UHFFFAOYSA-N 497.433 5.836 5 20 JKBD CC(C)(C)c1csc(CNC(=O)Cc2cn(-c3ccccc3)nc2-c2ccc([N+](=O)[O-])cc2)n1 520522794 YJDWNZQKLHHDEO-UHFFFAOYSA-N 475.574 5.060 5 20 JKBD Cc1cc(C(=O)N2CCCC[C@H]2C)ccc1NC(=O)CCNc1ccc(C(F)(F)F)cc1[N+](=O)[O-] 520653007 CSGWRUUGQAISKC-MRXNPFEDSA-N 492.498 5.377 5 20 JKBD Cc1ccc(NC(=O)c2ccc(N(C)CC(=O)Nc3c(C)cc(C)cc3C)c([N+](=O)[O-])c2)cc1 559719674 SMKVPNFCMYPKHL-UHFFFAOYSA-N 460.534 5.156 5 20 JKBD COc1cccc(NCc2nnc(SCCc3ccc([N+](=O)[O-])cc3)n2C2CCCCC2)c1 603723164 MGOQETHGYPTLHL-UHFFFAOYSA-N 467.595 5.647 5 20 JKBD O=C(Nc1ccc(Sc2nncs2)cc1)c1ccc(NCc2ccccc2Cl)c([N+](=O)[O-])c1 604119479 UZHJTQQQFGXHJX-UHFFFAOYSA-N 497.989 6.115 5 20 JKBD COC(=O)c1ccoc1COc1cccc2c1N(C(=O)c1cc3cc([N+](=O)[O-])ccc3s1)CCC2 608946472 BYUVIBDQLFEPBX-UHFFFAOYSA-N 492.509 5.361 5 20 JKBD C[C@@H]1CSc2ccc(Br)cc2[C@@H]1NC(=O)C1CCN(c2ccccc2[N+](=O)[O-])CC1 609192180 AVWKHUQSLABMFN-SPLOXXLWSA-N 490.423 5.173 5 20 JKBD Cc1cc(C(=O)OCC(=O)Nc2ccc([N+](=O)[O-])cc2C(F)(F)F)sc1-c1ccc(F)cc1 726655748 ILWPYDMQAYXMRG-UHFFFAOYSA-N 482.411 5.585 5 20 JKBD O=C(C[C@H](c1ccccc1)C(F)(F)F)Oc1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2Cl)cc1 728456311 HYZQUXCOUYQQJS-LJQANCHMSA-N 492.837 6.142 5 20 JKBD O=C(Nc1ccc(OC(=O)c2csc(-c3cccc([N+](=O)[O-])c3)n2)cc1)c1ccsc1 728886844 UGHDTWKNCWFNDE-UHFFFAOYSA-N 451.485 5.251 5 20 JKBD C[C@H](OC(=O)c1cnc(-c2ccccc2Cl)s1)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 747953995 VLNXIRWJOAPIJK-NSHDSACASA-N 456.867 5.340 5 20 JKBD CC(=O)N1CCCc2cc(NC(=O)c3ccccc3NC(=O)c3ccc([N+](=O)[O-])cc3Cl)ccc21 749229886 GYFJTHQZGUXTER-UHFFFAOYSA-N 492.919 5.052 5 20 JKBD CC(C)C[C@@H](C)N(C(=O)c1ccc(Sc2nncn2C)c([N+](=O)[O-])c1)c1ccc2[nH]ccc2c1 750826382 LTMFNNQHBKGRLM-MRXNPFEDSA-N 478.578 5.437 5 20 JKBD COc1ccc(-c2n[nH]c(S[C@@H](C(=O)Nc3ccc(Cl)c([N+](=O)[O-])c3)c3ccccc3)n2)cc1 785501130 QFOYTGMGXDAKCZ-HXUWFJFHSA-N 495.948 5.514 5 20 JKBD CCN(CC)Cc1ccc(C(=O)Oc2ccc(NC(=O)c3cc([N+](=O)[O-])ccc3Cl)cc2)o1 827159367 BPZOQTVJQYXCKW-UHFFFAOYSA-N 471.897 5.155 5 20 JKBD O=C(Oc1ccc2c(-c3ccc([N+](=O)[O-])cc3)cc(=O)oc2c1)C1(c2ccccc2)CCOCC1 915133435 QQLVICLBRSQPEW-UHFFFAOYSA-N 471.465 5.022 5 20 JKBD CCOc1ccccc1NC(=O)[C@H](OC(=O)c1cc2cc([N+](=O)[O-])ccc2[nH]1)c1ccccc1 917330427 SXNPOMZUWDGEHU-HSZRJFAPSA-N 459.458 5.012 5 20 JKBD Cc1cc[n+](/C(C(=S)Nc2c(C(C)C)cccc2C(C)C)=C(/O)c2cccc([N+](=O)[O-])c2)cc1 917610098 GZCVYDXSTCIXHH-UHFFFAOYSA-O 476.622 6.761 5 20 JKBD Cc1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2I)c(OCc2ccccc2)c1 917787213 DSKCTTIREYYFBY-UHFFFAOYSA-N 488.281 5.339 5 20 JKBD Cc1sc(C(=O)Nc2ccc(S(=O)(=O)Nc3cccc(C(F)(F)F)c3)cc2)cc1[N+](=O)[O-] 917897053 UFWIRPDEUVXUKC-UHFFFAOYSA-N 485.465 5.037 5 20 JKBD O=C(COC(=O)c1cc2cccc([N+](=O)[O-])c2[nH]1)Nc1c(Cl)c(Cl)cc(Cl)c1Cl 919523417 SBIYWPMCNKEBJN-UHFFFAOYSA-N 477.087 5.485 5 20 JKBD O=C(C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)OCc1nccn1C(F)F 926629488 OAIAOBKCFMQBOX-RVDMUPIBSA-N 470.457 5.470 5 20 JKBD C[C@H](Sc1ccccc1)C(=O)NC1(c2ccc(NC(=O)/C=C/c3ccc([N+](=O)[O-])o3)cc2)CCC1 1786205786 QEMTXAZIMIKNBH-SZEUEKNRSA-N 491.569 5.516 5 20 JKBD O=C(NC1(c2ccc(NC(=O)[C@H](F)c3ccccc3)cc2)CCC1)c1cccc(F)c1[N+](=O)[O-] 1786613317 LLUSUULVXDDHPL-OAQYLSRUSA-N 465.456 5.192 5 20 JKBD CN(C)c1ccc([N+](=O)[O-])c(C(=O)NC2(c3ccc(NC(=O)[C@@H](F)c4ccccc4)cc3)CCC2)c1 1786614451 NQQBRKXGHMKZAQ-DEOSSOPVSA-N 490.535 5.119 5 20 JKBD O=C(Cc1cccc([N+](=O)[O-])c1)NC1(c2ccc(NC(=O)c3ccc4ncccc4c3)cc2)CCC1 1788906488 LTGFKULYPDMKRR-UHFFFAOYSA-N 480.524 5.133 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)c3cccnc3-c3ccccc3)CCC2)cc1)c1ccc([N+](=O)[O-])[nH]1 1790186364 OITXVNVSAXNHBE-UHFFFAOYSA-N 481.512 5.046 5 20 JKBD COc1cc(F)c(C(=O)NC2(c3ccc(NC(=O)c4ccc([N+](=O)[O-])cc4F)cc3)CCC2)c(F)c1 1790626154 PXWWTGSLGUTFEL-UHFFFAOYSA-N 499.445 5.082 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)[C@@H]3CCCCO3)CCC2)cc1)c1cc2cc([N+](=O)[O-])ccc2s1 1791008291 CBHHXFQOVJIJOA-FQEVSTJZSA-N 479.558 5.126 5 20 JKBD O=C(/C=C/c1ccccc1[N+](=O)[O-])Nc1ccc(C2(NC(=O)c3scnc3C3CC3)CCC2)cc1 1792315642 KKSXCLVNHFLCFR-MDWZMJQESA-N 488.569 5.390 5 20 JKBD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc2cc([N+](=O)[O-])ccc2s1)[C@@H]1CCC[C@H]2CCCC[C@@H]21 1801207379 MECSINWLJLZJTL-RPMOBBQVSA-N 495.645 5.668 5 20 JKBD O=C(N1CCCC[C@@H]1c1cc(NC(=O)C2(c3cccc([N+](=O)[O-])c3)CCC2)n[nH]1)C1(F)CCCCC1 1820840829 NHRFDKGMKDKUKB-OAQYLSRUSA-N 497.571 5.104 5 20 JKBD O=C(CSc1ccccc1[N+](=O)[O-])N1CCCC[C@@H]1c1cc(NC(=O)C23CCC(CC2)CC3)n[nH]1 1822963372 NXOMFPKTTQNRBX-WHEQYPTASA-N 497.621 5.073 5 20 JKBD CC(C)(Cc1ccccc1)C(=O)N1CCC([C@@H]2CCCCN2C(=O)/C=C/c2ccc([N+](=O)[O-])o2)CC1 1824277439 YUBSDWMJZXAKJJ-CWSBKQHBSA-N 493.604 5.090 5 20 JKBD O=C(c1ccc(O)c([N+](=O)[O-])c1)N1CCC([C@@H]2CCCCN2C(=O)[C@@H]2CCC[C@H]3CCCC[C@@H]32)CC1 1828460971 VVJJDWLTSDGHQI-GOUWZUTHSA-N 497.636 5.140 5 20 JKBD CC1=CC[C@H](C(=O)N2CCC([C@H]3CCCCN3C(=O)c3c(F)ccc([N+](=O)[O-])c3C)CC2)CC1 1830733995 TXCDNRGKCZUSRG-NZQKXSOJSA-N 471.573 5.022 5 20 JKBD Cc1c(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)CCC(C)C)CC2)cc(Cl)cc1[N+](=O)[O-] 1830736984 HAKIXCOGYXEAKA-OAQYLSRUSA-N 464.006 5.226 5 20 JKBD Cc1cc(C(=O)N2CCC([C@@H]3CCCCN3C(=O)c3cc4cc([N+](=O)[O-])ccc4s3)CC2)c(C)o1 1831059515 HVDZYPGROMOZOG-QFIPXVFZSA-N 495.601 5.566 5 20 JKBD O=C(OCC(=O)N1N=C(c2cc3ccccc3o2)C[C@@H]1c1ccco1)c1cc(Cl)ccc1[N+](=O)[O-] 24460675 XBBSTPVZLDKUMQ-LJQANCHMSA-N 493.859 5.122 5 20 JKBD Cc1c(NC(=O)[C@H](C)Sc2ncc(-c3ccccc3)n2C[C@@H]2CCCO2)cccc1[N+](=O)[O-] 28752007 MMTIRXRNOJFRJR-HKUYNNGSSA-N 466.563 5.065 5 20 JKBD CSc1ccc(C(=O)Nc2ccc(Cl)c(-c3nnc4n3CCCCC4)c2)cc1[N+](=O)[O-] 29710141 DTHCPNOCNVQFKQ-UHFFFAOYSA-N 457.943 5.207 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)Nc2nc(-c3cc(Cl)ccc3Cl)cs2)cc1SC 112529600 LSARAQYTCIPYAN-UHFFFAOYSA-N 470.359 6.008 5 20 JKBD CC(C)c1nccn1Cc1cccc(NC(=O)c2ccc(N3CCC[C@H](C)C3)c([N+](=O)[O-])c2)c1 117470895 ABGUDMRPPBOLNU-IBGZPJMESA-N 461.566 5.452 5 20 JKBD Cc1ccccc1-n1nc(C)c(CN(C)C(=O)c2csc(-c3cccc([N+](=O)[O-])c3)n2)c1C 215803698 WKJCHLUUZAFETI-UHFFFAOYSA-N 461.547 5.101 5 20 JKBD Cc1nc(-c2ccccc2)sc1[C@H](C)N[C@@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 303025412 PTMIIEMVOYINMH-JSGCOSHPSA-N 478.496 5.723 5 20 JKBD COc1ccc(Br)c(NC(=O)c2cc([N+](=O)[O-])ccc2Sc2ccccc2)c1 503446024 GEGBFFWXPIKUBT-UHFFFAOYSA-N 459.321 5.769 5 20 JKBD Cc1nc(-c2ccc([C@H](C)NC(=O)c3ccc(N[C@H](C)c4ccccn4)c([N+](=O)[O-])c3)cc2)cs1 506163479 KJBNUAPVNMBSIN-DLBZAZTESA-N 487.585 6.086 5 20 JKBD CCCNC(=O)c1ccc(NC(=O)c2ccc(N3C[C@@H](C)C[C@@H](C)C3)c([N+](=O)[O-])c2)cc1Cl 509373507 OPAOXYASSBMGJP-IYBDPMFKSA-N 472.973 5.123 5 20 JKBD O=C(NCc1ccccc1[N+](=O)[O-])Nc1cccc(NC(=O)c2cccc(C(F)(F)F)c2)c1 509878996 QCNPQALAXRFFOO-UHFFFAOYSA-N 458.396 5.188 5 20 JKBD O=[N+]([O-])c1cccc(-c2ccc(CNc3cc(-c4ccc(Br)cc4)nn3CCO)o2)c1 517551529 LHDHMESPEWUUIL-UHFFFAOYSA-N 483.322 5.085 5 20 JKBD COc1ccc(-n2ccc(CNCc3ccc(Oc4ccccc4Cl)c([N+](=O)[O-])c3)n2)cc1 518275550 SHTKQWFJVQZJIN-UHFFFAOYSA-N 464.909 5.525 5 20 JKBD O=[N+]([O-])c1ccc2c(c1)nc(SCc1nnc(C3CC3)o1)n2-c1cccc(C(F)(F)F)c1 518485912 GIUGAQULQCAUBS-UHFFFAOYSA-N 461.425 5.505 5 20 JKBD CCOc1cc(C(=O)N[C@H](Cc2ccccc2Cl)c2ccccc2)c([N+](=O)[O-])cc1OC 521728978 KYCLVOKNSNNMCW-HXUWFJFHSA-N 454.910 5.369 5 20 JKBD CCOc1ccc(C(=O)Nc2c(-c3ccc(Cl)cc3)c(C(F)(F)F)nn2C)cc1[N+](=O)[O-] 524346499 UKPIOAGHJLJCFI-UHFFFAOYSA-N 468.819 5.319 5 20 JKBD CN(C)Cc1ccccc1NC(=O)C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1 560317193 ADFZJQWRDVOCAK-HKWRFOASSA-N 472.570 5.836 5 20 JKBD O=C(C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)Nc1cccc(C(=O)NC2CC2)c1 577307163 IXQHLKNCNRYOJY-XMHGGMMESA-N 498.564 5.666 5 20 JKBD CC[C@@H](C)c1ccc([C@@H](NC(=O)C(=O)Nc2cc([N+](=O)[O-])ccc2C)c2cccs2)cc1 603706151 IKZZOWJRVZMMKB-IVZQSRNASA-N 451.548 5.323 5 20 JKBD O=C(NC1C[C@@H](C(F)(F)F)C[C@H](C(F)(F)F)C1)c1cc([N+](=O)[O-])ccc1Oc1ccccc1 603738252 PCIUUFPJORSZSX-STQMWFEESA-N 476.373 6.026 5 20 JKBD O=C(Nc1ccc(C(=O)Nc2cccnc2)c(Cl)c1)c1csc(-c2cccc([N+](=O)[O-])c2)n1 608875272 QOVZNJCAWOIMDV-UHFFFAOYSA-N 479.905 5.271 5 20 JKBD Cc1occc1C(=O)NC1CCN(C(=O)c2cc([N+](=O)[O-])ccc2Sc2ccc(Cl)cc2)CC1 608949453 PXEYMTMOZTUUOO-UHFFFAOYSA-N 499.976 5.335 5 20 JKBD Cc1ccc(NC(=O)c2ccc(N[C@H](c3ccc(Cl)cc3)c3nccn3C)c([N+](=O)[O-])c2)cc1 608971847 UQZIWLPMDXWHAO-HSZRJFAPSA-N 475.936 5.744 5 20 JKBD Cc1ccc(NC(=O)CSc2ccccc2C(=O)Nc2ccc([N+](=O)[O-])c(Cl)c2)cc1 727712242 SGVGOLFQNPUIQU-UHFFFAOYSA-N 455.923 5.540 5 20 JKBD O=C(CCC(=O)c1ccc2ccc3cccc4ccc1c2c34)NCC(=O)Nc1ccc(F)c(F)c1F 727765941 NNJQUDHZMVTVOA-UHFFFAOYSA-N 488.465 5.719 5 20 JKBD O=C(NCc1ccc(NC(=O)c2cc(Cl)ccc2[N+](=O)[O-])cc1)c1ccc(Br)cc1 730763628 XBQBIVWLJRDGIS-UHFFFAOYSA-N 488.725 5.193 5 20 JKBD CCN(Cc1ccc(Cl)cc1)C(=O)c1ccccc1NC(=O)c1ccc([N+](=O)[O-])cc1Cl 745844078 MCDYORMHKSVFEI-UHFFFAOYSA-N 472.328 5.816 5 20 JKBD COc1cc(C(=O)Oc2ccccc2SC(F)(F)F)c([N+](=O)[O-])cc1OCc1cscn1 748047385 LXBYBFUEZWXNNH-UHFFFAOYSA-N 486.449 5.470 5 20 JKBD Cc1nc(C(=O)Oc2ccc(NC(=O)c3cccc([N+](=O)[O-])c3)cc2)nn1-c1ccccc1C(C)C 749472662 GOBYPCMSGJBWEL-UHFFFAOYSA-N 485.500 5.079 5 20 JKBD O=C(O[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1)c1cc(F)c(F)c(F)c1F 919220013 UFHBFJLCWXLXNN-LJQANCHMSA-N 482.773 5.341 5 20 JKBD O=C(CN1CCCCC1)NC1(c2ccc(NC(=O)c3cc4cc([N+](=O)[O-])ccc4s3)cc2)CCC1 1791010972 LZSWLDNNRYXWAP-UHFFFAOYSA-N 492.601 5.043 5 20 JKBD CC(C)(C)CCCCCC(=O)N1CC[C@@H](CNC(=O)c2ccc(O)c([N+](=O)[O-])c2)[C@@H]1c1cccnc1 1810718866 ZNEYNSXFAROJLT-OFVILXPXSA-N 496.608 5.012 5 20 JKBD CCC(C)(C)C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cc(Br)ccc2[N+](=O)[O-])CC1 1830563655 GCZABNBITJVACY-IBGZPJMESA-N 494.430 5.027 5 20 JKBD CCCCC[C@H](C)C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cc([N+](=O)[O-])ccc2N(C)C)CC1 1830766883 SLLYICQKHWRAGS-GBXCKJPGSA-N 486.657 5.111 5 20 JKBD CC[C@H](C(=O)N1CCC([C@H]2CCCCN2C(=O)Cc2ccc([N+](=O)[O-])cc2F)CC1)c1ccccc1 1831290792 HKDPTULKHATOKF-AZGAKELHSA-N 495.595 5.090 5 20 JKBD C[C@@H](CC(=O)N1CCCC[C@H]1C1CCN(C(=O)CCc2cccc([N+](=O)[O-])c2)CC1)c1ccccc1 1831503052 HSJVKPYKURTFFK-CUNXSJBXSA-N 491.632 5.341 5 20 JKBD O=C(Nc1ccc(Cl)c([N+](=O)[O-])c1)[C@H](Sc1ncnc2sccc12)c1ccccc1 15277177 HNOYUKYDALCVMH-QGZVFWFLSA-N 456.936 5.725 5 20 JKBD COCCN(C(=O)c1cc(F)c(Cl)cc1Cl)c1nc(-c2ccc([N+](=O)[O-])cc2)cs1 17346232 WJNJRUMFIZVMCO-UHFFFAOYSA-N 470.309 5.457 5 20 JKBD COc1ccccc1-n1c(SCCC(=O)Nc2ccc([N+](=O)[O-])cc2C)nnc1-c1cccs1 26364651 NRLHDFYJLFANHJ-UHFFFAOYSA-N 495.586 5.342 5 20 JKBD O=C(Nc1ccccc1Cc1ccccc1)c1ccc([N+](=O)[O-])cc1I 72068413 HQCGRMGQHKUZBA-UHFFFAOYSA-N 458.255 5.043 5 20 JKBD C[C@@H](Nc1ccc(C(=O)N2CCC[C@@H]2c2ccc(Cl)cc2)cc1[N+](=O)[O-])c1ccccn1 115710370 WOXZYCHFOVVTQP-OPAMFIHVSA-N 450.926 5.794 5 20 JKBD O=C(Cc1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1)Nc1ccnn1CCc1ccccc1 303089632 HVCZTRKUOZAUSM-UHFFFAOYSA-N 492.539 5.068 5 20 JKBD CCOc1ccc2nc(N(Cc3ccccc3)C(=O)CCn3nc(C)c([N+](=O)[O-])c3C)sc2c1 303094582 AANBFMWPKOFESL-UHFFFAOYSA-N 479.562 5.040 5 20 JKBD C[C@@H](Sc1nc2cc3ccccc3cc2c(=O)n1C)C(=O)c1ccc(NC(=O)C(C)(C)C)cc1 495350303 BRJCIBVAASZKEC-MRXNPFEDSA-N 473.598 5.435 5 20 JKBD COc1ccc(C(=O)Nc2cccc(/C=C(\c3ccncc3)c3ccc([N+](=O)[O-])cc3)c2)cc1 502179833 CWHLAIVRGIDSCW-ITYLOYPMSA-N 451.482 5.840 5 20 JKBD C[C@H](Nc1ccc(C(=O)NC2(c3ccc(Cl)cc3)CCOCC2)cc1[N+](=O)[O-])c1ccccn1 505132667 DIPGLGRGZHPJHH-KRWDZBQOSA-N 480.952 5.252 5 20 JKBD COc1ccc(CCC2CCN(C(=O)c3ccc(N[C@H](C)c4ccccn4)c([N+](=O)[O-])c3)CC2)cc1 506072455 QPSUNEOJHBLJSG-HXUWFJFHSA-N 488.588 5.657 5 20 JKBD COC(=O)Cc1sc(NC(=O)c2cc3ccccc3c3cccnc23)nc1-c1ccccc1 507543607 BLJDBYGXJOEDBQ-UHFFFAOYSA-N 453.523 5.479 5 20 JKBD COc1cc(C(=O)N(CCc2ccccc2)c2nc(-c3ccccc3)cs2)ccc1[N+](=O)[O-] 508779861 QZSJIZCPGZEDLR-UHFFFAOYSA-N 459.527 5.616 5 20 JKBD O=C(NCC1(c2ccc(F)cc2)CCOCC1)c1cc([N+](=O)[O-])ccc1Sc1ccccc1 509674534 ZONYJLWVKIFQTM-UHFFFAOYSA-N 466.534 5.363 5 20 JKBD COc1cccc([C@H](CNC(=O)c2cc3cccc([N+](=O)[O-])c3[nH]2)c2c[nH]c3ccccc23)c1OC 511998921 LTKUBNSWBCNSNA-FQEVSTJZSA-N 484.512 5.137 5 20 JKBD COc1ccc(CNCc2nn(-c3ccccc3)c3c2CCC3)cc1OCc1ccc([N+](=O)[O-])cc1 513643501 PKVLMPBJWKACGK-UHFFFAOYSA-N 484.556 5.147 5 20 JKBD COc1ccc([N+](=O)[O-])c(C(=O)NCc2ccc(Oc3ccc(Oc4ccccc4)cc3)nc2)c1 517864232 WFZIHCGIEXMFQE-UHFFFAOYSA-N 471.469 5.513 5 20 JKBD COc1cc(C(=O)NC2(c3cccc(C(F)(F)F)c3)CC2)c([N+](=O)[O-])cc1OCc1cscn1 550507100 RDLAIROGEFTLMQ-UHFFFAOYSA-N 493.463 5.077 5 20 JKBD CCOC(=O)c1sc(-c2ccccc2)cc1NC(=O)c1cc(OC)c(OC(F)F)cc1[N+](=O)[O-] 585707544 GIJOQDQQMQFTDK-UHFFFAOYSA-N 492.456 5.362 5 20 JKBD CCN(C(=O)Cc1ccc(NCc2ccc(C(F)(F)F)cc2[N+](=O)[O-])cc1)c1ccccc1 600851687 GBEIWXODFZHBGB-UHFFFAOYSA-N 457.452 5.821 5 20 JKBD C[C@@H](NC(=O)c1ccc([N+](=O)[O-])cc1Cl)c1cccc(NC(=O)Cc2ccccc2F)c1 603764968 RKWBAULDGGSUGV-CQSZACIVSA-N 455.873 5.060 5 20 JKBD C[C@@H](NC(=O)c1ccc(Nc2ccccc2)c([N+](=O)[O-])c1)c1ccc(NC(=O)NC2CC2)cc1 603903264 PIVBQVZCTQXBIU-MRXNPFEDSA-N 459.506 5.113 5 20 JKBD Cc1cc(C(=O)Nc2nc(-c3ccc(OC(F)F)cc3OC(F)F)cs2)cc([N+](=O)[O-])c1 604511019 MUWJFWRFXGVQEM-UHFFFAOYSA-N 471.388 5.482 5 20 JKBD C[C@H](NC(=O)c1ccc(C(=O)N[C@H](C)c2cc3ccccc3o2)cc1[N+](=O)[O-])c1cc2ccccc2o1 609043653 GYLXBDONHZULPH-SJORKVTESA-N 497.507 6.069 5 20 JKBD Cn1ccnc1[C@@H](NC(=O)CCC(=O)c1ccc2ccc3cccc4ccc1c2c34)c1ccccc1 727753711 PLHPIDDIXQZTQN-PMERELPUSA-N 471.560 6.186 5 20 JKBD CCOc1cc([C@H](C[N+](=O)[O-])c2c[nH]c3ccccc23)ccc1OS(=O)(=O)Cc1ccccc1F 728056648 IZSFDJZIBCUPKA-NRFANRHFSA-N 498.532 5.023 5 20 JKBD O=C(OCc1nc2ccccc2c2ccccc12)c1ccccc1CS(=O)(=O)c1ccccc1 731263550 VBFOBHCQFGLIQM-UHFFFAOYSA-N 467.546 5.719 5 20 JKBD O=C(c1csc(-c2ccc3c(c2)OCCO3)n1)N(CC1CC1)c1ccc(Cl)c([N+](=O)[O-])c1 731325626 VYNZTXQZHYKIGH-UHFFFAOYSA-N 471.922 5.200 5 20 JKBD Cc1ccc([N+](=O)[O-])cc1C(=O)O[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1 742997710 DTPSPYDDPVENII-FQEVSTJZSA-N 469.837 5.002 5 20 JKBD O=C(c1ccc(Cl)cc1)N1CCC[C@H](C(=O)N(CC2CC2)c2ccc(Cl)c([N+](=O)[O-])c2)C1 745344777 QFFMZRMEOPXEKX-KRWDZBQOSA-N 476.360 5.197 5 20 JKBD O=C(O[C@@H](C(=O)Nc1ccc(F)cc1)c1ccccc1)c1csc(-c2ccc([N+](=O)[O-])cc2)n1 747958654 RFUWHUOAHSWFEQ-OAQYLSRUSA-N 477.473 5.394 5 20 JKBD O=C(OCC1CCN(c2ncccc2[N+](=O)[O-])CC1)[C@H](Sc1ccccc1)c1ccccc1 749359225 PXCNJMBDJWTBMJ-HSZRJFAPSA-N 463.559 5.283 5 20 JKBD CN1CCC(Oc2ccc(Cl)cc2NCc2c(Br)cccc2[N+](=O)[O-])CC1 864014376 ONRLYBPRGJNSDY-UHFFFAOYSA-N 454.752 5.096 5 20 JKBD O=C(c1ccc([N+](=O)[O-])s1)N1CCC[C@@H]1c1nc(-c2ccccc2OCc2ccccc2)no1 904465293 JCPHLFCLGXBEAJ-GOSISDBHSA-N 476.514 5.263 5 20 JKBD Cc1cc(NC(=O)c2ccccc2NC(=O)c2ccc([N+](=O)[O-])cc2Cl)ccc1N(C)C 915195912 IDCMQTZIMAVMAY-UHFFFAOYSA-N 452.898 5.127 5 20 JKBD Cc1ccc(NC(=O)[C@@H](OC(=O)c2cc3ccccc3c(Cl)n2)c2ccccc2)c([N+](=O)[O-])c1 915446109 RTOFRWGGEBYPPS-QFIPXVFZSA-N 475.888 5.642 5 20 JKBD Cc1ccc(-n2nc(C)c(CC(=O)O[C@H](C)c3nnc(-c4ccc([N+](=O)[O-])cc4)o3)c2C)cc1Cl 915531665 LSNCDVARURQYIS-MRXNPFEDSA-N 495.923 5.256 5 20 JKBD Cc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)N[C@@H](c1ccc(CC(C)C)cc1)c1cccs1 915740907 UICKFANUHBAODS-QFIPXVFZSA-N 451.548 5.008 5 20 JKBD COc1ccc(NC(=O)OC(C)(C)C)c(NC(=O)c2cc(OCC(F)(F)F)ccc2[N+](=O)[O-])c1 916439472 MQAIIESNQNBICL-UHFFFAOYSA-N 485.415 5.144 5 20 JKBD CC(=O)Nc1ccc(Nc2ccc(S(=O)(=O)Nc3ccc(C)cc3C)cc2[N+](=O)[O-])cc1C 917052319 KBZHRBLRFZJZMQ-UHFFFAOYSA-N 468.535 5.023 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)c3cc4cc[nH]c4cc3Cl)CCC2)cc1)c1ccc([N+](=O)[O-])[nH]1 1790185866 IDLTYIMIDHNRLU-UHFFFAOYSA-N 477.908 5.119 5 20 JKBD Cc1ccc([C@H](C)C(=O)N2CCC3(CCCN(C(=O)Cc4ccc(Cl)cc4[N+](=O)[O-])C3)CC2)cc1 1805485196 USTUZLQFVGCJEJ-FQEVSTJZSA-N 498.023 5.134 5 20 JKBD Cc1cc(F)c(F)c(C(=O)N2CCC([C@@H]3CCCCN3C(=O)CCc3cccc([N+](=O)[O-])c3)CC2)c1 1824843573 QGRCFFUAUXFYGZ-DEOSSOPVSA-N 499.558 5.048 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cc3sccc3[nH]2)CC1 1828711476 OSVZFKATSRDBAY-NRFANRHFSA-N 498.580 5.132 5 20 JKBD Cc1ccc(C(=O)N2CCC([C@@H]3CCCCN3C(=O)c3cc(F)cc([N+](=O)[O-])c3)CC2)c(Cl)c1 1830615325 BMAQHDDVDYSXDV-QHCPKHFHSA-N 487.959 5.243 5 20 JKBD CC[C@@H](C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cccc(F)c2[N+](=O)[O-])CC1)c1ccccc1 1830615740 BKEODPZIPKKNQF-ZJSXRUAMSA-N 481.568 5.161 5 20 JKBD O=C(/C=C/c1ccccc1[N+](=O)[O-])N1CCC([C@@H]2CCCCN2C(=O)c2ccc3ccoc3c2)CC1 1830909969 JFPPPWVFIQOFQJ-LTDXDOBXSA-N 487.556 5.288 5 20 JKBD CCCCC[C@@H](C)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cc([N+](=O)[O-])ccc2N(C)C)CC1 1831465384 HYPAYUYUQKFBPT-HYBUGGRVSA-N 486.657 5.111 5 20 JKBD CCCCC[C@@H](C)C(=O)N1CCCC[C@H]1C1CCN(C(=O)CSc2ccccc2[N+](=O)[O-])CC1 1831467768 ABNGOOSCGVQRTP-IRLDBZIGSA-N 489.682 5.523 5 20 JKBD Cc1ccc(F)c(C(=O)N2CCC([C@H]3CCCCN3C(=O)CSc3ccccc3[N+](=O)[O-])CC2)c1 1831777256 LYVFRGBVNCSRPA-JOCHJYFZSA-N 499.608 5.068 5 20 JKBD C[C@H](OC(=O)c1cc([N+](=O)[O-])ccc1Cl)C(=O)N(Cc1ccccc1)Cc1ccccc1 10666691 LZOLCTBXLGLMSU-KRWDZBQOSA-N 452.894 5.023 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Br)[C@@H](NCc1ccc(Cl)cc1)c1ccccc1 21818308 NQCGDAJFSJNJRP-FQEVSTJZSA-N 474.742 5.480 5 20 JKBD O=C(Cc1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1)Nc1cccc(N2CCCCC2=O)c1 25237171 RNXFODRQGKXBNN-UHFFFAOYSA-N 495.539 5.146 5 20 JKBD CCN(Cc1ccc(OCc2cccs2)c(OC)c1)C(=O)c1ccn(-c2cccc([N+](=O)[O-])c2)n1 31217221 VKLKPJBIPNGBCF-UHFFFAOYSA-N 492.557 5.092 5 20 JKBD COc1cc(C(=O)Oc2ccc(N(C)C(=O)c3ccc(C)cc3)cc2)c([N+](=O)[O-])cc1OC(F)F 115379551 IHWRWSUCWIETNA-UHFFFAOYSA-N 486.427 5.009 5 20 JKBD O=C(Nc1cc(Cl)cc(Cl)c1)[C@H]1CCCN1C(=O)c1csc(-c2cccc([N+](=O)[O-])c2)n1 303076061 ZFLXWFZSMWUJPG-GOSISDBHSA-N 491.356 5.268 5 20 JKBD COc1cccc(Cc2nnc(NC(=O)c3cc([N+](=O)[O-])ccc3Oc3ccccc3)s2)c1 410284129 CCVIJZUNLKGWPJ-UHFFFAOYSA-N 462.487 5.090 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)N(Cc2ccccc2)[C@@H](C)c2cccc(NC(C)=O)c2)cc1SC 482028339 YOBGZDUTLSZUIR-KRWDZBQOSA-N 493.585 5.687 5 20 JKBD COc1ccc(OC(F)F)c(NC(=O)c2ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])cc2)c1 482162612 HAWHQVMLWDTENY-UHFFFAOYSA-N 464.808 5.903 5 20 JKBD Cn1cnnc1-c1cccc(NC(=O)c2ccccc2Sc2ccc(C(F)(F)F)cc2[N+](=O)[O-])c1 483221422 FRIZFENWJVPWJX-UHFFFAOYSA-N 499.474 5.813 5 20 JKBD Cc1sc(NC(=O)Cn2c3ccccc3c(=O)c3ccccc32)nc1-c1c(F)cc(F)cc1F 504713779 YSUDADNGSMERPT-UHFFFAOYSA-N 479.483 5.643 5 20 JKBD C[C@H]1C[C@@H](C)CN(c2ccc(C(=O)N[C@@H](c3ccccc3)c3nccs3)cc2[N+](=O)[O-])C1 505052920 AAGLBHAKCGGFKP-JKSBSHDWSA-N 450.564 5.053 5 20 JKBD CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)NCc1cccc(NC(=O)c2cccc(F)c2)c1 509767417 UHQSENPTRQKOBC-UHFFFAOYSA-N 464.497 5.106 5 20 JKBD CCOC(=O)c1c(C2CC2)csc1NC(=O)c1ccc(N[C@H](C)c2ccccn2)c([N+](=O)[O-])c1 512553662 HOANKTWQJYQPPT-CQSZACIVSA-N 480.546 5.531 5 20 JKBD CC(C)CNC(=O)c1ccc(NC(=O)CCNc2ccc(C(F)(F)F)cc2[N+](=O)[O-])cc1Cl 515739103 LHMVKNCKBRYOQP-UHFFFAOYSA-N 486.878 5.094 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Cl)[C@@H](NCc1ccc(OCC(F)(F)F)nc1)c1ccccc1 515756110 KKUQJJNTZLDSAN-FQEVSTJZSA-N 494.857 5.054 5 20 JKBD O=C(Nc1cccc(-c2cn3cccnc3n2)c1)c1ccc(NCc2ccccc2)c([N+](=O)[O-])c1 517450090 JCESODXGIKGLHC-UHFFFAOYSA-N 464.485 5.169 5 20 JKBD O=[N+]([O-])c1ccc(-c2ccc(CNCc3cnn(-c4ccccc4)c3)o2)c(Br)c1 520209997 ZPZSFCHKUHMWQE-UHFFFAOYSA-N 453.296 5.093 5 20 JKBD Cc1ccccc1CN(Cc1ccccn1)C(=O)c1ccc(N[C@H](C)c2ccccn2)c([N+](=O)[O-])c1 520497946 NBLGRMSCRXJRNZ-OAQYLSRUSA-N 481.556 5.709 5 20 JKBD COc1ccc(CSCC(=O)Nc2ccc(SCc3cccnc3)cc2)cc1[N+](=O)[O-] 603567718 VGGIPNCXNCXXIE-UHFFFAOYSA-N 455.561 5.163 5 20 JKBD CCOc1ccc(Oc2ccc(Cl)cc2NC(=O)c2cc3c(cc2[N+](=O)[O-])OCO3)cc1 603940974 CMBMNVSLMANDTQ-UHFFFAOYSA-N 456.838 5.420 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Cl)[C@@H](NCc1cc2c(s1)CCCC2)c1ccccc1 604045750 GGZYJIJURNCEPS-QFIPXVFZSA-N 455.967 5.658 5 20 JKBD O=C(Nc1ccc2ncnc(O)c2c1)c1ccccc1Sc1ccc(C(F)(F)F)cc1[N+](=O)[O-] 604500881 CPJXHUNKVQPMPM-UHFFFAOYSA-N 486.431 5.666 5 20 JKBD O=C(CCCn1c(=O)oc2cc([N+](=O)[O-])ccc21)N1CCCC[C@H]1c1ccccc1C(F)(F)F 608945446 NQEAVJHVDWVRHI-SFHVURJKSA-N 477.439 5.056 5 20 JKBD COc1cc(-n2cccc2)c(Cl)cc1C(=O)O[C@H](C)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 725944094 DMDLNUKPIRQUSV-CYBMUJFWSA-N 468.853 5.016 5 20 JKBD O=C(COC(=O)c1csc(-c2ccc([N+](=O)[O-])cc2)n1)Nc1ccccc1Sc1ccccc1 747955847 NQRYXRCGNVZIOR-UHFFFAOYSA-N 491.550 5.665 5 20 JKBD Cc1c(C(=O)Nc2ccc(N(C)C(=O)c3ccc(Cl)cc3)cc2)cc([N+](=O)[O-])c(C)c1[N+](=O)[O-] 748631180 SHPLHALDXGHIBQ-UHFFFAOYSA-N 482.880 5.302 5 20 JKBD CCOC(=O)c1sc(-c2ccc(OC)c(OC)c2)cc1NC(=O)c1cc(Cl)ccc1[N+](=O)[O-] 750916938 PPJHLVVGYROYIR-UHFFFAOYSA-N 490.921 5.423 5 20 JKBD C[C@H](OC(=O)/C(=C\c1ccc(F)cc1)c1cccs1)C(=O)Nc1ccc(F)c([N+](=O)[O-])c1 772127218 ZKIJOERDBUFHHD-MFVBVHDHSA-N 458.442 5.046 5 20 JKBD Cn1cc(-c2nc(-c3ccc(Cn4cnc5ccccc54)cc3)no2)c(-c2ccc([N+](=O)[O-])cc2)n1 904479848 PRSATDXNZIPSNJ-UHFFFAOYSA-N 477.484 5.110 5 20 JKBD Cc1c(C(=O)Nc2ccc(Cl)cc2C(=O)N2[C@@H](C)CCC[C@H]2C)cc([N+](=O)[O-])cc1[N+](=O)[O-] 915153830 CFEQKTTXSUOYOX-BETUJISGSA-N 474.901 5.120 5 20 JKBD CSc1ccc(C(=O)c2ccccc2C(=O)OCc2cncc(Br)c2)cc1[N+](=O)[O-] 915168545 GHCYICZPUOBDFH-UHFFFAOYSA-N 487.331 5.062 5 20 JKBD O=C(Nc1ccc(Cl)c([N+](=O)[O-])c1)C(=O)N[C@H](c1ccc2c(c1)CCCC2)c1cccs1 915754437 FWXGKRNRTRDVAX-OAQYLSRUSA-N 469.950 5.033 5 20 JKBD CCOC(=O)c1nc(N(CCc2ccccc2)C(=O)c2cc(Cl)ccc2[N+](=O)[O-])sc1C 917366844 SSHTYVABBRSLSC-UHFFFAOYSA-N 473.938 5.079 5 20 JKBD CCCc1cc[n+](/C(C(=S)Nc2ccc3ccccc3c2)=C(/O)c2ccc(C)c([N+](=O)[O-])c2)cc1 917609658 CUWQCGTVQSIYRB-UHFFFAOYSA-O 484.601 6.620 5 20 JKBD O=C(NCc1ccc(Cl)nc1)c1ccccc1Sc1ccc(C(F)(F)F)cc1[N+](=O)[O-] 917724929 KLSKUVXSKKEHRM-UHFFFAOYSA-N 467.856 5.743 5 20 JKBD C[C@H](Sc1cc(Cl)ccc1Cl)C(=O)O[C@H](C)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 919509301 NSQGLZKVUNZBFV-MNOVXSKESA-N 468.318 5.737 5 20 JKBD CC(C)c1nc(COC(=O)C/C(=C\c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)no1 920514329 UYDHZBZQMOCNOT-LFIBNONCSA-N 464.503 5.385 5 20 JKBD CC(=O)N(c1ccc(C(F)(F)F)cc1)c1nc(COc2ccc([N+](=O)[O-])c(F)c2)cs1 921266878 ODNHXYWKENGQON-UHFFFAOYSA-N 455.389 5.473 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)C34CC(c5ccccc5)(C3)C4)CCC2)cc1)c1ccc([N+](=O)[O-])o1 1785752956 WOYAWPJFGOQGSI-UHFFFAOYSA-N 471.513 5.057 5 20 JKBD COc1cc(C(=O)NC2(c3ccc(NC(=O)c4nc(C(C)C)cs4)cc3)CCC2)ccc1[N+](=O)[O-] 1787005431 IPPAVCSBQPHQQG-UHFFFAOYSA-N 494.573 5.245 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)Nc1ccc(C2(NC(=O)c3cnc4ccoc4c3)CCC2)cc1 1790771160 SLVHHTJNGOZSPJ-UHFFFAOYSA-N 488.475 5.245 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)[C@@H]3C[C@@]3(F)Cl)CCC2)cc1)c1cc2cc([N+](=O)[O-])ccc2s1 1791009848 AIFBNUYIXWZQOV-SBUREZEXSA-N 487.940 5.482 5 20 JKBD CCCCCc1cccc(CC(=O)Nc2cc([C@@H]3CCCCN3C(=O)c3ccc([N+](=O)[O-])o3)[nH]n2)c1 1820710152 CZKQXVRPCGBREI-NRFANRHFSA-N 493.564 5.192 5 20 JKBD CC1=CC[C@H](C(=O)N2CCCC[C@H]2C2CCN(C(=O)c3c(F)ccc([N+](=O)[O-])c3C)CC2)CC1 1828351364 FEAKCXDESRQRHW-REWPJTCUSA-N 471.573 5.022 5 20 JKBD O=C(c1ccc([N+](=O)[O-])cc1F)N1CCC([C@@H]2CCCCN2C(=O)c2cc(F)ccc2Cl)CC1 1830577761 YSTUNRGCZAHBMP-QFIPXVFZSA-N 491.922 5.074 5 20 JKBD Cc1ncc(C(=O)N2CCC([C@H]3CCCCN3C(=O)c3cc4cc([N+](=O)[O-])ccc4s3)CC2)s1 1831061080 LYGHCQZKMPUXBG-LJQANCHMSA-N 498.630 5.122 5 20 JKBD COc1ccccc1NS(=O)(=O)c1cc(NC(=O)c2cc3cc([N+](=O)[O-])ccc3s2)ccc1C 15633164 SBHWKIJILWGWHX-UHFFFAOYSA-N 497.554 5.180 5 20 JKBD CCN(c1ccccc1)S(=O)(=O)c1ccc(Sc2nnc(-c3cccs3)o2)c([N+](=O)[O-])c1 20667414 BEKVJCDYJZDLTH-UHFFFAOYSA-N 488.572 5.073 5 20 JKBD CCn1c(SCC(=O)N[C@H](C)c2ccccc2Cl)nc2cc3ccccc3cc2c1=O 22178695 ZSBPAKJTGRBJCC-OAHLLOKOSA-N 451.979 5.193 5 20 JKBD C[C@@H]1CCN(C(=O)CSc2nc3cc4ccccc4cc3c(=O)n2C)c2ccccc2S1 22254219 VRTYZDYHONORQT-MRXNPFEDSA-N 461.612 5.096 5 20 JKBD CN(Cc1ccc(Cl)cc1)C(=O)c1ccccc1NC(=O)c1ccc([N+](=O)[O-])cc1Cl 29004924 ZKXWYINCMDTHMS-UHFFFAOYSA-N 458.301 5.426 5 20 JKBD COc1cc(C(=O)N2C[C@@H](C)O[C@H](c3ccccc3)C2)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 109045923 XOKQXPMZBKDCIU-GYCJOSAFSA-N 482.920 5.651 5 20 JKBD Cc1ccc2sc(N(Cc3ccccc3)C(=O)c3cc([N+](=O)[O-])cc(S(C)(=O)=O)c3)nc2c1C 115858248 CUQJYNFOEPIJOC-UHFFFAOYSA-N 495.582 5.072 5 20 JKBD Cc1c(NC(=O)c2ccc(NCc3ccccc3Cl)c([N+](=O)[O-])c2)cccc1C(=O)N1CCCC1 303008786 JKHYHZREPRBSDV-UHFFFAOYSA-N 492.963 5.657 5 20 JKBD O=C(C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)N1CC[C@@H](c2ccccc2)C1 476172665 UZQDXPMESMCZAH-BCIXFCFJSA-N 469.566 6.151 5 20 JKBD O=C(C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)Nc1ccc(-n2cccn2)nc1 477205015 LWYHLNIMSYFYFT-NBVRZTHBSA-N 482.525 5.355 5 20 JKBD Cc1cc(N[C@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Br)c2ccccc2)ccc1F 488460410 PVTVRQCHCVHABB-FQEVSTJZSA-N 458.287 5.597 5 20 JKBD O=C(NC1CCN(Cc2cccc(C(F)(F)F)c2)CC1)c1csc(-c2ccc([N+](=O)[O-])cc2)n1 498719611 YVJPUKOQUHYGHM-UHFFFAOYSA-N 490.507 5.132 5 20 JKBD CCN(C(=O)c1cc([N+](=O)[O-])ccc1OC)[C@H]1CCSc2ccc(Br)cc21 504609087 YIGDXAGOZIFFCK-INIZCTEOSA-N 451.342 5.065 5 20 JKBD COc1cc([C@@H](C)NCc2ccc(Oc3ccc(F)cc3)c([N+](=O)[O-])c2)cc(OC)c1OC 508100542 GFKXDYLNUXPWPT-OAHLLOKOSA-N 456.470 5.403 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Cl)[C@@H](N[C@@H](c1ccccc1)c1ccco1)c1ccccc1 510650320 ZMAMUZBTJKVSIR-ZEQRLZLVSA-N 461.905 5.900 5 20 JKBD Cc1ncc([N+](=O)[O-])cc1C(=O)N(C[C@H]1CCCO1)c1nc(-c2cccc(C(F)(F)F)c2)cs1 514935465 GFAQRXMEVJJXOH-QGZVFWFLSA-N 492.479 5.266 5 20 JKBD CC(=O)Nc1cc(NC(=O)c2ccc(N[C@@H](C)c3ccccn3)c([N+](=O)[O-])c2)ccc1Cl 516370854 SDBZLZUMAPLNJF-ZDUSSCGKSA-N 453.886 5.027 5 20 JKBD CC(C)c1c(C(=O)Nc2nc(-c3cccc([N+](=O)[O-])c3)cs2)cnn1-c1ccc(F)cc1 516474717 GHGXBOWDYLUFMX-UHFFFAOYSA-N 451.483 5.419 5 20 JKBD O=[N+]([O-])c1ccc(-c2ccc(CNCc3cccc(OCC(F)F)c3)o2)c(Br)c1 518275480 JSMRULLIQISJBS-UHFFFAOYSA-N 467.266 5.551 5 20 JKBD CC(C)(C)c1ccc(Oc2ccc(CNCc3nccn3CC(F)(F)F)cc2[N+](=O)[O-])cc1 518783767 WOZQFNCQYQRNIS-UHFFFAOYSA-N 462.472 5.733 5 20 JKBD Cc1ccc(Sc2ccc(C(=O)N3CCC(NC(=O)C4CCCCC4)CC3)cc2[N+](=O)[O-])cc1 520098757 PVPSZUXURGSVCG-UHFFFAOYSA-N 481.618 5.356 5 20 JKBD NC(=O)CC[C@H]1CCCN(C(=O)c2c3c(nc4ccccc24)/C(=C\c2cccc([N+](=O)[O-])c2)CCC3)C1 524039817 UNRCSJSNPKIGJW-DSPRMBBKSA-N 498.583 5.138 5 20 JKBD C[C@H](Nc1cccc(CO[C@@H]2CCC[C@@H](C)C2)c1)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 582351541 BMRBJOQYDXFOIK-GQIGUUNPSA-N 479.499 6.148 5 20 JKBD O=C(NCCc1c[nH]c2cc(Cl)ccc12)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 604487349 MUJPPXIQTRCVOD-UHFFFAOYSA-N 494.901 5.324 5 20 JKBD O=C(c1ccc(C(=O)N2CCC[C@@H]2Cc2ccccc2)c([N+](=O)[O-])c1)N1CCC[C@H]1Cc1ccccc1 609043640 GLHLTNPELKWTIK-IZZNHLLZSA-N 497.595 5.289 5 20 JKBD O=C(Nc1ccc(Oc2ccnc3cc(Cl)ccc23)c(F)c1)c1cc2c(cc1[N+](=O)[O-])OCCO2 609066059 DCHXAUSAVBOLEY-UHFFFAOYSA-N 495.850 5.751 5 20 JKBD CC(C)c1nc(C(=O)O[C@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2ccccc2)cs1 726690102 UMELMSBQTQWWSF-SFHVURJKSA-N 459.911 5.365 5 20 JKBD COc1ccc(NC(=S)/C(=C(/O)c2cccc([N+](=O)[O-])c2)[n+]2ccc(Cc3ccccc3)cc2)cn1 726963196 RIPPSXRNGKAMLV-UHFFFAOYSA-O 499.572 5.200 5 20 JKBD O=C(Nc1cc([N+](=O)[O-])c(F)cc1F)[C@@H](Oc1ccc(F)cc1Br)c1ccccc1 730470200 BKMGANGEISLGFG-IBGZPJMESA-N 481.224 5.533 5 20 JKBD O=C(COC(=O)C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)Nc1ccccc1 748579042 IXOZEWOHMPIODK-NBVRZTHBSA-N 473.510 5.317 5 20 JKBD O=C(Nc1ccccc1Oc1ccccc1NC(=O)c1cccc([N+](=O)[O-])c1)c1cccc([N+](=O)[O-])c1 749554969 NCTBQUZXZZYSEP-UHFFFAOYSA-N 498.451 5.800 5 20 JKBD CC(C)c1noc2ncc(C(=O)O[C@@H](C(=O)Nc3ccc(Cl)c([N+](=O)[O-])c3)c3ccccc3)cc12 752938775 ZIEKURJUZYMIKP-OAQYLSRUSA-N 494.891 5.445 5 20 JKBD CC(C)(C)OC(=O)N[C@@H]1C[C@H]1c1ccc(NCc2ccc(C(F)(F)F)cc2[N+](=O)[O-])cc1 864042889 ZAFTVWDRRJIRQX-ZWKOTPCHSA-N 451.445 5.606 5 20 JKBD CC1=C(C(=O)Nc2cc(Cl)ccc2C)[C@@H](c2cc([N+](=O)[O-])c(F)cc2F)NC(=O)N1CC1CC1 916726074 QHOBUICNPBXEQW-OAQYLSRUSA-N 490.894 5.224 5 20 JKBD O=C(Cc1cccc([N+](=O)[O-])c1)Nc1ccc(C2(NC(=O)c3ccc4occc4c3)CCC2)cc1 1785792132 SLTKCSQCHRCNED-UHFFFAOYSA-N 469.497 5.331 5 20 JKBD COc1cc(C(=O)NC2(c3ccc(NC(=O)c4cccc5ncccc45)cc3)CCC2)ccc1[N+](=O)[O-] 1788906200 BDNDEVOXHMCDEV-UHFFFAOYSA-N 496.523 5.213 5 20 JKBD O=C(Cc1cccc([N+](=O)[O-])c1)NC1(c2ccc(NC(=O)c3cc4ccccc4o3)cc2)CCC1 1789004141 MFFXJROFBGNOPJ-UHFFFAOYSA-N 469.497 5.331 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)c3ccc4ccoc4c3)CCC2)cc1)c1ccc(O)c([N+](=O)[O-])c1 1790618782 JNSBPFROHJJRJS-UHFFFAOYSA-N 471.469 5.108 5 20 JKBD Cc1c(C(=O)Nc2ccc(C3(NC(=O)c4cccnc4S)CCC3)cc2)cc(Cl)cc1[N+](=O)[O-] 1790773579 LBYNOPQWEHNHPM-UHFFFAOYSA-N 496.976 5.302 5 20 JKBD Cc1cc(CCC(=O)NC2(c3ccc(NC(=O)/C=C/c4ccccc4[N+](=O)[O-])cc3)CCC2)ccn1 1792315534 YCIFZSHLZLFVCN-RIYZIHGNSA-N 484.556 5.078 5 20 JKBD Cc1c(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)[C@H](C)Sc2cccs2)C3)cc(Cl)cc1[N+](=O)[O-] 1800711712 SIEYTXHYSVBOCK-LLLHUVSDSA-N 494.038 5.051 5 20 JKBD Cc1ccc2cc(C(=O)N3CCCC[C@@H]3c3cc(NC(=O)c4ccc([N+](=O)[O-])o4)n[nH]3)sc2c1 1814312929 UXPPPKUXUSEWQF-MRXNPFEDSA-N 479.518 5.054 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)N1CCCC[C@H]1c1cc(NC(=O)CCC2CCCC2)n[nH]1 1816696741 QJCLAOUXRSCLDZ-FQEVSTJZSA-N 471.533 5.042 5 20 JKBD Cc1cc(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)c3ccc(C(C)(C)C)s3)[nH]n2)ncc1[N+](=O)[O-] 1818263904 BXNRONXHOYXZCQ-KRWDZBQOSA-N 496.593 5.000 5 20 JKBD CC[C@H]1CC[C@H](C(=O)N2CCC([C@H]3CCCCN3C(=O)c3cc(N(C)C)ccc3[N+](=O)[O-])CC2)CC1 1829648324 IISUFDMWXGOTIU-QFZWGZQFSA-N 498.668 5.111 5 20 JKBD Cc1ccc(CCC(=O)N2CCC([C@H]3CCCCN3C(=O)c3cc(F)cc([N+](=O)[O-])c3)CC2)cc1F 1830612683 HZBVYUXOJOJNEG-RUZDIDTESA-N 499.558 5.048 5 20 JKBD CC1CCN(c2ccc(C(=O)N(Cc3nnc(-c4ccc(Cl)cc4)o3)C3CC3)cc2[N+](=O)[O-])CC1 16014764 MVXGYWZUGJOQGJ-UHFFFAOYSA-N 495.967 5.339 5 20 JKBD Cc1ccc(NC(=O)c2cc(Cl)ccc2[N+](=O)[O-])cc1S(=O)(=O)Nc1ccc(Cl)cc1 16498138 UVLBTUZOMYHVCU-UHFFFAOYSA-N 480.329 5.263 5 20 JKBD COCCN(C(=O)c1sc(-c2ccccc2)nc1C)c1nc(-c2ccc([N+](=O)[O-])cc2)cs1 17346236 XGSQSJAIBUQDJT-UHFFFAOYSA-N 480.571 5.443 5 20 JKBD Cc1ccc(/C=C/C(=O)O[C@@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)c(Br)c1 17747664 YYPLBNHFDFMMSE-RSPDNQDQSA-N 458.268 5.033 5 20 JKBD Cc1cc(=O)c(C(=O)N(c2ccccc2)c2nc3ccccc3s2)nn1-c1ccccc1[N+](=O)[O-] 21907845 OLJABTYYLBVIMN-UHFFFAOYSA-N 483.509 5.037 5 20 JKBD CC(=O)c1cccc(NC(=O)c2ccccc2Sc2ccc(C(F)(F)F)cc2[N+](=O)[O-])c1 24006687 BAKUTTZWEJQDSQ-UHFFFAOYSA-N 460.433 6.220 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)NCc2ccccc2-c2ccc(Cn3cccn3)cc2)cc1SC 78402420 YRPUKVSKNPDHEJ-UHFFFAOYSA-N 488.569 5.167 5 20 JKBD COCCOc1cc([N+](=O)[O-])c(C(=O)N(c2nc3ccccc3s2)c2ccccc2C)cc1OC 105336754 BATMQEQDHDTIRR-UHFFFAOYSA-N 493.541 5.525 5 20 JKBD Cc1sc(NC(=O)c2occc2CSc2ccccc2)nc1-c1cccc([N+](=O)[O-])c1 195704101 WSSXJZJMNBZTPZ-UHFFFAOYSA-N 451.529 6.164 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)NCc2cn(Cc3ccccc3)nc2-c2ccccc2)cc1SC 482100732 DSXIMFVSHDYWBJ-UHFFFAOYSA-N 488.569 5.167 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)N(C2CC2)[C@H](C)c2cccc(C(F)(F)F)c2)cc1SC 482542524 HHGVXCUKDXNGHO-GFCCVEGCSA-N 454.470 5.710 5 20 JKBD Cc1ccc(C(=O)NC2CC2)cc1NC(=O)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1 483719787 ANLZTQGYYCETFN-UHFFFAOYSA-N 465.893 5.493 5 20 JKBD CC(=O)Nc1ccc(F)c(NC(=O)C/C(=C/c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)c1 484372103 MCVCBQWDQBMJPY-ATVHPVEESA-N 490.516 5.871 5 20 JKBD C[C@@H](c1ccccc1Cl)N1CCN(C(=O)c2ccc(N[C@H](C)c3ccccn3)c([N+](=O)[O-])c2)CC1 506160130 MPMWHEGAPXCFAY-MOPGFXCFSA-N 493.995 5.335 5 20 JKBD CSCC[C@H](NC(=O)c1cccc([N+](=O)[O-])c1)C(=O)Nc1ccc(OC2CCCC2)c(Cl)c1 508265840 UBTYVMUKQXKKAK-FQEVSTJZSA-N 491.997 5.060 5 20 JKBD O=C(CC1CCCC1)NC1CCC(C(=O)Nc2ccc([N+](=O)[O-])cc2C(=O)c2ccccc2)CC1 508806968 ADLQJSLCQBMQMM-UHFFFAOYSA-N 477.561 5.020 5 20 JKBD CCCNC(=O)c1ccc(NC(=O)c2ccc(NCc3ccccc3)c([N+](=O)[O-])c2)cc1Cl 509390834 WJKUFDNVLIVTBW-UHFFFAOYSA-N 466.925 5.252 5 20 JKBD CCOc1ccc([C@H](CNC(=O)c2ccc([N+](=O)[O-])c(OC)c2)c2c[nH]c3ccccc23)cc1OC 511133907 ANMMSGZXVBZYBT-FQEVSTJZSA-N 489.528 5.054 5 20 JKBD O=C(Cn1c2ccccc2c(=O)c2ccccc21)Nc1nc2c(C(F)(F)F)cccc2s1 514490437 JUJULOZCEKMRGP-UHFFFAOYSA-N 453.445 5.422 5 20 JKBD CCC(=O)N1CCCN(C(=O)c2c3c(nc4ccccc24)/C(=C\c2ccc([N+](=O)[O-])cc2)CCC3)CC1 517433364 FPTHRKZEEQVFSO-VZCXRCSSSA-N 498.583 5.104 5 20 JKBD O=C(Nc1cc(Cl)ccc1Cl)[C@H]1CCCCN1C(=O)c1cc2cc([N+](=O)[O-])ccc2o1 523059825 WYECEHZOGPVOHP-QGZVFWFLSA-N 462.289 5.281 5 20 JKBD Cc1c(NC(=O)c2ccc(SCCC(C)C)c([N+](=O)[O-])c2)cccc1C(=O)N1CCSCC1 523661779 KNDNYSQOINLIEL-UHFFFAOYSA-N 487.647 5.483 5 20 JKBD O=[N+]([O-])c1ccc(-c2nnc(COc3ccc(-c4ccc(Br)cc4)cc3)o2)cc1 575885376 MDNKMNDYJSIUDY-UHFFFAOYSA-N 452.264 5.653 5 20 JKBD C[C@H](NC(=O)Cc1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1)c1c(F)cccc1F 603510326 OCTMGEXJCFTSAQ-INIZCTEOSA-N 462.456 5.146 5 20 JKBD COc1cc(C(=O)NCc2ccc(N3CCCCC3)nc2)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 603905986 XTULHWKZAMXWQT-UHFFFAOYSA-N 496.951 5.364 5 20 JKBD Cc1nn(Cc2ccc(C(=O)Nc3ccc(Cl)cc3NC(=O)c3ccco3)cc2)c(C)c1[N+](=O)[O-] 604098270 UALMPGDPGUNXSL-UHFFFAOYSA-N 493.907 5.207 5 20 JKBD COc1cc(C(=O)Nc2nc3cc(Cl)ccc3n2CCCc2ccccc2)c([N+](=O)[O-])cc1OC 608952628 DRZLEEOBEVRWFF-UHFFFAOYSA-N 494.935 5.500 5 20 JKBD O=C(Nc1ccc(OC(=O)c2csc(-c3cccc([N+](=O)[O-])c3)n2)cc1)c1cccc([N+](=O)[O-])c1 747625296 LSIOHIGUEMIVEW-UHFFFAOYSA-N 490.453 5.098 5 20 JKBD O=C(COC(=O)c1csc(-c2ccc([N+](=O)[O-])cc2)n1)c1ccc(NC(=O)c2ccccc2)cc1 747958858 YIXWBNNWSYKSBO-UHFFFAOYSA-N 487.493 5.010 5 20 JKBD CC(=O)N(c1cccc(Cl)c1)c1nc(COC(=O)c2c[nH]c3ccc([N+](=O)[O-])cc23)cs1 749314211 BHEYTYPFRFCJFA-UHFFFAOYSA-N 470.894 5.228 5 20 JKBD Cc1csc(Sc2ccc(C(=O)N(c3ccc(N4CCOCC4)cc3)C(C)C)cc2[N+](=O)[O-])n1 751181611 SOQDADUVFVXZDW-UHFFFAOYSA-N 498.630 5.403 5 20 JKBD Cc1cccc([N+](=O)[O-])c1NC(=O)COC(=O)c1cc2c(C)nn(-c3cccc(Cl)c3)c2s1 814422109 PSBLPGLQZZRBCW-UHFFFAOYSA-N 484.921 5.061 5 20 JKBD O=C(Nc1nnc(C2CC2)s1)c1cc([N+](=O)[O-])ccc1N1CCC(Cc2ccccc2)CC1 862347835 RAKXGNVMQRBEEV-UHFFFAOYSA-N 463.563 5.035 5 20 JKBD O=C(c1cccc(NCc2c3ccccc3c(Cl)c3ccccc23)c1)N1CCC(CO)CC1 864028080 ZDPRQHSYEZQNEZ-UHFFFAOYSA-N 458.989 6.103 5 20 JKBD CC1=C(C(=O)Nc2cccc([N+](=O)[O-])c2)[C@@H](c2cccs2)NC(=S)N1c1ccccc1 916161893 UVKYUOWFHJUKSC-HXUWFJFHSA-N 450.545 5.005 5 20 JKBD CCn1c(SCc2nc(C(C)(C)NC(=O)OC(C)(C)C)no2)nc2cc3ccccc3cc2c1=O 920071471 QEXFJSYIQFMATL-UHFFFAOYSA-N 495.605 5.005 5 20 JKBD O=C(C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)OCc1nnc(C2CC2)o1 920408029 VHZCDQXDRLCNFT-LFIBNONCSA-N 462.487 5.139 5 20 JKBD Cc1ccc(CC(=O)Nc2ccc(C3(NC(=O)[C@H]4CCC(F)(F)C4)CCC3)cc2)cc1[N+](=O)[O-] 1790524692 QVJLLLODILVWQC-SFHVURJKSA-N 471.504 5.015 5 20 JKBD Cc1c(C(=O)N2CCCC[C@H]2c2cc(NC(=O)[C@H]3CCC(F)(F)C3)n[nH]2)cc(Cl)cc1[N+](=O)[O-] 1814389909 YFPKQWRVJKEBBR-GUYCJALGSA-N 495.914 5.021 5 20 JKBD O=C(Nc1cc([C@@H]2CCCCN2C(=O)/C=C/c2ccccc2[N+](=O)[O-])[nH]n1)c1cccc2ccoc12 1821543106 PHGSBUWHOCBXBF-LEQVUBRHSA-N 485.500 5.083 5 20 JKBD C[C@@H](CC(=O)N1CCCC[C@H]1C1CCN(C(=O)/C=C/c2ccc([N+](=O)[O-])o2)CC1)c1ccccc1 1831502600 CKHQWCBUBPSPRU-IQVDQNKCSA-N 479.577 5.015 5 20 JKBD O=C(c1cc2cc([N+](=O)[O-])ccc2s1)N1CC2(CCCN2C(=O)c2cccc(-c3ccccc3)n2)C1 1843480450 LKICVYYUHAULDL-UHFFFAOYSA-N 498.564 5.002 5 20 JKBD CC(=O)N1CCc2cc(NC(=O)c3ccc(Oc4ccc(Cl)cc4[N+](=O)[O-])cc3)ccc21 10849457 VQFKVUOHWSKJJE-UHFFFAOYSA-N 451.866 5.202 5 20 JKBD C[C@H](Oc1ccc2c(-c3ccc([N+](=O)[O-])cc3)cc(=O)oc2c1)C(=O)Nc1ccccc1OC(F)F 15370893 SLKJUXHTAVWALO-AWEZNQCLSA-N 496.422 5.376 5 20 JKBD O=C(Nc1ccccc1C(=O)NCc1ccc(CN2CCCC2)cc1)c1ccc([N+](=O)[O-])cc1Cl 15372883 TUKYBHSQOFIQQV-UHFFFAOYSA-N 492.963 5.026 5 20 JKBD Cc1ccc(-c2cnc(-c3ccccc3C(=O)OCC(=O)Nc3c(C)cccc3[N+](=O)[O-])o2)cc1 18753991 LPGNURZAHCMDNZ-UHFFFAOYSA-N 471.469 5.329 5 20 JKBD O=C(Nc1ccc(Cl)c([N+](=O)[O-])c1)[C@H](Sc1nnc2[nH]c3ccccc3n12)c1ccccc1 23472248 GFBLUHXGWTZFQO-LJQANCHMSA-N 478.921 5.244 5 20 JKBD COc1cc(CSc2nnc(-c3ccc(Br)cc3)o2)c([N+](=O)[O-])cc1OC(F)F 24890075 DPVDMNARTFCLHU-UHFFFAOYSA-N 488.266 5.310 5 20 JKBD O=C(NCCc1nccn1Cc1ccccc1)c1ccc(NCc2ccccc2Cl)c([N+](=O)[O-])c1 26214974 LOLQEBCVXXHKCO-UHFFFAOYSA-N 489.963 5.078 5 20 JKBD O=C(CSc1ccc(C(F)(F)F)cc1[N+](=O)[O-])Nc1ccccc1OC[C@@H]1CCCCO1 108912980 OEPCGPUSJNNUCS-HNNXBMFYSA-N 470.469 5.292 5 20 JKBD O=C(CSc1ncccc1[N+](=O)[O-])N(Cc1ccccc1)c1nc(-c2ccc(F)cc2)cs1 195660997 NWOXSKUXRSGTLF-UHFFFAOYSA-N 480.546 5.578 5 20 JKBD Cc1nn(-c2ccccc2)c(C)c1NC(=O)CSc1ccc(C(F)(F)F)cc1[N+](=O)[O-] 253600468 OCVGVPZEBLEBHE-UHFFFAOYSA-N 450.442 5.147 5 20 JKBD C[C@H]1C[C@@H](C)CN(c2ccc(C(=O)Nc3ccccc3NC(=O)Cc3cccs3)cc2[N+](=O)[O-])C1 409992246 JRYFLFCXJLKIBL-HDICACEKSA-N 492.601 5.572 5 20 JKBD CCN(Cc1ccc(C(=O)N(C)C)cc1)C(=O)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1 476492217 PYTINEKXVJXPDK-UHFFFAOYSA-N 481.936 5.405 5 20 JKBD C[C@H]1Cc2cc([N+](=O)[O-])ccc2N1C(=O)c1cccc(NC(=O)c2cccc(Br)c2)c1 504312071 XVYBKSZLCWBRMM-AWEZNQCLSA-N 480.318 5.201 5 20 JKBD CCN(C(=O)Nc1cc([N+](=O)[O-])ccc1C)[C@H]1CCSc2ccc(Br)cc21 509071999 WJJVKORSFMITFA-KRWDZBQOSA-N 450.358 5.757 5 20 JKBD C[C@@H](NC(=O)N(C)[C@@H]1CCSc2ccc(Br)cc21)c1cccc([N+](=O)[O-])c1 509479335 KSMNOUOTXGWTRW-SJKOYZFVSA-N 450.358 5.297 5 20 JKBD CCN(Cc1ccc(-c2ccc(C(F)(F)F)cc2)o1)C(=O)C(=O)Nc1ccc(C)c([N+](=O)[O-])c1 513006414 XYNFGVZZALQVMF-UHFFFAOYSA-N 475.423 5.169 5 20 JKBD Cc1csc(Sc2ccc(C(=O)Nc3cccc(-c4ncc(C)o4)c3)cc2[N+](=O)[O-])n1 517508759 RBESWERNWHVEFJ-UHFFFAOYSA-N 452.517 5.727 5 20 JKBD CCOc1cc([N+](=O)[O-])c(C(=O)N[C@H](Cc2ccccc2Cl)c2ccccc2)cc1OC 519876962 NYIJRTRYNRPARE-HXUWFJFHSA-N 454.910 5.369 5 20 JKBD Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)c1cc(OCC(F)(F)F)cc(OCC(F)(F)F)c1 520376235 GNXDYHMXCHGPGH-UHFFFAOYSA-N 466.334 5.346 5 20 JKBD CSc1ccc(C(=O)N2CCCC[C@H]2C(=O)Nc2cc(Cl)ccc2Cl)cc1[N+](=O)[O-] 523445775 ASTYMOJRTFYXPP-INIZCTEOSA-N 468.362 5.257 5 20 JKBD O=C(N[C@@H]1CCCc2nc(O)ccc21)c1ccccc1Sc1ccc(C(F)(F)F)cc1[N+](=O)[O-] 603222935 WLLIUHDPCJJMKR-QGZVFWFLSA-N 489.475 5.673 5 20 JKBD CN1C/C(=C/c2ccc(Oc3ccc(F)cc3)c([N+](=O)[O-])c2)c2nc3ccccc3c(C(=O)O)c2C1 603781499 LNCIXRMFAHEDRP-ATVHPVEESA-N 485.471 5.759 5 20 JKBD COc1ccc(-c2nn(Cc3ccccc3)cc2C(=O)Nc2cc([N+](=O)[O-])ccc2C)cc1OC 603826346 CZULBEJMAYDDAM-UHFFFAOYSA-N 472.501 5.085 5 20 JKBD COc1cc(C(=O)Nc2cccc(-c3noc(C)n3)c2)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 604441290 NIWHLCKLLOAQDD-UHFFFAOYSA-N 480.864 5.660 5 20 JKBD CC(C)Oc1ccc(NC(=O)c2ccc(N3CCC[C@H](C)C3)c([N+](=O)[O-])c2)c(C(F)(F)F)c1 609188968 RCFAAAGBWRVKJV-HNNXBMFYSA-N 465.472 5.889 5 20 JKBD O=C(c1cc2cc([N+](=O)[O-])ccc2s1)N1CCCN(Cc2ccc(C(F)(F)F)cc2)CC1 619221617 QCKZIFAOFLYIGL-UHFFFAOYSA-N 463.481 5.176 5 20 JKBD CC(C)OC(=O)C[C@@H](NC(=O)c1cc(-c2ccncc2)nc2ccccc12)c1ccccc1[N+](=O)[O-] 789839155 BTPCCRKMDFGXSO-XMMPIXPASA-N 484.512 5.018 5 20 JKBD COCCOc1c(Cl)cc(NCc2c(Br)cccc2[N+](=O)[O-])cc1Cl 864031568 GEVLOJRDSYEADC-UHFFFAOYSA-N 450.116 5.301 5 20 JKBD C[C@H](Oc1ccc(Cl)cc1[N+](=O)[O-])c1nc(C2(NC(=O)OC(C)(C)C)CCCC2)no1 904416353 ONMBNUWUTTVSJP-LBPRGKRZSA-N 452.895 5.065 5 20 JKBD O=[N+]([O-])c1ccc2[nH]cc(Cc3nc(-c4ccc(Cn5cnc6ccccc65)cc4)no3)c2c1 904473568 MUSAECXKUGUHEV-UHFFFAOYSA-N 450.458 5.115 5 20 JKBD COc1ccc2cc(C(=O)Oc3ccc(NC(=O)c4cc([N+](=O)[O-])ccc4Cl)cc3)[nH]c2c1 909231857 ICKQEHZANJCBML-UHFFFAOYSA-N 465.849 5.210 5 20 JKBD O=C(C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)NC[C@H]1CC1(Cl)Cl 914610754 ZOELTTZZIUERDV-AAWPKVBNSA-N 462.358 5.445 5 20 JKBD O=C(CCc1ccc2ccccc2n1)O[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1 917236489 SBNUKIOQRZEQCZ-VWLOTQADSA-N 489.915 5.652 5 20 JKBD Cc1c(C(=O)Nc2ccccc2SC[C@H]2CC2(Cl)Cl)cc([N+](=O)[O-])cc1[N+](=O)[O-] 917751459 MBAKQMWGBAWXGC-LLVKDONJSA-N 456.307 5.350 5 20 JKBD O=C(c1ccc(Br)c([N+](=O)[O-])c1)N(Cc1cccnc1)c1ccc(Br)cc1 917774252 HUPMAFVTIVZJQQ-UHFFFAOYSA-N 491.139 5.362 5 20 JKBD C[C@@H](OC(=O)c1ccc(Sc2nncn2C)c([N+](=O)[O-])c1)c1ccc(Cl)cc1Cl 917959032 WTEKLSUGPRFLTK-SNVBAGLBSA-N 453.307 5.099 5 20 JKBD COC(=O)c1ccoc1CSc1ccccc1C(=O)N(C)Cc1cc([N+](=O)[O-])ccc1Cl 917983505 HNFYDAIUOUHJRQ-UHFFFAOYSA-N 474.922 5.192 5 20 JKBD O=C(O[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1)c1c(Cl)nc2ccccn12 919234699 JLDNNGQTUJUYHW-IBGZPJMESA-N 485.283 5.086 5 20 JKBD Cc1cc(C(=O)O[C@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2ccccc2)nn1C(C)(C)C 919352255 OQQYGXVMGIEWLZ-FQEVSTJZSA-N 470.913 5.045 5 20 JKBD COC(=O)c1ccc(-c2ccc(C(=O)O[C@@H](C)c3nnc(-c4ccc([N+](=O)[O-])cc4)o3)cc2)cc1 919586118 TUERBVIUMOFQSK-HNNXBMFYSA-N 473.441 5.016 5 20 JKBD COc1cc(C(=O)Nc2ccc(-c3ccccc3)cc2)c([N+](=O)[O-])cc1OCc1cscn1 919880921 ZMGOZNLAOAPBFH-UHFFFAOYSA-N 461.499 5.558 5 20 JKBD CC(=O)Nc1cccc([C@H](C)OC(=O)Cc2cn(-c3ccccc3)nc2-c2ccc([N+](=O)[O-])cc2)c1 920264827 YTZDLCQEKRRSRS-SFHVURJKSA-N 484.512 5.253 5 20 JKBD O=C(Oc1ccc(-c2ccccc2)cc1[N+](=O)[O-])[C@@H]1CCCN(C(=O)Nc2ccccc2F)C1 920329191 APKWILZZYZHGFJ-LJQANCHMSA-N 463.465 5.250 5 20 JKBD CC(=O)Nc1cc(NC(=O)c2ccccc2NC(=O)c2ccc([N+](=O)[O-])cc2Cl)ccc1Cl 920746795 ISSGHEYPVNIBGH-UHFFFAOYSA-N 487.299 5.365 5 20 JKBD O=C(Cc1ccc(NC(=O)c2cc3ccccc3o2)cc1)Oc1cc(Cl)ccc1[N+](=O)[O-] 921136488 KHQFCQWCCVCIAG-UHFFFAOYSA-N 450.834 5.395 5 20 JKBD O=C(Cc1cccc([N+](=O)[O-])c1)Nc1ccc(C2(NC(=O)[C@H]3C[C@H]3c3ccccc3)CCC2)cc1 1785795406 NETGZKQEXJLCCV-DQEYMECFSA-N 469.541 5.075 5 20 JKBD COc1cc(C(=O)Nc2ccc(C3(NC(=O)c4ccc5cc[nH]c5c4)CCC3)cc2)ccc1[N+](=O)[O-] 1792164431 CFUDXHOCXUSACS-UHFFFAOYSA-N 484.512 5.146 5 20 JKBD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C12CCC(CC1)CC2)c1cc2cc([N+](=O)[O-])ccc2s1 1803247487 MSQULQSGMZRVSP-IPMKCRKTSA-N 467.591 5.032 5 20 JKBD O=C(/C=C/c1ccccc1[N+](=O)[O-])N1[C@H]2CC[C@@H]1C[C@H](NC(=O)C1(c3ccc(Cl)cc3)CCC1)C2 1804345040 SGOOZPLCSCQCRB-GRGOBQFGSA-N 493.991 5.022 5 20 JKBD CC(C)[C@@H](C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2ccc([N+](=O)[O-])cc2F)[nH]n1)c1ccccc1 1814932100 WGLZIFLUZRXWPB-ISKFKSNPSA-N 493.539 5.203 5 20 JKBD CCC[C@H]1CC[C@H](C(=O)N2CCC([C@H]3CCCCN3C(=O)c3ccc([N+](=O)[O-])o3)CC2)CC1 1823617661 HYUOFJMCPBEWLO-HMXCVIKNSA-N 459.587 5.028 5 20 JKBD Cc1c(C(=O)N2CCC([C@@H]3CCCCN3C(=O)c3cccc(F)c3)CC2)cc(Cl)cc1[N+](=O)[O-] 1829963254 ZFXLBTRPCGMTER-QFIPXVFZSA-N 487.959 5.243 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cc3ccccc3o2)CC1 1830733240 KIZRQEXDCIPTRB-JOCHJYFZSA-N 493.535 5.336 5 20 JKBD CCCCC[C@H](C)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cc(N(C)C)ccc2[N+](=O)[O-])CC1 1831467146 VFINIJFWKIBEPD-GBXCKJPGSA-N 486.657 5.111 5 20 JKBD Cc1ccc([N+](=O)[O-])cc1NC(=O)CSc1nc2ccccc2c(=O)n1Cc1ccccc1Cl 9456207 SMNUOQYYKLLMKR-UHFFFAOYSA-N 494.960 5.046 5 20 JKBD CC(C)c1ccc(CSc2nnc(S[C@H](C)c3nnc(-c4ccc([N+](=O)[O-])cc4)o3)s2)cc1 17725584 ZDZSWGQLZYNMTQ-CQSZACIVSA-N 499.643 6.765 5 20 JKBD COc1ccccc1-c1nnc(SCC(=O)Nc2cc([N+](=O)[O-])ccc2F)n1-c1ccc(C)cc1 21673762 JSLREXDZGPINEJ-UHFFFAOYSA-N 493.520 5.029 5 20 JKBD CCOc1ccc(C(=O)Nc2ncc(Cc3ccc(Br)cc3)s2)cc1[N+](=O)[O-] 28685558 ROAHHXGSQNVGNO-UHFFFAOYSA-N 462.325 5.056 5 20 JKBD CC(C)OCc1cccc(NC(=O)Cc2cn(-c3ccccc3)nc2-c2ccc([N+](=O)[O-])cc2)c1 109115604 CEKMXPMAHMJNRO-UHFFFAOYSA-N 470.529 5.554 5 20 JKBD CC(C)N(C)C(=O)c1ccc(Cl)c(NC(=O)c2ccc(N3C[C@H](C)C[C@@H](C)C3)c([N+](=O)[O-])c2)c1 303158044 UPAVSUZFHCUOIQ-IAGOWNOFSA-N 487.000 5.463 5 20 JKBD O=C(C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)NCc1ccc(-n2cncn2)cc1 410401838 XXDZIKZXEYMVJT-DEDYPNTBSA-N 496.552 5.032 5 20 JKBD O=[N+]([O-])c1ccc(-c2nn(-c3ccccc3)cc2CN[C@H](c2ccccc2)c2cccnc2)cc1 488617488 KNSYFXNJQHQJBL-HHHXNRCGSA-N 461.525 5.722 5 20 JKBD Cc1cc(C(=O)NCC(C)C)ccc1NC(=O)c1ccc(NCc2ccccc2)c([N+](=O)[O-])c1 496880631 GNZPMKJKFWLFHN-UHFFFAOYSA-N 460.534 5.153 5 20 JKBD C[C@H](Nc1ccc(C(=O)N(C)[C@@H](C)c2ccc(Cl)c(Cl)c2)cc1[N+](=O)[O-])c1ccccn1 506176760 BFFJVCUQJSRLNE-GJZGRUSLSA-N 473.360 6.303 5 20 JKBD CCOc1cc(CNC(C)(C)c2ccccc2)ccc1OCc1cc([N+](=O)[O-])cc2c1OCOC2 507948420 IIOOIAPRCKPOPT-UHFFFAOYSA-N 478.545 5.464 5 20 JKBD C[C@@H](Nc1ccc(C(=O)Nc2ccc(C(=O)NC3CCCCC3)cc2)cc1[N+](=O)[O-])c1ccccn1 509579207 LLVHSFACBPSWOU-GOSISDBHSA-N 487.560 5.478 5 20 JKBD COc1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2NCc2ccccc2)cc1OCc1ccncc1 512352702 OTRHHRKWEBAVOR-UHFFFAOYSA-N 484.512 5.442 5 20 JKBD C[C@@H](NCc1ccc(Oc2ccc(F)cc2)c([N+](=O)[O-])c1)c1cccc(OCc2ccccn2)c1 513125782 JTPOXTNZDDKZLB-LJQANCHMSA-N 473.504 6.351 5 20 JKBD COc1cc([C@H](C)N[C@@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2ccccc2)cc(OC)c1OC 515516946 LHHPXQMOSDISJT-NPMXOYFQSA-N 499.951 5.305 5 20 JKBD Cc1cnc(-c2cccc(NC(=O)c3ccccc3C(=O)c3ccc(N(C)C)c([N+](=O)[O-])c3)c2)o1 518244784 DKWPPCIFRGJHHP-UHFFFAOYSA-N 470.485 5.108 5 20 JKBD COc1ccc(Oc2ccc([N+](=O)[O-])cc2C(=O)Nc2ccc(Cl)c(NC(C)=O)c2)cc1 518709784 JHMZQOZFLCANCI-UHFFFAOYSA-N 455.854 5.260 5 20 JKBD O=[N+]([O-])c1ccc(-c2ccc(CNCc3nn(-c4ccccc4)c4c3CCC4)o2)c(Br)c1 520202506 MZRPXXZRGDOEMZ-UHFFFAOYSA-N 493.361 5.582 5 20 JKBD CC[C@@H](C)C(=O)Nc1cccc(CNCc2ccc(-c3ccc([N+](=O)[O-])cc3Br)o2)c1 520949791 QTGFQKOAZQDAJI-OAHLLOKOSA-N 486.366 5.892 5 20 JKBD C[C@H](Sc1nnc(-c2ccccc2Br)o1)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl 594639392 DXLQBEBYXKGGNV-VIFPVBQESA-N 483.731 5.180 5 20 JKBD O=C(N[C@@H]1C[C@@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1)c1cc([N+](=O)[O-])ccc1Sc1ccccc1 603573183 VKGPHASGUYXXPH-WDNDVIMCSA-N 492.441 6.385 5 20 JKBD C[C@H]1CCCCN1C(=O)c1ccc(NC(=O)[C@@H](C)Sc2ccc([N+](=O)[O-])cc2)cc1Cl 603987181 LQMKWZFNHFBECW-LSDHHAIUSA-N 461.971 5.382 5 20 JKBD O=C(Nc1ccc(-c2cn3cccnc3n2)cc1)c1cc([N+](=O)[O-])ccc1NCc1ccccc1 604457189 QRGRPBFTGOHOQA-UHFFFAOYSA-N 464.485 5.169 5 20 JKBD C[C@H](c1cccc([N+](=O)[O-])c1)S(=O)(=O)Cc1csc(-c2ccc(C(F)(F)F)cc2)n1 609251481 GLQXOXYCOXJROU-GFCCVEGCSA-N 456.467 5.413 5 20 JKBD Cc1ccc2nc(-c3cccnc3)cc(C(=O)O[C@H](C)c3nnc(-c4ccc([N+](=O)[O-])cc4)o3)c2c1 730442800 YBKYHIOLUOXMDY-MRXNPFEDSA-N 481.468 5.481 5 20 JKBD Cc1cc(-c2cc(C(=O)N(CC3CC3)c3ccc(Cl)c([N+](=O)[O-])c3)c3c(C)noc3n2)c(C)o1 745344343 BAOUMUCEYPZNMW-UHFFFAOYSA-N 480.908 6.026 5 20 JKBD O=C(COC(=O)C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)Nc1ccc(O)cc1 760453169 AOTVNYOPZLIGPT-LGMDPLHJSA-N 489.509 5.023 5 20 JKBD CC(C)Cn1cc([C@@H]2N(Cc3ccc(Oc4ccc(F)cc4)c([N+](=O)[O-])c3)CC23CCOCC3)cn1 849478029 FMCMURGLANRQOJ-SANMLTNESA-N 494.567 5.732 5 20 JKBD CC1=C(C(=O)Nc2cccc([N+](=O)[O-])c2)[C@H](c2cccs2)NC(=S)N1c1ccccc1 916161892 UVKYUOWFHJUKSC-FQEVSTJZSA-N 450.545 5.005 5 20 JKBD Cc1ccc(Sc2ccc(C(=O)N(C)C3CCN(C(=O)OC(C)(C)C)CC3)cc2[N+](=O)[O-])cc1 918123960 IDMCMKNISYLQOZ-UHFFFAOYSA-N 485.606 5.526 5 20 JKBD CC(=O)N(c1nc(COC(=O)c2cc3cccc([N+](=O)[O-])c3[nH]2)cs1)c1c(C)cc(C)cc1Cl 919522652 FSTWNUONRVNNOG-UHFFFAOYSA-N 498.948 5.844 5 20 JKBD CC(C)N(Cc1ccc([N+](=O)[O-])cc1)Cn1nc(-c2cccs2)n(C[C@@H]2CCCO2)c1=S 919950884 WAGOIATXENKTRU-IBGZPJMESA-N 473.624 5.098 5 20 JKBD COc1cc(C(=O)O[C@H](C)c2ccc(F)c(Cl)c2)c([N+](=O)[O-])cc1OCc1cscn1 920161944 MJGOQBSMFFSJBJ-LLVKDONJSA-N 466.874 5.349 5 20 JKBD Cc1nc(CC(=O)NC2(c3ccc(NC(=O)c4cc(Cl)cc([N+](=O)[O-])c4C)cc3)CCC2)cs1 1790773573 BMGSPUYEHLROST-UHFFFAOYSA-N 498.992 5.312 5 20 JKBD Cc1c(C(=O)Nc2ccc(C3(NC(=O)c4cscn4)CCC3)cc2)cc(Cl)cc1[N+](=O)[O-] 1790774656 VTWWHNQMVICSOK-UHFFFAOYSA-N 470.938 5.075 5 20 JKBD CC(C)C1(C(=O)NC2(c3ccc(NC(=O)c4nc5cc([N+](=O)[O-])ccc5[nH]4)cc3)CCC2)CCC1 1790827424 KUXYSYJTZRSSHA-UHFFFAOYSA-N 475.549 5.045 5 20 JKBD O=C(NC1(c2ccc(NC(=O)c3c[nH]c4c(Cl)cccc34)cc2)CCC1)c1ccc([N+](=O)[O-])o1 1790954687 OTGAHFQFXLFXRX-UHFFFAOYSA-N 478.892 5.384 5 20 JKBD O=C(CSc1ccccc1[N+](=O)[O-])N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc2occ(Cl)c2c1 1799329566 RGSLLTUHOMFWLX-BJWYYQGGSA-N 499.976 5.039 5 20 JKBD Cc1ccc(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)c3ccc([N+](=O)[O-])cc3F)n[nH]2)cc1Cl 1821049199 GLEFJVJPAFFTME-HXUWFJFHSA-N 485.903 5.039 5 20 JKBD Cc1cc(CCCC(=O)N2CCCC[C@@H]2C2CCN(C(=O)C3=CCCC3)CC2)c([N+](=O)[O-])cc1F 1824370164 QPMPYDLUNNMQSH-XMMPIXPASA-N 485.600 5.095 5 20 JKBD CCOc1cc(C(=O)Nc2ccc(Br)c(C(F)(F)F)c2)c([N+](=O)[O-])cc1OC 18084205 IFELZVOMQOKGLL-UHFFFAOYSA-N 463.206 5.036 5 20 JKBD CCn1c(S[C@H](C)C(=O)Nc2ccccc2C(F)(F)F)nc2cc3ccccc3cc2c1=O 18467445 MTNNNXOPTRBWNW-CQSZACIVSA-N 471.504 5.708 5 20 JKBD COc1ccccc1-c1nnc(S[C@@H](C)C(=O)Nc2ccccc2[N+](=O)[O-])n1-c1ccc(C)cc1 21752480 STXHNPPYMHTTJZ-KRWDZBQOSA-N 489.557 5.279 5 20 JKBD C[C@@H](OC(=O)c1cc2ccc(F)cc2s1)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 26222263 HJNAOAGGDGLZNF-SECBINFHSA-N 456.373 5.151 5 20 JKBD O=C(COc1ccc2c(-c3ccc([N+](=O)[O-])cc3)cc(=O)oc2c1)Nc1cccc(Cl)c1 28609965 ZCUYWZDSEISTQO-UHFFFAOYSA-N 450.834 5.039 5 20 JKBD CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)[C@H]1CCCN(C(=O)c2cccc3ccccc23)C1 302999729 KPEOGSKZHRJEFX-QFIPXVFZSA-N 459.546 5.037 5 20 JKBD NC(=O)C1CCN(c2ncccc2CNCc2c3ccccc3c(Cl)c3ccccc23)CC1 303342668 ZFNDPWRDNGCJBK-UHFFFAOYSA-N 458.993 5.033 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Cl)N[C@@H](Cn1cnc2ccccc21)c1ccc(F)cc1 409754891 OWHOMOFIGQEQOJ-FQEVSTJZSA-N 453.861 5.300 5 20 JKBD COc1cc(CN(C)C(=O)c2ccc(Sc3nc(C)cs3)c([N+](=O)[O-])c2)ccc1SC 477788161 IWIUNGYZTXWKLL-UHFFFAOYSA-N 475.617 5.514 5 20 JKBD COc1cccc(/C=C(/CC(=O)N2CCc3cc([N+](=O)[O-])ccc32)c2nc3ccccc3s2)c1 478111349 MWXITQMKIGSZFW-UYRXBGFRSA-N 471.538 5.733 5 20 JKBD COc1ccc(CNC(=O)c2ccc(N[C@H](C)c3ccccn3)c([N+](=O)[O-])c2)cc1OC1CCCC1 485456692 XAXVDMOEBMNKJA-GOSISDBHSA-N 490.560 5.423 5 20 JKBD O=C(Nc1nnc(-c2ccco2)s1)c1cc([N+](=O)[O-])ccc1Sc1ccc(Cl)cc1 491387615 RPDGIGOPOZKFRB-UHFFFAOYSA-N 458.908 5.763 5 20 JKBD C[C@H]1CCc2c(sc3nc([C@@H](C)Sc4nc5cc6ccccc6cc5c(=O)n4C)nc(O)c23)C1 495383251 BARAIONPMWNFNZ-UONOGXRCSA-N 488.638 5.775 5 20 JKBD CC[C@H](C)Sc1ccc(NC(=O)c2cc(OCC(F)(F)F)ccc2[N+](=O)[O-])c(C(F)(F)F)c1 499532291 IAPFIDFIJMSJLE-NSHDSACASA-N 496.429 6.698 5 20 JKBD O=C([C@H]1CCC[C@H](C(F)(F)F)C1)N1CCN(Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)CC1 500725794 PAVNRQAPPJUCIL-IRXDYDNUSA-N 481.540 5.336 5 20 JKBD CCn1c(SCC(=O)N2c3ccc([N+](=O)[O-])cc3C[C@@H]2C)nnc1-c1ccc(Cl)cc1Cl 504311017 COVQXFVMHNVVLA-LBPRGKRZSA-N 492.388 5.250 5 20 JKBD Cc1nn(Cc2ccc(F)cc2)c2sc(C(=O)N3c4ccc([N+](=O)[O-])cc4C[C@H]3C)cc12 504329873 VWTPBZSUOFCWMG-CYBMUJFWSA-N 450.495 5.093 5 20 JKBD CCSc1ccc([C@@H](C)NC(=O)c2ccc(N[C@H](C)c3ccccn3)c([N+](=O)[O-])c2)cc1 504711585 JZWKBJZPCAAQFV-IAGOWNOFSA-N 450.564 5.766 5 20 JKBD Cc1csc(Sc2ccc(C(=O)N(CC(=O)Nc3ccc(F)cc3)C(C)C)cc2[N+](=O)[O-])n1 504776364 RAXGXACAHDENDN-UHFFFAOYSA-N 488.566 5.139 5 20 JKBD CCOc1cc(CNCc2ccc(Cl)s2)ccc1OCc1cc([N+](=O)[O-])cc2c1OCOC2 507928223 CKCIZIXVEGBHOH-UHFFFAOYSA-N 490.965 5.444 5 20 JKBD Cc1nc(Cc2ccc(F)cc2)sc1C(=O)Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1 512142583 MNXMRCRUBMTEJL-UHFFFAOYSA-N 454.508 5.465 5 20 JKBD COCCN(C(=O)[C@@H](C)Sc1ccc(Cl)cc1)c1nc(-c2ccc([N+](=O)[O-])cc2)cs1 517303728 RUSVCHMAPVLFRH-CQSZACIVSA-N 477.995 5.532 5 20 JKBD Cc1ccc(NS(=O)(=O)c2ccc(N3CCC(OCCC(C)C)CC3)c([N+](=O)[O-])c2)c(C)c1 519175410 UIDYEDVHRUSOHR-UHFFFAOYSA-N 475.611 5.044 5 20 JKBD C[C@H](c1ccncc1)N(C)C(=O)C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1 520103659 CHBSSTIQNUEMNM-FABDANFUSA-N 458.543 5.750 5 20 JKBD Cc1c(NC(=O)[C@@H](C)Nc2ccc3c(c2)CCC(=O)N3Cc2ccc(Cl)cc2)cccc1[N+](=O)[O-] 520124997 VFJASFBTEJDBTO-QGZVFWFLSA-N 492.963 5.475 5 20 JKBD O=C(Nc1nc(-c2ccc3c(c2)CCC3)cs1)c1ccc([N+](=O)[O-])cc1I 522999343 UGGMKUBGNQXUPU-UHFFFAOYSA-N 491.310 5.064 5 20 JKBD Cc1ccc(NC(=O)c2ccccc2)cc1NC(=O)CSc1ccc(C(F)(F)F)cc1[N+](=O)[O-] 555626454 UFCHFLJQHLVGFU-UHFFFAOYSA-N 489.475 5.905 5 20 JKBD O=C(C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)Nc1ccc(N2CCNC2=O)cc1 589743176 IEVLCCUQANUGQU-OBGWFSINSA-N 499.552 5.304 5 20 JKBD Cc1oc(-c2ccccc2)nc1CN(c1cccc([N+](=O)[O-])c1)S(=O)(=O)c1ccc(F)c(F)c1 591649374 SLRGIKYMVYWSIR-UHFFFAOYSA-N 485.468 5.232 5 20 JKBD COc1ccc([N+](=O)[O-])cc1NC(=O)Cc1sc(-c2ccccc2)nc1-c1cccs1 603475609 STWIXQPAONXSLW-UHFFFAOYSA-N 451.529 5.637 5 20 JKBD Cc1ccc(NS(=O)(=O)c2ccc(N3CCCC[C@H]3c3noc(C4CC4)n3)c([N+](=O)[O-])c2)c(C)c1 603872198 COVQVVUWHVRUDF-NRFANRHFSA-N 497.577 5.004 5 20 JKBD COC(=O)c1ccsc1NC(=O)C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1 603965310 KRXVCHAYASXVHD-QINSGFPZSA-N 479.539 5.622 5 20 JKBD O=C(CCNc1ccc(C(F)(F)F)cc1[N+](=O)[O-])Nc1ccc(-c2noc(C(F)(F)F)n2)cc1 608875463 ODSOLQDVYPBGTI-UHFFFAOYSA-N 489.332 5.123 5 20 JKBD CC(C)(C)[C@@H](NC(=O)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1cccc(C(F)(F)F)c1 608923629 KJGMRHYMLGFJJZ-INIZCTEOSA-N 457.836 5.109 5 20 JKBD COc1cc(C(=O)Nc2cccc(-c3ccc4ccccc4c3)n2)c([N+](=O)[O-])cc1OC(F)F 609171050 NPBNESLZWCFBPS-UHFFFAOYSA-N 465.412 5.672 5 20 JKBD Cc1ccc[n+](/C(C(=S)NCCc2ccc(Cl)cc2Cl)=C(/O)c2ccc([N+](=O)[O-])cc2)c1 726572919 KHDFBRNMEKSGEI-UHFFFAOYSA-O 489.404 5.541 5 20 JKBD O=C(c1cc([N+](=O)[O-])ccc1N1CCCCC1)N1CCO[C@H](c2ccc(Cl)c(Cl)c2)C1 727395122 GXWOXAAZNIZGMG-NRFANRHFSA-N 464.349 5.106 5 20 JKBD CCC(CC)c1cc[n+](/C(C(=S)NC2CCOCC2)=C(/O)c2ccc(C)c([N+](=O)[O-])c2)cc1 727813939 RKKRFVGBOKUDEB-UHFFFAOYSA-O 470.615 5.074 5 20 JKBD COc1ccc(/C=C(/Cl)c2nc(=O)c3cccc(C)c3[nH]2)cc1OCc1ccc([N+](=O)[O-])cc1 747201173 PWMHPDSGJBMIHF-UDWIEESQSA-N 477.904 5.464 5 20 JKBD CC(C)[C@@H](OC(=O)c1csc(-c2ccc([N+](=O)[O-])cc2)n1)C(=O)Nc1ccccc1Cl 747954787 LDBAVQBJFCLJKZ-GOSISDBHSA-N 459.911 5.192 5 20 JKBD C[C@@H](OC(=O)c1csc(-c2ccc([N+](=O)[O-])cc2)n1)C(=O)Nc1ccc(C(C)(C)C)cc1 747958441 NAFWAPVVPRZOQF-CQSZACIVSA-N 453.520 5.200 5 20 JKBD Cc1cccc(C(C)C)c1NC(=O)[C@@H](C)OC(=O)c1csc(-c2ccc([N+](=O)[O-])cc2)n1 747958613 PKLBHCODFOMQET-OAHLLOKOSA-N 453.520 5.334 5 20 JKBD Cc1sc2nc([C@@H](C)OC(=O)c3ccc(N4CCC(C)CC4)c([N+](=O)[O-])c3)nc(O)c2c1C 783322693 GABYWYBKBFQUPB-CQSZACIVSA-N 470.551 5.076 5 20 JKBD C[C@H](OC(=O)c1cc(Cl)ccc1[N+](=O)[O-])C(=O)N1c2ccccc2Sc2ccccc21 824291102 ZBSZQCSTDOEHJS-ZDUSSCGKSA-N 454.891 5.623 5 20 JKBD COc1ccc(-n2c(-c3ccccc3)nn(CN(C)Cc3ccccc3[N+](=O)[O-])c2=S)cc1 914783501 KQDMCJOEJQPHPW-UHFFFAOYSA-N 461.547 5.077 5 20 JKBD Cc1ccc(NC(=S)Nc2ccc([N+](=O)[O-])cc2)cc1S(=O)(=O)Nc1cccc(Cl)c1 916111533 OODMKHDUYLGAKK-UHFFFAOYSA-N 476.967 5.166 5 20 JKBD CCc1c(C(=O)Oc2ccc(NC(=O)c3cc([N+](=O)[O-])ccc3Cl)cc2)cnn1C(C)(C)C 916951813 JBOPLSCRFXANGY-UHFFFAOYSA-N 470.913 5.234 5 20 JKBD C[C@H](OC(=O)[C@@H](C)Oc1ccc(Cl)c(Cl)c1)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 919442763 FKXNJLGBXGMARI-WDEREUQCSA-N 452.250 5.023 5 20 JKBD Cc1occ(C(F)(F)F)c1C(=O)NC1(c2ccc(NC(=O)c3ccc([N+](=O)[O-])o3)cc2)CCC1 1785748976 SRAQGPXYZXXFGH-UHFFFAOYSA-N 477.395 5.170 5 20 JKBD Cc1ccc(C(=O)Nc2ccc(C3(NC(=O)c4cccc([N+](=O)[O-])c4Br)CCC3)cc2)o1 1786493339 BJTOMDPFPHRBRT-UHFFFAOYSA-N 498.333 5.320 5 20 JKBD O=C(Cc1cccc([N+](=O)[O-])c1)NC1(c2ccc(NC(=O)c3cccc(-c4cnco4)c3)cc2)CCC1 1790708485 WKWJZLNQYDSUIX-UHFFFAOYSA-N 496.523 5.240 5 20 JKBD O=C(C[C@@H]1C[C@@H]2CC[C@H]1C2)Nc1ccc(C2(NC(=O)Cc3cccc([N+](=O)[O-])c3)CCC2)cc1 1791318130 MRDIGGXSJLISLG-HKBOAZHASA-N 461.562 5.098 5 20 JKBD Cc1cccc(C(=O)N2CCCC3(CCN(C(=O)c4cc(Cl)cc([N+](=O)[O-])c4C)CC3)C2)c1F 1805075710 HVVWSNOBMUUPDS-UHFFFAOYSA-N 487.959 5.163 5 20 JKBD CC1(C)CCC(CC(=O)N2CCCC[C@H]2c2cc(NC(=O)/C=C/c3ccc([N+](=O)[O-])o3)n[nH]2)CC1 1814970103 RCYQQAHPQPPFGH-IEJURRBGSA-N 483.569 5.223 5 20 JKBD O=C(Nc1cc([C@H]2CCCCN2C(=O)c2cccc(F)c2[N+](=O)[O-])[nH]n1)c1cc2sccc2s1 1819029499 RQMQWTOMRUHVNA-OAHLLOKOSA-N 499.549 5.353 5 20 JKBD CC1(C)CCC(CC(=O)N2CCCC[C@H]2c2cc(NC(=O)c3cccc(F)c3[N+](=O)[O-])n[nH]2)CC1 1821172040 HQWNZLLFDKDBEB-FQEVSTJZSA-N 485.560 5.369 5 20 JKBD CC1(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)c3cc4cc([N+](=O)[O-])ccc4s3)n[nH]2)CCCC1 1821612270 SXNIAUAOBGDMIM-GOSISDBHSA-N 481.578 5.419 5 20 JKBD O=C(c1ccc([N+](=O)[O-])o1)N1CCC([C@@H]2CCCCN2C(=O)[C@@H]2CCC[C@@H]3CCCC[C@H]32)CC1 1828455456 BAZQHRQUWXENNU-PDGJWGCVSA-N 471.598 5.028 5 20 JKBD O=C([C@@H]1CCC[C@@H]2CCCC[C@H]21)N1CCC([C@@H]2CCCCN2C(=O)c2cc(O)cc([N+](=O)[O-])c2)CC1 1830705193 UVTZVJOEWYQEKW-PGTVGAIHSA-N 497.636 5.140 5 20 JKBD C[C@@H](OC(=O)c1ccccc1C(=O)c1ccc(Cl)cc1)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl 10661616 SDTYSYJCWKVFPM-CYBMUJFWSA-N 487.295 5.317 5 20 JKBD C[C@@H](OC(=O)/C=C/c1ccc(Cl)s1)C(=O)Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1 11669286 YSFHBEXAUPNARK-LXSSAFMLSA-N 463.924 5.017 5 20 JKBD COc1cc(C(=O)Nc2ncc(Cc3cccc(Cl)c3)s2)c([N+](=O)[O-])cc1OC(F)F 12017844 BBUYZKJSRGOQHJ-UHFFFAOYSA-N 469.853 5.158 5 20 JKBD O=C(c1ccccc1)C1CCN(C(=O)c2ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])cc2)CC1 14415028 FNLUOHCXYAULSX-UHFFFAOYSA-N 464.905 5.776 5 20 JKBD Cc1cc(C)c2c(-n3cccc3)c(C(=O)O[C@@H](C)c3nnc(-c4ccc([N+](=O)[O-])cc4)o3)sc2n1 17899375 PDLOPCZTYDXQCL-HNNXBMFYSA-N 489.513 5.580 5 20 JKBD C[C@H](OC(=O)c1ccccc1-c1ncc(-c2ccccc2)o1)C(=O)Nc1ccccc1[N+](=O)[O-] 19165088 VBNVKCVEJMCBJC-INIZCTEOSA-N 457.442 5.101 5 20 JKBD CCOc1cc(-c2nnc(Sc3ccc([N+](=O)[O-])cc3Cl)o2)cc(OCC)c1OCC 20666999 JFAJVFXPYOLZIO-UHFFFAOYSA-N 465.915 5.646 5 20 JKBD Cc1ccc([N+](=O)[O-])cc1NC(=O)CSc1nnc(-c2ccc(Cl)cc2)n1Cc1ccccc1 20889484 BJGVFMXDJMIAJI-UHFFFAOYSA-N 493.976 5.594 5 20 JKBD CC(C)[C@H](Sc1nc2cc3ccccc3cc2c(=O)n1C)C(=O)Nc1ccccc1C(F)(F)F 32328349 IBIFVRIFCSUIIR-NRFANRHFSA-N 485.531 5.861 5 20 JKBD O=C(Cn1c2ccccc2c(=O)c2ccccc21)Nc1cccc(NC(=O)Nc2ccccc2)c1 36660978 JUVRWKISIUSSQY-UHFFFAOYSA-N 462.509 5.437 5 20 JKBD O=C(c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1)N1CCN(c2ncnc3sccc23)CC1 219573849 UMBJEWYQNUXHNV-UHFFFAOYSA-N 495.948 5.008 5 20 JKBD C[C@@H](NC(=O)c1cc([N+](=O)[O-])ccc1Sc1ccc(Cl)cc1)c1ccc(NC(N)=O)cc1 480218014 OKYJEHYOWUIRLC-CYBMUJFWSA-N 470.938 5.381 5 20 JKBD COC(=O)c1sc(NC(=O)c2ccccc2Sc2ccc(C(F)(F)F)cc2[N+](=O)[O-])nc1C 499167845 MHWXZZVKISRGPU-UHFFFAOYSA-N 497.476 5.569 5 20 JKBD CC[C@H](C)Sc1ccc(NC(=O)c2cnn(-c3ccc([N+](=O)[O-])cc3)c2)c(C(F)(F)F)c1 499541091 QLDKXLFFLVGFTJ-ZDUSSCGKSA-N 464.469 5.942 5 20 JKBD CN(CCc1ccncc1)C(=O)C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1 499947652 IWCDCUZNLONGAD-SILNSSARSA-N 458.543 5.231 5 20 JKBD Cc1cnn(Cc2cc(F)ccc2F)c1NC(=O)CSc1ccc(C(F)(F)F)cc1[N+](=O)[O-] 502694622 SDJZPQSUXSCGJF-UHFFFAOYSA-N 486.422 5.176 5 20 JKBD CCOc1ccc([C@@H]2CCCN2C(=O)c2ccc(N[C@H](C)c3ccccn3)c([N+](=O)[O-])c2)cc1 506071226 PIWNNMNSCCAMFO-KOSHJBKYSA-N 460.534 5.539 5 20 JKBD O=C(Nc1cc([N+](=O)[O-])ccc1OC(F)F)c1csc(-c2cccc(C(F)(F)F)c2)n1 508941862 MLPVLLQKUNAJHZ-UHFFFAOYSA-N 459.352 5.591 5 20 JKBD O=C(c1ccccc1Sc1ccc(C(F)(F)F)cc1[N+](=O)[O-])N1CCC(c2ncc[nH]2)CC1 509951516 IORDMMHLXCUZAX-UHFFFAOYSA-N 476.480 5.508 5 20 JKBD COc1cc(C(=O)N[C@@H](c2ccccc2)c2ccc(F)cc2)c([N+](=O)[O-])cc1OCc1cscn1 512184695 IHBMZQHUHYYEBS-DEOSSOPVSA-N 493.516 5.297 5 20 JKBD O=C(Nc1nc(Cc2ccccc2)c(-c2ccccc2)s1)c1cc2c(cc1[N+](=O)[O-])OCCO2 515129824 PURDAMYYDBVVSM-UHFFFAOYSA-N 473.510 5.333 5 20 JKBD COc1ccc(CCCN[C@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Br)c2ccccc2)cc1 604125331 PDDUIHTULMWNQT-QHCPKHFHSA-N 498.377 5.268 5 20 JKBD CCCN1Cc2cccc(NC(=O)Cc3cn(-c4ccccc4)nc3-c3ccc([N+](=O)[O-])cc3)c2C1 608949535 HRXSAQUUQJUMHQ-UHFFFAOYSA-N 481.556 5.354 5 20 JKBD Cn1c(-c2ccc(NC(=O)c3ccc([N+](=O)[O-])cc3I)cc2)nc2ccccc21 608954264 JGIVMYKSIVGBQW-UHFFFAOYSA-N 498.280 5.005 5 20 JKBD COc1cc(C(=O)Nc2cccc(Sc3ccccc3)c2)c([N+](=O)[O-])cc1OCc1cscn1 609375334 UTVRJGCVGAISTI-UHFFFAOYSA-N 493.566 6.042 5 20 JKBD C[C@@H](OC(=O)c1ccc(-c2ccc(Br)cc2)n1C)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 726020728 ADQHVNWRKWUKLZ-CYBMUJFWSA-N 497.305 5.331 5 20 JKBD Cc1ccc(C(=O)Nc2nc3ccc(NC(=O)c4cc([N+](=O)[O-])cc([N+](=O)[O-])c4C)cc3s2)s1 726537834 RNKAIPVZDPJRRA-UHFFFAOYSA-N 497.514 5.296 5 20 JKBD O=C(O[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1)c1ccc(C(F)F)cc1 726667018 ZQAXQCAAWXIDEO-LJQANCHMSA-N 460.820 5.723 5 20 JKBD CC(C)N(Cc1nnc(-c2cccc([N+](=O)[O-])c2)o1)C(=O)CCCc1ccc(C(C)(C)C)cc1 727294589 FPTBSUQJMPUHBP-UHFFFAOYSA-N 464.566 5.702 5 20 JKBD CCCc1cc[n+](/C(C(=S)Nc2ccccc2CC)=C(/O)c2ccc(C)c([N+](=O)[O-])c2)cc1 731122552 LTXIJKNESFNQBQ-UHFFFAOYSA-O 462.595 6.029 5 20 JKBD COc1ccccc1[C@H](C)NC(=O)[C@@H](C)Oc1ccc2c(-c3ccc([N+](=O)[O-])cc3)cc(=O)oc2c1 851960067 YUDBXCVJKNDSPI-DLBZAZTESA-N 488.496 5.022 5 20 JKBD O=C(Nc1nc2ccc(SC(F)F)cc2s1)c1ccc(N2CCCC2)c([N+](=O)[O-])c1 855612667 RVVTWULEEJELOI-UHFFFAOYSA-N 450.492 5.372 5 20 JKBD COc1cc(C(=O)Nc2cccc(CN3CCOC3=O)c2)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 916078389 YISWAURIGKVBSI-UHFFFAOYSA-N 497.891 5.254 5 20 JKBD CCOc1cc(C(=O)Nc2ccccc2SC[C@H]2CC2(Cl)Cl)c([N+](=O)[O-])cc1OC 917751338 JSAVHANQUSIGIB-GFCCVEGCSA-N 471.362 5.540 5 20 JKBD CN(Cc1csc2ccccc12)C(=O)c1ccccc1NC(=O)c1ccc([N+](=O)[O-])cc1Cl 918580989 ZGUKFRDZMNMWSD-UHFFFAOYSA-N 479.945 5.987 5 20 JKBD CC(=O)N(c1ccc(F)cc1)c1nc(COC(=O)[C@@H](C)Sc2ccc([N+](=O)[O-])cc2)cs1 918875179 NOXJPUGCCOKPDM-CYBMUJFWSA-N 475.523 5.099 5 20 JKBD C[C@H](SCc1ncc(-c2ccc(Cl)cc2)o1)C(=O)O[C@H](C)C(=O)Nc1cccc([N+](=O)[O-])c1 920673649 MSSYOFUUQLMQFH-KGLIPLIRSA-N 489.937 5.095 5 20 JKBD Cc1cc(C(=O)N2CCC[C@@H](C)C2)ccc1NC(=O)c1cc([N+](=O)[O-])ccc1N1CCC(C)CC1 921008427 FHTWGBHTAUKMSW-LJQANCHMSA-N 478.593 5.264 5 20 JKBD O=C(Nc1cc([N+](=O)[O-])c(F)cc1F)c1oc2ccccc2c1CSc1ccccc1F 921148081 QEBNCXUYQIWXDW-UHFFFAOYSA-N 458.417 6.303 5 20 JKBD O=C(/C=C/c1ccc([N+](=O)[O-])o1)NC1(c2ccc(NC(=O)c3cc4sccc4[nH]3)cc2)CCC1 1789366732 KJWRRZUKQKHIIM-SOFGYWHQSA-N 476.514 5.192 5 20 JKBD O=C(NC1(c2ccc(NC(=O)[C@@H]3CCc4cccc(Cl)c43)cc2)CCC1)c1ccc([N+](=O)[O-])[nH]1 1791141474 MBRUHPZANGIFFS-GOSISDBHSA-N 478.936 5.054 5 20 JKBD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(F)cc([N+](=O)[O-])c1)c1ccc(-c2ccc(Cl)cc2)o1 1800525187 RPOGJKZKKPSXRT-ACDBMABISA-N 497.910 5.213 5 20 JKBD O=C(Cc1cccc([N+](=O)[O-])c1)N1CCC([C@@H]2CCCCN2C(=O)CCc2ccccc2Cl)CC1 1826571952 QSLWAMBTUCMBIW-VWLOTQADSA-N 498.023 5.043 5 20 JKBD O=C(CSc1ccccc1[N+](=O)[O-])N1CCC([C@@H]2CCCCN2C(=O)/C=C/C2CCCC2)CC1 1830351940 PLTAQVIROAPFKL-GNNUASRNSA-N 485.650 5.053 5 20 JKBD O=C(/C=C/c1ccccc1[N+](=O)[O-])N1CCC([C@@H]2CCCCN2C(=O)C[C@H]2C[C@@H]3CC[C@H]2C3)CC1 1831484681 ZYYSLLWYIYIRBY-RSRHMREQSA-N 479.621 5.054 5 20 JKBD Cc1cc(CCCC(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)c2ccc(C(C)C)cc2)c([N+](=O)[O-])cc1F 1847715475 FCHPOLISWAPFEF-ZEQRLZLVSA-N 481.568 5.004 5 20 JKBD CCn1c(S[C@@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)nnc1-c1cccc(Cl)c1 9821207 QADMWKKCSHHIMO-NSHDSACASA-N 466.350 5.299 5 20 JKBD C[C@H](Sc1nnc(-c2ccc(F)cc2)n1-c1ccccc1)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 17654905 LSUPDUORGCMUSS-HNNXBMFYSA-N 488.504 5.885 5 20 JKBD C[C@@H](Sc1nnc(-c2ccccc2)n1Cc1ccco1)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 17665225 BCTHPJHQCCBFLN-OAHLLOKOSA-N 474.502 5.398 5 20 JKBD COc1ccc(-c2nn(-c3ccccc3)cc2C(=O)Nc2ccc(C)c([N+](=O)[O-])c2)c(OC)c1 20893573 PMIKOUAPBHTDIJ-UHFFFAOYSA-N 458.474 5.025 5 20 JKBD Cc1csc(Sc2ccc(C(=O)O[C@H](C)C(=O)Nc3cccc(C)c3C)cc2[N+](=O)[O-])n1 23968901 YHNHVCZYZVGLMS-OAHLLOKOSA-N 471.560 5.312 5 20 JKBD CCN(c1ccccc1)S(=O)(=O)c1ccc(NCc2nc3ccccc3s2)c([N+](=O)[O-])c1 24153232 PNCNNKQYYPLZBN-UHFFFAOYSA-N 468.560 5.032 5 20 JKBD COc1cc2c(cc1OC)[C@H](c1cccs1)N(C(=O)[C@@H](C)Sc1ccc([N+](=O)[O-])cc1)CC2 24445904 CVHNENBBKUFTCK-IQMFZBJNSA-N 484.599 5.328 5 20 JKBD O=C(Cn1c2ccccc2c(=O)c2ccccc21)NC[C@@H]1CC2c3ccccc3C1c1ccccc12 26001607 OMSLYKIPUMLUQD-DEIADXHFSA-N 470.572 5.568 5 20 JKBD O=C(C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)NCCOc1ccccc1F 31390889 QRACXJGKSWAWNP-SDXDJHTJSA-N 477.517 5.470 5 20 JKBD Cc1cccc(C(=O)N2CCCN(C(=O)c3ccc(Oc4ccc(Cl)cc4[N+](=O)[O-])cc3)CC2)c1 31641000 RFNCXNMDMNDOFF-UHFFFAOYSA-N 493.947 5.337 5 20 JKBD COc1ccc(Oc2ccc([N+](=O)[O-])cc2C(=O)N(C)Cc2ccc(OC(F)F)c(OC)c2)cc1 32681526 IVZSDJICEWNLOJ-UHFFFAOYSA-N 488.443 5.278 5 20 JKBD O=[N+]([O-])c1cccc(-c2noc(CSc3nnc(Nc4ccc(OC(F)(F)F)cc4)s3)n2)c1 45705526 NGFWMVGCAVODDT-UHFFFAOYSA-N 496.452 5.431 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Br)[C@@H](NCc1cc2ccccc2[nH]1)c1ccccc1 476989822 NOZJCZQPHJTJGR-QFIPXVFZSA-N 479.334 5.308 5 20 JKBD CC(C)CCSc1ccc(C(=O)Nc2cccc(C(=O)NCc3ccccn3)c2)cc1[N+](=O)[O-] 482813025 OYAQVCUGGDURHH-UHFFFAOYSA-N 478.574 5.310 5 20 JKBD COc1ccc([C@@H](NC(=O)c2ccc([N+](=O)[O-])cc2Cl)c2ccccc2)cc1Br 485258865 QBYWKVCAVVDMQO-FQEVSTJZSA-N 475.726 5.539 5 20 JKBD O=C(Nc1cccc(CN2CCCCC2=O)c1)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1 497347551 OTRWQCSTCJXJAJ-UHFFFAOYSA-N 479.920 5.805 5 20 JKBD CC[C@H](C)Sc1ccc(NC(=O)c2ccc(S(C)(=O)=O)c([N+](=O)[O-])c2)c(C(F)(F)F)c1 499579414 BELGVPNZQPJOQN-NSHDSACASA-N 476.498 5.160 5 20 JKBD O=C(Nc1cccc(C(=O)N2CCOCC2)c1)c1cc([N+](=O)[O-])ccc1Sc1ccc(Cl)cc1 500292495 GKTJHNAUDHHIDP-UHFFFAOYSA-N 497.960 5.124 5 20 JKBD Cc1nnc(Sc2ccc(NC(=O)Cn3c4ccccc4c(=O)c4ccccc43)c(C)c2)s1 505877218 JVUANMYCHAWRSF-UHFFFAOYSA-N 472.595 5.413 5 20 JKBD Cc1nnc(NC(=O)c2c3c(nc4ccccc24)/C(=C/c2ccc([N+](=O)[O-])cc2)CCC3)s1 509143944 XEXYXQWQTHGVOI-DTQAZKPQSA-N 457.515 5.432 5 20 JKBD CCOc1cc(NC(=O)c2sc(COc3ccc(F)cc3)nc2C)c([N+](=O)[O-])cc1OCC 514351725 XRWGNXJPAFKCLD-UHFFFAOYSA-N 475.498 5.128 5 20 JKBD C[C@H](c1ccccc1)n1c(SCc2nc(-c3ccc([N+](=O)[O-])cc3)no2)nc2ccccc2c1=O 514458134 FWWUUBJLSCKYSH-MRXNPFEDSA-N 485.525 5.256 5 20 JKBD C[C@@H](Nc1ccc(C(=O)NC[C@@H](c2ccccc2Cl)N2CCCC2)cc1[N+](=O)[O-])c1ccccn1 516170029 XNDPLZQWBYIYRH-CJAUYULYSA-N 493.995 5.383 5 20 JKBD Cc1ncc2c(n1)CCN(C(=O)c1c3c(nc4ccccc14)/C(=C/c1cccc([N+](=O)[O-])c1)CCC3)C2 517344212 VLRAYCVIVFZWMV-XSFVSMFZSA-N 491.551 5.317 5 20 JKBD Cc1ccc(Sc2ccc(CNCc3cccc(C(=O)NC[C@@H]4CCCO4)c3)cc2[N+](=O)[O-])cc1 517549399 OICYUIRWMNMNKO-QHCPKHFHSA-N 491.613 5.253 5 20 JKBD COC(=O)c1sc(-c2cccc(Br)c2)cc1NC(=O)c1ccccc1[N+](=O)[O-] 520410231 WJVCFLCZHLWFNZ-UHFFFAOYSA-N 461.293 5.125 5 20 JKBD CC[C@@H](C)Sc1ccc(NC(=O)c2ccc(-n3ccnc3)c([N+](=O)[O-])c2)c(C(F)(F)F)c1 556564349 BOJWHEMDILJOBY-CYBMUJFWSA-N 464.469 5.942 5 20 JKBD CCOc1ccccc1NC(=O)C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1 598865480 FLPQCCZOBZIJHB-OBGWFSINSA-N 459.527 6.173 5 20 JKBD CN(C)[C@@H](CNC(=O)c1ccccc1Sc1ccc(C(F)(F)F)cc1[N+](=O)[O-])c1cccs1 600839351 UJJAAVYRTGTMHL-KRWDZBQOSA-N 495.548 5.859 5 20 JKBD CCOc1cc([N+](=O)[O-])c(C(=O)Nc2cc(C(C)(C)C)nn2-c2ccccc2C)cc1OC 603638329 KTQUAYOXLUMNQC-UHFFFAOYSA-N 452.511 5.046 5 20 JKBD CSc1ccc(-c2csc(NC(=O)c3cc(OCC(F)(F)F)ccc3[N+](=O)[O-])n2)cc1 603730096 CVAMIAWGQRGYRF-UHFFFAOYSA-N 469.466 5.634 5 20 JKBD O=C(Nc1ccccc1Cn1cncn1)c1ccc(Sc2nc3ccccc3s2)c([N+](=O)[O-])c1 604020961 LASSLRGQGRKOMY-UHFFFAOYSA-N 488.554 5.248 5 20 JKBD CCC(=O)Nc1cccc(CN[C@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2ccccc2)c1 604045776 QWWBBWVCQSBQKR-QHCPKHFHSA-N 466.925 5.066 5 20 JKBD COC(=O)c1ccccc1C(=O)c1ccc(N(C)C[C@@H]2CCCO[C@@H]2c2ccccc2)c([N+](=O)[O-])c1 604520422 MPVVQENKSGTKGL-KDYSTLNUSA-N 488.540 5.217 5 20 JKBD O=[N+]([O-])c1ccc(-c2ccc(CNC3C[C@@H](C(F)(F)F)C[C@H](C(F)(F)F)C3)s2)cc1 608835866 RAXYZRSOZUDYFE-STQMWFEESA-N 452.420 6.322 5 20 JKBD CCOc1cc([N+](=O)[O-])c(C(=O)Nc2ccc(Oc3ccc(F)cc3)c3ccncc23)cc1OC 609033338 SPBZVEIOVDYQFN-UHFFFAOYSA-N 477.448 5.734 5 20 JKBD COc1cc(C(=O)N[C@H](c2ccc(Cl)cc2)C2CCCC2)c([N+](=O)[O-])cc1OC(F)F 609218515 OGZBTQRVCZYGIF-IBGZPJMESA-N 454.857 5.520 5 20 JKBD Cc1csc(Sc2ccc(NC(=O)N3CCN(c4ccccc4[N+](=O)[O-])CC3)c(C)c2)n1 609424446 KHSNDENMLUGLSW-UHFFFAOYSA-N 469.592 5.173 5 20 JKBD O=C(CCC(=O)c1ccc2ccc3cccc4ccc1c2c34)Nc1cccc(C(=O)N2CCOCC2)c1 727754439 CZRAULAFSWCRAC-UHFFFAOYSA-N 490.559 5.658 5 20 JKBD COc1ccc(NS(=O)(=O)c2cc(Cl)ccc2[N+](=O)[O-])cc1OCc1ccc2ccccc2n1 728016974 CELSEMGZVBEFFM-UHFFFAOYSA-N 499.932 5.185 5 20 JKBD Cc1ccc(C)c(NC(=O)[C@H](OC(=O)Cn2ccc3cc([N+](=O)[O-])ccc32)c2ccccc2)c1 744623195 MESIEZCRUXDLLR-RUZDIDTESA-N 457.486 5.090 5 20 JKBD C[C@H](OC(=O)CSc1cc(Cl)ccc1Cl)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 789876558 GEHINVVRAOJFJH-VIFPVBQESA-N 497.278 5.583 5 20 JKBD O=C(OCc1coc(-c2ccccc2)n1)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 825335859 FHSUOSFYFJZWMF-UHFFFAOYSA-N 475.423 5.228 5 20 JKBD Cc1ccc(-c2nc(COC(=O)C3CCN(c4ccc(C(F)(F)F)cc4[N+](=O)[O-])CC3)co2)cc1 899895928 XQYIVAFMUZTFDA-UHFFFAOYSA-N 489.450 5.537 5 20 JKBD C[C@@H](Nc1ccc(-c2nc(-c3ccc(Oc4ccc(F)cc4)nc3)no2)cc1[N+](=O)[O-])c1ccccn1 904511707 SZRGRBGTXAAOSG-MRXNPFEDSA-N 498.474 6.206 5 20 JKBD CC(C)N(Cc1nnc(-c2cccc([N+](=O)[O-])c2)o1)C(=O)CCc1ccc(Cl)cc1Cl 912898929 CCBWSJIIBVMAEM-UHFFFAOYSA-N 463.321 5.321 5 20 JKBD O=C(Nc1ccccc1C(=O)OCc1coc(-c2cccc(F)c2)n1)c1ccc([N+](=O)[O-])cc1Cl 914621580 HNHYXIUJXCTEFB-UHFFFAOYSA-N 495.850 5.652 5 20 JKBD C[C@@H](NC(=O)c1ccccc1NC(=O)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-])c1ccccc1 915812695 LIOYPADZPNZDPO-OAHLLOKOSA-N 487.434 5.279 5 20 JKBD O=[N+]([O-])c1cccc(-c2nccc(/C=C/c3ccc(-c4ccc([N+](=O)[O-])cc4Cl)o3)[n+]2[O-])c1 915988019 PLTHVYSEOXDUOC-GQCTYLIASA-N 464.821 5.282 5 20 JKBD Cc1ccc(NC(=O)[C@H](OC(=O)[C@@H]2CCC[C@H](C(F)(F)F)C2)c2ccccc2)c([N+](=O)[O-])c1 919372400 YGJWHACOHYKUCH-FUHIMQAGSA-N 464.440 5.495 5 20 JKBD Cc1nccn1-c1ncccc1CNC(=O)c1cc([N+](=O)[O-])ccc1Sc1ccc(Cl)cc1 919760381 KRRWMONKIWNODR-UHFFFAOYSA-N 479.949 5.219 5 20 JKBD Cc1ccc(-c2nc(COC(=O)c3ccc(N[C@H](C)c4ccccn4)c([N+](=O)[O-])c3)co2)cc1 920545123 FVQUKUVZUUAHSZ-QGZVFWFLSA-N 458.474 5.483 5 20 JKBD C[C@H](OC(=O)c1ccc(N[C@H](C)c2ccccn2)c([N+](=O)[O-])c1)C(=O)c1ccc2c(c1)CCC2 920546106 ULNBOKCGUDLILP-SJORKVTESA-N 459.502 5.080 5 20 JKBD CC(=O)N(c1ccc(C)cc1)c1nc(COC(=O)[C@@H](C)Oc2ccc(Cl)cc2[N+](=O)[O-])cs1 920778136 KCIHCKHYWWQTHC-CQSZACIVSA-N 489.937 5.208 5 20 JKBD C[C@H](OC(=O)[C@H](C)Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)Nc1ccccc1Cc1ccccc1 920779302 RVIFOBNEYXXJKK-IRXDYDNUSA-N 482.920 5.177 5 20 JKBD O=C(Cc1cccc([N+](=O)[O-])c1)Nc1ccc(C2(NC(=O)C[C@H]3C[C@@H]4CC[C@H]3C4)CCC2)cc1 1785795218 CZVLYNXKOPDDNP-QHAWAJNXSA-N 461.562 5.098 5 20 JKBD Cc1nc(C)c(C(=O)Nc2ccc(C3(NC(=O)c4cc(Cl)cc([N+](=O)[O-])c4C)CCC3)cc2)s1 1787335935 QPOWBCVWKNOXEE-UHFFFAOYSA-N 498.992 5.691 5 20 JKBD CCOc1ccc(Cl)cc1C(=O)NC1(c2ccc(NC(=O)c3ccc([N+](=O)[O-])[nH]3)cc2)CCC1 1790187177 BZXINPLCQGWRCO-UHFFFAOYSA-N 482.924 5.037 5 20 JKBD CC[C@H](C)CC(=O)N1CCCC2(CCN(C(=O)CCCc3cc(C)c(F)cc3[N+](=O)[O-])CC2)C1 1805782468 WYPQYMYGMUUGFF-IBGZPJMESA-N 475.605 5.032 5 20 JKBD C[C@@H](Sc1ccccc1)C(=O)N1CCCC2(CCN(C(=O)/C=C/c3ccccc3[N+](=O)[O-])CC2)C1 1805859733 XUWALIHGWVQRQW-JNCYCUAHSA-N 493.629 5.020 5 20 JKBD O=C(Nc1cc([C@H]2CCCCN2C(=O)c2cc3c(Cl)cccc3s2)[nH]n1)c1ccc([N+](=O)[O-])[nH]1 1820365010 MCLKRTKGYSDRHY-MRXNPFEDSA-N 498.952 5.134 5 20 JKBD CC[C@H]1CC[C@H](C(=O)Nc2cc([C@H]3CCCCN3C(=O)CSc3ccccc3[N+](=O)[O-])[nH]n2)CC1 1822224325 LVVQBXPZVGBDKL-QWFCFKBJSA-N 499.637 5.319 5 20 JKBD O=C(Nc1cc([C@@H]2CCCCN2C(=O)CCc2cccc([N+](=O)[O-])c2)[nH]n1)c1ccccc1C1CC1 1823130313 OCQUAQKUAJDXSR-DEOSSOPVSA-N 487.560 5.134 5 20 JKBD CCCCC[C@H](C)C(=O)N1CCCC[C@H]1C1CCN(C(=O)Cc2cc([N+](=O)[O-])ccc2F)CC1 1831462267 IDMXLFZVYQLPBT-CYFREDJKSA-N 475.605 5.113 5 20 JKBD C[C@@H](CC(=O)N1CCCC[C@@H]1C1CCN(C(=O)/C=C/c2ccccc2[N+](=O)[O-])CC1)c1ccccc1 1831510430 MRFQHHULILGEFM-WFDXBIBDSA-N 489.616 5.422 5 20 JKBD O=C(O[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Br)c1ccccc1)c1cc2ccccc2[nH]1 11225998 JJZZQXCJAPOYNP-OAQYLSRUSA-N 494.301 5.375 5 20 JKBD C[C@@H](OC(=O)c1nc(Cl)c(Cl)c(Cl)c1Cl)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl 12681985 OMAJCEWCIXXZGV-RXMQYKEDSA-N 487.510 5.441 5 20 JKBD Cc1cc(NC(=O)c2ccco2)sc1C(=O)Oc1ccc(NC(=O)c2cccc([N+](=O)[O-])c2)cc1 26076164 WPKCGVFCVQPHCY-UHFFFAOYSA-N 491.481 5.282 5 20 JKBD O=C(c1ccc(Br)c([N+](=O)[O-])c1)N(Cc1ccccn1)c1ccc(Br)cc1 68734249 LKYDCXZUOUAXTB-UHFFFAOYSA-N 491.139 5.362 5 20 JKBD CC(C)c1ccc(CSc2nnc(SCc3nc(-c4ccc([N+](=O)[O-])cc4)no3)s2)cc1 69628516 IPWSMGMVOVEEQG-UHFFFAOYSA-N 485.616 6.204 5 20 JKBD CC(=O)NCc1ccc(-c2csc(NC(=O)c3cc([N+](=O)[O-])ccc3Oc3ccccc3)n2)s1 69640913 UDWDBYMGABPMCM-UHFFFAOYSA-N 494.554 5.461 5 20 JKBD CC(=O)N(c1ccc(C)c(C)c1)c1nc(COc2ccc([N+](=O)[O-])cc2C(F)(F)F)cs1 72048596 RCYMIWXZUSRSSB-UHFFFAOYSA-N 465.453 5.951 5 20 JKBD O=C(NCc1cn(-c2ccccc2)nc1-c1ccc(F)cc1)c1cc([N+](=O)[O-])ccc1Cl 105046404 XGJBHNZEEBAQEU-UHFFFAOYSA-N 450.857 5.170 5 20 JKBD CCOc1cc(C(=O)Nc2ccccc2C(=O)Nc2ccc(Cl)cc2)c([N+](=O)[O-])cc1OC 105341916 VGMLUENPJMBIBN-UHFFFAOYSA-N 469.881 5.160 5 20 JKBD Cc1ccc(Br)cc1NC(=O)c1ccc(N[C@H](C)c2ccccn2)c([N+](=O)[O-])c1 108830502 HXFKJLPDDXIZSE-CQSZACIVSA-N 455.312 5.486 5 20 JKBD O=C(CCNc1ccc(C(F)(F)F)cc1[N+](=O)[O-])Nc1ccccc1OC[C@H]1CCCCO1 108915000 XUUYAAOZKICSQO-MRXNPFEDSA-N 467.444 5.002 5 20 JKBD Cc1cc(OCc2cccc(F)c2)ccc1NC(=O)[C@@H]1CCCN1C(=O)c1ccc([N+](=O)[O-])c(C)c1 112518716 HAGMOUKYADLHKM-VWLOTQADSA-N 491.519 5.173 5 20 JKBD C[C@H](Nc1ccc(C(=O)Nc2cc(F)ccc2Sc2nccn2C)cc1[N+](=O)[O-])c1ccccn1 116436593 RUBHXZZSFKHCRK-HNNXBMFYSA-N 492.536 5.439 5 20 JKBD Cc1ccc(-c2csc(NC(=O)Cc3csc(-c4cccc(F)c4)n3)n2)cc1[N+](=O)[O-] 247994041 OHIWPWCKOWQJBE-UHFFFAOYSA-N 454.508 5.471 5 20 JKBD C[C@H](Sc1nnc(-c2ccc(Cl)cc2)o1)C(=O)Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1 255929838 NZYPIAFOKKBLJR-NSHDSACASA-N 487.950 5.541 5 20 JKBD Cc1cc(Sc2nnc(COc3ccc(Cl)cc3)o2)nc(-c2ccc([N+](=O)[O-])cc2)n1 489337851 XSCNPFBGXXLUBC-UHFFFAOYSA-N 455.883 5.127 5 20 JKBD O=C(Cn1c2ccccc2c(=O)c2ccccc21)N[C@@H](Cc1cccc(F)c1)c1cccc(F)c1 489909416 QBJIWNBVHFVAEL-VWLOTQADSA-N 468.503 5.533 5 20 JKBD COc1cc(C(=O)N[C@@H](Cc2cccc(F)c2)c2cccc(F)c2)c([N+](=O)[O-])cc1OC(F)F 489939034 AOEYRRMCKDIQJR-SFHVURJKSA-N 478.398 5.197 5 20 JKBD C[C@H]1CN(Cc2ccccc2NC(=O)c2ccc(N[C@H](C)c3ccccn3)c([N+](=O)[O-])c2)C[C@@H](C)O1 508946652 AZSHQBBZQVUSDD-HSALFYBXSA-N 489.576 5.024 5 20 JKBD CS(=O)(=O)c1ccc(-c2csc(NC(=O)c3cc4ccccc4c4cccnc34)n2)cc1 515287847 YZWASMCSBSMVPC-UHFFFAOYSA-N 459.552 5.167 5 20 JKBD CCN(Cc1ccccc1)C(=O)c1cc(NC(=O)Cc2ccccc2[N+](=O)[O-])ccc1Cl 515449398 WTBIVIBZPXLBLD-UHFFFAOYSA-N 451.910 5.092 5 20 JKBD O=C(Nc1ccc(=O)n(Cc2ccc(Cl)c(Cl)c2)c1)c1cc2cc([N+](=O)[O-])ccc2s1 520096852 OQNNHEDUOHEDKI-UHFFFAOYSA-N 474.325 5.579 5 20 JKBD Cc1csc(Sc2ccc(C(=O)Nc3nccn3Cc3ccccc3)cc2[N+](=O)[O-])n1 520777088 WFWWELQHWDMQKC-UHFFFAOYSA-N 451.533 5.008 5 20 JKBD C[C@@H]1CCCN(c2ccc(C(=O)Nc3ccc(CC(=O)Nc4ccccc4F)cc3)cc2[N+](=O)[O-])C1 524386813 XKFUFTGXNXGRTJ-GOSISDBHSA-N 490.535 5.404 5 20 JKBD Cc1ccc(C)c(SCc2nc(=O)c3c(C)c(C(=O)Nc4cc([N+](=O)[O-])ccc4C)sc3[nH]2)c1 592414685 MPAVNHVWDSSWNQ-UHFFFAOYSA-N 494.598 5.671 5 20 JKBD COC(=O)COc1cccc(NC(=O)c2cc([N+](=O)[O-])ccc2Sc2ccc(Cl)cc2)c1 603578765 VTTQLUBACICPNY-UHFFFAOYSA-N 472.906 5.204 5 20 JKBD CSc1ccc(C(=O)c2ccccc2C(=O)NCc2cc(-c3ccccc3)no2)cc1[N+](=O)[O-] 603889946 GZXSGNXEJXGILS-UHFFFAOYSA-N 473.510 5.133 5 20 JKBD O=C(c1cc([N+](=O)[O-])ccc1Sc1ccccc1)N1C[C@@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1 604257695 LWBQECJNRSHDTF-BETUJISGSA-N 478.414 5.949 5 20 JKBD COc1cc(CN[C@@H](C)c2ccc(-c3csc(C)n3)cc2)c([N+](=O)[O-])cc1OCC(F)(F)F 604532406 QDYIEKYYPBRDCJ-ZDUSSCGKSA-N 481.496 5.827 5 20 JKBD C[C@H](NCc1ccc(-c2cccc([N+](=O)[O-])c2)o1)c1cccc(NC(=O)Cc2ccccc2F)c1 608836159 MEKSUATVGDQKIY-SFHVURJKSA-N 473.504 6.026 5 20 JKBD O=[N+]([O-])c1ccc(-c2nn(-c3ccccc3)cc2CNCc2ccc(N3CCCCCC3)nc2)cc1 608836276 YTSRPGJDLOUAOV-UHFFFAOYSA-N 482.588 5.513 5 20 JKBD CCN(Cc1ccoc1)[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Br)c1ccccc1 608840367 XUFOHZFDYRPRFT-FQEVSTJZSA-N 458.312 5.152 5 20 JKBD CCCO[C@@H]1CCCN(C(=O)c2cc([N+](=O)[O-])ccc2N2CCC(Cc3ccccc3)CC2)CC1 730990410 WJVOFFATRMYEQP-RUZDIDTESA-N 479.621 5.475 5 20 JKBD COc1ccc(COC(=O)Cc2csc(-c3ccc(Cl)cc3Cl)n2)cc1[N+](=O)[O-] 747258268 KEXXQBJLGJCSNZ-UHFFFAOYSA-N 453.303 5.320 5 20 JKBD Cc1cc(C(=O)COC(=O)c2csc(-c3ccc([N+](=O)[O-])cc3)n2)c(C)n1Cc1cccs1 747958610 PBPOZIUCEFIYKY-UHFFFAOYSA-N 481.555 5.286 5 20 JKBD O=C(Nc1ccc(OC(=O)c2ccccc2OCc2cscn2)cc1)c1cccc([N+](=O)[O-])c1 750649480 ZOBSNXNGYSODFO-UHFFFAOYSA-N 475.482 5.102 5 20 JKBD CC(C)c1c(C(=O)O[C@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)cnn1-c1cccc(Cl)c1 914640848 DACABHKKNHONNL-CQSZACIVSA-N 481.896 5.525 5 20 JKBD COc1ccccc1[C@@H](NCc1ccc(Sc2ccc(C)cc2)c([N+](=O)[O-])c1)c1nccn1C 915226849 SPPBEBYCXLYCKY-RUZDIDTESA-N 474.586 5.676 5 20 JKBD Cc1ccc(/C(O)=C(/C(=S)Nc2ccc3ccccc3c2)[n+]2ccc3c(c2)CCCC3)cc1[N+](=O)[O-] 917609990 JHQJWHXBHOOKOP-UHFFFAOYSA-O 496.612 6.546 5 20 JKBD O=C(Cc1cc([N+](=O)[O-])ccc1F)Nc1ccc(C2(NC(=O)c3cc4[nH]ccc4s3)CCC2)cc1 1786671095 GDIWHNXUZQPQES-UHFFFAOYSA-N 492.532 5.267 5 20 JKBD CC1(C)CCc2cccc(C(=O)Nc3ccc(C4(NC(=O)c5ccc([N+](=O)[O-])o5)CCC4)cc3)c2O1 1788496286 WXHLFXIVXRNODC-UHFFFAOYSA-N 489.528 5.353 5 20 JKBD Cc1cc(C(=O)Nc2ccc(C3(NC(=O)c4cc5cc([N+](=O)[O-])ccc5s4)CCC3)cc2)c[nH]1 1788817842 GDAFERVLJAQCFX-UHFFFAOYSA-N 474.542 5.508 5 20 JKBD Cc1[nH]ccc1C(=O)NC1(c2ccc(NC(=O)c3cccc([N+](=O)[O-])c3Br)cc2)CCC1 1790636765 QHAPJCSEQHYROM-UHFFFAOYSA-N 497.349 5.055 5 20 JKBD Cc1ccc(CCC(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)CCc2cccc([N+](=O)[O-])c2)c2ccccc12 1793945494 OFBQUFKKFLWLBW-QEIWAGNOSA-N 499.611 5.260 5 20 JKBD CC1(C)CCC(CC(=O)NC[C@H]2CCN(C(=O)c3ccc([N+](=O)[O-])cc3F)[C@@H]2c2cccnc2)CC1 1808903398 NDHUXIAHPBRCQM-CJFMBICVSA-N 496.583 5.055 5 20 JKBD O=C(Nc1cc([C@@H]2CCCCN2C(=O)CCc2ccccc2Cl)[nH]n1)c1cccc(F)c1[N+](=O)[O-] 1821168806 DROJMDGOPBKCPF-FQEVSTJZSA-N 499.930 5.049 5 20 JKBD Cc1cc(CCCC(=O)N2CCCC[C@H]2C2CCN(C(=O)CC(C)C)CC2)c([N+](=O)[O-])cc1F 1824370420 YTYJFYSVVWOPSP-QHCPKHFHSA-N 475.605 5.031 5 20 JKBD O=C(Cc1cc([N+](=O)[O-])ccc1F)N1CCC([C@H]2CCCCN2C(=O)c2ccc(C3CC3)cc2)CC1 1830746798 LRLWHNBBPGIAGF-AREMUKBSSA-N 493.579 5.087 5 20 JKBD CC(C)CC(=O)N1CCC([C@H]2CCCCN2C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)CC1 1831061055 LNRAGTSWFOZZLC-HXUWFJFHSA-N 457.596 5.089 5 20 JKBD O=C(CCc1ccc[nH]1)N1CCC([C@@H]2CCCCN2C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)CC1 1831061408 SDVLMRKZCSCNCS-QFIPXVFZSA-N 494.617 5.004 5 20 JKBD O=C(COC(=O)c1ccccc1Cc1nc2ccccc2s1)Nc1ccc([N+](=O)[O-])cc1Cl 10610167 NBMWLHWETPBDJF-UHFFFAOYSA-N 481.917 5.244 5 20 JKBD C[C@H](Sc1nnc(-c2c[nH]c3ccccc23)o1)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 11347705 KMAGQAMMZPPWLR-JTQLQIEISA-N 477.424 5.264 5 20 JKBD O=C(COC(=O)c1nc(Cl)c(Cl)c(Cl)c1Cl)Nc1cc(Cl)ccc1[N+](=O)[O-] 12682084 JFMRDVMFBABODB-UHFFFAOYSA-N 473.483 5.052 5 20 JKBD C[C@@H](Sc1nnc(COc2ccccc2Cl)n1C1CC1)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 17712409 RPZSFJFZJQVGRA-CYBMUJFWSA-N 498.952 5.657 5 20 JKBD CCOc1cc(C(=O)OCc2csc(N(C(C)=O)c3ccc(C)c(C)c3)n2)c([N+](=O)[O-])cc1OC 19473729 PQCRABBJIJBPTL-UHFFFAOYSA-N 499.545 5.117 5 20 JKBD COc1ccccc1-n1c(S[C@H](C)C(=O)Nc2ccc(F)c([N+](=O)[O-])c2)nnc1-c1cccs1 21681231 XCQZQDGSFAPXDI-CYBMUJFWSA-N 499.549 5.171 5 20 JKBD CSc1ccc(C(=O)O[C@@H](C)C(=O)Nc2ccccc2Cc2ccccc2)cc1[N+](=O)[O-] 22161788 MMTQOBDFWRHAGL-INIZCTEOSA-N 450.516 5.092 5 20 JKBD CCOc1cc([N+](=O)[O-])c(C(=O)Nc2ccc(NC(=O)c3ccco3)cc2C(F)(F)F)cc1OC 22182191 XJEKLXCTMZZRJK-UHFFFAOYSA-N 493.394 5.119 5 20 JKBD Cc1nn(C)c2ncc(NC(=O)c3ccccc3Sc3ccc(C(F)(F)F)cc3[N+](=O)[O-])cc12 24032728 BBSGRIJMSNJREM-UHFFFAOYSA-N 487.463 5.607 5 20 JKBD Cc1c(NC(=O)[C@H](C)SCc2nc(=O)c3c(-c4ccccc4)csc3[nH]2)cccc1[N+](=O)[O-] 30057798 GGBPYZZRRSUBDV-AWEZNQCLSA-N 480.571 5.129 5 20 JKBD CCS(=O)(=O)Nc1ccc(NC(=O)c2ccc(SCCC(C)C)c([N+](=O)[O-])c2)cc1C 59886970 JFHTXDDJOQFEMO-UHFFFAOYSA-N 465.597 5.055 5 20 JKBD Cc1ccc(NC(=O)C2CC2)cc1NC(=O)c1ccc(N[C@H](C)c2ccccn2)c([N+](=O)[O-])c1 108830470 WUJKUIAXICMIGP-MRXNPFEDSA-N 459.506 5.072 5 20 JKBD COc1ccc(OC(F)F)c(NC(=O)Cc2cn(-c3ccccc3)nc2-c2ccc([N+](=O)[O-])cc2)c1 482160980 BLXNAWNAEBZAAM-UHFFFAOYSA-N 494.454 5.239 5 20 JKBD O=C(c1nc(-c2cccs2)n(-c2ccccc2)n1)N(Cc1ccccc1[N+](=O)[O-])CC(F)(F)F 486069122 LKSNBIOWZYTRRA-UHFFFAOYSA-N 487.463 5.109 5 20 JKBD C[C@@H](Nc1ccc(C(=O)Nc2ccc3c(c2)OC2(CCCC2)O3)cc1[N+](=O)[O-])c1ccccn1 505991610 MQGCBUJPIKFDEF-MRXNPFEDSA-N 460.490 5.457 5 20 JKBD COc1ccc(Oc2cc(CNC(=O)c3ccc(N[C@@H](C)c4ccccn4)c([N+](=O)[O-])c3)ccn2)cc1 508961201 CYNLOVSXYLNMII-SFHVURJKSA-N 499.527 5.289 5 20 JKBD COc1ccc(NC(=O)N(Cc2ccc([N+](=O)[O-])cc2)C(C)C)cc1OCc1ccncc1 509207514 BPQISFMYXCSDHJ-UHFFFAOYSA-N 450.495 5.020 5 20 JKBD COc1cccc(Oc2ccc(N[C@H](C)C(=O)Nc3ccc([N+](=O)[O-])cc3C(F)(F)F)cc2)c1 511006859 AGFRGSPLBCTDLB-CQSZACIVSA-N 475.423 5.854 5 20 JKBD COc1cccc(NCc2nnc(SCc3ccc(OC)c([N+](=O)[O-])c3)n2C2CCCCC2)c1 515289273 VKTFHPLBQSOWKG-UHFFFAOYSA-N 483.594 5.613 5 20 JKBD COc1cc(C(=O)N2CCc3cc([N+](=O)[O-])ccc32)ccc1OCc1ccc(Br)s1 603637619 QXQVGMTWJIIUDR-UHFFFAOYSA-N 489.347 5.209 5 20 JKBD COc1ccc([C@H](NC(=O)c2cc(OCC(F)(F)F)ccc2[N+](=O)[O-])c2ccccc2)cc1 603732288 GUAUJIOTIAGISA-OAQYLSRUSA-N 460.408 5.064 5 20 JKBD CN(C(=O)c1nn(-c2cc(C(F)(F)F)ccc2Cl)c2c1CCC2)c1ccc([N+](=O)[O-])cc1 609093402 ADGOGBOWSDDOLY-UHFFFAOYSA-N 464.831 5.218 5 20 JKBD Cc1ccc(-c2nn(-c3ccccc3)cc2CN(C)Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)cc1C 611909337 MKJRNWGEMUGQBO-UHFFFAOYSA-N 494.555 5.746 5 20 JKBD CCOc1cc(NC(=O)Cc2csc(-c3ccc(CC)cc3)n2)c([N+](=O)[O-])cc1OCC 619213134 SGERINYDJUJKBO-UHFFFAOYSA-N 455.536 5.259 5 20 JKBD CN(C(=O)CSc1nc2cc(Cl)ccc2c(=O)n1C1CCCCC1)c1ccc([N+](=O)[O-])cc1 619806186 OGULQPMZDCHXKR-UHFFFAOYSA-N 486.981 5.218 5 20 JKBD CCc1cc[n+](/C(C(=S)N[C@H](C)c2cccs2)=C(/O)c2ccc(C)c([N+](=O)[O-])c2)cc1 726578914 GVOAWEIAMRWDKI-MRXNPFEDSA-O 454.597 5.377 5 20 JKBD C[C@H]1Oc2ccc(C(=O)C3CCN(c4cc(Cl)c(C(F)(F)F)cc4[N+](=O)[O-])CC3)cc2NC1=O 727432330 HYPKNBYVKAHHOM-LLVKDONJSA-N 497.857 5.086 5 20 JKBD O=C(Nc1ccc(OC(=O)c2csc(-c3ccc([N+](=O)[O-])cc3)n2)cc1)c1cccc([N+](=O)[O-])c1 747624823 DDWFULAAIYDNBU-UHFFFAOYSA-N 490.453 5.098 5 20 JKBD O=C(/C=C\c1cc(C(F)(F)F)cc(C(F)(F)F)c1)OCc1nnc(-c2ccc([N+](=O)[O-])cc2)o1 843414397 BZJTZJWZBQSTBF-BHQIHCQQSA-N 487.312 5.439 5 20 JKBD CC(C)N(Cc1nnc(-c2cccc([N+](=O)[O-])c2)o1)C(=O)/C=C\c1cc(C(F)(F)F)ccc1Cl 864244606 FKFPNJAXXGXCLD-TWGQIWQCSA-N 494.857 5.767 5 20 JKBD Cc1cccc(NC(=O)c2ccccc2NC(=O)C2CCN(c3ccccc3[N+](=O)[O-])CC2)c1 905308487 NRNWMGSNAKRPGB-UHFFFAOYSA-N 458.518 5.011 5 20 JKBD Cc1ccc(/C(O)=C(/C(=S)N[C@H]2C[C@H]3CC[C@H]2C3)[n+]2ccc3c(c2)CCCC3)cc1[N+](=O)[O-] 912843510 KWQYPZSXEBKKQG-JLMWRMLUSA-O 464.611 5.059 5 20 JKBD C[C@H](OC(=O)c1cccc(NC(=O)C2CCCCC2)c1)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 915435060 AEGCFAZSRPLAEN-HNNXBMFYSA-N 464.478 5.082 5 20 JKBD O=C(Cc1ccc(NC(=O)c2ccc(Br)cc2)cc1)Nc1cc([N+](=O)[O-])c(F)cc1F 916043339 VWUOPYISIYETQB-UHFFFAOYSA-N 490.260 5.069 5 20 JKBD O=C(CCc1nc2ccccc2o1)O[C@H](C(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1)c1ccccc1 917234222 ZQRSEUAWGLPQEF-QHCPKHFHSA-N 479.876 5.245 5 20 JKBD Cc1nn(Cc2ccc(C(=O)Nc3cccc(COc4ccccc4)c3)cc2)c(C)c1[N+](=O)[O-] 917852824 BJPDVPQLOQLEDW-UHFFFAOYSA-N 456.502 5.288 5 20 JKBD O=C(CSc1ccccc1[N+](=O)[O-])Nc1ccc(C2(NC(=O)c3cccc(F)c3)CCC2)cc1 1791523247 NVKUEKHVDJRBLL-UHFFFAOYSA-N 479.533 5.274 5 20 JKBD C/C(=C\c1cccs1)C(=O)N1CCCC2(CCN(C(=O)/C=C/c3ccccc3[N+](=O)[O-])CC2)C1 1804813213 JMDXXILQFDJOCS-CCWOYPALSA-N 479.602 5.004 5 20 JKBD Cc1c(F)cccc1C(=O)N1CCCC2(CCN(C(=O)C3(c4cccc([N+](=O)[O-])c4)CCC3)CC2)C1 1805113343 ZSVQNOIFQFAHOZ-UHFFFAOYSA-N 493.579 5.009 5 20 JKBD Cc1cccc2[nH]c(C(=O)N3CCC([C@H]4CCCCN4C(=O)c4cc(F)cc([N+](=O)[O-])c4)CC3)cc12 1830617028 LKXDOUBVHBAQKB-RUZDIDTESA-N 492.551 5.071 5 20 JKBD C[C@@H](CC(=O)N1CCCC[C@H]1C1CCN(C(=O)c2ccc([N+](=O)[O-])cc2F)CC1)c1ccccc1 1831507508 QMYYMTMKWJGBOO-DFBJGRDBSA-N 481.568 5.161 5 20 JKBD O=C(Nc1ccccc1C(=O)NCCSCc1ccccc1F)c1ccc([N+](=O)[O-])cc1Cl 15372899 WHOYGXWYBGKGPS-UHFFFAOYSA-N 487.940 5.303 5 20 JKBD Cc1ccc(-c2nnc(-c3ccc(C(=O)OCC(=O)Nc4ccc([N+](=O)[O-])cc4Cl)cc3)o2)cc1 16287802 LFCOITARLFKIIG-UHFFFAOYSA-N 492.875 5.069 5 20 JKBD Cc1ccc(NC(=O)[C@@H](Sc2nnc(-c3cccc(Cl)c3)o2)c2ccccc2)c([N+](=O)[O-])c1 21547866 ROBSTNSCSHQDPR-FQEVSTJZSA-N 480.933 6.079 5 20 JKBD C[C@H](SC1=Nc2ccccc2CS1)C(=O)Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1 22022037 HJGDAFKDKYHZDM-LBPRGKRZSA-N 456.574 5.713 5 20 JKBD O=C(Cn1c2ccccc2c(=O)c2ccccc21)Nc1nc2ccc(OCC(F)(F)F)cc2s1 71891902 YYHLRSSOYQGRHS-UHFFFAOYSA-N 483.471 5.344 5 20 JKBD COc1cccc([C@H](CNC(=O)CSc2ccc([N+](=O)[O-])cc2)c2c[nH]c3ccccc23)c1OC 104722529 KZMRVNPXJXQFNJ-QFIPXVFZSA-N 491.569 5.134 5 20 JKBD CCOc1ccc([C@@H](CNC(=O)c2cc([N+](=O)[O-])c(C)s2)c2c[nH]c3ccccc23)cc1OC 105837843 LOSAOUSUVHUFKS-GOSISDBHSA-N 479.558 5.415 5 20 JKBD C[C@H](Nc1ccc(C(=O)Nc2ccc(Br)cc2F)cc1[N+](=O)[O-])c1ccccn1 108751231 GFAVXNCYADIVMK-LBPRGKRZSA-N 459.275 5.317 5 20 JKBD O=C(Nc1cccc(CN2CCOCC2)c1)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1 109337894 DWSINSANHDLCCQ-UHFFFAOYSA-N 467.909 5.125 5 20 JKBD CCOc1cc(C(=O)Nc2cc(-c3ccccc3)nn2-c2ccccc2C)c([N+](=O)[O-])cc1OC 302929285 FSYZAGAKDGTVQE-UHFFFAOYSA-N 472.501 5.416 5 20 JKBD O=C(Nc1ccc(Cl)cc1Cl)[C@H]1CCCCN1C(=O)c1ccc([N+](=O)[O-])cc1Cl 302936425 JLECYZORBTWDBG-QGZVFWFLSA-N 456.713 5.188 5 20 JKBD CN(Cc1ccccc1[N+](=O)[O-])C(=O)c1cnn(-c2ncc(C(F)(F)F)cc2Cl)c1C(F)F 409505167 VPHQVGBZJIBUPW-UHFFFAOYSA-N 489.788 5.058 5 20 JKBD Cc1cc(NC(=O)c2c3c(nc4ccccc24)/C(=C/c2ccc([N+](=O)[O-])cc2)CCC3)n(C)n1 409793765 UVBZZDOYYWHCKM-OBGWFSINSA-N 453.502 5.314 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)Nc2ccccc2NC(=O)c2ccc(C(C)(C)C)cc2)cc1SC 482784939 CETXFDDDZJKSIX-UHFFFAOYSA-N 493.585 6.127 5 20 JKBD CSc1ccc([N+](=O)[O-])c(C(=O)Nc2ccc(Cl)c(C(=O)NCc3ccccc3F)c2)c1 484285468 ZPVXXRXDMSELDE-UHFFFAOYSA-N 473.913 5.292 5 20 JKBD CN(C[C@@H]1CCCCO1)C(=O)C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1 491922217 TYMSFDAQTLMOCW-GJPUVDBCSA-N 451.548 5.163 5 20 JKBD COc1ccc(CN(Cc2ccccc2)C(=O)c2cc(OC)c(OC(F)F)cc2[N+](=O)[O-])cc1 500604842 RKYQVWYDUJSHQM-UHFFFAOYSA-N 472.444 5.056 5 20 JKBD CC1CCN(c2ccc(C(=O)Nc3ccccc3OCc3cscn3)cc2[N+](=O)[O-])CC1 503505499 LEZDICGAGRNSSG-UHFFFAOYSA-N 452.536 5.119 5 20 JKBD C[C@@H](Nc1ccc(C(=O)N(C)Cc2cc(Cl)cc(Cl)c2)cc1[N+](=O)[O-])c1ccccn1 507392856 QSKGDXZHLXCCFX-CQSZACIVSA-N 459.333 5.742 5 20 JKBD CC[C@@H](c1ccc(F)cc1)N(Cc1cccc(F)c1)C(=O)c1ccc(S(C)(=O)=O)c([N+](=O)[O-])c1 512334630 WCJYTIGRWOMTRY-NRFANRHFSA-N 488.512 5.070 5 20 JKBD Cc1cccc(Cc2sc(NC(=O)Cn3c4ccccc4c(=O)c4ccccc43)nc2C)c1 515635209 OGOWNEUHLWGUSI-UHFFFAOYSA-N 453.567 5.458 5 20 JKBD CSc1ccc(C(=O)c2ccccc2C(=O)Nc2cc(-c3nc(C)no3)ccc2C)cc1[N+](=O)[O-] 515683795 LMISTJJEOHPUKE-UHFFFAOYSA-N 488.525 5.467 5 20 JKBD Cc1ccc(NC(=O)c2ccccc2)cc1NC(=O)[C@H](C)Oc1ccc(Cl)cc1[N+](=O)[O-] 518831725 VUZBNUNABKUYLP-HNNXBMFYSA-N 453.882 5.215 5 20 JKBD O=C(NCCCN(C(=O)C1CCC1)C1CC1)c1cc([N+](=O)[O-])ccc1Sc1ccc(Cl)cc1 520921278 REAOMFZLVNYSLQ-UHFFFAOYSA-N 488.009 5.310 5 20 JKBD COc1cc(Cc2nc(O)c3cc4ccccc4cc3n2)c(Br)cc1OC(F)F 590124275 DCBRUKCFAWCLKH-UHFFFAOYSA-N 461.262 5.452 5 20 JKBD Cn1c(CNC(=O)C/C(=C\c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)nc2ccccc21 590629431 INANSJCZHOMCND-NBVRZTHBSA-N 483.553 5.338 5 20 JKBD COc1cc(C(=O)N2CCC(c3ccc(O)cc3)CC2)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 591533187 UCLGCJAUQSQXSG-UHFFFAOYSA-N 482.920 5.775 5 20 JKBD O=C(Nc1ccc(NC(=O)c2cc3cc([N+](=O)[O-])ccc3o2)c(C(F)(F)F)c1)c1ccc(F)cc1 603743159 VZDFIFKNOCCZMX-UHFFFAOYSA-N 487.365 6.004 5 20 JKBD O=C(c1ccc(C(=O)N2CCC[C@H]2Cc2ccccc2)c([N+](=O)[O-])c1)N1CCC[C@H]1Cc1ccccc1 609043641 GLHLTNPELKWTIK-UIOOFZCWSA-N 497.595 5.289 5 20 JKBD C[C@@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)Oc1ccc(NC(=O)c2ccc(F)cc2)cc1 728243681 PQDBPIYIGDIENM-CYBMUJFWSA-N 458.829 5.013 5 20 JKBD O=C(COC(=O)c1ccccc1OCc1cccs1)Nc1ccc(C(F)(F)F)cc1[N+](=O)[O-] 730616970 AYXTWMVNKMQCNM-UHFFFAOYSA-N 480.420 5.050 5 20 JKBD COc1ccc(NC(=O)[C@@H](C)Sc2nc3cc(C(F)(F)F)ccc3s2)c([N+](=O)[O-])c1 753855590 ZHXMFFJHIIKXJA-SECBINFHSA-N 457.455 5.351 5 20 JKBD O=C(O[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1)c1cc(Cl)c(Cl)[nH]1 828610564 MGKXJCMUZAZPDV-INIZCTEOSA-N 468.680 5.420 5 20 JKBD Cc1cc(C)n(-c2ccc(-c3noc(-c4ccc(N[C@H](C)c5ccccn5)c([N+](=O)[O-])c4)n3)cn2)n1 904522260 PXVNWRAOZWYVFL-QGZVFWFLSA-N 482.504 5.077 5 20 JKBD O=[N+]([O-])c1cc(/C=C(\Cl)c2nc(O)c3c(-c4ccc(Br)cc4)csc3n2)cs1 917144013 VQPQNNKFFWDDFE-ACAGNQJTSA-N 494.779 6.533 5 20 JKBD COc1ccc(N[C@@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2)cc1NC(=O)c1ccc(Cl)cc1F 917937120 CURCBABUGJOMQL-ZDUSSCGKSA-N 486.887 5.087 5 20 JKBD O=C(Cc1cccc([N+](=O)[O-])c1)Nc1ccc(C2(NC(=O)c3ncc(Cl)cc3Cl)CCC2)cc1 1785791501 FJTSHYQFCHRVPG-UHFFFAOYSA-N 499.354 5.287 5 20 JKBD O=C(/C=C/c1ccc([N+](=O)[O-])o1)Nc1ccc(C2(NC(=O)Cc3cccc4ncccc34)CCC2)cc1 1786205940 VQMRNTNKDKXYOG-ACCUITESSA-N 496.523 5.126 5 20 JKBD O=C(NC1(c2ccc(NC(=O)c3cc4ccoc4s3)cc2)CCC1)c1ccc([N+](=O)[O-])o1 1788413421 GONOKIOUKPVWKJ-UHFFFAOYSA-N 451.460 5.057 5 20 JKBD O=C(Cc1ccc(Cl)cc1[N+](=O)[O-])NC1(c2ccc(NC(=O)c3ccc(Cl)cn3)cc2)CCC1 1789731843 DMWNWKOBOHSUNV-UHFFFAOYSA-N 499.354 5.287 5 20 JKBD Cc1c(C(=O)NC2(c3ccc(NC(=O)[C@@H]4C[C@@]4(F)Cl)cc3)CCC2)cc(Cl)cc1[N+](=O)[O-] 1791675851 BUWKKBAIQXRGLV-JTSKRJEESA-N 480.323 5.229 5 20 JKBD C/C(=C\c1cccs1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CCCc1cc(C)c(F)cc1[N+](=O)[O-] 1793402718 KCYXRDUTVAKYSV-ZLSWTBEJSA-N 499.608 5.168 5 20 JKBD Cc1ccc(-c2ccccc2C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2ccc([N+](=O)[O-])cc2F)cc1 1800353369 ZRLPGVGXMILEIR-WKCHPHFGSA-N 487.531 5.275 5 20 JKBD O=C(Cc1cccc([N+](=O)[O-])c1)Nc1cc([C@@H]2CCCCN2C(=O)c2cccc3ccccc23)[nH]n1 1814375146 LXDPYMNXPZTYFC-DEOSSOPVSA-N 483.528 5.020 5 20 JKBD Cc1cc(Cl)ccc1C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cccc(F)c2[N+](=O)[O-])[nH]n1 1814593549 RTDWZZWLAYBXGU-IBGZPJMESA-N 485.903 5.039 5 20 JKBD Cc1ccoc1C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cc3cc([N+](=O)[O-])ccc3s2)n[nH]1 1821609862 NNNCLCPJRLGZPV-KRWDZBQOSA-N 479.518 5.054 5 20 JKBD CC(C)=CCCC(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cc3cc([N+](=O)[O-])ccc3s2)n[nH]1 1821611075 LTJWVMGPVRTVEM-LJQANCHMSA-N 481.578 5.585 5 20 JKBD CCCCC[C@H](C)C(=O)N1CCCC[C@H]1c1cc(NC(=O)CSc2ccccc2[N+](=O)[O-])n[nH]1 1822313046 KAWZMDOYUHAFEZ-HKUYNNGSSA-N 487.626 5.319 5 20 JKBD O=C(c1cccc2ccccc12)N1CCC([C@@H]2CCCCN2C(=O)/C=C/c2ccc([N+](=O)[O-])o2)CC1 1824276389 GUSSFNUELQYSKZ-BVYAJCBJSA-N 487.556 5.288 5 20 JKBD C[C@@H](CC(=O)N1CCC([C@H]2CCCCN2C(=O)/C=C/c2ccc([N+](=O)[O-])o2)CC1)c1ccccc1 1824278473 JDMOMVCNXZVSIX-YHQSXPEXSA-N 479.577 5.015 5 20 JKBD Cc1c(C(=O)N2CCC([C@H]3CCCCN3C(=O)Cc3ccccc3)CC2)cc(Cl)cc1[N+](=O)[O-] 1826465802 PYWLQGSPPLWPQH-HSZRJFAPSA-N 483.996 5.033 5 20 JKBD O=C(/C=C/C1CCCCC1)N1CCC([C@H]2CCCCN2C(=O)CSc2ccccc2[N+](=O)[O-])CC1 1831777122 FGHJCJCDVYZNSU-YAOQVBECSA-N 499.677 5.443 5 20 JKBD CC(=O)N(c1ccc(C)c(C)c1)c1nc(COC(=O)CSc2ccc([N+](=O)[O-])cc2)cs1 9352058 ITGBXWYLGMIKJD-UHFFFAOYSA-N 471.560 5.188 5 20 JKBD C[C@H](Sc1ncc(-c2ccc(F)cc2)o1)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 10715098 BXEQQQLTYNMWCQ-JTQLQIEISA-N 455.389 5.527 5 20 JKBD CC(C)C(=O)Nc1ccc(NC(=O)c2ccc(NCc3ccccc3Cl)c([N+](=O)[O-])c2)cc1 11713059 NNRCVDQJOVHNAV-UHFFFAOYSA-N 466.925 5.707 5 20 JKBD C[C@H](Sc1nc2ccc([N+](=O)[O-])cc2s1)C(=O)N(C)Cc1ccc(Br)cc1 23214209 HGOSSAWATCNWHT-NSHDSACASA-N 466.382 5.106 5 20 JKBD CCCN(CC(=O)Nc1cc(Cl)ccc1Cl)C(=O)c1cc(SC)ccc1[N+](=O)[O-] 24468930 HACSCYGURKEFCV-UHFFFAOYSA-N 456.351 5.114 5 20 JKBD O=C(COC(=O)/C(=C/c1ccc(F)cc1)c1cccs1)Nc1ccc(Cl)cc1[N+](=O)[O-] 28302668 NRTRHHYVTGVJIW-MHWRWJLKSA-N 460.870 5.171 5 20 JKBD Cc1ccc(Sc2ccc(NC(=O)c3cc([N+](=O)[O-])cc(S(C)(=O)=O)c3)cc2)c(C)c1 109024498 BDWMKSSRAYSRON-UHFFFAOYSA-N 456.545 5.019 5 20 JKBD COc1ccc([C@@H]2CCCCCN2C(=O)c2ccc(N[C@@H](C)c3ccccn3)c([N+](=O)[O-])c2)cc1 303037765 VMUQXJCECNATDR-DFBJGRDBSA-N 474.561 5.929 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)Nc2cccc(NC(=O)Nc3ccccc3)c2)cc1SC 482056195 YYMHTEDYERVHFA-UHFFFAOYSA-N 452.492 5.222 5 20 JKBD CC(=O)Nc1ccc(F)c(NC(=O)c2ccccc2Sc2ccc(C(F)(F)F)cc2[N+](=O)[O-])c1 484366795 BNIRLRWDXSYNRQ-UHFFFAOYSA-N 493.438 6.115 5 20 JKBD Cc1ccc2nc([C@H]3CCCN(C(=O)CCNc4ccc(C(F)(F)F)cc4[N+](=O)[O-])C3)[nH]c2c1 502964672 IUVDGOULDXTURQ-HNNXBMFYSA-N 475.471 5.007 5 20 JKBD COc1ccc(CSCC(=O)N[C@@H]2CCOc3c(-c4ccccc4)cccc32)cc1[N+](=O)[O-] 505162261 LVGFNINOYCQIHM-OAQYLSRUSA-N 464.543 5.144 5 20 JKBD Cc1nnc(Sc2ccc(NC(=O)c3csc(-c4cccc([N+](=O)[O-])c4)n3)c(C)c2)s1 505856511 WJHWFTPOAHOLGP-UHFFFAOYSA-N 469.573 5.590 5 20 JKBD Cc1nnc(Sc2ccc(NC(=O)c3ccc(N4CCC[C@H](C)C4)c([N+](=O)[O-])c3)c(C)c2)s1 505870750 BKBPBWAQEUZHNB-AWEZNQCLSA-N 483.619 5.703 5 20 JKBD O=C(c1ccc(Sc2nc3ccccc3s2)c([N+](=O)[O-])c1)N(CC(F)(F)F)c1ccccn1 508599103 PIWRDTZFLBRVLU-UHFFFAOYSA-N 490.488 5.960 5 20 JKBD Cc1c(NC(=O)Cc2ccc(NC(=O)c3ccc(Br)cc3)cc2)cccc1[N+](=O)[O-] 514568793 IDEUQUUBKVLHNB-UHFFFAOYSA-N 468.307 5.099 5 20 JKBD C[C@H](c1ccccc1)n1c(SCC(=O)Nc2ccc(Cl)cc2[N+](=O)[O-])nnc1-c1ccccc1 515571495 UZBHZMMCSRCNJT-MRXNPFEDSA-N 493.976 5.847 5 20 JKBD O=C(Nc1ccc(Cl)cc1)Nc1ccc(NC(=O)c2n[nH]c3ccc([N+](=O)[O-])cc23)cc1 518677660 GXXBUBUOCKOKOG-UHFFFAOYSA-N 450.842 5.021 5 20 JKBD CCC(=O)Nc1cccc(CNCc2cn(-c3ccccc3)nc2-c2ccc([N+](=O)[O-])cc2)c1 518762213 GZYSTOVQTDDXRZ-UHFFFAOYSA-N 455.518 5.086 5 20 JKBD CC(=O)NC[C@H]1CCCN(C(=O)c2c3c(nc4ccccc24)/C(=C\c2ccc([N+](=O)[O-])cc2)CCC3)C1 519206627 LLPSMTOPMSYXMQ-NCJDQSJGSA-N 498.583 5.008 5 20 JKBD CCCn1c(C)cc(-c2csc(NC(=O)c3cc([N+](=O)[O-])ccc3Sc3nc[nH]n3)n2)c1C 590628296 YALBUCCZOAUCPC-UHFFFAOYSA-N 483.579 5.068 5 20 JKBD CN(C(=O)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1)[C@@H]1CCCc2ccccc21 603820539 NWAFCSXTFIASJW-HXUWFJFHSA-N 461.484 5.366 5 20 JKBD CN1CCC2(CC1)C[C@@H](NC(=O)c1cc([N+](=O)[O-])ccc1Sc1ccccc1)c1ccccc1O2 603821190 HLBPLAPPTGNCEO-HSZRJFAPSA-N 489.597 5.464 5 20 JKBD CC(C)OC(=O)C[C@@H](NC(=O)Nc1ccc(Cl)c2ncccc12)c1ccccc1[N+](=O)[O-] 604125570 ZLQRRGNECFDASF-GOSISDBHSA-N 456.886 5.001 5 20 JKBD COc1ccc([C@@H](NC(=O)c2ccc(N[C@@H](C)c3ccccn3)c([N+](=O)[O-])c2)c2ccccc2)cc1 604296267 MTLPAQPHLAFMJM-PPHZAIPVSA-N 482.540 5.691 5 20 JKBD CC1(C)CN(C(=O)C2CCN(c3ccc(C(F)(F)F)cc3[N+](=O)[O-])CC2)[C@H]1c1ccccc1 604332397 PJFHFFCMIUCSQB-NRFANRHFSA-N 461.484 5.440 5 20 JKBD COc1ccc(CNCc2coc(-c3cccs3)n2)cc1OCc1ccc([N+](=O)[O-])cc1 604441993 SHQZQNPOCALAJN-UHFFFAOYSA-N 451.504 5.189 5 20 JKBD O=C(Nc1cc(F)ccc1Oc1ccccc1)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-] 609022599 IZSZXILIRWVWCA-UHFFFAOYSA-N 450.344 5.720 5 20 JKBD C[C@H]1CCCN(c2ccc(C(=O)Nc3cc(Cl)ccc3C(=O)N3CCCCC3)cc2[N+](=O)[O-])C1 609057015 IILVWDYFPORKSI-KRWDZBQOSA-N 484.984 5.363 5 20 JKBD Cc1nc(-c2ccc(C(F)(F)F)cc2)sc1C(=O)Nc1ccnn1-c1ccc([N+](=O)[O-])cc1 609151303 DKUNKLRXCOXBLJ-UHFFFAOYSA-N 473.436 5.484 5 20 JKBD C[C@H](NCc1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1)c1ccc(N2CCCC2=O)cc1 726607499 XXCLQJGHOPRVPT-FQEVSTJZSA-N 481.556 5.425 5 20 JKBD COC(=O)Nc1cc(NC(=O)c2ccccc2C(=O)c2ccc(SC)c([N+](=O)[O-])c2)ccc1F 727335540 XRVBFRPJWLNUQO-UHFFFAOYSA-N 483.477 5.117 5 20 JKBD CC(C)(C)[C@H](Cn1ccnc1)NC(=O)C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1 729340411 GACAKDFGNKMWSI-YHSGTQGLSA-N 489.601 5.563 5 20 JKBD CSc1ccc([N+](=O)[O-])c(C(=O)Nc2ccc(NC(=O)OC(C)(C)C)cc2C(F)(F)F)c1 729656082 YSNPZHUPSJIYEW-UHFFFAOYSA-N 471.457 5.935 5 20 JKBD CCOc1ccccc1NC(=O)[C@H](OC(=O)c1ccc(N2CCCC2)c([N+](=O)[O-])c1)c1ccccc1 798273088 QHXZAAFVYWJQKU-RUZDIDTESA-N 489.528 5.131 5 20 JKBD C[C@@H](OC(=O)CSc1ccccc1[N+](=O)[O-])C(=O)Nc1c(Cl)cc(Cl)cc1Cl 819016186 HROGADLKLWOEIR-SECBINFHSA-N 463.726 5.218 5 20 JKBD C[C@@H](OC(=O)[C@@H](C)Oc1cccc(Cl)c1Cl)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 915496470 GDSGLMILMHYGHP-NXEZZACHSA-N 495.237 5.258 5 20 JKBD C[C@@H](OC(=O)c1cc2cc([N+](=O)[O-])ccc2o1)C(=O)Nc1ccc(Cl)cc1C(F)(F)F 917262774 COYVHTJQZYSPEN-SECBINFHSA-N 456.760 5.197 5 20 JKBD Cc1cccc(NC(=O)[C@H](OC(=O)c2ccc(N[C@@H](C)c3ccccn3)c([N+](=O)[O-])c2)C(C)C)c1C 920543617 FEAIEMDWBNRNPL-UQBPGWFLSA-N 490.560 5.600 5 20 JKBD C[C@H](Nc1ccc(C(=O)O[C@@H](C)c2nc(-c3cccs3)no2)cc1[N+](=O)[O-])c1ccccn1 920544722 DZWNYYBRRJRYIM-KBPBESRZSA-N 465.491 5.192 5 20 JKBD COc1cc(C(=O)NC2(c3ccc(NC(=O)[C@H]4CC=C(C)CC4)cc3)CCC2)cc([N+](=O)[O-])c1OC 1789115475 UATDNMQZQZSCOI-SFHVURJKSA-N 493.560 5.106 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)c3ccnc4ccccc34)CCC2)cc1)c1cccc(F)c1[N+](=O)[O-] 1790698945 OMQGRJPPXNOGKX-UHFFFAOYSA-N 484.487 5.344 5 20 JKBD CCO/C=C/C(=O)Nc1ccc(C2(NC(=O)c3cc4cc([N+](=O)[O-])ccc4s3)CCC2)cc1 1791741136 IIIBVTQYBSKWLV-JLHYYAGUSA-N 465.531 5.107 5 20 JKBD Cc1ccc(C(=O)Nc2ccc(C3(NC(=O)Cn4ccc5ccc([N+](=O)[O-])cc54)CCC3)cc2)c(O)c1 1792091026 BGRRBLQACZLSGF-UHFFFAOYSA-N 498.539 5.011 5 20 JKBD Cc1cc(Cl)ccc1C(=O)N1CCCC2(CCN(C(=O)/C=C/c3ccccc3[N+](=O)[O-])CC2)C1 1805088669 VZCLVGLJIRMCAN-JXMROGBWSA-N 481.980 5.115 5 20 JKBD CCC[C@H]1CC[C@H](C(=O)NC[C@H]2CCN(C(=O)c3cccc(F)c3[N+](=O)[O-])[C@H]2c2cccnc2)CC1 1812789713 MTTFXTWLGBTDGY-ZRXZBVFWSA-N 496.583 5.055 5 20 JKBD O=C(CC1CCC1)Nc1cc([C@@H]2CCCCN2C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)[nH]n1 1823432222 GDDSCDSANIOBSK-SFHVURJKSA-N 467.551 5.029 5 20 JKBD CCCCC[C@H](C)C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cc(N(C)C)ccc2[N+](=O)[O-])CC1 1829648245 GVWZOIVLQSJUTB-GBXCKJPGSA-N 486.657 5.111 5 20 JKBD Cc1ccc(CC(=O)N2CCCC[C@H]2C2CCN(C(=O)CCC3CCCC3)CC2)cc1[N+](=O)[O-] 1830363305 VMBDKYDWRPPOAX-DEOSSOPVSA-N 469.626 5.036 5 20 JKBD CCCCC[C@@H](C)C(=O)N1CCCC[C@H]1C1CCN(C(=O)Cc2cc([N+](=O)[O-])ccc2F)CC1 1831462269 IDMXLFZVYQLPBT-DVECYGJZSA-N 475.605 5.113 5 20 JKBD CCCCC[C@H](C)C(=O)N1CCCC[C@H]1C1CCN(C(=O)Cc2ccc([N+](=O)[O-])cc2F)CC1 1831467722 YIMMRINHZDMNPR-CYFREDJKSA-N 475.605 5.113 5 20 JKBD CCC[C@H]1CC[C@H](C(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3ccc([N+](=O)[O-])o3)CC2)CC1 1831559600 IPPXBROSWRTMHM-HMXCVIKNSA-N 459.587 5.028 5 20 JKBD COc1cc(C(=O)N(C)Cc2nc3ccccc3s2)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 10285893 CESAGDZOZCDZBJ-UHFFFAOYSA-N 483.933 5.931 5 20 JKBD COc1cc(CSc2nncn2-c2ccc(C)c(Cl)c2)c([N+](=O)[O-])cc1OC(F)F 10534823 LPILJRIWYPEERO-UHFFFAOYSA-N 456.858 5.040 5 20 JKBD COCCCn1c(Sc2ccc(C(F)(F)F)cc2[N+](=O)[O-])nnc1-c1ccccc1Cl 15131311 PVVURICDGFMIBL-UHFFFAOYSA-N 472.876 5.713 5 20 JKBD COc1cc(C(=O)Nc2cccc(C(=O)NC3CC3)c2)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 16173115 UXZMLOHMRLOHKE-UHFFFAOYSA-N 481.892 5.194 5 20 JKBD COc1cccc(Nc2nnc(S[C@H](C)c3nnc(-c4ccc([N+](=O)[O-])cc4)o3)s2)c1 17741447 FVEBMUPZFYUNPP-LLVKDONJSA-N 456.509 5.102 5 20 JKBD C[C@@H](Sc1nccn1-c1cccc(Cl)c1)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 21422371 NELAVFNNTIKPMX-LLVKDONJSA-N 470.860 5.572 5 20 JKBD Cc1c(NC(=O)[C@H](C)Sc2nnc(COc3ccccc3Cl)n2C2CC2)cccc1[N+](=O)[O-] 22077902 VEGFAMXLANYSMB-AWEZNQCLSA-N 487.969 5.181 5 20 JKBD C[C@@H](Sc1nnc(-c2cccnc2)n1Cc1ccccc1)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl 36788105 PAGQYPDAYKMPFB-OAHLLOKOSA-N 494.964 5.069 5 20 JKBD C[C@H](Nc1ccc(C(=O)NCc2ccccc2CN2CCCC[C@@H]2C)cc1[N+](=O)[O-])c1ccccn1 108834270 KXSDHFHINYTUPS-SFTDATJTSA-N 487.604 5.467 5 20 JKBD C[C@H](NC(=O)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-])c1nc(-c2ccccc2)cs1 410289182 SZDULKFABMBAMO-LBPRGKRZSA-N 451.426 5.150 5 20 JKBD COc1cc(C(=O)Nc2ccc3nc(C)oc3c2)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 483371701 CGUDMLGXHDEHEC-UHFFFAOYSA-N 453.838 5.751 5 20 JKBD CN(C[C@@H]1OCCc2ccccc21)[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1 507258583 CQXNCBLLEPPJPL-ZEQRLZLVSA-N 465.937 5.174 5 20 JKBD Cc1ccc(NC(=O)c2ccc(N[C@@H](C)c3ccccn3)c([N+](=O)[O-])c2)c(OCc2ccccc2)c1 509250149 WFFHSPBRMOAWHI-FQEVSTJZSA-N 482.540 6.303 5 20 JKBD Cc1cc(Sc2ccccc2)ccc1NC(=O)CCCn1c(=O)oc2cc([N+](=O)[O-])ccc21 510271098 OQARNSZTWGKPNZ-UHFFFAOYSA-N 463.515 5.381 5 20 JKBD COc1c(Cl)cc(NC(=O)N[C@@H](CC(=O)OC(C)C)c2ccccc2[N+](=O)[O-])cc1Cl 513878519 PMFAAPONEQATEW-INIZCTEOSA-N 470.309 5.115 5 20 JKBD C[C@H](NCc1ccc(-c2ccccc2[N+](=O)[O-])s1)c1cccc(NC(=O)c2ccccc2)c1 517535575 IWPBIRZRMBZGBJ-SFHVURJKSA-N 457.555 6.426 5 20 JKBD COc1cc(CCNC(=O)Nc2ccc(Sc3nc(C)cs3)cc2C)c([N+](=O)[O-])cc1OC 518223471 KORIZGBFCRTVLW-UHFFFAOYSA-N 488.591 5.201 5 20 JKBD CC[C@@H](C)NC(=O)c1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2NCc2ccccc2)c(C)c1 520592510 VNPYHOOODOMLAK-GOSISDBHSA-N 460.534 5.296 5 20 JKBD Cc1nc([N+](=O)[O-])cn1CCC(=O)Nc1nc(C2CC2)c(Cc2cccc(C(F)(F)F)c2)s1 522374573 DPXKALRUANPRJA-UHFFFAOYSA-N 479.484 5.072 5 20 JKBD Cn1ccnc1-c1cccc(NC(=O)C/C(=C/c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)c1 524328705 YNMXDZCLIDMCGK-HKWRFOASSA-N 495.564 6.174 5 20 JKBD Cc1ccc(NC(=O)[C@@H](Sc2n[nH]c(/C=C\c3ccccc3)n2)c2ccccc2)c([N+](=O)[O-])c1 598953731 WBCLNXIZRVFJMM-RBPYYZBISA-N 471.542 5.664 5 20 JKBD Cc1ccc(C)c(Oc2ccc(CNC(=O)c3cc(OCC(F)(F)F)ccc3[N+](=O)[O-])cn2)c1 603899587 HIUPINUTBLQQOG-UHFFFAOYSA-N 475.423 5.270 5 20 JKBD O=C(Nc1ccc(-c2noc(C(F)(F)F)n2)cc1)c1cc([N+](=O)[O-])ccc1Sc1ccccc1 608876017 ZYNVCKZMMLOUPS-UHFFFAOYSA-N 486.431 6.067 5 20 JKBD Cc1ccc(C)c(NC(=O)[C@@H](C)OC(=O)C2CCN(c3ccc(C(F)(F)F)cc3[N+](=O)[O-])CC2)c1 729628164 SSPWFVZEDSAXMD-MRXNPFEDSA-N 493.482 5.017 5 20 JKBD Cc1ccc(-c2noc([C@H](C)OC(=O)c3csc(-c4ccc([N+](=O)[O-])cc4)n3)n2)cc1F 747957745 SOAHLVKQBMHNMY-LBPRGKRZSA-N 454.439 5.134 5 20 JKBD C[C@@H](Sc1nc2ccc([N+](=O)[O-])cc2s1)c1nc(O)c2c(-c3cccs3)csc2n1 788010330 VJCNQQDKFVUCKQ-SECBINFHSA-N 472.598 6.497 5 20 JKBD C[C@@H](OC(=O)CCSc1ccc(Cl)cc1)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 788986777 PUYZEGRNZVFYJV-LLVKDONJSA-N 476.860 5.320 5 20 JKBD COc1ccc(/C=C2\N=C(SCCc3ccc([N+](=O)[O-])cc3)N(c3cccc(OC)c3)C2=O)cc1 915791776 XRLCEJHVQAFXND-JLPGSUDCSA-N 489.553 5.332 5 20 JKBD Cc1ccc(NC(=O)c2sc3[nH]c(/C(Cl)=C\c4cccc([N+](=O)[O-])c4)nc(=O)c3c2C)c(C)c1 916127789 HODABRVXJCGXIS-GZTJUZNOSA-N 494.960 5.807 5 20 JKBD CCO[C@H](C(=O)Oc1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2Cl)cc1)c1ccccc1 920216116 JRQGEPFVVDGEDY-NRFANRHFSA-N 454.866 5.184 5 20 JKBD O=C(Cc1cccc([N+](=O)[O-])c1)Nc1ccc(C2(NC(=O)[C@]3(F)CCCC=C3F)CCC2)cc1 1785794773 DPTDPCPGQNGWKE-VWLOTQADSA-N 469.488 5.017 5 20 JKBD O=C(/C=C/c1ccccc1[N+](=O)[O-])NC1(c2ccc(NC(=O)c3ccncc3Cl)cc2)CCC1 1789732149 MJAPUUFBQJGFSL-IZZDOVSWSA-N 476.920 5.104 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)C34CC(C(F)(F)F)(C3)C4)CCC2)cc1)c1cccc(F)c1[N+](=O)[O-] 1790699894 RZDDCXASENLSJR-UHFFFAOYSA-N 491.441 5.214 5 20 JKBD O=C(CSc1ccccc1[N+](=O)[O-])Nc1ccc(C2(NC(=O)CCCC(F)(F)F)CCC2)cc1 1791521557 WCKZPNVWTZVQCY-UHFFFAOYSA-N 495.523 5.554 5 20 JKBD Cc1oc(C(C)(C)C)cc1C(=O)N1CCCC2(CCN(C(=O)c3ccc([N+](=O)[O-])cc3F)CC2)C1 1808383638 UJHQZRNEWGJTAR-UHFFFAOYSA-N 485.556 5.091 5 20 JKBD C[C@@H](CC(=O)N1CCCC[C@H]1c1cc(NC(=O)/C=C/c2ccccc2[N+](=O)[O-])n[nH]1)c1ccccc1 1823503405 LDUKJVZVSBKIDC-MTAXOXARSA-N 487.560 5.217 5 20 JKBD O=C(c1cc(Cl)c(F)c(Cl)c1)N1CCC([C@@H]2CCCCN2C(=O)c2ccc([N+](=O)[O-])o2)CC1 1823615166 NCHAYWFCGKPUBZ-KRWDZBQOSA-N 498.338 5.181 5 20 JKBD O=C([C@@H]1CCC[C@@H]2CCCC[C@@H]21)N1CCC([C@@H]2CCCCN2C(=O)Cc2cccc([N+](=O)[O-])c2)CC1 1823679560 OSZXQUNBTHBQDV-IXDWGBGWSA-N 495.664 5.364 5 20 JKBD Cc1c(C(=O)N2CCCC[C@H]2C2CCN(C(=O)c3ccc([N+](=O)[O-])o3)CC2)[nH]c2c(Cl)cccc12 1827517754 MXBRHUCMERMBMR-IBGZPJMESA-N 498.967 5.178 5 20 JKBD Cc1ccc(C(=O)N2CCCC[C@H]2C2CCN(C(=O)CSc3ccccc3[N+](=O)[O-])CC2)c(F)c1 1830470190 WUODGFMDGCKCHR-QFIPXVFZSA-N 499.608 5.068 5 20 JKBD Cc1cccc2[nH]c(C(=O)N3CCC([C@@H]4CCCCN4C(=O)c4cc(F)cc([N+](=O)[O-])c4)CC3)cc12 1830617029 LKXDOUBVHBAQKB-VWLOTQADSA-N 492.551 5.071 5 20 JKBD CC(C)(C)CCCCCC(=O)N1CCCC[C@H]1C1CCN(C(=O)c2ccc([N+](=O)[O-])o2)CC1 1831574772 ZOQWJSYSSDOAIG-FQEVSTJZSA-N 461.603 5.418 5 20 JKBD O=C(c1ccc([N+](=O)[O-])cc1F)N1CCC([C@H]2CCCCN2C(=O)c2cc(F)cc(Cl)c2)CC1 1832628714 DVKWCVNEBQVPPM-JOCHJYFZSA-N 491.922 5.074 5 20 JKBD O=C(Nc1cc2c(cc1Cl)OCCCO2)c1cc([N+](=O)[O-])ccc1Sc1ccccc1 11004363 OVKQUHKUKYNSBH-UHFFFAOYSA-N 456.907 5.813 5 20 JKBD O=C(NCc1ccc(C(=O)N2CCCCC2)cc1)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1 16142741 QKLKBCNQKOQLEH-UHFFFAOYSA-N 493.947 5.597 5 20 JKBD CC[C@H](NC(=O)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1)c1ccc(OC)cc1 18131683 ROWIJPDVQPDNFY-IBGZPJMESA-N 465.472 5.106 5 20 JKBD CCCc1ccc([C@@H](NC(=O)c2ccc(Sc3nncn3C)c([N+](=O)[O-])c2)c2cccs2)cc1 18136437 CWEOZOOQFKYUPE-JOCHJYFZSA-N 493.614 5.408 5 20 JKBD Cc1ccc([N+](=O)[O-])cc1NC(=O)c1ccc(OCC(=O)Nc2cccc(C(F)(F)F)c2)cc1 19160849 IWAYBOTUIMTMKW-UHFFFAOYSA-N 473.407 5.192 5 20 JKBD COCc1c(C(=O)O[C@@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2ccccc2)oc2ccccc12 21122608 JIAKHXXQHZUHCM-JOCHJYFZSA-N 494.887 5.678 5 20 JKBD C[C@H]1CCCN(c2ccc(C(=O)Nc3ccc(Cl)cc3NC(=O)c3ccco3)cc2[N+](=O)[O-])C1 117329616 YMMFWIJYSGDVRU-HNNXBMFYSA-N 482.924 5.582 5 20 JKBD O=C(NC1CCN(Cc2ccncc2)CC1)c1cc([N+](=O)[O-])ccc1Sc1ccc(Cl)cc1 488055339 XJRFXHOIHNTOGG-UHFFFAOYSA-N 482.993 5.189 5 20 JKBD O=C(Nc1cccc(N[C@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2ccccc2)c1)C1CC1 493552813 LRJGUUKUSKDXPE-QFIPXVFZSA-N 464.909 5.389 5 20 JKBD C[C@@H]1C[C@@H](C)CN(c2ccc(C(=O)Nc3cccc(NC(=O)c4ccoc4)c3)cc2[N+](=O)[O-])C1 499607175 XQECWOFWRIGRLH-IAGOWNOFSA-N 462.506 5.175 5 20 JKBD O=C(Nc1nc2c(ccc3ccccc32)s1)c1ccc([N+](=O)[O-])cc1I 508914652 DOKYXMOZIBFRRE-UHFFFAOYSA-N 475.267 5.215 5 20 JKBD COc1cc(C(=O)Nc2ccc(Oc3ccc(F)cc3)nc2)c([N+](=O)[O-])cc1OCc1cscn1 509956136 IQPOMTDTMZIPNF-UHFFFAOYSA-N 496.476 5.218 5 20 JKBD COc1ccc(Cl)cc1-c1cc(NC(=O)c2ccc(N[C@@H](C)c3ccccn3)c([N+](=O)[O-])c2)n[nH]1 512847632 XXPKBVJUNAFNQZ-AWEZNQCLSA-N 492.923 5.467 5 20 JKBD CN(Cc1ccccc1[N+](=O)[O-])C(=O)[C@@H](Oc1ccccc1Br)c1ccccc1 514568556 BRBFXVJTMFCQQV-NRFANRHFSA-N 455.308 5.136 5 20 JKBD C[C@@H](c1ccccc1)n1c(S[C@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2)nnc1-c1ccccc1 515488827 YBXWLMNGFJZVAM-ZWKOTPCHSA-N 473.558 5.582 5 20 JKBD C[C@@H](NC(=O)C(=O)Nc1cc(Cl)ccc1Sc1ccc(F)cc1)c1cccc([N+](=O)[O-])c1 517185244 YOMYCPZTNUVTPE-CYBMUJFWSA-N 473.913 5.354 5 20 JKBD O=C(C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)N1CC[C@@H](N2CCCCC2)C1 518086818 DYIRKJTWNUGMMP-QMZMWQIVSA-N 476.602 5.222 5 20 JKBD COc1ccc([N+](=O)[O-])cc1C(=O)Nc1cc(C(=O)Nc2cccc(C(F)(F)F)c2)ccc1C 519952825 SNASSHSJMGBMQJ-UHFFFAOYSA-N 473.407 5.435 5 20 JKBD C[C@H](c1ccncc1)N(C)C(=O)C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1 520103660 CHBSSTIQNUEMNM-MNTXUITRSA-N 458.543 5.750 5 20 JKBD CC(C)c1ccc(OC2CCN(C(=O)c3csc(-c4ccc([N+](=O)[O-])cc4)n3)CC2)cc1 523649224 RTBFHOBJIOVPJV-UHFFFAOYSA-N 451.548 5.525 5 20 JKBD COCCN(C(=O)[C@H]1C[C@H]1c1ccccc1Cl)c1nc(-c2ccc([N+](=O)[O-])cc2)cs1 552999545 LLUONMRXEFMGRQ-ROUUACIJSA-N 457.939 5.155 5 20 JKBD O=C(c1cc([N+](=O)[O-])ccc1NCc1ccccc1)N1C[C@H]2CC[C@H]1[C@@H]1CN(Cc3ccccc3)C[C@H]21 594657583 HBHALSFEFPWVFU-WXVZLDJUSA-N 496.611 5.190 5 20 JKBD C[C@@H](C1CC1)n1nccc1NC(=O)C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1 602140957 RNRCEZARLPZLGB-TWQQJCIXSA-N 473.558 5.941 5 20 JKBD O=C(CC1CCN(C(=O)c2cc([N+](=O)[O-])ccc2Sc2ccc(Cl)cc2)CC1)N1CCCC1 603767254 GNCJJHIZQWTEBH-UHFFFAOYSA-N 488.009 5.264 5 20 JKBD C[C@H](NC(=O)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-])c1cccc(OCc2ccccn2)c1 603982667 OWPAQNABRJGCBY-HNNXBMFYSA-N 475.423 5.001 5 20 JKBD Cc1ccc(C(=O)Nc2cccc(C(F)(F)F)c2)cc1NC(=O)CCOc1ccccc1[N+](=O)[O-] 604449405 PJNAMVOQNWKJGD-UHFFFAOYSA-N 487.434 5.582 5 20 JKBD C[C@H](N[C@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F)c1cc(F)c(Cl)cc1Cl 610246673 UMFRPCUKCYAMNU-DTWKUNHWSA-N 468.234 5.737 5 20 JKBD O=C(CSc1nnc(-c2ccc(Cl)cc2Cl)n1Cc1ccco1)c1cccc([N+](=O)[O-])c1 612379536 URTQYIWMQLPELD-UHFFFAOYSA-N 489.340 5.776 5 20 JKBD Cc1cc(C(=O)O[C@H](C)C(=O)Nc2cc([N+](=O)[O-])ccc2Cl)c2cc(Br)ccc2n1 725977088 UKCLJHYYQSNOAB-LLVKDONJSA-N 492.713 5.051 5 20 JKBD COCc1c(C(=O)N2CCN(c3ccc([N+](=O)[O-])cc3C(F)(F)F)CC2)sc2cccc(F)c12 727329644 MVIUXBOLXFSHFQ-UHFFFAOYSA-N 497.470 5.076 5 20 JKBD CCN(c1ccccc1)S(=O)(=O)c1ccc(Cl)c(C(=O)N2c3ccc([N+](=O)[O-])cc3C[C@H]2C)c1 728812003 UIIPHFQOYRCSKA-MRXNPFEDSA-N 499.976 5.055 5 20 JKBD C[C@H](OC(=O)CCC(=O)c1ccc2c(c1)-c1ccccc1C2)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 746633170 FXBZGZLZMAYMBM-INIZCTEOSA-N 483.480 5.483 5 20 JKBD Cc1c(C(=O)N(C)CCCCCc2cc(-c3cccc(F)c3)n[nH]2)cc([N+](=O)[O-])c(C)c1[N+](=O)[O-] 748713864 GKGNUXFTBOOLHH-UHFFFAOYSA-N 483.500 5.134 5 20 JKBD CCCOc1ccc(-c2nc(C(=O)O[C@H](C)C(=O)Nc3cc([N+](=O)[O-])ccc3Cl)cs2)cc1 750274852 IOPXZCCQEOIOEG-CYBMUJFWSA-N 489.937 5.345 5 20 JKBD CC(C)(C)OC(=O)N1CCC[C@H]1[C@@H]1CCCCN1C(=O)c1csc(-c2cccc([N+](=O)[O-])c2)n1 751413885 UVYHYLDVUBMICD-PMACEKPBSA-N 486.594 5.113 5 20 JKBD C[C@H](OC(=O)c1occc1CSc1ccccc1)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl 792737900 ZUHZUEDTKSGVCO-ZDUSSCGKSA-N 460.895 5.318 5 20 JKBD O=C(Nc1cc(Cl)c([N+](=O)[O-])cc1OCc1ccccc1)c1cnn(-c2ccc([N+](=O)[O-])cc2)c1 918553381 ALMOBNSXUHPOOB-UHFFFAOYSA-N 493.863 5.173 5 20 JKBD C[C@H](Nc1ccc(C(=O)O[C@H](C)C(=O)c2ccc3c(c2)CCC3)cc1[N+](=O)[O-])c1ccccn1 920546101 ULNBOKCGUDLILP-DLBZAZTESA-N 459.502 5.080 5 20 JKBD COC(=O)c1ccc2c(O)nc(/C=C\c3ccc(-c4ccc(Cl)cc4[N+](=O)[O-])o3)nc2c1 1321414298 YORPKTWULZFRLL-UITAMQMPSA-N 451.822 5.114 5 20 JKBD O=C(NC1(c2ccc(NC(=O)[C@H]3C[C@H]3C3CC3)cc2)CCC1)c1cccc([N+](=O)[O-])c1Br 1786055938 IXZKUWOUQMTODD-OALUTQOASA-N 498.377 5.151 5 20 JKBD Cc1cc(CCCC(=O)Nc2ccc(C3(NC(=O)c4oncc4C)CCC3)cc2)c([N+](=O)[O-])cc1F 1786274636 JBEBCVACDRNSNL-UHFFFAOYSA-N 494.523 5.109 5 20 JKBD O=C(Cc1cc([N+](=O)[O-])ccc1F)Nc1ccc(C2(NC(=O)c3ccc4occc4c3)CCC2)cc1 1786671226 VEUDDZIZLBDGHB-UHFFFAOYSA-N 487.487 5.471 5 20 JKBD Cc1ccc(CCC(=O)Nc2ccc(C3(NC(=O)/C=C/c4ccccc4[N+](=O)[O-])CCC3)cc2)nc1 1786870307 ZIIPWEGLWLVPBO-OVCLIPMQSA-N 484.556 5.078 5 20 JKBD CNc1ccc(C(=O)Nc2ccc(C3(NC(=O)c4c(F)ccc([N+](=O)[O-])c4C)CCC3)cc2)cc1 1788001267 PDHYCQDDNQPNGX-UHFFFAOYSA-N 476.508 5.146 5 20 JKBD O=C(CCc1cccc([N+](=O)[O-])c1)NC1(c2ccc(NC(=O)c3ccc(Cl)o3)cc2)CCC1 1788876708 IELPJUSNLXVQNJ-UHFFFAOYSA-N 467.909 5.222 5 20 JKBD Cc1occc1C(=O)NC1(c2ccc(NC(=O)c3cccc(Br)c3[N+](=O)[O-])cc2)CCC1 1790751872 NGRDMCSQUCFUOV-UHFFFAOYSA-N 498.333 5.320 5 20 JKBD CCCC(=O)NC1(c2ccc(NC(=O)c3cc(F)cc([N+](=O)[O-])c3Br)cc2)CCC1 1790795546 NRRCGVFNRSAVKY-UHFFFAOYSA-N 478.318 5.044 5 20 JKBD Cc1[nH]ccc1C(=O)NC1(c2ccc(NC(=O)c3cc4cc([N+](=O)[O-])ccc4s3)cc2)CCC1 1791011259 UGNQXXUNWVVPDJ-UHFFFAOYSA-N 474.542 5.508 5 20 JKBD CC(C)[C@H](C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cccc(F)c1[N+](=O)[O-])C2)c1ccc(Cl)cc1 1793224015 PJEVSTLTAPUDGQ-WEMPKCCASA-N 487.959 5.079 5 20 JKBD CC(C)(C)CCCCCC(=O)NC[C@H]1CCN(C(=O)c2cccc(F)c2[N+](=O)[O-])[C@@H]1c1cccnc1 1812809554 STVHYNCJQMVLPY-HYBUGGRVSA-N 498.599 5.445 5 20 JKBD O=C(C1CC2(CCC2)C1)N1CCCC[C@H]1c1cc(NC(=O)C2(c3cccc([N+](=O)[O-])c3)CCC2)n[nH]1 1820842622 GLKKYDYVUDSTPO-QFIPXVFZSA-N 491.592 5.012 5 20 JKBD C[C@H](C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2ccc([N+](=O)[O-])cc2F)n[nH]1)c1ccc(Cl)cc1 1821049304 JMDXTGZJJFFQJH-LHSJRXKWSA-N 499.930 5.220 5 20 JKBD Cc1csc(CCC(=O)N2CCCC[C@H]2C2CCN(C(=O)CCc3cccc([N+](=O)[O-])c3)CC2)c1 1825204712 RYPXGABLIFXSQC-VWLOTQADSA-N 497.661 5.150 5 20 JKBD O=C(/C=C/c1ccc([N+](=O)[O-])o1)N1CC[C@H]2[C@@H]1CCN2C(=O)C1CCC(c2ccc(Cl)cc2)CC1 1847616526 RBGTVUCORCTFGV-JNCVRHBESA-N 497.979 5.030 5 20 JKBD Cc1nc(CSc2ccccc2C(=O)OCC(=O)Nc2ccc(Cl)cc2[N+](=O)[O-])cs1 11595852 RTHIXXMIIBLWSK-UHFFFAOYSA-N 477.951 5.101 5 20 JKBD COc1cc(-c2nnc(SCc3nc4ccccc4c4ccccc34)o2)cc(OC)c1OC 20039878 UJQGCZSVCFDAGT-UHFFFAOYSA-N 459.527 5.756 5 20 JKBD CCc1cccc(CC)c1NC(=O)[C@@H](C)OC(=O)c1ccc(Sc2nc(C)cs2)c([N+](=O)[O-])c1 23968914 KCYXACADESNPNL-OAHLLOKOSA-N 499.614 5.820 5 20 JKBD Cc1ccc(-n2c(SCC(=O)Nc3ccc(Cl)cc3[N+](=O)[O-])nnc2-c2ccncc2)cc1C 24226939 XAPOTZZCDMOSNB-UHFFFAOYSA-N 494.964 5.239 5 20 JKBD O=C(CCSc1nnc(Nc2ccc(OC(F)(F)F)cc2)s1)Nc1ccccc1[N+](=O)[O-] 26409518 BJYGVHCBGVFXRR-UHFFFAOYSA-N 485.469 5.209 5 20 JKBD Cc1c(NC(=O)[C@@H](C)OC(=O)c2ccccc2-c2ncc(-c3ccccc3)o2)cccc1[N+](=O)[O-] 27415202 FSZIZNXEQJBJHE-QGZVFWFLSA-N 471.469 5.409 5 20 JKBD Cc1ccc2nc(-c3ccccc3)cc(C(=O)OCc3nnc(-c4ccc([N+](=O)[O-])cc4)o3)c2c1 28627715 GUMUERDJMSUHQN-UHFFFAOYSA-N 466.453 5.525 5 20 JKBD CC(=O)NCCc1ccc(C(=O)[C@@H](C)Sc2nc3ccccc3c3nc4ccccc4n23)cc1 32387730 MBDAMUSAMONBJE-QGZVFWFLSA-N 468.582 5.078 5 20 JKBD Cc1ccc(-n2c(SCc3nc(-c4ccc([N+](=O)[O-])cc4)no3)nnc2-c2ccncc2)cc1C 46864904 UJYYXWBYLSNBJI-UHFFFAOYSA-N 485.529 5.197 5 20 JKBD O=C1COc2cc(NC(=O)c3ccc(Oc4ccc(Cl)cc4[N+](=O)[O-])cc3)c(Cl)cc2N1 106023949 QVMSBSRDPRDMDS-UHFFFAOYSA-N 474.256 5.277 5 20 JKBD CC(C)[C@@H](NC(=O)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1)c1nc(-c2ccncc2)no1 110373785 HQTXAGLEVRNMEK-OAQYLSRUSA-N 493.907 5.613 5 20 JKBD CCC(CC)C(=O)N1CCC(NC(=O)c2ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])cc2)CC1 489289820 JXLIZWQPNOGLQJ-UHFFFAOYSA-N 473.957 5.198 5 20 JKBD COc1cc(C(=O)Nc2cccc(CO[C@H]3CCC[C@@H](C)C3)c2)c([N+](=O)[O-])cc1OC(F)F 499196102 SOPMUICPZRNBSA-PBHICJAKSA-N 464.465 5.552 5 20 JKBD O=C(Nc1ccc(OC2CCCC2)c(Cl)c1)c1ccc([N+](=O)[O-])cc1I 511661577 PMINUILXZNUFJZ-UHFFFAOYSA-N 486.693 5.427 5 20 JKBD O=C(Nc1cccc(C(=O)Nc2nc(-c3cccc([N+](=O)[O-])c3)cs2)c1)c1ccc(F)cc1 512140473 XNNZHEVCXYNDIE-UHFFFAOYSA-N 462.462 5.362 5 20 JKBD COc1cc(C(=O)Nc2cc(Cl)c(Cl)cc2Cl)c([N+](=O)[O-])cc1OCc1cscn1 512306051 JLKIFRLBBYPRGL-UHFFFAOYSA-N 488.736 5.851 5 20 JKBD O=C(Nc1ccc(NC(=O)c2ccc(N3CCCC3)c([N+](=O)[O-])c2)c(C(F)(F)F)c1)c1ccccc1 514567986 SOQSEUVNNNGXDK-UHFFFAOYSA-N 498.461 5.718 5 20 JKBD O=C(Nc1ccc(Sc2ccc(Cl)cc2)cc1)N1CCN(c2ccc([N+](=O)[O-])nc2)CC1 520422492 UTDZPFZYURDSII-UHFFFAOYSA-N 469.954 5.149 5 20 JKBD COc1cc(CN[C@@H](c2ccccc2)c2ccccn2)ccc1OCc1ccc([N+](=O)[O-])cc1 521823088 CMHGSWUAMCRFLP-MHZLTWQESA-N 455.514 5.457 5 20 JKBD COCCN(C(=O)c1cc2c(s1)CCCCC2)c1nc(-c2ccc([N+](=O)[O-])cc2)cs1 559480504 XUFCGYYMVFEXIU-UHFFFAOYSA-N 457.577 5.342 5 20 JKBD Cc1ccc(Cc2cnc(NC(=O)c3cc(OCC(F)(F)F)ccc3[N+](=O)[O-])s2)cc1C 603904089 IKYPFZTTWDRRJP-UHFFFAOYSA-N 465.453 5.452 5 20 JKBD Cc1ccc(C(=O)C2CCN([C@H](C(=O)Nc3ccc([N+](=O)[O-])cc3Cl)c3ccccc3)CC2)cc1 603937370 ICGOFHWQWGGGHG-VWLOTQADSA-N 491.975 5.831 5 20 JKBD CCOC1CCN(C(=O)C/C(=C\c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)CC1 604255748 KQKBMNIFRHSHFY-OBGWFSINSA-N 451.548 5.163 5 20 JKBD COc1cc(C(=O)Nc2cc(-c3cccc(C)c3)nn2-c2ccccc2)c([N+](=O)[O-])cc1OC 604456012 JQRCFDRVTIEVOC-UHFFFAOYSA-N 458.474 5.025 5 20 JKBD Cc1csc(Sc2ccc(C(=O)NC[C@@H]3CCN(c4ccc(F)c(F)c4)C3)cc2[N+](=O)[O-])n1 604459117 OAMJVWWMPCJYAC-AWEZNQCLSA-N 490.557 5.045 5 20 JKBD CCCCN(C(=O)c1ccc(N[C@@H](C)c2ccccn2)c([N+](=O)[O-])c1)[C@@H](C)c1ccc(C)o1 604491521 WPEQFXCDPRQNKO-OALUTQOASA-N 450.539 6.068 5 20 JKBD Cc1cnn([C@@H]2CCCc3ccccc32)c1NC(=O)c1csc(-c2cccc([N+](=O)[O-])c2)n1 609059774 OXJQWTDJWFXZRW-OAQYLSRUSA-N 459.531 5.401 5 20 JKBD O=C(Cc1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1)N1CCCc2sccc2C1 609332353 QMVZZXDWZOOSPW-UHFFFAOYSA-N 458.543 5.027 5 20 JKBD O=C(Oc1ccccc1)N1CCCN(C(=O)c2ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])cc2)CC1 725756776 CQZHEWSSBIMHRF-UHFFFAOYSA-N 495.919 5.387 5 20 JKBD CC(C)c1nnc(COC(=O)c2c3c(nc4ccccc24)/C(=C/c2ccc([N+](=O)[O-])cc2)CCC3)o1 726988016 GGOOHJOJQZCEMR-NBVRZTHBSA-N 484.512 5.883 5 20 JKBD Cc1c(NC(=O)[C@H](C)OC(=O)c2cc(-c3ccco3)nc3onc(C(C)C)c23)cccc1[N+](=O)[O-] 727920544 XNUZVIQQLRKNHQ-AWEZNQCLSA-N 478.461 5.007 5 20 JKBD CN(Cc1ccccc1[N+](=O)[O-])Cn1nc(-c2ccc(Cl)c(Cl)c2)c2ccccc2c1=O 729462645 FXXZLXKGVBEOGN-UHFFFAOYSA-N 469.328 5.368 5 20 JKBD O=[N+]([O-])c1ccc(NC(=S)N(CCN2CCCC2)Cc2ccc(Cl)c(Cl)c2)cc1 743585194 ZKRNGCIDMXHGLH-UHFFFAOYSA-N 453.395 5.196 5 20 JKBD Nc1ccc(Cl)c(C(=O)O[C@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2ccccc2)c1 745515092 KWWTVQSEOPTSIX-IBGZPJMESA-N 460.273 5.021 5 20 JKBD CC(C)Sc1ccccc1C(=O)O[C@@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 844172376 WJQRVLGUQXQXIH-LBPRGKRZSA-N 456.442 5.298 5 20 JKBD O=[N+]([O-])c1ccc(/C=C(\Cc2nc(Cn3cnc4ccccc43)no2)c2nc3ccccc3s2)cc1 904736451 BQJBVAUFSHJWDY-QGOAFFKASA-N 494.536 5.769 5 20 JKBD O=C(Nc1cc([N+](=O)[O-])c(F)cc1F)[C@@H](Oc1ccccc1Br)c1ccccc1 916042966 OQOKUVNVMSWKDL-IBGZPJMESA-N 463.234 5.394 5 20 JKBD CC(C)Oc1cccc([C@@H](C)NC(=O)c2ccccc2NC(=O)c2ccc([N+](=O)[O-])cc2Cl)c1 918583683 YWZBGEWZRKPAQK-MRXNPFEDSA-N 481.936 5.779 5 20 JKBD CC(C)(C)c1cc[n+](/C(C(=S)Nc2ccc3c(c2)CCC3)=C(/O)c2cccc([N+](=O)[O-])c2)cc1 920396299 YGBXTOLRELYEJH-UHFFFAOYSA-O 474.606 5.992 5 20 JKBD O=C(COc1cccc2ccccc12)NC1(c2ccc(NC(=O)c3ccc([N+](=O)[O-])o3)cc2)CCC1 1785748679 KFIGOXWPFQQPDW-UHFFFAOYSA-N 485.496 5.168 5 20 JKBD O=C(Cc1cc([N+](=O)[O-])ccc1F)NC1(c2ccc(NC(=O)c3ccc4cnccc4c3)cc2)CCC1 1789010850 YSGODKKIUILQKQ-UHFFFAOYSA-N 498.514 5.273 5 20 JKBD Cc1ccc(CC(=O)Nc2ccc(C3(NC(=O)[C@@H]4CCC(F)(F)C4)CCC3)cc2)cc1[N+](=O)[O-] 1790524691 QVJLLLODILVWQC-GOSISDBHSA-N 471.504 5.015 5 20 JKBD Cc1cc(O)c([N+](=O)[O-])cc1C(=O)Nc1ccc(C2(NC(=O)[C@@H]3CCCCC3(F)F)CCC2)cc1 1790806191 BHMGZZWZLGXEHO-IBGZPJMESA-N 487.503 5.182 5 20 JKBD O=C(Cc1ccc([N+](=O)[O-])cc1F)Nc1ccc(C2(NC(=O)c3cccc4ccncc34)CCC2)cc1 1791183893 NQAXZTXTLIFQDM-UHFFFAOYSA-N 498.514 5.273 5 20 JKBD Cc1c(C(=O)NC2(c3ccc(NC(=O)/C=C/c4ccccc4[N+](=O)[O-])cc3)CCC2)nc2ccccn12 1792317738 LTMPBOKQDFTSJS-XNTDXEJSSA-N 495.539 5.012 5 20 JKBD CC(C)(C)CCCCCC(=O)N1CC[C@@H](CNC(=O)c2cc(O)cc([N+](=O)[O-])c2)[C@@H]1c1cccnc1 1811689784 YMZFOCRENCITAQ-CPJSRVTESA-N 496.608 5.012 5 20 JKBD C[C@@H](Sc1ccccc1)C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2ccc([N+](=O)[O-])cc2F)CC1 1824391510 FNZJWJRRWZLTSK-KOSHJBKYSA-N 499.608 5.148 5 20 JKBD O=C(CCc1cccc([N+](=O)[O-])c1)N1CCC([C@H]2CCCCN2C(=O)CCC2CCCC2)CC1 1826264098 BBHOMCYRDOPVSK-RUZDIDTESA-N 469.626 5.118 5 20 JKBD CC[C@H](C)CC(=O)N1CCC([C@H]2CCCCN2C(=O)c2ccc(Br)c([N+](=O)[O-])c2)CC1 1830522257 AVBREQOVQHBYQA-OXJNMPFZSA-N 494.430 5.027 5 20 JKBD Cc1cc(F)ccc1C(=O)N1CCCC[C@H]1C1CCN(C(=O)CSc2ccccc2[N+](=O)[O-])CC1 1832727771 XFMBAFOSWRGQIL-QFIPXVFZSA-N 499.608 5.068 5 20 JKBD Cc1ccc(NC(=O)[C@@H](OC(=O)c2cc([N+](=O)[O-])ccc2Cl)c2ccccc2)c([N+](=O)[O-])c1 10665283 KWKMXQXDYZPSPN-FQEVSTJZSA-N 469.837 5.002 5 20 JKBD C[C@@H](OC(=O)[C@@H](C)Sc1ccc(Cl)cc1)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 21457611 PJOBHQAZLMVHJD-GHMZBOCLSA-N 476.860 5.318 5 20 JKBD C[C@@H](OC(=O)c1ccc(Br)c([N+](=O)[O-])c1)c1nc(-c2cccc(C(F)(F)F)c2)no1 23437508 QMIYFUVSALZQAD-SECBINFHSA-N 486.200 5.344 5 20 JKBD O=C(Nc1nc2cc(C(F)(F)F)ccc2n1Cc1ccco1)c1ccc(-n2ccnc2)c([N+](=O)[O-])c1 69487596 OFHIUXJKHYVNNO-UHFFFAOYSA-N 496.405 5.043 5 20 JKBD COc1ccc(CSCC(=O)N[C@H](C)c2ccc(NC(=O)Nc3ccccc3)cc2)cc1[N+](=O)[O-] 108607593 WEKNMSASYFXDDH-QGZVFWFLSA-N 494.573 5.358 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)Nc2ccc(N(C)C(=O)c3ccc(Cl)cc3)cc2)cc1SC 483373507 FWXDEKWAGHANIC-UHFFFAOYSA-N 485.949 5.508 5 20 JKBD C[C@H]1C[C@H](C)CN(c2ccc(C(=O)Nc3ccc(-n4cccn4)cc3C(F)(F)F)cc2[N+](=O)[O-])C1 484316655 HGVLNFMAWFULIF-HOTGVXAUSA-N 487.482 5.534 5 20 JKBD CCC(=O)Nc1ccc(Cl)c(NC(=O)c2ccc(Sc3nc(C)cs3)c([N+](=O)[O-])c2)c1 500901132 CXLVWCJHKHDZCA-UHFFFAOYSA-N 476.967 5.765 5 20 JKBD COc1cc(C(=O)Nc2cc(Cl)c(OC)c(Cl)c2)c([N+](=O)[O-])cc1OCc1cscn1 506303844 DLEJODLUYOZVJW-UHFFFAOYSA-N 484.317 5.207 5 20 JKBD COCCOc1ccc(NC(=O)C/C(=C\c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)cn1 506777459 HMKKHIQBISDUOA-NBVRZTHBSA-N 490.541 5.194 5 20 JKBD C[C@@H](Nc1ccc(C(=O)Nc2cccc(OCc3cccnc3)c2)cc1[N+](=O)[O-])c1ccccn1 507402185 KAYHVCXAMVRVCR-GOSISDBHSA-N 469.501 5.389 5 20 JKBD Cc1nn(Cc2ccc(C(=O)Nc3ccccc3OCCc3ccccc3)cc2)c(C)c1[N+](=O)[O-] 512522943 BHTSKTMDURJTPW-UHFFFAOYSA-N 470.529 5.330 5 20 JKBD CCCS(=O)(=O)Nc1cccc(NC(=O)c2ccc(SCCC(C)C)c([N+](=O)[O-])c2)c1C 518863041 LOHZLICXFPAHKE-UHFFFAOYSA-N 479.624 5.445 5 20 JKBD COCCOc1c(Cl)cccc1NC(=O)c1cc([N+](=O)[O-])ccc1Oc1ccc(OC)cc1 520675184 TUXBNCBZIXJBIP-UHFFFAOYSA-N 472.881 5.327 5 20 JKBD CN(C)C(=O)c1cccc(NC(=O)C/C(=C\c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)c1 592950433 VNYRZBBDSQLPSE-XMHGGMMESA-N 486.553 5.476 5 20 JKBD O=C(Nc1nc(-c2ccco2)c(-c2ccco2)s1)C1CCN(c2ccccc2[N+](=O)[O-])CC1 603058544 IICFLLHRFQKYNL-UHFFFAOYSA-N 464.503 5.426 5 20 JKBD COc1cccc(/C=C(\CC(=O)N[C@@H](C)c2cccc([N+](=O)[O-])c2)c2nc3ccccc3s2)c1 603966490 AMJSHDNUJMWXIM-NNIWKIFQSA-N 473.554 6.021 5 20 JKBD Cc1sc(NC(=O)C2CCN(c3ccc(C(F)(F)F)cn3)CC2)nc1-c1cccc([N+](=O)[O-])c1 603996883 ISCUNYOZIHBNCB-UHFFFAOYSA-N 491.495 5.296 5 20 JKBD CC(C)c1ccc([C@H](NC(=O)C(=O)Nc2cc([N+](=O)[O-])ccc2OC(F)F)c2cccs2)cc1 604140769 ZCMDUJJRCPRCAH-FQEVSTJZSA-N 489.500 5.225 5 20 JKBD CCCS(=O)(=O)c1ccccc1S[C@@H](C)C(=O)Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1 609323951 NNGZVETXUZGGRG-AWEZNQCLSA-N 491.616 5.021 5 20 JKBD COc1ccc(NC(=S)/C(=C(/O)c2ccc(C)c([N+](=O)[O-])c2)[n+]2ccc(C)cc2)cc1Cl 726963016 XFPDQVIHRKDANJ-UHFFFAOYSA-O 470.958 5.484 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)Nc2ccccc2C(=O)N[C@@H](C)c2ccccc2)cc1SC 728458475 MOBFNPHAXVWCRT-HNNXBMFYSA-N 465.531 5.069 5 20 JKBD C/C(=C\C(=O)O[C@@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F)c1ccc(C(F)(F)F)cc1 748392858 PMOVGTNLGYJEEQ-ZKQHCESOSA-N 490.356 5.606 5 20 JKBD O=C(Nc1nc(-c2ccco2)c(-c2ccco2)s1)c1cc([N+](=O)[O-])ccc1Br 751049548 LPIDYQSVGADDSD-UHFFFAOYSA-N 460.265 5.586 5 20 JKBD O=C(Cc1coc2cc(O)ccc12)O[C@H](C(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1)c1ccccc1 779873671 WWBSJZUASKDUGX-QHCPKHFHSA-N 480.860 5.166 5 20 JKBD O=[N+]([O-])c1cccc(/C(O)=C(/C(=S)N[C@H]2C[C@H]3CC[C@H]2C3)[n+]2ccc(Cc3ccccc3)cc2)c1 912845598 VYIWELDNOHYNJX-HWBMXIPRSA-O 486.617 5.463 5 20 JKBD C[C@@H](OC(=O)/C=C/c1ccccc1OC(F)(F)F)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 914944100 YWELYLRXVUGHIC-OALRPVAKSA-N 492.328 5.096 5 20 JKBD CCN(Cc1ccccc1)C(=O)c1cc(NC(=O)c2cc([N+](=O)[O-])ccc2Cl)ccc1Cl 917766235 HHQZUHPQXQNWHS-UHFFFAOYSA-N 472.328 5.816 5 20 JKBD Cc1cccc2sc(N(Cc3ccccc3)C(=O)Cn3ncc4ccc([N+](=O)[O-])cc43)nc12 918552580 QDUYVPXRCWZUKV-UHFFFAOYSA-N 457.515 5.096 5 20 JKBD C[C@H](OC(=O)c1cc([N+](=O)[O-])ccc1Oc1ccccc1)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl 919192779 ODZJFOMGWNXDSZ-ZDUSSCGKSA-N 485.836 5.133 5 20 JKBD Cc1c(NC(=O)[C@@H](C)OC(=O)c2cc(C(C)C)nc3c2c(C)nn3C(C)(C)C)cccc1[N+](=O)[O-] 919207839 FAEJQUQAWBSXKF-MRXNPFEDSA-N 481.553 5.019 5 20 JKBD O=C(Nc1ccc(OC(=O)C2(c3cccc(Cl)c3)CCOCC2)cc1)c1cccc([N+](=O)[O-])c1 919679532 VBSOCUIHVYSDDI-UHFFFAOYSA-N 480.904 5.154 5 20 JKBD C[C@@H](Nc1ccc(C(=O)OCC(=O)Nc2ccccc2C(C)(C)C)cc1[N+](=O)[O-])c1ccccn1 920545147 FZRKVTNGQSRQQG-QGZVFWFLSA-N 476.533 5.256 5 20 JKBD O=C(CCCOc1ccc(Cl)cc1)Nc1ccc(C2(NC(=O)c3ccc([N+](=O)[O-])[nH]3)CCC2)cc1 1786697397 VJWBTXYRJIUPGP-UHFFFAOYSA-N 496.951 5.183 5 20 JKBD O=C(CCc1cccc([N+](=O)[O-])c1)NC1(c2ccc(NC(=O)c3scnc3C3CC3)cc2)CCC1 1787184094 QFHDYFRWYAJSLK-UHFFFAOYSA-N 490.585 5.309 5 20 JKBD C[C@H](CC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc2cc([N+](=O)[O-])ccc2s1)c1ccccc1 1801206651 BLBCWBSQLJLMCU-RZXSNQJFSA-N 477.586 5.255 5 20 JKBD Cc1c(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)[C@H](F)c3ccccc3)n[nH]2)cc(Cl)cc1[N+](=O)[O-] 1815557391 VSZMZEDQJPGMHU-DENIHFKCSA-N 499.930 5.296 5 20 JKBD Cc1ccc(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)Cc3ccc(Cl)cc3[N+](=O)[O-])CC2)cc1 1830058910 WTARIBNUUZXLNW-HSZRJFAPSA-N 483.996 5.033 5 20 JKBD C[C@@H](Sc1nc(-c2ccc(Cl)cc2)n[nH]1)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 21451573 LSBDZQMMHDBHQV-SECBINFHSA-N 471.848 5.171 5 20 JKBD CCOc1cc(C(=O)Nc2ncc(Cc3cccc(C(F)(F)F)c3)s2)c([N+](=O)[O-])cc1OC 24827140 QNVXJONEFNPREN-UHFFFAOYSA-N 481.452 5.321 5 20 JKBD CN(C)C(=O)c1ccc(NC(=O)c2ccc(Sc3nc4ccccc4s3)c([N+](=O)[O-])c2)cc1 27223555 QDFVLLDLXPUQKN-UHFFFAOYSA-N 478.555 5.310 5 20 JKBD O=C(Cn1c2ccccc2c(=O)c2ccccc21)Nc1ccc(SCc2cccnc2)cc1 45780663 OYMVYUJNYPUEOH-UHFFFAOYSA-N 451.551 5.481 5 20 JKBD CCCNC(=O)c1ccc(NC(=O)c2ccc(NCc3ccccc3Cl)c([N+](=O)[O-])c2)cc1 59800301 AKTMGDCFXIWMBZ-UHFFFAOYSA-N 466.925 5.252 5 20 JKBD CCOC(=O)c1nc(N(CCc2ccccc2)C(=O)c2cc(SC)ccc2[N+](=O)[O-])sc1C 105270381 MONUKMVSEKPCFR-UHFFFAOYSA-N 485.587 5.148 5 20 JKBD O=C(N[C@@H](c1ccc(Cl)cc1)c1cccs1)C1CCN(c2ccccc2[N+](=O)[O-])CC1 107958043 FLJSPDMHOHUTEB-QFIPXVFZSA-N 455.967 5.432 5 20 JKBD O=C(Nc1ccccc1)c1ccc(Cl)c(NC(=O)c2ccc(NC3CC3)c([N+](=O)[O-])c2)c1 116993555 KQAMZUTZDUMBCQ-UHFFFAOYSA-N 450.882 5.327 5 20 JKBD CS(=O)(=O)c1cc(C(=O)Nc2ccccc2-c2ccc(-c3ccccc3)cc2)cc([N+](=O)[O-])c1 410035825 AJDMPOOFAKRCCL-UHFFFAOYSA-N 472.522 5.585 5 20 JKBD CC(C)N(C(=O)c1ccc(Sc2nncn2C)c([N+](=O)[O-])c1)c1ccc(Cl)c(Cl)c1 505074521 ULXUNLSVOUZEOD-UHFFFAOYSA-N 466.350 5.237 5 20 JKBD O=C(Nc1ccccc1OCCc1ccccc1)c1ccc([N+](=O)[O-])cc1I 508941519 KKLAZXUTALQVQE-UHFFFAOYSA-N 488.281 5.073 5 20 JKBD Cc1nn(Cc2ccc(C(=O)N(Cc3ccc4ccccc4c3)C3CC3)cc2)c(C)c1[N+](=O)[O-] 509030720 JSVMHQXKQOQZLE-UHFFFAOYSA-N 454.530 5.414 5 20 JKBD C[C@@H](Nc1ccc(C(=O)Nc2ccccc2CN2CCc3ccccc32)cc1[N+](=O)[O-])c1ccccn1 509495707 ZNPKIHXAJKQOEP-HXUWFJFHSA-N 493.567 5.978 5 20 JKBD CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)N[C@H](C)c1ccc(NC(=O)c2ccc(F)cc2)cc1 509781276 HREVMLITTWZISS-GOSISDBHSA-N 478.524 5.667 5 20 JKBD C[C@H](c1ccco1)N(C(=O)Cc1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1)C1CC1 509826152 GDEXJNZDCXCJDQ-GOSISDBHSA-N 456.502 5.335 5 20 JKBD C[C@H](Nc1ccc(C(=O)N2CCC(Nc3ccc(F)cc3)CC2)cc1[N+](=O)[O-])c1ccccn1 512159953 VAHZNAMGOBTNDO-KRWDZBQOSA-N 463.513 5.019 5 20 JKBD O=C(Nc1cc(N2CCCC2=O)ccc1Cl)c1ccc(Nc2ccccc2)c([N+](=O)[O-])c1 519489738 KOTOMWOANYQTGH-UHFFFAOYSA-N 450.882 5.371 5 20 JKBD CCOc1cccc([C@@H](C)N[C@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Br)c2ccccc2)c1 521726199 LNVWLYPOKZDNDM-MWTRTKDXSA-N 498.377 5.787 5 20 JKBD Cc1ccc(Sc2ccc(C(=O)Nc3ccccc3OCCn3ccnc3)cc2[N+](=O)[O-])cc1 521745420 LJSSOWZFOYUJKG-UHFFFAOYSA-N 474.542 5.582 5 20 JKBD COc1cc(C(=O)Nc2ncc(Cc3ccc(C)c(Cl)c3)s2)c([N+](=O)[O-])cc1OC(F)F 602244925 XVPUIGBIWJZSCN-UHFFFAOYSA-N 483.880 5.466 5 20 JKBD COc1cc(NC(=O)c2cc([N+](=O)[O-])ccc2Oc2ccccc2)ccc1NC(=O)c1cccnc1 603739759 XLLINFLLGBDBGW-UHFFFAOYSA-N 484.468 5.295 5 20 JKBD CCC(C)(C)NC(=O)c1ccc(NC(=O)c2ccc(N3CCC(C)CC3)c([N+](=O)[O-])c2)cc1 603985607 YVQHLQCJDIZKOX-UHFFFAOYSA-N 452.555 5.002 5 20 JKBD Cc1ccc(Sc2ccc(C(=O)N3CCC(C(=O)OC(C)(C)C)CC3)cc2[N+](=O)[O-])cc1 608989120 FGSBXOAKICICIR-UHFFFAOYSA-N 456.564 5.248 5 20 JKBD Cc1cccc([N+](=O)[O-])c1NC(=O)COC(=O)c1sc2cc(Br)ccc2c1Cl 729871567 LZPHKNFIYVPIMW-UHFFFAOYSA-N 483.727 5.329 5 20 JKBD Cc1sc(NC(=O)c2csc(-c3ccc([N+](=O)[O-])cc3)n2)nc1-c1cccc([N+](=O)[O-])c1 747643973 UWIKSSPIADCNBW-UHFFFAOYSA-N 467.488 5.311 5 20 JKBD O=C(OCc1cc(Cl)ccc1OCc1cccnc1)c1csc(-c2ccc([N+](=O)[O-])cc2)n1 747955441 SBFDACXISPVWAP-UHFFFAOYSA-N 481.917 5.703 5 20 JKBD O=C(OCc1cc(Cl)ccc1OCc1cccnc1)c1csc(-c2cccc([N+](=O)[O-])c2)n1 747956254 PVJADRTULBNTJG-UHFFFAOYSA-N 481.917 5.703 5 20 JKBD Cc1cccc(-c2nnc(-c3ccc(C(=O)OCC4CCN(c5ccc([N+](=O)[O-])cn5)CC4)cc3)o2)c1 750433055 BFISEGNUOODPQZ-UHFFFAOYSA-N 499.527 5.089 5 20 JKBD COC(=O)c1ccc2c(=O)nc(/C(Cl)=C\c3ccc(-c4ccccc4[N+](=O)[O-])s3)[nH]c2c1 810225858 OOKIXYZSUGJGDT-LFIBNONCSA-N 467.890 5.083 5 20 JKBD CN(C(=O)CSc1ccccc1C(=O)Nc1cc([N+](=O)[O-])c(F)cc1F)C1CCCCC1 897467482 PGRDPCNAYNUARW-UHFFFAOYSA-N 463.506 5.009 5 20 JKBD C[C@H](NC(=O)c1ccccc1NC(=O)c1ccc([N+](=O)[O-])cc1Cl)c1c(F)cccc1F 914484530 GFTXZPWOLAXPCF-LBPRGKRZSA-N 459.836 5.270 5 20 JKBD C[C@H](OC(=O)[C@@H](C)Oc1cccc(Cl)c1Cl)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 915496472 GDSGLMILMHYGHP-VHSXEESVSA-N 495.237 5.258 5 20 JKBD NC(=O)c1cc(N2CCCCC2)ccc1NC(=O)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1 918557139 FWAKPDFCGFYKJO-UHFFFAOYSA-N 494.935 5.382 5 20 JKBD CCOc1ccccc1C(=O)NC1(c2ccc(NC(=O)c3cccc(F)c3[N+](=O)[O-])cc2)CCC1 1790698623 KBSBICPIVULVSR-UHFFFAOYSA-N 477.492 5.194 5 20 JKBD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)Cc1ccc(Cl)cc1[N+](=O)[O-])[C@@H]1CCC[C@H]2CCCC[C@@H]21 1793079296 PUHWQSBIPAPHLT-QFHQZCAOSA-N 488.028 5.035 5 20 JKBD O=C(Cc1ccc(F)cc1)N1CCCC2(CCN(C(=O)c3cc4cc([N+](=O)[O-])ccc4s3)CC2)C1 1809261861 UNHCLASFDPJHBT-UHFFFAOYSA-N 495.576 5.036 5 20 JKBD CCCCC[C@H](C)C(=O)Nc1cc([C@H]2CCCCN2C(=O)Cn2ccc3ccc([N+](=O)[O-])cc32)[nH]n1 1822003112 YWNJUQOZSMQYBA-PGRDOPGGSA-N 494.596 5.181 5 20 JKBD O=C(c1ccccc1F)N1CCCC[C@H]1C1CCN(C(=O)C2(c3cccc([N+](=O)[O-])c3)CCC2)CC1 1829879927 XIDNODZFCBPEJC-VWLOTQADSA-N 493.579 5.089 5 20 JKBD CCCOc1ccc(C(=O)N2CCC([C@H]3CCCCN3C(=O)c3ccc([N+](=O)[O-])cc3F)CC2)cc1 1830499491 YGZFRRHBZQAMHP-RUZDIDTESA-N 497.567 5.070 5 20 JKBD C/C=C(/C)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)CC1 1831349799 BZYRNWFBKAPFOR-PXWJFQKQSA-N 455.580 5.009 5 20 JKBD CCCCC[C@H](C)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)/C=C/c2ccc([N+](=O)[O-])o2)CC1 1831462137 JMHJVMKBMCLQFY-CIRHMYPESA-N 459.587 5.037 5 20 JKBD O=C(/C=C/c1ccc([N+](=O)[O-])o1)N1CCC([C@@H]2CCCCN2C(=O)c2cccc3c2CCCC3)CC1 1832639852 YMIYOAOMKPIESJ-BVYAJCBJSA-N 491.588 5.013 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)N1CC2(CCCN2C(=O)c2cccc3c2oc2ccccc23)C1 1845736639 VCSYCBLRNHXDBV-UHFFFAOYSA-N 487.487 5.073 5 20 JKBD CC(=O)N(c1nc(COC(=O)/C=C/c2ccc([N+](=O)[O-])cc2)cs1)c1c(C)cc(C)cc1Cl 10757930 OWZQZBMJYQXPKO-RMKNXTFCSA-N 485.949 5.763 5 20 JKBD Cc1cc(C(=O)CCC(=O)Oc2ccc(NC(=O)c3cccc([N+](=O)[O-])c3)cc2)c(C)s1 15576323 KTRKGTSCDNTPFY-UHFFFAOYSA-N 452.488 5.094 5 20 JKBD Cc1cc(C)c(Nc2nnc(SCc3nnc(-c4ccc([N+](=O)[O-])cc4)o3)s2)c(Cl)c1 16328410 YSKZRKDZZAREBC-UHFFFAOYSA-N 474.955 5.802 5 20 JKBD CC(C)OCc1c(C(=O)O[C@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)oc2ccccc12 17721792 AAKHYQRDBFLJGY-CQSZACIVSA-N 451.435 5.234 5 20 JKBD COc1ccc(-c2nc(C(=O)Nc3nc(-c4cccc([N+](=O)[O-])c4)cs3)cs2)cc1OC 18946988 BUHKHBJVFUIOPB-UHFFFAOYSA-N 468.516 5.111 5 20 JKBD C[C@@H](Sc1ncc(-c2ccccc2)n1C[C@H]1CCCO1)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl 29072041 FQUHECQNZUNQKD-CRAIPNDOSA-N 486.981 5.410 5 20 JKBD C[C@@H](Nc1cc(Cl)c(C(F)(F)F)cc1[N+](=O)[O-])c1cc(F)ccc1N1CCC(O)CC1 78656524 DPTIIZSSQHGXLS-LLVKDONJSA-N 461.843 5.540 5 20 JKBD C[C@H]1C[C@@H](C)CN(c2ccc(C(=O)N3CCC(Oc4ccc(F)cc4F)CC3)cc2[N+](=O)[O-])C1 195640724 PYNKBVIVBDUORU-CALCHBBNSA-N 473.520 5.039 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)Nc2ccc(OCc3cccc(F)c3)c(F)c2)cc1SC 483986064 ZJUJHDKFEPCNHR-UHFFFAOYSA-N 460.458 5.435 5 20 JKBD C[C@H](c1cc(F)ccc1F)N(C)C(=O)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 498572563 AXHFGQHWPAOSRT-CYBMUJFWSA-N 471.426 5.328 5 20 JKBD COc1ccc(NC(=O)c2ccc(Sc3nc(C)cs3)c([N+](=O)[O-])c2)c(C(F)(F)F)c1 500788379 RJUTZDIVPSBSAZ-UHFFFAOYSA-N 469.466 5.791 5 20 JKBD CC(=O)N1CCCc2cc(NC(=O)c3ccc(Sc4nc(C)cs4)c([N+](=O)[O-])c3)ccc21 502046709 HWSWMAGPQMOHJS-UHFFFAOYSA-N 468.560 5.062 5 20 JKBD C[C@@H](Nc1ccc(C(=O)Nc2ccc(-c3cnc(C4CC4)o3)cc2)cc1[N+](=O)[O-])c1ccccn1 506195784 YNQRRDHDEQGYHX-MRXNPFEDSA-N 469.501 5.948 5 20 JKBD COc1ccc(CSCC(=O)Nc2cccc(CSc3ccccn3)c2)cc1[N+](=O)[O-] 509129377 KMTPVXDWOLLEAT-UHFFFAOYSA-N 455.561 5.163 5 20 JKBD COc1ccc(CSCC(=O)NCC2(c3ccc(Cl)cc3Cl)CCOCC2)cc1[N+](=O)[O-] 510098062 IVIXRXFCGFXPPJ-UHFFFAOYSA-N 499.416 5.008 5 20 JKBD COc1ccc(C(=O)Nc2ccc3nc(NC(=O)c4ccc(C)s4)sc3c2)cc1[N+](=O)[O-] 511314178 HYCWNTMEQPSABL-UHFFFAOYSA-N 468.516 5.088 5 20 JKBD O=C(NC1CCN(CCc2ccccc2)CC1)c1cc([N+](=O)[O-])ccc1Sc1ccccc1 512490547 YQCVRAXCYSDJHF-UHFFFAOYSA-N 461.587 5.183 5 20 JKBD COc1cc(C(=O)N(Cc2ccco2)Cc2ccc(C)s2)c([N+](=O)[O-])cc1OC(F)F 519986365 IFGINEBZAWCCQA-UHFFFAOYSA-N 452.435 5.010 5 20 JKBD C[C@@H](c1cccnc1)N(C)C(=O)C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1 520103174 QIKPCTAWPSPLTN-PNWWAVQQSA-N 458.543 5.750 5 20 JKBD CC(C)(C)OCc1cccc(CN[C@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2ccccc2)c1 522441252 XEKAWVZXVVUQMS-DEOSSOPVSA-N 481.980 6.033 5 20 JKBD CN(c1ccccc1)c1ccc(CNc2ccc(N=S3(=O)CCCC3)cc2)cc1[N+](=O)[O-] 600852834 YXTNSFPPXNJYDP-UHFFFAOYSA-N 450.564 5.868 5 20 JKBD CSc1ccc(C(=O)c2ccccc2C(=O)Nc2ccc(Cl)c(C(=O)N(C)C)c2)cc1[N+](=O)[O-] 603623745 GUJXOXWTKYFSNV-UHFFFAOYSA-N 497.960 5.155 5 20 JKBD Cc1sc(NC(=O)c2cc(OCC(F)(F)F)ccc2[N+](=O)[O-])nc1-c1ccc(F)cc1 603729896 WYHFNSDRJSIFNT-UHFFFAOYSA-N 455.389 5.359 5 20 JKBD O=C(c1cnn(-c2ccc([N+](=O)[O-])cc2)c1)N1CCC(c2nc3cc(Cl)ccc3s2)CC1 603733161 BABGUDLGXFYMAX-UHFFFAOYSA-N 467.938 5.063 5 20 JKBD Cc1ccc(-c2csc3ncnc(SCC(=O)N[C@H](C)c4cccc([N+](=O)[O-])c4)c23)cc1 603904773 QEOXTHYKSVPBIO-OAHLLOKOSA-N 464.572 5.544 5 20 JKBD Cc1nc(COc2ccc(Cl)cc2)sc1C(=O)Nc1ccnn1-c1ccc([N+](=O)[O-])cc1 609151315 FBMVCRBIXITBEI-UHFFFAOYSA-N 469.910 5.030 5 20 JKBD O=C(Nc1ccc(OC(=O)c2cc(F)c(F)cc2[N+](=O)[O-])cc1)c1ccccc1Br 727705518 SKIGCZSHAGVBCK-UHFFFAOYSA-N 477.217 5.107 5 20 JKBD Cc1cc(-c2noc(CCC(=O)N(CC3CC3)c3ccc(Cl)c([N+](=O)[O-])c3)n2)ccc1F 728166496 ILDCHSGPWUYMPH-UHFFFAOYSA-N 458.877 5.122 5 20 JKBD C[C@@H](Nc1ccc(C(=O)N(CC2CC2)c2ccc(Cl)c([N+](=O)[O-])c2)cc1[N+](=O)[O-])c1ccccn1 728167479 ZKHJDZKQAUTHSZ-OAHLLOKOSA-N 495.923 5.781 5 20 JKBD O=C(Nc1ccc(Oc2ccc(F)cc2)cn1)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-] 729381336 XVJFQFBUVGUMAY-UHFFFAOYSA-N 451.332 5.115 5 20 JKBD C[C@H](OC(=O)c1cc(-c2ccc(C(F)(F)F)cc2)no1)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 730858795 UQOUOXGGZPQRDI-NSHDSACASA-N 474.351 5.237 5 20 JKBD CC(C)(C)OC(=O)NCc1ccc2c(c1)CCCN2C(=O)c1csc(-c2ccc([N+](=O)[O-])cc2)n1 731023550 WRKJJIZJNWRGLO-UHFFFAOYSA-N 494.573 5.336 5 20 JKBD CC[C@H](C)n1c(SCC(=O)N(C)Cc2cc([N+](=O)[O-])ccc2Cl)nnc1-c1ccccc1 749842759 KOZHJYSUHLSZKY-HNNXBMFYSA-N 473.986 5.228 5 20 JKBD COc1ccc(C[C@H](NC(=O)c2cc([N+](=O)[O-])ccc2Br)c2ccc(OC)cc2)cc1 751060458 BZGABCYETMNRLK-QFIPXVFZSA-N 485.334 5.088 5 20 JKBD CC(C)Cn1cc([C@@H]2N(C(=O)c3cc4ccccc4c4cccnc34)CC23CCOCC3)cn1 849532767 VHAYTTFLMHEALN-SANMLTNESA-N 454.574 5.234 5 20 JKBD CSCC[C@H](NC(=O)c1ccc(Cl)c([N+](=O)[O-])c1)C(=O)O[C@@H](C)c1ccc(Cl)cc1 857760873 UAVWXSPIEABUDI-SJCJKPOMSA-N 471.362 5.058 5 20 JKBD O=C(NCc1cccc(N2CCOC2=O)c1)c1cc([N+](=O)[O-])ccc1Sc1ccc(Cl)cc1 918094544 OLOSEFFAVOTTCS-UHFFFAOYSA-N 483.933 5.286 5 20 JKBD Cc1ccc(OCc2ccc(C(=O)O[C@@H](C)c3nnc(-c4ccc([N+](=O)[O-])cc4)o3)o2)c(C)c1 920586324 MEZZDTWYCDAPOG-INIZCTEOSA-N 463.446 5.352 5 20 JKBD CCc1cc(C(=O)NC2(c3ccc(NC(=O)CCc4cccc([N+](=O)[O-])c4)cc3)CCC2)cc(C)n1 1786600052 HXUWGZLKGPQKBG-UHFFFAOYSA-N 486.572 5.241 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)c3ccc(Cl)cc3)CCC2)cc1)c1cc(O)cc([N+](=O)[O-])c1 1790756954 LFSZARGIPBBIIX-UHFFFAOYSA-N 465.893 5.015 5 20 JKBD C[C@H](Sc1ccccc1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cc3cc([N+](=O)[O-])ccc3s1)C2 1793441110 AEZIYJKOKKXRHI-KANFNMMFSA-N 495.626 5.242 5 20 JKBD CC(C)(C)CCCCCC(=O)N1CCCC[C@@H]1c1cc(NC(=O)/C=C/c2ccc([N+](=O)[O-])o2)n[nH]1 1814970067 OMBGUEWBHMUXPP-VSFZPWCASA-N 485.585 5.613 5 20 JKBD O=C(c1cc2cc([N+](=O)[O-])ccc2s1)N1CCC([C@H]2CCCCN2C(=O)C2=CCCS2)CC1 1824566301 FHOAYRPXRCLGQU-LJQANCHMSA-N 485.631 5.064 5 20 JKBD Cc1cccnc1C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)CC1 1824699252 AEKYVDJYJAKIOX-OAQYLSRUSA-N 492.601 5.060 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)N1CCC([C@H]2CCCCN2C(=O)/C=C/c2cccs2)CC1 1827078966 IRHDWTYMALHJJQ-HWWNHIDJSA-N 485.581 5.051 5 20 JKBD C/C(=C\c1ccc(C)o1)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)CCc2cccc([N+](=O)[O-])c2)CC1 1829005059 RPDTYJFOZAJSBN-OPIUMXSJSA-N 493.604 5.152 5 20 JKBD CC(C)(C)c1cc(C(=O)N2CCC([C@@H]3CCCCN3C(=O)/C=C/c3ccccc3[N+](=O)[O-])CC2)c[nH]1 1832903234 WIAYMLWNKHWIRK-RGPPVUSESA-N 492.620 5.167 5 20 JKBD Cc1nn(Cc2ccc(C(=O)OCc3ccc(C(=O)Nc4ccccc4)cc3)cc2)c(C)c1[N+](=O)[O-] 11540809 FJIQWHAJDFLNOX-UHFFFAOYSA-N 484.512 5.066 5 20 JKBD Cc1cc(Br)ccc1SCC(=O)O[C@@H](C)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 17529810 NAZWPPXGBDQGDW-LBPRGKRZSA-N 478.324 5.112 5 20 JKBD O=C(CSc1nnc(Nc2cccc(F)c2)s1)Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1 22171377 ODDJDDJSXMBPRJ-UHFFFAOYSA-N 488.551 5.183 5 20 JKBD Cc1c(NC(=O)[C@H](C)Sc2nnc(-c3ccc(F)cc3)n2Cc2ccccc2)cccc1[N+](=O)[O-] 23602847 RYLUCJKYTMCDDU-KRWDZBQOSA-N 491.548 5.468 5 20 JKBD CCn1c(S[C@@H](C)C(=O)N2CCC[C@H]2c2cccs2)nc2cc3ccccc3cc2c1=O 26581199 MWBXMNIXHILNMZ-KKSFZXQISA-N 463.628 5.475 5 20 JKBD Cc1ccc([N+](=O)[O-])cc1NC(=O)COC(=O)c1ccc(-c2nc3ccccc3s2)s1 28786269 IECSGORUKDHOGQ-UHFFFAOYSA-N 453.501 5.037 5 20 JKBD O=C(Nc1ccc(NC(=O)c2ccco2)cc1C(F)(F)F)c1ccc(N2CCCC2)c([N+](=O)[O-])c1 105501904 PUONVDGHTGHSPM-UHFFFAOYSA-N 488.422 5.311 5 20 JKBD COc1ccc(/C=C2\N=C(S/C=C/c3ccc([N+](=O)[O-])o3)N(c3cccc(OC)c3)C2=O)cc1 106913052 MXJPHGJPOQJMAA-CVVVEFECSA-N 477.498 5.353 5 20 JKBD C[C@H](Nc1ccc(C(=O)Nc2ccccc2OC[C@@H]2CCCCO2)cc1[N+](=O)[O-])c1ccccn1 108910900 QOERSVPRKXZRAV-ICSRJNTNSA-N 476.533 5.363 5 20 JKBD CCOc1cc(C(=O)N[C@@H]2CCCc3nc(-c4ccc(F)cc4)sc32)c([N+](=O)[O-])cc1OC 303243389 KZHRKSBUZQZRPQ-MRXNPFEDSA-N 471.510 5.072 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)N[C@@H](COc2ccccc2F)c2ccccc2)cc1SC 482751743 KQAGNZHDNXPBBS-SFHVURJKSA-N 456.495 5.015 5 20 JKBD CN(Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1)Cc1cn(-c2ccccc2)nc1-c1cccs1 485372967 BXZIMCDWABHKDC-UHFFFAOYSA-N 472.530 5.191 5 20 JKBD COc1cc(C(=O)N(C)C[C@H]2OCCc3ccccc32)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 506239827 XTTRAYFQQHVFIA-XMMPIXPASA-N 482.920 5.435 5 20 JKBD C[C@@H](Nc1ccc(C(=O)Nc2cc(C(F)(F)F)ccc2-n2cccn2)cc1[N+](=O)[O-])c1ccccn1 507389586 DXSRTUYWMJTNGB-OAHLLOKOSA-N 496.449 5.620 5 20 JKBD O=C(c1ccccc1F)N1CCC(NCc2ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])cc2)CC1 509587222 PQMUSDCMEWXXIR-UHFFFAOYSA-N 483.927 5.574 5 20 JKBD C[C@H](Nc1ccc(C(=O)N(C2CC2)[C@H](C)c2ccccc2Cl)cc1[N+](=O)[O-])c1ccccn1 512099765 NHZBOCNGVHHGOT-DLBZAZTESA-N 464.953 6.182 5 20 JKBD Cc1nc(NC(=O)c2ccn(-c3cccc([N+](=O)[O-])c3)n2)sc1-c1nc2ccccc2n1C(F)F 518227593 JLIUKRDCUOZMLO-UHFFFAOYSA-N 495.471 5.210 5 20 JKBD Cc1ccc(C(C)C)c(Oc2ccc(CNCc3ccccc3S(=O)(=O)N(C)C)cc2[N+](=O)[O-])c1 518271737 LEIWQIKITAYUOC-UHFFFAOYSA-N 497.617 5.359 5 20 JKBD CN(C)[C@@H](CNC(=O)C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)c1ccco1 518748637 KFEFCCFIMVVKBH-TVADFSRQSA-N 476.558 5.147 5 20 JKBD O=C(Cn1c2ccccc2c(=O)c2ccccc21)Nc1ccc(Oc2ccccc2)cc1C(F)(F)F 519083145 SBXONUHGEDGBRJ-UHFFFAOYSA-N 488.465 6.605 5 20 JKBD O=C(Nc1nc(-c2cc(F)ccc2F)cs1)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-] 603728958 ZZZKWYVZVUNRKW-UHFFFAOYSA-N 459.352 5.190 5 20 JKBD C[C@H]1CCC[C@@H](C)N1C(=O)c1cc(Cl)ccc1NCc1nc(-c2ccc([N+](=O)[O-])cc2)no1 604010252 XZWSFPVTVSGXBS-GASCZTMLSA-N 469.929 5.313 5 20 JKBD CCOc1cc(C(=O)N[C@@H](Cc2ccc(Cl)cc2)c2ccccc2)c([N+](=O)[O-])cc1OC 604118945 OKTLIFMLIDRIKJ-FQEVSTJZSA-N 454.910 5.369 5 20 JKBD C[C@H](NCc1ccc(N(C)c2ccccc2)c([N+](=O)[O-])c1)c1nc2ccccc2n1C(F)F 609006323 AHVZJAUFDJJVRY-INIZCTEOSA-N 451.477 5.958 5 20 JKBD CCOc1cc(NC(=O)c2sc(-c3cccc(Cl)c3)nc2C)c([N+](=O)[O-])cc1OCC 619213028 AEPULJKPDKJBRW-UHFFFAOYSA-N 461.927 5.730 5 20 JKBD CCc1cc[n+](/C(C(=S)Nc2ccc(OC(C)C)cc2)=C(/O)c2ccc([N+](=O)[O-])cc2)cc1 726573746 FHTMVIKWCHBOGM-UHFFFAOYSA-O 464.567 5.555 5 20 JKBD O=C(CCCc1nc(-c2ccc(Cl)cc2)no1)N(CC1CC1)c1ccc(Cl)c([N+](=O)[O-])c1 728165981 TYIQSJPTOITXHM-UHFFFAOYSA-N 475.332 5.718 5 20 JKBD O=C(Cc1csc(-c2cccnc2)n1)Oc1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2Cl)cc1 743886819 GZJLYEIEKOWQTL-UHFFFAOYSA-N 494.916 5.167 5 20 JKBD C[C@@H]1CN(c2ccc(NC(=O)CNc3cc([N+](=O)[O-])ccc3Nc3ccccc3)cc2)C[C@@H](C)O1 747449846 MBEAKIQGXNWSRT-RTBURBONSA-N 475.549 5.003 5 20 JKBD O=C1/C(=C/c2ccc(-c3ccccc3[N+](=O)[O-])o2)NC(=S)N1c1ccccc1C(F)(F)F 747968340 CIUAJPFJHMWUFM-PTNGSMBKSA-N 459.405 5.136 5 20 JKBD CC(C)c1noc2ncc(C(=O)O[C@H](C(=O)Nc3ccc(Cl)c([N+](=O)[O-])c3)c3ccccc3)cc12 752938758 ZIEKURJUZYMIKP-NRFANRHFSA-N 494.891 5.445 5 20 JKBD CC(C)c1c(C(=O)O[C@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)cnn1-c1ccc(F)cc1 914670323 YJTDPKCLISIALZ-CQSZACIVSA-N 465.441 5.011 5 20 JKBD CC(=O)N(c1ccc(Cl)cc1)c1nc(COC(=O)CSc2ccc([N+](=O)[O-])cc2)cs1 919038504 YYIULVIVCDBAEI-UHFFFAOYSA-N 477.951 5.225 5 20 JKBD Cc1cc(Cl)ccc1NC(=O)[C@@H](C)OC(=O)c1ccc(N[C@H](C)c2ccccn2)c([N+](=O)[O-])c1 920548161 QEVMJDFUGPZTCU-HZPDHXFCSA-N 482.924 5.309 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)NC1(c2ccc(NC(=O)c3ccc(Cl)nc3)cc2)CCC1 1785758300 NSQZBUPVAVDEID-UHFFFAOYSA-N 482.899 5.152 5 20 JKBD O=C(NC1(c2ccc(NC(=O)[C@@H]3CCCCC3(F)F)cc2)CCC1)c1cc(F)cc([N+](=O)[O-])c1 1786465283 NTOGVFDBMUSXBT-FQEVSTJZSA-N 475.467 5.307 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)c3cccc4ncsc34)CCC2)cc1)c1ccc([N+](=O)[O-])cc1F 1790621742 FDOGMDWTTPBIIP-UHFFFAOYSA-N 490.516 5.405 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)Nc1ccc(C2(NC(=O)c3cccnc3Cl)CCC2)cc1 1790775075 UJOKKKQBWILMKE-UHFFFAOYSA-N 482.899 5.152 5 20 JKBD Cc1ccc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cc(Cl)cc([N+](=O)[O-])c2C)cc1Cl 1800709462 VRXULBSKNZCCBU-BCDXTJNWSA-N 476.360 5.084 5 20 JKBD COc1ccc(Cl)cc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc2cc([N+](=O)[O-])ccc2s1 1801207362 XVHODFCFYCSQSJ-BJWYYQGGSA-N 499.976 5.037 5 20 JKBD O=C(c1ccc(-c2ccc(Cl)cc2)o1)N1CCC2(CCCN(C(=O)c3ccc([N+](=O)[O-])o3)C2)CC1 1804649784 KBAQXMBVZQWEAN-UHFFFAOYSA-N 497.935 5.260 5 20 JKBD O=C(c1cc2ccc(Cl)cc2[nH]1)N1CCCC2(CCN(C(=O)c3cccc(F)c3[N+](=O)[O-])CC2)C1 1804749732 HGNBPPGCZLUBCU-UHFFFAOYSA-N 498.942 5.027 5 20 JKBD Cc1ccc(-c2ccccc2C(=O)Nc2cc([C@@H]3CCCCN3C(=O)c3ccc([N+](=O)[O-])o3)[nH]n2)cc1 1821222797 AMAAWSIESKWCLH-QFIPXVFZSA-N 499.527 5.506 5 20 JKBD CC[C@@H](C(=O)N1CCCC[C@H]1C1CCN(C(=O)/C=C/c2ccc([N+](=O)[O-])o2)CC1)c1ccccc1 1826309558 BDTSFBDKVCHQAD-SZLQQSRFSA-N 479.577 5.015 5 20 JKBD COc1ccc(OC)c([C@@H](C)N[C@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2ccccc2)c1 15509385 HFECAMICHKOKOR-CMJOXMDJSA-N 469.925 5.296 5 20 JKBD COc1ccc(NC(=O)[C@@H](C)Sc2nnc(-c3cccs3)n2Cc2ccccc2)c([N+](=O)[O-])c1 16716139 GPRMWHKMAOJUSB-OAHLLOKOSA-N 495.586 5.091 5 20 JKBD C[C@@H](Sc1nnc(-c2ccco2)n1C1CCCCC1)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 17709625 SZJOEWWYASQZQL-CQSZACIVSA-N 466.523 5.855 5 20 JKBD Cn1c(SCC(=O)N[C@H](c2ccccc2)c2cccs2)nc2cc3ccccc3cc2c1=O 19417888 ZUVKYNAVIPGBCN-XMMPIXPASA-N 471.607 5.146 5 20 JKBD CCNC(=O)COc1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2Sc2ccc(Cl)cc2)cc1 25647650 JTSGUPLGTJZLQN-UHFFFAOYSA-N 485.949 5.167 5 20 JKBD C[C@H](Sc1nc(-c2ccc(Cl)cc2)n[nH]1)C(=O)Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1 28807298 XEWJQPFOSYEZKM-NSHDSACASA-N 486.966 5.276 5 20 JKBD C[C@@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccccc1Oc1ncc(Cl)cc1Cl 58987559 SVLASGOOJPWVSQ-GFCCVEGCSA-N 464.330 6.208 5 20 JKBD COCc1c(C(=O)N(Cc2ccccc2[N+](=O)[O-])CC(F)(F)F)sc2cccc(F)c12 106187962 RLPOUYAHYIIXNG-UHFFFAOYSA-N 456.417 5.300 5 20 JKBD CCCc1ccc([C@@H](NC(=O)c2cc(SC)c(OC)cc2[N+](=O)[O-])c2cccs2)cc1 482019254 XTCOQWUCIUBQDP-JOCHJYFZSA-N 456.589 5.859 5 20 JKBD O=C(Nc1ccccc1)c1ccc(Cl)c(NC(=O)c2csc(-c3ccc([N+](=O)[O-])cc3)n2)c1 496365013 TUDQPEACKBLAJH-UHFFFAOYSA-N 478.917 5.876 5 20 JKBD COc1cc(C(=O)N[C@@H](C)c2ccc3c(c2)CCC(=O)N3)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 500056716 RJUBFAXHSRSKQK-AWEZNQCLSA-N 495.919 5.425 5 20 JKBD CCOc1cc(NC(=O)N[C@@H](C)c2nc(-c3ccccc3)cs2)c([N+](=O)[O-])cc1OCC 503719165 TUXHHNKVKVTAOY-AWEZNQCLSA-N 456.524 5.398 5 20 JKBD CCSc1ccc([C@H](C)NC(=O)c2cc(OC)c(OCc3cscn3)cc2[N+](=O)[O-])cc1 504703786 QBIRVSDERKAMQY-AWEZNQCLSA-N 473.576 5.242 5 20 JKBD CCOc1cc(CNCc2ccc(F)cc2F)ccc1OCc1cc([N+](=O)[O-])cc2c1OCOC2 507912211 FTSCJPQAPPCXGZ-UHFFFAOYSA-N 486.471 5.007 5 20 JKBD CC(C)CCSc1ccc(C(=O)Nc2ccc(CCC(=O)N3CCCC3)cc2)cc1[N+](=O)[O-] 510144034 OXLBRHXMQHUFDR-UHFFFAOYSA-N 469.607 5.540 5 20 JKBD COc1ccc(-n2c(SCCC(=O)Nc3ccc([N+](=O)[O-])cc3C)nnc2-c2ccccc2)cc1 514941799 ULSBIKGVXJHLQB-UHFFFAOYSA-N 489.557 5.280 5 20 JKBD Cc1cc(C)nc(NC(=O)c2c3c(nc4ccccc24)/C(=C/c2cccc([N+](=O)[O-])c2)CCC3)n1 514981875 NMVBBUJPSRLZOK-XMHGGMMESA-N 465.513 5.679 5 20 JKBD CN(C)[C@H](CNCc1ccc(-c2ccc([N+](=O)[O-])cc2Br)o1)c1ccsc1 518767560 HWTMXZHGHRKVBN-GOSISDBHSA-N 450.358 5.071 5 20 JKBD Cc1ccc(Cl)cc1N1CC[C@H](CNC(=O)c2ccc(N[C@@H](C)c3ccccn3)c([N+](=O)[O-])c2)C1 523267221 NKXJPXGQBJRNTH-RBUKOAKNSA-N 493.995 5.381 5 20 JKBD Cc1cc(Br)cc2c1N(C(=O)c1ccc(N[C@@H](C)c3ccccn3)c([N+](=O)[O-])c1)CCC2 524455011 AVYZWUOGSFOFNN-INIZCTEOSA-N 495.377 5.827 5 20 JKBD Cn1cc(/C=C(/CC(=O)O)c2nc3cc(Cl)ccc3s2)c(-c2ccc([N+](=O)[O-])cc2)n1 557433587 AIAXYRJKMACPHU-JYRVWZFOSA-N 454.895 5.274 5 20 JKBD COCCN(C(=O)C1CCN(c2ccccc2[N+](=O)[O-])CC1)[C@@H](C)c1cccc(C(F)(F)F)c1 603529894 HNURRBUBTIFGKA-KRWDZBQOSA-N 479.499 5.066 5 20 JKBD CCOc1cc(NC(=O)c2cccnc2SCc2ccc(F)cc2)c([N+](=O)[O-])cc1OCC 603733626 ITKAURQWWMDBIL-UHFFFAOYSA-N 471.510 5.471 5 20 JKBD CC(=O)N1CCCc2cc(NC(=O)c3ccc(Oc4ccc(Cl)cc4[N+](=O)[O-])cc3)ccc21 604536401 UWJJHJUWLJSZLR-UHFFFAOYSA-N 465.893 5.592 5 20 JKBD CN(CCCc1cc(-c2ccc(F)cc2)no1)C(=O)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-] 604570247 HIHOBFZQDWEKNS-UHFFFAOYSA-N 481.402 5.035 5 20 JKBD CC(C)(C)c1ccc(Oc2ccc(CN[C@@H]3CCCc4c3cnn4CCO)cc2[N+](=O)[O-])cc1 608782026 HDNBDBBOVXPALJ-JOCHJYFZSA-N 464.566 5.041 5 20 JKBD C[C@@H](C[C@H]1CCCO1)NC(=O)c1ccccc1Sc1ccc(C(F)(F)F)cc1[N+](=O)[O-] 608820647 ZFWPVQQHRLHVRG-DZGCQCFKSA-N 454.470 5.452 5 20 JKBD COc1cc(C(=O)Nc2ccc(-c3nc4ccccc4n3C)cc2)c([N+](=O)[O-])cc1OC(F)F 608954513 OKMSZFJAUSPFJK-UHFFFAOYSA-N 468.416 5.011 5 20 JKBD COC(=O)c1sc2ccccc2c1CNC(=O)c1ccc(N[C@@H](C)c2ccccn2)c([N+](=O)[O-])c1 609119555 VLFFGHVUYBCGGX-HNNXBMFYSA-N 490.541 5.094 5 20 JKBD Cc1ccc([C@H](NCc2nc(-c3cccc([N+](=O)[O-])c3)no2)c2ccc(F)cc2Cl)cc1 609385710 DEFMFURWNNWJCR-QFIPXVFZSA-N 452.873 5.625 5 20 JKBD O=C(C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)NC[C@@H]1CCOc2ccccc21 609409198 SHBBOVIZVPIAQT-RVPSJEOCSA-N 485.565 5.818 5 20 JKBD C[C@H](c1ccc(Cl)cc1)N(C)C(=O)CSc1nc2cc3ccccc3cc2c(=O)n1C 613973438 XFSJZVFYBGMIPR-OAHLLOKOSA-N 451.979 5.052 5 20 JKBD C[C@@H](NCc1ccc(Oc2ccccc2Cl)c([N+](=O)[O-])c1)c1ccc(N2CCOC2=O)cc1 725847612 HKTWUGMYKKUITP-MRXNPFEDSA-N 467.909 5.848 5 20 JKBD Cc1nn(-c2ccccc2)c2nc(C(=O)N(CC3CC3)c3ccc(Cl)c([N+](=O)[O-])c3)ccc12 728166823 NYQMFARGVXAMFC-UHFFFAOYSA-N 461.909 5.347 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)OCC(=O)N2c3ccccc3Sc3ccccc32)cc1SC 728658791 YDJSCNRWBVHURV-UHFFFAOYSA-N 482.539 5.312 5 20 JKBD O=C(COC(=O)c1csc(-c2cccc([N+](=O)[O-])c2)n1)Nc1ccc(OCc2ccccc2)cc1 747962823 KGWWUCPKAPLJHV-UHFFFAOYSA-N 489.509 5.093 5 20 JKBD C[C@H]1CCCCN1C(=O)COC(=O)C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1 748579790 XUQBTFYRCYDPRV-WFVLPUPGSA-N 479.558 5.079 5 20 JKBD O=C(CSc1ccc(C(F)(F)F)cc1[N+](=O)[O-])Oc1ccc(Oc2ccccn2)cc1 874991366 BUNSGWVEUSKACY-UHFFFAOYSA-N 450.394 5.499 5 20 JKBD COc1ccc([C@H]2NC(=O)c3sc4ccccc4c3N2)cc1OCc1ccc([N+](=O)[O-])cc1 877854061 MAXWIOJTMULWMN-HSZRJFAPSA-N 461.499 5.251 5 20 JKBD CSc1ccc(C(=O)N2CCC(C(O)(c3ccccc3)c3ccccc3)CC2)cc1[N+](=O)[O-] 912889542 DHNXRKMXRBTEGU-UHFFFAOYSA-N 462.571 5.105 5 20 JKBD Cc1nn(C(C)(C)C)c2nc(C(C)C)cc(C(=O)O[C@H](C)c3nnc(-c4ccc([N+](=O)[O-])cc4)o3)c12 919206181 XWWCSYRASVNEIP-OAHLLOKOSA-N 492.536 5.494 5 20 JKBD O=C(NC1(c2ccc(NC(=O)c3ccc([N+](=O)[O-])o3)cc2)CCC1)c1cc(F)cc(C(F)(F)F)c1 1785751154 RICWKVNITGYFHI-UHFFFAOYSA-N 491.397 5.407 5 20 JKBD O=C(Cc1ccc(Cl)cc1[N+](=O)[O-])Nc1ccc(C2(NC(=O)c3cccnc3Cl)CCC2)cc1 1786114937 PFZNYAFYQLGUMK-UHFFFAOYSA-N 499.354 5.287 5 20 JKBD O=C(/C=C/c1ccc([N+](=O)[O-])o1)Nc1ccc(C2(NC(=O)C[C@H]3C[C@@H]4CC[C@H]3C4)CCC2)cc1 1786208262 UGGNBTNEDBZBKH-LMMUQKOOSA-N 463.534 5.161 5 20 JKBD COc1cccc(C(=O)NC2(c3ccc(NC(=O)Cn4ccc5ccc([N+](=O)[O-])cc54)cc3)CCC2)c1 1786277105 LERPDMQUESJEHP-UHFFFAOYSA-N 498.539 5.006 5 20 JKBD COc1ccc(C(=O)Nc2ccc(C3(NC(=O)CSc4ccccc4[N+](=O)[O-])CCC3)cc2)s1 1787059749 KYDQARQFBWAKDG-UHFFFAOYSA-N 497.598 5.205 5 20 JKBD O=C(Cc1cccc([N+](=O)[O-])c1)NC1(c2ccc(NC(=O)c3cc4cccnc4s3)cc2)CCC1 1788968089 JXSGSXPLNHRATA-UHFFFAOYSA-N 486.553 5.195 5 20 JKBD COc1ccc(CC(=O)NC2(c3ccc(NC(=O)[C@H]4C[C@@H]4c4ccccc4)cc3)CCC2)c([N+](=O)[O-])c1 1791534701 VFZQBFIXAKIKSO-RPBOFIJWSA-N 499.567 5.084 5 20 JKBD Cc1ccn2c(C(=O)NC3(c4ccc(NC(=O)/C=C/c5ccccc5[N+](=O)[O-])cc4)CCC3)cnc2c1 1792317262 IKWARAUFEFAKKC-KPKJPENVSA-N 495.539 5.012 5 20 JKBD Cc1cc(Cl)cc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cc(Cl)cc([N+](=O)[O-])c2C)C3)c1 1803640014 FTYBOCIJTSKUFP-REPLKXPHSA-N 476.360 5.084 5 20 JKBD CC(C)[C@@H](C(=O)N1CCCC2(CCN(C(=O)c3cc(F)cc([N+](=O)[O-])c3)CC2)C1)c1ccccc1 1805623519 PBIIOGIRIGJXPY-XMMPIXPASA-N 481.568 5.019 5 20 JKBD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2cc(F)cc([N+](=O)[O-])c2)[nH]n1)[C@@H]1CCC[C@@H]2CCCC[C@@H]21 1818930899 DJGQUISICRNXDT-GCUYEVCFSA-N 497.571 5.369 5 20 JKBD Cc1c(Cl)cccc1C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2ccc([N+](=O)[O-])cc2F)n[nH]1 1821049042 DIXBLIMQAYWVDH-HXUWFJFHSA-N 485.903 5.039 5 20 JKBD Cc1occc1C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cc3cc([N+](=O)[O-])ccc3s2)n[nH]1 1821609598 HYADUDNEURSELJ-SFHVURJKSA-N 479.518 5.054 5 20 JKBD Cc1csc(Sc2ccc(C(=O)N3CCc4[nH]c5ccccc5c4C3)cc2[N+](=O)[O-])n1 9901056 HZAUEMRQTOMPSQ-UHFFFAOYSA-N 450.545 5.191 5 20 JKBD C[C@H](OC(=O)Cn1c2ccccc2c(=O)c2ccccc21)C(=O)Nc1cccc(Cl)c1Cl 11276511 YXPRDHQLBOEPTG-AWEZNQCLSA-N 469.324 5.032 5 20 JKBD Cc1cc(-c2nc3ccc([N+](=O)[O-])cc3c(-c3ccccc3)c2Cl)c(C)n1[C@H]1CCS(=O)(=O)C1 15454037 CQDOZDWWDNERAF-IBGZPJMESA-N 495.988 5.908 5 20 JKBD O=[N+]([O-])c1ccc(Sc2nnc(CSc3nc4ccccc4s3)n2Cc2ccccc2)nc1 23615168 ZNFDOEVXZISDQP-UHFFFAOYSA-N 492.611 5.683 5 20 JKBD C[C@@H](c1ccc(Cl)cc1Cl)N(C)C(=O)c1ccc(Sc2nncn2C)c([N+](=O)[O-])c1 24456819 SAPUXKJDTOVXEV-NSHDSACASA-N 466.350 5.015 5 20 JKBD COc1cc(C(=O)Nc2ccc3oc(C)nc3c2)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 28320254 BUVTVAUMQXZHAG-UHFFFAOYSA-N 453.838 5.751 5 20 JKBD COCCCn1c(Sc2ccc([N+](=O)[O-])c3cnccc23)nnc1-c1ccccc1Cl 104775879 SPOLFBCXSIIUIG-UHFFFAOYSA-N 455.927 5.243 5 20 JKBD CSc1ccc(C(=O)c2ccccc2C(=O)OCc2noc(-c3cccs3)n2)cc1[N+](=O)[O-] 105245028 MSCGRSWXFFUCEG-UHFFFAOYSA-N 481.511 5.016 5 20 JKBD CCc1cccc2c(C3CCN(C(=O)c4cn(C)nc4-c4ccc([N+](=O)[O-])cc4)CC3)c[nH]c12 410091930 WTIKOTWEIDQIRU-UHFFFAOYSA-N 457.534 5.059 5 20 JKBD O=C(C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)Nc1cccc(-c2cnco2)c1 489000058 IACQUMNVZVXANK-UNOMPAQXSA-N 482.521 6.429 5 20 JKBD O=C(CNC(=O)c1ccccc1Sc1ccc(C(F)(F)F)cc1[N+](=O)[O-])Nc1ccccc1 489363166 OYHWUDKBAAHRRY-UHFFFAOYSA-N 475.448 5.133 5 20 JKBD CCOc1ccccc1Oc1ccc(CNC(=O)c2csc(-c3ccc([N+](=O)[O-])cc3)n2)cn1 496242837 FWTHCCFKUIFPAN-UHFFFAOYSA-N 476.514 5.234 5 20 JKBD Cc1sc(C(=O)Nc2ccc(NS(=O)(=O)c3c(Cl)cccc3Cl)cc2)cc1[N+](=O)[O-] 497881521 GKLYQZBEKLFXTH-UHFFFAOYSA-N 486.358 5.325 5 20 JKBD Cc1nn(Cc2ccc(C(=O)N(C)[C@H](C)c3cccc(C(F)(F)F)c3)cc2)c(C)c1[N+](=O)[O-] 498493931 KYOAJQSCYFSFCZ-OAHLLOKOSA-N 460.456 5.308 5 20 JKBD CCN(CC)[C@H](CNC(=O)c1cc(SC)ccc1[N+](=O)[O-])c1ccc(C(F)(F)F)cc1 502528959 CZZKLDOZBCXOSK-LJQANCHMSA-N 455.502 5.148 5 20 JKBD CC(=O)N(c1nc(Cn2cc(Br)c([N+](=O)[O-])n2)cs1)c1c(C)cc(C)cc1Cl 502857471 QCASUTVDXIMOBC-UHFFFAOYSA-N 484.763 5.013 5 20 JKBD O=C(Nc1ccc(NC(=O)[C@@H]2CCCO2)cc1)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1 503036943 YVESNIQNAARDAC-QFIPXVFZSA-N 481.892 5.410 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Cl)[C@@H](c1ccccc1)N1CCC(OC2CCCC2)CC1 503575107 ZJVOMGHSDIYIKB-HSZRJFAPSA-N 457.958 5.352 5 20 JKBD O=C(NC1CCN(C(=O)c2ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])cc2)CC1)c1ccsc1 510222341 LTIHFYLHFFTEPT-UHFFFAOYSA-N 485.949 5.137 5 20 JKBD C[C@@H](Nc1ccccc1OC[C@@H]1CCCCO1)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 518013031 BWASXFKKZHIZAD-ZBFHGGJFSA-N 467.444 5.001 5 20 JKBD COc1ccc(-c2ccc(CNCc3cn(-c4ccccc4)nc3-c3ccncc3)o2)c([N+](=O)[O-])c1 518785035 JRIAMUKXCYSTOF-UHFFFAOYSA-N 481.512 5.401 5 20 JKBD COc1cc2c(cc1OC)[C@@H](c1cccs1)N(C(=O)Nc1cccc([N+](=O)[O-])c1C)CC2 603645770 YPPCQYHUXRUZDR-QFIPXVFZSA-N 453.520 5.162 5 20 JKBD O=[N+]([O-])c1ccc(-c2ccc(CNCc3ccc(Oc4cccc(F)c4)nc3)o2)c(Br)c1 608837062 XEBYDCSVNFEMMT-UHFFFAOYSA-N 498.308 6.234 5 20 JKBD Cc1ccc(CN(C(=O)c2ccc(C(=O)N(Cc3ccc(C)o3)C3CC3)c([N+](=O)[O-])c2)C2CC2)o1 609044566 LMOCVGBQQPZOEE-UHFFFAOYSA-N 477.517 5.007 5 20 JKBD CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)N[C@@H]1C[C@@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1 609148116 CCUDJVATDNPDDN-FICVDOATSA-N 455.399 5.424 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)N(CC(=O)Nc2ccccc2)c2cc(C)cc(C)c2)cc1SC 609218636 ZGTJJRVOEQTSLW-UHFFFAOYSA-N 479.558 5.228 5 20 JKBD Cc1nnc(SCc2c(C(=O)OCc3cc([N+](=O)[O-])cc4c3OCOC4)oc3ccccc23)s1 742956215 QCRKONKGTZUREZ-UHFFFAOYSA-N 499.526 5.017 5 20 JKBD O=C(Nc1ccccc1C(=O)Nc1ccc(-c2cnc[nH]2)cc1)c1ccc([N+](=O)[O-])cc1Cl 744280593 PQIWHEBXRPJZCD-UHFFFAOYSA-N 461.865 5.143 5 20 JKBD CCCCC[C@H](C)n1c(SCc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)nc2ccccc2c1=O 801024846 ZEDQDDMLZIPYTD-INIZCTEOSA-N 479.562 5.788 5 20 JKBD COc1cc(CNc2ccc([C@@H](O)C(F)(F)F)cc2)ccc1OCc1ccc([N+](=O)[O-])cc1 864043734 NUQLDAYIMRVGAX-JOCHJYFZSA-N 462.424 5.390 5 20 JKBD CC(C)OC(=O)C[C@H](NC(=O)Nc1cccc(C2SCCS2)c1)c1ccccc1[N+](=O)[O-] 915331844 PBNSESHLKZCQSE-SFHVURJKSA-N 475.592 5.278 5 20 JKBD Cc1cc(Br)oc1C(=O)Oc1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2Cl)cc1 916037212 TYLRPKHAOFDJJZ-UHFFFAOYSA-N 479.670 5.384 5 20 JKBD COC(=O)c1ccc2c(=O)nc(/C(Cl)=C\c3ccc(-c4ccc([N+](=O)[O-])cc4Cl)o3)[nH]c2c1 916127472 XLZNXRYMRZJRFA-LICLKQGHSA-N 486.267 5.268 5 20 JKBD O=C(Nc1ccccc1C(=O)OCc1cc(F)ccc1[N+](=O)[O-])c1ccccc1Br 918991955 QTQZNUMZQSGBPU-UHFFFAOYSA-N 473.254 5.106 5 20 JKBD COc1ccc(-c2nn(CN(Cc3ccc([N+](=O)[O-])cc3)C(C)C)c(=S)n2C[C@H]2CCCO2)cc1 919950037 DKZXSQRNLGOZFC-HSZRJFAPSA-N 497.621 5.045 5 20 JKBD C[C@H](Nc1ccc(C(=O)OCC(=O)Nc2ccc3ccccc3c2)cc1[N+](=O)[O-])c1ccccn1 920544604 DGKONLLGMPHFND-KRWDZBQOSA-N 470.485 5.112 5 20 JKBD CC(F)(F)C(C)(C)C(=O)Nc1ccc(C2(NC(=O)Cn3ccc4ccc([N+](=O)[O-])cc43)CCC2)cc1 1786451022 TWUZDOROTQEQKG-UHFFFAOYSA-N 498.530 5.365 5 20 JKBD Cc1nc(C(=O)Nc2ccc(C3(NC(=O)Cc4ccc(Cl)cc4[N+](=O)[O-])CCC3)cc2)cs1 1787524705 PDNOWPJXXSSBFO-UHFFFAOYSA-N 484.965 5.004 5 20 JKBD COc1cc(C(=O)Nc2ccc(C3(NC(=O)/C=C/c4cccs4)CCC3)cc2)ccc1[N+](=O)[O-] 1792164711 RVEAFRHCNXBJBH-ZRDIBKRKSA-N 477.542 5.126 5 20 JKBD COc1cccc(C(=O)NC2(c3ccc(NC(=O)/C=C/c4ccccc4[N+](=O)[O-])cc3)CCC2)c1 1792317429 PHIYAWLVFIEASY-XNTDXEJSSA-N 471.513 5.065 5 20 JKBD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)Cc1ccc(Cl)cc1[N+](=O)[O-])[C@@H]1CCC[C@H]2CCCC[C@H]21 1793079294 PUHWQSBIPAPHLT-CJHLONAUSA-N 488.028 5.035 5 20 JKBD Cc1cccc(CCC(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cc4cc([N+](=O)[O-])ccc4s2)C3)c1 1793969660 BMIBBACGJXWXRY-WKCHPHFGSA-N 477.586 5.003 5 20 JKBD O=C(Cc1ccc(Cl)cc1[N+](=O)[O-])N1CCCC2(CCN(C(=O)c3cc4ccccc4o3)CC2)C1 1805485798 LIUSVDGDLLSFHX-UHFFFAOYSA-N 495.963 5.082 5 20 JKBD COc1cc(C(=O)N2CCCC[C@H]2c2cc(NC(=O)c3cccc4ccccc34)n[nH]2)ccc1[N+](=O)[O-] 1818454516 AXZDFBLEKYPPLJ-QFIPXVFZSA-N 499.527 5.099 5 20 JKBD Cc1cc2cccc(C(=O)N3CCC([C@@H]4CCCCN4C(=O)c4cc(F)cc([N+](=O)[O-])c4)CC3)c2[nH]1 1830616602 DLQSRALSXANMHO-DEOSSOPVSA-N 492.551 5.071 5 20 JKBD O=C([C@H]1CC=CCC1)N1CCC([C@@H]2CCCCN2C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)CC1 1831061091 MFCRTKVQUJRRLQ-UGKGYDQZSA-N 481.618 5.399 5 20 JKBD Cc1cc(O)c([N+](=O)[O-])cc1C(=O)N1CCC([C@@H]2CCCCN2C(=O)C[C@H](C)c2ccccc2)CC1 1831510057 QFBVEVNQFZBDIS-CYFREDJKSA-N 493.604 5.036 5 20 JKBD O=C(Nc1nc(-c2cccnc2)cs1)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1 11811234 YZUFFEGDJSXOMV-UHFFFAOYSA-N 452.879 5.811 5 20 JKBD Cc1ccc([N+](=O)[O-])cc1NC(=O)c1ccc2c(c1)C(=O)N(c1ccc(Cl)c(Cl)c1)C2=O 15629612 CUTUACDCKYEWPX-UHFFFAOYSA-N 470.268 5.263 5 20 JKBD C[C@H](OC(=O)c1ccc(Oc2ccc(C(F)(F)F)cn2)cc1)C(=O)Nc1ccc(F)c([N+](=O)[O-])c1 16169155 OVEBSKBRJDWLRJ-LBPRGKRZSA-N 493.369 5.124 5 20 JKBD Cc1ccc(F)cc1NC(=O)[C@@H](C)OC(=O)c1ccccc1C(=O)c1ccc(Cl)c([N+](=O)[O-])c1 22669857 TYXQGWWWZBJWTP-CQSZACIVSA-N 484.867 5.111 5 20 JKBD O=[N+]([O-])c1ccc(-c2noc(CSc3nnc(Nc4ccc(OC(F)(F)F)cc4)s3)n2)cc1 32935092 ZLJWMJCNLOKNLP-UHFFFAOYSA-N 496.452 5.431 5 20 JKBD Cc1ccc(-c2csc(NC(=O)C3CCN(c4nc5ccccc5o4)CC3)n2)cc1[N+](=O)[O-] 247988050 KYKFUBDBFSCQAI-UHFFFAOYSA-N 463.519 5.023 5 20 JKBD CC[C@@H](NC(=O)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])c(OC)c1)c1nc(C)cs1 303183607 DJPDYKWJTLDWFH-OAHLLOKOSA-N 461.927 5.695 5 20 JKBD COc1ccc(NC(=O)[C@@H](C)Sc2nnc(-c3ccc(F)cc3)c3ccccc23)c([N+](=O)[O-])c1 513241881 MFBBDBXHIRWTQY-CQSZACIVSA-N 478.505 5.472 5 20 JKBD C[C@@H]1CCCCN1CCNC(=O)C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1 518044605 ZOSRSJSOCRHUMA-RILMWAFASA-N 464.591 5.126 5 20 JKBD Cc1ccc(CN(Cc2ccco2)C(=O)c2cc(OCC(F)(F)F)ccc2[N+](=O)[O-])s1 519049534 VRYBBQVFPBEQBI-UHFFFAOYSA-N 454.426 5.341 5 20 JKBD CC(C)(C)n1cc(NC(=O)C/C(=C/c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)cn1 520110828 NDJSICPTZVBFBX-ATVHPVEESA-N 461.547 5.725 5 20 JKBD O=C(Cn1c2ccccc2c(=O)c2ccccc21)Nc1cc(Cl)ccc1C(=O)N1CCCCC1 522960872 ARFKCRAXULNDQC-UHFFFAOYSA-N 473.960 5.073 5 20 JKBD O=C(Nc1cc(Cl)ccc1Cl)[C@H]1CCCCN1C(=O)c1ccc([N+](=O)[O-])cc1Cl 523443647 GKKDEPNAMGEZHI-QGZVFWFLSA-N 456.713 5.188 5 20 JKBD Cc1ncc([N+](=O)[O-])cc1C(=O)Nc1ccccc1OCc1ncc(-c2cccc(Cl)c2)o1 608849926 BJZYNOQTVOHENF-UHFFFAOYSA-N 464.865 5.438 5 20 JKBD Cc1noc(CCCNC(=O)c2c3c(nc4ccccc24)/C(=C/c2ccc([N+](=O)[O-])cc2)CCC3)n1 608965564 ICMAKXCCQCORGQ-KNTRCKAVSA-N 483.528 5.074 5 20 JKBD O=C(Nc1nc2c(s1)COCC2)c1c2c(nc3ccccc13)/C(=C/c1cccc([N+](=O)[O-])c1)CCC2 609022157 GIGPLFGKQSUYNZ-GHRIWEEISA-N 498.564 5.801 5 20 JKBD Cc1cc(Br)cc2c1N(C(=O)c1ccc(Br)c([N+](=O)[O-])c1)CCC2 728180721 CXZUVVWWOZNXEJ-UHFFFAOYSA-N 454.118 5.021 5 20 JKBD C[C@@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)Nc1ccc2c(c1)CCCN2C(=O)OC(C)(C)C 729412867 IKGZZOKFQNTXFQ-CQSZACIVSA-N 475.929 5.342 5 20 JKBD C[C@@H](OC(=O)c1c(NC(=O)C(C)(C)C)sc2c1CCC2)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 746144229 RAEPMCCPISMYDZ-GFCCVEGCSA-N 484.534 5.098 5 20 JKBD C[C@H](Sc1nc(-c2ccc(F)cc2)cs1)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 786589590 BJSGYYWTRKRUMW-JTQLQIEISA-N 471.457 5.996 5 20 JKBD O=C(CCc1nc(-c2ccco2)no1)Nc1cc(Cl)c([N+](=O)[O-])cc1OCc1ccccc1 885673806 WKADBYNWGGYJMG-UHFFFAOYSA-N 468.853 5.042 5 20 JKBD Cc1nc(-c2ccc([C@@H](C)NC(=O)c3cc([N+](=O)[O-])ccc3I)cc2)cs1 915294098 RJCMPRCTPBELPS-LLVKDONJSA-N 493.326 5.122 5 20 JKBD CCN(Cc1ccccc1)C(=O)c1cc(NC(=O)c2cc(Cl)ccc2[N+](=O)[O-])ccc1Cl 917765933 BICIJYYCOAGOOF-UHFFFAOYSA-N 472.328 5.816 5 20 JKBD C[C@H](OC(=O)c1ccc(N[C@H](C)c2ccccn2)c([N+](=O)[O-])c1)c1nc2ccccc2n1C(F)F 919684210 IQRFMVURNFIIRN-CABCVRRESA-N 481.459 5.826 5 20 JKBD COc1ccc2ccc(OC(=O)c3cc(OC)c(OCc4cscn4)cc3[N+](=O)[O-])cc2c1 919883629 KWJPSWWUEPVNFU-UHFFFAOYSA-N 466.471 5.020 5 20 JKBD O=C(Oc1ccc(-c2ccccc2)cc1[N+](=O)[O-])c1nc(NCc2ccco2)ncc1Cl 920331086 VKOVIAIEKOQLSN-UHFFFAOYSA-N 450.838 5.130 5 20 JKBD Cc1ccc(C(=O)Nc2ccc(C3(NC(=O)/C=C/c4ccccc4[N+](=O)[O-])CCC3)cc2)nc1C 1787172718 XEWISEDFGHWMSA-OQLLNIDSSA-N 470.529 5.068 5 20 JKBD CCCc1onc(C)c1C(=O)Nc1ccc(C2(NC(=O)Cc3ccc(C)c([N+](=O)[O-])c3)CCC2)cc1 1788778441 GVKYJPICNBYYQI-UHFFFAOYSA-N 490.560 5.143 5 20 JKBD Cc1cccc(-c2cnccc2C(=O)NC2(c3ccc(NC(=O)c4ccc([N+](=O)[O-])[nH]4)cc3)CCC2)c1 1790185318 OROQOFLBTVXSTJ-UHFFFAOYSA-N 495.539 5.355 5 20 JKBD O=C(/C=C/c1ccc([N+](=O)[O-])o1)NC1(c2ccc(NC(=O)c3cccc(Cl)c3)cc2)CCC1 1790262567 JAAIAMYZZBNZBI-PKNBQFBNSA-N 465.893 5.302 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)C3CCC(F)(F)CC3)CCC2)cc1)c1cccc(F)c1[N+](=O)[O-] 1790699776 KEHBAXNRJAZVDK-UHFFFAOYSA-N 475.467 5.307 5 20 JKBD C[C@H](C(=O)NC1(c2ccc(NC(=O)CSc3ccccc3[N+](=O)[O-])cc2)CCC1)c1ccccn1 1791523287 OMMJYYNUMUHUSB-SFHVURJKSA-N 490.585 5.020 5 20 JKBD C/C(=C\c1cccnc1)C(=O)Nc1ccc(C2(NC(=O)Cc3ccc(C)c([N+](=O)[O-])c3)CCC2)cc1 1791852573 CSNNCNISXTWJAO-HMMYKYKNSA-N 484.556 5.078 5 20 JKBD O=C(CCc1ccccc1Cl)N1CCC2(CCCN(C(=O)CCc3cccc([N+](=O)[O-])c3)C2)CC1 1806491244 AQTJXQQLSNSFPV-UHFFFAOYSA-N 498.023 5.045 5 20 JKBD Cc1c(C(=O)N2CCCC[C@H]2c2cc(NC(=O)[C@@H]3CCC(F)(F)C3)n[nH]2)cc(Cl)cc1[N+](=O)[O-] 1814389908 YFPKQWRVJKEBBR-DYVFJYSZSA-N 495.914 5.021 5 20 JKBD O=C(c1ccc(Cl)c(Cl)c1)N1CCC([C@H]2CCCCN2C(=O)c2ccc([N+](=O)[O-])o2)CC1 1823613624 GRFQJEQLRAJZFK-GOSISDBHSA-N 480.348 5.042 5 20 JKBD O=C(c1ccc(Cl)o1)N1CCC([C@@H]2CCCCN2C(=O)C2(c3cccc([N+](=O)[O-])c3)CCC2)CC1 1830292815 GTNIYOKLGOFTCM-NRFANRHFSA-N 499.995 5.196 5 20 JKBD C[C@@H](CC(=O)N1CCCC[C@@H]1C1CCN(C(=O)Cc2cc(F)ccc2[N+](=O)[O-])CC1)c1ccccc1 1831509653 FNNJOEZHXPKRFV-NBGIEHNGSA-N 495.595 5.090 5 20 JKBD CCN(CC)C(=O)c1ccc(NC(=O)CSc2nc3ccccc3c3nc4ccccc4n23)cc1 8760809 OIZIFCYKDUKIEA-UHFFFAOYSA-N 483.597 5.249 5 20 JKBD COc1cc(C(=O)Nc2ccc(NC(=O)C(C)C)cc2)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 11713515 JNHGSDCFLRBVMF-UHFFFAOYSA-N 483.908 5.896 5 20 JKBD Cc1cc(CSc2ccccc2C(=O)O[C@@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)on1 16698764 IYEFQVVLDHRIPB-AWEZNQCLSA-N 466.475 5.152 5 20 JKBD C[C@H](OC(=O)c1cc(-c2cccs2)nc2ccccc12)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 17717540 ABXCUVVXBOJKIT-AWEZNQCLSA-N 472.482 5.840 5 20 JKBD C[C@H](OC(=O)c1ccccc1SCc1cccs1)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 17939132 JQIHXTFSQVNFOQ-AWEZNQCLSA-N 467.528 5.917 5 20 JKBD O=C(COC(=O)c1ccc(Br)c([N+](=O)[O-])c1)Nc1c(Cl)cc(Cl)cc1Cl 22671006 DUJQXEIJZVNXBR-UHFFFAOYSA-N 482.501 5.113 5 20 JKBD CC(C)c1cccc(N(C)C(=O)c2ccccc2NC(=O)c2ccc([N+](=O)[O-])cc2Cl)c1 109056683 HKENCVQRKHVRIQ-UHFFFAOYSA-N 451.910 5.901 5 20 JKBD Cc1cc(C(=O)N2CCSCC2)ccc1NC(=O)c1ccc(Nc2ccccc2)c([N+](=O)[O-])c1 110134841 QNGCVBDIANUGBM-UHFFFAOYSA-N 476.558 5.088 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)N[C@H](Cc2cccc(F)c2)c2cccc(F)c2)cc1SC 112532372 PEUIJCDLONGQGW-LJQANCHMSA-N 458.486 5.317 5 20 JKBD O=C(CSc1ccc(C(F)(F)F)cc1[N+](=O)[O-])Nc1ccc(S(=O)(=O)C2CCCC2)cc1 482283525 CBIMGLKFTBOYTI-UHFFFAOYSA-N 488.509 5.061 5 20 JKBD C[C@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)N[C@@H](Cn1cnc2ccccc21)c1ccc(F)cc1 484051111 WMAUVJZGKRWVQB-AOMKIAJQSA-N 464.522 5.122 5 20 JKBD CCC(=O)N[C@H]1CCCN(C(=O)c2c3c(nc4ccccc24)/C(=C\c2cccc([N+](=O)[O-])c2)CCC3)C1 499568439 BPTHAFULPYGFQM-LDETYFQJSA-N 498.583 5.151 5 20 JKBD COc1cc(CCNC(=O)[C@@H](Sc2ccc(F)c(F)c2)c2ccccc2)c([N+](=O)[O-])cc1OC 499679250 UBFDQHAPKDMDFL-QHCPKHFHSA-N 488.512 5.083 5 20 JKBD COc1cc(C(=O)Nc2ccccc2NC(=O)c2ccc(C(C)(C)C)cc2)c([N+](=O)[O-])cc1OC 500763375 WFCOLJJNLKPQNU-UHFFFAOYSA-N 477.517 5.414 5 20 JKBD O=C(Nc1cc([N+](=O)[O-])ccc1OC(F)F)NC1CCN(Cc2cccc(C(F)(F)F)c2)CC1 511541670 SZJMNRKBFTXTCY-UHFFFAOYSA-N 488.413 5.001 5 20 JKBD COc1ccc([C@@H]2CCCN2C(=O)C/C(=C\c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)cc1 515004958 KTIRXZJFIILAKX-RUYOUXBXSA-N 499.592 6.508 5 20 JKBD Cc1ccccc1OCCCC(=O)Nc1ccc(CNC(=O)c2ccc([N+](=O)[O-])cc2Cl)cc1 515161481 VDYKRKISAOBPBZ-UHFFFAOYSA-N 481.936 5.284 5 20 JKBD COc1ccc(CNC[C@H]2CCCO[C@H]2c2ccccc2)cc1OCc1ccc([N+](=O)[O-])cc1 517549451 URVZDNZVOGEURP-KCWPFWIISA-N 462.546 5.440 5 20 JKBD O=C(c1ccc(Sc2nc3ccccc3s2)c([N+](=O)[O-])c1)N(Cc1ccncc1)C1CC1 520864501 WVXAPAOYQQGDAF-UHFFFAOYSA-N 462.556 5.556 5 20 JKBD CC(=O)NC1CCC(NC(=O)c2c3c(nc4ccccc24)/C(=C/c2cccc([N+](=O)[O-])c2)CCC3)CC1 570908932 PMZPUUWSAPCHGY-CAPFRKAQSA-N 498.583 5.197 5 20 JKBD COc1ccc(CSc2nnc(SCCC(=O)Nc3ccc([N+](=O)[O-])cc3C)s2)cc1 602212379 HBINUTSQZGUASI-UHFFFAOYSA-N 476.605 5.177 5 20 JKBD COc1ccc(CSc2nnc(-c3ccc(Cl)cc3)n2Cc2ccco2)cc1[N+](=O)[O-] 603722740 XNYPBRAHTROODJ-UHFFFAOYSA-N 456.911 5.449 5 20 JKBD Cc1c(NC(=O)[C@H](C)Sc2ccc([N+](=O)[O-])cc2)cccc1-c1nnc2n1CCCCC2 603962166 HSHPSFJCRNOTAT-INIZCTEOSA-N 451.552 5.007 5 20 JKBD COc1cc(C(=O)Nc2nc(C)c(Cc3cccc(C)c3)s2)c([N+](=O)[O-])cc1OC(F)F 603974491 WVYRFPHZLCKRJD-UHFFFAOYSA-N 463.462 5.121 5 20 JKBD O=C(Nc1ccccc1Oc1ncc(Cl)cc1Cl)c1cc([N+](=O)[O-])cc2c1OCCO2 608938131 WNXDXSWRFSHOAJ-UHFFFAOYSA-N 462.245 5.112 5 20 JKBD O=C(Nc1cc([N+](=O)[O-])ccc1OC(F)F)c1nc(-c2ccccc2)oc1-c1ccccc1 609425987 KPSVQHCKQXRDDO-UHFFFAOYSA-N 451.385 5.771 5 20 JKBD COCCN(Cc1cccs1)C(=O)C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1 619211467 JNGLVMKCSWVUHD-XDJHFCHBSA-N 493.610 5.872 5 20 JKBD CC(=O)c1ccc(Sc2nnc(-c3cccnc3)n2-c2ccc(Br)cc2)c([N+](=O)[O-])c1 619685663 ZCBKTGBHOCFJRF-UHFFFAOYSA-N 496.346 5.354 5 20 JKBD CSc1ccc(C(=O)c2ccccc2C(=O)OCc2nc(-c3ccsc3)oc2C)cc1[N+](=O)[O-] 726804008 RDSUKHOKUHKSPT-UHFFFAOYSA-N 494.550 5.930 5 20 JKBD CC(C)[C@@H](Sc1ccccc1)C(=O)O[C@@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 727212930 SGVMUKSENIAQRU-SCLBCKFNSA-N 470.469 5.301 5 20 JKBD COc1ccccc1[C@@H](Nc1ccc(C(=O)Nc2ccc(C)cc2)cc1[N+](=O)[O-])c1nccn1C 727431766 VOVJLBICXQBIJA-XMMPIXPASA-N 471.517 5.099 5 20 JKBD Cc1nc2ccc(C(=O)O[C@H](C(=O)Nc3ccc([N+](=O)[O-])cc3Cl)c3ccccc3)cc2nc1C 746180556 RAQFLWHDBRVZHX-QHCPKHFHSA-N 490.903 5.345 5 20 JKBD CCN(C(=O)COC(=O)c1csc(-c2cccc([N+](=O)[O-])c2)n1)c1cccc2ccccc12 747964268 XECLWXHSKUGZSC-UHFFFAOYSA-N 461.499 5.081 5 20 JKBD O=C(O[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1)c1ccc(O)c(Cl)c1 848950443 UCWAOCSGSOWPPE-LJQANCHMSA-N 461.257 5.144 5 20 JKBD Cc1nn(Cc2ccc(C(=O)Nc3ccccc3SC(F)(F)F)cc2)c(C)c1[N+](=O)[O-] 916060762 DYNQLVHDGDIASW-UHFFFAOYSA-N 450.442 5.321 5 20 JKBD O=[N+]([O-])c1ccc(/C(O)=C(/C(=S)Nc2ccc(Cl)cc2)[n+]2ccc3c(c2)CCCC3)cc1 916204457 RWVQTTUQFUIXAC-UHFFFAOYSA-O 466.970 5.738 5 20 JKBD O=C(CNc1ccc(Oc2ncc(Cl)cc2Cl)cc1)N1CCc2ccc([N+](=O)[O-])cc21 917819389 RSOKFVNSTRDAGO-UHFFFAOYSA-N 459.289 5.090 5 20 JKBD COc1ccc(N[C@@H](C)C(=O)Nc2ccccc2[N+](=O)[O-])cc1NC(=O)c1ccc(Cl)cc1F 917939935 WPNZCADKENFGRE-ZDUSSCGKSA-N 486.887 5.087 5 20 JKBD O=C(CCc1ccc(-c2ccccc2)[nH]1)Oc1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2Cl)cc1 917952667 DLOKUUOQBUIOMR-UHFFFAOYSA-N 489.915 6.034 5 20 JKBD CC(C)c1ccc(SCC(=O)OCC(=O)Nc2ccc([N+](=O)[O-])cc2C(F)(F)F)cc1 919320959 PHBWNBGZRMMADP-UHFFFAOYSA-N 456.442 5.011 5 20 JKBD COc1ccc([N+](=O)[O-])c(C(=O)OCC(=O)N2c3ccccc3Sc3ccc(Cl)cc32)c1 920704716 DAIUQRKWLTYJQB-UHFFFAOYSA-N 470.890 5.243 5 20 JKBD O=C(/C=C/c1cccnc1)NC1(c2ccc(NC(=O)Cc3ccc(Cl)cc3[N+](=O)[O-])cc2)CCC1 1786114929 OBHHKDYNEYEUHB-NYYWCZLTSA-N 490.947 5.033 5 20 JKBD CN(C)c1ccc([N+](=O)[O-])c(C(=O)NC2(c3ccc(NC(=O)C(C)(C)C(C)(F)F)cc3)CCC2)c1 1786454658 WHHPITOCPIEOMH-UHFFFAOYSA-N 488.535 5.090 5 20 JKBD Cc1ccc(C(=O)NC2(c3ccc(NC(=O)c4ccc(Br)c([N+](=O)[O-])c4)cc3)CCC2)o1 1790642264 MWWVLIDIGSFTDY-UHFFFAOYSA-N 498.333 5.320 5 20 JKBD Cc1cc(CC(=O)Nc2ccc(C3(NC(=O)c4cc5cc([N+](=O)[O-])ccc5s4)CCC3)cc2)no1 1791804955 MKUWAGDLTLEBBE-UHFFFAOYSA-N 490.541 5.096 5 20 JKBD C[C@H](Cc1ccccn1)C(=O)NC1(c2ccc(NC(=O)/C=C/c3ccccc3[N+](=O)[O-])cc2)CCC1 1792319180 JGIYJAUQNFNLFY-XMUSRXTASA-N 484.556 5.016 5 20 JKBD Cc1scc(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)CSc3ccccc3[N+](=O)[O-])n[nH]2)c1C 1822312779 QHKDTMGUPZKDER-GOSISDBHSA-N 499.618 5.094 5 20 JKBD CC(C)/C=C/C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)[nH]n1 1823092302 PSCMUZWYVZDWRS-AHKGRUIUSA-N 467.551 5.051 5 20 JKBD Cc1ccc(C(=O)N2CCC([C@@H]3CCCCN3C(=O)c3cc(Cl)cc([N+](=O)[O-])c3C)CC2)o1 1830734568 NRSORYHZUOQHRW-FQEVSTJZSA-N 473.957 5.005 5 20 JKBD O=C(c1cc2cc(F)ccc2s1)N1CC2(CCCN2C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)C1 1845739126 NFPIOWHCJLNSQG-UHFFFAOYSA-N 495.557 5.294 5 20 JKBD CCCn1c(S[C@@H](C)C(=O)Nc2cc([N+](=O)[O-])ccc2Cl)nnc1-c1ccc(Cl)cc1 9139099 LZKAFCKWCFUGBZ-LBPRGKRZSA-N 480.377 5.689 5 20 JKBD O=C(O[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1)c1ccc(Br)o1 10800527 SVSQRFKAEMPWTQ-KRWDZBQOSA-N 479.670 5.141 5 20 JKBD C[C@H](NC(=O)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1)c1ccc(-n2cncn2)cc1 11407283 LUAJXWCAJWZVIE-HNNXBMFYSA-N 463.881 5.112 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Cl)[C@@H](OC(=O)[C@H]1Cc2cc(Cl)ccc2O1)c1ccccc1 12643527 SBNOAMUWYBTQCG-RTWAWAEBSA-N 487.295 5.128 5 20 JKBD O=C(Cn1c2ccccc2c(=O)c2ccccc21)Nc1nc(-c2ccc(Br)cc2)cs1 14808413 SOXAZIIDHZXHLX-UHFFFAOYSA-N 490.382 5.679 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Cl)[C@H](N[C@@H]1CCSc2ccccc21)c1ccccc1 19669688 ZUWWHHIPMZXVGG-DENIHFKCSA-N 453.951 5.755 5 20 JKBD O=[N+]([O-])c1cc(S(=O)(=O)N2CCCCCC2)ccc1Sc1nnc(-c2ccc(Cl)cc2)o1 20666967 LJOSLEXZNDSPQL-UHFFFAOYSA-N 494.982 5.014 5 20 JKBD COc1cc2c(cc1OC)[C@@H](c1ccccc1)N(C(=O)c1cc(SC)ccc1[N+](=O)[O-])CC2 24475934 HISDRUWAZZEUOJ-XMMPIXPASA-N 464.543 5.122 5 20 JKBD CC[C@@H](C)Sc1ccc(NC(=O)c2cc([N+](=O)[O-])cc(S(C)(=O)=O)c2)c(C(F)(F)F)c1 68813040 MHTBSUAJIXDMKY-LLVKDONJSA-N 476.498 5.160 5 20 JKBD CC(C)[C@@H](NC(=O)CSc1ccc(C(F)(F)F)cc1[N+](=O)[O-])c1nc2ccccc2[nH]1 104723618 UHPGDVRBXDRFHQ-GOSISDBHSA-N 452.458 5.096 5 20 JKBD CN(C(=O)c1ccc(NC(=O)c2cc3cccc([N+](=O)[O-])c3[nH]2)cc1Cl)C1CCCCC1 488692141 BPOXMWKILLFCRB-UHFFFAOYSA-N 454.914 5.387 5 20 JKBD C[C@H](NC(=O)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1)c1cccc(OC(F)F)c1 515127609 DSNCQPFEDFFMOZ-ZDUSSCGKSA-N 487.425 5.309 5 20 JKBD COCCOc1ccc(NC(=O)c2ccc(NCc3ccccc3Cl)c([N+](=O)[O-])c2)c(C)c1 603977351 RYQMBCBKYSVNDN-UHFFFAOYSA-N 469.925 5.446 5 20 JKBD C[C@@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)N[C@H](C)c1ccc(NC(=O)Nc2ccccc2)cc1 604446128 DVIMBDKVJDYGIF-HZPDHXFCSA-N 482.924 5.537 5 20 JKBD O=C(C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)N1CCC[C@H](n2ccnc2)C1 609131696 VGVBXVPPILTXEK-PHJXOXRPSA-N 473.558 5.195 5 20 JKBD O=C(C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)NC[C@H]1CCOc2ccccc21 609409197 SHBBOVIZVPIAQT-NGYXKBBWSA-N 485.565 5.818 5 20 JKBD O=C(c1cc(Cl)cc(Cl)c1)N1CCN(C(=O)c2cc3ccccc3c3cccnc23)CC1 643140953 YVFKEMSTLXQKIV-UHFFFAOYSA-N 464.352 5.293 5 20 JKBD C[C@@H](OC(=O)c1csc(-c2cccc([N+](=O)[O-])c2)n1)C(=O)Nc1ccc(Cl)cc1Cl 747961896 AASZVDKXRFXJHW-SNVBAGLBSA-N 466.302 5.209 5 20 JKBD CCN(Cc1ccccc1)c1ccc(C(=O)N(Cc2nnc(-c3cccc([N+](=O)[O-])c3)o2)C(C)C)cc1 748606327 GKTUOASSJWLESF-UHFFFAOYSA-N 499.571 5.722 5 20 JKBD O=C(CSC1=N/C(=C\c2ccccc2)C(=O)N1c1ccc(F)cc1)c1ccc([N+](=O)[O-])cc1 849191809 WEYSHZVJOICMQW-STZFKDTASA-N 461.474 5.094 5 20 JKBD CC(C)Cn1cc([C@@H]2N(Cc3ccc(-c4ccc([N+](=O)[O-])cc4)s3)CC23CCOCC3)cn1 849479443 QYDPELSHMAZPCZ-DEOSSOPVSA-N 466.607 5.530 5 20 JKBD CC(C)N(Cc1nnc(-c2cccc([N+](=O)[O-])c2)o1)C(=O)c1ccc(CSc2ccccc2)cc1 864244673 IMMJEKJNZOZEBP-UHFFFAOYSA-N 488.569 5.988 5 20 JKBD O=C(NC[C@@H](c1ccccc1Cl)c1c[nH]c2ccccc12)C(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1 915719729 RBYPEWLWWBLETD-KRWDZBQOSA-N 497.338 5.270 5 20 JKBD Cc1noc(C)c1CSCC(=O)Nc1cc(Cl)c([N+](=O)[O-])cc1OCc1ccccc1 916827254 CWYDLBRVFKDVSG-UHFFFAOYSA-N 461.927 5.304 5 20 JKBD COC(=O)c1ccc(OCC(=O)N2c3ccccc3Sc3ccc(Cl)cc32)c([N+](=O)[O-])c1 918046145 RZHITOUONVNEOW-UHFFFAOYSA-N 470.890 5.243 5 20 JKBD C[C@@H](OC(=O)c1cc([N+](=O)[O-])ccc1Oc1ccccc1)C(=O)N1CCC[C@@H]1c1cccs1 919191531 GCWBLIDQZKMBSW-OXQOHEQNSA-N 466.515 5.358 5 20 JKBD CC(=O)Nc1cccc([C@@H](C)OC(=O)Cc2cn(-c3ccccc3)nc2-c2ccc([N+](=O)[O-])cc2)c1 920264826 YTZDLCQEKRRSRS-GOSISDBHSA-N 484.512 5.253 5 20 JKBD Cc1cc(C(=O)NC2(c3ccc(NC(=O)/C=C/c4ccc([N+](=O)[O-])o4)cc3)CCC2)ccc1F 1786207745 LNBISAKHBNNPHQ-DHZHZOJOSA-N 463.465 5.096 5 20 JKBD CCc1ncccc1C(=O)Nc1ccc(C2(NC(=O)c3c(F)ccc([N+](=O)[O-])c3C)CCC2)cc1 1787094298 LJEAHYDQPLSOJM-UHFFFAOYSA-N 476.508 5.061 5 20 JKBD Cc1cccc2[nH]c(C(=O)NC3(c4ccc(NC(=O)c5ccc(O)c([N+](=O)[O-])c5)cc4)CCC3)cc12 1790619529 CFFPLMBBAZEWBU-UHFFFAOYSA-N 484.512 5.152 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)Nc1ccc(C2(NC(=O)c3cnccc3Cl)CCC2)cc1 1790772492 WCAQRFGZBVMUPB-UHFFFAOYSA-N 482.899 5.152 5 20 JKBD CCOc1ccsc1C(=O)NC1(c2ccc(NC(=O)Cc3ccc([N+](=O)[O-])cc3F)cc2)CCC1 1791182112 ICAQGIXAQFYWEK-UHFFFAOYSA-N 497.548 5.185 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2ccc(Cl)cc2)n[nH]1 1820563539 JTWWZWAJEJLKBH-LJQANCHMSA-N 485.903 5.039 5 20 JKBD Cc1ccc(C(=O)N2CCCC[C@H]2C2CCN(C(=O)c3cc(Cl)cc([N+](=O)[O-])c3C)CC2)c(C)n1 1829533454 RGEPTSPYDGJDKL-QHCPKHFHSA-N 499.011 5.116 5 20 JKBD O=C(CCc1ncc(-c2ccc(F)cc2F)o1)Oc1ccc(NC(=O)c2cccc([N+](=O)[O-])c2)cc1 12832682 OXLXHRBBQSPJHS-UHFFFAOYSA-N 493.422 5.319 5 20 JKBD COc1cc(C(=O)N2CCN(Cc3ccsc3)CC2)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 17814046 SCQZNCXSYDREJR-UHFFFAOYSA-N 487.965 5.069 5 20 JKBD Cc1ccc(OCc2nc(CC(=O)Nc3nc(-c4cccc([N+](=O)[O-])c4)cs3)cs2)cc1 18184545 SWRDFIYPBLKMCB-UHFFFAOYSA-N 466.544 5.243 5 20 JKBD O=c1c2ccccc2nc(SCc2nc3ccccc3c3ccccc23)n1C[C@H]1CCCO1 20057391 AEVWNNASUDEZIT-GOSISDBHSA-N 453.567 5.569 5 20 JKBD CCn1c(SCC(=O)Nc2ccccc2C(F)(F)F)nc2cc3ccccc3cc2c1=O 22177911 DUKBGFLOWGADLM-UHFFFAOYSA-N 457.477 5.319 5 20 JKBD CCCc1ccc([C@H](NC(=O)CCCn2c(=O)oc3cc([N+](=O)[O-])ccc32)c2cccs2)cc1 24136451 GPZLCYNXERZCRH-DEOSSOPVSA-N 479.558 5.203 5 20 JKBD Cc1csc(Sc2ccc(C(=O)Nc3ccccc3C(=O)N3CCCCC3)cc2[N+](=O)[O-])n1 27917740 OMAGEBPYKGZVAO-UHFFFAOYSA-N 482.587 5.389 5 20 JKBD COc1ccc([N+](=O)[O-])cc1NC(=O)[C@H](C)OC(=O)c1ccc(-c2nc3ccccc3s2)s1 28305193 CAQYKZFIDFNXOQ-LBPRGKRZSA-N 483.527 5.126 5 20 JKBD O=C(NCc1ccc(Cn2ccnc2)cc1)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1 30219981 JQGKCGVKUQADGX-UHFFFAOYSA-N 462.893 5.215 5 20 JKBD C[C@@H](NC(=O)Cn1c2ccccc2c(=O)c2ccccc21)c1ccc(NC(=O)c2ccc(F)cc2)cc1 68737312 QDMYZXKEMLGREO-LJQANCHMSA-N 493.538 5.424 5 20 JKBD O=[N+]([O-])c1ccccc1CN(Cn1nc(C2CC2)n(-c2ccccc2)c1=S)CC(F)(F)F 71966578 GGFKMJUPDCDYLH-UHFFFAOYSA-N 463.485 5.211 5 20 JKBD Cc1ccc(-c2csc(NC(=O)c3sc(NC(=O)c4ccco4)cc3C)n2)cc1[N+](=O)[O-] 105456164 MILHXEUAQKGNKK-UHFFFAOYSA-N 468.516 5.494 5 20 JKBD Cc1ccc(NC(=O)c2ccc(N[C@H](C)c3ccccn3)c([N+](=O)[O-])c2)c(OC[C@H]2CCCO2)c1 108891230 VQDMKPRJCPVBLQ-UYAOXDASSA-N 476.533 5.281 5 20 JKBD O=C(Cn1c2ccccc2c(=O)c2ccccc21)Nc1ccc(-c2nc3ccccc3s2)cn1 218220933 QQATYGPKHHUKPV-UHFFFAOYSA-N 462.534 5.465 5 20 JKBD Cc1sc(NC(=O)c2cc(N3CCCC3=O)cc(C(F)(F)F)c2)nc1-c1cccc([N+](=O)[O-])c1 476800094 FRSKHGHXYCUOIQ-UHFFFAOYSA-N 490.463 5.425 5 20 JKBD CCOc1cc(Br)c(NC(=O)c2cc(SC)c(OC)cc2[N+](=O)[O-])cc1OCC 483346789 IAHOVIHPNVXIAD-UHFFFAOYSA-N 485.356 5.138 5 20 JKBD COc1ccc([C@@H](NC(=O)CCOc2ccccc2[N+](=O)[O-])c2ccccc2)cc1Br 485348271 HFCUCLDNIYPMPY-QHCPKHFHSA-N 485.334 5.041 5 20 JKBD Cc1occc1-c1nnc(S[C@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)n1-c1ccccc1 501212038 YURWNKJSQRKJPR-OAHLLOKOSA-N 474.502 5.647 5 20 JKBD O=C(Nc1cccc(OCc2cccnc2)c1)c1cc([N+](=O)[O-])ccc1Sc1ccccc1 502087599 NHVODSHUHUUKPO-UHFFFAOYSA-N 457.511 5.972 5 20 JKBD C[C@H](Nc1ccc(C(=O)NCC(c2ccccc2)c2ccccc2)cc1[N+](=O)[O-])c1ccccn1 506022248 REQVAJDPDQXFOH-FQEVSTJZSA-N 466.541 5.725 5 20 JKBD CC(C)Oc1ccc([N+](=O)[O-])cc1CSc1nnc(-c2ccccc2Br)o1 511043546 NLBRICOZOWWZJC-UHFFFAOYSA-N 450.314 5.487 5 20 JKBD CCc1cccc(Cc2cnc(NC(=O)c3cc(OC)c(OC(F)F)cc3[N+](=O)[O-])s2)c1 514577765 UDZCGUKCZBGNMH-UHFFFAOYSA-N 463.462 5.067 5 20 JKBD CNC(=O)c1ccc(NC(=O)c2ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])cc2)cc1Cl 515728429 ZAOSBRUQXFLBGQ-UHFFFAOYSA-N 460.273 5.306 5 20 JKBD CN(Cc1cscn1)C(=O)C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1 517936697 XHSZQWFKOSAYFD-YBEGLDIGSA-N 450.545 5.250 5 20 JKBD Cc1cnn([C@@H]2CCCc3ccccc32)c1NC(=O)c1csc(-c2ccc([N+](=O)[O-])cc2)n1 524418376 NPDFBKWCYGCVPN-OAQYLSRUSA-N 459.531 5.401 5 20 JKBD COc1ccc(Oc2ccc(Cl)cc2NC(=O)c2cc(OC)c(OC(F)F)cc2[N+](=O)[O-])cc1 585700686 KCYHRUBWHPDTNK-UHFFFAOYSA-N 494.834 5.911 5 20 JKBD O=C(Nc1nc(-c2ccncc2)cs1)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1 603454696 FCQXWUGMMHBJFV-UHFFFAOYSA-N 452.879 5.811 5 20 JKBD C[C@H](c1cccc(Cl)c1)N(C)C(=O)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 603512314 HEQORISUXOFVQH-CQSZACIVSA-N 469.891 5.703 5 20 JKBD O=C(Nc1ccc(NC(=O)C2CC2)cc1C(F)(F)F)c1csc(-c2cccc([N+](=O)[O-])c2)n1 604517130 PTMGBNHEFYVAHF-UHFFFAOYSA-N 476.436 5.338 5 20 JKBD COc1ccccc1[C@@H]1CCCN1C(=O)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 609036845 RHDFGWZWZVPDDM-IBGZPJMESA-N 477.483 5.202 5 20 JKBD CCC(CC)c1cc[n+](/C(C(=S)N[C@@H](C)c2cccs2)=C(/O)c2ccc([N+](=O)[O-])cc2)cc1 726578567 FXLGUTNAHGQLAA-KRWDZBQOSA-O 482.651 6.409 5 20 JKBD CCOc1ccc(OCC)c(NC(=S)/C(=C(/O)c2ccc(C)c([N+](=O)[O-])c2)[n+]2cccc(C)c2)c1 726963415 NKSJEVRIZYRRFP-UHFFFAOYSA-O 494.593 5.620 5 20 JKBD O=C(N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OCc1csc([N+](=O)[O-])c1)c1ccc2ccccc2c1 746751838 WHVIHFOQJNFZLR-DEOSSOPVSA-N 499.548 5.375 5 20 JKBD COC(=O)c1c(-c2ccccc2Cl)csc1NC(=O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1C 747615186 UJPNPMVPURJIBX-UHFFFAOYSA-N 475.866 5.232 5 20 JKBD O=C(COc1ccccc1C(=O)Nc1cc([N+](=O)[O-])ccc1F)Nc1ccc(SC(F)F)cc1 913183103 OQHXYDABTDFIKF-UHFFFAOYSA-N 491.447 5.318 5 20 JKBD COc1ccc(Oc2ccc(Cl)cc2NC(=O)Cn2ncc3ccc([N+](=O)[O-])cc32)cc1 915281232 YZPMENPMFNFZIP-UHFFFAOYSA-N 452.854 5.038 5 20 JKBD C[C@H](OC(=O)c1[nH]c2ccc(Cl)cc2c1Cl)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl 915417498 HWGMONQTOUBLIO-QMMMGPOBSA-N 456.669 5.220 5 20 JKBD Cc1ccccc1CC(=O)O[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Br)c1ccccc1 916535298 RQVYOOBSXOROTK-JOCHJYFZSA-N 483.318 5.131 5 20 JKBD COc1ccc([N+](=O)[O-])cc1C(=O)OCc1csc(N(C(C)=O)c2ccc(C(F)(F)F)cc2)n1 920502046 KLDLBHKYCZELBO-UHFFFAOYSA-N 495.435 5.120 5 20 JKBD Cc1cc(C(=O)Nc2ccc(C3(NC(=O)c4c(F)ccc([N+](=O)[O-])c4C)CCC3)cc2)c(C)o1 1787346418 ZWICNNCJJSYJIF-UHFFFAOYSA-N 465.481 5.314 5 20 JKBD Cc1c(C(=O)NC2(c3ccc(NC(=O)c4cnoc4C4CC4)cc3)CCC2)cc(Cl)cc1[N+](=O)[O-] 1787598019 NSPRAWSZDUWTPD-UHFFFAOYSA-N 494.935 5.484 5 20 JKBD O=C(NC1(c2ccc(NC(=O)c3cccc4cnccc34)cc2)CCC1)c1cccc(F)c1[N+](=O)[O-] 1789328142 RUHMYZJOUOPCHO-UHFFFAOYSA-N 484.487 5.344 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)Nc1ccc(C2(NC(=O)CCCc3ccncc3)CCC2)cc1 1790770669 LORUNFOQWHGKFO-UHFFFAOYSA-N 490.535 5.208 5 20 JKBD O=C(Cc1ccc([N+](=O)[O-])cc1F)Nc1ccc(C2(NC(=O)CSc3ccccc3)CCC2)cc1 1791184486 VVKRBSVFTYHZHO-UHFFFAOYSA-N 493.560 5.203 5 20 JKBD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc2ccccc2o1)c1cc2cc([N+](=O)[O-])ccc2s1 1797489271 NQSMNBHPLYHABL-BCDXTJNWSA-N 475.526 5.121 5 20 JKBD CCCCC[C@@H](C)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)Cc2cc([N+](=O)[O-])ccc2F)CC1 1831462271 IDMXLFZVYQLPBT-NTKDMRAZSA-N 475.605 5.113 5 20 JKBD COc1cc(C(=O)N2CCC([C@@H]3CCCCN3C(=O)[C@H]3CC[C@H](C(C)C)CC3)CC2)ccc1[N+](=O)[O-] 1831566709 QIXXMKXBDRDXKK-SSPYTLHUSA-N 499.652 5.299 5 20 JKBD O=[N+]([O-])c1ccccc1CSc1nnc(CN2CCCCC2)n1-c1ccc(OC(F)F)cc1 12136795 MZNWWNURQBFIJJ-UHFFFAOYSA-N 475.521 5.055 5 20 JKBD CCc1cccc(CC)c1NC(=O)C1=C(c2ccccc2)NC(=S)N[C@@H]1c1ccc([N+](=O)[O-])cc1 14878042 XLNALAPEQUQWPA-RUZDIDTESA-N 486.597 5.288 5 20 JKBD COCCN(C(=O)c1ccc(SC(F)(F)F)cc1)c1nc(-c2ccc([N+](=O)[O-])cc2)cs1 15607249 SDXZHOCAFRSYSH-UHFFFAOYSA-N 483.493 5.623 5 20 JKBD CCc1ccccc1N(C(C)=O)c1nc(COC(=O)c2cc(SC)ccc2[N+](=O)[O-])cs1 16196864 ABYVFACPKOCDCI-UHFFFAOYSA-N 471.560 5.377 5 20 JKBD COc1ccc(Nc2nnc(S[C@H](C)c3nnc(-c4ccc([N+](=O)[O-])cc4)o3)s2)cc1 17662918 JBDXLKLSTRIXST-LLVKDONJSA-N 456.509 5.102 5 20 JKBD C[C@H](OC(=O)c1oc2ccccc2c1COc1ccccc1)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 17710819 WJOFWQZBRBERET-INIZCTEOSA-N 485.452 5.888 5 20 JKBD O=C(OCc1cc(-c2ccco2)on1)c1ccccc1C(=O)c1ccc(Cl)c([N+](=O)[O-])c1 18219728 QHJPPJKFIHEQHX-UHFFFAOYSA-N 452.806 5.084 5 20 JKBD CCCOc1ccc(-c2csc(NC(=O)c3cc(OC)c(OCC)cc3[N+](=O)[O-])n2)cc1 19202192 OFQGPAFBWGZSAM-UHFFFAOYSA-N 457.508 5.167 5 20 JKBD COc1ccc([C@H](CNC(=O)COc2ccc([N+](=O)[O-])cc2Cl)c2c[nH]c3ccccc23)cc1 19352757 NIMOZDUEMGKQLZ-FQEVSTJZSA-N 479.920 5.065 5 20 JKBD CCOc1ccccc1NC(=O)[C@H](Sc1nc2cc3ccccc3cc2c(=O)n1C)c1ccccc1 24969773 OUHIUBCFEMLRIT-AREMUKBSSA-N 495.604 5.958 5 20 JKBD O=C(NC1CCN(C(=O)c2ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])cc2)CC1)c1ccccc1 45668371 SRWRMACGWQRXRF-UHFFFAOYSA-N 479.920 5.075 5 20 JKBD COc1ccc(C)c2c1N(C(=O)C1CCN(c3ccc(C(F)(F)F)cc3[N+](=O)[O-])CC1)CCC2 110588195 KSQAKYKZAHEMQQ-UHFFFAOYSA-N 477.483 5.126 5 20 JKBD CC(C)[C@@H](NC(=O)c1ccc(NCc2ccccc2Cl)c([N+](=O)[O-])c1)c1nc(C2CC2)no1 110700630 OCCCRRUGURBKES-HXUWFJFHSA-N 469.929 5.248 5 20 JKBD C[C@@H]1CCCN(c2ccc(C(=O)Nc3ccc(Sc4nncs4)cc3)cc2[N+](=O)[O-])C1 117352942 GECJYTFAWKWPOI-CQSZACIVSA-N 455.565 5.086 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)Nc2ncc(Cc3cccc(Br)c3)s2)cc1SC 483583475 JPYIBETWYCNHMV-UHFFFAOYSA-N 494.392 5.387 5 20 JKBD Cc1ccc(-c2cc(C(=O)Nc3cc([N+](=O)[O-])ccc3OC(F)F)c3cnn(C(C)C)c3n2)cc1 485873897 VUCSQUIRTJXLLO-UHFFFAOYSA-N 481.459 5.750 5 20 JKBD CCOc1cc(C(=O)N[C@H](c2ccc(F)cc2)c2ccccc2Cl)c([N+](=O)[O-])cc1OC 502407023 QCFBOOAXRMNDEE-JOCHJYFZSA-N 458.873 5.314 5 20 JKBD O=C(NC[C@@H]1CCCCN1C(=O)c1ccc(NCc2ccccc2)c([N+](=O)[O-])c1)Nc1ccccc1 502717752 FFLLNOAXDRLOAZ-QHCPKHFHSA-N 487.560 5.023 5 20 JKBD CCCOc1cc(NC(=O)N2CC[C@@H](c3ccc(OC)cc3)C2)c([N+](=O)[O-])cc1OCCC 506147758 IJASRZYYPANTAA-GOSISDBHSA-N 457.527 5.202 5 20 JKBD CCn1c([C@H]2CCCN2C(=O)CCNc2ccc(C(F)(F)F)cc2[N+](=O)[O-])nc2ccccc21 506169625 AWLDJCDQAMVNFY-LJQANCHMSA-N 475.471 5.149 5 20 JKBD O=C(CCc1ncc(-c2ccccc2Br)o1)Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1 506244435 AQEHKIUKZQLTCT-UHFFFAOYSA-N 499.346 5.707 5 20 JKBD CC[C@@H](C)C(=O)Nc1cccc(CNC(=O)c2ccc(N[C@@H](C)c3ccccn3)c([N+](=O)[O-])c2)c1 507367881 MTGXFXPBQYPMAV-MSOLQXFVSA-N 475.549 5.078 5 20 JKBD CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccc(N(C)C(=O)c2ccc(Cl)cc2)cc1 509199576 YLKXTGYAEKMMAX-UHFFFAOYSA-N 480.952 5.967 5 20 JKBD C[C@H](c1ccco1)N(C(=O)C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)C1CC1 509840483 RDRMGZCNDFVWFJ-JFPYRBRCSA-N 473.554 6.480 5 20 JKBD CC1CCN(c2ccc(C(=O)Nc3ccccc3OC[C@@H]3CCCCO3)cc2[N+](=O)[O-])CC1 510011631 DKXYFCZPZNPCMV-FQEVSTJZSA-N 453.539 5.031 5 20 JKBD COc1cc(C(=O)N(C)[C@@H](C)c2ccc(Cl)c(Cl)c2)c([N+](=O)[O-])cc1OCc1cscn1 512439660 VBWIIUKOJNYVGU-LBPRGKRZSA-N 496.372 5.779 5 20 JKBD O=C(N[C@H](c1ccc(Cl)cc1)c1ccsc1)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-] 512750981 ZCGPGLKGTQQWIX-GOSISDBHSA-N 470.856 5.770 5 20 JKBD Cc1cccc(C(=O)NC[C@H](c2ccc(Cl)cc2)N2CCc3sccc3C2)c1[N+](=O)[O-] 514160345 NRJHMOVSPAUJCQ-HXUWFJFHSA-N 455.967 5.148 5 20 JKBD CCCOc1cc(NC(=O)c2ccc(F)cc2Br)c([N+](=O)[O-])cc1OCCC 514318670 FMCZUCCKMPHLNW-UHFFFAOYSA-N 455.280 5.326 5 20 JKBD CSc1ccc(C(=O)c2ccccc2C(=O)Nc2ccc(Cl)c(NC(C)=O)c2)cc1[N+](=O)[O-] 518720903 BMHJLCNNPLSRJL-UHFFFAOYSA-N 483.933 5.412 5 20 JKBD O=C(c1csc(-c2cccc([N+](=O)[O-])c2)n1)N1CCC[C@@H](c2nc(-c3ccc(Cl)cc3)no2)C1 524157727 QXIMWEHYSWYFOP-MRXNPFEDSA-N 495.948 5.442 5 20 JKBD COc1ccc(N2C(=O)c3ccccc3N[C@H]2c2cc(OC)c(OCC(F)F)cc2[N+](=O)[O-])cc1 602762628 WRKUOJKBQMCPHW-HSZRJFAPSA-N 485.443 5.027 5 20 JKBD Cc1nc(-c2ccc(NC(=O)c3ccccc3C(=O)c3ccc(N(C)C)c([N+](=O)[O-])c3)cc2)oc1C 603940452 QVVUZPNCKKSFGR-UHFFFAOYSA-N 484.512 5.416 5 20 JKBD COc1ccc(CNC(=O)N[C@@H](c2ccccc2)c2ccc(Br)cc2F)cc1[N+](=O)[O-] 604078724 CKVUVZMSYVODLX-NRFANRHFSA-N 488.313 5.094 5 20 JKBD CCCCN(C)C(=O)C1CCN(C(=O)c2ccc(Sc3ccc(C)cc3)c([N+](=O)[O-])c2)CC1 604180735 VGAUDPOZKUEVQF-UHFFFAOYSA-N 469.607 5.165 5 20 JKBD COCCN(Cc1ccc(C)cc1C)C(=O)c1ccc(N[C@H](C)c2ccccn2)c([N+](=O)[O-])c1 604301496 VVWJERHNXAETGF-HXUWFJFHSA-N 462.550 5.069 5 20 JKBD COc1cc(CNCc2cc(C)cc3c(C)c(C)[nH]c23)c([N+](=O)[O-])cc1OCC(F)(F)F 609223388 MGMSWKPYGGTLNT-UHFFFAOYSA-N 451.445 5.241 5 20 JKBD COc1ccc(Oc2ccc([N+](=O)[O-])cc2C(=O)Nc2ccc(-c3nnc4n3CCCC4)cc2)cc1 609428459 HYQZTBRHVNTAHS-UHFFFAOYSA-N 485.500 5.243 5 20 JKBD COC1CCN(c2ccc(NC(=O)c3ccc(NC4CC4)c([N+](=O)[O-])c3)cc2C(F)(F)F)CC1 728010867 GCGYGDFILFFKLE-UHFFFAOYSA-N 478.471 5.055 5 20 JKBD Cc1nn(Cc2ccc(C(=O)N3CCC[C@@H]3c3ccccc3C(F)(F)F)cc2)c(C)c1[N+](=O)[O-] 728034442 PHZZZMITMCSULQ-OAQYLSRUSA-N 472.467 5.453 5 20 JKBD O=C(CSc1nnc(-c2cccs2)n1C1CC1)OCc1nc2ccccc2c2ccccc12 728635554 GEHCQSTXSDSTDB-UHFFFAOYSA-N 472.595 5.878 5 20 JKBD C[C@@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccc2c(c1)CCCN2C(=O)OC(C)(C)C 729412272 GHLNNAWDJKTAFQ-OAHLLOKOSA-N 457.552 5.402 5 20 JKBD C[C@@H](NC(=O)Nc1ccc(NC(=O)OC(C)(C)C)cc1C(F)(F)F)c1cccc([N+](=O)[O-])c1 729571469 LSGILNXDLSBXHM-GFCCVEGCSA-N 468.432 5.843 5 20 JKBD CCc1ccccc1N(C(C)=O)c1nc(COC(=O)c2c[nH]c3ccc([N+](=O)[O-])cc23)cs1 749314938 KUZNXAJDWPWZBS-UHFFFAOYSA-N 464.503 5.137 5 20 JKBD O=C(OCC1CCN(c2ncccc2[N+](=O)[O-])CC1)[C@@H]1CC=CC[C@H]1c1nc2ccccc2s1 749358648 MWNBXAXNSNJYHC-RTBURBONSA-N 478.574 5.109 5 20 JKBD COc1ccc(Br)cc1[C@@H]1CCCN1C(=O)c1ccc(Br)c([N+](=O)[O-])c1 751153348 RXANMBCRGLMMLQ-HNNXBMFYSA-N 484.144 5.106 5 20 JKBD O=C(O[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Br)c1ccccc1)c1cc(F)cc(F)c1 848942894 DAGYIKPHIPQYNE-IBGZPJMESA-N 491.244 5.172 5 20 JKBD O=C(Nc1ccc(Cl)c([N+](=O)[O-])c1)[C@H](Sc1nncc2ccccc12)c1ccccc1 900667065 LKHBLLZRULYDNN-HXUWFJFHSA-N 450.907 5.664 5 20 JKBD O=C(C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)NCc1ccc([N+](=O)[O-])cc1 917791023 YODBVDAPKXBGHH-AQTBWJFISA-N 474.498 5.360 5 20 JKBD O=C(O[C@@H](C(=O)Nc1ccccc1)c1ccccc1)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-] 919196354 UDPXLCJTSKBPQI-HXUWFJFHSA-N 474.391 5.073 5 20 JKBD O=C(/C=C/c1ccc([N+](=O)[O-])o1)NC1(c2ccc(NC(=O)[C@H]3C[C@H]3c3ccc(F)cc3)cc2)CCC1 1786028299 DTHROLALASKNPC-XPHCTPJTSA-N 489.503 5.278 5 20 JKBD O=C(/C=C/C1CC1)Nc1ccc(C2(NC(=O)Cc3cc(Br)ccc3[N+](=O)[O-])CCC2)cc1 1786156998 AYCWAEJVTRAHNI-NYYWCZLTSA-N 498.377 5.000 5 20 JKBD O=C(/C=C/c1ccccc1[N+](=O)[O-])NC1(c2ccc(NC(=O)c3ccnc(Cl)c3)cc2)CCC1 1787384790 FUBBBODCQAWNKM-IZZDOVSWSA-N 476.920 5.104 5 20 JKBD O=C(/C=C/c1ccc([N+](=O)[O-])o1)NC1(c2ccc(NC(=O)Cc3ccccc3Cl)cc2)CCC1 1787748387 AZIDZRVYDOBCTI-ZRDIBKRKSA-N 479.920 5.231 5 20 JKBD O=C(/C=C/c1ccc([N+](=O)[O-])o1)NC1(c2ccc(NC(=O)[C@@H]3C[C@H]3c3ccccc3)cc2)CCC1 1791526499 BOTYZKLYXHWGLC-ASTIYFOKSA-N 471.513 5.139 5 20 JKBD CC(C)[C@@H](C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cc(F)cc([N+](=O)[O-])c1)C2)c1ccc(Cl)cc1 1801552049 GOSRMHZEGYLXMZ-ADYITMSISA-N 487.959 5.079 5 20 JKBD O=C(CCc1ccccc1)N1CCCC2(CCN(C(=O)c3cc4cc([N+](=O)[O-])ccc4s3)CC2)C1 1809084992 MFJFVWGMIHQCGJ-UHFFFAOYSA-N 491.613 5.287 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)Nc1cc([C@@H]2CCCCN2C(=O)C[C@@H](C)c2ccccc2)[nH]n1 1821285406 CWCAKDMHWJHCBJ-ZHRRBRCNSA-N 493.539 5.265 5 20 JKBD Cc1c(C(=O)N2CCC([C@@H]3CCCCN3C(=O)CCC(F)(F)F)CC2)cc(Cl)cc1[N+](=O)[O-] 1826671803 UUPFYROCEHLNMS-SFHVURJKSA-N 489.922 5.132 5 20 JKBD O=C(NCc1csc(-c2ccccc2)n1)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 10893657 KOXWAIWJDSYBCI-UHFFFAOYSA-N 490.507 5.270 5 20 JKBD CCOc1cc(Br)c(CC(=O)N(C)Cc2cc([N+](=O)[O-])ccc2Cl)cc1OCC 10902312 XMZZOBXIONQTCP-UHFFFAOYSA-N 485.762 5.009 5 20 JKBD O=C(N[C@H]1CCSc2ccc(F)cc21)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 10964290 FYCVPKDAPGQWBE-KRWDZBQOSA-N 483.487 5.322 5 20 JKBD CCN1C/C(=C/c2ccc(-c3ccccc3[N+](=O)[O-])s2)c2nc3ccccc3c(C(=O)O)c2C1 11293961 KXSFGMCQCZSRGN-SSZFMOIBSA-N 471.538 5.946 5 20 JKBD COc1ccc(-c2cc(C(=O)O[C@H](C)C(=O)Nc3cccc([N+](=O)[O-])c3C)sc2C)cc1 22295594 JWLHQNAVNNHOQU-CQSZACIVSA-N 454.504 5.133 5 20 JKBD CSc1ccc([N+](=O)[O-])c(C(=O)Nc2sc(-c3ccccc3)c(C)c2C(=O)N2CCCCC2)c1 26862099 ZPSCWUYZWCOSBD-UHFFFAOYSA-N 495.626 6.232 5 20 JKBD O=C(OCc1nnc(-c2ccc([N+](=O)[O-])cc2)o1)c1ccc(-c2nc3ccccc3s2)s1 28614710 PKBVSRPTXHPXOE-UHFFFAOYSA-N 464.484 5.340 5 20 JKBD C[C@H](Nc1ccc(C(=O)N2CCC(Cc3cccc(F)c3)CC2)cc1[N+](=O)[O-])c1ccccn1 108828929 BGYOGYYKVNYQPQ-SFHVURJKSA-N 462.525 5.397 5 20 JKBD C[C@@H](Nc1ccc(C(=O)N[C@@H]2CCc3c(Br)cccc32)cc1[N+](=O)[O-])c1ccccn1 303190609 MNUVQSMITAQXDT-JLTOFOAXSA-N 481.350 5.343 5 20 JKBD O=C(CN(Cc1ccc(Cl)cc1)C(=O)c1cc2cc([N+](=O)[O-])ccc2o1)Nc1ccccc1F 488047317 YEQNPXSJWTUXSM-UHFFFAOYSA-N 481.867 5.415 5 20 JKBD COc1ccc(-c2nc(CSc3nc4cc5ccccc5cc4c(=O)n3C)cs2)c(OC)c1 495355712 QJMNAOBUUCKLBD-UHFFFAOYSA-N 475.595 5.520 5 20 JKBD C[C@@H](Nc1ccc(C(=O)N(C)Cc2cc(Br)cs2)cc1[N+](=O)[O-])c1ccccn1 507337519 CULKHXCFAGAZLD-CYBMUJFWSA-N 475.368 5.259 5 20 JKBD C[C@H](NCc1ccc(Oc2ccccc2Cl)c([N+](=O)[O-])c1)c1cccc(N2CCCC2=O)c1 507901144 DYVDMUWOFQLJEM-KRWDZBQOSA-N 465.937 6.018 5 20 JKBD COc1ccc(CSCC(=O)N[C@@H](C)c2sc(-c3ccccc3)nc2C)cc1[N+](=O)[O-] 509605294 PQACQTYALXFJDX-AWEZNQCLSA-N 457.577 5.146 5 20 JKBD O=C(c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1)N(C[C@@H]1CCCO1)[C@H]1CCSC1 514493133 JSAMAZORQXXNAX-HKUYNNGSSA-N 462.955 5.167 5 20 JKBD COc1cc2c(cc1CNCc1ccc(-c3ccc([N+](=O)[O-])cc3Br)o1)O[C@H](C)C2 517538987 VOHXPFHBOQDBSM-CYBMUJFWSA-N 473.323 5.239 5 20 JKBD CCN(CC)CC1CCN(C(=O)c2ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])c(OC)c2)CC1 519902493 IUSUQMRURVAXQI-UHFFFAOYSA-N 475.973 5.243 5 20 JKBD Cc1ccc(NC(=O)c2cccc(C(F)(F)F)c2)cc1NC(=O)c1cc2cc([N+](=O)[O-])ccc2o1 521294046 UQQZAHKHWRVVGY-UHFFFAOYSA-N 483.402 6.173 5 20 JKBD NC(=O)Nc1ccc(CNC(=O)c2ccccc2Sc2ccc(C(F)(F)F)cc2[N+](=O)[O-])cc1 591607240 FGGKXTWUFKZMHK-UHFFFAOYSA-N 490.463 5.185 5 20 JKBD COCCN(C(=O)Cc1ccc(Cl)cc1Cl)c1nc(-c2ccc([N+](=O)[O-])cc2)cs1 603461256 JMUKENRVRNMFFB-UHFFFAOYSA-N 466.346 5.247 5 20 JKBD COc1ccc(-c2[nH]c3ccccc3c2CCC(=O)NCc2ccc(OC)c([N+](=O)[O-])c2)cc1 604016598 KBZVUVHOUUBLJC-UHFFFAOYSA-N 459.502 5.009 5 20 JKBD CC1CCN(c2ccc(CNCc3cn(-c4ccccc4)nc3-c3ccc([N+](=O)[O-])cc3)cn2)CC1 608836050 INAXNBNHYYJURF-UHFFFAOYSA-N 482.588 5.369 5 20 JKBD O=C1Nc2cc(Cl)ccc2[C@@H]1C1CCN(C(=O)c2cc([N+](=O)[O-])ccc2Oc2ccccc2)CC1 608970881 FGXDSNJSIHCHGO-DEOSSOPVSA-N 491.931 5.629 5 20 JKBD CCc1cccc[n+]1/C(C(=S)NC12CC3CC(CC(C3)C1)C2)=C(/O)c1ccc([N+](=O)[O-])cc1 725762556 BHUABSAMCPLCOV-UHFFFAOYSA-O 464.611 5.214 5 20 JKBD O=[N+]([O-])c1ccc(Cl)cc1S(=O)(=O)N(Cc1ccc(Cl)c(Cl)c1)Cc1ccccn1 725829386 JEHFAWJTICZWLP-UHFFFAOYSA-N 486.764 5.341 5 20 JKBD Cn1cc(C(=O)Nc2ccc(OC(=O)c3ccc(Oc4ccc(Cl)cc4[N+](=O)[O-])cc3)cc2)cn1 727810536 YCPZUYBBMMUURU-UHFFFAOYSA-N 492.875 5.246 5 20 JKBD C[C@H](OC(=O)C[C@H](c1ccccc1)C(F)(F)F)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 728654011 SXIOWKZTMWLFCU-SMDDNHRTSA-N 478.345 5.220 5 20 JKBD O=[N+]([O-])c1ccc2nc(Sc3ccc(CN[C@H]4CCc5c(O)cccc54)cc3[N+](=O)[O-])sc2c1 729686105 ZMESVXQJEBUEOZ-KRWDZBQOSA-N 494.554 5.747 5 20 JKBD O=C(Cc1csc(NC(=O)c2cccs2)n1)OCc1nc2ccccc2c2ccccc12 742325387 ODTTZSMAMTZKRY-UHFFFAOYSA-N 459.552 5.444 5 20 JKBD Cc1c(C(=O)Nc2nc(Cc3ccc(Br)cc3)cs2)cc([N+](=O)[O-])c(C)c1[N+](=O)[O-] 748622314 DFPSITRLIJNDSS-UHFFFAOYSA-N 491.323 5.182 5 20 JKBD C[C@@H](OC(=O)CSc1ccc([N+](=O)[O-])cc1)C(=O)N1c2ccccc2Sc2ccccc21 852583522 XDINQXQCDRMFNU-OAHLLOKOSA-N 466.540 5.448 5 20 JKBD Cc1csc(SCc2ccccc2C(=O)Nc2cc([N+](=O)[O-])ccc2OC(F)F)n1 915283832 WDWXGSFUFQIMLM-UHFFFAOYSA-N 451.476 5.506 5 20 JKBD CC(C)c1cccc(C(C)C)c1NC(=S)N(Cc1nnc(-c2cccc([N+](=O)[O-])c2)o1)C(C)C 915998125 WXDKEDRIQFAMTQ-UHFFFAOYSA-N 481.622 6.499 5 20 JKBD COC(=O)Nc1ccc(OC(=O)C/C(=C\c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)cc1 918602589 BZACJPKEXJGZHS-SAPNQHFASA-N 489.509 5.919 5 20 JKBD CC(C)(C)OC(=O)Nc1ccc(C(F)(F)F)cc1NC(=O)c1ccn(-c2cccc([N+](=O)[O-])c2)n1 918615254 SZALYSIHXAEZLB-UHFFFAOYSA-N 491.426 5.399 5 20 JKBD Cc1c(NC(=O)[C@@H](C)OC(=O)c2cccnc2Oc2ccc(Cl)cc2Cl)cccc1[N+](=O)[O-] 920912500 LVOHDFSOGKRKPF-CYBMUJFWSA-N 490.299 5.581 5 20 JKBD O=C(/C=C/c1ccc([N+](=O)[O-])o1)Nc1ccc(C2(NC(=O)/C=C/c3ccccc3)CCC2)cc1 1786206585 UZHBOTHBKRLOLI-MCLPEHIOSA-N 457.486 5.049 5 20 JKBD CC(C)=CCCC(=O)N1CCCC[C@H]1C1CCN(C(=O)CSc2ccccc2[N+](=O)[O-])CC1 1830256694 WDGKWDYQJZJSPN-NRFANRHFSA-N 473.639 5.053 5 20 JKBD Cc1ccc(C(=O)N2CCC([C@H]3CCCCN3C(=O)c3cccc(F)c3[N+](=O)[O-])CC2)cc1Cl 1830615999 CSQJXRQTTUVFOU-JOCHJYFZSA-N 487.959 5.243 5 20 JKBD Cc1ccc(NC(=O)[C@H](Sc2nncn2CCc2cccs2)c2ccccc2)c([N+](=O)[O-])c1 11105585 QGTONNVTWATCLR-OAQYLSRUSA-N 479.587 5.271 5 20 JKBD Cc1ccc(-c2nc(C)sc2CC(=O)OCC(=O)Nc2ccc([N+](=O)[O-])cc2C(F)(F)F)cc1 11219539 BFKOFCKFUGCJME-UHFFFAOYSA-N 493.463 5.078 5 20 JKBD C[C@@H](Sc1nnc(NCc2ccccc2)s1)C(=O)Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1 11408359 GIPGMYKEGHWDNX-CYBMUJFWSA-N 498.615 5.301 5 20 JKBD O=C(Cc1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1)Nc1ccc(Cl)cc1F 19198972 GRBIYGUYEWOUMS-UHFFFAOYSA-N 450.857 5.421 5 20 JKBD O=C(Cn1c2ccccc2c(=O)c2ccccc21)Oc1ccc(C(=O)c2ccc(F)cc2)cc1 21966050 RYRZUIAIPWHNJF-UHFFFAOYSA-N 451.453 5.130 5 20 JKBD CCn1c(SCC(=O)Nc2ccc(Cl)cc2C(F)(F)F)nc2cc3ccccc3cc2c1=O 22177730 FOJUGHQUDSLFGQ-UHFFFAOYSA-N 491.922 5.973 5 20 JKBD COCc1ccccc1CNC(=O)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])c(OC)c1 29139440 FPJIIIFDPCIGRG-UHFFFAOYSA-N 456.882 5.126 5 20 JKBD COc1cc2c(cc1OC)[C@@H](c1ccccc1)N(C(=O)c1cc([N+](=O)[O-])ccc1Cl)CC2 104658886 FQSJNITYVUSNOP-HSZRJFAPSA-N 452.894 5.053 5 20 JKBD Cc1nn(C(C)(C)C)c2nc(C3CC3)cc(C(=O)N(Cc3ccccc3[N+](=O)[O-])CC(F)(F)F)c12 107799797 AYUKMDREIJPAKA-UHFFFAOYSA-N 489.498 5.485 5 20 JKBD Cc1nn(Cc2ccc(C(=O)Nc3ccccc3Oc3cccc(F)c3)cc2)c(C)c1[N+](=O)[O-] 108693841 ANDWNXUYCNWDPS-UHFFFAOYSA-N 460.465 5.640 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)Nc2ccnn2Cc2cccc(Cl)c2Cl)cc1SC 112529562 KEBYHVTUOPJTHA-UHFFFAOYSA-N 467.334 5.129 5 20 JKBD O=C(N[C@@H]1CCN2CCC[C@@H]2C1)c1ccccc1Sc1ccc(C(F)(F)F)cc1[N+](=O)[O-] 484934073 LQNAVVSUNMQEER-HZPDHXFCSA-N 465.497 5.121 5 20 JKBD CC(=O)Nc1ccc(Br)cc1NC(=O)c1ccc(N2C[C@@H](C)C[C@@H](C)C2)c([N+](=O)[O-])c1 506143640 JCJNUHDZDBCMSD-OKILXGFUSA-N 489.370 5.050 5 20 JKBD COc1cc(C(=O)N(C)C[C@@H]2OCCc3ccccc32)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 506239824 XTTRAYFQQHVFIA-DEOSSOPVSA-N 482.920 5.435 5 20 JKBD Cc1sc(CNC(=O)c2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)nc1-c1ccc(Cl)cc1 507906713 CIPAXYHBRPAZST-UHFFFAOYSA-N 467.938 5.011 5 20 JKBD COc1cc(C(=O)Nc2nc(C(F)(F)F)cs2)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 508298822 JQKCIAMJOCOIED-UHFFFAOYSA-N 473.816 5.777 5 20 JKBD O=C1CCCN1C[C@H](NCc1ccc(Oc2ccccc2Cl)c([N+](=O)[O-])c1)c1ccccc1 509568762 JZKMFWAGSBNWSJ-NRFANRHFSA-N 465.937 5.494 5 20 JKBD CC(=O)N(c1nc(COc2ccc(-c3ccccc3)cc2[N+](=O)[O-])cs1)c1cccc(C)c1C 516785931 DJPSYKMSLGWYHY-UHFFFAOYSA-N 473.554 6.599 5 20 JKBD COc1ccccc1CN(Cc1cccs1)C(=O)[C@@H](C)Oc1ccc(Cl)cc1[N+](=O)[O-] 518823580 XWENMFDJANDDBG-OAHLLOKOSA-N 460.939 5.315 5 20 JKBD COc1ccc(N(C)C(=O)c2ccc(NCc3ccccc3Cl)c([N+](=O)[O-])c2)cc1OC 520701603 OOAOXUALMWYFFG-UHFFFAOYSA-N 455.898 5.154 5 20 JKBD CCOc1ccc(CN(C(=O)CCn2nc(C)c([N+](=O)[O-])c2C)c2ccc(OC)c(Cl)c2)cc1 523954588 PRVZISOXIXAIFQ-UHFFFAOYSA-N 486.956 5.092 5 20 JKBD O=C1c2cc(Cl)ccc2N[C@@H](c2csc(-c3cccc([N+](=O)[O-])c3)n2)N1c1ccncc1 602757036 MUAAYCDRGBABNL-HXUWFJFHSA-N 463.906 5.538 5 20 JKBD Cc1ccc(NC(=O)C(C)C)cc1NC(=O)c1ccc(N2C[C@@H](C)C[C@H](C)C2)c([N+](=O)[O-])c1 603895816 ZFMKIISKTADPCT-IRXDYDNUSA-N 452.555 5.232 5 20 JKBD CNC(=O)c1ccc(NC(=O)c2ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])c(OC)c2)cc1Cl 604013611 VPFZKYQUHRETQP-UHFFFAOYSA-N 490.299 5.314 5 20 JKBD O=C(Nc1ccc(-c2cn3cccnc3n2)cc1)c1ccc(NCc2ccccc2)c([N+](=O)[O-])c1 604338053 OPRVUJQLXPNOPS-UHFFFAOYSA-N 464.485 5.169 5 20 JKBD O=C(C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)NCc1ccccc1N1CCCC1 604385350 RDGBMWDDSDUWNL-OQKWZONESA-N 498.608 6.052 5 20 JKBD CC(C)(C(=O)Nc1nc(C2CC2)c(Cc2cccc(C(F)(F)F)c2)s1)n1cc([N+](=O)[O-])cn1 608807666 LOOIKWXKUDTZRR-UHFFFAOYSA-N 479.484 5.109 5 20 JKBD O=C(C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)Nc1cnn(-c2ccncc2)c1 608899335 AAYHBTYDNDVATN-QGOAFFKASA-N 482.525 5.355 5 20 JKBD C[C@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)N1CCc2[nH]c3ccc(Br)cc3c2C1 609195875 ILXGHRRINRNLNV-GFCCVEGCSA-N 468.311 5.008 5 20 JKBD O=C(Cc1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1)N(Cc1cscn1)c1ccccc1 609410413 QFISAMGNRPCZCY-UHFFFAOYSA-N 495.564 5.680 5 20 JKBD O=C(OCC(=O)N1c2ccccc2Sc2ccc(Cl)cc21)c1cc(F)c(F)cc1[N+](=O)[O-] 725935567 MJCDESFMMYZKOJ-UHFFFAOYSA-N 476.844 5.513 5 20 JKBD CC1CCN(c2ccc(C(=O)Oc3ccc(NC(=O)c4cc([N+](=O)[O-])ccc4Cl)cc3)cn2)CC1 727099661 ASEZPLUDONJGBD-UHFFFAOYSA-N 494.935 5.351 5 20 JKBD COc1ccc(NC(=O)c2cc([N+](=O)[O-])cc([N+](=O)[O-])c2C)cc1OCc1ccc2ccccc2n1 728009306 YVQNSGKQFFRTDY-UHFFFAOYSA-N 488.456 5.200 5 20 JKBD CN(Cc1cc([N+](=O)[O-])ccc1Cl)C(=O)CCc1nc2cc(C(F)(F)F)ccc2s1 730459863 KHHDPKYOIJJAOO-UHFFFAOYSA-N 457.861 5.468 5 20 JKBD CCOc1ccc(-c2nc(NC(=O)c3cc([N+](=O)[O-])ccc3Br)sc2C)cc1 751050620 QJVROCCCAACIHG-UHFFFAOYSA-N 462.325 5.440 5 20 JKBD COc1ccc(-c2cc3[nH]c(/C(Cl)=C/c4ccc(Cl)c([N+](=O)[O-])c4)nc(=O)c3s2)cc1 797247356 PNEQZZQQADAKCA-NVNXTCNLSA-N 474.325 5.959 5 20 JKBD O=C(C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)Nc1ccc(-n2ccnc2)nc1 914452118 ITEPQDHQOUPRJR-AQTBWJFISA-N 482.525 5.355 5 20 JKBD CSc1ccc(C(=O)c2ccccc2C(=O)N2CCCN(c3ccc(C)cc3)CC2)cc1[N+](=O)[O-] 917824233 OUFNRYQYRRQZQG-UHFFFAOYSA-N 489.597 5.209 5 20 JKBD CCCOCc1ccccc1CNC(=O)c1ccccc1NC(=O)c1ccc([N+](=O)[O-])cc1Cl 918617266 MHWVKYYCMREZQB-UHFFFAOYSA-N 481.936 5.357 5 20 JKBD O=C(Nc1ccccc1C(=O)N[C@H]1CCc2cc(F)ccc21)c1ccc([N+](=O)[O-])cc1Cl 919870151 HRJDNZZAHFCRHI-NRFANRHFSA-N 453.857 5.057 5 20 JKBD COc1ccc(-c2[nH]c3ccccc3c2CCC(=O)Nc2cc([N+](=O)[O-])ccc2F)c(OC)c1 920020138 OERRINXMELYJPK-UHFFFAOYSA-N 463.465 5.471 5 20 JKBD O=C(Nc1ccccc1C(=O)NC[C@H]1CCCO[C@@H]1c1ccccc1)c1ccc([N+](=O)[O-])cc1Cl 920297745 RZBJCRKBTMNUST-HOYKHHGWSA-N 493.947 5.398 5 20 JKBD Cc1ccc(C(=O)Nc2cccc(C(F)(F)F)c2)cc1NC(=O)c1ccc(N)c([N+](=O)[O-])c1 920855505 OKDPKOYGULGKPC-UHFFFAOYSA-N 458.396 5.009 5 20 JKBD CCC[C@H]1CC[C@H](C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)Cc2ccc(Cl)cc2[N+](=O)[O-])C3)CC1 1801811804 XMUSRAPDXYXCDC-UXUYGWKFSA-N 476.017 5.035 5 20 JKBD CC(C)[C@H](C(=O)N1CCC([C@H]2CCCCN2C(=O)c2ccc([N+](=O)[O-])o2)CC1)c1ccc(F)cc1 1823617103 FBWVSBQIBXIHSX-QPPBQGQZSA-N 485.556 5.000 5 20 JKBD Cc1c(C(=O)N2CCCC[C@H]2C2CCN(C(=O)[C@@H]3CC=CCC3)CC2)cc(Cl)cc1[N+](=O)[O-] 1830734349 IBYYYQFNPUADGS-KNQAVFIVSA-N 474.001 5.146 5 20 JKBD CC(C)(C)CCCCCC(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2ccc([N+](=O)[O-])o2)CC1 1831574773 ZOQWJSYSSDOAIG-HXUWFJFHSA-N 461.603 5.418 5 20 JKBD O=C(c1cc2[nH]ccc2s1)N1CCC([C@H]2CCCCN2C(=O)/C=C/c2ccccc2[N+](=O)[O-])CC1 1832906890 HNMRVMZJTGCZIX-MHNQQFQPSA-N 492.601 5.084 5 20 JKBD CCNc1ccc(C(=O)OCc2csc(N(C(C)=O)c3c(C)cc(C)cc3C)n2)cc1[N+](=O)[O-] 14072727 JZZISDQUFNOYIO-UHFFFAOYSA-N 482.562 5.450 5 20 JKBD Cc1cccc(-n2c(S[C@H](C)c3nnc(-c4ccc([N+](=O)[O-])cc4)o3)nc3ccccc3c2=O)c1C 17533575 MISSLLJDXGJVFZ-QGZVFWFLSA-N 499.552 5.814 5 20 JKBD Cc1cc(N2CCN(C)CC2)ccc1NC(=O)c1cc([N+](=O)[O-])ccc1Sc1ccccc1 23689207 NKNPLOLTSZEBKP-UHFFFAOYSA-N 462.575 5.059 5 20 JKBD C[C@H](Nc1ccc(C(=O)Nc2ccc(-c3ncc4n3CCCC4)cc2)cc1[N+](=O)[O-])c1ccccn1 195626639 XGEGWZXDTUINEK-SFHVURJKSA-N 482.544 5.615 5 20 JKBD CSc1ccc(C(=O)c2ccccc2C(=O)N2CC[C@@H](c3ccccc3F)C2)cc1[N+](=O)[O-] 410292257 SEAWCXBHASPBRB-QGZVFWFLSA-N 464.518 5.317 5 20 JKBD COc1cc(C(=O)NC(C)(C)c2ccc(Cl)c(Cl)c2)c([N+](=O)[O-])cc1OCc1cscn1 497355492 XMGBZFMFYAZOIE-UHFFFAOYSA-N 496.372 5.611 5 20 JKBD O=C(c1csc(-c2ccc([N+](=O)[O-])cc2)n1)N(Cc1cc(Br)ccc1F)C1CC1 499060987 XKSJBARUDCXRGG-UHFFFAOYSA-N 476.327 5.425 5 20 JKBD COCCN(C(=O)Cc1csc(-c2cccc(C)c2)n1)c1nc(-c2ccc([N+](=O)[O-])cc2)cs1 499133388 CIGJQTZUBOOCEP-UHFFFAOYSA-N 494.598 5.372 5 20 JKBD Cc1c(C(=O)N(CC(=O)Nc2ccc(Cl)cc2C(F)(F)F)C(C)C)cccc1[N+](=O)[O-] 504789773 JICZATUBSMUAQK-UHFFFAOYSA-N 457.836 5.065 5 20 JKBD CC[C@@H](C)n1ncc2c(C(=O)Nc3nc(-c4ccc(C)c([N+](=O)[O-])c4)cs3)cc(C)nc21 508792085 CMGCQGKSBXHYAL-CQSZACIVSA-N 450.524 5.303 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Cl)[C@H](Nc1cccc(OC[C@H]2CCCO2)c1)c1ccccc1 518994343 BGZGVPYXQSCNPG-ZJSXRUAMSA-N 481.936 5.598 5 20 JKBD Cc1nc2ccccc2c2c(NC(=O)Cc3csc(-c4cnccn4)n3)c3ccccc3n12 589288184 VNSZCWOFHIHHOS-UHFFFAOYSA-N 450.527 5.044 5 20 JKBD COc1cc(/C=C2/CCn3c2nc2sc(C)c(C)c2c3=O)ccc1OCc1ccc([N+](=O)[O-])cc1 603781359 MWOHLAOVRGNHOF-UNOMPAQXSA-N 489.553 5.515 5 20 JKBD Cc1ccc2[nH]c3c(c2c1)CN(C(=O)c1ccc(N[C@H](C)c2ccccn2)c([N+](=O)[O-])c1)CC3 604301737 UOTAJGWBUMNLMR-QGZVFWFLSA-N 455.518 5.151 5 20 JKBD O=C(Nc1nc2c(s1)COCC2)c1c2c(nc3ccccc13)/C(=C\c1cccc([N+](=O)[O-])c1)CCC2 609022164 GIGPLFGKQSUYNZ-LGMDPLHJSA-N 498.564 5.801 5 20 JKBD CC(C)CCSc1ccc(C(=O)Nc2cccc(NC(=O)NCc3ccncc3)c2)cc1[N+](=O)[O-] 609175024 UEPFXOLJTHVNLP-UHFFFAOYSA-N 493.589 5.702 5 20 JKBD O=C(OCc1nc2ccccc2c2ccccc12)c1cnn(-c2ncccc2Cl)c1C(F)F 730887129 WCTMCNOZSMMRCU-UHFFFAOYSA-N 464.859 5.917 5 20 JKBD O=C1CC[C@H](c2noc(-c3ccccc3Sc3ccccc3[N+](=O)[O-])n2)CN1CC1CCC1 856547061 YZRHQDCPCZAKTK-KRWDZBQOSA-N 464.547 5.302 5 20 JKBD O=C1CC[C@@H](c2noc(-c3ccc(Sc4ccc([N+](=O)[O-])cc4)cc3)n2)CN1CC1CCC1 856553007 KCKZLYGPQAEGFE-GOSISDBHSA-N 464.547 5.302 5 20 JKBD COc1cccc(-c2nn(CN(C)Cc3ccccc3[N+](=O)[O-])c(=S)n2-c2ccccc2)c1 914783563 VCFXDKGTRDIALA-UHFFFAOYSA-N 461.547 5.077 5 20 JKBD CC1=C(C(=O)Nc2cccc(F)c2)[C@@H](c2ccc([N+](=O)[O-])cc2)NC(=S)N1c1ccccc1 917373305 CYSVVCNNFFSBBL-JOCHJYFZSA-N 462.506 5.082 5 20 JKBD CSCC[C@H](NC(=O)c1ccc(Cl)c([N+](=O)[O-])c1)C(=O)O[C@@H](C)c1cccc(Cl)c1 918765731 XOHUZQBJKODVOD-SJCJKPOMSA-N 471.362 5.058 5 20 JKBD Cc1ccc(N2C(=O)/C(=C/c3cn(C)nc3-c3ccc([N+](=O)[O-])cc3)c3ccccc3C2=O)cc1 920397769 PMNSNHGEFSQGIG-BUVRLJJBSA-N 464.481 5.031 5 20 JKBD Cc1sc2nc([C@H](C)OC(=O)c3ccc(N[C@H](C)c4ccccn4)c([N+](=O)[O-])c3)nc(O)c2c1C 920543357 BYLFHIRKZYHITC-KGLIPLIRSA-N 493.545 5.408 5 20 JKBD O=C(NC1(c2ccc(NC(=O)C3CC(F)(F)C3)cc2)CCC1)c1cc2cc([N+](=O)[O-])ccc2s1 1785911694 KQQSGFZBRXNRMY-UHFFFAOYSA-N 485.512 5.603 5 20 JKBD Cc1nc(C(=O)NC2(c3ccc(NC(=O)CCc4cccc([N+](=O)[O-])c4)cc3)CCC2)sc1C 1786602696 NKANBRGFGHEUBT-UHFFFAOYSA-N 478.574 5.049 5 20 JKBD CN(C)c1ccc([N+](=O)[O-])cc1C(=O)NC1(c2ccc(NC(=O)[C@H](F)c3ccccc3)cc2)CCC1 1786612439 DDLHBJKKVGUUJK-XMMPIXPASA-N 490.535 5.119 5 20 JKBD O=C(NC1(c2ccc(NC(=O)c3cccnc3-c3cccc(F)c3)cc2)CCC1)c1ccc([N+](=O)[O-])[nH]1 1788375071 WJDWOWPJUMBXQR-UHFFFAOYSA-N 499.502 5.186 5 20 JKBD COc1cc(C(=O)Nc2ccc(C3(NC(=O)[C@@H](F)c4ccccc4)CCC3)cc2)ccc1[N+](=O)[O-] 1792164229 VWKLGWJZKCZCGO-QHCPKHFHSA-N 477.492 5.062 5 20 JKBD Cc1ccc(C(=O)NC2(c3ccc(NC(=O)/C=C/c4ccccc4[N+](=O)[O-])cc3)CCC2)nc1C 1792315672 OBVFATOFVQUMQB-OQLLNIDSSA-N 470.529 5.068 5 20 JKBD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc2cc([N+](=O)[O-])ccc2s1)c1cc2ccoc2s1 1801206778 LEJQURJVWNJIHT-MUJYYYPQSA-N 481.555 5.183 5 20 JKBD C[C@@H](CC(=O)Nc1cc([C@@H]2CCCCN2C(=O)CCc2cccc([N+](=O)[O-])c2)[nH]n1)c1ccccc1 1822040952 HKLVLBKOLCDJNT-CYFREDJKSA-N 489.576 5.137 5 20 JKBD O=C(c1cccc(F)c1[N+](=O)[O-])N1CCC([C@@H]2CCCCN2C(=O)c2cccc3ccccc23)CC1 1828009749 LGQHDRRNUFJEMA-VWLOTQADSA-N 489.547 5.434 5 20 JKBD CC1=CC[C@@H](C(=O)N2CCC([C@@H]3CCCCN3C(=O)c3cc(Cl)cc([N+](=O)[O-])c3C)CC2)CC1 1830735728 LEYYOUVYNCLASF-OFNKIYASSA-N 488.028 5.536 5 20 JKBD C[C@@]1(C(=O)N2CCC([C@H]3CCCCN3C(=O)CSc3ccccc3[N+](=O)[O-])CC2)CC=CCC1 1831777627 ULEYMCPOLYKZTR-QFQXNSOFSA-N 485.650 5.053 5 20 JKBD O=C(Nc1ccccc1C(=O)NCc1ccc(C(F)(F)F)cc1)c1ccc([N+](=O)[O-])cc1Cl 16301864 VOVRHVQMCZDSJV-UHFFFAOYSA-N 477.826 5.449 5 20 JKBD CCOc1cc2c(cc1NC(=O)CSc1ccc(C(F)(F)F)cc1[N+](=O)[O-])O[C@H](C)C2 16302783 TXKJNJXDNNJJDX-LLVKDONJSA-N 456.442 5.067 5 20 JKBD CCn1c(S[C@@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)nnc1-c1cccc(Cl)c1 17725323 RBRHRJKEJUFENI-LBPRGKRZSA-N 456.915 5.430 5 20 JKBD O=C(CSc1nnc(Cc2cccs2)n1-c1ccccc1)Nc1ccc(Cl)cc1[N+](=O)[O-] 17757840 JXEWOAIPZCPHSI-UHFFFAOYSA-N 485.978 5.212 5 20 JKBD CSc1ccc([N+](=O)[O-])c(C(=O)N(Cc2ccccc2)[C@H](C)c2cccc(NC(C)=O)c2)c1 23193746 SKIDVIGCCKCBIU-QGZVFWFLSA-N 463.559 5.679 5 20 JKBD COc1cc(C(=O)Nc2cccc(CN3CCCC3=O)c2)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 29289210 PLLSCPMIXLUFBX-UHFFFAOYSA-N 495.919 5.424 5 20 JKBD C[C@@H](Nc1ccc(C(=O)Nc2ccc3oc(C(F)(F)F)nc3c2)cc1[N+](=O)[O-])c1ccccn1 195748505 OMAFLYDFPSRHDH-GFCCVEGCSA-N 471.395 5.575 5 20 JKBD Cc1c(NC(=O)CCNc2ccc(C(F)(F)F)cc2[N+](=O)[O-])cccc1NC(=O)c1ccccc1 409508768 NIFSGDCICNSBRZ-UHFFFAOYSA-N 486.450 5.615 5 20 JKBD O=C(NCC1CCN(Cc2cccs2)CC1)c1cc([N+](=O)[O-])ccc1Sc1ccccc1 489412706 WTEVQLNBAJLPJZ-UHFFFAOYSA-N 467.616 5.450 5 20 JKBD O=C(c1cc2cc(Br)cc(Br)c2o1)N1CCc2cc([N+](=O)[O-])ccc21 494055980 KSUYDNLMLYGEJW-UHFFFAOYSA-N 466.085 5.069 5 20 JKBD O=[N+]([O-])c1ccc(-c2nnc(CSc3nnc(COc4ccc(Cl)cc4Cl)o3)o2)cc1 501055296 HBOKVDLIRCOUIE-UHFFFAOYSA-N 480.289 5.206 5 20 JKBD COc1ccc(Oc2ccc([N+](=O)[O-])cc2C(=O)NCCc2coc(-c3ccc(F)cc3)n2)cc1 507148782 ILJKAWVEQSZMAD-UHFFFAOYSA-N 477.448 5.162 5 20 JKBD COc1cc(C(=O)N[C@H](c2ccc(C)cc2)c2ccc(F)cc2Cl)c([N+](=O)[O-])cc1OC(F)F 518646583 UXJGVVQJTZIDTA-OAQYLSRUSA-N 494.853 5.825 5 20 JKBD COc1cc(C(=O)Nc2ccc(-c3nc4ccccc4o3)cc2)c([N+](=O)[O-])cc1OC(F)F 590654441 DWALYTKZACJTHL-UHFFFAOYSA-N 455.373 5.265 5 20 JKBD C[C@@H](c1ccccc1)n1c(SCc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)nnc1-c1ccccc1 603917207 CUYHDKAWUZZDAW-KRWDZBQOSA-N 484.541 5.805 5 20 JKBD Cc1nc(-c2ccccc2)sc1CNC(=O)c1ccc(N[C@@H](C)c2ccccn2)c([N+](=O)[O-])c1 608954472 PEFOSLYTDKZYRP-INIZCTEOSA-N 473.558 5.525 5 20 JKBD CCn1cnnc1-c1ccccc1NC(=O)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])c(OC)c1 609163824 AJXAZACBTOMCOY-UHFFFAOYSA-N 493.907 5.580 5 20 JKBD COc1ccc(CSCC(=O)N[C@H]2CCCc3nc(-c4ccc(F)cc4)sc32)cc1[N+](=O)[O-] 609186825 UTVVWEUSDLELID-KRWDZBQOSA-N 487.578 5.293 5 20 JKBD Cc1ccc(NC(=O)c2ccc(N[C@H](C)c3cc(F)ccc3N3CCC(O)CC3)c([N+](=O)[O-])c2)cc1 730566185 AKUQYOIUKYZWOV-GOSISDBHSA-N 492.551 5.429 5 20 JKBD O=C(O[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1)c1c(Cl)cccc1[N+](=O)[O-] 730645411 WJCVNJIYYCKKRY-LJQANCHMSA-N 490.255 5.347 5 20 JKBD CC(C)(C)OC(=O)N1CCC[C@@H](N(Cc2ccccc2)Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C1 730663616 PMGKRRLSACUGQG-JOCHJYFZSA-N 493.564 5.047 5 20 JKBD O=[N+]([O-])c1cc(C(F)(F)F)c(Cl)cc1Sc1nnc(-c2ccncc2)n1CC(F)(F)F 744171297 IDHYIEBXSJFPOB-UHFFFAOYSA-N 483.781 5.634 5 20 JKBD C[C@H](OC(=O)c1ccc(-c2nc3ccccc3s2)s1)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 745941624 BSCWXXNRERSTQN-LBPRGKRZSA-N 478.511 5.901 5 20 JKBD Cc1cccc(COc2cccc(C(=O)N(Cc3nnc(-c4cccc([N+](=O)[O-])c4)o3)C(C)C)c2)c1 834588756 FSDYHCXJJSGGEK-UHFFFAOYSA-N 486.528 5.583 5 20 JKBD CC(C)N(Cc1nnc(-c2cccc([N+](=O)[O-])c2)o1)C(=O)c1cc2c(s1)-c1ccccc1CC2 864240345 ZGDBSTUSHJPDBY-UHFFFAOYSA-N 474.542 5.523 5 20 JKBD CC(C)c1ccc(-c2nc(C(=O)OCC(=O)Nc3ccc([N+](=O)[O-])cc3Cl)cs2)cc1 900226795 OACBNDSAPOOTFU-UHFFFAOYSA-N 459.911 5.291 5 20 JKBD CN(Cc1cc([N+](=O)[O-])ccc1Cl)C(=O)c1ccccc1SCc1cn2ccccc2n1 914753575 ZYLYCVWCYVOBGV-UHFFFAOYSA-N 466.950 5.460 5 20 JKBD COc1ccc(CSCC(=O)OCC(=O)N2c3ccccc3Sc3ccccc32)cc1[N+](=O)[O-] 914916349 QGAPPUQRLIEFJJ-UHFFFAOYSA-N 496.566 5.209 5 20 JKBD Cc1cccc(NC(=O)c2ccc(Sc3nc4ccccc4s3)c([N+](=O)[O-])c2)c1C(N)=O 916471523 PNQGXEWLSALHTB-UHFFFAOYSA-N 464.528 5.015 5 20 JKBD O=C(CCOc1ccccc1[N+](=O)[O-])OCc1csc(-c2ccc(C(F)(F)F)cc2)n1 919491505 HZIVIDOKDFYWIV-UHFFFAOYSA-N 452.410 5.249 5 20 JKBD Cn1ccc(C(=O)Nc2ccc(C3(NC(=O)c4cc5cc([N+](=O)[O-])ccc5s4)CCC3)cc2)c1 1787239461 APVCACOXDWQJAB-UHFFFAOYSA-N 474.542 5.210 5 20 JKBD O=C(NC1(c2ccc(NC(=O)c3ncccc3-c3ccccc3)cc2)CCC1)c1ccc([N+](=O)[O-])o1 1788800999 ZTIMXMOUPNGTGL-UHFFFAOYSA-N 482.496 5.311 5 20 JKBD Cc1cccc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)c1Cl 1801208732 KWFPWLNUFJKNCB-BJWYYQGGSA-N 483.977 5.337 5 20 JKBD CCCc1ccc(C(=O)N2CCCC[C@H]2C2CCN(C(=O)/C=C/c3ccc([N+](=O)[O-])o3)CC2)cc1 1830102553 FNENFBGCKCBJFM-CWSBKQHBSA-N 479.577 5.087 5 20 JKBD Cc1nn(Cc2ccc(C(=O)N[C@H](c3ccc(F)cc3)c3cccs3)cc2)c(C)c1[N+](=O)[O-] 9900449 AFZLZDXIHDPTDW-JOCHJYFZSA-N 464.522 5.176 5 20 JKBD O=C(CSc1nnc(-c2cccs2)n1-c1ccccc1)Nc1cc([N+](=O)[O-])ccc1Cl 11210552 IIUAHDDTEYNXIH-UHFFFAOYSA-N 471.951 5.288 5 20 JKBD O=C(Cn1c2ccccc2c(=O)c2ccccc21)Nc1ccccc1SCc1ccccc1 14729747 UHOZASVOUYHKJZ-UHFFFAOYSA-N 450.563 6.086 5 20 JKBD COc1ccc(NC(C)=O)cc1NC(=O)[C@@H](C)OC(=O)c1c2ccccc2cc2ccccc12 22787441 NEFXFESVYHJLON-MRXNPFEDSA-N 456.498 5.144 5 20 JKBD O=C(CCSc1nnc(-c2ccccc2)n1-c1ccc(F)cc1F)Nc1ccccc1[N+](=O)[O-] 26361777 DKWDHLMGHFYDLS-UHFFFAOYSA-N 481.484 5.242 5 20 JKBD Cc1ccc(-n2c(-c3ccncc3)nn(CN(C)Cc3cc([N+](=O)[O-])ccc3Cl)c2=S)cc1 27533656 GHHLVKTVONOCBV-UHFFFAOYSA-N 480.981 5.425 5 20 JKBD CSc1ccc(C(=O)c2ccccc2C(=O)Nc2cccc(C(=O)N3CCCC3)c2)cc1[N+](=O)[O-] 116859896 URAGOPVYIXLQNE-UHFFFAOYSA-N 489.553 5.036 5 20 JKBD Cc1ccc(NS(=O)(=O)c2ccc(N[C@H](C)c3nc4ccccc4[nH]3)c([N+](=O)[O-])c2)c(C)c1 302994481 WWUOKNGYFVRSPP-MRXNPFEDSA-N 465.535 5.062 5 20 JKBD O=C(N[C@@H](c1ccccc1)c1ccc(Br)cc1)C1CCN(c2ccccc2[N+](=O)[O-])CC1 303047724 QZSNDHLJQWWMFD-DEOSSOPVSA-N 494.389 5.480 5 20 JKBD Cc1ccc(NC(=O)Cn2c3ccccc3c(=O)c3ccccc32)c(-c2nc3ccccc3[nH]2)c1 409612101 KNNGDYHLNLEUEZ-UHFFFAOYSA-N 458.521 5.645 5 20 JKBD C[C@H](Nc1ccc(C(=O)N(C)CCCc2cc(-c3ccccc3)n(C)n2)cc1[N+](=O)[O-])c1ccccn1 410083828 BKYNDGGUUPOORL-FQEVSTJZSA-N 498.587 5.268 5 20 JKBD C[C@@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)N[C@H](C)c1ccc(NC(=O)Nc2ccccc2)cc1 480747242 ZWXMRHZIVMNNHW-IAGOWNOFSA-N 464.547 5.597 5 20 JKBD O=C(Nc1ccc(Cl)c(C(=O)NC2CC2)c1)c1ccc(NCc2ccccc2)c([N+](=O)[O-])c1 488494549 OHGSXNFASRRMFH-UHFFFAOYSA-N 464.909 5.005 5 20 JKBD CC(C)N(CC(=O)Nc1ccc(Cl)cc1C(F)(F)F)C(=O)c1c[nH]c2ccc([N+](=O)[O-])cc12 505396585 QWQMRYLWSZHHGE-UHFFFAOYSA-N 482.846 5.238 5 20 JKBD NC(=O)c1ccc(NC(=O)c2c3c(nc4ccccc24)/C(=C\c2ccc([N+](=O)[O-])cc2)CCC3)cc1 514912620 QFRKWWXFTWFRPX-MNDPQUGUSA-N 478.508 5.371 5 20 JKBD COc1ccc([N+](=O)[O-])c(C(=O)N[C@H](c2ccccc2)c2ccc(Br)cc2F)c1 517902315 NSYDXWOVKACHPL-HXUWFJFHSA-N 459.271 5.024 5 20 JKBD C[C@@H](Nc1ccc(C(=O)Nc2ccccc2-c2nc3ccccc3s2)cc1[N+](=O)[O-])c1ccccn1 518423374 JMFZURFKHJLVII-QGZVFWFLSA-N 495.564 6.692 5 20 JKBD COC(=O)c1occc1CN(C(=O)c1ccc(C(C)(C)C)c([N+](=O)[O-])c1)[C@@H](C)c1ccccn1 523039996 IUODPAKJJRHWFK-INIZCTEOSA-N 465.506 5.071 5 20 JKBD Cc1nc(COc2ccc(Cl)cc2)sc1C(=O)Nc1cc([N+](=O)[O-])ccc1OC(F)F 603638142 CYUGKYMRMCMZKN-UHFFFAOYSA-N 469.853 5.446 5 20 JKBD COc1cc2c(cc1OC)[C@H](c1cccs1)N(C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)CC2 603646481 LRKCYGHWUFTTPP-OAQYLSRUSA-N 473.938 5.507 5 20 JKBD CCCOc1cc(NC(=O)N2CCC[C@H](c3nc4ccccc4o3)C2)c([N+](=O)[O-])cc1OCCC 603652493 FLYGFIVJWUKSTD-KRWDZBQOSA-N 482.537 5.725 5 20 JKBD O=C([C@H]1CCCN(c2nc3ccccc3s2)C1)N(Cc1ccccc1[N+](=O)[O-])CC(F)(F)F 604242902 LYYDDXZZIDWKAM-INIZCTEOSA-N 478.496 5.012 5 20 JKBD C[C@@H](Nc1ccc(C(=O)Nc2ncc(Cc3cc(F)cc(F)c3)s2)cc1[N+](=O)[O-])c1ccccn1 604308270 ZAIJFBNARPCXKR-CQSZACIVSA-N 495.511 5.741 5 20 JKBD COc1cc(OCC(=O)NC[C@@H](c2ccccc2Cl)c2c[nH]c3ccccc23)ccc1[N+](=O)[O-] 604456935 LKUDIBUWSGKEGT-IBGZPJMESA-N 479.920 5.065 5 20 JKBD COc1cc(C(=O)N[C@@H](c2cccc(C(F)(F)F)c2)C(C)C)c([N+](=O)[O-])cc1OC(F)F 608810265 GQKHTFFZAJSWHK-QGZVFWFLSA-N 462.371 5.351 5 20 JKBD O=C(c1ccccc1Sc1ccc(C(F)(F)F)cc1[N+](=O)[O-])N1CCC[C@@H](c2cc[nH]n2)C1 608813464 WLPBFHINNKKMML-CQSZACIVSA-N 476.480 5.508 5 20 JKBD Cc1cc([C@H](C)NC(=O)c2ccc(C(=O)N[C@@H](C)c3cc(C)sc3C)c([N+](=O)[O-])c2)c(C)s1 609043951 JUMMIELIPHVERG-GJZGRUSLSA-N 485.631 5.933 5 20 JKBD CN1C(=O)CCc2cc(NC(=O)C/C(=C\c3ccc([N+](=O)[O-])cc3)c3nc4ccccc4s3)ccc21 609186053 VDHUQJLBNQLMKD-XMHGGMMESA-N 498.564 5.683 5 20 JKBD Cc1ccc(NC(=O)[C@@H](OC(=O)c2csc(-c3ccc(O)cc3)n2)c2ccccc2)c([N+](=O)[O-])c1 726646839 ZPFVLEHCYXWMQY-QFIPXVFZSA-N 489.509 5.269 5 20 JKBD O=C(Nc1nc(-c2ccccc2OC(F)F)cs1)c1cc([N+](=O)[O-])ccc1Br 727714717 DAEVFZBFQWPSQN-UHFFFAOYSA-N 470.251 5.335 5 20 JKBD O=C(COC(=O)[C@@H]1C[C@@H]1c1ccc2ccccc2c1)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 731279257 XJSVSJOAYKLXBE-QZTJIDSGSA-N 458.392 5.052 5 20 JKBD C[C@@H](OC(=O)c1cc2cc([N+](=O)[O-])ccc2s1)C(=O)Nc1ccc(NC(=O)c2cccs2)cc1 750112740 NGPXSZXBMRLUMW-CYBMUJFWSA-N 495.538 5.307 5 20 JKBD O=C(Nc1ccnn1Cc1ccc(Cl)cc1Cl)c1cc([N+](=O)[O-])ccc1Br 751069689 CIJQSVQQVMSZOC-UHFFFAOYSA-N 470.110 5.161 5 20 JKBD O=C(COC(=O)C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)Nc1ccc(O)cc1 760453168 AOTVNYOPZLIGPT-GHRIWEEISA-N 489.509 5.023 5 20 JKBD Cc1nc2ccccc2c(-c2ccccc2)c1CC(=O)O[C@@H](C)C(=O)Nc1ccccc1[N+](=O)[O-] 800373592 BVOVUTQTZXJCJY-SFHVURJKSA-N 469.497 5.231 5 20 JKBD O=C(c1cc([N+](=O)[O-])ccc1N1CCCCC1)N1CCC[C@@H](c2nc3ccccc3s2)C1 883977737 USVKKGPGKISUQX-QGZVFWFLSA-N 450.564 5.215 5 20 JKBD CCOC(=O)c1sc(-c2cccc([N+](=O)[O-])c2)cc1NC(=O)c1cc(Cl)ccc1[N+](=O)[O-] 903406065 SDQYCSFIHAZUHA-UHFFFAOYSA-N 475.866 5.314 5 20 JKBD CC(C)c1ccc2cc(C(=O)O[C@H](C)C(=O)Nc3ccc([N+](=O)[O-])cc3C(F)(F)F)[nH]c2c1 914669106 UGWFKZYFPZQFNY-GFCCVEGCSA-N 463.412 5.402 5 20 JKBD COc1ccc(Oc2ccc([N+](=O)[O-])cc2C(=O)O[C@H](C)C(=O)Nc2ccc(C)cc2F)cc1 915249268 HTYIEILGUUMGKD-OAHLLOKOSA-N 468.437 5.027 5 20 JKBD Cc1cnn(-c2ccc(C(=O)Oc3ccc(NC(=O)c4cc([N+](=O)[O-])ccc4Cl)cc3)cc2)c1 916037551 ZMPCLJNXNPYGAA-UHFFFAOYSA-N 476.876 5.214 5 20 JKBD C[C@H](NC(=O)CSc1nc2ccc([N+](=O)[O-])cc2s1)c1ccc(OC(F)(F)F)cc1 917171971 WXCONZXZNUPAKE-JTQLQIEISA-N 457.455 5.073 5 20 JKBD C[C@@H](OC(=O)c1cc([N+](=O)[O-])ccc1Oc1ccccc1)C(=O)Nc1ccccc1Br 917256648 AOSKEJSOJPIIDW-CQSZACIVSA-N 485.290 5.334 5 20 JKBD C[C@H](Oc1cccc(C(C)(C)C)c1)C(=O)O[C@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 919407279 JIPHHTBWINRVDS-KGLIPLIRSA-N 482.455 5.249 5 20 JKBD Cc1ccc2c(COC(=O)c3ccc(N[C@@H](C)c4ccccn4)c([N+](=O)[O-])c3)cc(=O)oc2c1C 920543756 AKCWNZDUFMLMQL-KRWDZBQOSA-N 473.485 5.243 5 20 JKBD COc1cc(C(=O)OCc2csc(-c3ccc(C)o3)n2)c([N+](=O)[O-])cc1OCc1cscn1 920652205 JDYSIDLDTJKPQY-UHFFFAOYSA-N 487.515 5.021 5 20 JKBD Cc1ccc(/C=C/C(=O)NC2(c3ccc(NC(=O)c4ccc([N+](=O)[O-])o4)cc3)CCC2)s1 1785752040 VBSMOVQPLBCCHN-PKNBQFBNSA-N 451.504 5.019 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)c3ccc([N+](=O)[O-])cc3F)CCC2)cc1)c1ccnc(C(F)F)c1 1787018581 ADHSFBIDZBOBHY-UHFFFAOYSA-N 484.434 5.128 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)[C@H]3C[C@@H]3c3ccc(Cl)cc3)CCC2)cc1)c1ccc([N+](=O)[O-])[nH]1 1790185745 DVPSCAFMVBDRSI-UXHICEINSA-N 478.936 5.128 5 20 JKBD CC(C)[C@H]1CC[C@H](C(=O)N2CCC([C@@H]3CCCCN3C(=O)/C=C/c3ccc([N+](=O)[O-])o3)CC2)CC1 1824278719 KWASVMLJQRGDMK-DRKSHDSUSA-N 485.625 5.283 5 20 JKBD O=C(c1ccc(Cl)s1)N1CCC([C@@H]2CCCCN2C(=O)CCc2cccc([N+](=O)[O-])c2)CC1 1824838464 IITZHBBLGXBZTN-FQEVSTJZSA-N 490.025 5.176 5 20 JKBD Cc1ccc(CC(=O)N2CCC([C@H]3CCCCN3C(=O)c3ccc4occc4c3)CC2)cc1[N+](=O)[O-] 1828259064 UQJBZYXLRMCTOX-XMMPIXPASA-N 489.572 5.125 5 20 JKBD O=C(c1ccc(C2CC2)cc1)N1CCC([C@@H]2CCCCN2C(=O)c2ccc([N+](=O)[O-])cc2F)CC1 1830498728 GUPLWZNYFNYMIL-VWLOTQADSA-N 479.552 5.158 5 20 JKBD O=C(c1ccc2ccoc2c1)N1CCC([C@H]2CCCCN2C(=O)/C=C/c2ccccc2[N+](=O)[O-])CC1 1832904200 OUFGTQJHMPIBGL-NFPSEPLVSA-N 487.556 5.288 5 20 JKBD CC[C@H]1CCc2sc(-c3nnc(SCc4cc([N+](=O)[O-])cc5c4OCOC5)n3C)cc2C1 10440117 RTMLAYOBQQJPHB-ZDUSSCGKSA-N 472.592 5.126 5 20 JKBD O=C(c1ccccc1[N+](=O)[O-])N(C[C@H]1CCCO1)c1nc(-c2ccc(Br)cc2)cs1 14819579 FXWNFGHRQCRWHL-MRXNPFEDSA-N 488.363 5.307 5 20 JKBD Cc1csc(Sc2ccc(C(=O)Nc3cccc(NC(=O)c4cccs4)c3)cc2[N+](=O)[O-])n1 24030909 GBAVTPYQLWLHSS-UHFFFAOYSA-N 496.595 6.077 5 20 JKBD CSc1ccc([N+](=O)[O-])c(C(=O)NC[C@H](c2ccc(N(C)C)cc2)c2c[nH]c3ccccc23)c1 24486575 RCOLYDBUHKSQFA-JOCHJYFZSA-N 474.586 5.426 5 20 JKBD CCN(CC(=O)Nc1c(Cl)cccc1Cl)C(=O)c1ccc(C(C)(C)C)c([N+](=O)[O-])c1 26889273 LHDTWDJXCMLPQW-UHFFFAOYSA-N 452.338 5.300 5 20 JKBD CCOc1cc([N+](=O)[O-])c(C(=O)Nc2nc(-c3ccc(OC(F)F)cc3)c(C)s2)cc1OC 28250414 XYOFLMQIUQOFJD-UHFFFAOYSA-N 479.461 5.288 5 20 JKBD CC1CCN(c2ccc(C(=O)NC3C[C@@H](C(F)(F)F)C[C@H](C(F)(F)F)C3)cc2[N+](=O)[O-])CC1 33195219 YEJVTPZGDFDIGR-GJZGRUSLSA-N 481.437 5.470 5 20 JKBD C[C@@H](Nc1ccc(C(=O)N[C@@H]2CCSc3ccc(F)cc32)cc1[N+](=O)[O-])c1ccccn1 108788886 POGPPEBUVFPIHB-AUUYWEPGSA-N 452.511 5.269 5 20 JKBD CSc1ccc([N+](=O)[O-])c(C(=O)Nc2ncc(Cc3ccc(Br)c(C)c3)s2)c1 302975013 TXRFPDLUOVVFAO-UHFFFAOYSA-N 478.393 5.687 5 20 JKBD O=C(Cn1c2ccccc2c(=O)c2ccccc21)NCc1ccccc1-c1ccc(Cn2ccnc2)cc1 303186391 JBLSYBJTZFDJSY-UHFFFAOYSA-N 498.586 5.383 5 20 JKBD CC(=O)Nc1ccc(C)c(NC(=O)c2ccc(NCc3ccccc3Cl)c([N+](=O)[O-])c2)c1 479105009 ZXRHSSDLKZNUII-UHFFFAOYSA-N 452.898 5.379 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)Nc2nc(-c3cc(Cl)sc3Cl)cs2)cc1SC 481929293 FVFRTZWZOQJTBJ-UHFFFAOYSA-N 476.388 6.069 5 20 JKBD O=C(C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)N1CCO[C@@H](c2ccccc2)C1 485498753 NTPBTLCQJPFKHL-MWKGPOOMSA-N 485.565 5.735 5 20 JKBD CNC(=O)c1ccc(Cl)c(NC(=O)c2ccc(Sc3nc4ccccc4s3)c([N+](=O)[O-])c2)c1 500250409 LWAVCFREBAVGEC-UHFFFAOYSA-N 498.973 5.621 5 20 JKBD O=C(CCc1ccccc1)N1CCC(NCc2ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])cc2)CC1 507923102 MGMNLHIORUBNMM-UHFFFAOYSA-N 493.991 5.754 5 20 JKBD COc1ccc(-n2c(SCc3nnc(-c4ccc([N+](=O)[O-])cc4)o3)nnc2-c2ccccc2)cc1 514197606 PXMNIGZYZWQALY-UHFFFAOYSA-N 486.513 5.193 5 20 JKBD COc1ccc(CSc2nc3cc(Cl)ccc3c(=O)n2CCCOC(C)C)cc1[N+](=O)[O-] 514433081 BXXLLLUONQSKEP-UHFFFAOYSA-N 477.970 5.074 5 20 JKBD COc1ccc([C@H]2CCCN2C(=O)COc2ccc(-c3ccccc3)cc2[N+](=O)[O-])c(OC)c1 518658533 DDXDYWNUYOSJBQ-JOCHJYFZSA-N 462.502 5.022 5 20 JKBD C[C@@H](NC(=O)N(C)CCCCCc1cc(-c2cccc(F)c2)no1)c1cccc([N+](=O)[O-])c1 520160232 GXMIFIRUQMADJL-QGZVFWFLSA-N 454.502 5.504 5 20 JKBD CCNC(=O)Nc1cccc(NC(=O)c2cc([N+](=O)[O-])ccc2Sc2ccc(Cl)cc2)c1 521490522 RNAKTGCZKCBYKB-UHFFFAOYSA-N 470.938 5.793 5 20 JKBD Cn1c(=O)oc2ccc(NC(=O)c3cc([N+](=O)[O-])ccc3Sc3ccc(Cl)cc3)cc21 522581808 HIPGGVHOWOYILV-UHFFFAOYSA-N 455.879 5.097 5 20 JKBD O=C(c1ccc(NCc2ccc(Oc3ccccc3Cl)c([N+](=O)[O-])c2)cc1F)N1CCOCC1 600850335 XVJAYFBODDABEC-UHFFFAOYSA-N 485.899 5.264 5 20 JKBD O=C(C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)NC[C@H]1COc2ccccc2O1 603461305 SNEWFTWAEPTVOU-LVSKKATPSA-N 487.537 5.091 5 20 JKBD Cc1csc(Sc2ccc(C(=O)N3CCN(c4ccc5ccccc5n4)CC3)cc2[N+](=O)[O-])n1 603627322 MTJFSKDWIFMYCJ-UHFFFAOYSA-N 491.598 5.022 5 20 JKBD NC(=O)c1ccc(F)c(NC(=O)c2c3c(nc4ccccc24)/C(=C/c2ccc([N+](=O)[O-])cc2)CCC3)c1 603762287 CLFNQOCSVWVLKS-SAPNQHFASA-N 496.498 5.510 5 20 JKBD CCN(C(=O)Cc1ccc(NC(=O)c2ccc(N3CCCC3)c([N+](=O)[O-])c2)cc1)c1ccccc1 603989383 DOXWRHJXNJRQMQ-UHFFFAOYSA-N 472.545 5.043 5 20 JKBD Cc1sc(NC(=O)c2cnn(-c3ccc(F)cc3)c2C(F)(F)F)nc1-c1cccc([N+](=O)[O-])c1 603997877 VQLDMCMWJZLOHG-UHFFFAOYSA-N 491.426 5.623 5 20 JKBD CC(=O)Nc1ccc(Cl)c(NC(=O)C2CCN(c3ccc(C(F)(F)F)cc3[N+](=O)[O-])CC2)c1 604012172 GWRQGULEEFQVKU-UHFFFAOYSA-N 484.862 5.081 5 20 JKBD C[C@@H](NCc1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1)c1ccccc1OC(F)F 608835625 FZTUNFQYPQCKLG-QGZVFWFLSA-N 464.472 5.900 5 20 JKBD Cc1c(Br)cccc1NC(=O)N1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 608892726 GGSBUYUZNILARM-UHFFFAOYSA-N 487.276 5.039 5 20 JKBD CCOc1ccc(NC(=O)c2ccc(C(=O)Nc3ccc(OCC)c(F)c3)c([N+](=O)[O-])c2)cc1F 609044889 RREARFTVHKPQQE-UHFFFAOYSA-N 485.443 5.175 5 20 JKBD CCC(CC)c1cc[n+](/C(C(=S)N[C@@H](C)c2cccs2)=C(/O)c2cccc([N+](=O)[O-])c2)cc1 726581598 VXGDAXYAVFTMFA-KRWDZBQOSA-O 482.651 6.409 5 20 JKBD O=C(Nc1nnc(SCc2c(Cl)cccc2Cl)s1)c1cc(F)c(F)cc1[N+](=O)[O-] 727705135 ICNCMVKPSSQOLT-UHFFFAOYSA-N 477.301 5.576 5 20 JKBD O=C(CCC(=O)c1ccc2ccc3cccc4ccc1c2c34)NCc1cccc(Cn2ccnc2)c1 729263342 WMWSTHKJAPNURW-UHFFFAOYSA-N 471.560 6.108 5 20 JKBD O=C(N[C@H]1CCCc2nc(-c3ccc(F)cc3)sc21)c1cc([N+](=O)[O-])ccc1Br 729659286 QENUYVDCTFWAAC-INIZCTEOSA-N 476.327 5.427 5 20 JKBD CC(C)c1ccc(-c2nc(C(=O)OC[C@H]3CCCN3C(=O)c3ccccc3[N+](=O)[O-])cs2)cc1 730705590 XMVHWHJYKFAENX-LJQANCHMSA-N 479.558 5.303 5 20 JKBD CN(CCCCCc1cc(-c2ccc(F)cc2)n[nH]1)C(=O)c1cc([N+](=O)[O-])ccc1N1CCCC1 743918833 CCTZFCKZTNTEGU-UHFFFAOYSA-N 479.556 5.209 5 20 JKBD CCC(CC)c1cc[n+](/C(C(=S)Nc2cc(C)ccc2F)=C(/O)c2cccc([N+](=O)[O-])c2)cc1 744115925 JLNUDHDQVLMVLW-UHFFFAOYSA-O 480.585 6.557 5 20 JKBD C[C@@H](OC(=O)c1csc(-c2cccc([N+](=O)[O-])c2)n1)C(=O)N[C@H](C)c1ccc2c(c1)CCCC2 747961700 IUPDPSSLMBKRBN-HZPDHXFCSA-N 479.558 5.020 5 20 JKBD COc1cc(/C=C/C(=O)N(C)Cc2cc([N+](=O)[O-])ccc2Cl)ccc1OCc1c(C)noc1C 812210882 QGNZERLZONYKQT-UXBLZVDNSA-N 485.924 5.112 5 20 JKBD CC1=C(C(=O)Nc2ccccc2C(F)(F)F)[C@H](c2ccc(Cl)c([N+](=O)[O-])c2)N(C)C(=O)N1C 916164772 DVYIKWWMYHKSOW-SFHVURJKSA-N 482.846 5.218 5 20 JKBD O=C(CCCn1c(=O)oc2ccccc21)Nc1cc(Cl)c([N+](=O)[O-])cc1OCc1ccccc1 916827817 ZWLZPBNBKUPEPL-UHFFFAOYSA-N 481.892 5.154 5 20 JKBD CCOc1cc(-c2ccccc2)sc1C(=O)O[C@H](C)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 919452364 SQHFJINHLUAGME-CQSZACIVSA-N 465.487 5.690 5 20 JKBD COc1c([N+](=O)[O-])cc(NCc2ccc(OC(C)(C)C)cc2)c([N+](=O)[O-])c1Br 920485409 CBYMELGWCCXGEO-UHFFFAOYSA-N 454.277 5.064 5 20 JKBD O=C(Cc1cc([N+](=O)[O-])ccc1F)Nc1ccc(C2(NC(=O)C[C@@H]3C[C@@H]4CC[C@H]3C4)CCC2)cc1 1786671601 NOIAVQWVZLKOOJ-QYZOEREBSA-N 479.552 5.237 5 20 JKBD O=C(NC1(c2ccc(NC(=O)c3scnc3C3CC3)cc2)CCC1)c1cc(F)cc([N+](=O)[O-])c1 1787186288 IZVPBZJHTZPSCL-UHFFFAOYSA-N 480.521 5.129 5 20 JKBD C[C@@H](C(=O)NC1(c2ccc(NC(=O)c3cc([N+](=O)[O-])cc4c3OCC4)cc2)CCC1)c1cccs1 1790045030 BBVQJAQHAKAQSZ-MRXNPFEDSA-N 491.569 5.143 5 20 JKBD COc1ccc(Cl)c(C(=O)NC2(c3ccc(NC(=O)c4cc(O)cc([N+](=O)[O-])c4)cc3)CCC2)c1 1790758303 YYVVFTAAUBTGQD-UHFFFAOYSA-N 495.919 5.024 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)C3(c4cccc([N+](=O)[O-])c4)CCC3)CCC2)cc1)[C@@H]1[C@@H]2C=CS[C@@H]12 1791093621 XURVYZWKVSSURG-YTFSRNRJSA-N 489.597 5.026 5 20 JKBD O=C(CSc1ccccc1[N+](=O)[O-])Nc1ccc(C2(NC(=O)c3ccc(Cl)o3)CCC2)cc1 1791522468 WFTRDHARZNQVCC-UHFFFAOYSA-N 485.949 5.381 5 20 JKBD O=C(/C=C/c1ccccc1[N+](=O)[O-])NC1(c2ccc(NC(=O)CCCn3cccc3)cc2)CCC1 1791903992 XCZYLKHVVVXRAT-XNTDXEJSSA-N 472.545 5.024 5 20 JKBD O=C(/C=C/c1ccccc1[N+](=O)[O-])Nc1ccc(C2(NC(=O)CCCc3cccnc3)CCC2)cc1 1792318996 DPEBWRUGADVHCR-LFIBNONCSA-N 484.556 5.160 5 20 JKBD CC(C)(C)c1cc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2ccc([N+](=O)[O-])[nH]2)cc(C(C)(C)C)c1 1799481531 RUNAPQUGKJCCPR-WKCHPHFGSA-N 480.609 5.084 5 20 JKBD O=C(Nc1cc([C@H]2CCCCN2C(=O)/C=C/c2ccccc2[N+](=O)[O-])[nH]n1)c1cc(F)cc(Cl)c1 1823213545 XOMPOQJGNMKWIN-MHNQQFQPSA-N 497.914 5.130 5 20 JKBD O=C(c1cccc(F)c1)N1CCC([C@@H]2CCCCN2C(=O)C2(c3cccc([N+](=O)[O-])c3)CCC2)CC1 1830292934 MSLRJMAYFUWZAN-VWLOTQADSA-N 493.579 5.089 5 20 JKBD O=C(CSc1ccccc1[N+](=O)[O-])N1CCCC[C@H]1C1CCN(C(=O)C23CCC(CC2)CC3)CC1 1831777157 GKWRGUNPYGRLIV-VITNCHFBSA-N 499.677 5.277 5 20 JKBD C[C@@H](OC(=O)c1ccccc1C(=O)c1ccccc1)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 11024582 ZADACJGWQHLPOB-CQSZACIVSA-N 486.402 5.029 5 20 JKBD Cc1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2Cl)cc1S(=O)(=O)Nc1ccc(Cl)cc1 15705110 DLIRIYMHOQQJDU-UHFFFAOYSA-N 480.329 5.263 5 20 JKBD 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O=[N+]([O-])c1cc(/C=C(\Cl)c2nc(O)c3c(-c4ccccc4Cl)csc3n2)cs1 917142884 BTZGAOJMILHKIU-ACAGNQJTSA-N 450.328 6.424 5 20 JKBD O=C(Nc1ccccc1C(=O)Nc1cccc(OC(F)F)c1)c1ccc([N+](=O)[O-])cc1Cl 918584845 PHXVZRXDXBTAFH-UHFFFAOYSA-N 461.808 5.354 5 20 JKBD CC(C)c1ccc(SCC(=O)O[C@@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2C(F)(F)F)cc1 919319719 RFVVNANTKYTDFY-ZDUSSCGKSA-N 470.469 5.400 5 20 JKBD Cc1cc(-c2ccccc2)ccc1NC(=O)c1ccc(N[C@H](C)c2ccccn2)c([N+](=O)[O-])c1 919713659 XABCGCNBZCQCMI-LJQANCHMSA-N 452.514 6.391 5 20 JKBD COc1cc(NC(=O)[C@@H](C)Oc2ccc(Cl)cc2[N+](=O)[O-])ccc1NC(=O)OC(C)(C)C 920766343 XLQRXNWGASUQGK-GFCCVEGCSA-N 465.890 5.010 5 20 JKBD O=C(/C=C/c1ccc([N+](=O)[O-])o1)Nc1ccc(C2(NC(=O)[C@]3(F)CCCC=C3F)CCC2)cc1 1786208449 KBXYZGCVELRGKE-LJTKGQTQSA-N 471.460 5.081 5 20 JKBD Cc1c[nH]cc1C(=O)Nc1ccc(C2(NC(=O)c3cc(Br)ccc3[N+](=O)[O-])CCC2)cc1 1788732930 WJSZKPZOQGIAKK-UHFFFAOYSA-N 497.349 5.055 5 20 JKBD CCc1ncsc1C(=O)Nc1ccc(C2(NC(=O)c3c(F)ccc([N+](=O)[O-])c3C)CCC2)cc1 1790198824 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C[C@@H](COCC(F)(F)F)NC(=O)C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1 521504809 QPODLUCBMBYEST-KNGSKEOJSA-N 479.480 5.219 5 20 JKBD C[C@@H](Nc1ccc(C(=O)N(CCc2ccccc2)Cc2cccnc2)cc1[N+](=O)[O-])c1ccccn1 524022606 UQGDNLVWKHUVMG-OAQYLSRUSA-N 481.556 5.443 5 20 JKBD Cc1cc(C(=O)N2CCCC[C@H]2C)ccc1NC(=O)c1ccc(NCc2ccccc2)c([N+](=O)[O-])c1 553380274 LLZNAAZPEJDBOR-HXUWFJFHSA-N 486.572 5.782 5 20 JKBD O=C(C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)N1CCC[C@H]1c1ccccc1 590683039 YQKRMEIEONCTRL-DEZPSGRBSA-N 469.566 6.499 5 20 JKBD COc1ccc(NC(=O)CSc2nnc(-c3ccco3)n2[C@@H](C)[C@H]2C[C@H]3CC[C@H]2C3)c([N+](=O)[O-])c1 594534404 FWSWZYSPDJUTHN-NBOOPKSLSA-N 497.577 5.183 5 20 JKBD CC(C)c1ccccc1N(C(=O)c1ccc(S(C)(=O)=O)c([N+](=O)[O-])c1)c1nc2ccccc2s1 600848956 ZVJVFIMQWIRLBP-UHFFFAOYSA-N 495.582 5.710 5 20 JKBD NC(=O)c1cc(NC(=O)c2ccccc2Sc2ccc(C(F)(F)F)cc2[N+](=O)[O-])ccc1F 603571577 CRRFIOZPJWNRDB-UHFFFAOYSA-N 479.411 5.255 5 20 JKBD COCCOCc1cccc(NC(=O)c2cc([N+](=O)[O-])ccc2Sc2ccc(Cl)cc2)c1 603816305 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CCc1cccc[n+]1/C(C(=S)Nc1c(Cl)ccc(C)c1Cl)=C(/O)c1ccc([N+](=O)[O-])cc1 728559089 XQUIABQDBRHYCD-UHFFFAOYSA-O 489.404 6.383 5 20 JKBD CC(C)(C)OC(=O)N1CCCc2cc(NC(=O)c3cc(OCC(F)(F)F)ccc3[N+](=O)[O-])ccc21 729410645 CUPVRKYTFJGTOV-UHFFFAOYSA-N 495.454 5.476 5 20 JKBD CCOc1ccc(-c2nc(COC(=O)c3csc(-c4ccc([N+](=O)[O-])cc4)n3)cs2)cc1OC 747955748 BVUYPVVJSFCCSJ-UHFFFAOYSA-N 497.554 5.606 5 20 JKBD COc1ccccc1C1(C(=O)Oc2ccc(NC(=O)c3cc([N+](=O)[O-])ccc3Cl)cc2)CC1 749112429 BFVLCRXAQWYIBW-UHFFFAOYSA-N 466.877 5.146 5 20 JKBD Cc1ccc(-c2nnc([C@@H](C)OC(=O)CCNc3ccc(C(F)(F)F)cc3[N+](=O)[O-])o2)cc1 750503785 SURSIYGBKFQQSS-CYBMUJFWSA-N 464.400 5.078 5 20 JKBD COc1ccc([N+](=O)[O-])cc1NC(=O)[C@H](C)OC(=O)Cc1c(C)nc2ccccc2c1-c1ccccc1 800367637 JASUCTCKUCZBIL-SFHVURJKSA-N 499.523 5.240 5 20 JKBD O=C(OCc1nnc(-c2ccc([N+](=O)[O-])cc2)o1)c1ccccc1-c1ncc(-c2ccccc2F)o1 899993716 LTPVTVOQWDVADC-UHFFFAOYSA-N 486.415 5.463 5 20 JKBD CC(C)(C)c1cc[n+](/C(C(=S)N[C@@H]2C[C@H]3CC[C@H]2C3)=C(/O)c2ccc([N+](=O)[O-])cc2)cc1 912845943 YAWWLTFNEIEYSZ-DJPFJPOOSA-O 452.600 5.169 5 20 JKBD Cc1ccc(NC(=O)[C@@H](OC(=O)c2ccc(NC(=O)C(C)C)cc2)c2ccccc2)c([N+](=O)[O-])c1 914928999 ASCNIUPEPNGIMH-QHCPKHFHSA-N 475.501 5.035 5 20 JKBD CC1=C(C(=O)Nc2ccc(C)cc2Cl)[C@@H](c2cc([N+](=O)[O-])c(F)cc2F)NC(=O)N1CC1CC1 916725621 DVHLTPGWDJFWIT-OAQYLSRUSA-N 490.894 5.224 5 20 JKBD CCOC(=O)c1c(-c2ccccc2Cl)csc1NC(=O)c1cc2c(cc1[N+](=O)[O-])OCO2 917509300 AZXWGELKWFINFV-UHFFFAOYSA-N 474.878 5.134 5 20 JKBD CCC(CC)c1cc[n+](/C(C(=S)Nc2ccc3ccccc3c2)=C(/O)c2ccc([N+](=O)[O-])cc2)cc1 917609464 AFKVNBGTWQGYSB-UHFFFAOYSA-O 498.628 7.262 5 20 JKBD COc1ccc(C2=N/C(=C\c3csc(-c4ccc(C(F)(F)F)cc4)n3)C(=O)O2)cc1[N+](=O)[O-] 918727338 SVQCQAUMORGXNA-DHDCSXOGSA-N 475.404 5.090 5 20 JKBD Cc1ccc(C(=O)O[C@H](C(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)c2ccccc2)c(Cl)n1 919252558 YFBIDUGJLVLAEN-SFHVURJKSA-N 460.273 5.142 5 20 JKBD C[C@H](OC(=O)[C@H](C)SCc1ncc(-c2ccc(Cl)cc2)o1)C(=O)Nc1cccc([N+](=O)[O-])c1 920673646 MSSYOFUUQLMQFH-KBPBESRZSA-N 489.937 5.095 5 20 JKBD CCOC(=O)c1c(NC(=O)c2cc(Cl)ccc2[N+](=O)[O-])sc(C(=O)Nc2ccccc2)c1C 927214375 LLRJDIYAIQULES-UHFFFAOYSA-N 487.921 5.299 5 20 JKBD Cc1ccccc1NCC(=O)NC1(c2ccc(NC(=O)CCc3cccc([N+](=O)[O-])c3)cc2)CCC1 1786599811 ASURGHWLPKBCBK-UHFFFAOYSA-N 486.572 5.082 5 20 JKBD CN(C)c1ccc([N+](=O)[O-])c(C(=O)Nc2ccc(C3(NC(=O)C4(F)CCCCC4)CCC3)cc2)c1 1790055671 IWQMGEOAJQIPDQ-UHFFFAOYSA-N 482.556 5.081 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)c3cccc4ccoc34)CCC2)cc1)c1ccc(O)c([N+](=O)[O-])c1 1790623483 LTCSPMSKGNMXPZ-UHFFFAOYSA-N 471.469 5.108 5 20 JKBD Cc1ccc(CC(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)CCCCCC(C)(C)C)C3)cc1[N+](=O)[O-] 1800139750 GDHJUOPHYVFSQX-KOUNCHBCSA-N 457.615 5.081 5 20 JKBD Cc1ccc(CCC(=O)N2CCCC[C@H]2C2CCN(C(=O)c3cc(F)cc([N+](=O)[O-])c3)CC2)cc1F 1824458258 WGFUYJNFWPJVDH-VWLOTQADSA-N 499.558 5.048 5 20 JKBD Cc1c(C(=O)N2CCCC[C@H]2C2CCN(C(=O)[C@H]3CCC(F)(F)C3)CC2)cc(Cl)cc1[N+](=O)[O-] 1830734246 GQTHLNRPOGBSOQ-PXNSSMCTSA-N 497.970 5.225 5 20 JKBD CCOC(=O)c1c(NC(=O)c2ccc(C)c([N+](=O)[O-])c2)sc(C(=O)Nc2ccc(C)cc2C)c1C 14862857 BDKAWECWLQKPPL-UHFFFAOYSA-N 495.557 5.571 5 20 JKBD Cc1c(NC(=O)c2cccc(NS(=O)(=O)c3ccc(Cl)c(Cl)c3)c2)cccc1[N+](=O)[O-] 15790596 MVBKOFZSUAAUAW-UHFFFAOYSA-N 480.329 5.263 5 20 JKBD C[C@H](Sc1nnc(-c2cccs2)n1Cc1ccccc1)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 17653092 PMISVKNXSWMYPO-HNNXBMFYSA-N 490.570 5.866 5 20 JKBD Cc1nc(-c2ccc(F)cc2)sc1C(=O)O[C@@H](C)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 18018400 QBXFKJXWOYZZSM-LBPRGKRZSA-N 454.439 5.134 5 20 JKBD COc1ccc(-c2nnc(SCc3nc4ccccc4c4ccccc34)n2C[C@H]2CCCO2)cc1 20053005 JGBDTZMJOCKKBF-OAQYLSRUSA-N 482.609 6.126 5 20 JKBD Cc1ccc2c(COC(=O)c3ccccc3NC(=O)c3ccc([N+](=O)[O-])cc3Cl)cc(=O)oc2c1 20991290 QQXPCKFJUPWOSJ-UHFFFAOYSA-N 492.871 5.272 5 20 JKBD O=C(Nc1ccc(Oc2ccc(Br)cc2)cc1)c1cc2c(cc1[N+](=O)[O-])OCCO2 28317043 UHNANKKUFDILIR-UHFFFAOYSA-N 471.263 5.173 5 20 JKBD Cc1nn(C)c2sc(C(=O)O[C@H](C(=O)Nc3ccc(Cl)c([N+](=O)[O-])c3)c3ccccc3)cc12 106923709 FCUROMUIYIGOFW-IBGZPJMESA-N 484.921 5.042 5 20 JKBD C[C@@H](Nc1ccc(C(=O)N2CCC[C@@H]2Cc2ccccc2Cl)cc1[N+](=O)[O-])c1ccccn1 108892943 BNDOLXCSFGNQBJ-YLJYHZDGSA-N 464.953 5.664 5 20 JKBD Cc1cccc(-c2nc(C(C)C)no2)c1NC(=O)CSc1ccc(C(F)(F)F)cc1[N+](=O)[O-] 110635630 IAUVTECOKCPZNM-UHFFFAOYSA-N 480.468 5.826 5 20 JKBD CCOc1cc(Br)c(NC(=O)c2csc(-c3ccc([N+](=O)[O-])cc3)n2)cc1OCC 215731489 RHXNZRPLAXAYJP-UHFFFAOYSA-N 492.351 5.531 5 20 JKBD C[C@H](Cc1nnc(SCC(=O)Nc2ccc([N+](=O)[O-])cc2C(F)(F)F)o1)c1ccccc1 255937670 KIDHBQROFHXLRI-GFCCVEGCSA-N 466.441 5.074 5 20 JKBD O=C(Nc1ccccc1C(=O)N1CCC(=Cc2cccc(F)c2)CC1)c1ccc([N+](=O)[O-])cc1Cl 486307584 HEVVIAVSOIBJGD-UHFFFAOYSA-N 493.922 5.959 5 20 JKBD O=C(c1csc(-c2ccc([N+](=O)[O-])cc2)n1)N(C[C@H]1CCCO1)c1ccc(Br)cc1 496614651 YWZCFPTXACMSCX-GOSISDBHSA-N 488.363 5.307 5 20 JKBD C[C@H](Nc1ccc(C(=O)Nc2cccc(NC(=O)c3ccoc3)c2)cc1[N+](=O)[O-])c1ccccn1 499621838 VSYLHSBTTSWYDZ-INIZCTEOSA-N 471.473 5.261 5 20 JKBD CCOC(=O)CC1CCN(C(=O)C/C(=C/c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)CC1 502905534 YNTITZAEHXHZPZ-HKWRFOASSA-N 493.585 5.327 5 20 JKBD O=C(N[C@@H]1CCOc2c(-c3ccccc3)cccc21)C1CCN(c2ccccc2[N+](=O)[O-])CC1 505076850 SXJMBKFUEJKHAE-HSZRJFAPSA-N 457.530 5.118 5 20 JKBD C[C@@H](Nc1ccc(C(=O)Nc2ccc(Br)cc2Cl)cc1[N+](=O)[O-])c1ccccn1 506221488 UKQBWIZSMLMXAF-GFCCVEGCSA-N 475.730 5.831 5 20 JKBD CC(C)(C)[C@@H]1CCc2sc(-c3nnc(SCc4ccc(C(N)=O)cc4[N+](=O)[O-])o3)cc2C1 514315009 UAQGCDIUNNJVMR-OAHLLOKOSA-N 472.592 5.249 5 20 JKBD Cc1ccc([C@@H](NC(=O)C2CCN(c3ccc(C(F)(F)F)cc3[N+](=O)[O-])CC2)C2CC2)cc1 514765979 FPUYHQGTRATHIS-JOCHJYFZSA-N 461.484 5.406 5 20 JKBD CC[C@H](NC(=O)c1ccc(Sc2ccc(C)cc2)c([N+](=O)[O-])c1)c1nnc2n1CCCCC2 521716624 IWRTYZGSBWGRLN-IBGZPJMESA-N 465.579 5.253 5 20 JKBD Cc1cc(C)cc(Oc2ccc(CNC(=O)CNC(=O)c3c(Cl)cccc3[N+](=O)[O-])cc2C)c1 521726584 QYBKAJHLVHCZQJ-UHFFFAOYSA-N 481.936 5.012 5 20 JKBD C[C@H](OCCCNC(=O)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1)c1ccccc1 589452039 IYNZHUYIPDJPHC-KRWDZBQOSA-N 479.499 5.114 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Cl)C(=O)N[C@H](c1ccc2c(c1)CCCC2)c1cccs1 603708841 QHEBCOOMXCLHHY-OAQYLSRUSA-N 469.950 5.033 5 20 JKBD COc1ccc(-c2nnc(SCc3ccc(OC)c([N+](=O)[O-])c3)n2C2CCCCC2)cc1OC 603722923 ZQEFCJIPJMBPFB-UHFFFAOYSA-N 484.578 5.677 5 20 JKBD C[C@H](N[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1)c1cccc(C(F)(F)F)c1 603744461 OPARBDYHBPOJPI-QKKBWIMNSA-N 477.870 6.298 5 20 JKBD O=C(Nc1cccc(NC(=O)c2ccc(NCc3ccccc3)c([N+](=O)[O-])c2)c1)c1ccccc1 603911696 MHUUMSOOQJVDQC-UHFFFAOYSA-N 466.497 5.712 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Cl)[C@@H](c1ccccc1)N1CCO[C@@H](c2ccccc2F)C1 608976082 KOEQJHYYMPAHSS-DHIUTWEWSA-N 469.900 5.141 5 20 JKBD COc1cc(CSCc2cccc(C(=O)N3CCCCC3)c2)c([N+](=O)[O-])cc1OC(F)F 609237619 HEOXXSIGNACRKH-UHFFFAOYSA-N 466.506 5.264 5 20 JKBD COc1ccc2oc(C(=O)Nc3ccc(NS(=O)(=O)c4ccc(C)c([N+](=O)[O-])c4)cc3)c(C)c2c1 609453963 RJSFZWRCLNPYLA-UHFFFAOYSA-N 495.513 5.020 5 20 JKBD CN1CCN(c2cc(CNC(=O)CCC(=O)c3ccc4ccc5cccc6ccc3c4c56)ccn2)CC1 727768507 GCNRXLFFTSUKPS-UHFFFAOYSA-N 490.607 5.010 5 20 JKBD CSc1ccc([N+](=O)[O-])c(C(=O)Nc2cc(C(F)(F)F)ccc2NC(=O)OC(C)(C)C)c1 727790917 ZMLUHYQLBTZZFO-UHFFFAOYSA-N 471.457 5.935 5 20 JKBD C[C@@H](NCc1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1)c1ccc2c(c1)CC(=O)N2C 728301200 LEEHOYBOBQBVHW-OAHLLOKOSA-N 451.910 5.410 5 20 JKBD COc1cc(-c2cc(C(=O)N3c4ccc([N+](=O)[O-])cc4C[C@H]3C)c3ccccc3n2)cc(OC)c1OC 728812250 ZTOHKPDKCNDMAR-MRXNPFEDSA-N 499.523 5.427 5 20 JKBD O=C(c1c2c(nc3ccccc13)/C(=C/c1cccc([N+](=O)[O-])c1)CCC2)N1CCC[C@H](C2OCCO2)C1 729361308 VIHGXWNGFUHPCD-UZLGTAQGSA-N 499.567 5.245 5 20 JKBD O=C(Nc1ccc(CN2C(=O)Cc3ccc(Cl)cc32)cc1)c1cc([N+](=O)[O-])ccc1Cl 745080040 ZAKBWUGSMUQSLT-UHFFFAOYSA-N 456.285 5.243 5 20 JKBD Cc1cccc(C)c1NC(=O)COC(=O)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1 849192488 SIYIVPYDIBSOHD-UHFFFAOYSA-N 454.866 5.453 5 20 JKBD COc1ccc(NC(=O)c2nnc(/C(Cl)=C\c3ccc(Cl)c([N+](=O)[O-])c3)s2)cc1 912963586 PYLVUVUJQMBJHY-RIYZIHGNSA-N 451.291 5.098 5 20 JKBD CCC[C@@H](C)NS(=O)(=O)c1cc(C(=O)Nc2cc([N+](=O)[O-])c(C)cc2C)c(Cl)cc1Cl 913416690 PDBNBSOQSQOTGV-CYBMUJFWSA-N 488.393 5.238 5 20 JKBD O=C(Nc1ccc(N2CCC(O)CC2)cc1)c1ccc(NCc2ccccc2Cl)c([N+](=O)[O-])c1 915644444 REKHHBSEJUDDCO-UHFFFAOYSA-N 480.952 5.074 5 20 JKBD CSc1ccc(C(=O)c2ccccc2C(=O)Nc2cc([N+](=O)[O-])ccc2C)cc1[N+](=O)[O-] 916665454 NMPXZYXXVSDFSG-UHFFFAOYSA-N 451.460 5.017 5 20 JKBD C[C@@H](Cc1ccccc1Cl)NC(=O)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 917167753 YRPHADASXLPUPH-AWEZNQCLSA-N 469.891 5.231 5 20 JKBD CC(=O)N(c1ccc(C)cc1)c1nc(/C=C(\Cl)c2nc3cc([N+](=O)[O-])ccc3[nH]2)cs1 917559651 MDLKASRQWJWSTI-MFOYZWKCSA-N 453.911 5.658 5 20 JKBD O=C(Nc1cccc(N2CCCCC2)c1)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 919823539 JZXMEMHISIMEQX-UHFFFAOYSA-N 476.499 5.459 5 20 JKBD C[C@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)OCC(=O)Nc1c(Cl)cc(Cl)cc1Cl 920777212 HSWBIHYVDHXITF-QMMMGPOBSA-N 482.103 5.158 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)c3ncccc3-c3ccccc3)CCC2)cc1)c1ccc([N+](=O)[O-])o1 1785748657 ALKIBVOYGUWAKN-UHFFFAOYSA-N 482.496 5.311 5 20 JKBD O=C(Cc1cc([N+](=O)[O-])ccc1F)Nc1ccc(C2(NC(=O)c3ccc4ncccc4c3)CCC2)cc1 1786671192 RPGOAGLYYVCDJE-UHFFFAOYSA-N 498.514 5.273 5 20 JKBD COc1cc(CC(=O)NC2(c3ccc(NC(=O)/C=C/c4ccsc4)cc3)CCC2)ccc1[N+](=O)[O-] 1786943994 IHPOFMKNDFZHSB-ONNFQVAWSA-N 491.569 5.055 5 20 JKBD O=C(CSc1ccccc1[N+](=O)[O-])NC1(c2ccc(NC(=O)c3ccnc(Cl)c3)cc2)CCC1 1787384866 KCKGVKVOJQYASC-UHFFFAOYSA-N 496.976 5.183 5 20 JKBD O=C(NC1(c2ccc(NC(=O)c3cc4cccc(F)c4s3)cc2)CCC1)c1ccc([N+](=O)[O-])o1 1788982404 UIYQILAQSLRSIH-UHFFFAOYSA-N 479.489 5.603 5 20 JKBD COc1ccccc1C(=O)NC1(c2ccc(NC(=O)/C=C/c3ccccc3[N+](=O)[O-])cc2)CCC1 1792317287 LAIZPBNBYZMRNN-LFIBNONCSA-N 471.513 5.065 5 20 JKBD O=C(/C=C/c1ccccc1[N+](=O)[O-])N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(Oc2ccccc2)cc1 1800348955 DZCRDTIMNZADIZ-NQZMGVAGSA-N 497.551 5.352 5 20 JKBD Cc1c(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)[C@@H](C)c2ccc(Cl)cc2)C3)cc(Cl)cc1[N+](=O)[O-] 1800709171 PHDIPZICYPYLRN-JZOCTASASA-N 490.387 5.266 5 20 JKBD CC1(C(=O)NC[C@@H]2CCN(C(=O)c3cc4cc([N+](=O)[O-])ccc4s3)[C@@H]2c2cccnc2)CCCC1 1802625742 TXRWEYGHOFCBPH-FDDCHVKYSA-N 492.601 5.104 5 20 JKBD Cc1cc(CCCC(=O)N2CCCC[C@H]2C2CCN(C(=O)C3=CCCC3)CC2)c([N+](=O)[O-])cc1F 1824370163 QPMPYDLUNNMQSH-DEOSSOPVSA-N 485.600 5.095 5 20 JKBD Cc1ncsc1C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)CC1 1825997329 HSPFRCIKKDKUMV-LJQANCHMSA-N 498.630 5.122 5 20 JKBD O=C(/C=C/c1ccccc1[N+](=O)[O-])N1CCC([C@@H]2CCCCN2C(=O)c2ccc3cnccc3c2)CC1 1828205552 KTMBZVRQXWFHCA-BKRCECSGSA-N 498.583 5.090 5 20 JKBD O=C(c1cc2cc([N+](=O)[O-])ccc2s1)N1CCC([C@H]2CCCCN2C(=O)c2ccccc2)CC1 1829876270 MOMSCDQYBKMKOQ-JOCHJYFZSA-N 477.586 5.357 5 20 JKBD C[C@H](OC(=O)c1ccc(Br)c([N+](=O)[O-])c1)C(=O)Nc1c(Cl)cc(Cl)cc1Cl 9849102 JUZBWFHTKXHDBZ-ZETCQYMHSA-N 496.528 5.502 5 20 JKBD Cc1cccc([N+](=O)[O-])c1NC(=O)CSc1ncnc2cc(-c3ccc(F)cc3)sc12 23555112 NRBUWBKLCWBMRJ-UHFFFAOYSA-N 454.508 5.445 5 20 JKBD C[C@@H](Sc1nnc(NCc2ccc(F)cc2)s1)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 24507053 PRUDFBXMWQDNBN-LLVKDONJSA-N 458.500 5.101 5 20 JKBD C[C@H](Sc1nc2ccc([N+](=O)[O-])cc2s1)C(=O)Nc1c(Cl)cc(Cl)cc1Cl 28673251 KDVIHASTMUNEAX-ZETCQYMHSA-N 462.767 6.284 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Cl)[C@@H](c1ccccc1)N1CCO[C@@H](c2ccccc2)C1 29533080 DAQWKRKUAAEULT-DHIUTWEWSA-N 451.910 5.002 5 20 JKBD CC(C)CCSc1ccc(C(=O)N(Cc2nc(O)c3ccccc3n2)C(C)C)cc1[N+](=O)[O-] 253610094 CVUVOASNMDLLOP-UHFFFAOYSA-N 468.579 5.433 5 20 JKBD Cc1cc(NC(=O)c2ccc(N[C@@H](C)c3ccccn3)c([N+](=O)[O-])c2)ccc1NC(=O)c1ccco1 409843693 JAOZPUUOFHCWPM-KRWDZBQOSA-N 485.500 5.569 5 20 JKBD COc1cc(C(=O)N[C@@H](C)c2nc(-c3ccccc3)cs2)c([N+](=O)[O-])cc1OCc1cscn1 410303208 MCGBCGMSGDPVJU-AWEZNQCLSA-N 496.570 5.253 5 20 JKBD CC(C)N1CCC(N(C)C(=O)c2c3c(nc4ccccc24)/C(=C/c2ccc([N+](=O)[O-])cc2)CCC3)CC1 476139611 HHCBLGNLJOVUQE-ZBJSNUHESA-N 498.627 5.965 5 20 JKBD COc1ccc([C@@H](NCc2cc([N+](=O)[O-])ccc2OC)c2ccccc2)cc1Br 488082085 NGJXYZFBLWKBEX-QFIPXVFZSA-N 457.324 5.254 5 20 JKBD COc1ccc(Oc2ccc([N+](=O)[O-])cc2C(=O)Nc2ccc(CS(=O)(=O)C(C)(C)C)cc2)cc1 497761987 VATCGIHSMQEXPB-UHFFFAOYSA-N 498.557 5.361 5 20 JKBD Cc1nn(Cc2ccc(C(=O)N3CCC[C@@H]3Cc3c(F)cccc3Cl)cc2)c(C)c1[N+](=O)[O-] 502406130 OANSNJLEEUYVBK-LJQANCHMSA-N 470.932 5.096 5 20 JKBD O=C(Nc1nnc(-c2ccccn2)s1)c1ccc(NCc2ccccc2Cl)c([N+](=O)[O-])c1 502887652 MUXLDCMEEBCDLQ-UHFFFAOYSA-N 466.910 5.026 5 20 JKBD CC[C@H](C)n1c(SCC(=O)Nc2ccc([N+](=O)[O-])cc2Br)nnc1-c1ccccc1 504291078 RUVFEEHRVOHWSF-ZDUSSCGKSA-N 490.383 5.318 5 20 JKBD COc1ccc(-n2c(SCc3c(F)cccc3[N+](=O)[O-])nnc2-c2ccccc2OC)cc1 504518406 LDTASWQVBPSAMZ-UHFFFAOYSA-N 466.494 5.291 5 20 JKBD C[C@H]1C[C@@H](C)CN(c2ccc(C(=O)N[C@H](c3ccccc3)c3nccs3)cc2[N+](=O)[O-])C1 505052919 AAGLBHAKCGGFKP-HYFFOGBASA-N 450.564 5.053 5 20 JKBD Cc1ccc(Cc2cnc(NC(=O)c3cn(C)nc3-c3ccc([N+](=O)[O-])cc3)s2)cc1Cl 507253800 SAQKKMBGVOPGDJ-UHFFFAOYSA-N 467.938 5.257 5 20 JKBD CC[C@@H](C)n1ncc2c(C(=O)N(CCOC)c3nc(-c4ccc([N+](=O)[O-])cc4)cs3)cc(C)nc21 508875284 BWCPGFPWDVRMGD-MRXNPFEDSA-N 494.577 5.036 5 20 JKBD Cn1ccnc1Sc1ccc(Cl)cc1NC(=O)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-] 509191175 ASGYHYQOAXITLL-UHFFFAOYSA-N 486.859 5.326 5 20 JKBD O=C(c1ccc(N[C@H](c2ccc(F)cc2)c2ccccc2Cl)c([N+](=O)[O-])c1)N1CCOCC1 517092163 FNQABMDWLISWGF-HSZRJFAPSA-N 469.900 5.061 5 20 JKBD COc1cc(Br)c(NC(=O)c2ccc(N3C[C@H](C)C[C@@H](C)C3)c([N+](=O)[O-])c2)cc1OC 520425669 UVSYEQGJOCZHPZ-ZIAGYGMSSA-N 492.370 5.109 5 20 JKBD O=C(c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1)N1CCCN(C(=O)c2ccccc2F)CC1 520503751 DONJSPVSYBOVAV-UHFFFAOYSA-N 497.910 5.168 5 20 JKBD CC(=O)Nc1cccc([C@H](C)N(Cc2ccccc2)C(=O)CCNc2ccccc2[N+](=O)[O-])c1 591757330 OCAFRSAZDBEJQY-IBGZPJMESA-N 460.534 5.145 5 20 JKBD CC1(C)CC(NC(=O)c2ccccc2Sc2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC(C)(C)N1 603466641 VFFLYHJXFVOHJU-UHFFFAOYSA-N 481.540 5.804 5 20 JKBD COC(=O)c1ccoc1CSc1ccccc1C(=O)Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1 603946678 UWPGUEOYZFPJTP-UHFFFAOYSA-N 495.538 5.643 5 20 JKBD C[C@H]1CCCCN1C(=O)c1ccc(NC(=O)C2CCN(c3ccccc3[N+](=O)[O-])CC2)cc1Cl 603988060 YRMILKMATCUBFQ-KRWDZBQOSA-N 484.984 5.118 5 20 JKBD Cc1ccc(NC(=O)c2ccc(NCc3cccc(NC(=O)C4CCC4)c3)c([N+](=O)[O-])c2)cc1 608972983 OTEFEBWENHLLBJ-UHFFFAOYSA-N 458.518 5.506 5 20 JKBD CCOc1cc(C(=O)Nc2ccc(O[C@@H](C)c3ccccc3)cc2C)c([N+](=O)[O-])cc1OC 609066323 CVQHPUBGFQUSIC-KRWDZBQOSA-N 450.491 5.703 5 20 JKBD Cc1cccc(COc2ccc(NC(=O)c3cn(C)nc3-c3ccc([N+](=O)[O-])cc3)c(C)c2)c1 609228190 IFEXCAXGBLKSFV-UHFFFAOYSA-N 456.502 5.443 5 20 JKBD O=C(Cc1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1)OCc1csc(-c2ccoc2)n1 731068744 DLADDDUHSZDPGQ-UHFFFAOYSA-N 486.509 5.450 5 20 JKBD O=C(O[C@H](c1ccc(Br)cc1)C(F)(F)F)c1csc(-c2cccc([N+](=O)[O-])c2)n1 731146180 PHAFNQVIHVQSTR-OAHLLOKOSA-N 487.253 5.941 5 20 JKBD O=C(COC(=O)[C@@H]1C[C@H]1c1ccc2ccccc2c1)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 731279259 XJSVSJOAYKLXBE-ZWKOTPCHSA-N 458.392 5.052 5 20 JKBD O=C(CSc1ccc(C(F)(F)F)cc1[N+](=O)[O-])N1CCC(c2cc3ccccc3[nH]2)CC1 744046077 RXDWSEHZNLDLFC-UHFFFAOYSA-N 463.481 5.593 5 20 JKBD CCc1ccccc1N(C(C)=O)c1nc(CSc2nc3ccc([N+](=O)[O-])cc3s2)cs1 787994759 GEBUOASSJSPYQT-UHFFFAOYSA-N 470.601 6.200 5 20 JKBD CC(=O)N[C@H](CC(=O)Nc1cc(Cl)c([N+](=O)[O-])cc1OCc1ccccc1)c1cccs1 822219431 FGKHDRWSDGUHII-GOSISDBHSA-N 473.938 5.095 5 20 JKBD C[C@@H](Oc1ccc(F)cc1)C(=O)O[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1 825380210 MJWBLHYZWRQXBC-SPLOXXLWSA-N 472.856 5.078 5 20 JKBD Cc1csc(SCc2c(C(=O)Nc3cc([N+](=O)[O-])c(F)cc3F)oc3ccccc23)n1 825487991 OHFWNYOBRVCNLF-UHFFFAOYSA-N 461.471 5.929 5 20 JKBD COC(=O)c1cc(Cl)cc(Cl)c1NC(=O)CSc1nc2ccc([N+](=O)[O-])cc2s1 862652758 BVSUINKDUGEHKL-UHFFFAOYSA-N 472.331 5.029 5 20 JKBD CC(C)N(Cc1nnc(-c2cccc([N+](=O)[O-])c2)o1)C(=O)/C=C/c1cc(C(F)(F)F)ccc1Cl 864244605 FKFPNJAXXGXCLD-RMKNXTFCSA-N 494.857 5.767 5 20 JKBD Cc1cc([N+](=O)[O-])nn1Cc1cccc(-c2nc(-c3ccc(Oc4ccc(F)cc4)nc3)no2)c1 904509923 YCRXBVYDNCQIKJ-UHFFFAOYSA-N 472.436 5.191 5 20 JKBD C[C@H](OC(=O)[C@@H](C)Oc1ccc(Cl)cc1Br)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 907683925 OMMGDJKMCNOSLN-WDEREUQCSA-N 496.701 5.132 5 20 JKBD Cc1c(-c2ccccc2)oc2c(C(=O)OCc3nc(-c4cccc([N+](=O)[O-])c4)no3)cccc2c1=O 914882427 OEXCQLKDLSXHGT-UHFFFAOYSA-N 483.436 5.084 5 20 JKBD Cc1ccc(S(=O)(=O)Nc2cccc(Cl)c2)cc1NC(=S)Nc1ccc([N+](=O)[O-])cc1 916115946 UDNHSIYHLKSCHV-UHFFFAOYSA-N 476.967 5.166 5 20 JKBD CCOC(=O)Nc1ccc(N[C@@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2ccccc2)cc1 917933067 CVYHMICKKHNLES-OAQYLSRUSA-N 468.897 5.609 5 20 JKBD O=C(COC(=O)c1cc2cc([N+](=O)[O-])ccc2o1)Nc1c(Cl)c(Cl)cc(Cl)c1Cl 919213457 KPGPILPBEKJXAW-UHFFFAOYSA-N 478.071 5.750 5 20 JKBD Cc1cccc(C(C)C)c1NC(=O)[C@@H](C)OC(=O)c1ccc(N[C@H](C)c2ccccn2)c([N+](=O)[O-])c1 920544884 MYLADRKKTAHFFN-RTBURBONSA-N 490.560 5.779 5 20 JKBD Cc1cc(-c2noc([C@H](C)OC(=O)c3ccc(N[C@H](C)c4ccccn4)c([N+](=O)[O-])c3)n2)ccc1F 920546302 YAGSUTPEUPZDSZ-CVEARBPZSA-N 491.479 5.578 5 20 JKBD Cc1ccc(C)c(Sc2ccc(NC(=O)Cn3c(C)nc([N+](=O)[O-])c3Br)cc2)c1 920750826 CRGZNTWURLSWHS-UHFFFAOYSA-N 475.368 5.269 5 20 JKBD CC(C)(C)CCCCCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CCc1cccc([N+](=O)[O-])c1 1793944204 MZQDZVNLGAFXRC-KOUNCHBCSA-N 457.615 5.162 5 20 JKBD O=C(CCc1cccc([N+](=O)[O-])c1)N1CCCC2(CCN(C(=O)[C@@H]3CCC[C@H]4CCCC[C@@H]43)CC2)C1 1806490068 GPTXRSQFEWTCEK-DMTNHVFBSA-N 495.664 5.365 5 20 JKBD O=C(/C=C/c1ccc([N+](=O)[O-])o1)N1CCC([C@@H]2CCCCN2C(=O)CCc2ccccc2Cl)CC1 1826571823 NWPPZDWSLUMYBE-SRLUVNLFSA-N 499.995 5.107 5 20 JKBD O=C(c1cc(Cl)ccc1F)N1CCC([C@@H]2CCCCN2C(=O)c2cc(F)cc([N+](=O)[O-])c2)CC1 1830612748 KYWPFZYJFUDESI-QFIPXVFZSA-N 491.922 5.074 5 20 JKBD O=C(O[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1)c1ccc(Br)o1 10800546 SVSQRFKAEMPWTQ-QGZVFWFLSA-N 479.670 5.141 5 20 JKBD Cc1ccc(NC(=O)[C@H](Sc2nnc(-c3cccc(Cl)c3)n2N)c2ccccc2)c([N+](=O)[O-])c1 11308997 HGFFCNAEBLPYJX-HXUWFJFHSA-N 494.964 5.001 5 20 JKBD CC(C)n1c(SC[C@H](O)COc2cccc([N+](=O)[O-])c2)nnc1-c1ccc(Cl)cc1Cl 15244601 UHOJWUDINVXLHF-OAHLLOKOSA-N 483.377 5.273 5 20 JKBD CSc1ccc([N+](=O)[O-])c(C(=O)O[C@@H](C(=O)Nc2ccc(C)cc2[N+](=O)[O-])c2ccccc2)c1 16196165 KOQOSZCQSMPYOR-OAQYLSRUSA-N 481.486 5.070 5 20 JKBD O=C(Nc1ccc(Cl)c(C(F)(F)F)c1)[C@H](Oc1cccnc1[N+](=O)[O-])c1ccccc1 22027535 BEBUFWYYOHKWSU-QGZVFWFLSA-N 451.788 5.421 5 20 JKBD Cc1cc(C)cc(-c2nnc(S[C@H](C(=O)Nc3ccc(C)cc3[N+](=O)[O-])c3ccccc3)o2)c1 22236792 DAHZWQDOCXAYGI-QFIPXVFZSA-N 474.542 6.042 5 20 JKBD Cc1c(NC(=O)[C@H](C)OC(=O)c2ccccc2-c2ncc(-c3ccccc3)o2)cccc1[N+](=O)[O-] 27415211 FSZIZNXEQJBJHE-KRWDZBQOSA-N 471.469 5.409 5 20 JKBD COc1ccc(-c2nnc(SCC(=O)Nc3ccccc3[N+](=O)[O-])n2C2CCCCC2)cc1 28606485 DDNKLCSMHYJXMK-UHFFFAOYSA-N 467.551 5.098 5 20 JKBD COc1cc([C@@H](C)N[C@@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2C(F)(F)F)ccc1OC(C)C 30492582 KQFNGIHAGLQYQQ-KGLIPLIRSA-N 469.460 5.087 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)N(Cc2cccc(Br)c2)C(C)C)cc1SC 482382396 QGRLGRDTZYCZQW-UHFFFAOYSA-N 453.358 5.139 5 20 JKBD C[C@H](Nc1ccc(C(=O)Nc2ccc(OC(F)F)c3ncccc23)cc1[N+](=O)[O-])c1ccccn1 509136341 IKFLIKLYLUYRFY-AWEZNQCLSA-N 479.443 5.565 5 20 JKBD Cc1cccc2c1CC[C@@H]2N[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Br)c1ccccc1 517934328 PDBZJHJANVSARV-JTHBVZDNSA-N 480.362 5.623 5 20 JKBD COc1ccc(Br)c(NC(=O)CSc2ccc(C(F)(F)F)cc2[N+](=O)[O-])c1 522891398 YZKCUQXGCZVCMX-UHFFFAOYSA-N 465.247 5.116 5 20 JKBD CCCN(CC(=O)Nc1ccc(Cl)cc1Cl)[C@@H](C)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 560868351 SVGDMXTZLHUVGJ-ZDUSSCGKSA-N 478.336 5.363 5 20 JKBD O=C(N[C@H](c1ccccc1)c1ccc2nc(C(F)(F)F)[nH]c2c1)c1ccc([N+](=O)[O-])cc1F 603951703 YZQKBCRRJFWQBF-LJQANCHMSA-N 458.371 5.148 5 20 JKBD C[C@H](NC(=O)CSc1nnc(-c2ccccc2F)n1-c1ccc(F)cc1)c1cccc([N+](=O)[O-])c1 603965792 LOAQNBGHICCDBV-HNNXBMFYSA-N 495.511 5.090 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Cl)N1CCC[C@H](c2nc(-c3ccc(Cl)cc3)no2)C1 608838093 BQBJMBQYGWFBGS-ZDUSSCGKSA-N 462.293 5.363 5 20 JKBD CC(C)N(Cc1nnc(-c2cccc([N+](=O)[O-])c2)o1)C(=O)c1cccc(OC2CCCC2)c1 731163882 CYUAZTJUPYDZCZ-UHFFFAOYSA-N 450.495 5.017 5 20 JKBD O=C(COC(=O)c1oc2ccccc2c1CSc1cccs1)Nc1ccccc1[N+](=O)[O-] 742974807 LTBOVLBWHLMCOC-UHFFFAOYSA-N 468.512 5.490 5 20 JKBD Cc1nc(COC(=O)c2c3c(nc4ccccc24)/C(=C\c2ccc([N+](=O)[O-])cc2)CCC3)no1 783179884 PRHHJMOECBXAHF-LGMDPLHJSA-N 456.458 5.068 5 20 JKBD COc1ccc([C@H]2[C@H](C(=O)Nc3cc([N+](=O)[O-])c(F)cc3F)CCC(=O)N2c2ccc(C)cc2)cc1 897500584 ZTHVIPNXNHCCIE-CLOONOSVSA-N 495.482 5.313 5 20 JKBD CC(C)(NC(=O)c1cccc(Cl)c1)c1noc(-c2ccc3[nH]c4ccccc4c(=O)c3c2)n1 904597507 FSWWRISZTZVFOJ-UHFFFAOYSA-N 458.905 5.050 5 20 JKBD Cc1cc(C)c2cc(C(=O)O[C@H](C)C(=O)Nc3nc(-c4cccc([N+](=O)[O-])c4)cs3)sc2n1 917349711 DLBHSSBXGXXKMW-CYBMUJFWSA-N 482.543 5.129 5 20 JKBD Cc1cc(C)c2cc(C(=O)O[C@@H](C)C(=O)Nc3nc(-c4cccc([N+](=O)[O-])c4)cs3)sc2n1 917349712 DLBHSSBXGXXKMW-ZDUSSCGKSA-N 482.543 5.129 5 20 JKBD C[C@H](OC(=O)c1ccc(Sc2nncn2C)c([N+](=O)[O-])c1)c1ccc(Cl)cc1Cl 917959031 WTEKLSUGPRFLTK-JTQLQIEISA-N 453.307 5.099 5 20 JKBD O=C(Nc1ccccc1C(=O)Nc1cc(N2CCCC2=O)ccc1F)c1ccc([N+](=O)[O-])cc1Cl 918655413 ILCVZOXYFWKAET-UHFFFAOYSA-N 496.882 5.019 5 20 JKBD CCCn1cc(NC(=O)C/C(=C\c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)ccc1=O 919845552 ZNTKQGHOUVTLJP-NBVRZTHBSA-N 474.542 5.346 5 20 JKBD Cc1cccc2sc(C(=O)OCCNC(=O)c3ccc([N+](=O)[O-])cc3Cl)c(Cl)c12 920147430 BLZREGLXBHSYMB-UHFFFAOYSA-N 453.303 5.012 5 20 JKBD C[C@H](OC(=O)c1csc(-c2ccc(Cl)s2)n1)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl 920675451 JVGOYFPXZJOZGO-QMMMGPOBSA-N 472.331 5.271 5 20 JKBD O=C(/C=C/c1ccco1)NC1(c2ccc(NC(=O)Cc3ccc(Cl)cc3[N+](=O)[O-])cc2)CCC1 1786114944 QCBORSMJVZXGAI-ZHACJKMWSA-N 479.920 5.231 5 20 JKBD O=C(NC1(c2ccc(NC(=O)c3ccc4sccc4c3O)cc2)CCC1)c1ccc([N+](=O)[O-])o1 1790931100 FKGXRUBZJXKKTC-UHFFFAOYSA-N 477.498 5.170 5 20 JKBD CCc1cc(C(=O)NC2(c3ccc(NC(=O)/C=C/c4ccccc4[N+](=O)[O-])cc3)CCC2)cc(C)n1 1792317865 VSVYKQIZZDVMTK-NTEUORMPSA-N 484.556 5.322 5 20 JKBD O=C(CSc1ccccc1[N+](=O)[O-])Nc1cc([C@H]2CCCCN2C(=O)c2ccc(Cl)cc2)[nH]n1 1822313281 OASFQCMHWWEQIC-GOSISDBHSA-N 499.980 5.070 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)N1CCC([C@H]2CCCCN2C(=O)[C@H](C)c2cccs2)CC1 1832144930 DRCJBOFFCXHPIU-DYESRHJHSA-N 487.597 5.141 5 20 JKBD O=C(c1ccc([N+](=O)[O-])[nH]1)N1CCC([C@@H]2CCCCN2C(=O)c2ccc(-c3ccccc3)cc2)CC1 1832699566 GJTFLCZFVYQTSQ-VWLOTQADSA-N 486.572 5.137 5 20 JKBD COc1cccc(NCc2nnc(SCc3cccc([N+](=O)[O-])c3)n2C2CCCCC2)c1 10073034 ZPFFXWIJAVPYFG-UHFFFAOYSA-N 453.568 5.605 5 20 JKBD C[C@H](OC(=O)C1c2ccccc2Oc2ccccc21)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl 10797890 WZRJYOFYDUQHGZ-ZDUSSCGKSA-N 452.850 5.056 5 20 JKBD O=C(c1ccc(NCc2ccccc2)c([N+](=O)[O-])c1)N1CC=C(c2c[nH]c3ccccc23)CC1 10990207 WKKULOJWZDTCQY-UHFFFAOYSA-N 452.514 5.618 5 20 JKBD C[C@H](Sc1nnc(-c2ccc(C(C)(C)C)cc2)n1C)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl 22213578 QQQUQOXBAPMYLM-ZDUSSCGKSA-N 473.986 5.461 5 20 JKBD CCN(CC)c1ccc(-c2nnc(S[C@@H](C)C(=O)Nc3ccc([N+](=O)[O-])cc3Cl)n2C)cc1 22434058 LYTXATKDSNLYME-AWEZNQCLSA-N 489.001 5.009 5 20 JKBD COc1ccc(CSc2nnc(S[C@@H](C)C(=O)Nc3cccc([N+](=O)[O-])c3C)s2)cc1 24002405 FACOAXWLNZWPFU-ZDUSSCGKSA-N 476.605 5.175 5 20 JKBD COc1cc([N+](=O)[O-])ccc1NC(=O)CCSc1nnc(-c2ccc(F)cc2)n1-c1ccccc1 26368901 HWRXMVZIRPHEGY-UHFFFAOYSA-N 493.520 5.111 5 20 JKBD Cc1nc(-c2cccc(Cl)c2)sc1C(=O)O[C@H](C)C(=O)Nc1cccc([N+](=O)[O-])c1C 26845959 LFHSRLAWUQPVDP-CYBMUJFWSA-N 459.911 5.173 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Br)[C@H](c1ccccc1)N1CCO[C@@H](c2ccccc2)C1 29533026 PYDFQZIKKCDGCG-PKTZIBPZSA-N 496.361 5.111 5 20 JKBD Cc1ncc(-c2ccc(NC(=O)Cc3cn(-c4ccccc4)nc3-c3ccc([N+](=O)[O-])cc3)cc2)o1 29858588 CJVFAKNRVGFCFZ-UHFFFAOYSA-N 479.496 5.592 5 20 JKBD O=C(c1nc(-c2ccccc2)n2c1CCCCC2)N(Cc1ccccc1[N+](=O)[O-])CC(F)(F)F 59253238 MFIKFCXWZINOCU-UHFFFAOYSA-N 472.467 5.389 5 20 JKBD COc1ccc(-c2nc(C)c(C(=O)O[C@H](C)c3nnc(-c4ccc([N+](=O)[O-])cc4)o3)s2)cc1OC 105091828 CEDYVQKHBVVXJL-CYBMUJFWSA-N 496.501 5.012 5 20 JKBD CC(C)[C@H](NC(=O)c1ccc(N[C@@H](C)c2ccccn2)c([N+](=O)[O-])c1)c1ccc2c(c1)OCCO2 108787324 QQAITVJJONCDMY-GKVSMKOHSA-N 476.533 5.061 5 20 JKBD C[C@H](Nc1ccc(C(=O)N2CCC(C(=O)c3cc(F)ccc3F)CC2)cc1[N+](=O)[O-])c1ccccn1 108828499 QKESQPXUUYGTDK-INIZCTEOSA-N 494.498 5.176 5 20 JKBD CCOc1cccc([C@@H](C)NC(=O)C2CCN(c3ccc(C(F)(F)F)cc3[N+](=O)[O-])CC2)c1 109367060 CUVYZDLDCPQFBK-OAHLLOKOSA-N 465.472 5.106 5 20 JKBD C[C@H](Nc1ccc(C(=O)Nc2ccc3nc(N4CCCC4)sc3c2)cc1[N+](=O)[O-])c1ccccn1 195605296 HQOPFVFPLVWSOA-INIZCTEOSA-N 488.573 5.625 5 20 JKBD C[C@H](Sc1nnc(-c2ccccc2Cl)n1Cc1ccccc1)C(=O)Nc1cccc([N+](=O)[O-])c1 409932029 JTDCTONSPPBZOX-INIZCTEOSA-N 493.976 5.674 5 20 JKBD O=[N+]([O-])c1ccccc1CSc1nnc(Cn2cnc3ccccc32)n1-c1ccccc1Cl 410297175 JYNIGTCKVOZJMY-UHFFFAOYSA-N 476.949 5.519 5 20 JKBD Cc1ccc(-c2nc(C)c([C@H](C)NC(=O)C3CCN(c4ccccc4[N+](=O)[O-])CC3)s2)cc1 502481744 NRHLFEDWBLOSRS-KRWDZBQOSA-N 464.591 5.429 5 20 JKBD O=C(C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)Nc1cccc(C(F)F)c1 505978466 DBRCNFHTKPYVAJ-SFQUDFHCSA-N 465.481 6.712 5 20 JKBD Cc1cc(Sc2ccccc2)ccc1NC(=O)c1ccc(Sc2nncn2C)c([N+](=O)[O-])c1 509021617 KTVJCIUSCNSXPI-UHFFFAOYSA-N 477.571 5.586 5 20 JKBD Cn1c([C@H](NCc2ccc(-c3ccccc3[N+](=O)[O-])s2)c2ccccc2)nc2ccccc21 517549361 LRLVAOSVFXLMOQ-RUZDIDTESA-N 454.555 6.089 5 20 JKBD C[C@H](NC(=O)N(Cc1ccc(Cl)c(Cl)c1)Cc1ccccn1)c1cccc([N+](=O)[O-])c1 517889406 LFLLCAAMAXXPTK-HNNXBMFYSA-N 459.333 5.770 5 20 JKBD Cc1ccc([C@H]2CCCN2C(=O)C2CCN(c3ccc(C(F)(F)F)cc3[N+](=O)[O-])CC2)cc1C 518793090 GHWNOPQRCLGPRD-OAQYLSRUSA-N 475.511 5.811 5 20 JKBD O=C(Nc1ccc(Sc2ccccc2Cl)cc1)N1CCN(c2ccc([N+](=O)[O-])nc2)CC1 520464404 XPJIHGCSXFQRNK-UHFFFAOYSA-N 469.954 5.149 5 20 JKBD CCO[C@@H]1CCCN(C(=O)C/C(=C\c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)C1 604427858 DKQMBPNCDOYACQ-WORNYLJVSA-N 451.548 5.163 5 20 JKBD COc1cc(C(=O)Nc2ccc(-c3cnc[nH]3)cc2)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 604484764 WVDWTONCCHEIRL-UHFFFAOYSA-N 464.865 5.692 5 20 JKBD NC(=O)CCSc1ccccc1NC(=O)c1ccc(NCc2ccccc2Cl)c([N+](=O)[O-])c1 609407711 IDSQPUVVCQFBCB-UHFFFAOYSA-N 484.965 5.080 5 20 JKBD CCc1cccc[n+]1/C(C(=S)NCc1cccc(C(F)(F)F)c1)=C(/O)c1ccc([N+](=O)[O-])cc1 726570733 RSBUCVNTZVXMBU-UHFFFAOYSA-O 488.511 5.465 5 20 JKBD Cc1sc(NC(=O)c2cc([N+](=O)[O-])c(C)c([N+](=O)[O-])c2C)nc1-c1c(F)cc(F)cc1F 728835190 JPGDDOOPIVFDEC-UHFFFAOYSA-N 466.397 5.221 5 20 JKBD Cc1c(C(=O)O[C@@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)nnn1-c1ccc(-c2ccccc2)cc1 731265111 CCKPEEGPMOSGGS-KRWDZBQOSA-N 496.483 5.119 5 20 JKBD Cc1csc(Sc2ccc([N+](=O)[O-])cc2C(=O)OCC(=O)Nc2cc(Cl)ccc2F)n1 849132729 SVEAEISFVYJAPZ-UHFFFAOYSA-N 481.914 5.099 5 20 JKBD O=C(Nc1ccc(NCc2c(Br)cccc2[N+](=O)[O-])c(C(F)(F)F)c1)[C@H]1CCCO1 863997199 UPMZVXUJZIHDJI-QGZVFWFLSA-N 488.260 5.106 5 20 JKBD O=c1c2ccccc2n(Cc2nc(-c3cccc(Cn4cnc5ccccc54)c3)no2)c2ccccc12 904491061 LZQLYOIMQRDJCZ-UHFFFAOYSA-N 483.531 5.651 5 20 JKBD COc1cc(-c2nc(Cn3cnc4ccccc43)no2)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 904736400 AOWUVFRUIKSSQP-UHFFFAOYSA-N 477.864 5.497 5 20 JKBD CCCc1cc[n+](/C(C(=S)Nc2cccc(C(C)C)c2)=C(/O)c2ccc(C)c([N+](=O)[O-])c2)cc1 917616310 WHOYPHDQJWZTGE-UHFFFAOYSA-O 476.622 6.590 5 20 JKBD Cn1cc(CCCOC(=O)C/C(=C\c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)cn1 920514467 XRLWHCCXAMPQEX-CPNJWEJPSA-N 462.531 5.045 5 20 JKBD O=C(/C=C/c1ccc([N+](=O)[O-])o1)Nc1ccc(C2(NC(=O)CCc3cccs3)CCC2)cc1 1786206256 DOXIMMROJFTNPC-DHZHZOJOSA-N 465.531 5.029 5 20 JKBD O=C(Cc1cccc([N+](=O)[O-])c1)NC1(c2ccc(NC(=O)[C@]3(F)CCCCC3(F)F)cc2)CCC1 1789163871 RHDCVWOMARYTIH-XMMPIXPASA-N 489.494 5.189 5 20 JKBD Cc1c(C(=O)Nc2ccc(C3(NC(=O)c4ccc[nH]4)CCC3)cc2)cc(Br)cc1[N+](=O)[O-] 1790713094 JLIRAWIIOJTDQM-UHFFFAOYSA-N 497.349 5.055 5 20 JKBD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)[nH]n1)C1CCCC1 1816680383 BODRNPJLDHQNGJ-SFHVURJKSA-N 467.551 5.029 5 20 JKBD O=C(Nc1cc([C@@H]2CCCCN2C(=O)CCc2cccc([N+](=O)[O-])c2)[nH]n1)c1cccc2ccoc12 1821534284 IVNQYZFANCNCHZ-QFIPXVFZSA-N 487.516 5.003 5 20 JKBD Cc1ccc(CC(=O)N2CCCC[C@H]2C2CCN(C(=O)c3cc4ccccc4o3)CC2)cc1[N+](=O)[O-] 1830365888 HPPXKPFWNNBWHO-QHCPKHFHSA-N 489.572 5.125 5 20 JKBD Cc1ccc(C(=O)N2CCC([C@@H]3CCCCN3C(=O)CSc3ccccc3[N+](=O)[O-])CC2)c(C)c1 1831777071 BMZKUJYRRZDSPT-QHCPKHFHSA-N 495.645 5.237 5 20 JKBD O=C(Nc1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2NCc2ccccc2)cc1)c1ccco1 10722228 CJJDBTGFKVLAOK-UHFFFAOYSA-N 456.458 5.305 5 20 JKBD CCc1ccccc1N(C(C)=O)c1nc(COC(=O)c2ccc(Cl)c([N+](=O)[O-])c2)cs1 11025218 VVUHYNAVMOYLER-UHFFFAOYSA-N 459.911 5.309 5 20 JKBD C[C@H](OC(=O)c1cc2cc([N+](=O)[O-])ccc2s1)C(=O)N(c1nccs1)C1CCCCC1 11182194 ICIUYUSEOJHBNO-ZDUSSCGKSA-N 459.549 5.177 5 20 JKBD Cn1cnnc1Sc1ccc(C(=O)Nc2ccccc2-c2nc3ccccc3s2)cc1[N+](=O)[O-] 14604113 VDETZRNDHBIXRY-UHFFFAOYSA-N 488.554 5.404 5 20 JKBD Cn1c(SCC(=O)N[C@@H](c2ccccc2)c2cccs2)nc2cc3ccccc3cc2c1=O 19417887 ZUVKYNAVIPGBCN-DEOSSOPVSA-N 471.607 5.146 5 20 JKBD Cc1ccc(C=C(C(=O)Nc2ccccc2Cl)C(=O)Nc2ccccc2Cl)cc1[N+](=O)[O-] 20885620 LBBIIHBVQZJXCU-UHFFFAOYSA-N 470.312 5.871 5 20 JKBD CC(=O)Nc1cccc([C@H](C)N(Cc2ccccc2)C(=O)[C@H](C)Sc2ccc([N+](=O)[O-])cc2)c1 23193198 JUSXVABBXQVDIT-OALUTQOASA-N 477.586 5.824 5 20 JKBD O=C(/C=C/c1cnc2ccccc2n1)O[C@@H](C(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1)c1ccccc1 23647905 MGKLZYRNWNVPSO-CYNGKWMKSA-N 488.887 5.128 5 20 JKBD Cc1ccc(NC(=O)[C@H](OC(=O)c2cc3cnn(C(C)C)c3nc2C)c2ccccc2)c([N+](=O)[O-])c1 26255748 WACDLFXEHOIGCS-HSZRJFAPSA-N 487.516 5.074 5 20 JKBD COc1ccc([N+](=O)[O-])cc1OCc1csc(N(C(C)=O)c2cccc(C(F)(F)F)c2)n1 31673867 SRUWDTRSOCOMTG-UHFFFAOYSA-N 467.425 5.342 5 20 JKBD O=[N+]([O-])c1cccc(-c2ccc(CNCc3ccccc3-c3ccc(Cn4ccnc4)cc3)o2)c1 504163921 UFDWCCFKYZUQJL-UHFFFAOYSA-N 464.525 6.056 5 20 JKBD Cc1noc([C@H](C)NC(=O)c2c3c(nc4ccccc24)/C(=C/c2ccc([N+](=O)[O-])cc2)CCC3)n1 509115920 UKXUADUMPNUEPV-JZBMNUFDSA-N 469.501 5.202 5 20 JKBD CCc1cc(O)nc(-c2cccc(NC(=O)c3ccc(Nc4ccccc4)c([N+](=O)[O-])c3)c2)n1 510961625 MZTVZXFEHRWVRH-UHFFFAOYSA-N 455.474 5.316 5 20 JKBD C[C@H](Nc1ccc(C(=O)Nc2cccc(CSc3ccccn3)c2)cc1[N+](=O)[O-])c1ccccn1 512558228 CPZVIUXGFJZGEE-SFHVURJKSA-N 485.569 6.103 5 20 JKBD COc1ccc([C@@H](NC(=O)c2cc(OC)c(OC(F)F)cc2[N+](=O)[O-])c2ccc(C)cc2)cc1 512946289 ZUTPAUDRZARRAK-QFIPXVFZSA-N 472.444 5.041 5 20 JKBD O=C(Nc1ccc(F)cc1Cl)c1ccccc1NS(=O)(=O)c1c(Cl)cccc1[N+](=O)[O-] 517912561 VFTBFCLRGVGQOU-UHFFFAOYSA-N 484.292 5.094 5 20 JKBD Cc1nc(-c2ccccc2)sc1[C@H](C)Nc1cnn(-c2ccc([N+](=O)[O-])cc2)c(=O)c1Cl 523295381 KVRPOJVBAYBEOP-ZDUSSCGKSA-N 467.938 5.399 5 20 JKBD O=C(c1cc([N+](=O)[O-])ccc1NCc1ccccc1)N1CCC(c2nc3ccccc3s2)CC1 602139720 HZWHUDYJYJIQEJ-UHFFFAOYSA-N 472.570 5.836 5 20 JKBD O=C(N[C@H](c1ccccc1)c1ccccn1)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1 603449027 JNYNUFXOBRXYHL-XMMPIXPASA-N 459.889 5.955 5 20 JKBD CCOc1ccc(NC(=O)C2CCN(c3ccc(C(F)(F)F)cc3[N+](=O)[O-])CC2)cc1OCC 603459772 JCQHNWCWXLZAHU-UHFFFAOYSA-N 481.471 5.266 5 20 JKBD O=C(Nc1nnc(SCc2c(Cl)cccc2Cl)s1)c1ccc([N+](=O)[O-])cc1F 603947154 LSHOFXKEAIDYEC-UHFFFAOYSA-N 459.311 5.437 5 20 JKBD CCOC1CCN(C(=O)c2c3c(nc4ccccc24)/C(=C\c2cccc([N+](=O)[O-])c2)CCC3)CC1 604255776 VDJNLNRHXLFUAK-JZJYNLBNSA-N 471.557 5.661 5 20 JKBD CC(=O)N(c1cccc(Cl)c1)c1nc(COc2ccc([N+](=O)[O-])cc2C(F)(F)F)cs1 604508335 DGFXVFBQEREKKP-UHFFFAOYSA-N 471.844 5.987 5 20 JKBD O=C(c1csc(-c2ccc([N+](=O)[O-])cc2)n1)N(Cc1ccc2c(c1)OCO2)C1CCCC1 604517428 OIRYDBKGQCLASL-UHFFFAOYSA-N 451.504 5.032 5 20 JKBD CCN(CC)S(=O)(=O)c1ccc([C@H](C)NCc2ccc(-c3ccccc3[N+](=O)[O-])s2)cc1 604539205 YVSSKCUBGXAHGM-KRWDZBQOSA-N 473.620 5.205 5 20 JKBD O=C(c1ccc(NCc2ccccc2Cl)c([N+](=O)[O-])c1)N1CCO[C@@H](c2cccc(F)c2)C1 608965283 SZTMCPMZDFEUDB-HSZRJFAPSA-N 469.900 5.213 5 20 JKBD Cc1ccc(-c2nnc(S[C@@H](C)C(=O)Nc3ccc([N+](=O)[O-])cc3C(F)(F)F)o2)cc1 619647625 YXBWKLWSTJZZDD-NSHDSACASA-N 452.414 5.091 5 20 JKBD Cc1ccc(-c2csc(NC(=O)c3cn(-c4ccccc4)nc3-c3cccnc3)n2)cc1[N+](=O)[O-] 619729303 BOXREFCTZSJFIZ-UHFFFAOYSA-N 482.525 5.527 5 20 JKBD Cc1ccc(/C(O)=C(/C(=S)N[C@H](C)c2cccs2)[n+]2ccc(C(C)(C)C)cc2)cc1[N+](=O)[O-] 726579461 KZRXJOFVJVKSKI-QGZVFWFLSA-O 482.651 6.112 5 20 JKBD Cc1ccc(-c2csc(NC(=O)c3ccc(F)c(NC(=O)OC(C)(C)C)c3)n2)cc1[N+](=O)[O-] 730458789 ZKNUBCVOVSQKGH-UHFFFAOYSA-N 472.498 5.765 5 20 JKBD COc1ccc(-c2ccc(C(=O)O[C@H](C)C(=O)Nc3cccc([N+](=O)[O-])c3C)c(F)c2)c(F)c1 730634131 NIKKDTVFTMKGNO-CQSZACIVSA-N 470.428 5.041 5 20 JKBD C[C@H](OC(=O)[C@H](C)Cc1ccc(Cl)cc1Cl)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 730636377 VKCBJTDEAGZULZ-NEPJUHHUSA-N 450.278 5.435 5 20 JKBD O=C(c1nn(Cc2ccccc2)c(=O)c2ccccc12)N(CC1CC1)c1ccc(Cl)c([N+](=O)[O-])c1 745345016 UEXSVJACRJJQCR-UHFFFAOYSA-N 488.931 5.063 5 20 JKBD CCCn1c(C)cc(-c2csc(NC(=O)c3cc([N+](=O)[O-])ccc3Br)n2)c1C 751056167 VVOFIVSKXNZWPI-UHFFFAOYSA-N 463.357 5.561 5 20 JKBD O=C(Nc1ccccc1C(=O)N1CCC([C@H](O)c2ccccc2)CC1)c1ccc([N+](=O)[O-])cc1Cl 914539209 KOIMUUROXBTWIH-XMMPIXPASA-N 493.947 5.086 5 20 JKBD Cc1ccccc1NC(=O)c1cc2ccccc2cc1OS(=O)(=O)Cc1ccc([N+](=O)[O-])cc1 914577531 SMSKWIVUBRFXGX-UHFFFAOYSA-N 476.510 5.218 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Cl)[C@H](c1ccccc1)N1CCC([C@H](O)c2ccccc2)CC1 917023870 MOPGYXRADQOHRW-LOSJGSFVSA-N 479.964 5.374 5 20 JKBD Cc1c([N+](=O)[O-])cc(C(=O)O[C@H](C)C(=O)N2c3ccccc3Sc3ccccc32)cc1[N+](=O)[O-] 919228370 PHIMVUIUVBAWJY-CQSZACIVSA-N 479.470 5.186 5 20 JKBD C[C@H](Nc1ccc(C(=O)OCC(=O)N[C@H](C)c2cccc3ccccc23)cc1[N+](=O)[O-])c1ccccn1 920544955 OJPUBJTXBXCVCO-MOPGFXCFSA-N 498.539 5.350 5 20 JKBD O=C(C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)NCc1ccc(-n2ccnc2)cc1 921148363 FVOBAVHBYXFAND-RCCKNPSSSA-N 495.564 5.637 5 20 JKBD C[C@@H](SCc1nc(O)c2c(-c3ccccc3)csc2n1)C(=O)OCc1ccccc1[N+](=O)[O-] 921173632 HTNHUPAQCHVRGN-CQSZACIVSA-N 481.555 5.337 5 20 JKBD CSc1ccc(CC(=O)NC2(c3ccc(NC(=O)c4cc(C)c([N+](=O)[O-])cn4)cc3)CCC2)cc1 1788767725 XARILQQXSXFURC-UHFFFAOYSA-N 490.585 5.011 5 20 JKBD COc1cc(C(=O)NC2(c3ccc(NC(=O)C4(F)CCCCC4)cc3)CCC2)ccc1[N+](=O)[O-] 1789161612 DDUWFWBXZOEZDR-UHFFFAOYSA-N 469.513 5.024 5 20 JKBD Cc1cc(C(=O)NC2(c3ccc(NC(=O)c4cccc([N+](=O)[O-])c4Br)cc3)CCC2)c[nH]1 1790636722 NLUNALMMBSZFIL-UHFFFAOYSA-N 497.349 5.055 5 20 JKBD COc1cc(C(=O)NC2(c3ccc(NC(=O)c4cccc5ccoc45)cc3)CCC2)ccc1[N+](=O)[O-] 1790954731 RMXDVBJEUAMMKS-UHFFFAOYSA-N 485.496 5.411 5 20 JKBD Cc1ccc(CC(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cc3c(Cl)cccc3s2)cc1[N+](=O)[O-] 1797649849 NDKAMVMDUNNRPR-BCDXTJNWSA-N 498.004 5.266 5 20 JKBD CC1(C(=O)N2CC[C@@H](CNC(=O)c3cc4cc([N+](=O)[O-])ccc4s3)[C@H]2c2cccnc2)CCCC1 1812304864 VJQGPBYBROZLMI-FDDCHVKYSA-N 492.601 5.104 5 20 JKBD Cc1ccc(C(=O)N2CCC([C@@H]3CCCCN3C(=O)Cc3ccc(Cl)cc3[N+](=O)[O-])CC2)s1 1824159532 AIPOQQRHCXQKDE-FQEVSTJZSA-N 490.025 5.094 5 20 JKBD Cc1cc2cccc(C(=O)N3CCCC[C@H]3C3CCN(C(=O)c4cc(F)cc([N+](=O)[O-])c4)CC3)c2[nH]1 1828214132 CXFFDFKQMYWHBT-DEOSSOPVSA-N 492.551 5.071 5 20 JKBD Cc1c(C(=O)N2CCC([C@@H]3CCCCN3C(=O)c3ccoc3Cl)CC2)cc(Cl)cc1[N+](=O)[O-] 1829864077 UDYAHYCGZHLVSH-IBGZPJMESA-N 494.375 5.350 5 20 JKBD Cc1c(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3cccc(F)c3)CC2)cc(Cl)cc1[N+](=O)[O-] 1830734291 BWIMCRLTAWDLSY-JOCHJYFZSA-N 487.959 5.243 5 20 JKBD Cc1cc(O)c([N+](=O)[O-])cc1C(=O)N1CCC([C@H]2CCCCN2C(=O)c2ccccc2C2CC2)CC1 1832556350 XBWKQTSYQHMXLE-XMMPIXPASA-N 491.588 5.033 5 20 JKBD CC(C)n1ncc2c(C(=O)Nc3cc4c(cc3[N+](=O)[O-])OCCCO4)cc(-c3ccccc3)nc21 10965458 OGAWYVNCAZRJKH-UHFFFAOYSA-N 473.489 5.001 5 20 JKBD Cn1cnnc1Sc1ccc(C(=O)Nc2ccccc2Oc2ccccc2Cl)cc1[N+](=O)[O-] 15710582 JQYBYSKOQFBFMC-UHFFFAOYSA-N 481.921 5.573 5 20 JKBD C[C@@H](Sc1nnc(-c2ccc(F)cc2)c2ccccc12)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl 20883461 TYYPAWGYDAYRAJ-CYBMUJFWSA-N 482.924 6.117 5 20 JKBD C[C@H](Sc1nncn1-c1cccc(Cl)c1)C(=O)Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1 24844132 UUGHHWWCWILOKW-LBPRGKRZSA-N 486.966 5.072 5 20 JKBD C[C@H](N[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1)c1ccc2c(c1)OCO2 30500773 LPVGRRRVCMYFHJ-RCDICMHDSA-N 453.882 5.008 5 20 JKBD CCCC(=O)Nc1cccc(CNC(=O)Cc2cn(-c3ccccc3)nc2-c2ccc([N+](=O)[O-])cc2)c1 68704970 BGEGFNJHKXKUQX-UHFFFAOYSA-N 497.555 5.045 5 20 JKBD Cc1sc(NC(=O)c2ccc(NC(=O)c3cccs3)cc2)nc1-c1cccc([N+](=O)[O-])c1 195703964 QIUXRNUDOPYYDJ-UHFFFAOYSA-N 464.528 5.593 5 20 JKBD O=C(CSc1ccc([N+](=O)[O-])cc1)Nc1ccc2c(c1)CCC(=O)N2Cc1ccc(Cl)cc1 195721949 JYAJITKXFLOMPC-UHFFFAOYSA-N 481.961 5.458 5 20 JKBD Cc1ccc(-c2csc(NC(=O)c3sc(COc4ccc(F)cc4)nc3C)n2)cc1[N+](=O)[O-] 218146070 JLPRMRUOWUSHNZ-UHFFFAOYSA-N 484.534 5.762 5 20 JKBD C[C@H](N[C@@H](Cc1ccccc1)c1ccccc1)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 248235146 DGGDGEGTEDPXMH-AOMKIAJQSA-N 457.452 5.514 5 20 JKBD Cc1noc(C)c1CCNC(=O)c1ccccc1Sc1ccc(C(F)(F)F)cc1[N+](=O)[O-] 410040775 JMJHSNATBSMVFD-UHFFFAOYSA-N 465.453 5.342 5 20 JKBD Cc1ccc(NC(=O)C(C)C)cc1NC(=O)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 479251129 RZTJINVLWDGTIB-UHFFFAOYSA-N 492.498 5.372 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)Nc2cc(Cl)ccc2Oc2cccc(C)c2)cc1SC 482320765 WWXGVUDXZKZWPQ-UHFFFAOYSA-N 458.923 6.332 5 20 JKBD O=C(c1cc([N+](=O)[O-])ccc1Sc1ccccc1)N1CCC[C@H](c2nnc3n2CCCCC3)C1 486565854 NDQJSGJQWYAZNK-SFHVURJKSA-N 477.590 5.084 5 20 JKBD O=C(CSCc1cc(-c2cccs2)on1)Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1 488345635 KGYWKLLAUGIGFA-UHFFFAOYSA-N 458.546 5.307 5 20 JKBD COc1cc(C(=O)Nc2sc3c(c2C(=O)c2ccccc2)CCCC3)c([N+](=O)[O-])cc1OC 503062963 XGWAPZHGRYZPTO-UHFFFAOYSA-N 466.515 5.036 5 20 JKBD C[C@H]1Cc2cc([N+](=O)[O-])ccc2N1C(=O)c1csc(-c2cc(Br)cs2)n1 504386840 DIRUZWPMOWLTSP-VIFPVBQESA-N 450.339 5.134 5 20 JKBD CCN(C(=O)N[C@@H](C)c1cccc([N+](=O)[O-])c1)[C@@H]1CCSc2ccc(Br)cc21 507330873 RSOKWGHMRNHBES-SCLBCKFNSA-N 464.385 5.687 5 20 JKBD CC(=O)Nc1cccc([C@H](C)N(Cc2ccccc2)C(=O)c2cc3cc([N+](=O)[O-])ccc3o2)c1 514208433 LYLYICLBJDYBKW-KRWDZBQOSA-N 457.486 5.703 5 20 JKBD C[C@H](N[C@@H](C)c1cccc(NC(=O)Cc2ccccc2F)c1)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl 515523535 OGAWTDDBPUZMKL-HOTGVXAUSA-N 498.942 5.246 5 20 JKBD O=C(C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)Nc1ccc2nc[nH]c2c1 521580717 UGQSCVYWVIRKEQ-WJDWOHSUSA-N 455.499 5.650 5 20 JKBD O=C(c1c2c(nc3ccccc13)/C(=C\c1cccc([N+](=O)[O-])c1)CCC2)N1CCC(n2ccnc2)CC1 522387247 FNVASMFISSPICC-FXBPSFAMSA-N 493.567 5.694 5 20 JKBD O=C(C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)Nc1nc(-c2ccncc2)cs1 603454843 SRNDJVGAPYFQFT-QGOAFFKASA-N 499.577 6.292 5 20 JKBD CC(C)(C)C(=O)N1CCOc2ccc(NC(=O)c3cc([N+](=O)[O-])ccc3NCc3ccccc3)cc21 604020462 QPNHSPZVNORWGI-UHFFFAOYSA-N 488.544 5.231 5 20 JKBD O=[N+]([O-])c1ccc(-c2ccc(CNCc3ccc(CN4CCCC4)cc3)o2)c(Br)c1 608835918 YTQMDCIUHBHEAW-UHFFFAOYSA-N 470.367 5.503 5 20 JKBD COc1ccc(CN(Cc2ccc(OC)cc2)C(=O)c2csc(-c3ccc([N+](=O)[O-])cc3)n2)cc1 609129926 VERRHLMRUXJNRU-UHFFFAOYSA-N 489.553 5.578 5 20 JKBD O=c1c2cc([N+](=O)[O-])ccc2nc2n1CC/C2=C\c1ccc(-c2cccc(Br)c2)o1 609335192 BKUXEJUHOFMWCT-SDNWHVSQSA-N 464.275 5.272 5 20 JKBD CC(=O)N(c1ccc(Cl)cc1)c1nc(COC(=O)c2cc(F)c(F)cc2[N+](=O)[O-])cs1 725935088 NLTTXRRHLNQFTO-UHFFFAOYSA-N 467.837 5.025 5 20 JKBD Cc1nc(-c2ccco2)ccc1C(=O)Oc1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2Cl)cc1 726133525 IFBNFLRTOLADNX-UHFFFAOYSA-N 477.860 5.683 5 20 JKBD O=C(COC(=O)c1ccccc1NCc1ccccc1)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 726831551 SRXZKXQZIGXSPG-UHFFFAOYSA-N 473.407 5.021 5 20 JKBD COc1cc(CNC(=O)CCC(=O)c2ccc3ccc4cccc5ccc2c3c45)cc(OC)c1OC 727752246 FLBZWATWVDPBLJ-UHFFFAOYSA-N 481.548 5.889 5 20 JKBD O=C(Nc1cccc(NC(=O)c2cc(Cl)ccc2[N+](=O)[O-])c1)c1cccc(C(F)(F)F)c1 728848355 IKLZCAGIMZEUHI-UHFFFAOYSA-N 463.799 5.772 5 20 JKBD O=C(COC(=O)[C@H]1C[C@@H]1c1ccc(Cl)cc1Cl)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 730610390 BWEQLFSPNKVHNU-OLZOCXBDSA-N 477.222 5.206 5 20 JKBD COc1ccc(CNCc2c(C)nn(Cc3c(Cl)cccc3Cl)c2Cl)cc1[N+](=O)[O-] 742717509 JXUFQMHJMJSETQ-UHFFFAOYSA-N 469.756 5.407 5 20 JKBD O=C(O[C@@H](c1ccccc1)c1ccncc1)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 744964836 BXMCLUHAYHBDNQ-QHCPKHFHSA-N 485.462 5.558 5 20 JKBD CCOC(=O)/C(=C/c1ccc(-c2ccccc2[N+](=O)[O-])o1)c1nc(O)c2c(C)c(C)sc2n1 745999931 QZBVHKIRIONJRW-LFIBNONCSA-N 465.487 5.286 5 20 JKBD O=C(COC(=O)c1csc(-c2ccc([N+](=O)[O-])cc2)n1)NCc1ccc(-c2ccc(Cl)cc2)o1 747957927 GODQEUIRXKCFGM-UHFFFAOYSA-N 497.916 5.105 5 20 JKBD O=C(O[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1)c1c[nH]c2cc([N+](=O)[O-])ccc12 756767859 ZODGWKGFFUWBIN-OAQYLSRUSA-N 494.847 5.175 5 20 JKBD C[C@H](Nc1ccc(-c2nc([C@H]3CCCN3C(=O)OC(C)(C)C)no2)cc1[N+](=O)[O-])c1ccccn1 904702387 XWDWRYJWNODIKN-HNAYVOBHSA-N 480.525 5.285 5 20 JKBD Cc1c([N+](=O)[O-])cc(C(=O)Nc2ccc(Cl)cc2C(=O)N2[C@H](C)CCC[C@H]2C)cc1[N+](=O)[O-] 915153928 FBWRAUFVDPIIKW-CHWSQXEVSA-N 474.901 5.120 5 20 JKBD CN(Cc1cc([N+](=O)[O-])ccc1Cl)C(=O)c1cccc(NC(=O)CCCc2cccs2)c1 918553508 CHODSIIFRGAHGW-UHFFFAOYSA-N 471.966 5.543 5 20 JKBD C[C@@H](NC(=O)c1cc([N+](=O)[O-])ccc1N1CCCC1)c1cccc(NC(=O)Cc2ccccc2F)c1 918587011 YUPRYMLNKTWVLA-GOSISDBHSA-N 490.535 5.006 5 20 JKBD CC(C)CC(=O)Nc1ccc(C2(NC(=O)c3cc(Br)ccc3[N+](=O)[O-])CCC2)cc1 1787663906 OYIQZNBGSDQEJJ-UHFFFAOYSA-N 474.355 5.151 5 20 JKBD O=C(Cc1cc([N+](=O)[O-])ccc1F)NC1(c2ccc(NC(=O)c3ccnc4ccccc34)cc2)CCC1 1788888630 ZVPSCLAZMRMNLL-UHFFFAOYSA-N 498.514 5.273 5 20 JKBD CC1=CC[C@@H](C(=O)Nc2ccc(C3(NC(=O)Cc4cc([N+](=O)[O-])ccc4F)CCC3)cc2)CC1 1789109725 KTMZFXHRVCPZJF-GOSISDBHSA-N 465.525 5.157 5 20 JKBD O=C(Cc1c[nH]c2ccccc12)NC1(c2ccc(NC(=O)c3cc(F)cc([N+](=O)[O-])c3)cc2)CCC1 1790697381 GHGOOWCXZAIWMI-UHFFFAOYSA-N 486.503 5.206 5 20 JKBD O=C(C[C@H]1C[C@@H]2CC[C@H]1C2)Nc1ccc(C2(NC(=O)Cc3cccc([N+](=O)[O-])c3)CCC2)cc1 1791318131 MRDIGGXSJLISLG-QHAWAJNXSA-N 461.562 5.098 5 20 JKBD O=C(Cc1cc(F)ccc1[N+](=O)[O-])Nc1ccc(C2(NC(=O)[C@H]3CCCCC3(F)F)CCC2)cc1 1792308439 OVDMQSLDOCFCJX-HXUWFJFHSA-N 489.494 5.236 5 20 JKBD O=C(/C=C/c1ccccc1[N+](=O)[O-])Nc1ccc(C2(NC(=O)Cc3ccsc3)CCC2)cc1 1792317894 WXKVSJSTTJQCGV-IZZDOVSWSA-N 461.543 5.046 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1ccc(-c3ccccc3)cc1)C2 1800701099 CEMOCPSTBLBHLE-NUNAXRQHSA-N 487.531 5.275 5 20 JKBD C[C@@H](C(=O)N1CCCC2(CCN(C(=O)c3cc(F)cc([N+](=O)[O-])c3)CC2)C1)c1ccc(Cl)cc1 1805198651 QRTNUTIXQRQAOW-QGZVFWFLSA-N 487.959 5.036 5 20 JKBD Cc1cccc2[nH]c(C(=O)Nc3cc([C@H]4CCCCN4C(=O)/C=C/c4ccccc4[N+](=O)[O-])[nH]n3)cc12 1819056400 JYPDBEXBYFRTOE-JHUUHBRDSA-N 498.543 5.127 5 20 JKBD CC[C@H](C)CC(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cc(Cl)cc([N+](=O)[O-])c2C)CC1 1824346814 NAGPZSBEHRIYPO-HRAATJIYSA-N 464.006 5.226 5 20 JKBD CCCc1ccc(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3ccc([N+](=O)[O-])c(OC)c3)CC2)cc1 1830106019 MNVWMAQPGHPUJL-XMMPIXPASA-N 493.604 5.103 5 20 JKBD O=C(c1c(F)cccc1Cl)N1CCC([C@H]2CCCCN2C(=O)c2ccc([N+](=O)[O-])cc2F)CC1 1830499446 XNCRTYPAIKWEND-OAQYLSRUSA-N 491.922 5.074 5 20 JKBD CCCCC[C@@H](C)C(=O)N1CCCC[C@H]1C1CCN(C(=O)/C=C/c2ccc([N+](=O)[O-])o2)CC1 1831462139 JMHJVMKBMCLQFY-VOIFRGJBSA-N 459.587 5.037 5 20 JKBD CC(C)C1(C(=O)N2CCCC[C@H]2C2CCN(C(=O)CSc3ccccc3[N+](=O)[O-])CC2)CCC1 1832492220 INUKLBSTNUFPOG-NRFANRHFSA-N 487.666 5.133 5 20 JKBD O=C(Cn1c2ccccc2c(=O)c2ccccc21)Nc1ncc(Cc2ccccc2Cl)s1 11251160 BINKXRSWJLMJLW-UHFFFAOYSA-N 459.958 5.494 5 20 JKBD Cc1csc(Sc2ccc(C(=O)O[C@@H](C)C(=O)Nc3c(C)cccc3C)cc2[N+](=O)[O-])n1 16903639 VKVSBVYGGXKFAW-HNNXBMFYSA-N 471.560 5.312 5 20 JKBD COc1ccc(NC(=O)c2ccc(Cn3nc(C)c([N+](=O)[O-])c3C)cc2)cc1OC1CCCC1 24930359 ZEKDKABLKHMXHS-UHFFFAOYSA-N 464.522 5.039 5 20 JKBD Cc1ccc(NC(=O)[C@H](Sc2nncn2-c2ccccc2F)c2ccccc2)c([N+](=O)[O-])c1 25031031 ZUZRTDWEUHBYDB-OAQYLSRUSA-N 463.494 5.095 5 20 JKBD O=C(Nc1ccc(Cl)c([N+](=O)[O-])c1)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 104796797 ITSKGTWVZPYWET-UHFFFAOYSA-N 472.807 5.030 5 20 JKBD Cc1ccc2c(c1C)OC[C@H]2N[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1 477031260 HCLPTUIYTGZSLK-FGZHOGPDSA-N 451.910 5.268 5 20 JKBD COc1cccc(/C=C(\CC(=O)NCc2ccccc2[N+](=O)[O-])c2nc3ccccc3s2)c1 500771817 GWGRZODMTQMTDK-CPNJWEJPSA-N 459.527 5.460 5 20 JKBD Cn1cnnc1Sc1ccc(C(=O)Nc2nc(-c3ccc(F)c(Cl)c3)cs2)cc1[N+](=O)[O-] 511624516 PRKVGSKFZBAKGA-UHFFFAOYSA-N 490.929 5.043 5 20 JKBD CCCCN(C(=O)Cn1ccc([N+](=O)[O-])n1)c1nc(-c2ccc(Cl)cc2Cl)cs1 515435819 AGMGVZMQWPDJJF-UHFFFAOYSA-N 454.339 5.055 5 20 JKBD O=C1CCCN1C[C@H](NCc1ccc(-c2ccc([N+](=O)[O-])cc2)s1)c1cccc(C(F)(F)F)c1 520948967 LUSIGJNEJKRKGB-NRFANRHFSA-N 489.519 5.795 5 20 JKBD CCc1nc(CCNC(=O)c2ccccc2Sc2ccc(C(F)(F)F)cc2[N+](=O)[O-])cs1 522552267 YCOBHLRUJJYVHR-UHFFFAOYSA-N 481.521 5.756 5 20 JKBD CN(Cc1ccccc1[N+](=O)[O-])C(=O)CSc1ncnc2scc(-c3ccccc3)c12 603569034 FDDOBDIABUFYDC-UHFFFAOYSA-N 450.545 5.017 5 20 JKBD CSc1ccc([C@H](CNC(=O)c2cccc(C)c2[N+](=O)[O-])N2CCc3sccc3C2)cc1 603759835 UMOWGUJUVBRMQE-NRFANRHFSA-N 467.616 5.216 5 20 JKBD CCNc1ccc(C(=O)Nc2ccc(NC(=O)c3ccoc3)cc2C(F)(F)F)cc1[N+](=O)[O-] 603762091 SGZGGUMMFFMOIU-UHFFFAOYSA-N 462.384 5.143 5 20 JKBD COc1cc(C(=O)N[C@@H](c2ccccc2)c2ccc(Cl)c(Cl)c2)c([N+](=O)[O-])cc1OC(F)F 604006504 IUCATXXYDCZUNJ-FQEVSTJZSA-N 497.281 6.031 5 20 JKBD CCOC(=O)C[C@H](c1ccccc1)C1CCN(C(=O)c2csc(-c3ccc([N+](=O)[O-])cc3)n2)CC1 604519512 BZSRWWJTGVJIFT-JOCHJYFZSA-N 493.585 5.308 5 20 JKBD CN(CCCc1cc(-c2ccc(F)cc2)no1)C(=O)c1csc(-c2cccc([N+](=O)[O-])c2)n1 604570264 KQYWBIGVWCHZDK-UHFFFAOYSA-N 466.494 5.217 5 20 JKBD COc1cc(CNc2ccc(C(=O)Nc3ccc(C)cc3)cc2[N+](=O)[O-])ccc1OC(F)F 608971102 AHRMQFRTNLXXGQ-UHFFFAOYSA-N 457.433 5.378 5 20 JKBD Cn1nc(C(F)(F)F)c(-c2ccc(Cl)cc2)c1NC(=O)CSc1ccc([N+](=O)[O-])cc1 609026649 WJEGJXUOULRSNF-UHFFFAOYSA-N 470.860 5.398 5 20 JKBD CC(=O)c1csc(NC(=O)c2ccc(Sc3nc4ccccc4s3)c([N+](=O)[O-])c2)n1 610428932 YFMHQXJEUBPYKU-UHFFFAOYSA-N 456.530 5.267 5 20 JKBD O=C(Nc1ccccc1Br)C1CCN(c2ccc([N+](=O)[O-])cc2C(F)(F)F)CC1 726182423 DTJHFXCQRZHUFN-UHFFFAOYSA-N 472.261 5.231 5 20 JKBD COc1cc2c(cc1NC(=O)[C@H]1CCCN1C(=O)c1ccc([N+](=O)[O-])c(C)c1)oc1ccccc12 726496463 YSOBVWWFBYKOCR-OAQYLSRUSA-N 473.485 5.055 5 20 JKBD Cc1ccc[n+](/C(C(=S)N[C@H](C)c2ccc(Cl)cc2Cl)=C(/O)c2cccc([N+](=O)[O-])c2)c1 726571262 WALMSJGRMMAHLJ-OAHLLOKOSA-O 489.404 6.060 5 20 JKBD O=C(CCC(=O)c1ccc2ccc3cccc4ccc1c2c34)NC1CCN(Cc2ccncc2)CC1 727768045 RJROJQYTFSKAPF-UHFFFAOYSA-N 475.592 5.723 5 20 JKBD Cc1sc(NC(=O)c2cc([N+](=O)[O-])ccc2Br)nc1-c1c(F)cc(F)cc1F 728835394 PPBCDDDEUUWVLR-UHFFFAOYSA-N 472.242 5.459 5 20 JKBD Cc1c(C(=O)N(C)[C@@H]2CCSc3ccc(Br)cc32)cc([N+](=O)[O-])c(C)c1[N+](=O)[O-] 728845058 QGPRDKQVYKJISR-OAHLLOKOSA-N 480.340 5.191 5 20 JKBD C[C@H](OC(=O)c1csc(-c2ccc([N+](=O)[O-])cc2)n1)C(=O)Nc1ccc(Cl)c(Cl)c1 747958382 IWNMFVMIXAMTQJ-JTQLQIEISA-N 466.302 5.209 5 20 JKBD C[C@H](Nc1ccc(C(=O)O[C@@H](c2ccncc2)c2ccc(F)cc2)cc1[N+](=O)[O-])c1ccccn1 748569920 AOMZYSREXHTAPU-SSOJOUAXSA-N 472.476 5.643 5 20 JKBD C[C@@H](C(=O)Nc1cc([N+](=O)[O-])ccc1Cl)N1CCC(c2nc(C(C)(C)C)cs2)CC1 750069498 YVGYFXOQMQDBJS-ZDUSSCGKSA-N 450.992 5.209 5 20 JKBD CC(=O)N(c1nc(CSc2nc3ccc([N+](=O)[O-])cc3s2)cs1)c1ccc(C)cc1C 787994832 HFJSREXIYBIUEZ-UHFFFAOYSA-N 470.601 6.255 5 20 JKBD CC1CCN(c2ccc([N+](=O)[O-])cc2C(=O)N[C@@H](C)c2nc3ccccc3n2C(F)F)CC1 823765256 IULAFAOZXRPNMO-HNNXBMFYSA-N 457.481 5.067 5 20 JKBD Cc1cccc([N+](=O)[O-])c1NC(=O)COC(=O)/C=C\c1cc(C(F)(F)F)cc(C(F)(F)F)c1 843415423 UVRNJIMQVNGLKL-WAYWQWQTSA-N 476.329 5.136 5 20 JKBD CC1=C(C(=O)Nc2ccccc2C(F)(F)F)[C@@H](c2cc([N+](=O)[O-])c(F)cc2F)NC(=O)N1C1CC1 916724994 KBPASNLJGUNBEM-LJQANCHMSA-N 496.392 5.033 5 20 JKBD CCc1ccc(-c2nc(CC(=O)N(Cc3nnc(-c4cccc([N+](=O)[O-])c4)o3)C(C)C)cs2)cc1 917512742 AFGMEWPVTUUVHL-UHFFFAOYSA-N 491.573 5.310 5 20 JKBD O=C(OCC[C@@H]1CCCCN1C(=O)c1ccc(Oc2ccccc2)nc1)c1cccc([N+](=O)[O-])c1 918327667 XYJZWONGRYMZKQ-NRFANRHFSA-N 475.501 5.024 5 20 JKBD Cc1c(C(=O)OCC(=O)Nc2c(Cl)c(Cl)cc(Cl)c2Cl)cc([N+](=O)[O-])cc1[N+](=O)[O-] 919225433 FTBZAPKUBXFKRL-UHFFFAOYSA-N 497.074 5.221 5 20 JKBD CC(=O)Nc1cccc([C@@H](C)OC(=O)c2ccc(Sc3nc(C)cs3)c([N+](=O)[O-])c2)c1 920264801 WIBWMUZFJHIMNU-CYBMUJFWSA-N 457.533 5.387 5 20 JKBD C[C@@H](OC(=O)c1cccnc1Oc1ccc(Cl)cc1Cl)C(=O)Nc1ccc(F)c([N+](=O)[O-])c1 920912487 LKIKKPDVZHVYDD-LLVKDONJSA-N 494.262 5.412 5 20 JKBD CCN(C(=O)c1cc([N+](=O)[O-])ccc1C)c1cccc(NC(=O)c2cc([N+](=O)[O-])ccc2C)c1 921280635 IHYVRUGNZDQQHS-UHFFFAOYSA-N 462.462 5.039 5 20 JKBD O=C(CCc1cccc([N+](=O)[O-])c1)NC1(c2ccc(NC(=O)[C@H]3CCC(F)(F)C3)cc2)CCC1 1785800955 UDLGUFALYJARDA-SFHVURJKSA-N 471.504 5.097 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)c3cccc(F)c3[N+](=O)[O-])CCC2)cc1)c1ccoc1C(F)(F)F 1788727608 WXBPNSPYSDZQNI-UHFFFAOYSA-N 491.397 5.407 5 20 JKBD Cc1nc2cc(C(=O)Nc3ccc(C4(NC(=O)c5ccc([N+](=O)[O-])o5)CCC4)cc3)ccc2s1 1789046313 LRTHPFZHMMGGIO-UHFFFAOYSA-N 476.514 5.167 5 20 JKBD Cc1ccc(CCC(=O)NC2(c3ccc(NC(=O)c4ccc([N+](=O)[O-])cc4F)cc3)CCC2)c(C)n1 1790625201 WEFVDMQSVAMPOQ-UHFFFAOYSA-N 490.535 5.126 5 20 JKBD O=C(/C=C/c1ccccc1[N+](=O)[O-])Nc1ccc(C2(NC(=O)Cc3noc4ccccc34)CCC2)cc1 1792315683 PZRLUOFNAWSYRQ-XNTDXEJSSA-N 496.523 5.126 5 20 JKBD C[C@H](Sc1ccccc1)C(=O)N1CCCC2(CCN(C(=O)/C=C/c3ccccc3[N+](=O)[O-])CC2)C1 1805859730 XUWALIHGWVQRQW-IWGBCORSSA-N 493.629 5.020 5 20 JKBD O=C(c1cc2cc([N+](=O)[O-])ccc2s1)N1CCC2(CCCN(C(=O)[C@H](F)c3ccccc3)C2)CC1 1806524630 QAQDIJOIFIBOTB-HSZRJFAPSA-N 495.576 5.365 5 20 JKBD CC[C@H](C)[C@H](C(=O)N1CCCC2(CCN(C(=O)/C=C/c3ccc([N+](=O)[O-])o3)CC2)C1)c1ccccc1 1809153334 GXFKNYHIGDKNQY-PYEYBSRVSA-N 493.604 5.262 5 20 JKBD O=C(c1cccc(F)c1[N+](=O)[O-])N1CCC([C@H]2CCCCN2C(=O)c2ccc(Cl)cc2F)CC1 1823899298 WEIAPFNPERDDFM-OAQYLSRUSA-N 491.922 5.074 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cc3ccoc3s2)CC1 1830730194 YYUQRPHHHQNRQH-FQEVSTJZSA-N 499.564 5.397 5 20 JKBD Cc1ccc(NC(=O)[C@@H](Sc2nnc(-c3cccnc3)n2C2CC2)c2ccccc2)c([N+](=O)[O-])c1 11541525 XONFGBBZTOYRST-QFIPXVFZSA-N 486.557 5.364 5 20 JKBD CCOc1cc(NC(=O)c2ccc([N+](=O)[O-])cc2Cl)c(OCC)cc1NC(=O)c1ccccc1 14717273 ITKSVGMVFLRBEJ-UHFFFAOYSA-N 483.908 5.550 5 20 JKBD Cc1ccc(C)c(NC(=O)[C@H](C)Oc2ccc3c(-c4ccc([N+](=O)[O-])cc4)cc(=O)oc3c2)c1 15370791 JFTSLAANKUGCAG-KRWDZBQOSA-N 458.470 5.391 5 20 JKBD CCN(CC(=O)Nc1ccccc1C(F)(F)F)C(=O)c1ccc(Nc2ccccc2)c([N+](=O)[O-])c1 18095002 OQAIQVQNMFUBNW-UHFFFAOYSA-N 486.450 5.458 5 20 JKBD COc1cc(-c2nnc(Sc3ccc(C(=O)c4ccccc4)cc3[N+](=O)[O-])o2)cc(OC)c1OC 20666859 GIBZFTGYEWTWSE-UHFFFAOYSA-N 493.497 5.053 5 20 JKBD Cc1cc(C)c(NC(=O)CN(c2ccccc2)S(=O)(=O)c2ccc(Cl)c([N+](=O)[O-])c2)c(C)c1 20923776 GIMMIEYXXKIZMK-UHFFFAOYSA-N 487.965 5.007 5 20 JKBD O=C(CSc1nc2ccccc2c(=O)n1C1CCCCC1)Nc1cc([N+](=O)[O-])ccc1Cl 28609208 JEBLKMWYDNTELJ-UHFFFAOYSA-N 472.954 5.194 5 20 JKBD O=[N+]([O-])c1ccc(-c2nnc(CSc3nn(-c4ccc(Cl)cc4)c(=S)s3)o2)cc1 28790512 YGBXSBICBQNTRX-UHFFFAOYSA-N 463.953 5.567 5 20 JKBD COc1cc(C(=O)Nc2ccccc2SCC(F)(F)F)c([N+](=O)[O-])cc1OC(F)F 36660963 OKUXHDTXNJMVTF-UHFFFAOYSA-N 452.357 5.112 5 20 JKBD COc1ccc([C@@H](CNC(=O)c2cc3cccc([N+](=O)[O-])c3[nH]2)c2c[nH]c3ccccc23)cc1 71946043 KIAPUJBEOIQRKG-HXUWFJFHSA-N 454.486 5.128 5 20 JKBD COCCCn1c(Sc2ccc(Br)cc2[N+](=O)[O-])nnc1-c1ccccc1Cl 105510520 UKYOGLDQGJMJES-UHFFFAOYSA-N 483.775 5.457 5 20 JKBD CSc1ccc([N+](=O)[O-])c(C(=O)NCc2ccc(-n3nc(C)cc3C)cc2C(F)(F)F)c1 109091030 SDRUSMXSHRJHOA-UHFFFAOYSA-N 464.469 5.068 5 20 JKBD C[C@@H](Nc1ccc(C(=O)NCc2ccccc2OC2CCCC2)cc1[N+](=O)[O-])c1ccccn1 303050372 XXSHQLHGMNZSAT-GOSISDBHSA-N 460.534 5.414 5 20 JKBD CCC(=O)Nc1ccc(NC(=O)c2ccccc2Sc2ccc(C(F)(F)F)cc2[N+](=O)[O-])cc1 484070256 CPUBBGXBUTWIQD-UHFFFAOYSA-N 489.475 6.366 5 20 JKBD O=C(Nc1ccccc1-c1cccs1)c1ccc([N+](=O)[O-])cc1I 508784398 HPQXHYOEEKGHQS-UHFFFAOYSA-N 450.257 5.180 5 20 JKBD Cc1ccc(-c2csc(NC(=O)c3cc(F)ccc3I)n2)cc1[N+](=O)[O-] 508796562 QJEHKZQVSSGHSS-UHFFFAOYSA-N 483.262 5.023 5 20 JKBD CN(C(=O)c1ccc(NC(=O)N2CCN(c3cccc([N+](=O)[O-])c3)CC2)cc1Cl)C1CCCCC1 511037935 LMVVCGXGBWWCPN-UHFFFAOYSA-N 499.999 5.007 5 20 JKBD C[C@@H](NC(=O)Nc1ccc(C(=O)N(C)C2CCCCC2)c(Cl)c1)c1cccc([N+](=O)[O-])c1 511070946 YEELTXGBSSYBFI-OAHLLOKOSA-N 458.946 5.536 5 20 JKBD COc1ccc(CSc2nnc(-c3ccc(F)cc3)n2Cc2ccccc2)cc1[N+](=O)[O-] 515288390 RJZMQJTVIBZRGT-UHFFFAOYSA-N 450.495 5.342 5 20 JKBD COc1ccc([N+](=O)[O-])cc1NC(=O)[C@@H](C)N[C@@H](C)c1ccc(Oc2ccccc2)c(F)c1 515717559 OVBRYXRIJZANJY-JKSUJKDBSA-N 453.470 5.213 5 20 JKBD Cc1nn(Cc2ccc(C(=O)N3CCC[C@H]3c3cccc(Br)c3)cc2)c(C)c1[N+](=O)[O-] 515934680 CKBUENBSVMMPGY-NRFANRHFSA-N 483.366 5.196 5 20 JKBD CCN(C(=O)CCCNc1ccc([N+](=O)[O-])cc1)[C@@H](c1cccnc1)c1ccc(F)c(C)c1 517805289 BSFFRJMKELWOQG-RUZDIDTESA-N 450.514 5.268 5 20 JKBD O=C(C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)N(C[C@H]1CCOC1)C1CC1 520406105 AEMFYABUFPUHEQ-UIMCMNAESA-N 463.559 5.163 5 20 JKBD Cc1cc(C(=O)N2CCCC[C@@H]2C)ccc1NC(=O)CCNc1ccc(C(F)(F)F)cc1[N+](=O)[O-] 520653005 CSGWRUUGQAISKC-INIZCTEOSA-N 492.498 5.377 5 20 JKBD CC1CCC(OC2CCN(C(=O)C3CCN(c4ccc(C(F)(F)F)cc4[N+](=O)[O-])CC3)CC2)CC1 520797755 IPLYTCWJVNCBSN-UHFFFAOYSA-N 497.558 5.416 5 20 JKBD O=C(C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)N1CCc2sccc2C1 592901391 HZTBWRALUROGIH-QGOAFFKASA-N 461.568 5.782 5 20 JKBD COc1ccc(NC(=O)CSc2nnc(-c3ccco3)n2[C@H](C)[C@@H]2C[C@H]3CC[C@H]2C3)c([N+](=O)[O-])c1 594534402 FWSWZYSPDJUTHN-CVYDXHPNSA-N 497.577 5.183 5 20 JKBD CSc1ccc([N+](=O)[O-])c(C(=O)Nc2nc(-c3ccccc3)c(C(=O)c3ccccc3)s2)c1 603155847 PROBZDZHOFDQAC-UHFFFAOYSA-N 475.551 5.924 5 20 JKBD CC(=O)N(c1ccc(F)cc1)c1nc(/C=C/c2nc3cc([N+](=O)[O-])ccc3n2-c2ccccc2)cs1 603945824 QMUJLPZNHFGMNP-NTEUORMPSA-N 499.527 6.384 5 20 JKBD CCCS(=O)(=O)Nc1ccc(NC(=O)c2ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])cc2)cc1 604437296 GGYYYAULKAOVFC-UHFFFAOYSA-N 489.937 5.445 5 20 JKBD CCOc1ccc(S(=O)(=O)N2CCCCC2)cc1NC(=O)c1cc2ccccc2c2cccnc12 642518089 ZRJAYWJWHXYBHU-UHFFFAOYSA-N 489.597 5.214 5 20 JKBD O=C(CCC(=O)N1CCC(N2CCCCC2)CC1)c1ccc2ccc3cccc4ccc1c2c34 728151735 DEJQRMPDBIONMU-UHFFFAOYSA-N 452.598 6.024 5 20 JKBD O=C(OCc1nc(-c2ccc([N+](=O)[O-])cc2)no1)c1nc(-c2ccccc2)oc1-c1ccccc1 731377307 ANLXJTGVDPSYCQ-UHFFFAOYSA-N 468.425 5.324 5 20 JKBD O=C(OCc1nnc(-c2ccc([N+](=O)[O-])cc2)o1)c1ccc(COc2ccc(Cl)cc2)cc1 745949121 OXSFHVBJFQWZOK-UHFFFAOYSA-N 465.849 5.234 5 20 JKBD C[C@@H](OC(=O)c1cc(-c2ccccc2)nn1-c1ccccc1)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 745962394 PJLYUNWBTYUBFD-QGZVFWFLSA-N 481.468 5.416 5 20 JKBD O=C(Cc1cccc2cccnc12)O[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1 834076111 ZKKDFFUMPKRQHF-XMMPIXPASA-N 475.888 5.262 5 20 JKBD Cc1ccc(-c2cc(C(=O)N(Cc3nnc(-c4cccc([N+](=O)[O-])c4)o3)C(C)C)c3ccccc3n2)o1 864242512 IIXJZVULOPTLGL-UHFFFAOYSA-N 497.511 5.812 5 20 JKBD CC(C)c1ccc(-c2nc(C(=O)OCc3nnc(-c4ccc([N+](=O)[O-])cc4)o3)cs2)cc1 900229075 MVKMWQBPXWITRW-UHFFFAOYSA-N 450.476 5.249 5 20 JKBD COc1ccc(NC(=O)c2cc(-c3cc(OC)c(OC)c(OC)c3)nc3ccccc23)c([N+](=O)[O-])c1 916665320 YQZNCOOEXSZICQ-UHFFFAOYSA-N 489.484 5.097 5 20 JKBD O=C(Oc1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2Cl)cc1)c1csc(-c2ccccc2F)n1 920736689 WMJYGBINOLGRQX-UHFFFAOYSA-N 497.891 5.982 5 20 JKBD O=C(OCc1nc(-c2ccc([N+](=O)[O-])cc2)no1)c1cccnc1Oc1ccc(Cl)cc1Cl 920912460 KIHLZNXTTDGMBF-UHFFFAOYSA-N 487.255 5.496 5 20 JKBD C[C@H](Sc1cccs1)C(=O)NC1(c2ccc(NC(=O)/C=C/c3ccc([N+](=O)[O-])o3)cc2)CCC1 1786207497 RWWXCAAHFVZLDJ-SOGBHIHOSA-N 497.598 5.577 5 20 JKBD O=C(Cc1cc([N+](=O)[O-])ccc1F)NC1(c2ccc(NC(=O)C3CCC(F)(F)CC3)cc2)CCC1 1786242334 CGCWYBPSYKZBKV-UHFFFAOYSA-N 489.494 5.236 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)c3cccc(F)c3[N+](=O)[O-])CCC2)cc1)c1cc2ccccc2o1 1789004683 QALJOBPHNPABAX-UHFFFAOYSA-N 473.460 5.542 5 20 JKBD Cc1cc(O)c([N+](=O)[O-])cc1C(=O)NC1(c2ccc(NC(=O)c3cccc4cc[nH]c34)cc2)CCC1 1789094033 OEZVQSCBIOMRMH-UHFFFAOYSA-N 484.512 5.152 5 20 JKBD COc1cc(C(=O)Nc2ccc(C3(NC(=O)c4sccc4Cl)CCC3)cc2)ccc1[N+](=O)[O-] 1792165851 RAKFSVBODXBXHY-UHFFFAOYSA-N 485.949 5.380 5 20 JKBD Cc1ccc(CC(=O)Nc2cc([C@@H]3CCCCN3C(=O)C[C@H](C)c3ccccc3)[nH]n2)cc1[N+](=O)[O-] 1820918572 IFFRLZBFKVFXRF-CVDCTZTESA-N 489.576 5.055 5 20 JKBD Cc1c(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)[C@@H](F)c3ccccc3)[nH]n2)cc(Cl)cc1[N+](=O)[O-] 1821289762 KPIZQYMKHPDTOO-UGKGYDQZSA-N 499.930 5.296 5 20 JKBD Cc1cc2cccc(C(=O)N3CCCC[C@H]3c3cc(NC(=O)/C=C/c4ccccc4[N+](=O)[O-])n[nH]3)c2[nH]1 1823505169 XFUWCFFLXDMMFZ-OTOIZHKDSA-N 498.543 5.127 5 20 JKBD CC[C@H](C)CC(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cccc([N+](=O)[O-])c2Br)CC1 1824346473 GHLGABRLSYLZHP-QFBILLFUSA-N 494.430 5.027 5 20 JKBD C[C@@H](Sc1ccccc1)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cccc(F)c2[N+](=O)[O-])CC1 1824392711 ROMJWJWVPHZJBE-WZONZLPQSA-N 499.608 5.148 5 20 JKBD O=C(c1cc2cc([N+](=O)[O-])ccc2s1)N1CCC([C@H]2CCCCN2C(=O)c2ccsc2)CC1 1825797077 SQRVSNYSYQJDNY-HXUWFJFHSA-N 483.615 5.418 5 20 JKBD CC(C)C1(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)/C=C/c3ccccc3[N+](=O)[O-])CC2)CCC1 1832495007 YATWXBFBWCNGPK-HRBBJJPOSA-N 467.610 5.054 5 20 JKBD Cc1cccc(C(=O)N2CCCC[C@H]2C2CCN(C(=O)Cc3cccc([N+](=O)[O-])c3)CC2)c1Cl 1832604163 IXHWVLXJOUDODL-QHCPKHFHSA-N 483.996 5.033 5 20 JKBD C/C(=C\c1ccc(C)o1)C(=O)N1CCC([C@@H]2CCCCN2C(=O)/C=C/c2ccccc2[N+](=O)[O-])CC1 1832905618 ZLAHJUSLQGRXEB-UBSRADMLSA-N 491.588 5.233 5 20 JKBD COc1ccc(C(=O)C2CCN(C(=O)c3ccc(Sc4nc(C)cs4)c([N+](=O)[O-])c3)CC2)cc1 12739387 UTASLJNOQHFCSN-UHFFFAOYSA-N 497.598 5.255 5 20 JKBD CC(=O)N(c1cccc(C(F)(F)F)c1)c1nc(COc2ccc(C)cc2[N+](=O)[O-])cs1 22052377 AJXANUKWDOQYBI-UHFFFAOYSA-N 451.426 5.642 5 20 JKBD CCn1c(S[C@H](C)C(=O)Nc2ccc(C)cc2Cl)nc2cc3ccccc3cc2c1=O 26581055 YSZSBFKHTNKZQJ-OAHLLOKOSA-N 451.979 5.651 5 20 JKBD CCOc1cc(C(=O)Nc2nc(-c3ccc(Br)cc3)c(C)s2)c([N+](=O)[O-])cc1OC 45438702 BVNLHOCQSLDHQW-UHFFFAOYSA-N 492.351 5.449 5 20 JKBD Cc1ccc(-n2nc(C)c(NC(=O)COc3ccc([N+](=O)[O-])cc3Cc3ccccc3)c2C)cc1 71858315 LSDIVALWNGIGLF-UHFFFAOYSA-N 470.529 5.314 5 20 JKBD Cn1cnnc1Sc1ccc(C(=O)Nc2cccc(Cl)c2SC(F)F)cc1[N+](=O)[O-] 110207238 ZHAOMBFSALQZDX-UHFFFAOYSA-N 471.898 5.095 5 20 JKBD Cc1ccc(Sc2ccc(C(=O)N[C@H](C)c3ccc(NC(N)=O)cc3)cc2[N+](=O)[O-])cc1 480220829 RTJIPJQBUKTWDC-OAHLLOKOSA-N 450.520 5.036 5 20 JKBD CN(C)[C@@H](CNC(=O)C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)c1ccsc1 499990741 HQMKIXVDGIDQQX-JJEHFPDLSA-N 492.626 5.616 5 20 JKBD Cc1ccc(-n2c(S[C@@H](C)c3nnc(-c4ccc([N+](=O)[O-])cc4)o3)nnc2-c2ccncc2)cc1C 501269174 NYJWMYSRXJPMCA-KRWDZBQOSA-N 499.556 5.758 5 20 JKBD CCOc1ccccc1[C@H](CC)NC(=O)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 505938502 MYGBDVDSFYSINJ-IBGZPJMESA-N 479.499 5.496 5 20 JKBD C[C@H](Nc1ccc(C(=O)N(Cc2ccc(C(F)(F)F)cc2)C2CC2)cc1[N+](=O)[O-])c1ccccn1 506178107 JYCHBJQJIJCVGM-INIZCTEOSA-N 484.478 5.987 5 20 JKBD CCCN(C(=O)c1cc([N+](=O)[O-])cnc1C)c1nc(-c2ccc(Cl)cc2Cl)cs1 506807961 WTWOMOFRWYTARB-UHFFFAOYSA-N 451.335 5.785 5 20 JKBD CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)N[C@@H](C)c1cccc(NC(=O)Cc2ccccc2F)c1 509331095 KQSUKNFKIIMDKV-IBGZPJMESA-N 492.551 5.596 5 20 JKBD COc1ccc(NC(C)=O)c(NC(=O)c2ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])cc2)c1 509851882 PRAVIOJCSBWSIS-UHFFFAOYSA-N 455.854 5.260 5 20 JKBD O=C(C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)N1CCC(c2ncc[nH]2)CC1 509966641 HJNREMVCUVOTMJ-XDJHFCHBSA-N 473.558 5.265 5 20 JKBD CN(C)C(=O)c1ccc(Cl)c(NC(=O)c2cc([N+](=O)[O-])ccc2Sc2ccccc2)c1 512328168 IKZTZPDPPDDYQZ-UHFFFAOYSA-N 455.923 5.354 5 20 JKBD COc1cc(CN[C@@H](C)c2cccc([N+](=O)[O-])c2)ccc1OCC(=O)Nc1ccc(F)c(Cl)c1 513114748 HBYPQOZERQGTRM-HNNXBMFYSA-N 487.915 5.264 5 20 JKBD C[C@H](c1nnc(Sc2ccc([N+](=O)[O-])c3cnccc23)n1-c1ccccc1)N1CCCCC1 515163961 AQEXGFRUNUGTHY-QGZVFWFLSA-N 460.563 5.422 5 20 JKBD O=C(Nc1ccc(Cl)cc1Cl)[C@H]1CCCCN1C(=O)c1ccc(N2CCCC2)c([N+](=O)[O-])c1 517374526 VRFQMLXXQIJLAD-HXUWFJFHSA-N 491.375 5.135 5 20 JKBD C[C@@H](NCc1ccc(Oc2ccc(F)cc2)c([N+](=O)[O-])c1)c1cc(F)ccc1N1CCN(C)CC1 518275123 CSCPVMJDINWSKY-GOSISDBHSA-N 482.531 5.268 5 20 JKBD COc1ccc(COc2cccc(F)c2)cc1NC(=O)c1cc(OC)c(OC(F)F)cc1[N+](=O)[O-] 520112175 JKRXZTHXSSVVDM-UHFFFAOYSA-N 492.406 5.184 5 20 JKBD COc1ccc([C@@H](NC(=O)[C@@H](C)Oc2ccc(Cl)cc2[N+](=O)[O-])c2ccc(F)cc2)cc1 520408820 SIBROFCVQVTGRU-PEBXRYMYSA-N 458.873 5.069 5 20 JKBD Cc1nc(-c2ccc(F)cc2)sc1[C@H](C)N[C@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl 520634573 UIPWFJXACZIXJF-WCQYABFASA-N 462.934 5.497 5 20 JKBD C[C@@H]1CCCN(Cc2csc(NC(=O)c3cc([N+](=O)[O-])ccc3Sc3ccccc3)n2)C1 589659827 WZVNUHLQDUHHQC-MRXNPFEDSA-N 468.604 5.687 5 20 JKBD O=[N+]([O-])c1cccc(-c2noc(CNc3ccc(Oc4ncc(Cl)cc4Cl)cc3)n2)c1 604009828 SIBPDZPQGKIULY-UHFFFAOYSA-N 458.261 5.751 5 20 JKBD Cc1ccc2nc([C@@H]3CCCN(C(=O)c4ccc(N5CCC(C)CC5)c([N+](=O)[O-])c4)C3)[nH]c2c1 608986694 JZVBXSXFWCZNDS-HXUWFJFHSA-N 461.566 5.036 5 20 JKBD COc1ccc([N+](=O)[O-])c(C(=O)Nc2cccc(NC(=O)Nc3cccc4c3CCCC4)c2)c1 609428272 KZHZDJQBIVTTEY-UHFFFAOYSA-N 460.490 5.379 5 20 JKBD Cc1ccc(S(=O)(=O)Nc2ccc(N[C@@H](C)C(=O)Nc3ccccc3C(C)C)cc2)cc1[N+](=O)[O-] 619639143 MOYIIBPVQZRXIE-SFHVURJKSA-N 496.589 5.267 5 20 JKBD Cc1ccc(/C(O)=C(/C(=S)N[C@@H](C)c2cccs2)[n+]2ccc(C(C)(C)C)cc2)cc1[N+](=O)[O-] 726579460 KZRXJOFVJVKSKI-KRWDZBQOSA-O 482.651 6.112 5 20 JKBD COc1ccc(NC(=O)c2cc(Cl)ccc2[N+](=O)[O-])cc1OCc1ccc2ccccc2n1 728009077 NYAPXFYJFJPKNT-UHFFFAOYSA-N 463.877 5.636 5 20 JKBD O=C(O[C@H](c1ccc(Br)cc1)C(F)(F)F)c1csc(-c2ccc([N+](=O)[O-])cc2)n1 731146601 JHGNWIYCPPAXBE-OAHLLOKOSA-N 487.253 5.941 5 20 JKBD Cc1cc(COc2ccc(C(=O)O[C@@H](C)c3cccc([N+](=O)[O-])c3)cc2Br)on1 742965811 DYWQFEZIAMPWMG-ZDUSSCGKSA-N 461.268 5.151 5 20 JKBD C[C@H](OC(=O)c1cn(-c2ccccc2)nc1-c1ccccc1)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 745929368 AYYQYJYLZCWNGE-KRWDZBQOSA-N 481.468 5.416 5 20 JKBD Cc1ccc(-c2nnc([C@H](C)OC(=O)c3cc([N+](=O)[O-])ccc3N3CCC(C)CC3)o2)cc1 746145834 RRUMGNFAXGTFCZ-KRWDZBQOSA-N 450.495 5.108 5 20 JKBD CN(C(=O)c1ccc(Cl)cc1)c1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2Br)cc1 751106361 BFXWNLSLLBTYGC-UHFFFAOYSA-N 488.725 5.540 5 20 JKBD O=c1cc(-c2ccc([N+](=O)[O-])cc2)c2ccc(Oc3ncnc4c3cnn4-c3ccccc3)cc2o1 875863390 GVHKDFSFUFXRHD-UHFFFAOYSA-N 477.436 5.289 5 20 JKBD C[C@H](OC(=O)c1cccc(OCc2cccs2)c1)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl 915464123 LOSLGQXZRNEAIG-ZDUSSCGKSA-N 460.895 5.073 5 20 JKBD O=C(OCc1nc(O)c2ccc(C(F)(F)F)cc2n1)c1ccc(NCc2ccccc2)c([N+](=O)[O-])c1 916597370 QDVOMXQOHSXSQF-UHFFFAOYSA-N 498.417 5.232 5 20 JKBD CCOc1ccccc1NC(=O)[C@H](OC(=O)c1cc2cc([N+](=O)[O-])ccc2o1)c1ccccc1 917263149 LFBFCIWRVGNIRW-HSZRJFAPSA-N 460.442 5.277 5 20 JKBD Cc1c([N+](=O)[O-])cc(C(=O)N2CC[C@H](C)Sc3ccc(C(F)(F)F)cc32)cc1[N+](=O)[O-] 917680091 BYHKIPNDSUUFCQ-JTQLQIEISA-N 455.414 5.361 5 20 JKBD CN(C(=O)c1c2c(nc3ccccc13)/C(=C/c1ccc([N+](=O)[O-])cc1)CCC2)c1ccc(C(N)=O)cc1 917860251 FOTJQFCPVMBIFP-LVZFUZTISA-N 492.535 5.395 5 20 JKBD Cc1c(C(=O)Nc2cc(Cl)c([N+](=O)[O-])cc2OCc2ccccc2)cnn1-c1ccccc1 918554008 MPHTZZMUOGDTGI-UHFFFAOYSA-N 462.893 5.574 5 20 JKBD O=C(OCC(=O)N1CCC[C@@H]1c1ccc(Cl)c(Cl)c1)c1ccc(Cl)cc1[N+](=O)[O-] 919039851 ZIIYTDFTHCIXHE-MRXNPFEDSA-N 457.697 5.076 5 20 JKBD O=C(COC(=O)c1cc2cc([N+](=O)[O-])ccc2[nH]1)Nc1c(Cl)c(Cl)cc(Cl)c1Cl 919513903 IPCVAMUEGGVXEE-UHFFFAOYSA-N 477.087 5.485 5 20 JKBD Cc1cc2nc(C(=O)NC3(c4ccc(NC(=O)/C=C/c5ccc([N+](=O)[O-])o5)cc4)CCC3)[nH]c2cc1C 1786207516 ULFCGLZJXCSYSB-CSKARUKUSA-N 499.527 5.142 5 20 JKBD Cc1cc2[nH]c(C(=O)NC3(c4ccc(NC(=O)c5cc(C)c([N+](=O)[O-])cn5)cc4)CCC3)cc2s1 1788766631 LYADNCGXMVAEQB-UHFFFAOYSA-N 489.557 5.211 5 20 JKBD COc1cc(C(=O)NC2(c3ccc(NC(=O)CCC=C(C)C)cc3)CCC2)ccc1[N+](=O)[O-] 1790453373 BSRZADRMUFHXLC-UHFFFAOYSA-N 451.523 5.098 5 20 JKBD CCSc1cccnc1C(=O)NC1(c2ccc(NC(=O)c3ccc([N+](=O)[O-])cc3F)cc2)CCC1 1790625655 CLXOSELBYSBKHX-UHFFFAOYSA-N 494.548 5.302 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)c3ccoc3C(F)(F)F)CCC2)cc1)c1cc(F)cc([N+](=O)[O-])c1 1790696470 IVVHKGWYWCTBOD-UHFFFAOYSA-N 491.397 5.407 5 20 JKBD Cc1c(C(=O)Nc2ccc(C3(NC(=O)CC[C@@H]4CCOC4)CCC3)cc2)cc(Cl)cc1[N+](=O)[O-] 1790774917 VIGSADRLIPMBRJ-QGZVFWFLSA-N 485.968 5.121 5 20 JKBD O=C(/C=C/c1ccc([N+](=O)[O-])o1)NC1(c2ccc(NC(=O)C[C@@H]3C[C@@H]4CC[C@H]3C4)cc2)CCC1 1791320270 FOFHPMNPOUGOFY-APXNVGFCSA-N 463.534 5.161 5 20 JKBD O=C(/C=C/c1ccc([N+](=O)[O-])o1)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1sc2ccccc2c1Cl 1797460388 WKAIRDNNBZRLPR-DDQJEZCPSA-N 485.949 5.021 5 20 JKBD O=C(NC[C@@H]1CCN(C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)[C@@H]1c1cccnc1)C1CCCCC1 1806231971 YOCGZCXPROBAQD-YADARESESA-N 492.601 5.104 5 20 JKBD O=C(NC[C@@H]1CCN(C(=O)CC2CCCC2)[C@@H]1c1cccnc1)c1cc2cc([N+](=O)[O-])ccc2s1 1812304459 IXYAXMXPJNMOQS-UQBPGWFLSA-N 492.601 5.104 5 20 JKBD CC(C)c1ccc(C(=O)N2CCCC[C@H]2c2cc(NC(=O)/C=C/c3ccc([N+](=O)[O-])o3)n[nH]2)cc1 1814969550 HLJDZDUFKWGHOP-ACUNGTFPSA-N 477.521 5.054 5 20 JKBD CC[C@H]1CC[C@H](C(=O)N2CCC([C@H]3CCCCN3C(=O)c3ccc([N+](=O)[O-])c(OC)c3)CC2)CC1 1832696579 CBESHTNUNHBGPU-KJXAQDMKSA-N 485.625 5.053 5 20 JKBD CCN(Cc1ccc(OCc2cccs2)c(OC)c1)Cc1cc([N+](=O)[O-])cc2c1OCOC2 15369648 XLELSFNXZYWMSP-UHFFFAOYSA-N 470.547 5.133 5 20 JKBD CCCn1c(S[C@@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)nnc1-c1cccc(C)c1 17706577 CXZRDITTYBBZMX-HNNXBMFYSA-N 450.524 5.475 5 20 JKBD CC(C)C(=O)Nc1ccc(C(=O)[C@@H](C)Sc2nc3cc4ccccc4cc3c(=O)n2C)cc1 22254691 VGJNHSIMCONQHC-MRXNPFEDSA-N 459.571 5.045 5 20 JKBD O=C(Cn1cnc(-c2cccc([N+](=O)[O-])c2)n1)Nc1ccccc1Sc1ccc(Cl)cc1 60370936 QCZYBLGHOKGFGO-UHFFFAOYSA-N 465.922 5.297 5 20 JKBD COCCOc1cc([N+](=O)[O-])c(C(=O)Nc2nc(-c3cc(Cl)ccc3Cl)cs2)cc1OC 105336204 UZXVXYKJQXHZRK-UHFFFAOYSA-N 498.344 5.311 5 20 JKBD COc1cc(C(=O)N(CC(F)(F)F)c2ccccn2)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 409623827 QZKLLWSAXPXBIR-UHFFFAOYSA-N 481.814 5.653 5 20 JKBD C[C@@H](Nc1ccc(C(=O)N2CCC[C@@H]2c2cccc(Br)c2)cc1[N+](=O)[O-])c1ccccn1 410088393 PDJVBJZTMVGLFX-OPAMFIHVSA-N 495.377 5.903 5 20 JKBD Cc1ccc([N+](=O)[O-])cc1NC(=O)c1ccc(NC(=O)c2ccc(Br)cc2)cc1 410150346 MFIPZTASEAFMCS-UHFFFAOYSA-N 454.280 5.170 5 20 JKBD COc1ccc([C@H]2[C@H](C(=O)Nc3cccc([N+](=O)[O-])c3C)CCC(=O)N2c2ccc(OC)cc2)cc1 481380811 LTEZQYBUBQRPAA-GJZUVCINSA-N 489.528 5.043 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)Nc2cc(C(F)(F)F)cc(C(F)(F)F)c2)cc1SC 482319102 RPWPNEVDEZFLTH-UHFFFAOYSA-N 454.348 5.615 5 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TVOPJVRRSZDOQC-UHFFFAOYSA-N 477.365 5.611 5 20 JKBD CCOc1ccc(C(F)(F)F)cc1N[C@@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 518743985 UQQIYZDXFKRISU-JTQLQIEISA-N 465.350 5.470 5 20 JKBD O=C(Nc1cc(Cl)ccc1Cl)[C@@H]1CCCCN1C(=O)c1ccc(N2CCCC2)c([N+](=O)[O-])c1 522270158 HUAHXFDNVMROCG-FQEVSTJZSA-N 491.375 5.135 5 20 JKBD CCOc1cc([N+](=O)[O-])c(C(=O)Nc2cc(-c3cccc(OC)c3)nn2-c2ccccc2)cc1OC 603760626 OJVJHODSAZKOMS-UHFFFAOYSA-N 488.500 5.116 5 20 JKBD COc1cc(C(=O)N(c2cccc(C(F)(F)F)c2)[C@@H](C)C2CC2)c([N+](=O)[O-])cc1OC(F)F 603964428 MKLISFNZYTYTSH-NSHDSACASA-N 474.382 5.669 5 20 JKBD O=C(Nc1ccc(CC[C@@H](O)c2ccccc2)cc1)C1CCN(c2ccccc2[N+](=O)[O-])CC1 727762819 HSIQLTRKNQNFRX-AREMUKBSSA-N 459.546 5.116 5 20 JKBD COc1ccc(-c2csc(NC(=O)c3cc([N+](=O)[O-])c(C)c([N+](=O)[O-])c3C)n2)cc1Cl 748609777 XGCHDZLLUGTOPT-UHFFFAOYSA-N 462.871 5.158 5 20 JKBD CN(Cc1cccc(NC(=O)c2cc([N+](=O)[O-])ccc2Oc2ccccc2)c1)C(=O)C(F)(F)F 915858591 OQEBLVBOTARLBX-UHFFFAOYSA-N 473.407 5.160 5 20 JKBD CCc1ccc(NC(=S)Nc2ccc(NS(=O)(=O)c3ccc(C)c([N+](=O)[O-])c3)cc2)cc1 916120145 RTZRCFPJVGWBPZ-UHFFFAOYSA-N 470.576 5.075 5 20 JKBD CN(C(=O)c1ccc([N+](=O)[O-])cc1Cl)c1cccc(NC(=O)c2ccc([N+](=O)[O-])cc2Cl)c1 917698531 QZPNPEGCCYDVMP-UHFFFAOYSA-N 489.271 5.339 5 20 JKBD Cc1c(C(=O)N2CCC([C@H]3CCCCN3C(=O)Cc3cccc([N+](=O)[O-])c3)CC2)oc2ccccc12 1823679547 OMAZEGQSROPQCU-XMMPIXPASA-N 489.572 5.125 5 20 JKBD Cc1ccoc1C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)CC1 1827742655 UREFXMYDGGDHRD-HXUWFJFHSA-N 481.574 5.258 5 20 JKBD O=C(c1ccc(Cl)cc1F)N1CCC([C@@H]2CCCCN2C(=O)c2ccc([N+](=O)[O-])cc2F)CC1 1830492759 MYAXFYUTNCOOIK-QFIPXVFZSA-N 491.922 5.074 5 20 JKBD Cc1ccc(F)c(C(=O)N2CCC([C@@H]3CCCCN3C(=O)CSc3ccccc3[N+](=O)[O-])CC2)c1 1831777257 LYVFRGBVNCSRPA-QFIPXVFZSA-N 499.608 5.068 5 20 JKBD O=C([C@H]1CCCCC1(F)F)N1CCC([C@H]2CCCCN2C(=O)/C=C/c2ccccc2[N+](=O)[O-])CC1 1832899719 FKPUPBZVCGITNZ-CXYUPCIPSA-N 489.563 5.053 5 20 JKBD O=C(CSc1nnc(-c2ccccc2Cl)n1C1CCCC1)Nc1ccc(Cl)cc1[N+](=O)[O-] 8989061 HACGBNPAVZTGHH-UHFFFAOYSA-N 492.388 6.006 5 20 JKBD O=C(Nc1ccc(NC(=O)c2ccco2)cc1)c1ccc(NCc2ccccc2Cl)c([N+](=O)[O-])c1 10550675 UZJMPEWYLKTCRB-UHFFFAOYSA-N 490.903 5.958 5 20 JKBD Cc1ccc(NC(=O)[C@H](Sc2nnnn2-c2ccc(Cl)cc2)c2ccccc2)c([N+](=O)[O-])c1 16485372 UXHHCNCZUQPUKE-HXUWFJFHSA-N 480.937 5.004 5 20 JKBD COc1ccc(NC(=O)[C@@H](C)Sc2nnc(-c3ccco3)n2C2CCCCC2)c([N+](=O)[O-])c1 16864222 KGKCYSIXSYVAQD-CQSZACIVSA-N 471.539 5.079 5 20 JKBD C[C@@H](Sc1nn(-c2ccc(Cl)cc2)c(=S)s1)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl 20852173 ZVBBKWJGIPLCII-SECBINFHSA-N 487.415 5.998 5 20 JKBD Cn1cnnc1Sc1ccc(C(=O)Nc2cc(C(F)(F)F)cc(C(F)(F)F)c2)cc1[N+](=O)[O-] 20859054 KQLVTHUIOGCNTD-UHFFFAOYSA-N 491.373 5.164 5 20 JKBD CC(C)(C)SCC(=O)O[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Br)c1ccccc1 22721227 BTKXLKPIYJCOOF-GOSISDBHSA-N 481.368 5.112 5 20 JKBD COc1ccc(-c2cc(C(=O)OCC(=O)Nc3ccc([N+](=O)[O-])cc3C(F)(F)F)sc2C)cc1 23501293 ZXWWNBNWGBKKBU-UHFFFAOYSA-N 494.447 5.455 5 20 JKBD Cc1cccc([N+](=O)[O-])c1NC(=O)CSc1nnc(SCc2ccc(C(C)C)cc2)s1 23597941 IOYQYZNUHFLZMY-UHFFFAOYSA-N 474.633 5.901 5 20 JKBD CC(C)c1ccc(CSc2nnc(S[C@@H](C)C(=O)Nc3ccccc3[N+](=O)[O-])s2)cc1 26093335 SPYLZVPRBOIQHU-AWEZNQCLSA-N 474.633 5.981 5 20 JKBD C[C@@H](OC(=O)c1ccccc1C(=O)c1ccc(Cl)c([N+](=O)[O-])c1)c1nnc(-c2cccs2)o1 104923057 OSEZPDQHYIJWRZ-GFCCVEGCSA-N 483.889 5.509 5 20 JKBD Cc1c(C(=O)Nc2ccccc2NC(=O)c2ccc(C(C)(C)C)cc2)nnn1-c1cccc([N+](=O)[O-])c1 106249445 WKOCJROQZJMZAB-UHFFFAOYSA-N 498.543 5.286 5 20 JKBD COc1ccc(Cl)cc1CN(C)C(=O)c1ccc(N[C@@H](C)c2ccccn2)c([N+](=O)[O-])c1 108787697 IBCZEQLMMILLLU-HNNXBMFYSA-N 454.914 5.097 5 20 JKBD CCN(Cc1ccc(Cl)s1)C(=O)c1ccccc1NC(=O)c1ccc([N+](=O)[O-])cc1Cl 248269861 VDZXNFPLBLCECV-UHFFFAOYSA-N 478.357 5.878 5 20 JKBD Cc1ccc(C(=O)N(C)C)cc1NC(=O)c1ccc(NCc2ccccc2Cl)c([N+](=O)[O-])c1 481569585 LEDIBWUPCCEJFY-UHFFFAOYSA-N 466.925 5.123 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Cl)[C@H](NC[C@H]1CCCN(Cc2cccs2)C1)c1ccccc1 493886914 YWGNFASUSDFYPL-HOYKHHGWSA-N 499.036 5.491 5 20 JKBD C[C@H](Nc1ccc(S(=O)(=O)N2CCCCC2)cc1[N+](=O)[O-])c1nc(-c2ccccc2)cs1 501245875 NNAAXMVIWXNEAG-INIZCTEOSA-N 472.592 5.066 5 20 JKBD Cc1csc(Sc2ccc(C(=O)N3CCO[C@H](c4ccccc4Cl)C3)cc2[N+](=O)[O-])n1 505155535 VOSZZPJTFHPQQE-SFHVURJKSA-N 475.979 5.378 5 20 JKBD Cc1nnc(Sc2ccc(NC(=O)C3CCN(c4ccccc4[N+](=O)[O-])CC3)c(C)c2)s1 505904362 PPFLTAONWSMONC-UHFFFAOYSA-N 469.592 5.069 5 20 JKBD C[C@@H](Nc1ccc(C(=O)NCCc2cccc(Cl)c2Cl)cc1[N+](=O)[O-])c1ccccn1 507401863 KADCYQORMBUNJT-CQSZACIVSA-N 459.333 5.442 5 20 JKBD CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccc(Br)cc1C(F)(F)F 509237543 RGERRZQOEQQPEN-UHFFFAOYSA-N 460.250 5.819 5 20 JKBD O=C(CCc1ncc(-c2ccc(Cl)cc2)o1)Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1 514900206 GCWKZVKHARXPPO-UHFFFAOYSA-N 454.895 5.598 5 20 JKBD NC(=O)c1cccc(NC(=O)c2c3c(nc4ccccc24)/C(=C/c2ccc([N+](=O)[O-])cc2)CCC3)c1 515180530 RQJLUXPYYRBZGE-OBGWFSINSA-N 478.508 5.371 5 20 JKBD CCCC(=O)Nc1cccc(NC(=O)c2ccc(N[C@@H](C)c3ccccn3)c([N+](=O)[O-])c2)c1C 517912469 MMCJKUPTCLYCSM-KRWDZBQOSA-N 461.522 5.462 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Cl)[C@H](NC[C@@H]1CCCO[C@@H]1c1ccccc1)c1ccccc1 518002898 JWCILCHCWZTIAV-BUUDZMLXSA-N 479.964 5.686 5 20 JKBD COc1ccc(CNCc2cc(Br)c(OCc3ccccc3)c(OC)c2)cc1[N+](=O)[O-] 518776735 LHTZUZNLLGFYDQ-UHFFFAOYSA-N 487.350 5.243 5 20 JKBD C[C@@H](Sc1nnc(-c2ccccc2F)o1)C(=O)Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1 592947149 UGMUNSBULKKKHC-LLVKDONJSA-N 471.495 5.027 5 20 JKBD CCCOc1ccc(Oc2ncccc2CNC(=O)N[C@@H](C)c2cccc([N+](=O)[O-])c2)cc1 604127169 DLWNMRRNTPDSGO-KRWDZBQOSA-N 450.495 5.131 5 20 JKBD Cc1cc(Sc2ncccn2)ccc1NC(=O)c1ccc(N2CCC[C@@H](C)C2)c([N+](=O)[O-])c1 608895541 RORWBIJVRCVDPZ-MRXNPFEDSA-N 463.563 5.333 5 20 JKBD COc1cc(C(=O)Nc2nc(C3CC3)c(Cc3ccc(F)cc3)s2)c([N+](=O)[O-])cc1OC(F)F 608902150 GIONKQRPKWSIGY-UHFFFAOYSA-N 493.463 5.521 5 20 JKBD C[C@@H]1CO[C@@H](c2ccccc2)CN1C(=O)C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1 608966521 PCMJOFQBGSFRJL-ZMLNIQHFSA-N 499.592 6.124 5 20 JKBD Cc1ccc(NC(=O)c2ccc(N3CCO[C@H](c4ccc(F)c(F)c4)C3)c([N+](=O)[O-])c2)cc1 608973404 AMJABMKTVFLYSA-QHCPKHFHSA-N 453.445 5.012 5 20 JKBD Cc1cc(COc2ccc(C(=O)Nc3ccc([N+](=O)[O-])c(Cl)c3)cc2Br)on1 727711629 NTRVCWYRHXYSGY-UHFFFAOYSA-N 466.675 5.138 5 20 JKBD Cc1nc(C2(NC(=O)CCC(=O)c3ccc4ccc5cccc6ccc3c4c56)CCCC2)no1 727755672 AYZVEUIQKILUKC-UHFFFAOYSA-N 451.526 5.824 5 20 JKBD Cc1ccc(CN(Cn2nc(-c3cccc([N+](=O)[O-])c3)ccc2=O)[C@@H]2CCc3ccccc32)cc1 747075716 HUFMKECAVIUWDO-HHHXNRCGSA-N 466.541 5.274 5 20 JKBD COc1cc([C@H]2NC(=O)c3sc4ccccc4c3N2)ccc1OCc1ccc([N+](=O)[O-])cc1 877853748 KLMJEBGQUNHIIB-HSZRJFAPSA-N 461.499 5.251 5 20 JKBD Cc1cc(C(=O)N2CCC[C@H]2c2nc(-c3ccccc3OCc3ccccc3)no2)ccc1[N+](=O)[O-] 904465806 WEQBKJBZJFZUPA-QHCPKHFHSA-N 484.512 5.510 5 20 JKBD COc1cccc([C@H](CNC(=O)/C=C\c2ccc([N+](=O)[O-])cc2)c2c[nH]c3ccccc23)c1OC 912664139 XFLRTVYEORDMQK-QPMFXJJASA-N 471.513 5.055 5 20 JKBD Cc1onc(-c2c(Cl)cccc2Cl)c1C(=O)OCc1nc(-c2cccc([N+](=O)[O-])c2)no1 914900504 SRLVAZHGBKGSBS-UHFFFAOYSA-N 475.244 5.272 5 20 JKBD CC(C)(C)Cc1noc2nc(C3CC3)cc(C(=O)OCc3nc(-c4ccc([N+](=O)[O-])cc4)no3)c12 919164419 WRXLMAZRUJTKGV-UHFFFAOYSA-N 477.477 5.004 5 20 JKBD C[C@@H](OC(=O)Cc1csc(-c2ccc(Cl)s2)n1)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 920677686 LABFSQVGIYMHPN-SNVBAGLBSA-N 476.923 5.330 5 20 JKBD Cc1cc([N+](=O)[O-])ccc1NC(=O)COC(=O)c1cccnc1Oc1ccc(Cl)cc1Cl 920913056 SOVMCKJMGHYAHS-UHFFFAOYSA-N 476.272 5.193 5 20 JKBD O=C(COC(=O)c1csc(-c2ccc(Cl)cc2Cl)n1)Nc1cc([N+](=O)[O-])ccc1Cl 921223722 NTMWFIHLIXTYTM-UHFFFAOYSA-N 486.720 5.474 5 20 JKBD Cc1c(C(=O)NC2(c3ccc(NC(=O)C4CC(F)(F)C4)cc3)CCC2)cc(Cl)cc1[N+](=O)[O-] 1785909547 ORWUSBCMFPESEE-UHFFFAOYSA-N 477.895 5.350 5 20 JKBD O=C(NC1(c2ccc(NC(=O)[C@H]3C[C@H]3C3CC3)cc2)CCC1)c1cc(Br)ccc1[N+](=O)[O-] 1786056017 JQJSTNFAVXVJLV-OALUTQOASA-N 498.377 5.151 5 20 JKBD Cc1cc2cccc(C(=O)Nc3ccc(C4(NC(=O)c5cc(O)cc([N+](=O)[O-])c5)CCC4)cc3)c2[nH]1 1789019683 NQRQADQRYANEHG-UHFFFAOYSA-N 484.512 5.152 5 20 JKBD Cc1ccc2cc(C(=O)N[C@@H]3C[C@@H]4CC[C@H](C3)N4C(=O)c3c(F)ccc([N+](=O)[O-])c3C)sc2c1 1800700032 JWNOSHTYMWRWOT-BCDXTJNWSA-N 481.549 5.131 5 20 JKBD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccccc1C1CC1)c1cc2cc([N+](=O)[O-])ccc2s1 1803518953 KGVLSNKEZTYXTF-REPLKXPHSA-N 475.570 5.253 5 20 JKBD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)/C=C/c1ccccc1[N+](=O)[O-])c1cc(Cl)c(F)c(Cl)c1 1804345735 WVEUFMIJXUOAPY-ORIYUZMUSA-N 492.334 5.006 5 20 JKBD O=C(c1cc2cc([N+](=O)[O-])ccc2s1)N1CCC2(CCCN(C(=O)C3CCCCC3)C2)CC1 1808972180 YCJMPGVZFOHBAJ-UHFFFAOYSA-N 469.607 5.235 5 20 JKBD Cc1c(C(=O)N2CC[C@H](CNC(=O)[C@@]3(C)CC=CCC3)[C@H]2c2cccnc2)cc(Cl)cc1[N+](=O)[O-] 1813585360 HOWFZNVZQUBFGJ-RTGAMMJTSA-N 496.995 5.018 5 20 JKBD Cc1ccsc1C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)[nH]n1 1816349603 AXIJVPZRWXGMNV-KRWDZBQOSA-N 495.586 5.522 5 20 JKBD C/C(=C\c1ccc(C)o1)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2c(F)ccc([N+](=O)[O-])c2C)[nH]n1 1819492598 FFPLCLOOBQLLPE-OSJHKOOESA-N 495.511 5.076 5 20 JKBD CC1(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)Cc3ccc(Cl)cc3[N+](=O)[O-])[nH]n2)CCCCC1 1822330094 WVYZZEFVTIKDFY-IBGZPJMESA-N 487.988 5.177 5 20 JKBD Cc1ccc(CC(=O)N2CCCC[C@H]2C2CCN(C(=O)c3c[nH]c(C(C)(C)C)c3)CC2)cc1[N+](=O)[O-] 1830362533 AWMGAZJHEOJXLX-QHCPKHFHSA-N 494.636 5.005 5 20 JKBD Cc1cccc(C(=O)N2CCC([C@@H]3CCCCN3C(=O)c3ccc([N+](=O)[O-])cc3F)CC2)c1Cl 1830497326 FAXFXHPKTBSNEH-QFIPXVFZSA-N 487.959 5.243 5 20 JKBD C[C@@]1(C(=O)N2CCCC[C@H]2C2CCN(C(=O)c3cc4cc([N+](=O)[O-])ccc4s3)CC2)CC1(F)F 1832810121 PVDOZKUYHAZJKW-MBSDFSHPSA-N 491.560 5.088 5 20 JKBD Cc1c(C(=O)N2CCCC23CN(C(=O)c2cc4cccc(F)c4s2)C3)cc(Cl)cc1[N+](=O)[O-] 1845499409 QJUQTSAGAYKAHB-UHFFFAOYSA-N 487.940 5.041 5 20 JKBD COc1ccc(C(=O)C2CCN(C(=O)c3ccc(Oc4ccc(Cl)cc4[N+](=O)[O-])cc3)CC2)cc1 12745152 YFMYUHBGKQQVHI-UHFFFAOYSA-N 494.931 5.784 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Cl)[C@@H](NCc1ccc(CN2CCCCC2)cc1)c1ccccc1 15506449 QJGTVAWLBPZZGI-SANMLTNESA-N 493.007 5.704 5 20 JKBD CC(C)N(Cc1nnc(-c2cccc([N+](=O)[O-])c2)o1)C(=O)Cc1ccc(-c2ccccc2)cc1 16014844 VNNGOXNKXQKDTG-UHFFFAOYSA-N 456.502 5.292 5 20 JKBD C[C@H]1CCN(C(=O)CSc2nc3cc4ccccc4cc3c(=O)n2C)c2ccccc2S1 22254223 VRTYZDYHONORQT-INIZCTEOSA-N 461.612 5.096 5 20 JKBD C[C@@H](OC(=O)c1ccc(Cl)cc1[N+](=O)[O-])C(=O)Nc1ccc(Cl)cc1C(F)(F)F 23445169 MCODQBIGSDKUAY-MRVPVSSYSA-N 451.184 5.104 5 20 JKBD CCC(C)(C)NC(=O)c1ccc(NC(=O)c2ccc(N3CCC[C@H](C)C3)c([N+](=O)[O-])c2)cc1 117545410 XEBHXUQWHNCBHN-KRWDZBQOSA-N 452.555 5.002 5 20 JKBD Cc1sc(NC(=O)Cc2csc(-c3ccccc3Cl)n2)nc1-c1cccc([N+](=O)[O-])c1 195703998 UAOXPTHBJVUYKO-UHFFFAOYSA-N 470.963 5.985 5 20 JKBD C[C@H]1CCC[C@H](OCc2cccc(NC(=O)CCCn3c(=O)oc4cc([N+](=O)[O-])ccc43)c2)C1 303027516 WGHSLVHPNBYFPH-UWJYYQICSA-N 467.522 5.017 5 20 JKBD C[C@@H](Nc1ccc(C(=O)N(C)[C@@H](c2ccccc2)C(F)(F)F)cc1[N+](=O)[O-])c1ccccn1 485353126 RHJBCNCPTMTFAR-VFNWGFHPSA-N 458.440 5.539 5 20 JKBD C[C@@H]1CCCCN1C(=O)c1ccc(NC(=O)c2ccc(NCc3ccccc3)c([N+](=O)[O-])c2)cc1 489454104 DMPYIABJHNAVOO-LJQANCHMSA-N 472.545 5.474 5 20 JKBD COc1cc(CN(C)C(=O)c2csc(-c3cccc([N+](=O)[O-])c3)n2)ccc1OCc1ccccc1 495501247 GSYZFGGSSJCCCK-UHFFFAOYSA-N 489.553 5.578 5 20 JKBD CC1CCN(C[C@@H]2CCCN(C(=O)c3ccccc3NC(=O)c3ccc([N+](=O)[O-])cc3Cl)C2)CC1 498502080 FBQCHAQODTZJKX-IBGZPJMESA-N 499.011 5.085 5 20 JKBD CCCn1c(S[C@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)nc2ccc(C(F)(F)F)cc21 501236268 SSSKUCCLDRLUIK-GFCCVEGCSA-N 477.468 6.277 5 20 JKBD CCOc1cc(C(=O)N(C)[C@@H]2CCSc3ccc(Br)cc32)c([N+](=O)[O-])cc1OC 504630114 YELSVQNMWYYIFN-OAHLLOKOSA-N 481.368 5.074 5 20 JKBD O=c1ccccn1Cc1ccc(CNCc2ccc(Oc3ccccc3Cl)c([N+](=O)[O-])c2)cc1 507927078 ZIPYLEZVQMZUHS-UHFFFAOYSA-N 475.932 5.540 5 20 JKBD O=[N+]([O-])c1cc(CSc2nnc(-c3ccc(Cl)cc3Cl)n2Cc2ccco2)cs1 510867974 QRANGFPGMCZJNJ-UHFFFAOYSA-N 467.359 6.155 5 20 JKBD COc1cc(C)ccc1Oc1ccc(F)cc1NC(=O)c1ccn(-c2cccc([N+](=O)[O-])c2)n1 512817019 KDFGGKOISZYZTE-UHFFFAOYSA-N 462.437 5.281 5 20 JKBD Cc1cc(Oc2ncccn2)ccc1NC(=O)c1cc([N+](=O)[O-])ccc1NCc1ccccc1 518939951 OZGIXNZRQKDHTN-UHFFFAOYSA-N 455.474 5.350 5 20 JKBD O=C(Nc1ccc2ncnc(O)c2c1)c1cc([N+](=O)[O-])ccc1Sc1ccc(Cl)cc1 523336847 GVIRLMKJPLPLFV-UHFFFAOYSA-N 452.879 5.301 5 20 JKBD O=C(NC[C@H]1CCCc2ccccc21)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 603477621 HHQFFOUOUMGKQU-GOSISDBHSA-N 461.484 5.066 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Cl)C(=O)N[C@H](CCCc1ccccc1)c1ccccc1 603706438 JAALFFRORVZQTI-OAQYLSRUSA-N 451.910 5.067 5 20 JKBD CCOc1cc(NC(=O)c2cc(C3CC3)nc3c2c(C)nn3C(C)(C)C)c([N+](=O)[O-])cc1OCC 603733991 SEJQQLJDPRJRQJ-UHFFFAOYSA-N 481.553 5.330 5 20 JKBD O=C(CSc1ccc(C(F)(F)F)cc1[N+](=O)[O-])Nc1ccc(NC(=O)c2ccco2)c(Cl)c1 604120039 XANPZKBRSXJKHO-UHFFFAOYSA-N 499.854 5.843 5 20 JKBD O=C(C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)N1CCC[C@H]1CN1CCCCC1 609023904 AJYACKBPSBQGKE-WTKRLXQWSA-N 490.629 5.612 5 20 JKBD CC(C)(C)OC(=O)NC[C@@H]1CCN(C(=O)c2cc([N+](=O)[O-])ccc2Sc2ccc(Cl)cc2)C1 725733323 MFFWPTVAMCYKOF-HNNXBMFYSA-N 491.997 5.386 5 20 JKBD C[C@H](OC(=O)[C@H](C)c1c(Cl)cccc1Cl)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 726029448 QHIQNGOKCVAAOQ-ZJUUUORDSA-N 479.238 5.594 5 20 JKBD Cc1ccc(NC(=O)c2ccc(Nc3ccc(NC(=O)[C@@H]4CCCO4)cc3)c([N+](=O)[O-])c2)cc1 727431429 PXQCSMJPIAYNPL-QHCPKHFHSA-N 460.490 5.017 5 20 JKBD O=C(Oc1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2Cl)cc1)c1cnc(-c2ccccn2)s1 727661986 LBSYEPDXZAZSTI-UHFFFAOYSA-N 480.889 5.238 5 20 JKBD C[C@H]1CN(c2ccc(NC(=O)c3ccc(N4CCCC4)c([N+](=O)[O-])c3)cc2C(F)(F)F)C[C@@H](C)O1 728010141 DUWVLNGSBKFLDY-IYBDPMFKSA-N 492.498 5.080 5 20 JKBD COc1cc(NC(=O)c2ccccc2Cl)c(C(=O)OCc2c(F)cccc2[N+](=O)[O-])cc1OC 728989058 WQTOBUSLMVBOLA-UHFFFAOYSA-N 488.855 5.014 5 20 JKBD COc1ccc(NC(=O)c2ccccc2NC(=O)CSc2nc3ccc([N+](=O)[O-])cc3s2)cc1 788005062 ZMCAHUOMQHWNRJ-UHFFFAOYSA-N 494.554 5.196 5 20 JKBD O=[N+]([O-])c1cc(-c2nc(-c3ccc(Br)cn3)no2)ccc1NCc1ccccc1 904850622 ZYZKCXMZNBEVRV-UHFFFAOYSA-N 452.268 5.081 5 20 JKBD C[C@@H](Oc1ccccc1Cl)C(=O)Oc1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2Cl)cc1 914222178 VXHVJKPXKZFUQE-CYBMUJFWSA-N 475.284 5.527 5 20 JKBD CC1=C(C(=O)Nc2ccccc2C(F)(F)F)[C@@H](c2ccc(Cl)c([N+](=O)[O-])c2)NC(=O)N1C1CC1 916170616 SUJIKWJIDBHCCW-LJQANCHMSA-N 494.857 5.408 5 20 JKBD CCCNC(=O)c1ccc(Cl)cc1NC(=O)c1ccc(N[C@H](C)c2ccccn2)c([N+](=O)[O-])c1 919848778 NPBMTQHZZHCBCQ-OAHLLOKOSA-N 481.940 5.208 5 20 JKBD COC(=O)/C=C\c1ccc(Sc2nnc(-c3ccoc3C)n2Cc2ccccc2)c([N+](=O)[O-])c1 931413581 ZYTCMOWDDOHXJV-LUAWRHEFSA-N 476.514 5.140 5 20 JKBD O=C(Cc1cccc([N+](=O)[O-])c1)Nc1ccc(C2(NC(=O)[C@@H]3CCCCC3(F)F)CCC2)cc1 1785791714 IMNLYWVGNLBWDE-NRFANRHFSA-N 471.504 5.097 5 20 JKBD Cc1cccc(-c2cnccc2C(=O)Nc2ccc(C3(NC(=O)c4ccc([N+](=O)[O-])[nH]4)CCC3)cc2)c1 1788358446 JGIWXZIAWSCDED-UHFFFAOYSA-N 495.539 5.355 5 20 JKBD O=C(/C=C/c1ccsc1)NC1(c2ccc(NC(=O)c3cc([N+](=O)[O-])cc4c3OCC4)cc2)CCC1 1790044407 SFOWTSFZGMVDHW-FARCUNLSSA-N 489.553 5.052 5 20 JKBD CN(C)c1ccc([N+](=O)[O-])cc1C(=O)Nc1ccc(C2(NC(=O)[C@H](F)c3ccccc3)CCC2)cc1 1790791503 FODADFQITAMTAG-XMMPIXPASA-N 490.535 5.119 5 20 JKBD Cc1cc(O)c([N+](=O)[O-])cc1C(=O)NC1(c2ccc(NC(=O)c3cccc4ccncc34)cc2)CCC1 1790859337 DGKDWAIDCPBYCQ-UHFFFAOYSA-N 496.523 5.219 5 20 JKBD Cc1cc(O)c([N+](=O)[O-])cc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cccc3c1oc1ccccc13)C2 1800803383 NJGMURJVMJCCPA-BCDXTJNWSA-N 499.523 5.074 5 20 JKBD Cc1ccc([C@@H](C)C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cc4cc([N+](=O)[O-])ccc4s2)C3)cc1 1801779939 VVKQSIUDMVXZSU-RZXSNQJFSA-N 477.586 5.173 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)N1CCCC[C@H]1c1cc(NC(=O)C23CCC(CC2)CC3)n[nH]1 1822961622 ZMIAIOJCDRFNHK-RDEMWXPNSA-N 483.544 5.042 5 20 JKBD O=C(c1ccc(F)s1)N1CCCC[C@H]1C1CCN(C(=O)C2(c3cccc([N+](=O)[O-])c3)CCC2)CC1 1825351588 XMMLGAVHUKZMHV-NRFANRHFSA-N 499.608 5.151 5 20 JKBD Cc1c(C(=O)N2CCC([C@@H]3CCCCN3C(=O)[C@H]3CCC[C@H]3C)CC2)cc(Cl)cc1[N+](=O)[O-] 1828486405 OGPQRAMDSUKUSY-BUVFEPMLSA-N 476.017 5.226 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)N1CCC([C@@H]2CCCCN2C(=O)/C=C/C2CCCC2)CC1 1830350378 NDKOEJXLYLVUOG-SRLUVNLFSA-N 471.573 5.022 5 20 JKBD Cc1ccc(/C=C/C(=O)N2CCCC[C@H]2C2CCN(C(=O)c3ccc([N+](=O)[O-])cc3F)CC2)s1 1832173196 CXGNBWIVTACABY-LBQODKDLSA-N 485.581 5.051 5 20 JKBD COc1cc(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)C[C@H](C)c3ccccc3)CC2)ccc1[N+](=O)[O-] 1832697224 KRGKBWGPWQTROZ-GBXCKJPGSA-N 493.604 5.031 5 20 JKBD O=C(c1cccc(F)c1[N+](=O)[O-])N1CC[C@H]2[C@@H]1CCN2C(=O)C1CCC(c2ccc(Cl)cc2)CC1 1847619206 KSAUVSMQQHMGGW-ZNKZVOIUSA-N 499.970 5.177 5 20 JKBD Cc1cccc([N+](=O)[O-])c1NC(=O)COC(=O)c1c2c(nc3ccccc13)/C(=C/c1ccco1)CC2 8620699 DPGBVJGLXRVQKT-SAPNQHFASA-N 483.480 5.327 5 20 JKBD COc1ccc2cc(CN[C@@H](C(=O)Nc3ccc([N+](=O)[O-])cc3Cl)c3ccccc3)ccc2c1 10180104 QHKQMESRXGALSR-RUZDIDTESA-N 475.932 5.880 5 20 JKBD O=c1nc(/C(Cl)=C/c2ccc(Oc3ccccc3Cl)c([N+](=O)[O-])c2)[nH]c2ccccc12 16441392 AOAMKKZWQXEOHG-WJDWOHSUSA-N 454.269 6.014 5 20 JKBD C[C@H](OC(=O)c1ccccc1OCc1ccc(F)cc1)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 17537948 LPRPQUCFYAGXDP-HNNXBMFYSA-N 463.421 5.281 5 20 JKBD O=C(O[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1)c1cc(Cl)ccc1F 18799257 SRWFNPMBPDHRMD-LJQANCHMSA-N 463.248 5.578 5 20 JKBD Cc1ccc([N+](=O)[O-])cc1NC(=O)CSc1nnc(-c2ccc(Cl)cc2)n1Cc1ccco1 20990875 AYBVRYYQTIBCJF-UHFFFAOYSA-N 483.937 5.187 5 20 JKBD O=C(Nc1ccccc1Cl)C(=Cc1ccc(O)c([N+](=O)[O-])c1)C(=O)Nc1ccccc1Cl 28912081 ORERUVGGAPVUIE-UHFFFAOYSA-N 472.284 5.268 5 20 JKBD CCOC(=O)c1cc(-c2ccccc2)ccc1NC(=O)c1cc(OC)c(OC(F)F)cc1[N+](=O)[O-] 116272309 RUVGBZXHDFWLSR-UHFFFAOYSA-N 486.427 5.301 5 20 JKBD Cc1cc(C)c(NC(=O)CNCc2ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])cc2)c(C)c1 409518620 LPHWQILPFJESOD-UHFFFAOYSA-N 453.926 5.694 5 20 JKBD C[C@H](Cn1ccnc1)NC(=O)c1c2c(nc3ccccc13)/C(=C\c1ccc([N+](=O)[O-])cc1)CCC2 481312774 RXDRPENXRAKLIP-CTBJKRMSSA-N 467.529 5.035 5 20 JKBD O=C(C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)N1CCO[C@H](c2ccccc2)C1 485498766 NTPBTLCQJPFKHL-RTWFUWSXSA-N 485.565 5.735 5 20 JKBD COc1ccccc1NC(=O)Nc1cc(NC(=O)c2cc3cc([N+](=O)[O-])ccc3s2)ccc1OC 509451495 QDVFYKDRCYWNKT-UHFFFAOYSA-N 492.513 5.723 5 20 JKBD COc1cc(C(=O)Nc2ccc(-n3cncn3)c(F)c2)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 509504949 CMGTYIPSQNYJKI-UHFFFAOYSA-N 483.843 5.021 5 20 JKBD CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)c1nc(-c2cccs2)n(-c2ccc(F)cc2)n1 509697254 KDPLCVGXUAHHGP-UHFFFAOYSA-N 465.510 5.094 5 20 JKBD COc1cc(C(=O)Nc2nc3ccc(Cl)cc3s2)c([N+](=O)[O-])cc1OCc1cscn1 512384309 NMZAZAGSDAARFS-UHFFFAOYSA-N 476.923 5.154 5 20 JKBD COc1cc(C(=O)Nc2nc(-c3cc(C)oc3C)cs2)c([N+](=O)[O-])cc1OCc1cscn1 512635284 XMYWFFDHJLGJCW-UHFFFAOYSA-N 486.531 5.225 5 20 JKBD CCOc1cc(NC(=O)c2cn(-c3ccccc3)nc2-c2cccs2)c([N+](=O)[O-])cc1OCC 514864430 DDPAGISHUKCBDK-UHFFFAOYSA-N 478.530 5.559 5 20 JKBD O=C(CCNc1ccc(C(F)(F)F)cc1[N+](=O)[O-])Nc1ccccc1NC(=O)c1ccccc1 515169208 JSVSBEBYTMWSOS-UHFFFAOYSA-N 472.423 5.307 5 20 JKBD COc1ccc([C@H](CNC(=O)c2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)c2c[nH]c3ccccc23)cc1 517555241 KLHMSLMZTAZMKB-QHCPKHFHSA-N 495.539 5.047 5 20 JKBD CC(=O)N(c1ccc(C(F)(F)F)cc1)c1nc(-c2nc3cc([N+](=O)[O-])ccc3n2C)cs1 518742823 WNWXMKZKMJPNOW-UHFFFAOYSA-N 461.425 5.308 5 20 JKBD O=C(Nc1ccc(-c2nnc3n2CCCC3)cc1)c1cc([N+](=O)[O-])ccc1NCc1ccccc1 519507434 YBXNSIHTIWRMJE-UHFFFAOYSA-N 468.517 5.054 5 20 JKBD Cc1cc(NC(=O)c2ccc(N[C@H](C)c3ccccn3)c([N+](=O)[O-])c2)n(-c2ccccc2F)n1 520646113 FLGARZNMRGTQMU-MRXNPFEDSA-N 460.469 5.048 5 20 JKBD C[C@@H](Nc1ccc2c(c1)CCC(=O)N2Cc1ccc(Cl)cc1)C(=O)Nc1ccc([N+](=O)[O-])cc1 521642240 SAFQCCWVSWIZAW-MRXNPFEDSA-N 478.936 5.167 5 20 JKBD CN(CCc1ccccn1)C(=O)c1c2c(nc3ccccc13)/C(=C/c1cccc([N+](=O)[O-])c1)CCC2 524488680 MKRQVLOJWUSLQM-DYTRJAOYSA-N 478.552 5.730 5 20 JKBD Cc1nc(-c2ccc(C(F)(F)F)cc2)sc1C(=O)Nc1cc([N+](=O)[O-])ccc1OC(F)F 603638149 DSHSNVAPPUIDBK-UHFFFAOYSA-N 473.379 5.899 5 20 JKBD CCC(C)(C)NC(=O)c1ccc(NC(=O)c2ccc(N3CCC(C)CC3)c([N+](=O)[O-])c2)cc1Cl 603987469 RPOTZCGZZCDVTE-UHFFFAOYSA-N 487.000 5.655 5 20 JKBD O=C(C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)N1CCOc2ccccc2C1 604255773 SSJXAJKQTJKDEK-HKWRFOASSA-N 471.538 5.556 5 20 JKBD COc1ccc(Sc2ccc(NC(=O)C(=O)N(C)Cc3ccccc3[N+](=O)[O-])cc2Cl)cc1 604464181 GWILYURBHOXJNX-UHFFFAOYSA-N 485.949 5.005 5 20 JKBD O=C(Nc1cc([N+](=O)[O-])ccc1OC(F)F)N1CCO[C@H](c2ccc(Cl)c(Cl)c2)C1 608994632 ONGGFTOLDYAWDJ-INIZCTEOSA-N 462.236 5.108 5 20 JKBD CC(C)(C)OC(=O)Nc1ccc(NC(=O)c2cc(OCC(F)(F)F)ccc2[N+](=O)[O-])cc1 729403165 DFCUPXDGQDZNJC-UHFFFAOYSA-N 455.389 5.135 5 20 JKBD Cc1nn(Cc2ccc(C(=O)Nc3ccccc3CN(C)C(=O)OC(C)(C)C)cc2)c(C)c1[N+](=O)[O-] 742530738 RULLKTFJIGWTFN-UHFFFAOYSA-N 493.564 5.076 5 20 JKBD COc1ccccc1NC(=O)c1cc2ccccc2cc1OC(=O)Cn1ccc2cc([N+](=O)[O-])ccc21 744936873 YCTUPZMQLAMZJY-UHFFFAOYSA-N 495.491 5.569 5 20 JKBD C[C@@H](OC(=O)Cc1csc(-c2ccc(Cl)cc2Cl)n1)C(=O)Nc1cccc([N+](=O)[O-])c1 747255336 YIARDQSNIRSJDE-LLVKDONJSA-N 480.329 5.138 5 20 JKBD Cc1cc(-c2cc(C(=O)Nc3ccc(F)c([N+](=O)[O-])c3)c3cnn(C(C)C)c3n2)c(C)s1 814548165 POWTVDDKGHAWFF-UHFFFAOYSA-N 453.499 5.657 5 20 JKBD COc1ccccc1[C@H](NCc1ccc(Sc2ccc(C)cc2)c([N+](=O)[O-])c1)c1nccn1C 915226851 SPPBEBYCXLYCKY-VWLOTQADSA-N 474.586 5.676 5 20 JKBD CC(C)(C)Cc1noc2nc(C3CC3)cc(C(=O)OCc3nc(-c4cccc([N+](=O)[O-])c4)no3)c12 915578887 UGCIACDKJMNHSI-UHFFFAOYSA-N 477.477 5.004 5 20 JKBD CC(C)N(Cc1nnc(-c2cccc([N+](=O)[O-])c2)o1)C(=O)c1ccc(O[C@H](C)c2ccccc2)nc1 915822918 ACBJPPZEEJPBEH-GOSISDBHSA-N 487.516 5.231 5 20 JKBD CCOC(=O)/C(=C\c1ccc(-c2ccc(OC)cc2[N+](=O)[O-])o1)c1nc(O)c2c(C)c(C)sc2n1 916126670 IXIZVBGBWZQKQD-YVLHZVERSA-N 495.513 5.294 5 20 JKBD CCc1cc[n+](/C(C(=S)Nc2ccc3ccccc3c2)=C(/O)c2cccc([N+](=O)[O-])c2)cc1 917610079 KJCMAXPSEDZMSH-UHFFFAOYSA-O 456.547 5.921 5 20 JKBD Cc1cc[n+](/C(C(=S)Nc2c(C(C)C)cccc2C(C)C)=C(/O)c2ccc([N+](=O)[O-])cc2)cc1 917611215 XMMVVKOSTWINSK-UHFFFAOYSA-O 476.622 6.761 5 20 JKBD O=C(Cn1ncc2ccc([N+](=O)[O-])cc21)N(Cc1cccs1)c1ccc(Br)cc1 917738027 MILCONBPOACPHQ-UHFFFAOYSA-N 471.336 5.002 5 20 JKBD CC(=O)c1ccc(-c2ccc(C(=O)N3CCCC[C@@H]3CCOC(=O)c3cccc([N+](=O)[O-])c3)o2)cc1 918637387 JRDUFIVQZKUTDZ-JOCHJYFZSA-N 490.512 5.299 5 20 JKBD CCNc1ccc(C(=O)OCc2csc(N(C(C)=O)c3ccc(Cl)cc3)n2)cc1[N+](=O)[O-] 918854262 GPMROWQPHOPMFP-UHFFFAOYSA-N 474.926 5.178 5 20 JKBD C[C@@H](OC(=O)c1cc2cccc([N+](=O)[O-])c2[nH]1)C(=O)N1c2ccccc2Sc2ccccc21 919526113 DQXYMCCKXQNDHV-CQSZACIVSA-N 459.483 5.451 5 20 JKBD Cc1ccc(CC(=O)NC2(c3ccc(NC(=O)c4ccc(Cl)o4)cc3)CCC2)cc1[N+](=O)[O-] 1788881742 QCCOKORLKDAPGB-UHFFFAOYSA-N 467.909 5.140 5 20 JKBD CC1(C)CCc2cccc(C(=O)NC3(c4ccc(NC(=O)c5ccc([N+](=O)[O-])[nH]5)cc4)CCC3)c2O1 1790185021 GTAWGKZHPOPYAM-UHFFFAOYSA-N 488.544 5.088 5 20 JKBD O=C(/C=C/C1CC1)NC1(c2ccc(NC(=O)c3ccc(Br)c([N+](=O)[O-])c3)cc2)CCC1 1790641800 LZKHPELENQTFBF-NYYWCZLTSA-N 484.350 5.071 5 20 JKBD CC(F)(F)C(=O)NC1(c2ccc(NC(=O)c3cc4cc([N+](=O)[O-])ccc4s3)cc2)CCC1 1791011282 VVYRZHNFTLZOFD-UHFFFAOYSA-N 459.474 5.212 5 20 JKBD COc1cc(C(=O)NC2(c3ccc(NC(=O)[C@]4(C)CC=CCC4)cc3)CCC2)ccc1[N+](=O)[O-] 1791993613 FWTXHYUXQJQLAK-RUZDIDTESA-N 463.534 5.098 5 20 JKBD COc1cc(C(=O)Nc2ccc(C3(NC(=O)[C@]4(C)CC=CCC4)CCC3)cc2)ccc1[N+](=O)[O-] 1792165948 SPTQUFNHYAKBOR-RUZDIDTESA-N 463.534 5.098 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CCCCCC(C)(C)C 1801830643 OZLLDLCMGSTMMO-REPLKXPHSA-N 461.578 5.291 5 20 JKBD O=C(Nc1cc([C@H]2CCCCN2C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)[nH]n1)c1sccc1F 1815429803 QOOLHJZOCAKXAX-MRXNPFEDSA-N 499.549 5.353 5 20 JKBD Cc1cc(CCCC(=O)N2CCC([C@@H]3CCCCN3C(=O)[C@@]3(C)C[C@@H]3C)CC2)c([N+](=O)[O-])cc1F 1830216704 SIRHISHZNMQALL-UHORWHLBSA-N 487.616 5.031 5 20 JKBD Cc1c(C(=O)N2CCC([C@H]3CCCCN3C(=O)[C@H]3CC=CCC3)CC2)cc(Cl)cc1[N+](=O)[O-] 1830281001 WQNVNSQYRIZJDU-SIKLNZKXSA-N 474.001 5.146 5 20 JKBD C[C@@H](Sc1ccccc1)C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cc(F)cc([N+](=O)[O-])c2)CC1 1830612321 ANLDBDCLERQIGQ-HOYKHHGWSA-N 499.608 5.148 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cc3ccccc3o2)CC1 1830733242 KIZRQEXDCIPTRB-QFIPXVFZSA-N 493.535 5.336 5 20 JKBD Cc1cc(F)c(F)c(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)CCc3cccc([N+](=O)[O-])c3)CC2)c1 1830776888 VPHPBEMIDJIQNO-XMMPIXPASA-N 499.558 5.048 5 20 JKBD C[C@H](OC(=O)c1cc2c(s1)-c1ccccc1OC2)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl 9815363 APAGNSYKFCQYFU-NSHDSACASA-N 458.879 5.053 5 20 JKBD Cc1noc(C)c1COc1cc2ccccc2cc1C(=O)OCc1cc([N+](=O)[O-])cc2c1OCOC2 9836899 LCAFSJQAUDZBFP-UHFFFAOYSA-N 490.468 5.155 5 20 JKBD COc1ccc(C)cc1NC(=O)[C@H](OC(=O)c1ccc(Cl)c([N+](=O)[O-])c1)c1ccccc1 11025170 LBVAWAHSUPOFBD-OAQYLSRUSA-N 454.866 5.102 5 20 JKBD Cc1ccc(NC(=O)[C@@H](C)Oc2ccc3c(-c4ccc([N+](=O)[O-])cc4)cc(=O)oc3c2)c(C)c1 15370802 TUTVVIZYHJJEDD-QGZVFWFLSA-N 458.470 5.391 5 20 JKBD CCOc1cc2c(cc1CN[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1)O[C@H](C)C2 25704103 WYLGBWNXKRSWSN-CPJLOUKISA-N 495.963 5.440 5 20 JKBD O=C(c1nc(-c2cccs2)n(-c2cccc(C(F)(F)F)c2)n1)N1CCc2cc([N+](=O)[O-])ccc21 69525861 XEZIQUBQBOHQQU-UHFFFAOYSA-N 485.447 5.126 5 20 JKBD CC(C)n1ncc2ccc(NC(=O)c3ccccc3C(=O)c3ccc(N(C)C)c([N+](=O)[O-])c3)cc21 195746101 AHKGYGNYYVMQAG-UHFFFAOYSA-N 471.517 5.075 5 20 JKBD CC(=O)Nc1ccc(NC(=O)CCNc2ccc(C(F)(F)F)cc2[N+](=O)[O-])c(C(F)(F)F)c1 302932961 GKCUJLOGFJBSHS-UHFFFAOYSA-N 478.349 5.032 5 20 JKBD O=C(Nc1cc(-c2cccc([N+](=O)[O-])c2)n[nH]1)c1ccc(CNC(=O)C23CC4CC(CC(C4)C2)C3)cc1 303190566 VGVADVAVTJCQJX-UHFFFAOYSA-N 499.571 5.070 5 20 JKBD CSc1ccc(C(=O)c2ccccc2C(=O)NC[C@H]2CCCO[C@H]2c2ccccc2)cc1[N+](=O)[O-] 409547496 JNWGLMFBYRUTCO-IBVKSMDESA-N 490.581 5.445 5 20 JKBD CSc1ccc(C(=O)c2ccccc2C(=O)N2CCc3cc(F)c(F)cc32)cc1[N+](=O)[O-] 479955617 AOWKXKUAINUQNV-UHFFFAOYSA-N 454.454 5.029 5 20 JKBD CCc1c(C)sc2nc(Sc3ccc([N+](=O)[O-])c4cnccc34)n(C[C@H]3CCCO3)c(=O)c12 497757029 CBQOXXOXUGPTCI-CQSZACIVSA-N 482.587 5.115 5 20 JKBD O=C(N[C@@H]1CCOc2c(-c3ccccc3)cccc21)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-] 505107957 LOUNJYNWXXBPPP-HXUWFJFHSA-N 472.419 5.457 5 20 JKBD CCOc1ccccc1Oc1ccc(CNC(=O)Nc2cc([N+](=O)[O-])ccc2OC(F)F)cn1 510852460 VXWQFSCYBCRTAM-UHFFFAOYSA-N 474.420 5.104 5 20 JKBD O=C(Nc1nc(-c2cccc3ccccc23)cs1)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-] 516074392 RDBFYQOWBOEBDS-UHFFFAOYSA-N 473.432 6.065 5 20 JKBD C[C@@H](Nc1ccc(C(=O)Nc2ccc(OC(F)F)c(Cl)c2)cc1[N+](=O)[O-])c1ccccn1 516161825 NQBUEZWJUDNMRX-GFCCVEGCSA-N 462.840 5.670 5 20 JKBD C[C@H](Nc1ccccc1OC[C@@H]1CCCCO1)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 518013029 BWASXFKKZHIZAD-HOCLYGCPSA-N 467.444 5.001 5 20 JKBD CCN(C(=O)[C@H](C)Sc1ccc([N+](=O)[O-])cc1)[C@H](c1cccnc1)c1ccc(F)c(C)c1 521452053 NYOFKJFFUYWGDF-SBUREZEXSA-N 453.539 5.556 5 20 JKBD Cc1nn(C)cc1[C@H](C)NC(=O)C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1 524341112 LNTPCIKRPISXSH-BRFSQIRFSA-N 461.547 5.055 5 20 JKBD COc1cc2c(cc1OC)[C@H](c1cccs1)N(C(=O)Nc1cc([N+](=O)[O-])ccc1C)CC2 603643179 VJTBWRFHZPBTMO-JOCHJYFZSA-N 453.520 5.162 5 20 JKBD COc1cc(C(=O)N2CCC[C@H](OCC(F)(F)F)C2)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 603982057 WCYKRSUIXBYUHF-HNNXBMFYSA-N 488.846 5.233 5 20 JKBD COc1ccc(C(=O)N(C)C)cc1NC(=O)c1ccc(Sc2ccc(C)cc2)c([N+](=O)[O-])c1 604006350 IEXOZUPPUSVFNQ-UHFFFAOYSA-N 465.531 5.017 5 20 JKBD Cc1csc(Sc2ccc(NC(=O)N(Cc3ccc([N+](=O)[O-])cc3)C(C)C)c(C)c2)n1 609424401 DFIQTFKCTMFIET-UHFFFAOYSA-N 456.593 6.262 5 20 JKBD CC(=O)Nc1cc(Cl)ccc1C(=O)O[C@H](C(=O)Nc1ccc(C)cc1[N+](=O)[O-])c1ccccc1 727529357 MVKIMABOLQOVLM-QFIPXVFZSA-N 481.892 5.052 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Cl)[C@H](Nc1ccc(N2CCOCC2)c(F)c1)c1ccccc1 728062253 LJIYUGYNGRLAIG-HSZRJFAPSA-N 484.915 5.016 5 20 JKBD COc1ccc([C@H](OC(=O)c2csc(-c3cccc([N+](=O)[O-])c3)n2)[C@H](C)n2cccn2)cc1 729803359 NHTMGZMDIACYCK-YCRPNKLZSA-N 464.503 5.083 5 20 JKBD Cc1ccc(-c2nnc([C@@H](C)OC(=O)c3ccc(N4CCC[C@H](C)C4)c([N+](=O)[O-])c3)o2)cc1 745930542 OWUVQECCHKOCQG-DLBZAZTESA-N 450.495 5.108 5 20 JKBD C[C@@H](OC(=O)c1c[nH]c2cc([N+](=O)[O-])ccc12)C(=O)Nc1c(Cl)cc(Cl)cc1Cl 756764668 BCMPVRPGPZROAY-MRVPVSSYSA-N 456.669 5.220 5 20 JKBD O=C(OCc1nnc(-c2ccc([N+](=O)[O-])cc2)o1)c1c2c(nc3ccccc13)/C(=C\c1ccco1)CC2 765486215 QAZQZKHUZYITFA-VKAVYKQESA-N 494.463 5.630 5 20 JKBD COc1ccccc1[C@H](C)NC(=O)[C@H](C)Oc1ccc2c(-c3ccc([N+](=O)[O-])cc3)cc(=O)oc2c1 851960071 YUDBXCVJKNDSPI-IRXDYDNUSA-N 488.496 5.022 5 20 JKBD Cc1ccccc1N(C(=O)c1cc([N+](=O)[O-])ccc1N1CCOCC1)c1nc2ccccc2s1 863967872 AGYQHWNQMXQROK-UHFFFAOYSA-N 474.542 5.328 5 20 JKBD O=C(OCc1nnc(-c2ccc([N+](=O)[O-])cc2)o1)c1sc(-c2ccco2)nc1-c1ccccc1 900280088 TVNYSQYSVJXGOK-UHFFFAOYSA-N 474.454 5.385 5 20 JKBD C[C@@H](NC(=O)c1ccccc1NC(=O)c1ccc([N+](=O)[O-])cc1Cl)c1c(F)cccc1F 914484526 GFTXZPWOLAXPCF-GFCCVEGCSA-N 459.836 5.270 5 20 JKBD O=C(COc1ccccc1C(F)(F)F)Oc1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2Cl)cc1 914711481 CQTAFFUDFYTWAI-UHFFFAOYSA-N 494.809 5.504 5 20 JKBD C[C@@H](OC(=O)c1cc([N+](=O)[O-])ccc1Oc1ccccc1)C(=O)Nc1ccccc1OC(F)F 917256669 BJTBTZFKMPWXRJ-CQSZACIVSA-N 472.400 5.173 5 20 JKBD C[C@@H](NC(=O)c1ccc(Br)s1)C(=O)OCc1nc2ccccc2c2ccccc12 919520921 LIEXIUGERUIRKW-CYBMUJFWSA-N 469.360 5.074 5 20 JKBD CC(C)C(=O)N[C@H](Cc1c[nH]c2ccccc12)C(=O)Oc1ccc(-c2ccccc2)cc1[N+](=O)[O-] 920330488 GMELIZJBHRINPP-HSZRJFAPSA-N 471.513 5.032 5 20 JKBD CC1=C(C(=O)Nc2ccc([N+](=O)[O-])cc2)[C@@H](c2ccc(O)c(Cl)c2)NC(=S)N1c1ccccc1 921294794 OJRZIFYQNRJGMD-JOCHJYFZSA-N 494.960 5.302 5 20 JKBD O=C(NC1(c2ccc(NC(=O)c3ccc4occc4c3O)cc2)CCC1)c1ccc([N+](=O)[O-])cc1F 1790930826 LHKOYDWKAGIXOD-UHFFFAOYSA-N 489.459 5.247 5 20 JKBD CC(C)[C@H](C(=O)N1CCC2(CCCN(C(=O)c3ccc([N+](=O)[O-])o3)C2)CC1)c1ccc(Cl)cc1 1804642371 WVJAOSJANSYZPN-QFIPXVFZSA-N 487.984 5.126 5 20 JKBD O=C(/C=C/c1ccccc1)N1CCCC2(CCN(C(=O)c3cc4cc([N+](=O)[O-])ccc4s3)CC2)C1 1809307173 DBNBLEVEHBSALW-JXMROGBWSA-N 489.597 5.368 5 20 JKBD Cc1cccc(C(=O)Nc2cc([C@H]3CCCCN3C(=O)c3cc(F)cc([N+](=O)[O-])c3)[nH]n2)c1Cl 1823183551 DSTOKOAZGGTMNN-LJQANCHMSA-N 485.903 5.039 5 20 JKBD O=C(c1cccc(F)c1)N1CCC([C@H]2CCCCN2C(=O)C2(c3cccc([N+](=O)[O-])c3)CCC2)CC1 1830292933 MSLRJMAYFUWZAN-RUZDIDTESA-N 493.579 5.089 5 20 JKBD C/C(=C\c1ccc(C)o1)C(=O)N1CCC([C@@H]2CCCCN2C(=O)Cc2ccc(C)c([N+](=O)[O-])c2)CC1 1830364589 DEBWSNFLIXSKBN-XDKREJCVSA-N 493.604 5.070 5 20 JKBD C/C=C(\C)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)CC1 1831342284 BZYRNWFBKAPFOR-VYFWZWAVSA-N 455.580 5.009 5 20 JKBD CCN1C/C(=C/c2ccc(-c3ccc(OC)cc3[N+](=O)[O-])o2)c2nc3ccccc3c(C(=O)O)c2C1 9128916 QRIJUCMGNPRGKC-VBKFSLOCSA-N 485.496 5.486 5 20 JKBD CCOc1cc([N+](=O)[O-])c(C(=O)Nc2ccc(Br)c(C(F)(F)F)c2)cc1OC 15757222 CDMAVJNOONDUNN-UHFFFAOYSA-N 463.206 5.036 5 20 JKBD O=C(Nc1ccccc1C(=O)Nc1ccc(OC(F)F)cc1)c1ccc([N+](=O)[O-])cc1Cl 17524868 JQILWZQVZQXGBY-UHFFFAOYSA-N 461.808 5.354 5 20 JKBD COc1cc(C(=O)Nc2cc3c(cc2C(C)=O)OCO3)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 22372053 OBPAAQJSEKUIQP-UHFFFAOYSA-N 484.848 5.233 5 20 JKBD O=C(Nc1cc(Cl)ccc1OCC(F)(F)F)c1ccc(Br)c([N+](=O)[O-])c1 26495903 ACTVGGQSUKJZSQ-UHFFFAOYSA-N 453.598 5.204 5 20 JKBD COc1cc(C(=O)N2CCC[C@@H]2c2ccncc2)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 27272316 FELGCMXMXYNCKV-GOSISDBHSA-N 453.882 5.421 5 20 JKBD Cc1ccccc1-c1nnc(S[C@H](C(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)c2ccccc2)n1C 36801949 GJPPYSRELFIHFK-NRFANRHFSA-N 493.976 5.824 5 20 JKBD Cc1ccc(-c2csc(NC(=O)c3ccc(NC(=O)c4ccccc4)cc3)n2)cc1[N+](=O)[O-] 58617673 IIVLSIVHQDOJCO-UHFFFAOYSA-N 458.499 5.531 5 20 JKBD C[C@H](NC(=O)c1ccc(NC2CC2)c([N+](=O)[O-])c1)c1ccc(NC(=O)c2ccc(F)cc2)cc1 59812586 FTABRHKTZSCHNM-HNNXBMFYSA-N 462.481 5.052 5 20 JKBD O=C(NCc1ccc(COCc2ccccc2)cc1)c1ccc(Br)c([N+](=O)[O-])c1 107544616 WGLWKMMJLCXUQP-UHFFFAOYSA-N 455.308 5.004 5 20 JKBD CC(=O)Nc1ccc(C(F)(F)F)cc1NC(=O)c1ccc(N[C@@H](C)c2ccccn2)c([N+](=O)[O-])c1 109165793 PNDRVPNXFJHLJO-ZDUSSCGKSA-N 487.438 5.392 5 20 JKBD Cn1c([C@@H]2CCCCN2C(=O)CCNc2ccc(C(F)(F)F)cc2[N+](=O)[O-])nc2ccccc21 115757246 NXEOQTGHXPIRJQ-IBGZPJMESA-N 475.471 5.056 5 20 JKBD C[C@H](SC1=N/C(=C/c2ccccc2)C(=O)N1c1ccc(F)cc1)C(=O)Nc1ccc([N+](=O)[O-])cc1 207432617 HADLEJIRUAYYFJ-PZBNQXIHSA-N 490.516 5.238 5 20 JKBD O=C(Nc1ccccc1Oc1ccc(Cl)cc1)N1CCN(C(=O)c2ccc([N+](=O)[O-])s2)CC1 409822433 OYRYGWFAJMLCDA-UHFFFAOYSA-N 486.937 5.092 5 20 JKBD O=C(N[C@@H](c1ccccc1)c1ccc2c(c1)CCCO2)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-] 410037288 GSAWJODIPPMHMW-QHCPKHFHSA-N 486.446 5.380 5 20 JKBD Cc1noc(C)c1CCNC(=O)C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1 410307550 LSGHAQSIGKNGDB-QGOAFFKASA-N 462.531 5.099 5 20 JKBD Cc1ccc(C(=O)C2CCN(C(=O)c3cc([N+](=O)[O-])ccc3Sc3ccccc3)CC2)cc1 490724160 YMMWGWHKPMCVIR-UHFFFAOYSA-N 460.555 5.790 5 20 JKBD O=C(NC[C@@H]1CC2c3ccccc3C1c1ccccc12)C1CCN(c2ccccc2[N+](=O)[O-])CC1 491372455 FHKLNBAITRVNOV-QCTGCNBBSA-N 467.569 5.225 5 20 JKBD CCOc1cc(C(=O)N[C@@H](C)c2sc(-c3ccc(C)cc3)nc2C)c([N+](=O)[O-])cc1OC 502538291 BIDGYEJOBLPSHP-AWEZNQCLSA-N 455.536 5.233 5 20 JKBD Cc1ccc(N(C(=O)Cn2ccc3cc([N+](=O)[O-])ccc32)c2nc3ccccc3s2)c(C)c1 508575596 FEILFDGCLZLDMT-UHFFFAOYSA-N 456.527 6.141 5 20 JKBD CCOc1cc(C(=O)Nc2nc(-c3ccco3)c(-c3ccco3)s2)c([N+](=O)[O-])cc1OC 514517438 RXSLRBXFMLYXHA-UHFFFAOYSA-N 455.448 5.231 5 20 JKBD C[C@H](Cc1ccsc1)NC(=O)C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1 516538413 PHSSWCYUZZPLQX-CXDFQFJYSA-N 463.584 5.944 5 20 JKBD C[C@@H](NCc1ccc(Oc2ccc(F)cc2)c([N+](=O)[O-])c1)c1ccc(NC(=O)NC2CC2)cc1 517537318 PXWQVQUWFHFMMR-MRXNPFEDSA-N 464.497 5.661 5 20 JKBD Cc1ccc(C)c(Oc2ccc(CNC(=O)c3ccc(N[C@H](C)c4ccccn4)c([N+](=O)[O-])c3)cn2)c1 517575309 JERSFHQJVZCBGZ-HXUWFJFHSA-N 497.555 5.897 5 20 JKBD O=C(Nc1nc(-c2ccc(OC(F)F)cc2OC(F)F)cs1)c1c[nH]c2cc([N+](=O)[O-])ccc12 521769777 UQNNDFAQYONRBE-UHFFFAOYSA-N 496.398 5.655 5 20 JKBD CSc1ccc([N+](=O)[O-])c(C(=O)Nc2ccccc2OCc2ncc(-c3cccc(Cl)c3)o2)c1 608851291 ZSLBKJSNFDJSFK-UHFFFAOYSA-N 495.944 6.456 5 20 JKBD COCCN(C(=O)C[C@@H]1CCCc2ccccc21)c1nc(-c2ccc([N+](=O)[O-])cc2)cs1 609372093 VVZKIDIANCMTCF-IBGZPJMESA-N 451.548 5.208 5 20 JKBD CCn1c(SCC(=O)Nc2nc(-c3ccc(C)c([N+](=O)[O-])c3)cs2)nnc1-c1cccs1 619729577 WKWXXRWOLRKPFV-UHFFFAOYSA-N 486.604 5.097 5 20 JKBD CC(C)c1nnc(COC(=O)c2c3c(nc4ccccc24)/C(=C\c2ccc([N+](=O)[O-])cc2)CCC3)o1 726988015 GGOOHJOJQZCEMR-JXAWBTAJSA-N 484.512 5.883 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)O[C@@H](C)c2ccccc2NC(=O)c2ccccc2)cc1SC 728769852 KLUPYXRJQPUOSU-HNNXBMFYSA-N 466.515 5.496 5 20 JKBD O=C(Nc1cc2c(cc1[N+](=O)[O-])OCCCO2)c1sc2cc(Br)ccc2c1Cl 729825840 DASZDLSZLHPXJX-UHFFFAOYSA-N 483.727 5.639 5 20 JKBD O=C(OCC(=O)N1c2ccccc2Sc2ccc(Cl)cc21)c1ccc([N+](=O)[O-])cc1Cl 790568786 YOYPBDJSFAWJQL-UHFFFAOYSA-N 475.309 5.888 5 20 JKBD Cn1c(Cl)cnc1COC(=O)C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1 804859662 DCFCKMWOOUTUNI-GDNBJRDFSA-N 468.922 5.266 5 20 JKBD O=C(COC(=O)C1CCN(c2ccccc2[N+](=O)[O-])CC1)Nc1ccccc1Sc1ccccc1 844243467 YDNSDZCFNXUOGL-UHFFFAOYSA-N 491.569 5.144 5 20 JKBD Cc1c(NC(=O)[C@H](C)OC(=O)CCC(=O)c2ccc(-c3ccccc3)cc2)cccc1[N+](=O)[O-] 857749970 MIOYBUBEIAZULI-SFHVURJKSA-N 460.486 5.104 5 20 JKBD O=C(C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)Nn1cnc2ccccc21 900787750 IBUGYLAWILBEQJ-GHRIWEEISA-N 455.499 5.255 5 20 JKBD CC1=C(C(=O)Nc2ccccc2C)[C@@H](c2ccc(Oc3ccc(F)cc3)c([N+](=O)[O-])c2)NC(=S)N1 916191812 TUELTQNOAHASCR-HSZRJFAPSA-N 492.532 5.266 5 20 JKBD CSc1ccc(C(=O)c2ccccc2C(=O)Nc2cccc([N+](=O)[O-])c2C)cc1[N+](=O)[O-] 916702243 KPIAEQSFRBDISX-UHFFFAOYSA-N 451.460 5.017 5 20 JKBD O=C(Nc1ccccc1Oc1ccccc1Cl)[C@H]1CC(=O)N(c2ccc(F)c([N+](=O)[O-])c2)C1 918557091 AWZZJZMEIOMMFY-AWEZNQCLSA-N 469.856 5.171 5 20 JKBD CC(=O)N(c1ccc(Cl)cc1)c1nc(COC(=O)CCOc2cc(C)ccc2[N+](=O)[O-])cs1 919111604 AVMGTBJZYXIXBR-UHFFFAOYSA-N 489.937 5.210 5 20 JKBD C[C@H](OC(=O)[C@@H](C)SCc1ncc(-c2ccc(Cl)cc2)o1)C(=O)Nc1ccc([N+](=O)[O-])cc1 920671055 KNXIHNWCHAUVPP-UONOGXRCSA-N 489.937 5.095 5 20 JKBD O=C(CCc1ccsc1)Nc1ccc(C2(NC(=O)c3ccc([N+](=O)[O-])cc3F)CCC2)cc1 1788187200 NEUCCANHEFPBBS-UHFFFAOYSA-N 467.522 5.176 5 20 JKBD O=C(Cc1ccccn1)Nc1ccc(C2(NC(=O)c3cc4cc([N+](=O)[O-])ccc4s3)CCC2)cc1 1788282962 LEYUGNNBJPUOTF-UHFFFAOYSA-N 486.553 5.195 5 20 JKBD Cc1cc(O)c([N+](=O)[O-])cc1C(=O)Nc1ccc(C2(NC(=O)CCCCn3cccc3)CCC2)cc1 1790809170 FKAQGSWHHNUSAV-UHFFFAOYSA-N 490.560 5.029 5 20 JKBD COc1ccsc1C(=O)NC1(c2ccc(NC(=O)/C=C/c3ccccc3[N+](=O)[O-])cc2)CCC1 1792317295 LRIUPGUXZBBEBB-KPKJPENVSA-N 477.542 5.126 5 20 JKBD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C1(c2cccc([N+](=O)[O-])c2)CCC1)[C@@H]1CCC[C@@H]2CCCC[C@H]21 1800040813 LQNJJDDKZGPMLW-RCDFJRNUSA-N 493.648 5.261 5 20 JKBD CC(C)(C)c1ccc(C(=O)N2CCCC[C@H]2c2cc(NC(=O)c3cc(O)cc([N+](=O)[O-])c3)n[nH]2)s1 1821262473 YRRZIGKTQOUGAF-SFHVURJKSA-N 497.577 5.002 5 20 JKBD O=C(/C=C/c1ccccc1[N+](=O)[O-])Nc1cc([C@@H]2CCCCN2C(=O)c2ccc(C3CC3)cc2)[nH]n1 1823503019 HMDQDEQCXBKUPU-ZXYASIKESA-N 485.544 5.215 5 20 JKBD C[C@H](CC(=O)N1CCCC[C@@H]1c1cc(NC(=O)/C=C/c2ccccc2[N+](=O)[O-])n[nH]1)c1ccccc1 1823503407 LDUKJVZVSBKIDC-NJENJEQFSA-N 487.560 5.217 5 20 JKBD C[C@@H](CC(=O)N1CCC([C@@H]2CCCCN2C(=O)Cc2cc([N+](=O)[O-])ccc2F)CC1)c1ccccc1 1824949175 JFCMZYPKCZXUQJ-FNZWTVRRSA-N 495.595 5.090 5 20 JKBD Cc1ccc(CC(=O)N2CCC([C@@H]3CCCCN3C(=O)c3ccccc3Cl)CC2)cc1[N+](=O)[O-] 1829895445 XZKBGJLBGOEXDS-QHCPKHFHSA-N 483.996 5.033 5 20 JKBD C[C@H](CC(=O)N1CCCC[C@H]1C1CCN(C(=O)Cc2ccc([N+](=O)[O-])cc2F)CC1)c1ccccc1 1831510412 SWZPETLNHHUSQO-IBVKSMDESA-N 495.595 5.090 5 20 JKBD Cc1ccc(C(=O)N2CCCC[C@H]2C2CCN(C(=O)CCc3cccc([N+](=O)[O-])c3)CC2)c(F)c1F 1832611494 JRCNBTRZZRDEEK-QHCPKHFHSA-N 499.558 5.048 5 20 JKBD COc1cc2c(cc1NC(=O)COC(=O)c1ccc(SC)c([N+](=O)[O-])c1)oc1ccccc12 9620620 XEZJWEKZXWRYTN-UHFFFAOYSA-N 466.471 5.020 5 20 JKBD CCOc1ccc(Oc2ccccc2NC(=O)Cn2c3ccccc3c(=O)c3ccccc32)cc1 11250201 MTBYIRGETOZBET-UHFFFAOYSA-N 464.521 5.984 5 20 JKBD Cc1nc(CSc2ccc(C(=O)OCC(=O)Nc3cc([N+](=O)[O-])ccc3Cl)cc2)cs1 11698226 VCXHFCMXFSVSRH-UHFFFAOYSA-N 477.951 5.101 5 20 JKBD Cc1cc(C)c(NC(=O)CN(C)C(=O)c2ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])cc2)c(C)c1 14060646 KQIUYCAQSMBVRF-UHFFFAOYSA-N 481.936 5.676 5 20 JKBD Cc1nc2ccccc2n1CCNC(=O)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1 15135996 WWLQVGZSHGURKX-UHFFFAOYSA-N 450.882 5.129 5 20 JKBD Cc1nc2cc(NC(=O)Cc3cn(-c4ccccc4)nc3-c3ccc([N+](=O)[O-])cc3)ccc2o1 15601946 LHZUTNPLZSRCAC-UHFFFAOYSA-N 453.458 5.078 5 20 JKBD NC(=S)/C(=C\c1ccc(-c2ccc([N+](=O)[O-])cc2Br)o1)c1nc2ccccc2[nH]1 17476255 HKTMHQAKBIPXNO-GXDHUFHOSA-N 469.320 5.320 5 20 JKBD Cc1csc(Sc2ccc(C(=O)N(C)[C@@H](C)c3nc4ccccc4s3)cc2[N+](=O)[O-])n1 32341574 DDWMUHZCUHKMHV-ZDUSSCGKSA-N 470.601 5.954 5 20 JKBD O=C(C1CCN(c2ccccc2[N+](=O)[O-])CC1)N(Cc1ccccn1)c1ccc(Br)cc1 68734253 YXLDZMQJWWVDTP-UHFFFAOYSA-N 495.377 5.202 5 20 JKBD Cc1ccc2cccc(NC(=O)C3CCN(c4ccc(C(F)(F)F)cc4[N+](=O)[O-])CC3)c2n1 72091008 SXVOSLHHZBIQRL-UHFFFAOYSA-N 458.440 5.325 5 20 JKBD Cc1csc(Sc2ccc(C(=O)Nc3ccccc3-c3noc(C)n3)cc2[N+](=O)[O-])n1 107816348 XDZHVPXVSFMTLB-UHFFFAOYSA-N 453.505 5.122 5 20 JKBD CC1CCN(c2ccc([N+](=O)[O-])cc2C(=O)N(C)CCCc2cc(-c3ccccc3)no2)CC1 110094659 OUUMNLWSIGEROP-UHFFFAOYSA-N 462.550 5.191 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Cl)[C@H](c1ccccc1)N1CCC(OC2CCCCC2)CC1 497379862 ADGCLKAFTSLUGM-DEOSSOPVSA-N 471.985 5.742 5 20 JKBD CC(C)Oc1ccc(CN[C@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2ccccc2)cc1 502385009 JCNXGWUBCMZRGH-QHCPKHFHSA-N 453.926 5.505 5 20 JKBD Cc1nn(Cc2ccc(C(=O)N3CCC[C@H]3Cc3c(F)cccc3Cl)cc2)c(C)c1[N+](=O)[O-] 502406129 OANSNJLEEUYVBK-IBGZPJMESA-N 470.932 5.096 5 20 JKBD CC(=O)N(c1ccc(C(F)(F)F)cc1)c1nc(COc2cc([N+](=O)[O-])ccc2C)cs1 505877465 TUCYIXKEQJXALZ-UHFFFAOYSA-N 451.426 5.642 5 20 JKBD CCOc1cc([N+](=O)[O-])c(C(=O)Nc2cc(Cl)ccc2Oc2cccc(C)c2)cc1OC 506779479 VWDZNTYNPMBNDS-UHFFFAOYSA-N 456.882 6.009 5 20 JKBD COc1ccc([C@@H](CNC(=O)N[C@H](C)c2cccc([N+](=O)[O-])c2)c2c[nH]c3ccccc23)cc1 515840022 DNAYMKWFKDPTHC-UZUQRXQVSA-N 458.518 5.277 5 20 JKBD O=C(c1ccc(Sc2nc3ccccc3s2)c([N+](=O)[O-])c1)N(Cc1cccnc1)C1CC1 515896210 GTMNATBTWWWICS-UHFFFAOYSA-N 462.556 5.556 5 20 JKBD COc1cc(Br)c(CNCc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)cc1OC 518275854 UPBXUHWRUZETDI-UHFFFAOYSA-N 463.353 5.393 5 20 JKBD Cc1ccc(C(=O)Nc2cccc(C(F)(F)F)c2)cc1NC(=O)c1cc2c(cc1[N+](=O)[O-])OCO2 518952102 NWCRSVJRJCAXMP-UHFFFAOYSA-N 487.390 5.155 5 20 JKBD O=C(Nc1nc(-c2cc(Cl)sc2Cl)cs1)c1ccn(-c2ccc([N+](=O)[O-])cc2)n1 519137220 GIYGCMJVTBJPLJ-UHFFFAOYSA-N 466.331 5.525 5 20 JKBD Cc1cc(O[C@H](C)c2ccccc2)ccc1NC(=O)CCCn1c(=O)oc2cc([N+](=O)[O-])ccc21 524380896 CPXCLMOWIJNBBH-GOSISDBHSA-N 475.501 5.370 5 20 JKBD C[C@H]1C[C@@H](C)CN(c2ccc(C(=O)N3CCC[C@H](c4nc5ccccc5o4)C3)cc2[N+](=O)[O-])C1 603609379 MIRGWPKAVRIWJY-NSHGMRRFSA-N 462.550 5.238 5 20 JKBD CCNc1ccc(C(=O)Nc2ccc(Cl)c(C(=O)NCc3ccccc3F)c2)cc1[N+](=O)[O-] 603774632 NTHMMZGNWKWCPZ-UHFFFAOYSA-N 470.888 5.001 5 20 JKBD C[C@@H]1C[C@@H]1c1ccc(CN[C@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Br)c2ccccc2)o1 604044521 TUZKRTDILDWIMD-GHNFSYLKSA-N 484.350 5.543 5 20 JKBD Cc1ccc(C(=O)N2C[C@H](C)C[C@@H](C)C2)cc1NC(=O)[C@@H](C)Oc1ccc(Cl)cc1[N+](=O)[O-] 604443679 KJUSQDGPFWLESI-BFYDXBDKSA-N 473.957 5.081 5 20 JKBD CN(C(=O)c1cc([N+](=O)[O-])ccc1Sc1ccccc1)C1CCN(C(=O)c2ccccc2)CC1 608953029 RFTGZQIENCUZND-UHFFFAOYSA-N 475.570 5.123 5 20 JKBD Cc1ccc(C(=O)N[C@@H](CC(=O)Nc2cc([N+](=O)[O-])ccc2OC(F)F)c2ccccc2)cc1 609228475 VTTJQUMIQVTXMF-IBGZPJMESA-N 469.444 5.005 5 20 JKBD O=C(Cn1c2ccccc2c(=O)c2ccccc21)N1CCC[C@H]1c1ccc(Cl)c(Cl)c1 615897192 MHFZYZYJOKFZBH-NRFANRHFSA-N 451.353 5.825 5 20 JKBD C[C@@H](NCc1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1)c1ccc(N2CCOC2=O)cc1 725848255 OAQIYKKPVOYMDL-MRXNPFEDSA-N 467.909 5.848 5 20 JKBD Cc1cccc2[nH]cc(CC(=O)O[C@H](C(=O)Nc3ccc([N+](=O)[O-])cc3Cl)c3ccccc3)c12 729011044 CGNZQGUSZLUURY-DEOSSOPVSA-N 477.904 5.504 5 20 JKBD CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccc(NC(=O)CN2CCCCCCC2)cc1 729040227 MUVQMCXNSMSJNH-UHFFFAOYSA-N 481.597 5.242 5 20 JKBD Cc1cc(C(=O)COC(=O)c2csc(-c3ccc([N+](=O)[O-])cc3)n2)c(C)n1Cc1ccccc1 747958396 JWRCNLPTMXPSEC-UHFFFAOYSA-N 475.526 5.225 5 20 JKBD Cc1ccc(N2C(=O)CC[C@H](C(=O)N[C@@H](C)c3cccc([N+](=O)[O-])c3)[C@@H]2c2cccs2)cc1 917699615 DETJJXNQUJENPK-CODAWKSHSA-N 463.559 5.326 5 20 JKBD C[C@@H](N[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1)c1cccc([N+](=O)[O-])c1 917939537 VOPDOZCLVPDBJM-SZNDQCEHSA-N 454.870 5.187 5 20 JKBD O=C(OCC(=O)N1CCC[C@@H]1c1ccc(Cl)c(Cl)c1)c1cc2cc([N+](=O)[O-])ccc2o1 919213491 LKABGWHPZFVHRR-QGZVFWFLSA-N 463.273 5.168 5 20 JKBD C[C@@H](OC(=O)c1[nH]c2ccc(F)cc2c1Cl)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 919424092 HXPQGHNAPXYFSH-MRVPVSSYSA-N 473.766 5.071 5 20 JKBD Cc1ccc(-c2noc([C@@H](C)OC(=O)c3ccc(N[C@@H](C)c4ccccn4)c([N+](=O)[O-])c3)n2)cc1F 920549186 WFKRQRHKWBEVAZ-JKSUJKDBSA-N 491.479 5.578 5 20 JKBD O=C(Cc1ccc(Cl)cc1[N+](=O)[O-])NC1(c2ccc(NC(=O)c3ccc(Cl)nc3)cc2)CCC1 1785756067 ZBFRLADNDTXPBW-UHFFFAOYSA-N 499.354 5.287 5 20 JKBD O=C(COc1ccccc1)Nc1ccc(C2(NC(=O)Cc3ccc(Cl)cc3[N+](=O)[O-])CCC2)cc1 1787721806 OFTGEVDKNOJIRS-UHFFFAOYSA-N 493.947 5.004 5 20 JKBD O=C(NC1(c2ccc(NC(=O)c3cc4cc(F)ccc4[nH]3)cc2)CCC1)c1cc(F)cc([N+](=O)[O-])c1 1789236124 YBYVNUMLPANMBS-UHFFFAOYSA-N 490.466 5.416 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)[C@H]3C[C@@H]3C3CC3)CCC2)cc1)c1cc(Br)ccc1[N+](=O)[O-] 1790663923 MNWHALXYSRURJT-MOPGFXCFSA-N 498.377 5.151 5 20 JKBD C/C(=C\c1ccc(C)o1)C(=O)NC1(c2ccc(NC(=O)c3cccc(F)c3[N+](=O)[O-])cc2)CCC1 1790701075 LPFZSKBQUDPQIK-FOCLMDBBSA-N 477.492 5.487 5 20 JKBD O=C(NC1(c2ccc(NC(=O)C3CC4(CCC4)C3)cc2)CCC1)c1cccc(F)c1[N+](=O)[O-] 1792039762 FDBWLWWFPWCRTD-UHFFFAOYSA-N 451.498 5.062 5 20 JKBD COc1cc(C(=O)Nc2ccc(C3(NC(=O)c4cccc5ncccc45)CCC3)cc2)ccc1[N+](=O)[O-] 1792164658 MHDSSUWZOLMXCX-UHFFFAOYSA-N 496.523 5.213 5 20 JKBD COc1cc(C(=O)Nc2ccc(C3(NC(=O)[C@H]4C[C@H]4c4ccccc4)CCC3)cc2)ccc1[N+](=O)[O-] 1792165409 JTABKLBHDZCVFG-GOTSBHOMSA-N 485.540 5.155 5 20 JKBD CC(C)(C)c1ccc(C(=O)N2CCC([C@H]3CCCCN3C(=O)/C=C/c3ccc([N+](=O)[O-])o3)CC2)s1 1824275732 BTGAPDXKBNAZMV-WUTDNEBXSA-N 499.633 5.494 5 20 JKBD O=C([C@@H]1CCC[C@@H]2CCCC[C@@H]21)N1CCC([C@H]2CCCCN2C(=O)/C=C/c2ccc([N+](=O)[O-])o2)CC1 1824277098 PWOVFIIZVSYCNB-FWKUDUHDSA-N 497.636 5.427 5 20 JKBD O=C(c1cccc(F)c1)N1CCCC[C@@H]1C1CCN(C(=O)C2(c3cccc([N+](=O)[O-])c3)CCC2)CC1 1829963063 QHHYQYSMBLDWBX-RUZDIDTESA-N 493.579 5.089 5 20 JKBD Cc1ccc(/C=C/C(=O)N2CCC([C@H]3CCCCN3C(=O)c3cccc(F)c3[N+](=O)[O-])CC2)s1 1830622079 CCYRZGBATDJOFQ-NELJVSICSA-N 485.581 5.051 5 20 JKBD O=C(c1ccc([N+](=O)[O-])o1)N1CCC([C@H]2CCCCN2C(=O)c2cc(Cl)c(F)c(Cl)c2)CC1 1830730472 HNFPWDAYPAYMOU-QGZVFWFLSA-N 498.338 5.181 5 20 JKBD O=C(COC(=O)[C@H](Sc1ccccc1)c1ccccc1)Nc1ccc([N+](=O)[O-])cc1Cl 10588817 JFBZDVGGSKYVEZ-OAQYLSRUSA-N 456.907 5.264 5 20 JKBD O=C(CSc1ccc(C(F)(F)F)cc1[N+](=O)[O-])N1CCC(c2nc3ccccc3s2)CC1 15620212 STTLOJNGVZPPSU-UHFFFAOYSA-N 481.521 5.722 5 20 JKBD COc1ccc(NC(=O)[C@@H](C)Sc2nnc(-c3ccccc3)n2-c2ccc(F)cc2)c([N+](=O)[O-])c1 15813611 GHLGNHTVFFFOMS-OAHLLOKOSA-N 493.520 5.110 5 20 JKBD Cc1ccc(Cn2nc(C)c(C(=O)Nc3nc(-c4ccc(C)c([N+](=O)[O-])c4)cs3)c2Cl)cc1 105355081 NLUHGLBENZKYKL-UHFFFAOYSA-N 481.965 5.794 5 20 JKBD COc1ccc2[nH]cc(C3CCN(C(=O)Cn4c5ccccc5c(=O)c5ccccc54)CC3)c2c1 108867664 BHAVPWPNLOJFMY-UHFFFAOYSA-N 465.553 5.051 5 20 JKBD COc1cc(C(=O)Nc2ccc(Cl)c(C(N)=O)c2)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 115635069 XQYASUDJSABCAO-UHFFFAOYSA-N 476.272 5.054 5 20 JKBD Cc1ccc(NC(=O)C2CC2)cc1NC(=O)c1ccc(NCc2ccccc2Cl)c([N+](=O)[O-])c1 481975546 SAIAFQVIMPPLJS-UHFFFAOYSA-N 478.936 5.770 5 20 JKBD C[C@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)N[C@H](C)c1cccc(NC(=O)Cc2ccccc2F)c1 483238472 KICFRBBIAOYJKD-SJORKVTESA-N 481.549 5.273 5 20 JKBD C[C@H]1CCCN(c2ccc(C(=O)NCc3cn(-c4ccccc4)nc3-c3ccncc3)cc2[N+](=O)[O-])C1 489936188 QKOAOGIIYIXXHX-FQEVSTJZSA-N 496.571 5.009 5 20 JKBD CCOc1ccc([C@H](C)NC(=O)c2ccc(N[C@H](C)c3ccccn3)c([N+](=O)[O-])c2)cc1OC 506244441 AUIRTCVJNMVNLX-DLBZAZTESA-N 464.522 5.061 5 20 JKBD CCOC(=O)c1c(NC(=O)Cn2c3ccccc3c(=O)c3ccccc32)sc2ccccc12 506782629 RDORRNMLXSNJHR-UHFFFAOYSA-N 456.523 5.185 5 20 JKBD CC[C@H]1CCc2nc(NC(=O)c3ccc(N[C@H](C)c4ccccn4)c([N+](=O)[O-])c3)sc2C1 507401245 IOXGARQCCYXPOP-CABCVRRESA-N 451.552 5.387 5 20 JKBD Cc1sc(NC(=O)C2CCC(NC(=O)CC3CCCC3)CC2)nc1-c1cccc([N+](=O)[O-])c1 508946197 HCCMDXPLOQCBPO-UHFFFAOYSA-N 470.595 5.221 5 20 JKBD COc1ccc([C@@H](NC(=O)c2cc(OCC(F)(F)F)ccc2[N+](=O)[O-])c2ccc(F)cc2)cc1 512754340 QQVKHTSPQWZVJU-NRFANRHFSA-N 478.398 5.203 5 20 JKBD O=[N+]([O-])c1cc(Cl)ccc1Oc1ccc(CNCc2cccc(CN3CCOCC3)c2)cc1 513110005 IVQYNKPJWOYUIU-UHFFFAOYSA-N 467.953 5.163 5 20 JKBD O=C(Cc1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1)Nc1ccccc1N1CCCC1 513842447 IFXFOXPANFKQNL-UHFFFAOYSA-N 467.529 5.229 5 20 JKBD CN(C(=O)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1)c1ccc(Br)cn1 515678545 IXAKDLFKPLDKOC-UHFFFAOYSA-N 462.687 5.475 5 20 JKBD Cc1ccc(NC(=O)c2ccc(N3C[C@H](C)C[C@@H](C)C3)c([N+](=O)[O-])c2)cc1NC(=O)c1ccncc1 521393142 WFDSHQORPCFHKO-QZTJIDSGSA-N 487.560 5.285 5 20 JKBD O=C(Nc1ccc(Oc2ccccc2)cc1C(F)(F)F)c1cc([N+](=O)[O-])cc2c1OCCO2 524168514 GOWXHTYCLKLHNY-UHFFFAOYSA-N 460.364 5.429 5 20 JKBD Cc1cnn([C@H]2CCCc3ccccc32)c1NC(=O)c1ccc(N[C@H](C)c2ccccn2)c([N+](=O)[O-])c1 524378346 PEGIFPUZQBUFAU-CLOONOSVSA-N 496.571 5.846 5 20 JKBD O=C(C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)Nc1ccc(NC(=O)C2CC2)cc1 590693323 YOXFFGGMBVQUTN-XDJHFCHBSA-N 498.564 6.122 5 20 JKBD COc1cc([C@H](C)NC(=O)C2CCN(c3ccccc3[N+](=O)[O-])CC2)ccc1OCc1ccccc1 603986685 NONGYVXXVXLCKK-FQEVSTJZSA-N 489.572 5.276 5 20 JKBD O=[N+]([O-])c1ccc(CS(=O)(=O)N[C@H](c2ccccc2)c2ccc(Cl)c(Cl)c2)cc1 604042056 KAZUQPXCKQMSJL-HXUWFJFHSA-N 451.331 5.111 5 20 JKBD C[C@@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccc(C(=O)Nc2cccnc2)c(Cl)c1 608874310 BRSWLDORCBRAOH-CYBMUJFWSA-N 456.911 5.015 5 20 JKBD O=C(c1ccccc1Sc1ccc(C(F)(F)F)cc1[N+](=O)[O-])N1CCC[C@H](n2ccnc2)C1 609131524 RKYQPKWCPRYKIC-INIZCTEOSA-N 476.480 5.439 5 20 JKBD Cc1ccc(-c2nc(C)c([C@@H](C)N[C@H](C)C(=O)Nc3ccc([N+](=O)[O-])cc3Cl)s2)cc1 609352754 BYOCCDYRRMHDOQ-UKRRQHHQSA-N 458.971 5.666 5 20 JKBD CC(C)(C)c1cc(NC(=O)Cn2c3ccccc3c(=O)c3ccccc32)n(Cc2ccccc2)n1 641894052 GPBYYQZHZARXAT-UHFFFAOYSA-N 464.569 5.336 5 20 JKBD COc1cc(C(=O)Nc2cc(C(F)(F)F)ccc2NC(=O)OC(C)(C)C)c([N+](=O)[O-])cc1OC 727790774 RDIQUGOLOLHLLM-UHFFFAOYSA-N 485.415 5.230 5 20 JKBD CC(C)Oc1ccc([N+](=O)[O-])cc1CSc1nnc(-c2ccncc2)n1Cc1ccccc1 729152698 MYUITTSOPOBHMB-UHFFFAOYSA-N 461.547 5.376 5 20 JKBD O=C(c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1)N1CCC(c2nnc(S)n2C2CC2)CC1 729256205 MQYZUOQWVIWJLM-UHFFFAOYSA-N 499.980 5.275 5 20 JKBD O=C(Nc1cc(Cl)c([N+](=O)[O-])cc1OCc1ccccc1)c1ccc(Cl)nc1Cl 747627638 LEYVSKOQVPTEOQ-UHFFFAOYSA-N 452.681 5.781 5 20 JKBD CC1=C(C(=O)Nc2cccc([N+](=O)[O-])c2)[C@@H](c2ccc3ncccc3c2)NC(=O)N1Cc1cccs1 840195894 FOJSFKYYBWTDII-XMMPIXPASA-N 499.552 5.384 5 20 JKBD Cc1c(NC(=O)[C@@H](C)OC(=O)c2csc(-c3ccc(C(C)C)cc3)n2)cccc1[N+](=O)[O-] 900266503 FXSAUBYCTWUZSR-OAHLLOKOSA-N 453.520 5.334 5 20 JKBD COc1ccc(CSCc2nc(-c3cccc(Cn4cnc5ccccc54)c3)no2)cc1[N+](=O)[O-] 904489147 BRUSILABYGWRSA-UHFFFAOYSA-N 487.541 5.485 5 20 JKBD C[C@H](OC(=O)c1ccc2c(c1)Cc1ccccc1-2)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 915401600 YQKLMULAZRNXSP-ZDUSSCGKSA-N 470.403 5.369 5 20 JKBD O=C(Nc1ccc(OC(=O)c2cc(OCC(F)(F)F)ccc2[N+](=O)[O-])cc1)c1cccs1 916958689 RMFLWCJHZGAPEJ-UHFFFAOYSA-N 466.393 5.069 5 20 JKBD CC(=O)N(c1ccc(Cl)cc1)c1nc(COC(=O)c2ccc(Cl)c([N+](=O)[O-])c2)cs1 918849334 IZHBNFFHRZOXDX-UHFFFAOYSA-N 466.302 5.400 5 20 JKBD Cc1cc(C(=O)Nc2ccc(C3(NC(=O)c4ccc([N+](=O)[O-])o4)CCC3)cc2)c(C(F)(F)F)o1 1787397481 JWPNFVIWRSSOFT-UHFFFAOYSA-N 477.395 5.170 5 20 JKBD O=C(CSc1ccccc1[N+](=O)[O-])Nc1ccc(C2(NC(=O)CC3CCCC3)CCC2)cc1 1791521530 RSQADHNKGPAYQJ-UHFFFAOYSA-N 467.591 5.401 5 20 JKBD Cc1ccc2cc(C(=O)N[C@@H]3C[C@@H]4CC[C@H](C3)N4C(=O)CSc3ccccc3[N+](=O)[O-])sc2c1 1802183517 HPLBUHNOCIDIGR-REPLKXPHSA-N 495.626 5.162 5 20 JKBD Cc1ccc(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)c3cccc(F)c3[N+](=O)[O-])[nH]n2)c(Cl)c1 1823186989 UIHJIWFJDKQUCY-IBGZPJMESA-N 485.903 5.039 5 20 JKBD CC(C)c1ccc(C(=O)N2CCC([C@@H]3CCCCN3C(=O)Cc3cccc([N+](=O)[O-])c3)CC2)cc1 1823679378 CZERIGRYAYWWOB-SANMLTNESA-N 477.605 5.194 5 20 JKBD C[C@@H]1CCC[C@H]1C(=O)N1CCC([C@@H]2CCCCN2C(=O)C2(c3cccc([N+](=O)[O-])c3)CCC2)CC1 1830293232 WVVBIWGOGLJLQV-ZPZUNKDASA-N 481.637 5.072 5 20 JKBD O=C(CCc1ccoc1)N1CCC([C@H]2CCCCN2C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)CC1 1831061726 JKUFRIFIQBHINI-JOCHJYFZSA-N 495.601 5.269 5 20 JKBD O=C(/C=C/c1ccsc1)N1CCC([C@@H]2CCCCN2C(=O)CSc2ccccc2[N+](=O)[O-])CC1 1831775252 JFNNOJFPBLKANR-SHBDEGQCSA-N 499.658 5.082 5 20 JKBD Cc1cc(CCCC(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)CC2CCC(C)(C)CC2)c([N+](=O)[O-])cc1F 1847716665 PHBIEXDLJVFDFU-GOTSBHOMSA-N 487.616 5.173 5 20 JKBD Cc1ccc(-c2nnc([C@@H](C)OC(=O)c3ccc(Sc4nc(C)cs4)c([N+](=O)[O-])c3)o2)cc1 17715750 AZBCGAUJXDKJQQ-CQSZACIVSA-N 482.543 5.787 5 20 JKBD Cc1cc([N+](=O)[O-])ccc1NC(=O)CCSc1nnc(-c2ccccc2F)n1Cc1ccccc1 26231896 NEPHDQUAJMJPKL-UHFFFAOYSA-N 491.548 5.470 5 20 JKBD Cc1csc(Sc2ccc(C(=O)N(Cc3ccco3)Cc3ccco3)cc2[N+](=O)[O-])n1 30471818 PNDMENCDFIVASI-UHFFFAOYSA-N 455.517 5.540 5 20 JKBD C[C@H](Nc1ccc(NC(=O)c2ccc(Cl)cc2)cc1)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl 72030799 MODXKNHNNPEEQS-ZDUSSCGKSA-N 473.316 5.593 5 20 JKBD C[C@H](Nc1ccc(C(=O)N2CCC(CCc3ccccc3)CC2)cc1[N+](=O)[O-])c1ccccn1 108786027 MSYNMXPWHQWURJ-FQEVSTJZSA-N 458.562 5.648 5 20 JKBD Cc1nc(COc2ccc(F)cc2)sc1C(=O)N(Cc1ccccc1[N+](=O)[O-])CC(F)(F)F 195557859 PKDWCPOSRZCNEB-UHFFFAOYSA-N 483.443 5.283 5 20 JKBD COc1ccc(NC(=O)c2cc3c(C)nn(Cc4ccc(Cl)cc4)c3s2)c([N+](=O)[O-])c1 480973508 CDLBEVRQRIPDNV-UHFFFAOYSA-N 456.911 5.277 5 20 JKBD C[C@H]1Cc2cc([N+](=O)[O-])ccc2N1C(=O)c1ccc(NC(=O)c2ccc(Br)cc2)cc1 504300092 TXFGVADESQZGSD-AWEZNQCLSA-N 480.318 5.201 5 20 JKBD O=C(Nc1cccc(CNCc2ccc(Oc3ccccc3Cl)c([N+](=O)[O-])c2)c1)c1ccccn1 509578356 GIMNVKZZYZKVKV-UHFFFAOYSA-N 488.931 5.978 5 20 JKBD O=C(c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-])N1CCC(c2nc3ccccc3s2)CC1 514428461 XAHCHPSZIGCLGB-UHFFFAOYSA-N 465.453 5.165 5 20 JKBD CC(C)n1ncc2c(C(=O)Nc3cc([N+](=O)[O-])ccc3OC(F)F)cc(-c3ccccc3)nc21 514501897 GMSCFADKZFMSIL-UHFFFAOYSA-N 467.432 5.441 5 20 JKBD CC(=O)Nc1cc(NC(=O)c2ccc(Sc3nc4ccccc4s3)c([N+](=O)[O-])c2)ccc1Cl 517988011 CVLWBFYOUVVMDK-UHFFFAOYSA-N 498.973 6.220 5 20 JKBD COc1ccc(-c2ccc(CN[C@H](C)c3cccc(NC(=O)c4ccccc4)c3)o2)c([N+](=O)[O-])c1 521816323 UZKCOIJLXZXNEI-GOSISDBHSA-N 471.513 5.967 5 20 JKBD CSc1ccc(C(=O)c2ccccc2C(=O)Nc2cc(-c3ccncc3)ccc2C)cc1[N+](=O)[O-] 522396722 QMFHHQRDRQVXAI-UHFFFAOYSA-N 483.549 6.170 5 20 JKBD O=C(c1ccccc1)C1CCN(C(=O)Cc2cn(-c3ccccc3)nc2-c2ccc([N+](=O)[O-])cc2)CC1 590892107 WSZKFFKXRJSEGQ-UHFFFAOYSA-N 494.551 5.112 5 20 JKBD CCC(=O)Nc1ccc(C)c(NC(=O)c2cc([N+](=O)[O-])ccc2Sc2ccc(Cl)cc2)c1 603758476 ZUTKGUMUKIYKGW-UHFFFAOYSA-N 469.950 6.309 5 20 JKBD CC(C)CCSc1ccc(C(=O)N(C)C[C@@H]2CCCO[C@H]2c2ccccc2)cc1[N+](=O)[O-] 604519186 RCNPWOPRMCZRMO-URXFXBBRSA-N 456.608 5.973 5 20 JKBD Cn1ccnc1[C@H](NCc1ccc(-c2ccc([N+](=O)[O-])cc2Br)o1)c1ccccc1 608835595 AZPOWGRARPVHGC-OAQYLSRUSA-N 467.323 5.230 5 20 JKBD COc1ccc(NC(=O)c2ccc(Sc3nc(C)cs3)c([N+](=O)[O-])c2)c(Br)c1 608900656 NZXAIYQTOCWGGW-UHFFFAOYSA-N 480.365 5.534 5 20 JKBD O=C(c1cc2ccccc2c2cccnc12)N1CCN(Cc2nc(-c3ccc(Cl)cc3)no2)CC1 612168416 KLCZYDAUASXDPJ-UHFFFAOYSA-N 483.959 5.049 5 20 JKBD CCN(C(=O)c1cc([N+](=O)[O-])c(C)c([N+](=O)[O-])c1)[C@H]1CCSc2ccc(Br)cc21 728844669 ABNXKTLSHSPWNX-HNNXBMFYSA-N 480.340 5.273 5 20 JKBD CC[C@@H](C)Sc1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2I)c(C)c1 748194813 KWJNWYHKNODSRZ-GFCCVEGCSA-N 470.332 5.651 5 20 JKBD Cc1ccccc1[C@@H](OC(=O)c1ccc(Sc2nncn2C)c([N+](=O)[O-])c1)c1cccs1 748502652 ICFYEYLMODGYNK-HXUWFJFHSA-N 466.544 5.191 5 20 JKBD CCCCCN(C(=O)c1cc([N+](=O)[O-])ccc1Br)c1nc(C)c(C(=O)OCC)s1 751072468 ABEHNOVXUKIZFI-UHFFFAOYSA-N 484.372 5.136 5 20 JKBD O=C(Nc1cccc(-c2cccs2)c1)c1cc([N+](=O)[O-])ccc1I 751201343 LWVDADIFLGGLFT-UHFFFAOYSA-N 450.257 5.180 5 20 JKBD O=C(Nc1ccccc1C(=O)OCc1cc(-c2ccc(F)cc2)no1)c1ccc([N+](=O)[O-])cc1Cl 915376893 LUMWJZKMOMFBDP-UHFFFAOYSA-N 495.850 5.652 5 20 JKBD O=C(Nc1cccc(COc2ccccc2)c1)c1cc([N+](=O)[O-])ccc1I 917856484 PVOADQPRCXMUNY-UHFFFAOYSA-N 474.254 5.031 5 20 JKBD O=C(C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)NCc1cccnc1-n1ccnc1 918043362 SFNNKQGGNWLLJO-ZHZULCJRSA-N 496.552 5.032 5 20 JKBD CN(C(=O)c1cc(-c2ccncc2)nc2ccc(Br)cc12)c1ccc([N+](=O)[O-])cc1 919991208 WXUXSNTUOXQVHJ-UHFFFAOYSA-N 463.291 5.244 5 20 JKBD COc1cn(-c2ccccc2)nc1C(=O)Nc1cc(Cl)c([N+](=O)[O-])cc1OCc1ccccc1 921190836 JNKWATRAWYNIMD-UHFFFAOYSA-N 478.892 5.274 5 20 JKBD O=C(Cc1ccc(Cl)cc1[N+](=O)[O-])Nc1ccc(C2(NC(=O)c3ccc(Cl)o3)CCC2)cc1 1786116477 NBCIJZJSTUZTEF-UHFFFAOYSA-N 488.327 5.485 5 20 JKBD Cc1cc(O)c([N+](=O)[O-])cc1C(=O)NC1(c2ccc(NC(=O)C(C)(C)C(C)(F)F)cc2)CCC1 1786455042 YMPRDRIDZGWCOO-UHFFFAOYSA-N 475.492 5.038 5 20 JKBD Cc1ccc(C(=O)Nc2ccc(C3(NC(=O)c4ccc(Br)c([N+](=O)[O-])c4)CCC3)cc2)o1 1786493984 PQFFZCDPQNKFKH-UHFFFAOYSA-N 498.333 5.320 5 20 JKBD CC1=CC[C@H](C(=O)Nc2ccc(C3(NC(=O)Cn4ccc5ccc([N+](=O)[O-])cc54)CCC3)cc2)CC1 1789111027 XGTQEFWJCKKMOA-NRFANRHFSA-N 486.572 5.430 5 20 JKBD COCc1c[nH]c(C(=O)Nc2ccc(C3(NC(=O)c4cc(Cl)cc([N+](=O)[O-])c4C)CCC3)cc2)c1 1790039628 MKGRMCLPVAHOSB-UHFFFAOYSA-N 496.951 5.093 5 20 JKBD CN(C)c1ccc([N+](=O)[O-])c(C(=O)Nc2ccc(C3(NC(=O)c4cccc5ccoc45)CCC3)cc2)c1 1790056180 IEWZOARXEIEWNM-UHFFFAOYSA-N 498.539 5.469 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)C34CCC(CC3)CC4)CCC2)cc1)c1nc2cc([N+](=O)[O-])ccc2[nH]1 1790827294 CNVFPSJNANKHJL-UHFFFAOYSA-N 487.560 5.189 5 20 JKBD CC(C)c1cc(C(=O)NC2(c3ccc(NC(=O)/C=C/c4ccccc4[N+](=O)[O-])cc3)CCC2)on1 1792317223 CPGZBMFAXTXZHX-MDWZMJQESA-N 474.517 5.167 5 20 JKBD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)Cc1cccc([N+](=O)[O-])c1)c1ccc(-c2ccc(Cl)cc2)o1 1792473614 QVJARRSXEAGPLT-WKCHPHFGSA-N 493.947 5.003 5 20 JKBD Cc1c(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)c3ccc([N+](=O)[O-])cc3F)n[nH]2)oc2ccccc12 1821054375 KLKRBINLIOVYJT-HXUWFJFHSA-N 491.479 5.131 5 20 JKBD O=C(CCc1cccc([N+](=O)[O-])c1)N1CCC([C@H]2CCCCN2C(=O)c2ccccc2Cl)CC1 1829892001 BSHRDQOOANEHBK-XMMPIXPASA-N 483.996 5.114 5 20 JKBD Cc1ccncc1C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)CC1 1831061504 TWWSRJSIGMYEKG-QFIPXVFZSA-N 492.601 5.060 5 20 JKBD CC(C)CCC(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cccc([N+](=O)[O-])c2Br)CC1 1831382532 OKWRMFCRAUXPBB-LJQANCHMSA-N 494.430 5.027 5 20 JKBD CC(C)(C)c1cc(C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)/C=C/c2ccc([N+](=O)[O-])o2)cc(C(C)(C)C)c1 1847656350 SEXQBZLDFNSEAO-DXVFKNEASA-N 493.604 5.312 5 20 JKBD Cc1ccc(Cn2c(SCC(=O)Nc3ccc([N+](=O)[O-])cc3Cl)nc3ccccc3c2=O)cc1 8954214 RUVCTGAHDIHVSW-UHFFFAOYSA-N 494.960 5.046 5 20 JKBD Cc1nc(S[C@@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2C(F)(F)F)[nH]c1Cc1ccccc1 9946703 ZWXLLRLXZAKFCN-ZDUSSCGKSA-N 464.469 5.355 5 20 JKBD C[C@@H](OC(=O)c1ccc(NCc2ccccc2)c([N+](=O)[O-])c1)C(=O)Nc1ccccc1C(F)(F)F 16748769 CJKWYKLWESEENA-OAHLLOKOSA-N 487.434 5.410 5 20 JKBD C[C@H](OC(=O)c1ccc2c(c1)C[C@@H](c1ccccc1)OC2=O)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 17899409 TWPWDMLZHMUXBK-NYHFZMIOSA-N 485.452 5.017 5 20 JKBD Cc1nc(-c2cccc(Cl)c2)sc1C(=O)O[C@H](C)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 17956183 MDHGZTGBZODPJT-GFCCVEGCSA-N 470.894 5.648 5 20 JKBD Cc1c(-c2ccccc2)sc(NC(=O)COc2ccccc2[N+](=O)[O-])c1C(=O)N1CCCCC1 21900877 VOKMACAYAJWVFD-UHFFFAOYSA-N 479.558 5.275 5 20 JKBD Cc1c(NC(=O)[C@H](C)Sc2nnc(-c3ccccc3)n2-c2ccc(F)cc2)cccc1[N+](=O)[O-] 23209080 GAFAHDWZBJJTAQ-INIZCTEOSA-N 477.521 5.409 5 20 JKBD O=C(CCc1nc(-c2cccs2)no1)Oc1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2Cl)cc1 29475962 LBCLIBUDCHBUBR-UHFFFAOYSA-N 498.904 5.150 5 20 JKBD CCOc1ccc(-c2noc(CCC(=O)Nc3nc(-c4ccc(C)c([N+](=O)[O-])c4)cs3)n2)cc1 69573581 SGCVQSZNYHXSCB-UHFFFAOYSA-N 479.518 5.047 5 20 JKBD COc1ccc(-c2nc(CC(=O)Nc3nc(-c4ccc(C)c([N+](=O)[O-])c4)cs3)cs2)cc1OC 105352655 VPZCIBHFRPUQPQ-UHFFFAOYSA-N 496.570 5.349 5 20 JKBD C[C@@H](NC(=O)c1cccc(NS(=O)(=O)c2cc(Cl)ccc2Cl)c1)c1cccc([N+](=O)[O-])c1 108456859 MYKQZPSUJSPDHK-CYBMUJFWSA-N 494.356 5.193 5 20 JKBD COc1cc(C(=O)Nc2nnc(-c3ccco3)s2)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 491313051 RXFAYGVIVKWNNY-UHFFFAOYSA-N 472.866 5.413 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Cl)[C@H](c1ccccc1)N1CCO[C@@H](c2ccc(F)cc2)C1 492483730 AHXIMDJPWGBEAI-PKTZIBPZSA-N 469.900 5.141 5 20 JKBD C[C@@H](Sc1nc2cc3ccccc3cc2c(=O)n1C)c1nc(O)c2c(-c3ccccc3)csc2n1 495389562 NUMFNYVDRXHCSX-OAHLLOKOSA-N 496.617 6.317 5 20 JKBD CC(=O)N(c1ccc(C)cc1)c1nc(/C=C\c2nc3cc([N+](=O)[O-])ccc3n2-c2ccccc2)cs1 515598241 KIDYOTSRYOZOIC-GDNBJRDFSA-N 495.564 6.554 5 20 JKBD CN(C)c1ccc(C(=O)c2ccccc2C(=O)Nc2cccc(COCc3ccco3)c2)cc1[N+](=O)[O-] 516524392 IMGKFWIQCCSNBP-UHFFFAOYSA-N 499.523 5.454 5 20 JKBD Cc1ncsc1CNC(=O)c1ccccc1Sc1ccc(C(F)(F)F)cc1[N+](=O)[O-] 517079885 JWOBJQHJIXLXSM-UHFFFAOYSA-N 453.467 5.460 5 20 JKBD COc1ccc([C@@H](NCc2ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])cc2)c2nccn2C)cc1 518770538 OXLGDRLIUGNUEZ-XMMPIXPASA-N 478.936 5.662 5 20 JKBD CSc1ccc(C(=O)N2c3ccccc3CC[C@@H]2C(=O)Nc2ccccc2C)cc1[N+](=O)[O-] 524228656 TXQKQIOITJBLMJ-OAQYLSRUSA-N 461.543 5.225 5 20 JKBD O=C(C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)N1CCC[C@@H](c2ncc[nH]2)C1 524340004 KTAFLZSOZDNARG-GXYBQNOFSA-N 473.558 5.265 5 20 JKBD Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)c1cccc(NC(=O)Cc2ccc(Br)cc2)c1 603637433 FXFYSCUEGSUOBT-UHFFFAOYSA-N 482.334 5.408 5 20 JKBD COc1cc([C@@H](C)Nc2ccc(C(=O)NC3CC3)cc2[N+](=O)[O-])ccc1OCc1ccccc1 603870675 VAFRMMJFYLSNMY-QGZVFWFLSA-N 461.518 5.248 5 20 JKBD Cc1sc(NC(=O)c2cn(-c3ccccc3)nc2-c2cccnc2)nc1-c1cccc([N+](=O)[O-])c1 603997568 OKLWJIOOMLWTLB-UHFFFAOYSA-N 482.525 5.527 5 20 JKBD C[C@@H](NCc1ccc(Oc2ccccc2Cl)c([N+](=O)[O-])c1)c1nc2ccccc2n1C(F)F 609006527 KEUUUBWHQOJGPH-CQSZACIVSA-N 472.879 6.636 5 20 JKBD Cc1nn(-c2ccccc2)cc1C(=O)O[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1 726678762 FRKHEWJTBNRYBL-QHCPKHFHSA-N 490.903 5.279 5 20 JKBD C[C@H](Oc1ccccc1Cc1ccccc1)C(=O)O[C@@H](C)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 728352032 WGAGZJDOOHGLNN-ROUUACIJSA-N 473.485 5.307 5 20 JKBD Cc1cc(/C=C\C(=O)O[C@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)c(C)n1C1CCCCC1 746212453 XGBKBBHMLJPASD-DEQJRXDXSA-N 464.522 5.886 5 20 JKBD C[C@H](OC(=O)CSCc1ccc(Br)cc1F)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 747937272 IMAAHMXVRJAWHO-NSHDSACASA-N 496.314 5.084 5 20 JKBD C[C@H](SCc1nc(O)c2c(-c3ccccc3)csc2n1)C(=O)Nc1cc([N+](=O)[O-])ccc1F 767217037 UYSCOFPHTBGRAB-LBPRGKRZSA-N 484.534 5.372 5 20 JKBD O=C(C[C@@H](NC(=O)c1ccccc1Cl)c1ccccc1)Nc1ccc(Cl)c([N+](=O)[O-])c1 916695490 PULUGVDUYOLHGH-LJQANCHMSA-N 458.301 5.402 5 20 JKBD C[C@@H](OC(=O)c1cc([N+](=O)[O-])ccc1Oc1ccccc1)C(=O)Nc1ccc(F)cc1Cl 919192780 OJURXEHZJVDUID-CYBMUJFWSA-N 458.829 5.364 5 20 JKBD CC(C)c1ccc(NC(=O)COC(=O)c2ccc(N[C@H](C)c3ccccn3)c([N+](=O)[O-])c2)cc1 920545717 IOQGEYIFODVLQL-QGZVFWFLSA-N 462.506 5.082 5 20 JKBD O=C(Nc1ccccc1C(=O)NCc1cc2ccccc2s1)c1ccc([N+](=O)[O-])cc1Cl 920747027 OGJODXORNCESPA-UHFFFAOYSA-N 465.918 5.645 5 20 JKBD Cc1ccc(NC(=O)[C@H](OC(=O)c2cc(C)nc3onc(C(C)C)c23)c2ccccc2)c([N+](=O)[O-])c1 920897518 ZZNVMNFUHXYIGM-HSZRJFAPSA-N 488.500 5.408 5 20 JKBD O=C(CCc1cccc([N+](=O)[O-])c1)Nc1ccc(C2(NC(=O)CSC3CCCC3)CCC2)cc1 1786599119 MCXYSBYTFNLBSG-UHFFFAOYSA-N 481.618 5.337 5 20 JKBD O=C(NC1(c2ccc(NC(=O)c3scnc3C3CC3)cc2)CCC1)c1ccc([N+](=O)[O-])cc1F 1787186217 ABEUNHXSFVQWOZ-UHFFFAOYSA-N 480.521 5.129 5 20 JKBD Cc1ncc(/C=C/C(=O)Nc2ccc(C3(NC(=O)c4c(F)ccc([N+](=O)[O-])c4C)CCC3)cc2)s1 1791959013 PNSJHMOKQDWQGP-DHZHZOJOSA-N 494.548 5.268 5 20 JKBD O=C(CCCCCCCCc1ccccc1)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc([N+](=O)[O-])[nH]1 1799480906 AONLGZHCQVKMDT-NUNAXRQHSA-N 480.609 5.148 5 20 JKBD CC1(C)CCC(CC(=O)Nc2cc([C@H]3CCCCN3C(=O)c3ccc([N+](=O)[O-])cc3F)[nH]n2)CC1 1820978926 UXEOQUBVFNVTPS-OAQYLSRUSA-N 485.560 5.369 5 20 JKBD Cc1ccc(C(=O)N2CCCC[C@H]2C2CCN(C(=O)Cc3cccc([N+](=O)[O-])c3)CC2)cc1Cl 1823906550 YYRINCBLCXQIGO-DEOSSOPVSA-N 483.996 5.033 5 20 JKBD C[C@@H](Sc1ccccc1)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cc(F)cc([N+](=O)[O-])c2)CC1 1824393150 YCCVTUDQXQCJGR-HOYKHHGWSA-N 499.608 5.148 5 20 JKBD CC(C)c1csc(C(=O)N2CCCC[C@H]2C2CCN(C(=O)/C=C/c3ccccc3[N+](=O)[O-])CC2)n1 1825385821 NWRFCAWQSXFGKR-NEQMZLFVSA-N 496.633 5.121 5 20 JKBD Cc1oc(C(C)(C)C)cc1C(=O)N1CCCC[C@@H]1C1CCN(C(=O)Cc2cccc([N+](=O)[O-])c2)CC1 1825946766 CJYXMFXFFJZDCA-XMMPIXPASA-N 495.620 5.270 5 20 JKBD O=C(Cc1cccc([N+](=O)[O-])c1)N1CCC([C@@H]2CCCCN2C(=O)[C@@H]2CCC[C@@H]3CCCC[C@H]32)CC1 1828455355 AAEQRBVXVGAIRN-FDBFMKMFSA-N 495.664 5.364 5 20 JKBD C[C@@H](CC(=O)N1CCC([C@@H]2CCCCN2C(=O)c2ccc([N+](=O)[O-])cc2F)CC1)c1ccccc1 1830498462 WEXPUIBGNKNGPE-DFBJGRDBSA-N 481.568 5.161 5 20 JKBD CC1(C)CC(C(=O)N2CCC([C@H]3CCCCN3C(=O)c3cc4cc([N+](=O)[O-])ccc4s3)CC2)C1 1831062407 SYNDCTWEFDXTTE-OAQYLSRUSA-N 483.634 5.479 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)N1CCC([C@H]2CCCCN2C(=O)[C@H]2CC[C@H](C)CC2)CC1 1832372635 CPVSUHLKRQMMJL-HCLVMJGWSA-N 473.589 5.102 5 20 JKBD C[C@@H](C(=O)N1CCCC[C@H]1C1CCN(C(=O)CSc2ccccc2[N+](=O)[O-])CC1)c1ccccc1 1832897618 GJIKNMSIYIJZDX-OFNKIYASSA-N 495.645 5.110 5 20 JKBD O=C(Cn1c2ccccc2c(=O)c2ccccc21)OCc1ccc(C(=O)Nc2ccccc2)cc1 11497410 ARSZHTTXDCZSMH-UHFFFAOYSA-N 462.505 5.150 5 20 JKBD CC(C)n1c(SCC(=O)N2CCc3cc([N+](=O)[O-])ccc32)nnc1-c1ccc(Cl)cc1Cl 17230897 FWXGWJQXADZEEA-UHFFFAOYSA-N 492.388 5.422 5 20 JKBD COc1ccc2cc(/C=C/C(=O)O[C@H](C)C(=O)Nc3ccc([N+](=O)[O-])cc3C(F)(F)F)ccc2c1 18019597 KKTUAVCNFGHQOQ-LZTOIUFZSA-N 488.418 5.359 5 20 JKBD CCc1ccccc1-n1c(SCc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)nc2ccccc2c1=O 18811678 NEDZNSYZMSUYOT-UHFFFAOYSA-N 485.525 5.199 5 20 JKBD Cc1ccc(-n2c(S[C@@H](C)c3nnc(-c4ccc([N+](=O)[O-])cc4)o3)nnc2N2CCCCC2)cc1 19420909 QBFOGQGSKOGTQZ-KRWDZBQOSA-N 491.577 5.378 5 20 JKBD COc1cc(C(=O)N(Cc2cccnc2)C2CC2)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 32335973 OZUYOJLBWPMIEV-UHFFFAOYSA-N 453.882 5.249 5 20 JKBD O=C(Cc1csc(-c2ccc(Cl)cc2Cl)n1)Nc1cc([N+](=O)[O-])ccc1OC(F)F 302983245 KVALFIKOSPIHML-UHFFFAOYSA-N 474.272 5.808 5 20 JKBD CCOc1cc(C(=O)N[C@@H](c2cccc(C(F)(F)F)c2)C(C)(C)C)c([N+](=O)[O-])cc1OC 303135373 JKQVIXBBMSDINR-IBGZPJMESA-N 454.445 5.538 5 20 JKBD COc1ccc([C@H](CNC(=O)c2cc(SC)c(OC)cc2[N+](=O)[O-])c2c[nH]c3ccccc23)cc1 484933396 JKTJYVXICSKDDV-FQEVSTJZSA-N 491.569 5.377 5 20 JKBD C[C@H]1C[C@H](C)CN(c2ccc(C(=O)Nc3ccc(N(C)C)cc3C(F)(F)F)cc2[N+](=O)[O-])C1 485293115 ZOAFZIQFJLBPHI-GJZGRUSLSA-N 464.488 5.414 5 20 JKBD Cc1cc(Br)cc(C)c1NC(=O)c1ccc(Cn2nc(C)c([N+](=O)[O-])c2C)cc1 500094944 DLQCVPNSUAKALI-UHFFFAOYSA-N 457.328 5.088 5 20 JKBD O=C(NC[C@@H]1CCCO1)c1cccc(CNCc2ccc(Oc3ccccc3Cl)c([N+](=O)[O-])c2)c1 509572583 XQPZXBQWSPAPJO-NRFANRHFSA-N 495.963 5.239 5 20 JKBD COc1ccc([C@@H](NC(=O)Cn2c3ccccc3c(=O)c3ccccc32)c2ccc(F)cc2)cc1 512122723 MEJSAGSXYUOSNT-NDEPHWFRSA-N 466.512 5.208 5 20 JKBD O=C(Cn1cc([N+](=O)[O-])cn1)Nc1nc(-c2ccccc2Cl)c(-c2ccccc2Cl)s1 516462399 UCPAEQUJZIVMJT-UHFFFAOYSA-N 474.329 5.527 5 20 JKBD COc1ccc2c(c1)CCCN(C(=O)C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc3ccccc3s1)C2 524155742 VOSIZJVOBZSLKH-JCMHNJIXSA-N 499.592 6.119 5 20 JKBD CN(C(=O)c1ccc(NCc2nc(-c3cccc([N+](=O)[O-])c3)no2)cc1Cl)C1CCCCC1 604009378 HUAGIBPNVXLWLU-UHFFFAOYSA-N 469.929 5.315 5 20 JKBD NC(=O)c1ccc(SCC(=O)N(Cc2ccc(Cl)cc2)c2ccccc2Cl)c([N+](=O)[O-])c1 604019344 YRNOJOVQRDCXPA-UHFFFAOYSA-N 490.368 5.326 5 20 JKBD CCCCNC(=O)c1ccc(CNCc2ccc(-c3ccc([N+](=O)[O-])cc3Br)o2)cc1 608836581 VTIRDKCRTNOPNT-UHFFFAOYSA-N 486.366 5.437 5 20 JKBD CCN(C(=O)c1ccc(N2CCCC2)c([N+](=O)[O-])c1)[C@@H](c1cccnc1)c1ccc(F)c(C)c1 609155762 UYXJVEPVXYKEEJ-RUZDIDTESA-N 462.525 5.289 5 20 JKBD CC(C)(C)c1csc(CNCc2ccc(-c3ccc([N+](=O)[O-])cc3Br)o2)n1 609223735 QYKPTQVZLKBHBP-UHFFFAOYSA-N 450.358 5.661 5 20 JKBD CS(=O)(=O)Nc1ccccc1NC(=O)CCC(=O)c1ccc2ccc3cccc4ccc1c2c34 727754030 BDXCBHHRONJSLQ-UHFFFAOYSA-N 470.550 5.557 5 20 JKBD O=C(COC(=O)[C@H]1C[C@H]1c1cccc2ccccc12)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 730876525 POOSKQQGMRSOTP-ROUUACIJSA-N 458.392 5.052 5 20 JKBD CC(C)N(Cc1nnc(-c2cccc([N+](=O)[O-])c2)o1)C(=O)CCCc1ccc2c(c1)-c1ccccc1C2 747369507 BTVICLWAKSFTOO-UHFFFAOYSA-N 496.567 5.976 5 20 JKBD COc1cccc(NC(=O)c2ccccc2NC(=O)c2csc(-c3cccc([N+](=O)[O-])c3)n2)c1 747622737 RMZAOROGMHIXSS-UHFFFAOYSA-N 474.498 5.232 5 20 JKBD O=C(Nc1ccc(-n2cncn2)c(Cl)c1)c1cc([N+](=O)[O-])ccc1Sc1ccccc1 749142177 JPRCEANMCZYJPW-UHFFFAOYSA-N 451.895 5.232 5 20 JKBD COc1c([N+](=O)[O-])cc(NCc2ccc(Oc3ccccc3)nc2)c([N+](=O)[O-])c1Br 749441539 ARQUSNJLXXMOHS-UHFFFAOYSA-N 475.255 5.074 5 20 JKBD CCOc1cc([N+](=O)[O-])c(C(=O)Nc2ccccc2C(=O)Nc2ccc(Cl)cc2)cc1OC 798124671 GQYZRWYLBMHZEJ-UHFFFAOYSA-N 469.881 5.160 5 20 JKBD CC(C)N(Cc1nnc(-c2cccc([N+](=O)[O-])c2)o1)C(=O)[C@@H](C)Oc1cccc(Cl)c1Cl 915276481 TUUUQVSPPCDPHB-CYBMUJFWSA-N 479.320 5.156 5 20 JKBD COc1ccc(Oc2ccc([N+](=O)[O-])cc2C(=O)OCc2csc(-c3ccccn3)n2)cc1 915442130 NLJPSCQXOCONOF-UHFFFAOYSA-N 463.471 5.271 5 20 JKBD CCCc1cc[n+](/C(C(=S)Nc2cccc(C(C)C)c2)=C(/O)c2ccc([N+](=O)[O-])cc2)cc1 917615929 VDSFWFTXJAJVKU-UHFFFAOYSA-O 462.595 6.282 5 20 JKBD O=C(CCCCn1cccc1)Nc1ccc(C2(NC(=O)Cc3cc([N+](=O)[O-])ccc3F)CCC2)cc1 1789601551 WAJWRFVRZLFINE-UHFFFAOYSA-N 492.551 5.083 5 20 JKBD Cc1cc2[nH]c(C(=O)Nc3ccc(C4(NC(=O)c5ccc([N+](=O)[O-])o5)CCC4)cc3)cc2s1 1790876268 FHLBYNLGKWHWDS-UHFFFAOYSA-N 464.503 5.101 5 20 JKBD C[C@H](Cc1ccncc1)C(=O)Nc1ccc(C2(NC(=O)/C=C/c3ccccc3[N+](=O)[O-])CCC2)cc1 1791039025 BUQCCFICLWJGFG-ACGJQVIASA-N 484.556 5.016 5 20 JKBD CN(C)c1ccc([N+](=O)[O-])c(C(=O)NC2(c3ccc(NC(=O)C[C@H]4C[C@@H]5CC[C@H]4C5)cc3)CCC2)c1 1791322854 BANSRXWYUWLXDK-HSALFYBXSA-N 490.604 5.235 5 20 JKBD CC(C)(C)CCCCCC(=O)NC[C@@H]1CCN(C(=O)c2cccc(F)c2[N+](=O)[O-])[C@H]1c1cccnc1 1812809557 STVHYNCJQMVLPY-RDPSFJRHSA-N 498.599 5.445 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)N1CCCC[C@H]1c1cc(NC(=O)C[C@@H](C)c2ccccc2)n[nH]1 1822045944 QTIMNLBEFWJCPM-ZHRRBRCNSA-N 493.539 5.265 5 20 JKBD O=C(CCc1cccc([N+](=O)[O-])c1)N1CCC([C@H]2CCCCN2C(=O)c2cc3ccsc3[nH]2)CC1 1830882387 FDWRTKSLNBCUBO-HSZRJFAPSA-N 494.617 5.004 5 20 JKBD COc1cc(C(=O)N2CCC([C@H]3CCCCN3C(=O)C[C@H](C)c3ccccc3)CC2)ccc1[N+](=O)[O-] 1831510262 LDNBPGZAWXFGQR-GBXCKJPGSA-N 493.604 5.031 5 20 JKBD CC(C)Cn1c(S[C@H](C)C(=O)Nc2nc(-c3cccc([N+](=O)[O-])c3)cs2)nnc1-c1ccco1 9566589 KTEKKNQDDBBITK-CQSZACIVSA-N 498.590 5.345 5 20 JKBD O=C(COC(=O)c1sc2ccccc2c1Cl)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 12311371 QTNCMUQBGUGXSD-UHFFFAOYSA-N 458.801 5.277 5 20 JKBD Cc1sc(NC(=O)Cn2c3ccccc3c(=O)c3ccccc32)nc1-c1ccc(OC(F)F)cc1 24504983 AGBHXLUZZVMKSF-UHFFFAOYSA-N 491.519 5.827 5 20 JKBD Cc1c(NC(=O)[C@@H](C)OC(=O)c2cc(-c3ccccc3)nc3c2cnn3C(C)C)cccc1[N+](=O)[O-] 25361021 JTQSDLUSFLGQNX-QGZVFWFLSA-N 487.516 5.080 5 20 JKBD Cc1ccc(Cc2cnc(NC(=O)c3cc(OCC(F)(F)F)ccc3[N+](=O)[O-])s2)cc1Cl 107796016 JIFCBZCJYHKOLG-UHFFFAOYSA-N 485.871 5.797 5 20 JKBD O=C(CSc1nnc(-c2ccc(Cl)cc2)n1Cc1ccco1)c1ccc([N+](=O)[O-])cc1 108045400 VBHQWWPECALMPZ-UHFFFAOYSA-N 454.895 5.123 5 20 JKBD COc1ccccc1-c1csc(NC(=O)c2ccc(N[C@H](C)c3ccccn3)c([N+](=O)[O-])c2)n1 195609372 LMRKYSSGYXIBQW-OAHLLOKOSA-N 475.530 5.547 5 20 JKBD O=C(Nc1cccc(Cl)c1-n1cncn1)c1ccc(NCc2ccccc2Cl)c([N+](=O)[O-])c1 477489710 JPVZLUWKKVLXNZ-UHFFFAOYSA-N 483.315 5.347 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)Nc2cc(Br)ccc2Br)cc1SC 482690384 ILRPDOCHYSGITI-UHFFFAOYSA-N 476.146 5.103 5 20 JKBD O=C(Nc1cccc(C(=O)N2CCSCC2)c1)c1cc([N+](=O)[O-])ccc1Sc1ccccc1 494149833 SUVCAVAUXVDZAM-UHFFFAOYSA-N 479.583 5.187 5 20 JKBD Cc1ccc(N(C(=O)c2ccc(S(C)(=O)=O)c([N+](=O)[O-])c2)c2nc3ccccc3s2)c(C)c1 508572939 WCVQQXADYOQTAB-UHFFFAOYSA-N 481.555 5.203 5 20 JKBD C[C@@H](Cc1ccc(Br)cc1)NC(=O)c1ccc(N[C@H](C)c2ccccn2)c([N+](=O)[O-])c1 508840930 FXHWYJDLSFYJGM-JKSUJKDBSA-N 483.366 5.286 5 20 JKBD O=C(NCc1ccco1)c1cccc(CNCc2ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])cc2)c1 513070839 RIDBDQLMBDROCR-UHFFFAOYSA-N 491.931 5.853 5 20 JKBD CCCOc1cc(NC(=O)c2cccc(C)c2I)c([N+](=O)[O-])cc1OCCC 515211063 BZASSCAZNLXBPQ-UHFFFAOYSA-N 498.317 5.338 5 20 JKBD Cc1cccc(COc2ccc([C@H](C)Nc3ccc(C(=O)N4CCOCC4)cc3[N+](=O)[O-])cc2)c1 517093052 RXTQSKQEVXAMCW-FQEVSTJZSA-N 475.545 5.128 5 20 JKBD COc1cc(C(=O)N[C@H](Cc2ccccc2Cl)c2ccccc2)c([N+](=O)[O-])cc1OC(F)F 519876913 JGBCKCCQQTTZNH-GOSISDBHSA-N 476.863 5.572 5 20 JKBD CS(=O)(=O)c1ccc(C(=O)Nc2ccc(Oc3ccccc3C(F)(F)F)cc2)cc1[N+](=O)[O-] 519993635 DQSILRIWNCYTLK-UHFFFAOYSA-N 480.420 5.062 5 20 JKBD CCN(C(=O)Cn1c2ccccc2c(=O)c2ccccc21)[C@@H](c1cccnc1)c1ccc(F)c(C)c1 521453926 NZJLMXBZLIWXBC-GDLZYMKVSA-N 479.555 5.635 5 20 JKBD CCCCN(C(=O)c1ccc(N[C@@H](C)c2ccccn2)c([N+](=O)[O-])c1)C1CC(C)(C)NC(C)(C)C1 521453950 PEWMMASQOMHKIK-IBGZPJMESA-N 481.641 5.714 5 20 JKBD CCOC(=O)C[C@@H](c1ccccc1)C1CCN(C(=O)Nc2cc([N+](=O)[O-])ccc2OC(F)F)CC1 603831064 ZLLGBEQDBMIASD-IBGZPJMESA-N 491.491 5.177 5 20 JKBD COc1cc2c(cc1OC)[C@H](c1ccccc1)N(C(=O)N[C@H](C)c1cccc([N+](=O)[O-])c1)CC2 604126755 VFHXVANGMNQOGZ-NSYGIPOTSA-N 461.518 5.030 5 20 JKBD C[C@@H](NC(=O)C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)c1ccc2nc(O)[nH]c2c1 604244097 UHPVXZHOVJPKLP-PWDRBQJJSA-N 499.552 5.595 5 20 JKBD O=C(c1ccccc1Sc1ccc(C(F)(F)F)cc1[N+](=O)[O-])N1CCN(c2ccncc2)CC1 604514742 XANBJWSIJKROOL-UHFFFAOYSA-N 488.491 5.122 5 20 JKBD O=C(c1ccc(Nc2ccccc2)c([N+](=O)[O-])c1)N1CCC(c2nc(-c3ccccc3)no2)CC1 609141716 HMUWREPNSCCLGW-UHFFFAOYSA-N 469.501 5.408 5 20 JKBD Cc1ccc(C)c(C(=O)c2ccccc2C(=O)O[C@@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)c1 746114837 WQKRXFSYWMMFLX-KRWDZBQOSA-N 471.469 5.411 5 20 JKBD O=C(O[C@@H](C(=O)Nc1ccc(F)cc1)c1ccccc1)c1csc(-c2cccc([N+](=O)[O-])c2)n1 747962397 ONEHZCNJNHQYQS-OAQYLSRUSA-N 477.473 5.394 5 20 JKBD O=C(c1cc([N+](=O)[O-])ccc1Br)N1CCC(c2nc3cc(Cl)ccc3s2)CC1 751072529 ARHMEOZAIMPFEQ-UHFFFAOYSA-N 480.771 5.640 5 20 JKBD O=C(C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)OCc1nnc(-c2ccco2)o1 804858517 BUYZBOLOMXOKOM-VBKFSLOCSA-N 488.481 5.522 5 20 JKBD CCc1nnc(COC(=O)c2c3c(nc4ccccc24)/C(=C/c2cccc([N+](=O)[O-])c2)CCC3)o1 808706419 JQWQMSGHSQGFMA-GHRIWEEISA-N 470.485 5.322 5 20 JKBD Cc1nc(-c2ccc(C(F)(F)F)cc2)sc1C(=O)OCC(=O)c1cccc([N+](=O)[O-])c1 825349034 MQOQQULBHQUFNA-UHFFFAOYSA-N 450.394 5.085 5 20 JKBD O=[N+]([O-])c1ccc(-c2nc(-c3nc(-c4cccc(OCc5cccnc5)c4)no3)cs2)cc1 904500458 MBHARSDDIASAFI-UHFFFAOYSA-N 457.471 5.409 5 20 JKBD O=C(Cn1ncc2ccc([N+](=O)[O-])cc21)NC[C@H](c1ccccc1Cl)c1c[nH]c2ccccc12 915287322 FGSFRBQTKFPQPI-HXUWFJFHSA-N 473.920 5.028 5 20 JKBD O=C(Nc1ccccc1SC(F)F)N1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 915318978 AXBQOXRCAAICFB-UHFFFAOYSA-N 476.427 5.282 5 20 JKBD CC(C)Sc1ccc(C(=O)O[C@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2C(F)(F)F)cc1 919503132 SAYHORVXNSQFFW-GFCCVEGCSA-N 456.442 5.298 5 20 JKBD CCOC(=O)c1c(NC(=O)c2cc(OC)c(OC)cc2[N+](=O)[O-])sc(C)c1-c1ccc(C)cc1 920096650 PPGFUAYBHFVLDL-UHFFFAOYSA-N 484.530 5.386 5 20 JKBD C[C@@H](Nc1ccc(C(=O)OCC(=O)Nc2ccc3ccccc3c2)cc1[N+](=O)[O-])c1ccccn1 920544607 DGKONLLGMPHFND-QGZVFWFLSA-N 470.485 5.112 5 20 JKBD CC(C)OCc1cccc(NC(=O)c2ccccc2NC(=O)c2ccc([N+](=O)[O-])cc2Cl)c1 920749083 UZABVVKKCMQFMG-UHFFFAOYSA-N 467.909 5.678 5 20 JKBD C[C@@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)OCc1ccc(C(=O)Nc2ccccc2)cc1 920779477 XPXOVUGXSHZYAX-OAHLLOKOSA-N 454.866 5.011 5 20 JKBD O=C(Cn1ccc2ccc([N+](=O)[O-])cc21)NC1(c2ccc(NC(=O)c3sccc3F)cc2)CCC1 1786519517 WYNWEJMIJWTHAX-UHFFFAOYSA-N 492.532 5.198 5 20 JKBD O=C(CSc1ccccc1[N+](=O)[O-])Nc1ccc(C2(NC(=O)c3cnoc3C3CC3)CCC2)cc1 1791521551 VRGMCPPBPXBJPW-UHFFFAOYSA-N 492.557 5.000 5 20 JKBD CC(C)[C@H](C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2ccc([N+](=O)[O-])cc2F)[nH]n1)c1ccccc1 1814932103 WGLZIFLUZRXWPB-VWNXMTODSA-N 493.539 5.203 5 20 JKBD CC1(C(=O)Nc2cc([C@H]3CCCCN3C(=O)Cc3ccc(Cl)cc3[N+](=O)[O-])[nH]n2)CCCCC1 1822330095 WVYZZEFVTIKDFY-LJQANCHMSA-N 487.988 5.177 5 20 JKBD O=C(Cc1ccc(Cl)cc1[N+](=O)[O-])N1CCC([C@H]2CCCCN2C(=O)/C=C/c2ccccc2)CC1 1826527804 WMKIYIORPFBMQD-XJCKULRNSA-N 496.007 5.124 5 20 JKBD O=C(N1CCCC[C@H]1C1CCN(C(=O)C2(c3cccc([N+](=O)[O-])c3)CCC2)CC1)C1(F)CCCCC1 1828411727 KYKRQILTXYRSHW-DEOSSOPVSA-N 499.627 5.309 5 20 JKBD Cc1cccc(C(=O)N2CCC([C@@H]3CCCCN3C(=O)c3cc4cc([N+](=O)[O-])ccc4s3)CC2)n1 1831060356 UJDACTSKYGLIHA-QFIPXVFZSA-N 492.601 5.060 5 20 JKBD CC/C=C(\C)C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)CC1 1832520314 OOVUDTVUCBDLMO-PKWFBFISSA-N 469.607 5.399 5 20 JKBD COc1cc(C(=O)OCC(=O)Nc2cc(F)ccc2F)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 21998204 NRIYJRGYAOUMKU-UHFFFAOYSA-N 492.818 5.123 5 20 JKBD O=C(CCSc1nnc(-c2ccc(Cl)cc2)n1Cc1ccco1)Nc1ccc([N+](=O)[O-])cc1 26369747 OTBRUETYGJUWDC-UHFFFAOYSA-N 483.937 5.269 5 20 JKBD CSc1ccc(C(=O)c2ccccc2C(=O)N2CCC(c3ccccc3)CC2)cc1[N+](=O)[O-] 32367377 DONZCNRLDWQTIF-UHFFFAOYSA-N 460.555 5.568 5 20 JKBD COc1ccccc1-c1csc(NC(=O)c2cc([N+](=O)[O-])ccc2N2CCC(C)CC2)n1 71892271 KKXRSALIADUZBI-UHFFFAOYSA-N 452.536 5.216 5 20 JKBD C[C@@H](Nc1ccc(C(=O)Nc2ccc3c(c2)nc2n3CCCCC2)cc1[N+](=O)[O-])c1ccccn1 195602602 QWUHWCXBQQZYQD-QGZVFWFLSA-N 470.533 5.491 5 20 JKBD Cc1csc(Sc2ccc(C(=O)N(CC(F)(F)F)c3nc(C)cs3)cc2[N+](=O)[O-])n1 195644762 VSOUFDGRHHWQOT-UHFFFAOYSA-N 474.511 5.485 5 20 JKBD Cc1nn(Cc2ccc(C(=O)Nc3c(C)c(C(C)(C)C)nn3-c3ccccc3)cc2)c(C)c1[N+](=O)[O-] 410000786 DGYJBEIANKZVLP-UHFFFAOYSA-N 486.576 5.500 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)Nc2ccc(Cl)cc2C(=O)N2[C@H](C)CCC[C@H]2C)cc1SC 482823400 ZMOQOHCZSWLMQE-ZIAGYGMSSA-N 491.997 5.634 5 20 JKBD O=C(Cn1c2ccccc2c(=O)c2ccccc21)N[C@@H](c1ccccc1)c1cccc(Cl)c1 501447860 FTRJENKZDGOIHD-MHZLTWQESA-N 452.941 5.714 5 20 JKBD O=C(Nc1nc(-c2ccc(OCc3ccccc3)cc2)cs1)c1ccc(-n2cncn2)c([N+](=O)[O-])c1 505094257 NACKFADDKUCKHR-UHFFFAOYSA-N 498.524 5.130 5 20 JKBD COc1ccc(Oc2ccc([N+](=O)[O-])cc2C(=O)N(C)CCCc2cc(-c3ccccc3)no2)cc1 505392666 WROYXCWSCABLDJ-UHFFFAOYSA-N 487.512 5.756 5 20 JKBD COc1cc(CN[C@H](c2ccc3c(c2)OCCO3)C2CC2)ccc1OCc1ccc([N+](=O)[O-])cc1 507936242 AZNOCYZTMVOFHK-MHZLTWQESA-N 476.529 5.195 5 20 JKBD C[C@@H](NC(=O)Nc1ccc(NC(=O)c2ccoc2)cc1C(F)(F)F)c1cccc([N+](=O)[O-])c1 510344531 WXDVGMUEXRNKRP-GFCCVEGCSA-N 462.384 5.342 5 20 JKBD O=C(Cc1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1)Nc1ccc(NC2CCOCC2)cc1 513068056 FSWGISVPQQDVSC-UHFFFAOYSA-N 497.555 5.220 5 20 JKBD CSc1ccc(C(=O)N[C@@H](C)c2cccc(NC(=O)Cc3ccccc3F)c2)cc1[N+](=O)[O-] 515161873 PHSATAFXXVBUQO-HNNXBMFYSA-N 467.522 5.128 5 20 JKBD O=C(C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)N[C@@H]1CCN(Cc2ccccc2)C1 515360169 HJDKHAYJRWHYTM-YTMAHBJJSA-N 498.608 5.526 5 20 JKBD COCCN(C(=O)CSCc1cccc(Cl)c1)c1nc(-c2ccc([N+](=O)[O-])cc2)cs1 516070540 SMQKUQGDVYURTD-UHFFFAOYSA-N 477.995 5.285 5 20 JKBD O=C(CCn1ncc(=O)c2ccccc21)Nc1cc([N+](=O)[O-])ccc1Nc1cccc(C(F)(F)F)c1 516461343 UQBPBTHBUFDSJV-UHFFFAOYSA-N 497.433 5.096 5 20 JKBD Cc1ccc(C(N)=O)cc1NC(=O)c1ccccc1Sc1ccc(C(F)(F)F)cc1[N+](=O)[O-] 520916728 GRYJYRVARQIDMH-UHFFFAOYSA-N 475.448 5.424 5 20 JKBD C[C@@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)N(Cc1cccnc1)c1ccc(Br)cc1 521250044 LDWFBDQXSRBONP-CQSZACIVSA-N 490.741 5.406 5 20 JKBD O=C(NC1CCCCC1)C1CCN(C(=O)c2ccc(NCc3ccccc3Cl)c([N+](=O)[O-])c2)CC1 521548938 WKLYTQUSVKQEFD-UHFFFAOYSA-N 499.011 5.161 5 20 JKBD Cc1csc(Sc2ccc(C(=O)N[C@H](c3nc(-c4cccnc4)no3)C(C)C)cc2[N+](=O)[O-])n1 522503991 AXRQSRXRTLHGQQ-SFHVURJKSA-N 496.574 5.083 5 20 JKBD O=C(NC1C[C@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1)c1ccc(NCc2ccccc2)c([N+](=O)[O-])c1 603576264 FGHFNUJJFKDZFF-HZPDHXFCSA-N 489.416 5.846 5 20 JKBD COc1cccc(/C=C(\CC(=O)NCc2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)c1 603999211 QVCDBFUMEBVRIN-CPNJWEJPSA-N 459.527 5.460 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Cl)[C@@H](NCc1cc(F)cc(Br)c1)c1ccccc1 604047444 RBUSJVJQQUFOSC-FQEVSTJZSA-N 492.732 5.619 5 20 JKBD C[C@H](Nc1ccc(C(=O)NCc2cccc(OCc3ccccn3)c2)cc1[N+](=O)[O-])c1ccccn1 604309113 POKYXXFMMWMINT-IBGZPJMESA-N 483.528 5.067 5 20 JKBD CC[C@H](C)Sc1ccc(NC(=O)[C@H]2CCCN2C(=O)c2ccc([N+](=O)[O-])c(C)c2)c(C)c1 608806139 OBHOPPGUGOQCRS-HTAPYJJXSA-N 455.580 5.346 5 20 JKBD C[C@H](C[C@@H]1CCCO1)NC(=O)c1ccccc1Sc1ccc(C(F)(F)F)cc1[N+](=O)[O-] 608820651 ZFWPVQQHRLHVRG-HIFRSBDPSA-N 454.470 5.452 5 20 JKBD COc1cc(/C=C\C(=O)O[C@H](C)c2cccc([N+](=O)[O-])c2)ccc1OCc1c(C)noc1C 729475314 RCCZYMVOFNFSDA-HGPCXVNDSA-N 452.463 5.105 5 20 JKBD O=C(OCc1cc([N+](=O)[O-])cc2c1OCOC2)c1ccc(COc2ccc3ccccc3c2)o1 768685465 DKUSKTYVVOIVSS-UHFFFAOYSA-N 461.426 5.144 5 20 JKBD CSc1ccc([N+](=O)[O-])c(C(=O)Nc2nc(Cc3ccc(Br)cc3)cs2)c1 917711112 FHXXLSKUQGLOPG-UHFFFAOYSA-N 464.366 5.379 5 20 JKBD COCCn1cc(C(=O)Oc2ccc(NC(=O)c3cc([N+](=O)[O-])ccc3Cl)cc2)c2ccccc21 920033461 PZCJSARRYATFPU-UHFFFAOYSA-N 493.903 5.321 5 20 JKBD Cc1cc(Cl)ccc1C(=O)NC1(c2ccc(NC(=O)c3ccc([N+](=O)[O-])o3)cc2)CCC1 1785748806 RVYPBKBXADOUTN-UHFFFAOYSA-N 453.882 5.211 5 20 JKBD O=C(NC1(c2ccc(NC(=O)[C@@H]3CC3(F)F)cc2)CCC1)c1cc2cc([N+](=O)[O-])ccc2s1 1789135990 QRKZIDSSYVXZLK-KRWDZBQOSA-N 471.485 5.212 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)c3cc4ccccc4o3)CCC2)cc1)c1ccc(O)c([N+](=O)[O-])c1 1790619624 HUIKMTCFMPXTSJ-UHFFFAOYSA-N 471.469 5.108 5 20 JKBD CC(C)(C)c1ccc(C(=O)N2CCC3(CCCN(C(=O)/C=C/c4ccc([N+](=O)[O-])o4)C3)CC2)s1 1805681409 HRRVYSYBOQNKMZ-WEVVVXLNSA-N 485.606 5.105 5 20 JKBD O=C(CCc1cccc([N+](=O)[O-])c1)Nc1cc([C@@H]2CCCCN2C(=O)c2cccc3ccoc23)[nH]n1 1815538846 ZNQWBXOHOFCZCT-QFIPXVFZSA-N 487.516 5.003 5 20 JKBD C[C@H]1CC[C@H](C(=O)Nc2cc([C@@H]3CCCCN3C(=O)Cc3ccc(Cl)cc3[N+](=O)[O-])[nH]n2)CC1 1822939993 LXAXNSATINTZAQ-FTRWYGJKSA-N 487.988 5.032 5 20 JKBD Cc1c(C(=O)O[C@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2C(F)(F)F)sc2cccc(F)c12 17150538 ZXNUAODSZHMEPY-SNVBAGLBSA-N 470.400 5.460 5 20 JKBD Cc1ccc(C(=O)c2ccccc2C(=O)O[C@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)cc1 17528478 BRVHMXFAABKMFB-MRXNPFEDSA-N 457.442 5.102 5 20 JKBD O=C(CSc1nnc(COc2ccccc2Cl)n1-c1ccccc1)Nc1ccccc1[N+](=O)[O-] 21469202 BWFNPSFJDPSIQP-UHFFFAOYSA-N 495.948 5.139 5 20 JKBD COc1cc([C@@H](C)N[C@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2ccccc2)ccc1OC(C)C 30454847 NCOFBYUBEVYILZ-NSYGIPOTSA-N 497.979 6.075 5 20 JKBD O=C(c1ccc(NCc2ccccc2Cl)c([N+](=O)[O-])c1)N1CCC(OC2CCCC2)CC1 116425190 NQHFQAHYWBUKGZ-UHFFFAOYSA-N 457.958 5.424 5 20 JKBD Cc1cc(C(=O)Nc2ccc(NC(=O)c3ccccc3F)cc2C(F)(F)F)cc([N+](=O)[O-])c1 195692096 CYFYGMGYXMBUAH-UHFFFAOYSA-N 461.371 5.566 5 20 JKBD Cc1sc(NC(=O)c2csc(-c3cccc([N+](=O)[O-])c3)n2)nc1-c1cccc([N+](=O)[O-])c1 215726135 RELPZKKYJKOSTR-UHFFFAOYSA-N 467.488 5.311 5 20 JKBD COc1cc(C(=O)NC[C@H]2CCCO[C@H]2c2ccccc2)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 409572631 CMHOTTCLUVZBHH-CLOONOSVSA-N 496.947 5.947 5 20 JKBD O=C1CCc2cc([N+](=O)[O-])c(Sc3nnc(Cc4cccs4)n3CCc3ccccc3)cc2N1 506800887 VWDYJKQSPSYBIM-UHFFFAOYSA-N 491.598 5.117 5 20 JKBD CCOc1cc(Br)c(NC(=O)c2ccc(SC)c([N+](=O)[O-])c2)cc1OCC 508053324 INSQRMPHVPNTKS-UHFFFAOYSA-N 455.330 5.129 5 20 JKBD COCCN(C(=O)c1ccc(Sc2ccccn2)cc1)c1nc(-c2ccc([N+](=O)[O-])cc2)cs1 508881970 ORHXVIDRNXLEHY-UHFFFAOYSA-N 492.582 5.558 5 20 JKBD CCN(C(=O)c1ccc(N[C@@H](C)c2ccccn2)c([N+](=O)[O-])c1)[C@H](C)c1cc2ccccc2o1 509700710 ULISVVCACZLUCY-ZWKOTPCHSA-N 458.518 6.132 5 20 JKBD CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)c1cc(-c2cccs2)nc2c1cnn2C(C)C 509710194 GNVNRTNGHDVFTI-UHFFFAOYSA-N 463.563 5.700 5 20 JKBD COc1cc(C(=O)Nc2ccc(Cl)c(Cl)c2)c([N+](=O)[O-])cc1OCc1cscn1 509876351 DOZKIASSMKMHJP-UHFFFAOYSA-N 454.291 5.198 5 20 JKBD COc1ccc(C(=O)C(c2nc3ccccc3s2)c2nc3ccccc3s2)cc1[N+](=O)[O-] 513687631 WXXWDNZHENKBDP-UHFFFAOYSA-N 461.524 5.838 5 20 JKBD Cc1ccc(NC(=O)Nc2ccccc2)cc1NS(=O)(=O)c1c(Cl)cccc1[N+](=O)[O-] 517914743 ZDVMGPFKTCPLLZ-UHFFFAOYSA-N 460.899 5.001 5 20 JKBD C[C@H](NCc1ccc(-c2ccccc2[N+](=O)[O-])o1)c1ccc(NC(=O)c2ccc(F)cc2)cc1 549551249 UDHXOLHTUWOALS-KRWDZBQOSA-N 459.477 6.097 5 20 JKBD COc1cc(CNC(=O)c2ccccc2Sc2ccc(C(F)(F)F)cc2[N+](=O)[O-])ccn1 599794396 ZOXCHJVEDMFFPM-UHFFFAOYSA-N 463.437 5.098 5 20 JKBD CCOc1cc(C(=O)Nc2cc(-c3ccccc3OC)nn2-c2ccccc2)c([N+](=O)[O-])cc1OC 603760897 WINYQBVBISIWMG-UHFFFAOYSA-N 488.500 5.116 5 20 JKBD C[C@H](NC(=O)Nc1cc([N+](=O)[O-])ccc1OC(F)F)c1ccc(OCc2cccnc2)cc1 603829787 AZKJLHZNQZGEBD-AWEZNQCLSA-N 458.421 5.053 5 20 JKBD Cc1nn(Cc2ccc(C(=O)Nc3cccc(Cn4ccnc4C(C)C)c3)cc2)c(C)c1[N+](=O)[O-] 603927167 UZHLJCBXTQHDFX-UHFFFAOYSA-N 472.549 5.077 5 20 JKBD CCN(Cc1ccc(OCc2cccs2)c(OC)c1)C(=O)N[C@@H](C)c1cccc([N+](=O)[O-])c1 604126327 OECIPKBLNKKOAJ-KRWDZBQOSA-N 469.563 5.537 5 20 JKBD C[C@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)Nc1cccc(C(=O)Nc2cccc(F)c2)c1 604446922 GCMOOIVTZMREAQ-ZDUSSCGKSA-N 457.845 5.046 5 20 JKBD O=C(Nc1nc2c(s1)COCC2)c1c2c(nc3ccccc13)/C(=C/c1ccc([N+](=O)[O-])cc1)CCC2 609022673 XQDJWAXGQNEMQZ-SAPNQHFASA-N 498.564 5.801 5 20 JKBD CCc1cccc[n+]1/C(C(=S)Nc1ccc(OC)c(F)c1)=C(/O)c1ccc(C)c([N+](=O)[O-])c1 726576152 MQDPDJDLSCSOLL-UHFFFAOYSA-O 468.530 5.224 5 20 JKBD C[C@H](Nc1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2N2CCOCC2)cc1Cl)c1ccccc1 728024396 GKMJYKDRCLHIOV-KRWDZBQOSA-N 480.952 5.510 5 20 JKBD C[C@H]1C[C@@H](C)CN(c2ccc(C(=O)O[C@@H](C)C(=O)Nc3ccccc3C(F)(F)F)cc2[N+](=O)[O-])C1 728943843 UZZFZVYEMOSWRY-XHSDSOJGSA-N 493.482 5.280 5 20 JKBD C[C@@H](OC(=O)c1ccccc1C(=O)c1ccc(Cl)c(Cl)c1)C(=O)Nc1ccccc1[N+](=O)[O-] 729727216 OKEBFPPIVOXABK-CYBMUJFWSA-N 487.295 5.317 5 20 JKBD O=C(Nc1ccc(-c2nc3c(F)cccc3[nH]2)cc1)c1cc([N+](=O)[O-])ccc1Br 730761513 HBWZNMKAUCIFEH-UHFFFAOYSA-N 455.243 5.292 5 20 JKBD CC1=C(C(=O)Nc2ccccc2C(C)C)[C@@H](c2ccc([N+](=O)[O-])cc2)NC(=O)N1Cc1cccs1 732049683 ZAEMMDWMTNHPNK-XMMPIXPASA-N 490.585 5.959 5 20 JKBD O=C(COc1ccc([N+](=O)[O-])c(F)c1)Nc1sc2c(c1-c1nc3ccccc3[nH]1)CCCC2 745738684 PNSFNVWUOWHTLK-UHFFFAOYSA-N 466.494 5.235 5 20 JKBD Cc1ccc(/C(O)=C(/C(=S)Nc2cc(Cl)cc(Cl)c2)[n+]2cccc(CO)c2)cc1[N+](=O)[O-] 747878931 IIIFJNAUBVFIBS-UHFFFAOYSA-O 491.376 5.313 5 20 JKBD CCOc1ccc(N2C(=S)N[C@H](c3ccc([N+](=O)[O-])o3)C(C(=O)Nc3ccc(F)cc3)=C2C)cc1 812827155 JJTCFJZFNXUSGX-JOCHJYFZSA-N 496.520 5.074 5 20 JKBD CC(C)c1ccc(-c2nc(C(=O)N(Cc3nnc(-c4cccc([N+](=O)[O-])c4)o3)C(C)C)cs2)cc1 832601883 DJDURJFZOCHNPJ-UHFFFAOYSA-N 491.573 5.943 5 20 JKBD CCOc1cc([N+](=O)[O-])c(-c2nc(-c3cccc(Cn4cnc5ccccc54)c3)no2)cc1OC 904490312 IBSJWMVGFSXXLG-UHFFFAOYSA-N 471.473 5.117 5 20 JKBD O=C(Nc1ccc(OC(=O)[C@H]2CCC[C@@H](C(F)(F)F)C2)cc1)c1cc([N+](=O)[O-])ccc1Cl 916035722 GIZJVMPZEFMUKM-QWHCGFSZSA-N 470.831 5.775 5 20 JKBD Cc1cc(NC(=O)c2ccccc2Cl)sc1C(=O)N(C)Cc1cc([N+](=O)[O-])ccc1Cl 917069304 NZQZXYGLMDJLLN-UHFFFAOYSA-N 478.357 5.796 5 20 JKBD O=C1OC(c2ccc(Cl)c([N+](=O)[O-])c2)=N/C1=C/c1csc(COc2ccc(Cl)cc2)n1 918725463 DXNNUAPWGZFJRG-LZYBPNLTSA-N 476.297 5.282 5 20 JKBD C[C@H](Nc1ccc(C(=O)OCC(=O)N[C@@H](C)c2cccc3ccccc23)cc1[N+](=O)[O-])c1ccccn1 920544956 OJPUBJTXBXCVCO-OALUTQOASA-N 498.539 5.350 5 20 JKBD C[C@H](Nc1ccc(C(=O)OCC(=O)Nc2c(Cl)cccc2Cl)cc1[N+](=O)[O-])c1ccccn1 920545789 JKFXCDBYFCYJME-ZDUSSCGKSA-N 489.315 5.265 5 20 JKBD O=C(Cc1ccc(Cl)cc1[N+](=O)[O-])Nc1ccc(C2(NC(=O)COc3ccccc3)CCC2)cc1 1786116573 RXFMRPIKECTEOE-UHFFFAOYSA-N 493.947 5.004 5 20 JKBD Cc1cccc(/C=C/C(=O)NC2(c3ccc(NC(=O)CCc4cccc([N+](=O)[O-])c4)cc3)CCC2)n1 1786599284 VZBIHAWLCWBQRL-JQIJEIRASA-N 484.556 5.078 5 20 JKBD CC1=CC[C@H](C(=O)Nc2ccc(C3(NC(=O)c4cc([N+](=O)[O-])cc5c4OCC5)CCC3)cc2)CC1 1789114602 HYEIZMHFGPWXDF-SFHVURJKSA-N 475.545 5.024 5 20 JKBD C[C@@]1(C(=O)NC2(c3ccc(NC(=O)c4cc([N+](=O)[O-])cc5c4OCC5)cc3)CCC2)CC=CCC1 1790045560 UUIYMMDTKRNEGJ-AREMUKBSSA-N 475.545 5.024 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)c3ccc([N+](=O)[O-])o3)CCC2)cc1)c1ccc(-c2cccnc2)cc1 1790589164 AZKPPZNKGQWGEI-UHFFFAOYSA-N 482.496 5.311 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)[C@@]3(F)CCCC=C3F)CCC2)cc1)c1ccc([N+](=O)[O-])cc1F 1790625062 UYIUCNFXQXIVOG-XMMPIXPASA-N 473.451 5.227 5 20 JKBD CC(C)CC(=O)NC1(c2ccc(NC(=O)c3cccc(Br)c3[N+](=O)[O-])cc2)CCC1 1790752062 XQNSWZSTSUZGAO-UHFFFAOYSA-N 474.355 5.151 5 20 JKBD Cc1cc(CCCC(=O)N2CCCC3(CCN(C(=O)c4ccccc4F)CC3)C2)c([N+](=O)[O-])cc1F 1805821488 SJJVVOWUIPQYHK-UHFFFAOYSA-N 499.558 5.049 5 20 JKBD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2cccc(F)c2[N+](=O)[O-])[nH]n1)[C@@H]1CCC[C@H]2CCCC[C@@H]21 1818931177 JSMCLWKYQSXSSV-FOUBCARRSA-N 497.571 5.369 5 20 JKBD C/C(=C\c1cccs1)C(=O)N1CCCC[C@H]1C1CCN(C(=O)Cc2cc(F)ccc2[N+](=O)[O-])CC1 1823722097 HCVGGVQEPSGBHA-ZGSOLVRCSA-N 499.608 5.061 5 20 JKBD Cc1ccc(CC(=O)N2CCCC[C@@H]2C2CCN(C(=O)CCC3CCCC3)CC2)cc1[N+](=O)[O-] 1830363307 VMBDKYDWRPPOAX-XMMPIXPASA-N 469.626 5.036 5 20 JKBD C[C@@H](OC(=O)COc1ccc(-c2ccccc2)cc1Cl)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 17892171 PZTADKSNUUFDSB-OAHLLOKOSA-N 479.876 5.648 5 20 JKBD Cc1c([C@H](C)NC(=O)c2ccc(N[C@H](C)c3ccccn3)c([N+](=O)[O-])c2)cnn1-c1ccc(F)cc1 108777002 GXGJNWLNHGSLBO-DLBZAZTESA-N 488.523 5.287 5 20 JKBD O=C(Nc1ccc(NC(=O)[C@H]2CCCO2)cc1C(F)(F)F)c1cc2cc([N+](=O)[O-])ccc2s1 117255201 HERFHKHSRFCKCJ-MRXNPFEDSA-N 479.436 5.198 5 20 JKBD COc1cccc([C@@H](CNC(=O)N[C@@H](C)c2cccc([N+](=O)[O-])c2)c2c[nH]c3ccccc23)c1OC 195559667 ZQGGCSPODGXBGP-GAJHUEQPSA-N 488.544 5.286 5 20 JKBD COc1ccccc1-c1nnc(SCC(=O)c2cccc([N+](=O)[O-])c2)n1CCc1ccccc1 216803910 FPVKHCRSLXSHCG-UHFFFAOYSA-N 474.542 5.080 5 20 JKBD Cc1nc(-c2ccc(F)cc2)sc1[C@@H](C)NC(=O)c1ccc(N2CCCC2)c([N+](=O)[O-])c1 303189294 FGDYPAUDFHBUND-CQSZACIVSA-N 454.527 5.257 5 20 JKBD COc1cc(C(=O)N(Cc2cccnc2)C(C)C)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 488594050 OXDSYFVPWQAZOV-UHFFFAOYSA-N 455.898 5.495 5 20 JKBD Cc1c(NC(=O)c2cc([N+](=O)[O-])ccc2Sc2ccccc2)cccc1C(=O)N1CCSCC1 499468787 DTUZISINZJDKSD-UHFFFAOYSA-N 493.610 5.496 5 20 JKBD COc1ccc([C@H](C)NC(=O)C/C(=C\c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)cc1F 503212729 QHIUAEVILDUPKV-HUCUOGIVSA-N 491.544 6.160 5 20 JKBD Cc1ccc2c(C3=CCN(C(=O)c4ccc(N[C@H](C)c5ccccn5)c([N+](=O)[O-])c4)CC3)c[nH]c2c1 507408646 YTSXJYUAZNJTEQ-LJQANCHMSA-N 481.556 5.882 5 20 JKBD Cc1cccc(Oc2ccc(Cl)cc2NC(=O)C(=O)N[C@@H](C)c2cccc([N+](=O)[O-])c2)c1 518135785 NMOPOXFKASCCEC-HNNXBMFYSA-N 453.882 5.165 5 20 JKBD C[C@@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)Nc1ccc(F)c(NC(=O)C2CCCCC2)c1 518831481 GRUWITBLKJLGOP-CYBMUJFWSA-N 463.893 5.312 5 20 JKBD Cc1ccc(C(=O)Nc2ccccc2)cc1NC(=O)[C@@H](C)Oc1ccc(Cl)cc1[N+](=O)[O-] 520409906 CBEKKSKDMIMPIH-OAHLLOKOSA-N 453.882 5.215 5 20 JKBD O=C(Nc1nc2ccccc2n1C1CCCCC1)c1ccc([N+](=O)[O-])cc1I 522986032 DVLMRPZTZBDSET-UHFFFAOYSA-N 490.301 5.307 5 20 JKBD Cc1nc(-c2ccc(NC(=O)N[C@@H](CC(=O)OC(C)C)c3ccccc3[N+](=O)[O-])cc2)cs1 603652242 XEKAVUNAEQNJAN-IBGZPJMESA-N 468.535 5.231 5 20 JKBD O=C(C1CCN(c2nc3ccccc3s2)CC1)N(Cc1ccccc1[N+](=O)[O-])CC(F)(F)F 608937170 FABYIVWWARBZCJ-UHFFFAOYSA-N 478.496 5.012 5 20 JKBD COc1ccc(CC(=O)Nc2ccc(NC(=O)c3ccccc3)cc2C(F)(F)F)cc1[N+](=O)[O-] 609011308 OIWQDDVKTRWVLX-UHFFFAOYSA-N 473.407 5.056 5 20 JKBD CCOc1cc(NC(=O)c2sc(-c3ccc(OC)c(OC)c3)nc2C)c([N+](=O)[O-])cc1OCC 619212856 PFKYEKBPBXYHHL-UHFFFAOYSA-N 487.534 5.094 5 20 JKBD CCOc1cc(NC(=O)Cc2csc(-c3ccc(Cl)cc3)n2)c([N+](=O)[O-])cc1OCC 619213123 RKKLKSCXGHIJEO-UHFFFAOYSA-N 461.927 5.350 5 20 JKBD C[C@H](NC(=O)[C@@H](C)OC(=O)c1cc([N+](=O)[O-])ccc1Br)c1ccc(Cl)cc1Cl 725985000 NIKPSAZGAOUIPR-VHSXEESVSA-N 490.137 5.087 5 20 JKBD C[C@H](OC(=O)c1ccc(-c2ccccc2Br)n1C)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 726021934 XCPYKMRJVUOJEN-ZDUSSCGKSA-N 497.305 5.331 5 20 JKBD CCn1c(COC(=O)C2CCN(c3ccc(C(F)(F)F)cc3[N+](=O)[O-])CC2)nc2c(F)cccc21 728618021 UTPZENWFIRYXIR-UHFFFAOYSA-N 494.445 5.082 5 20 JKBD CC(C)(C)OC(=O)N1CCC[C@H]1C1CCN(C(=O)c2cc3ccccc3c3cccnc23)CC1 742496391 KMRAWPNOLJKPCR-DEOSSOPVSA-N 459.590 5.640 5 20 JKBD C[C@@H](OC(=O)c1csc(-c2cccc([N+](=O)[O-])c2)n1)C(=O)c1ccc(NC(=O)C(C)(C)C)cc1 747961740 HIEQRWHGQYEJRX-CQSZACIVSA-N 481.530 5.131 5 20 JKBD Cc1ccc(NC(=O)c2ccccc2)cc1NC(=O)c1cc([N+](=O)[O-])ccc1Br 751088670 AFIOFUNZQDHMND-UHFFFAOYSA-N 454.280 5.170 5 20 JKBD C[C@H](OC(=O)C1(c2cccc(F)c2)CCCC1)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 755855185 ZYKLIRWNJNKHNK-ZDUSSCGKSA-N 468.403 5.135 5 20 JKBD C[C@H](OC(=O)c1occc1CSc1ccccc1)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 792737631 UFNPYISZIMDHGX-ZDUSSCGKSA-N 494.447 5.683 5 20 JKBD O=C(Cc1ccc(NCc2c(Br)cccc2[N+](=O)[O-])cc1)Nc1ccccc1F 864003923 IHWLKEHDMNHKNA-UHFFFAOYSA-N 458.287 5.290 5 20 JKBD O=C(COc1cccc(NC(=O)C2CC2)c1)Nc1cc(Cl)c([N+](=O)[O-])cc1OCc1ccccc1 914838554 LTZDHUINFRLJQN-UHFFFAOYSA-N 495.919 5.193 5 20 JKBD C[C@H](OC(=O)CCOc1ccc2ccccc2c1)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 914913462 YPMOIXZIDQWFQK-AWEZNQCLSA-N 476.407 5.106 5 20 JKBD COc1ccc(Oc2ccc([N+](=O)[O-])cc2C(=O)O[C@H](C)C(=O)Nc2ccccc2SC)cc1 915443054 XETQTBQMFOWAEM-OAHLLOKOSA-N 482.514 5.302 5 20 JKBD COc1cccc(NC(=O)c2ccccc2NC(=O)c2cc(OCC(F)(F)F)ccc2[N+](=O)[O-])c1 915813876 WYVBLYYHIFNHCX-UHFFFAOYSA-N 489.406 5.049 5 20 JKBD COC(=O)c1ccc2c(=O)nc(/C(Cl)=C\c3ccc(Oc4ccc(F)cc4)c([N+](=O)[O-])c3)[nH]c2c1 916127129 FOGPVGNCGRUPMA-VCHYOVAHSA-N 495.850 5.286 5 20 JKBD CCOc1ccc(-c2nc(COC(=O)c3cc4cc([N+](=O)[O-])ccc4o3)cs2)cc1OC 917262915 FQVQVZNBIIWULC-UHFFFAOYSA-N 454.460 5.229 5 20 JKBD CCc1ccccc1NC(=O)C1=C(C)N(c2ccccc2)C(=S)N[C@H]1c1ccc([N+](=O)[O-])cc1 917372746 BCFLWDXWTABMPU-DEOSSOPVSA-N 472.570 5.506 5 20 JKBD C[C@H](NC(=S)/C(=C(/O)c1cccc([N+](=O)[O-])c1)[n+]1ccc(Cc2ccccc2)cc1)c1ccccc1 917613334 SLSUNOWXRGTUMV-NRFANRHFSA-O 496.612 6.035 5 20 JKBD C[C@@H](NC(=O)c1ccccc1NC(=O)c1cccc(Br)c1)c1cccc([N+](=O)[O-])c1 918136477 LNTOZQKZFGYIMU-CQSZACIVSA-N 468.307 5.101 5 20 JKBD C[C@H](NC(=O)NC[C@@H](c1ccc(N(C)C)cc1)c1c[nH]c2ccccc12)c1cccc([N+](=O)[O-])c1 918169648 UBJHDXZKELSFNG-UUOWRZLLSA-N 471.561 5.334 5 20 JKBD O=C(OCC(=O)N1CCC[C@H]1c1ccc(Cl)c(Cl)c1)c1ccc(Cl)cc1[N+](=O)[O-] 919039850 ZIIYTDFTHCIXHE-INIZCTEOSA-N 457.697 5.076 5 20 JKBD CC(C)Cn1cc(C(=O)OCC(=O)Nc2ccc([N+](=O)[O-])cc2C(F)(F)F)c2ccccc21 919482395 SBMPQFYIFLNUGU-UHFFFAOYSA-N 463.412 5.020 5 20 JKBD Cc1cc(C)c(NC(=O)[C@H](C)OC(=O)c2ccc(N[C@@H](C)c3ccccn3)c([N+](=O)[O-])c2)c(Cl)c1 920548192 QLFPPNXRYSBIQE-IRXDYDNUSA-N 496.951 5.617 5 20 JKBD COc1cc(C(=O)Nc2ccc(C3(NC(=O)c4cc(C)cnc4Cl)CCC3)cc2)ccc1[N+](=O)[O-] 1792163695 DHDOLHAUDLBWKL-UHFFFAOYSA-N 494.935 5.022 5 20 JKBD COc1cc(C(=O)Nc2ccc(C3(NC(=O)CCc4ccsc4)CCC3)cc2)ccc1[N+](=O)[O-] 1792164693 QAVKKARQFOXLLA-UHFFFAOYSA-N 479.558 5.045 5 20 JKBD CC[C@@H](C)[C@H](C(=O)N1CCC2(CCCN(C(=O)Cc3cccc([N+](=O)[O-])c3)C2)CC1)c1ccccc1 1804751436 QJAFMBAXLSKPDN-AMGIVPHBSA-N 491.632 5.198 5 20 JKBD Cc1c(C(=O)N2CC[C@@H](CNC(=O)C3(C(C)C)CCC3)[C@H]2c2cccnc2)cc(Cl)cc1[N+](=O)[O-] 1813665832 LEYRJCWXPLYCHF-WMZHIEFXSA-N 499.011 5.098 5 20 JKBD CC(C)(C)CC(=O)N1CCC([C@H]2CCCCN2C(=O)c2cccc(Br)c2[N+](=O)[O-])CC1 1830698205 TVUOTCXNXMBYSF-LJQANCHMSA-N 494.430 5.027 5 20 JKBD Cc1c(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3cccs3)CC2)cc(Cl)cc1[N+](=O)[O-] 1830735110 YZJLXVIZOHVRIL-LJQANCHMSA-N 475.998 5.165 5 20 JKBD Cc1c(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)C3CC(C)(C)C3)CC2)cc(Cl)cc1[N+](=O)[O-] 1830738856 VSKQWLYMOFWHEM-OAQYLSRUSA-N 476.017 5.226 5 20 JKBD O=C(C1CCCCC1)N1CCC([C@H]2CCCCN2C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)CC1 1831061240 QATRVECRLPVJRQ-JOCHJYFZSA-N 483.634 5.623 5 20 JKBD Cc1ccncc1C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)CC1 1831061502 TWWSRJSIGMYEKG-JOCHJYFZSA-N 492.601 5.060 5 20 JKBD CC[C@H]1CC[C@H](C(=O)N2CCCC[C@@H]2C2CCN(C(=O)Cc3cc([N+](=O)[O-])ccc3F)CC2)CC1 1831691756 NPMTUODIHLPOQD-DZRGJMJISA-N 487.616 5.113 5 20 JKBD Cc1ccc(NC(=O)[C@@H](OC(=O)c2nc(-c3ccccc3)oc2C)c2ccccc2)c([N+](=O)[O-])c1 9717691 QALQUUXLUAPAJT-QHCPKHFHSA-N 471.469 5.403 5 20 JKBD C[C@@H](OC(=O)c1cc(-c2ccco2)nc2ccccc12)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl 11398168 AGVRWZBIJPMOND-CYBMUJFWSA-N 465.849 5.240 5 20 JKBD O=C(Cn1c2ccccc2c(=O)c2ccccc21)Nc1nc2ccc(OC(F)(F)F)cc2s1 14343462 WIHWJXLFGJHWOP-UHFFFAOYSA-N 469.444 5.302 5 20 JKBD CCOc1ccc([C@H](CNC(=O)c2ccc([N+](=O)[O-])s2)c2c[nH]c3ccccc23)cc1OC 16176474 GDNNRUFKNHYLPS-KRWDZBQOSA-N 465.531 5.107 5 20 JKBD CCCN(Cc1nnc(-c2ccccc2Cl)o1)C(=O)c1ccc(N2CCC(C)CC2)c([N+](=O)[O-])c1 18832907 OVWUWAZLIDGCFM-UHFFFAOYSA-N 497.983 5.587 5 20 JKBD O=C(Nc1ccccc1C(=O)OCC(=O)c1c[nH]c2ccccc12)c1ccc([N+](=O)[O-])cc1Cl 20991278 ILPMYVDKFJTJEF-UHFFFAOYSA-N 477.860 5.022 5 20 JKBD O=C(Cn1c2ccccc2c(=O)c2ccccc21)OCCOC(c1ccccc1)c1ccccc1 23204758 HTFLKXOUWVGQMP-UHFFFAOYSA-N 463.533 5.504 5 20 JKBD COc1cc(/C=C/C(=O)O[C@@H](C)c2cccc([N+](=O)[O-])c2)ccc1OCc1c(C)noc1C 24084688 RCCZYMVOFNFSDA-SOGBHIHOSA-N 452.463 5.105 5 20 JKBD C[C@H](Sc1nc(CCC2CCCC2)n[nH]1)C(=O)Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1 36800319 KUBZYVPFGZEAQL-ZDUSSCGKSA-N 472.596 5.079 5 20 JKBD CC[C@@H](C)Sc1ccc(NC(=O)C2CCN(c3ccccc3[N+](=O)[O-])CC2)c(C(F)(F)F)c1 499563466 VAXRVPJWJXOBNE-OAHLLOKOSA-N 481.540 6.359 5 20 JKBD O=C(Nc1cccc(N[C@@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2ccccc2)c1)c1ccoc1 500370541 BBGPITQNLNMECO-HSZRJFAPSA-N 490.903 5.885 5 20 JKBD C[C@H](Nc1ccc(C(=O)Nc2cc(F)ccc2OC[C@H]2CCCO2)cc1[N+](=O)[O-])c1ccccn1 502287232 ZOKWVQDALJXIGW-QFBILLFUSA-N 480.496 5.112 5 20 JKBD Cc1ccc(-c2nc(C)c([C@H](C)NC(=O)c3cc(OCC(F)(F)F)ccc3[N+](=O)[O-])s2)cc1 502561158 BIGHUVSJSZEMEV-ZDUSSCGKSA-N 479.480 5.767 5 20 JKBD O=C(CSc1ccc(C(F)(F)F)cc1[N+](=O)[O-])Nc1ccccc1OCc1cscn1 503489658 OEGHQJFIAGUDLK-UHFFFAOYSA-N 469.466 5.380 5 20 JKBD C[C@@H](Nc1ccc(C(=O)N(C)Cc2cc(Br)ccc2F)cc1[N+](=O)[O-])c1ccccn1 506178073 JGQYYWLOQGMXOU-CQSZACIVSA-N 487.329 5.337 5 20 JKBD CC(C)(C)c1ccc(Oc2ccc(CNCc3ccc(NS(C)(=O)=O)cc3)cc2[N+](=O)[O-])cc1 507905142 SKIMDSVQLVNLAB-UHFFFAOYSA-N 483.590 5.346 5 20 JKBD CCN(Cc1ccc2ccccc2c1)C(=O)c1cc(OC)c(OCc2cscn2)cc1[N+](=O)[O-] 511456516 AUEYKHXGYUODJW-UHFFFAOYSA-N 477.542 5.454 5 20 JKBD Cc1c(NC(=O)N2CCN(C(c3ccc(F)cc3)c3ccc(F)cc3)CC2)cccc1[N+](=O)[O-] 514506081 KDCAZURKFXWNDO-UHFFFAOYSA-N 466.488 5.121 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Cl)[C@H](NCc1ccc(OCC(F)(F)F)nc1)c1ccccc1 515756111 KKUQJJNTZLDSAN-HXUWFJFHSA-N 494.857 5.054 5 20 JKBD COC(=O)c1cc2cc(NC(=O)C3CCN(c4ccc(C(F)(F)F)cc4[N+](=O)[O-])CC3)ccc2o1 518234720 KWXLCBSAUBEHAO-UHFFFAOYSA-N 491.422 5.002 5 20 JKBD CSc1ccc(C(=O)Nc2ccc(NC(=O)[C@@H](C)n3nc(C)cc3C)c(Cl)c2)cc1[N+](=O)[O-] 520107995 GBJOTTWNSSAWFA-CQSZACIVSA-N 487.969 5.235 5 20 JKBD COc1cc([C@@H](C)NCc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)ccc1OCc1ccncc1 520211549 YEUILIXFBVCUDI-GOSISDBHSA-N 475.570 6.157 5 20 JKBD C[C@@H](Nc1ccc(C(=O)N2CC=C(c3cccc4ccccc34)CC2)cc1[N+](=O)[O-])c1ccccn1 521759674 XUIHSWZGHQEEIK-HXUWFJFHSA-N 478.552 6.246 5 20 JKBD COC(=O)c1sc(-c2ccccc2Cl)cc1NC(=O)c1cc(SC)ccc1[N+](=O)[O-] 604007636 KBEPXRFBQYKNRF-UHFFFAOYSA-N 462.936 5.738 5 20 JKBD COc1ccc(CNC(=O)c2ccc(NC(=O)c3cc(Cl)cc(Cl)c3)cc2)cc1[N+](=O)[O-] 604016558 GVYFNIKMCKOHQL-UHFFFAOYSA-N 474.300 5.093 5 20 JKBD Cn1cc(CCCNC(=O)c2c3c(nc4ccccc24)/C(=C\c2cccc([N+](=O)[O-])c2)CCC3)cn1 608850650 ZPVNGBHKQHCUIS-QNGOZBTKSA-N 481.556 5.116 5 20 JKBD COc1ccc(Oc2ccc([N+](=O)[O-])cc2C(=O)N2CCC[C@@H](CN(C)C(=O)OC(C)(C)C)C2)cc1 744340956 CZLJTAOKZWQGHJ-SFHVURJKSA-N 499.564 5.115 5 20 JKBD Cc1ccc(NC(=O)Cc2nc(COC(=O)c3csc(-c4cccc([N+](=O)[O-])c4)n3)cs2)cc1 747962222 NAOKHXANFYMAGB-UHFFFAOYSA-N 494.554 5.021 5 20 JKBD O=C(Nc1nc(-c2cccc3ccccc23)cs1)c1cc([N+](=O)[O-])ccc1Br 751047724 AMCLJJCPUZZCMC-UHFFFAOYSA-N 454.305 5.886 5 20 JKBD O=C(Nc1ccccc1Oc1ncc(Cl)cc1Cl)c1cc([N+](=O)[O-])ccc1Br 751089426 UOMRDBOJJHWKFK-UHFFFAOYSA-N 483.105 6.104 5 20 JKBD Cc1csc(SCc2c(C(=O)N3CCc4ccc([N+](=O)[O-])cc43)oc3ccccc23)n1 794100893 IBGWIKGJFVYSMG-UHFFFAOYSA-N 451.529 5.601 5 20 JKBD O=C(Nc1cccc(N2CCOC2=O)c1)c1ccc(NCc2ccccc2Cl)c([N+](=O)[O-])c1 914727165 VZWCLSFIBCHPPQ-UHFFFAOYSA-N 466.881 5.069 5 20 JKBD Cc1ccc(S(=O)(=O)Nc2ccc(NC(=S)Nc3c(C)cccc3C)cc2)cc1[N+](=O)[O-] 916120135 QMYFQPICRFSFLZ-UHFFFAOYSA-N 470.576 5.130 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Cl)[C@H](Nc1ccc(N2CCCC2)c(F)c1)c1ccccc1 917937780 JCTGXDWXWCCWDJ-HSZRJFAPSA-N 468.916 5.779 5 20 JKBD Cc1nc(-c2ccccc2)sc1[C@@H](C)NC(=O)c1cc([N+](=O)[O-])ccc1I 919771416 FSLMNXOULQASIF-LLVKDONJSA-N 493.326 5.122 5 20 JKBD C[C@@H](OC(=O)C1=NN(c2ccccc2)[C@H](c2ccccc2)C1)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl 934167058 IYUBYJTXMNEOQD-MWTRTKDXSA-N 492.919 5.126 5 20 JKBD O=C(NC1(c2ccc(NC(=O)[C@@H]3C[C@@H]3C3CC3)cc2)CCC1)c1cccc([N+](=O)[O-])c1Br 1786055944 IXZKUWOUQMTODD-RTBURBONSA-N 498.377 5.151 5 20 JKBD O=C(Cc1ccc(Cl)cc1[N+](=O)[O-])Nc1ccc(C2(NC(=O)CCC(F)(F)F)CCC2)cc1 1786116585 TYMXRTMTIJLNNR-UHFFFAOYSA-N 483.874 5.267 5 20 JKBD CCO/C=C/C(=O)NC1(c2ccc(NC(=O)c3cc4cc([N+](=O)[O-])ccc4s3)cc2)CCC1 1791009954 FFGRKZATBJKIQR-JLHYYAGUSA-N 465.531 5.107 5 20 JKBD COc1cc(C(=O)Nc2ccc(C3(NC(=O)c4cccc5cc[nH]c45)CCC3)cc2)ccc1[N+](=O)[O-] 1792164461 GSPQMNYLJWXMAL-UHFFFAOYSA-N 484.512 5.146 5 20 JKBD O=C(/C=C/c1ccccc1[N+](=O)[O-])N1CCC2(CCCN(C(=O)CCc3ccccc3Cl)C2)CC1 1809357359 OPXDSSGVCCCDCG-ACCUITESSA-N 496.007 5.125 5 20 JKBD CC(C)(C)CC(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)[nH]n1 1816763791 QUCMYSFPIWNQQV-QGZVFWFLSA-N 469.567 5.275 5 20 JKBD O=C(Nc1cc([C@H]2CCCCN2C(=O)CCc2cccc([N+](=O)[O-])c2)[nH]n1)c1c(F)cccc1Cl 1820428897 FDULRJNJXNGWCG-HXUWFJFHSA-N 499.930 5.049 5 20 JKBD O=C(c1cc2sccc2s1)N1CCC([C@H]2CCCCN2C(=O)c2ccc([N+](=O)[O-])o2)CC1 1823614628 PKFNPACWTYONPX-OAHLLOKOSA-N 473.576 5.011 5 20 JKBD Cc1cscc1C(=O)N1CCC([C@H]2CCCCN2C(=O)Cc2ccc(Cl)cc2[N+](=O)[O-])CC1 1824162219 ONEPTYDAYFHZRE-OAQYLSRUSA-N 490.025 5.094 5 20 JKBD CC(C)[C@@H](C(=O)N1CCC([C@@H]2CCCCN2C(=O)/C=C/c2ccc([N+](=O)[O-])o2)CC1)c1ccccc1 1824275534 CZBAVNYKMYAGBS-YWKSOQAPSA-N 493.604 5.261 5 20 JKBD CCc1ccnc(C(=O)N2CCC([C@@H]3CCCCN3C(=O)c3cc(Cl)cc([N+](=O)[O-])c3C)CC2)c1 1830736098 QOYNWQBCZVRVAC-QHCPKHFHSA-N 499.011 5.061 5 20 JKBD O=C(CCCn1c(=O)oc2cc([N+](=O)[O-])ccc21)Nc1ccc(Oc2ccccc2Cl)cc1 11513513 GHAJIJJKAXIWIR-UHFFFAOYSA-N 467.865 5.367 5 20 JKBD Cc1ccc(-n2c(SCC(=O)Nc3cc([N+](=O)[O-])ccc3Cl)nnc2-c2ccncc2)cc1C 25120797 BYTCJQGWRHCZLI-UHFFFAOYSA-N 494.964 5.239 5 20 JKBD CC(=O)c1ccc(C(=O)O[C@@H](C(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)c2ccccc2)s1 25267014 DAUXNINJCGWRNS-LJQANCHMSA-N 458.879 5.049 5 20 JKBD CC(=O)Nc1nc(COC(=O)C/C(=C/c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)cs1 27252051 VRRAPAMIBKLXAD-YBEGLDIGSA-N 494.554 5.294 5 20 JKBD COc1cc(C(=O)N2CCO[C@@H](c3ccccc3)C2)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 27903709 ATTYRKBDWCISGQ-HSZRJFAPSA-N 468.893 5.263 5 20 JKBD O=[N+]([O-])c1ccc(-c2nnc(CSc3nnc(-c4ccco4)n3C3CCCCC3)o2)cc1 29813819 NNDCQJWZPSJJKA-UHFFFAOYSA-N 452.496 5.294 5 20 JKBD CCCC(=O)Nc1cccc(N[C@@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2C(F)(F)F)c1C 109109596 HGNMUJAOYZBYJE-ZDUSSCGKSA-N 452.433 5.100 5 20 JKBD COc1ccc(OC)c([C@@H](C)NCc2cn(-c3ccccc3)nc2-c2ccc([N+](=O)[O-])cc2)c1 215866179 DHARDVFJMDMOAM-GOSISDBHSA-N 458.518 5.316 5 20 JKBD Cc1cc([C@@H]2CCCN2C(=O)C/C(=C\c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)on1 481567844 CIFNCWOFTOERMV-TVADFSRQSA-N 474.542 5.795 5 20 JKBD O=[N+]([O-])c1cc(Cl)ccc1Oc1nc(CN2CCOCC2)nc2scc(-c3ccccc3)c12 497757007 BLEKWWRLPNRFOT-UHFFFAOYSA-N 482.949 5.544 5 20 JKBD O=C(Cc1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1)Nc1nc(-c2cccnc2)cs1 506848125 VQOOIFBHNARKIN-UHFFFAOYSA-N 482.525 5.147 5 20 JKBD COCCn1ccc(NC(=O)c2c3c(nc4ccccc24)/C(=C\c2cccc([N+](=O)[O-])c2)CCC3)n1 507150367 VDIHGGLMHFEEDS-MNDPQUGUSA-N 483.528 5.115 5 20 JKBD O=C(NC[C@@H]1CCN(c2ccc(F)cc2)C1)c1cc([N+](=O)[O-])ccc1Sc1ccccc1 512153646 USBVCRLHIKFPRU-KRWDZBQOSA-N 451.523 5.141 5 20 JKBD COc1cc(C(=O)N[C@H](c2ccc(Cl)cc2)C2CC2)c([N+](=O)[O-])cc1OCc1cscn1 512599871 KZFGMKBIRIYYKJ-NRFANRHFSA-N 473.938 5.173 5 20 JKBD CCN(Cc1ccc(-c2ccc(C(F)(F)F)cc2)o1)C(=O)C(=O)Nc1cccc([N+](=O)[O-])c1C 518553580 AEWVHDBMVNVPCR-UHFFFAOYSA-N 475.423 5.169 5 20 JKBD COc1ccc([N+](=O)[O-])c(C(=O)Nc2cccc(C(=O)Nc3cccc(C(F)(F)F)c3)c2)c1 518617717 BYYJMRMZEJXLIM-UHFFFAOYSA-N 459.380 5.127 5 20 JKBD COc1cc(OCC(=O)Nc2ccccc2NC(=O)c2ccc(C(C)(C)C)cc2)ccc1[N+](=O)[O-] 519049775 FPFOBSHVKYQCDJ-UHFFFAOYSA-N 477.517 5.171 5 20 JKBD Cc1nc(NC(=O)c2ccc([N+](=O)[O-])cc2Cl)sc1-c1nc2ccccc2n1C(F)F 521288515 PCGUGDANTLKXHL-UHFFFAOYSA-N 463.853 5.677 5 20 JKBD Cc1cc([C@@H](C)NC(=O)C2CCN(c3ccc(C(F)(F)F)cc3[N+](=O)[O-])CC2)c(C)s1 603873560 ROZDQLRBHZCRFR-CYBMUJFWSA-N 455.502 5.386 5 20 JKBD C[C@H](NC(=O)c1ccc(Nc2ccccc2)c([N+](=O)[O-])c1)c1ccc(NC(=O)NC2CC2)cc1 603903263 PIVBQVZCTQXBIU-INIZCTEOSA-N 459.506 5.113 5 20 JKBD Cc1cc(C(=O)N2CCC(C)CC2)ccc1NC(=O)c1ccc(N2CCC[C@H](C)C2)c([N+](=O)[O-])c1 603993371 UBYVXIYYNYZFFT-IBGZPJMESA-N 478.593 5.264 5 20 JKBD Cc1nn(Cc2ccc(C(=O)N(Cc3ccccn3)c3ccc(Cl)cc3)cc2)c(C)c1[N+](=O)[O-] 603998488 UBZSIOCXPDLTJM-UHFFFAOYSA-N 475.936 5.352 5 20 JKBD CN1CCC2(CC1)C[C@H](NC(=O)c1cc([N+](=O)[O-])ccc1Oc1ccccc1)c1ccccc1O2 604104016 YEDTVOVSVLHVHE-QHCPKHFHSA-N 473.529 5.105 5 20 JKBD CN(Cc1ccccc1CNC(=O)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-])C1CCCCC1 604193429 VGOVIWVXMFOCCL-UHFFFAOYSA-N 479.499 5.230 5 20 JKBD O=C(c1cc([N+](=O)[O-])ccc1Oc1ccccc1)N1C[C@@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1 604257302 FKFJWZFEJSSAKL-BETUJISGSA-N 462.346 5.590 5 20 JKBD C[C@@H](c1cccs1)N(C)C(=O)c1ccc(C(=O)N(C)[C@H](C)c2cccs2)c([N+](=O)[O-])c1 609044975 XLOVENPDRXIFEK-LSDHHAIUSA-N 457.577 5.384 5 20 JKBD Cn1c(SCC(=O)c2cccc([N+](=O)[O-])c2)nc2scc(-c3ccccc3Cl)c2c1=O 612402186 LSEYCRUVMVQJRV-UHFFFAOYSA-N 471.947 5.199 5 20 JKBD Cc1cc(Br)cc(Cl)c1NC(=O)c1ccc(I)c([N+](=O)[O-])c1 727748726 CKEXHYFYFBXIEL-UHFFFAOYSA-N 495.498 5.176 5 20 JKBD Cc1ccc(NC(=O)CCC(=O)c2ccc3ccc4cccc5ccc2c3c45)cc1NS(C)(=O)=O 727767766 LVNMLDHEYBFWIP-UHFFFAOYSA-N 484.577 5.866 5 20 JKBD O=C(Nc1ccc(Oc2cccc(F)c2)c2ccncc12)c1cc([N+](=O)[O-])ccc1N1CCOCC1 728183446 LIONXGTXSIIOEA-UHFFFAOYSA-N 488.475 5.163 5 20 JKBD Cc1nn(Cc2ccc(C(=O)OCc3ccccc3Oc3cccnc3)cc2)c(C)c1[N+](=O)[O-] 728320053 IVYWTCCHCFXQMK-UHFFFAOYSA-N 458.474 5.001 5 20 JKBD O=C(COC(=O)c1nc(-c2ccccc2)oc1-c1ccccc1)Nc1ccc(Cl)cc1[N+](=O)[O-] 731378936 SZDJHTBOVQANDV-UHFFFAOYSA-N 477.860 5.366 5 20 JKBD Cc1ccc(F)c(NC(=S)/C(=C(/O)c2ccc(C)c([N+](=O)[O-])c2)[n+]2ccc(C(C)(C)C)cc2)c1 744117364 UPFLBPGWKSZVFH-UHFFFAOYSA-O 480.585 6.259 5 20 JKBD C[C@@H](OC(=O)COC(c1ccccc1)c1ccccc1)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 746241238 FAROCYUTKWMGQF-QGZVFWFLSA-N 459.458 5.055 5 20 JKBD CC(C)c1cccc(C(C)C)c1NC(=O)COC(=O)c1csc(-c2cccc([N+](=O)[O-])c2)n1 747961708 GRRGXLLWXVWVGD-UHFFFAOYSA-N 467.547 5.761 5 20 JKBD CCOc1ccc(Oc2ccccc2NC(=O)c2cc([N+](=O)[O-])ccc2Br)cc1 750601541 WSUFLMOJASKXRB-UHFFFAOYSA-N 457.280 5.801 5 20 JKBD CSc1ccc([C@H](CNC(=O)c2cc(F)ccc2[N+](=O)[O-])N2CCc3sccc3C2)cc1 751085791 FDINQHAHLMIJST-NRFANRHFSA-N 471.579 5.047 5 20 JKBD CCc1ccc(N(C(C)=O)c2nc(COC(=O)c3c[nH]c4cc([N+](=O)[O-])ccc34)cs2)cc1 756767434 YDAHUMCGXYZGQY-UHFFFAOYSA-N 464.503 5.137 5 20 JKBD C[C@H](Nc1ccc(C(=O)N2CCC[C@@H](Oc3ccc(C4CC4)cn3)C2)cc1[N+](=O)[O-])c1ccccn1 858034283 YHJAGLFPMMBGSZ-PGRDOPGGSA-N 487.560 5.119 5 20 JKBD COCCNC(=O)/C(=C/c1ccc(Oc2ccccc2Cl)c([N+](=O)[O-])c1)c1nc2ccccc2[nH]1 916155213 OKDYBRMFQUMDRA-SAPNQHFASA-N 492.919 5.220 5 20 JKBD O=C(COC(=O)c1c(Cl)cc(C(F)(F)F)cc1Cl)Nc1cc(Cl)ccc1[N+](=O)[O-] 919296868 LIWOBKPROGFLAN-UHFFFAOYSA-N 471.602 5.369 5 20 JKBD Cc1cc(C(=O)O[C@@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2ccc(Br)cc2n1 919521774 JPHRJIPQLHHOAZ-NSHDSACASA-N 492.713 5.051 5 20 JKBD CCO[C@@H](C(=O)O[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1)c1ccccc1 920690106 ZFQBEUCMCNOMIP-FCHUYYIVSA-N 468.893 5.249 5 20 JKBD C[C@H](Nc1ccc(C(=O)O[C@H](c2ccccc2)c2ccncc2)cc1[N+](=O)[O-])c1ccccn1 920772476 NKHYLZSNLNTZFR-AVRWGWEMSA-N 454.486 5.504 5 20 JKBD C[C@H](Cc1ccc(F)cc1)C(=O)Oc1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2Cl)cc1 920999514 UTRQADUIAXHXHU-CQSZACIVSA-N 456.857 5.424 5 20 JKBD O=C(NC1(c2ccc(NC(=O)[C@@H]3C[C@H]3C3CC3)cc2)CCC1)c1cccc([N+](=O)[O-])c1Br 1786055941 IXZKUWOUQMTODD-RBUKOAKNSA-N 498.377 5.151 5 20 JKBD COc1cc(C(=O)NC2(c3ccc(NC(=O)[C@@H]4CCCCC4(F)F)cc3)CCC2)ccc1[N+](=O)[O-] 1786467344 QVRBALALGXILHZ-IBGZPJMESA-N 487.503 5.177 5 20 JKBD O=C(Cc1cc([N+](=O)[O-])ccc1F)Nc1ccc(C2(NC(=O)c3cc4sccn4c3)CCC2)cc1 1786671130 JVPYDPLYOUHFHY-UHFFFAOYSA-N 492.532 5.039 5 20 JKBD C[C@H](Cc1ccncc1)C(=O)NC1(c2ccc(NC(=O)/C=C/c3ccccc3[N+](=O)[O-])cc2)CCC1 1792317435 PNZFVVDVPMFANZ-ACGJQVIASA-N 484.556 5.016 5 20 JKBD O=C(/C=C/c1ccccc1[N+](=O)[O-])N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc2c(Cl)cccc2s1 1797652049 XCZLCAUTHRQPAS-CTSJQTPZSA-N 495.988 5.428 5 20 JKBD CCC[C@H]1CC[C@H](C(=O)NC[C@H]2CCN(C(=O)c3ccc([N+](=O)[O-])cc3F)[C@@H]2c2cccnc2)CC1 1812789323 IERQJOKXZVTITN-JJPBMRITSA-N 496.583 5.055 5 20 JKBD Cc1ccc(SCC(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3cc(F)cc([N+](=O)[O-])c3)CC2)cc1 1828345245 VXZQDSNZVMGMAO-XMMPIXPASA-N 499.608 5.068 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2ccccc2Cl)CC1 1830733221 JKNTXQSLNPGEOL-QFIPXVFZSA-N 487.959 5.243 5 20 JKBD Cc1cc(C)nc(C(=O)N2CCC([C@H]3CCCCN3C(=O)c3cc(Cl)cc([N+](=O)[O-])c3C)CC2)c1 1830736636 XVTMYYMMKNGALG-HSZRJFAPSA-N 499.011 5.116 5 20 JKBD O=C(c1cccc(F)c1[N+](=O)[O-])N1CCC([C@@H]2CCCCN2C(=O)c2ccc3ccoc3c2)CC1 1830913122 SWWLLNRDFUXNMW-QFIPXVFZSA-N 479.508 5.027 5 20 JKBD CC(C)Cn1c(S[C@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)nnc1-c1ccccc1F 8651070 KWNLSPLZTVBWRE-CYBMUJFWSA-N 477.949 5.421 5 20 JKBD CCOc1ccc(SCC(=O)Nc2c(Br)cc([N+](=O)[O-])cc2Br)cc1 16168387 ZAKCVRFZBSQGPH-UHFFFAOYSA-N 490.173 5.249 5 20 JKBD Cc1cccc(-c2nnc([C@H](C)OC(=O)c3ccc(Sc4nc(C)cs4)c([N+](=O)[O-])c3)o2)c1 17715741 AZWIMKFNLKEICD-AWEZNQCLSA-N 482.543 5.787 5 20 JKBD O=C(c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1)N1CCC[C@@H](c2nc3ccccc3o2)C1 27374819 GPPBGNAMXJIYQQ-QGZVFWFLSA-N 477.904 6.202 5 20 JKBD Cc1ccc(Br)cc1NC(=O)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 71933143 BUSQBTXPCQWJSP-UHFFFAOYSA-N 486.288 5.540 5 20 JKBD Cc1ccc(-c2csc(NC(=O)c3ccc(N[C@H](C)c4ccccn4)c([N+](=O)[O-])c3)n2)cc1 108751700 LRTJUHDAPIZRQD-MRXNPFEDSA-N 459.531 5.847 5 20 JKBD COc1ccc2cc(CNC(=O)c3ccc(N[C@@H](C)c4ccccn4)c([N+](=O)[O-])c3)ccc2c1 115705105 DJVZFSXEQMXZFO-KRWDZBQOSA-N 456.502 5.255 5 20 JKBD Cc1c(C(C)(C)C)nn(-c2ccccc2)c1NC(=O)c1ccc(N[C@H](C)c2ccccn2)c([N+](=O)[O-])c1 410024643 FOOULPKWRIOYAK-LJQANCHMSA-N 498.587 6.207 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Cl)[C@@H](c1ccccc1)N1CCC(OCc2ccccc2)CC1 477131545 HDSARHUNYDXSLC-RUZDIDTESA-N 479.964 5.609 5 20 JKBD CCCCCNC(=O)C1CCN(C(=O)c2ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])cc2)CC1 480408331 UYTNPTOIYFMQEZ-UHFFFAOYSA-N 473.957 5.199 5 20 JKBD Cc1occc1C(=O)Nc1cc(NC(=O)CSc2ccc(C(F)(F)F)cc2[N+](=O)[O-])ccc1F 481161938 KBLARQFVSQMTSI-UHFFFAOYSA-N 497.426 5.637 5 20 JKBD Cc1nn(Cc2ccc(C(=O)Nc3ccc(F)cc3-c3ccc(F)cc3)cc2)c(C)c1[N+](=O)[O-] 485726027 WZECYWIHHRUMLA-UHFFFAOYSA-N 462.456 5.654 5 20 JKBD CCOc1ccccc1Oc1ccc(CNC(=O)c2csc(-c3cccc([N+](=O)[O-])c3)n2)cn1 496245641 NMGYRCXCTGZDHO-UHFFFAOYSA-N 476.514 5.234 5 20 JKBD O=C(Nc1ccc(Cl)cc1NC(=O)c1ccco1)c1csc(-c2cccc([N+](=O)[O-])c2)n1 496248928 YECOKJYTGOFTCY-UHFFFAOYSA-N 468.878 5.469 5 20 JKBD C[C@H](c1ccccc1)N(C(=O)c1ccc(Sc2nncn2C)c([N+](=O)[O-])c1)c1ccccc1 498005575 HBRLCZYUNFQERZ-QGZVFWFLSA-N 459.531 5.283 5 20 JKBD O=C(N[C@H]1CCOc2c(-c3ccccc3)cccc21)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-] 505107956 LOUNJYNWXXBPPP-FQEVSTJZSA-N 472.419 5.457 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Br)[C@@H](NCc1ccc(F)c(Cl)c1)c1ccccc1 507887123 QCZPJCYGBCAYQQ-FQEVSTJZSA-N 492.732 5.619 5 20 JKBD CC[C@@H]1c2ccsc2CCN1C(=O)C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1 515078621 YHGCCUKMJWETCV-JVCJXORTSA-N 489.622 6.733 5 20 JKBD O=[N+]([O-])c1ccc(-c2ccc(CNCc3ccc(N4CCc5ccccc5C4)nc3)s2)cc1 555196523 XYHJOROHVKMNGR-UHFFFAOYSA-N 456.571 5.571 5 20 JKBD CC(C)N(Cc1nc(O)c2ccccc2n1)C(=O)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1 603223921 UGHQELIACRYCMF-UHFFFAOYSA-N 492.919 5.740 5 20 JKBD CN(Cc1ccccc1[N+](=O)[O-])C(=O)NC[C@@H](c1ccccc1Cl)c1c[nH]c2ccccc12 603746267 GULMMIUGXXZHIY-FQEVSTJZSA-N 462.937 5.703 5 20 JKBD Cc1ccc(NS(=O)(=O)c2ccc(N3CCCC[C@@H]3c3noc(C4CC4)n3)c([N+](=O)[O-])c2)c(C)c1 603872199 COVQVVUWHVRUDF-OAQYLSRUSA-N 497.577 5.004 5 20 JKBD CSc1ccc(C(=O)c2ccccc2C(=O)Nc2cc(NC(C)=O)ccc2Cl)cc1[N+](=O)[O-] 604012234 QTFDEVFNZPBVBA-UHFFFAOYSA-N 483.933 5.412 5 20 JKBD CSc1ccc([N+](=O)[O-])c(C(=O)N(C)CCCCCc2cc(-c3cccc(F)c3)n[nH]2)c1 604194262 IMROVSRHDLIKHW-UHFFFAOYSA-N 456.543 5.331 5 20 JKBD C[C@H]1CN(C(=O)c2c3c(nc4ccccc24)/C(=C\c2ccc([N+](=O)[O-])cc2)CCC3)CCCO1 608946516 QLUBEKASFGPBAC-OBKVJGTNSA-N 457.530 5.271 5 20 JKBD CN(C(=O)c1nn(-c2cc(C(F)(F)F)cc(C(F)(F)F)c2)c2c1CCC2)c1ccc([N+](=O)[O-])cc1 609094429 VEFPCQXPDWCZJB-UHFFFAOYSA-N 498.383 5.583 5 20 JKBD Cc1ccc(-c2csc(NC(=O)c3ccccc3SCc3ccco3)n2)cc1[N+](=O)[O-] 619729726 QWWPFXPYFOMMTB-UHFFFAOYSA-N 451.529 6.164 5 20 JKBD Cc1ccsc1C(=O)Nc1ccc(OC(=O)Cn2c3ccccc3c(=O)c3ccccc32)cc1 729217233 XFBUKOSEJNKAME-UHFFFAOYSA-N 468.534 5.383 5 20 JKBD COc1ccc([C@@H]2CCCCCN2C(=O)COC(=O)c2csc(-c3ccc([N+](=O)[O-])cc3)n2)cc1 747954970 QGULQXCXLRIYIA-QFIPXVFZSA-N 495.557 5.028 5 20 JKBD Cc1ccc(-c2nc(C)sc2CC(=O)O[C@@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)cc1 763720206 BLFZDPQMUAGQJG-AWEZNQCLSA-N 464.503 5.232 5 20 JKBD COc1cc([C@H](C)Nc2cc([N+](=O)[O-])c(OC)c(Br)c2[N+](=O)[O-])ccc1OC(C)C 915210989 JSSUEGQIWGJPRJ-NSHDSACASA-N 484.303 5.243 5 20 JKBD CC(C)N(Cc1nnc(-c2cccc([N+](=O)[O-])c2)o1)C(=O)Cc1csc(-c2ccc(Cl)cc2)n1 916550877 VKRZHJQQTXTSCO-UHFFFAOYSA-N 497.964 5.401 5 20 JKBD C[C@H]1Sc2ccc(C(=O)Nc3cc(Cl)c([N+](=O)[O-])cc3OCc3ccccc3)cc2NC1=O 916827739 VQCPGYGSRHSNTM-CYBMUJFWSA-N 483.933 5.512 5 20 JKBD C[C@@H](Nc1ccc(C(=O)Nc2cccc(-c3cn4c(n3)CCCC4)c2)cc1[N+](=O)[O-])c1ccccn1 919719524 OCTGGSLMZGIJOF-GOSISDBHSA-N 482.544 5.615 5 20 JKBD CC(C)c1nn2ccccc2c1C(=O)NC1(c2ccc(NC(=O)c3ccc([N+](=O)[O-])o3)cc2)CCC1 1785748859 MOSWYLLSAKKFSU-UHFFFAOYSA-N 487.516 5.020 5 20 JKBD Cc1cccc(Cl)c1C(=O)Nc1ccc(C2(NC(=O)c3ccc([N+](=O)[O-])o3)CCC2)cc1 1790681462 ABSWWMZSFZMYKY-UHFFFAOYSA-N 453.882 5.211 5 20 JKBD Cc1c(C(=O)Nc2cc([C@H]3CCCCN3C(=O)c3cc(F)cc([N+](=O)[O-])c3)[nH]n2)oc2ccccc12 1818569904 QCKHBIFOEOWLMJ-HXUWFJFHSA-N 491.479 5.131 5 20 JKBD O=C(/C=C/c1ccccc1[N+](=O)[O-])Nc1cc([C@@H]2CCCCN2C(=O)c2ccc(Cl)s2)[nH]n1 1823501706 XUEDTXQNCKCPBC-YRYLYKBFSA-N 485.953 5.052 5 20 JKBD CC(C)[C@@H](C(=O)N1CCCC[C@H]1C1CCN(C(=O)/C=C/c2ccc([N+](=O)[O-])o2)CC1)c1ccccc1 1824235575 LXECHXWOUOROGB-YWKSOQAPSA-N 493.604 5.261 5 20 JKBD CC1=CC[C@H](C(=O)N2CCC([C@H]3CCCCN3C(=O)C3(c4cccc([N+](=O)[O-])c4)CCC3)CC2)CC1 1830293150 SVLXQVTUAVMDIP-JYFHCDHNSA-N 493.648 5.383 5 20 JKBD CC[C@H](C)CC(=O)N1CCC([C@H]2CCCCN2C(=O)c2cc(Br)ccc2[N+](=O)[O-])CC1 1830563474 BUILXVNYUPMYFC-OXJNMPFZSA-N 494.430 5.027 5 20 JKBD Cc1cc2[nH]c(C(=O)N3CCCC[C@@H]3C3CCN(C(=O)c4cc(F)cc([N+](=O)[O-])c4)CC3)cc2s1 1830889509 BYLQDTNRSHJHBU-JOCHJYFZSA-N 498.580 5.132 5 20 JKBD Cc1ccc(C(=O)N2CCC([C@H]3CCCCN3C(=O)/C=C/c3ccccc3[N+](=O)[O-])CC2)c(F)c1F 1832903701 HYZFXQXJEBFVKD-RSNBEDGSSA-N 497.542 5.128 5 20 JKBD O=C(NCc1ccc(NC(=O)c2ccco2)cc1)c1ccc(Nc2ccccc2)c([N+](=O)[O-])c1 11363323 NSXCCLYOYAXXOH-UHFFFAOYSA-N 456.458 5.114 5 20 JKBD O=C(Nc1cccc(C(F)(F)F)c1)c1cccc(NC(=O)c2cc([N+](=O)[O-])cc([N+](=O)[O-])c2)c1 14567127 LYMMBLHJSALKFT-UHFFFAOYSA-N 474.351 5.026 5 20 JKBD COc1ccccc1CN(Cc1cccs1)C(=O)C1CCN(c2ccccc2[N+](=O)[O-])CC1 16015026 PMJFAKYEYVVKQW-UHFFFAOYSA-N 465.575 5.110 5 20 JKBD CC(C)c1ccc(CSc2nnc(SCC(=O)N3CCc4cc([N+](=O)[O-])ccc43)s2)cc1 16116736 OKKWBXFYOFIUEG-UHFFFAOYSA-N 486.644 5.543 5 20 JKBD COc1ccc(NC(=O)[C@H](OC(=O)[C@H](C)Sc2ccc([N+](=O)[O-])cc2)c2ccccc2)cc1 16118555 YRERYBFBAZHXEI-KSFYIVLOSA-N 466.515 5.007 5 20 JKBD Cc1nn(-c2ccc(C(=O)O[C@H](C)c3nnc(-c4ccc([N+](=O)[O-])cc4)o3)cc2)c(C)c1Cl 17534220 AAABRBSNZYIMEO-CQSZACIVSA-N 467.869 5.019 5 20 JKBD CCOc1c(Br)cc(Cl)cc1NC(=O)Cn1c2ccccc2c(=O)c2ccccc21 22187015 RXPIKOCKBHBTPQ-UHFFFAOYSA-N 485.765 5.608 5 20 JKBD Cc1cc(Br)c(NC(=O)COc2ccc([N+](=O)[O-])cc2Cl)c(Br)c1 28451594 IBFQKYAFWHEAFV-UHFFFAOYSA-N 478.524 5.099 5 20 JKBD Cc1ccc(-n2c(SCc3nnc(-c4ccc([N+](=O)[O-])cc4)o3)nnc2-c2ccccc2F)cc1 29827314 IZIGHAJPCQRESR-UHFFFAOYSA-N 488.504 5.632 5 20 JKBD COc1ccc(Oc2ccc([N+](=O)[O-])cc2C(=O)Nc2ccc(C(=O)NCC(C)C)cc2C)cc1 68803088 ZPULXHPFVFFMHR-UHFFFAOYSA-N 477.517 5.342 5 20 JKBD C[C@H](Nc1ccc(C(=O)NC2(c3ccc(Br)cc3)CC2)cc1[N+](=O)[O-])c1ccccn1 109341383 FJEAWZKMYJKXSB-HNNXBMFYSA-N 481.350 5.345 5 20 JKBD CN(Cc1cn(Cc2ccccc2Cl)nc1-c1ccccc1)C(=O)c1ccc([N+](=O)[O-])o1 482784667 XQSXOESJBKAYQA-UHFFFAOYSA-N 450.882 5.025 5 20 JKBD CCOc1ccc([C@H](NC(=O)c2cc(OCC(F)(F)F)ccc2[N+](=O)[O-])c2ccccc2)cc1 485477055 GPZNMUONGAFFJO-JOCHJYFZSA-N 474.435 5.454 5 20 JKBD O=C(Nc1cc(Cl)cc(Cl)c1)[C@@H]1CCCN1C(=O)c1csc(-c2ccc([N+](=O)[O-])cc2)n1 495485075 SIMVZHBHEKZXAY-SFHVURJKSA-N 491.356 5.268 5 20 JKBD COc1ccc2c(C)cc3nnc(S[C@H](C)c4nnc(-c5ccc([N+](=O)[O-])cc5)o4)n3c2c1 501226506 IJDAHYLDVUQCFM-CYBMUJFWSA-N 462.491 5.011 5 20 JKBD CCCCc1ccc([C@@H](NC(=O)c2cc(OC)c(OC)cc2[N+](=O)[O-])c2cccs2)cc1 503185876 CTRLIZAGHZNGPW-HSZRJFAPSA-N 454.548 5.536 5 20 JKBD O=C(Nc1ccc(Br)cc1)C1CCN(C(=O)c2cc3ccccc3c3cccnc23)CC1 505008129 FMVNSRDGLDNVLI-UHFFFAOYSA-N 488.385 5.641 5 20 JKBD C[C@@H](Nc1ccc(C(=O)Nc2nc3c(C(F)(F)F)cccc3s2)cc1[N+](=O)[O-])c1ccccn1 505980388 BAOMEGCLFLJGNY-GFCCVEGCSA-N 487.463 6.044 5 20 JKBD C[C@H](N[C@H](CCc1ccccc1)c1ccccc1)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 515431930 RHROHHHKSVXUQT-HTAPYJJXSA-N 471.479 5.904 5 20 JKBD Cc1c(NC(=O)c2ccccc2)cccc1NC(=O)c1cc([N+](=O)[O-])ccc1Oc1ccccc1 515508062 XYZSWOXCTKWHBE-UHFFFAOYSA-N 467.481 6.200 5 20 JKBD CC(=O)Nc1ccc(Cl)cc1NC(=O)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1 521843193 QKPIWCMCDWMUJK-UHFFFAOYSA-N 460.273 5.905 5 20 JKBD NC(=O)c1cccc(NC(=O)c2c3c(nc4ccccc24)/C(=C\c2cccc([N+](=O)[O-])c2)CCC3)c1 600840798 ZJLODALKIYHFEU-JXAWBTAJSA-N 478.508 5.371 5 20 JKBD O=C(Nc1ccc(F)cc1Cl)c1ccccc1NCc1nc(-c2ccc([N+](=O)[O-])cc2)no1 604007938 WFGHGIQUMJZXDD-UHFFFAOYSA-N 467.844 5.302 5 20 JKBD CCCOc1ccccc1Oc1ncccc1CNC(=O)N[C@H](C)c1cccc([N+](=O)[O-])c1 604127476 PLQICAZBLOMJAD-QGZVFWFLSA-N 450.495 5.131 5 20 JKBD O=C(Nc1ccc(-c2cn3cccnc3n2)cc1)c1cc([N+](=O)[O-])ccc1Sc1ccccc1 604338027 ALDKLUVYZLXMGT-UHFFFAOYSA-N 467.510 5.708 5 20 JKBD CC(C)c1noc2nc(-c3ccco3)cc(C(=O)O[C@H](C)c3nnc(-c4ccc([N+](=O)[O-])cc4)o3)c12 727920789 ZRKHCEGLSMPURW-CYBMUJFWSA-N 489.444 5.482 5 20 JKBD O=C(c1csc(COc2ccc(F)cc2)n1)N(CC1CC1)c1ccc(Cl)c([N+](=O)[O-])c1 728166238 XFVZTTBSSHXVTB-UHFFFAOYSA-N 461.902 5.480 5 20 JKBD C[C@H](OC(=O)c1ccc(Oc2ccccc2)c(N)c1)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 728638535 CZNQPPZDZQCWLW-ZDUSSCGKSA-N 489.406 5.172 5 20 JKBD Cc1c(NC(=O)[C@@H](C)OC(=O)CCC(=O)c2ccc3c(c2)-c2ccccc2C3)cccc1[N+](=O)[O-] 746633038 BFKHOUDBPMZFKW-QGZVFWFLSA-N 472.497 5.008 5 20 JKBD Cc1c(C(=O)O[C@H](C)c2cccc(NC(=O)c3ccccc3)c2)cc([N+](=O)[O-])c(C)c1[N+](=O)[O-] 748943309 GFLKQAZNXJAFDZ-MRXNPFEDSA-N 463.446 5.290 5 20 JKBD O=c1c2ccccc2n(Cc2nc(-c3ccc(Cn4cnc5ccccc54)cc3)no2)c2ccccc12 904472990 MRCVZPQPNFYBCM-UHFFFAOYSA-N 483.531 5.651 5 20 JKBD O=[N+]([O-])c1c(-c2nc(-c3cccc(OCc4cccnc4)c3)no2)ccnc1-c1ccccc1 904501793 CROOMSOYLYPUFP-UHFFFAOYSA-N 451.442 5.348 5 20 JKBD C[C@@H](Nc1ccc(-c2nc(C3(NC(=O)OC(C)(C)C)CCC3)no2)cc1[N+](=O)[O-])c1ccccn1 904558118 UEAAJKOVVHZXPR-OAHLLOKOSA-N 480.525 5.117 5 20 JKBD COc1c([N+](=O)[O-])cc(N[C@H](C)c2ccc(OC(F)F)cc2)c([N+](=O)[O-])c1Br 913046411 CODNCIOBEKXHCO-MRVPVSSYSA-N 462.203 5.049 5 20 JKBD CC(C)N(Cc1ccc([N+](=O)[O-])cc1)Cn1nc(-c2ccc(F)c(F)c2)c2ccccc2c1=O 919950961 ZYBQTPRLRHPZBQ-UHFFFAOYSA-N 464.472 5.118 5 20 JKBD C[C@H](Nc1ccc(C(=O)OCc2nc3ccccc3n2C(F)F)cc1[N+](=O)[O-])c1ccccn1 920116455 DTUYAAXKLOQALL-AWEZNQCLSA-N 467.432 5.265 5 20 JKBD O=C(NC1(c2ccc(NC(=O)[C@@H]3CCC(F)(F)C3)cc2)CCC1)c1cc2cc([N+](=O)[O-])ccc2s1 1785805123 SFQZOABNWMRUJT-OAHLLOKOSA-N 499.539 5.993 5 20 JKBD CC1=CC[C@H](C(=O)Nc2ccc(C3(NC(=O)c4cc([N+](=O)[O-])c(O)cc4C)CCC3)cc2)CC1 1789115613 YIMAVHBKAHXTSC-SFHVURJKSA-N 463.534 5.103 5 20 JKBD CN(C)c1ccc([N+](=O)[O-])c(C(=O)Nc2ccc(C3(NC(=O)CSC4CCCC4)CCC3)cc2)c1 1790055108 ZHXOTYDEFVQJQU-UHFFFAOYSA-N 496.633 5.084 5 20 JKBD O=C(NC1(c2ccc(NC(=O)c3ccc([N+](=O)[O-])cc3F)cc2)CCC1)c1ccc2occc2c1 1790621608 BAFUHSUQYIHIHJ-UHFFFAOYSA-N 473.460 5.542 5 20 JKBD O=C(/C=C/c1ccccc1[N+](=O)[O-])NC1(c2ccc(NC(=O)c3onc4ccccc34)cc2)CCC1 1790908880 QVPUVZYRMAYYHH-XNTDXEJSSA-N 482.496 5.197 5 20 JKBD O=C(CSc1ccccc1[N+](=O)[O-])Nc1ccc(C2(NC(=O)[C@@H]3CCC(F)(F)C3)CCC2)cc1 1791521795 LEGMYJKXHSPTPR-MRXNPFEDSA-N 489.544 5.256 5 20 JKBD O=C(CSc1ccccc1[N+](=O)[O-])N1CCC([C@@H]2CCCCN2C(=O)[C@H](F)c2ccccc2)CC1 1824862395 YQDLHYOARLKAEC-SQJMNOBHSA-N 499.608 5.017 5 20 JKBD CC[C@@H](C(=O)N1CCCC[C@@H]1C1CCN(C(=O)Cc2cc(F)ccc2[N+](=O)[O-])CC1)c1ccccc1 1826317021 OQYGNXCAJDHOGK-JWQCQUIFSA-N 495.595 5.090 5 20 JKBD O=C(c1cc2cc([N+](=O)[O-])ccc2s1)N1CCC([C@H]2CCCCN2C(=O)c2cccc(F)c2)CC1 1829963518 KREROVSQEPDQNX-JOCHJYFZSA-N 495.576 5.496 5 20 JKBD Cc1ccc(CC(=O)N2CCCC[C@H]2C2CCN(C(=O)c3ccc(Cl)s3)CC2)cc1[N+](=O)[O-] 1830363016 LTUHQFGPDSIDID-IBGZPJMESA-N 490.025 5.094 5 20 JKBD Cc1cc(Cl)c(Cl)cc1C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2ccc([N+](=O)[O-])o2)CC1 1830781324 ROEMZGPBCXOKDE-LJQANCHMSA-N 494.375 5.350 5 20 JKBD O=C(c1ccc([N+](=O)[O-])o1)N1CCC([C@@H]2CCCCN2C(=O)C2(c3ccc(Cl)cc3)CCC2)CC1 1831303525 WGMLHQMWURHQBD-NRFANRHFSA-N 499.995 5.196 5 20 JKBD O=C(c1cccc2cc[nH]c12)N1CCC([C@H]2CCCCN2C(=O)/C=C/c2ccccc2[N+](=O)[O-])CC1 1832907164 NPTQUXNCTRXRJU-UWHSVAFCSA-N 486.572 5.023 5 20 JKBD CCN(C(=O)[C@H](C)OC(=O)c1ccccc1C(=O)c1ccc(Cl)c([N+](=O)[O-])c1)c1ccccc1 3556460 DVGGYFKBRQHAGO-INIZCTEOSA-N 480.904 5.078 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Cl)[C@H](NCc1ccccc1OC(F)F)c1ccccc1 11040105 HPYPKOOUEPACIE-HXUWFJFHSA-N 461.852 5.319 5 20 JKBD C[C@H](Sc1nn(-c2ccc(Cl)cc2)c(=S)s1)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 17662034 ZALMBKVIZWFMTC-JTQLQIEISA-N 477.980 6.128 5 20 JKBD CCCCn1c(S[C@@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2C(F)(F)F)nc2ccccc2c1=O 21352524 WFCTXFTZRAXMSM-ZDUSSCGKSA-N 494.495 5.243 5 20 JKBD COc1ccc(OCc2csc(N(C(C)=O)c3c(C)cc(C)cc3Cl)n2)c([N+](=O)[O-])c1 22044305 PPYMXRSIZZOWTE-UHFFFAOYSA-N 461.927 5.594 5 20 JKBD O=C(Cn1cnc(-c2ccc([N+](=O)[O-])cc2)n1)Nc1ccccc1Sc1ccc(Cl)cc1 72066314 UYRCEXBWIDKJEO-UHFFFAOYSA-N 465.922 5.297 5 20 JKBD COc1ccc(NC(=O)c2cc3cccc([N+](=O)[O-])c3[nH]2)cc1NC(=O)c1ccc(Cl)cc1F 108692909 WZDZWQBWBUWIFG-UHFFFAOYSA-N 482.855 5.382 5 20 JKBD Cc1ccc(Cl)cc1N1CCN(C(=O)c2ccc(N[C@@H](C)c3ccccn3)c([N+](=O)[O-])c2)CC1 303044223 WWHZROOTISBHCC-SFHVURJKSA-N 479.968 5.087 5 20 JKBD Cc1cc(C(=O)N2CCC(C)CC2)ccc1NC(=O)c1csc(-c2ccc([N+](=O)[O-])cc2)n1 496610024 GWJVWYMRVILZNM-UHFFFAOYSA-N 464.547 5.151 5 20 JKBD O=C(Nc1cccc(C(=O)N2CCc3ccccc32)c1)c1csc(-c2cccc([N+](=O)[O-])c2)n1 499669806 JBFRAVXVNJLVMF-UHFFFAOYSA-N 470.510 5.174 5 20 JKBD C[C@@H](Nc1ccc(C(=O)NCc2ccnc(OCc3ccccc3)c2)cc1[N+](=O)[O-])c1ccccn1 507034883 IYHYPTNDWHINQA-LJQANCHMSA-N 483.528 5.067 5 20 JKBD CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)Nc1cc(-c2nnc3n2CCCCC3)ccc1F 509942593 HKRGHDAVNFCJGK-UHFFFAOYSA-N 466.517 5.161 5 20 JKBD COc1cccc([C@@H](C)N[C@@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Br)c2ccccc2)c1 511014591 MSERGHPFFUEAOQ-IVZQSRNASA-N 484.350 5.397 5 20 JKBD CCC(=O)Nc1ccc(Cl)c(NC(=O)c2ccc(N[C@H](C)c3ccccn3)c([N+](=O)[O-])c2)c1 512576579 HHJBVIJRFQHAAE-CQSZACIVSA-N 467.913 5.417 5 20 JKBD O=[N+]([O-])c1cc(CNCc2ccc(OCc3ccccn3)cc2)ccc1Oc1ccc(F)cc1 513061286 KHMFHRMQUUQLLX-UHFFFAOYSA-N 459.477 5.790 5 20 JKBD C[C@H](NC(=O)c1cc([N+](=O)[O-])ccc1NCc1ccccc1)c1nc2ccccc2n1C(F)F 514909778 BHOWSZBIDDWYOU-HNNXBMFYSA-N 465.460 5.443 5 20 JKBD C[C@@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)Nc1ccc(C(=O)N(C)C2CCCCC2)cc1 520389656 BTTYZLNJNITOSY-OAHLLOKOSA-N 459.930 5.059 5 20 JKBD Cc1sc(C(=O)Nc2ccc3c(c2)CCC(=O)N3Cc2ccc(Cl)cc2)cc1[N+](=O)[O-] 521549334 XBGIAUOXLITMQV-UHFFFAOYSA-N 455.923 5.350 5 20 JKBD COc1ccc(-c2ccc(CNCC3(c4cc(C)ccc4OC)CCOCC3)o2)c([N+](=O)[O-])c1 521831494 XOJKBOOZSOJFRF-UHFFFAOYSA-N 466.534 5.018 5 20 JKBD COc1ccc(OC)c(-c2csc(NC(=O)c3csc(-c4cccc([N+](=O)[O-])c4)n3)n2)c1 522635864 SPUCMXXGFZBPMN-UHFFFAOYSA-N 468.516 5.111 5 20 JKBD O=C(Nc1ccn(Cc2ccncc2)n1)c1cc([N+](=O)[O-])ccc1Sc1ccc(Cl)cc1 522792891 WLZANDNCEKIFBN-UHFFFAOYSA-N 465.922 5.292 5 20 JKBD CNc1ccc(C(=O)Nc2ccccc2OCc2ncc(-c3cccc(Cl)c3)o2)cc1[N+](=O)[O-] 524225163 VZGLQEGAGZJJHL-UHFFFAOYSA-N 478.892 5.776 5 20 JKBD CN1C/C(=C/c2ccc(-c3ccc([N+](=O)[O-])cc3)s2)c2nc3ccccc3c(C(=O)O)c2C1 591631561 WNUFXBJPDQRFRB-VBKFSLOCSA-N 457.511 5.556 5 20 JKBD O=C(C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)Nc1ccc(N2CCCC2)nc1 603475035 BIDHJIFDABZDFJ-CYVLTUHYSA-N 485.569 5.769 5 20 JKBD CNC(=O)Cc1ccc(NC(=O)C/C(=C\c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)cc1 603490003 GNLSXCCJKADPQW-XMHGGMMESA-N 486.553 5.062 5 20 JKBD CCc1sc(NC(=O)c2cc(OCC(F)(F)F)ccc2[N+](=O)[O-])nc1-c1ccccc1 603928601 QLNDTJZDPKAZSY-UHFFFAOYSA-N 451.426 5.474 5 20 JKBD CCC(C)(C)NC(=O)c1ccc(NC(=O)c2cc(OC)c(OC(F)F)cc2[N+](=O)[O-])cc1Cl 603987032 ILJQOKONSWAXCX-UHFFFAOYSA-N 485.871 5.029 5 20 JKBD O=[N+]([O-])c1ccc(-c2nn(-c3ccccc3)cc2CN[C@@H](CC(F)(F)F)c2ccccc2)cc1 608836071 IAOLMLWMONZKIA-QHCPKHFHSA-N 466.463 6.231 5 20 JKBD O=C(Nc1ccccc1N1CCOC1=O)c1ccc(NCc2ccccc2Cl)c([N+](=O)[O-])c1 726508084 XQJZBQCGIKMYKQ-UHFFFAOYSA-N 466.881 5.069 5 20 JKBD CC[C@@H](C)Sc1ccc(NC(=O)[C@@H]2CC(=O)N(c3ccc(F)c([N+](=O)[O-])c3)C2)c(C(F)(F)F)c1 748656371 GUMKFJXHLQQALU-CHWSQXEVSA-N 499.486 5.635 5 20 JKBD Cc1ccc(C(=O)N2C[C@@H](C)C[C@H](C)C2)cc1NC(=O)c1cc([N+](=O)[O-])ccc1Br 751093061 KDCKNMVIMPORPJ-KBPBESRZSA-N 474.355 5.036 5 20 JKBD CCCOc1cc(NC(=O)C[C@H]2c3ccccc3C=CN2C(C)=O)c([N+](=O)[O-])cc1OCCC 790522969 SULCBRAIYCOIHI-NRFANRHFSA-N 467.522 5.075 5 20 JKBD O=C(Nc1nc(Cc2ccc(Br)cc2)cs1)c1cc([N+](=O)[O-])ccc1Cl 864784236 UYIXOLLACIJRPK-UHFFFAOYSA-N 452.717 5.310 5 20 JKBD O=C(Nc1ccc(OC(=O)[C@@H]2CCCc3ccccc32)cc1)c1cc([N+](=O)[O-])ccc1Cl 907269923 XQSVBURDIZKHHD-HXUWFJFHSA-N 450.878 5.526 5 20 JKBD COC(=O)c1c(NC(=O)c2cc([N+](=O)[O-])cnc2C)sc(C)c1-c1ccc(Cl)cc1Cl 914527710 VKVIJLXEEJGJLH-UHFFFAOYSA-N 480.329 5.681 5 20 JKBD O=C(OCc1nc2ccccc2c2ccccc12)c1cccc(CS(=O)(=O)c2ccccc2)c1 919382354 OLQRKNRCWRVLLR-UHFFFAOYSA-N 467.546 5.719 5 20 JKBD COc1cc(C(=O)Oc2ccc(Oc3ccccn3)cc2)c([N+](=O)[O-])cc1OCc1cscn1 919995271 ZGBIDXJYAWDBSW-UHFFFAOYSA-N 479.470 5.045 5 20 JKBD Cc1cc(=O)oc2cc(OC(=O)c3ccc(N[C@H](C)c4ccccn4)c([N+](=O)[O-])c3)c(Cl)cc12 920113513 GFXGRXHECRLYAW-CQSZACIVSA-N 479.876 5.450 5 20 JKBD COCCOC(=O)Nc1cccc(NC(=O)c2ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])cc2)c1 920229552 MZVATCHMRYIVEP-UHFFFAOYSA-N 485.880 5.488 5 20 JKBD CCCc1noc2nc(-c3ccco3)cc(C(=O)O[C@H](C)C(=O)Nc3cc([N+](=O)[O-])ccc3Cl)c12 920680038 KNLYZSAWXDVWRL-GFCCVEGCSA-N 498.879 5.181 5 20 JKBD Cc1cc(CCCC(=O)NC2(c3ccc(NC(=O)c4cccnc4)cc3)CCC2)c([N+](=O)[O-])cc1F 1787300736 KKHLRSFOZSYDKD-UHFFFAOYSA-N 490.535 5.208 5 20 JKBD O=C(NC1(c2ccc(NC(=O)c3cccc4cc[nH]c34)cc2)CCC1)c1nc2cc([N+](=O)[O-])ccc2[nH]1 1789094068 SAOPVBZIHOPBDC-UHFFFAOYSA-N 494.511 5.014 5 20 JKBD O=C(NC1(c2ccc(NC(=O)c3sccc3Cl)cc2)CCC1)c1cc(O)cc([N+](=O)[O-])c1 1789903184 PJKQHRUFOMPKLI-UHFFFAOYSA-N 471.922 5.077 5 20 JKBD Cc1nc(C(=O)Nc2ccc(C3(NC(=O)/C=C/c4ccccc4[N+](=O)[O-])CCC3)cc2)sc1C 1789984865 SAGYZCFOKQPMCI-MDWZMJQESA-N 476.558 5.129 5 20 JKBD Cc1ccc(C(=O)NC2(c3ccc(NC(=O)C4(c5cccc([N+](=O)[O-])c5)CCC4)cc3)CCC2)c(C)n1 1790476012 SGRMXNDVRIBPDC-UHFFFAOYSA-N 498.583 5.476 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)c3nc4cc([N+](=O)[O-])ccc4[nH]3)CCC2)cc1)c1ccc2ccoc2c1 1790892316 GFSBMLIVWWYCIW-UHFFFAOYSA-N 495.495 5.279 5 20 JKBD O=C(NC1(c2ccc(NC(=O)[C@@]3(F)CCCC=C3F)cc2)CCC1)c1cc(F)cc([N+](=O)[O-])c1 1792378767 AFMXAERAMFTZSJ-XMMPIXPASA-N 473.451 5.227 5 20 JKBD O=C(c1cccc(F)c1[N+](=O)[O-])N1[C@H]2CC[C@@H]1C[C@H](NC(=O)C1(c3cccc(Cl)c3)CCCC1)C2 1800530645 ROTMFOSRVGCMAJ-ACDBMABISA-N 499.970 5.151 5 20 JKBD Cc1cc2cc(C(=O)N[C@@H]3C[C@@H]4CC[C@H](C3)N4C(=O)c3cc4cc([N+](=O)[O-])ccc4s3)ccc2[nH]1 1801206681 FHSDMJPNVJKWTQ-ACDBMABISA-N 488.569 5.165 5 20 JKBD C[C@@H]1CCC[C@H]1C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)[nH]n1 1818960250 RSHPEONQMVDFBA-LSBZLQRGSA-N 481.578 5.275 5 20 JKBD C/C(=C\c1ccc(C)o1)C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2c(F)ccc([N+](=O)[O-])c2C)[nH]n1 1819492599 FFPLCLOOBQLLPE-ZISLFAKRSA-N 495.511 5.076 5 20 JKBD Cc1c(C(=O)N2CCC([C@@H]3CCCCN3C(=O)[C@@H]3CCC(F)(F)C3)CC2)cc(Cl)cc1[N+](=O)[O-] 1823695445 IVZHMNUFMJZTNR-XLIONFOSSA-N 497.970 5.225 5 20 JKBD CC1=CC[C@@H](C(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3cc4cc([N+](=O)[O-])ccc4s3)CC2)CC1 1828352269 KBSVVBZTEQLWEW-NFBKMPQASA-N 495.645 5.789 5 20 JKBD Cc1cc(C)c(NC(=O)[C@@H](C)OC(=O)c2ccccc2C(=O)c2ccc(Cl)c([N+](=O)[O-])c2)c(C)c1 11029304 PICIDZYMQPIOMX-QGZVFWFLSA-N 494.931 5.588 5 20 JKBD CC(=O)Nc1ccc(NC(=O)c2ccc(NCc3ccccc3Cl)c([N+](=O)[O-])c2)cc1Cl 12735304 KEVJSXSTGMPSNJ-UHFFFAOYSA-N 473.316 5.724 5 20 JKBD COc1ccc(NC(=O)c2ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])c(OC)c2)c(OC)c1 15654171 DVKJITYOVXNDSX-UHFFFAOYSA-N 458.854 5.319 5 20 JKBD Cc1ccccc1[C@H](C)NC(=O)[C@H](C)OC(=O)c1ccccc1C(=O)c1ccc(Cl)c([N+](=O)[O-])c1 22669902 BMZBILYZIOVXIJ-IRXDYDNUSA-N 494.931 5.210 5 20 JKBD COc1ccc(-c2nnc(SCC(=O)Nc3ccc([N+](=O)[O-])cc3OC)n2C2CCCCC2)cc1 28606479 YRTIFHLXPFUGJB-UHFFFAOYSA-N 497.577 5.107 5 20 JKBD C[C@H]1c2cc3c(cc2C2(CCCC2)CN1C(=O)Cn1c2ccccc2c(=O)c2ccccc21)OCCO3 39539797 ZTPYESNOWKBLAQ-FQEVSTJZSA-N 494.591 5.341 5 20 JKBD CN(C)Cc1ccc(-c2ccccc2CNC(=O)c2cc(OCC(F)(F)F)ccc2[N+](=O)[O-])cc1 71947813 RFQQQZYHJYYUSH-UHFFFAOYSA-N 487.478 5.195 5 20 JKBD C[C@H](Nc1ccc(C(=O)NCc2ccc(CN3CCCC[C@H]3C)cc2)cc1[N+](=O)[O-])c1ccccn1 302979514 JJIDPSDTTMVSQL-RTWAWAEBSA-N 487.604 5.467 5 20 JKBD COCCN(C(=O)c1cc(SC)c(OC)cc1[N+](=O)[O-])[C@@H](C)c1cccc(C(F)(F)F)c1 482416327 SRDBMMXIASDUQH-ZDUSSCGKSA-N 472.485 5.194 5 20 JKBD O=C(Nc1ccc(-n2cccn2)cc1C(F)(F)F)c1csc(-c2cccc([N+](=O)[O-])c2)n1 496305267 HQPCOUHGLFQROD-UHFFFAOYSA-N 459.409 5.175 5 20 JKBD Cc1cccc([N+](=O)[O-])c1NC(=O)CSc1nc(-c2cccs2)c(-c2cccs2)[nH]1 501828353 LNICQLYXOOBKLV-UHFFFAOYSA-N 456.574 5.814 5 20 JKBD Cc1ccc(C(=O)N2C[C@@H](C)C[C@@H](C)C2)cc1NC(=O)Cn1c2ccccc2c(=O)c2ccccc21 515612716 NKFLRWURWSHJTF-BGYRXZFFSA-N 481.596 5.220 5 20 JKBD CN(C(=O)c1cccc(NC(=O)Cn2c3ccccc3c(=O)c3ccccc32)c1)c1ccccc1 516530769 DWORNMBDIQRODI-UHFFFAOYSA-N 461.521 5.070 5 20 JKBD CSc1ccc(C(=O)c2ccccc2C(=O)Nc2cccc(-c3nccn3C)c2)cc1[N+](=O)[O-] 518305703 GRRNBMOSTWTKTD-UHFFFAOYSA-N 472.526 5.201 5 20 JKBD Cc1cc(C(=O)N2CCCC[C@@H]2C)ccc1NC(=O)c1ccc(N2CCC[C@@H](C)C2)c([N+](=O)[O-])c1 520680758 GQZKBBMMOCJEHE-QUCCMNQESA-N 478.593 5.406 5 20 JKBD O=C(Nc1ccc(-c2nnc3n2CCCC3)cc1)c1ccc(Nc2ccccc2)c([N+](=O)[O-])c1 521792444 JSCSBFVMXOBWIM-UHFFFAOYSA-N 454.490 5.186 5 20 JKBD COc1cc(C(=O)Nc2nccc(-c3ccccc3)n2)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 585709567 YUDMSXBPNGNJLD-UHFFFAOYSA-N 476.876 5.758 5 20 JKBD Cc1ccc(C(C)C)c(Oc2ccc(CNCc3cccnc3N3CCOCC3)cc2[N+](=O)[O-])c1 603633160 FZJKWXCRUIDYDB-UHFFFAOYSA-N 476.577 5.340 5 20 JKBD O=C(Nc1ccc(N2CCOCC2)c2ccncc12)c1cc([N+](=O)[O-])ccc1Oc1ccccc1 603734169 UBZULPCAKVGSBC-UHFFFAOYSA-N 470.485 5.024 5 20 JKBD CCN(CC)S(=O)(=O)c1ccc(N[C@H](C)c2cccc(NC(=O)c3ccccc3)c2)c([N+](=O)[O-])c1 603856525 YWFNMGGVUNGNAQ-GOSISDBHSA-N 496.589 5.051 5 20 JKBD COc1ccc(Oc2ccc([N+](=O)[O-])cc2C(=O)Nc2cc(-c3nc(C)no3)ccc2C)cc1 603988203 YDZDVEIAQRELSF-UHFFFAOYSA-N 460.446 5.315 5 20 JKBD CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)Nc1nc(-c2ccc3c(c2)CCC(=O)N3)cs1 604455227 OZANSESWCFPXFG-UHFFFAOYSA-N 465.535 5.046 5 20 JKBD O=C(N[C@@H]1C[C@@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1)c1csc(-c2ccc([N+](=O)[O-])cc2)n1 604517444 CZKLOUZPOKIADG-GDNZZTSVSA-N 467.391 5.358 5 20 JKBD O=C(c1csc(-c2ccc([N+](=O)[O-])cc2)n1)N1CCC[C@H](c2nc(-c3ccc(Cl)cc3)no2)C1 608817602 OTPDRYLESGAMAH-INIZCTEOSA-N 495.948 5.442 5 20 JKBD CC(C)CC(=O)Nc1cccc(CNCc2cn(-c3ccccc3)nc2-c2ccc([N+](=O)[O-])cc2)c1 608836635 ANDITNJIYIKLKR-UHFFFAOYSA-N 483.572 5.722 5 20 JKBD Cc1csc(-c2cccc(NC(=O)N[C@H](CC(=O)OC(C)C)c3ccccc3[N+](=O)[O-])c2)n1 608841611 WCVARQUGORHKOW-LJQANCHMSA-N 468.535 5.231 5 20 JKBD O=C(NCC1(c2ccc(Cl)cc2)CC1)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 608948426 KGFASRNAHFFVCY-UHFFFAOYSA-N 481.902 5.331 5 20 JKBD COc1ccc(CNCc2ccc(-c3csc(C)n3)cc2)cc1OCc1ccc([N+](=O)[O-])cc1 610721772 BNLMUZSFXPRFAB-UHFFFAOYSA-N 475.570 5.904 5 20 JKBD O=C(c1ccccc1)c1ccc(Sc2nnc(COc3ccc(Cl)cc3)o2)c([N+](=O)[O-])c1 619716646 RYQNNEHCDSSJLB-UHFFFAOYSA-N 467.890 5.592 5 20 JKBD Cc1ccc(/C(O)=C(/C(=S)Nc2ccc(OC(C)C)cc2)[n+]2ccccc2)cc1[N+](=O)[O-] 726574228 OMLIZIPOSOVBEM-UHFFFAOYSA-O 450.540 5.301 5 20 JKBD CCN(CC)C(=O)c1ccc(C(=O)Nc2cc(Cl)c([N+](=O)[O-])cc2OCc2ccccc2)cc1 729170695 PXDZSGQFAYQGQS-UHFFFAOYSA-N 481.936 5.562 5 20 JKBD CCC(CC)c1cc[n+](/C(C(=S)Nc2cc(C)ccc2F)=C(/O)c2ccc(C)c([N+](=O)[O-])c2)cc1 744116815 QDHATUCHUQLKLL-UHFFFAOYSA-O 494.612 6.865 5 20 JKBD CCC(CC)c1cc[n+](/C(C(=S)Nc2cc(C)ccc2F)=C(/O)c2ccc([N+](=O)[O-])cc2)cc1 744116831 RJNOKGNTVFVVSN-UHFFFAOYSA-O 480.585 6.557 5 20 JKBD C[C@H](OC(=O)c1csc(-c2ccc(Cl)cc2)n1)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 763008918 HWRNMCZLSUSHKX-NSHDSACASA-N 456.867 5.340 5 20 JKBD C[C@H](OC(=O)c1cc([N+](=O)[O-])ccc1N1CCCCC1)C(=O)Nc1cc(Cl)ccc1Cl 823248272 NOFRWWZXOOMTJU-ZDUSSCGKSA-N 466.321 5.076 5 20 JKBD CC(=O)Nc1cccc([C@H](C)N(Cc2ccccc2)C(=O)c2cc([N+](=O)[O-])c(C)c([N+](=O)[O-])c2)c1 841837865 ZSWMQRQFJNVERK-KRWDZBQOSA-N 476.489 5.173 5 20 JKBD CC(C)c1ccc(-c2nc(C(=O)O[C@@H](C)c3nnc(-c4ccc([N+](=O)[O-])cc4)o3)cs2)cc1 900255558 LBXNMXFHGMXPEW-AWEZNQCLSA-N 464.503 5.810 5 20 JKBD CN(C(=O)c1ccccc1Sc1ccc(C(F)(F)F)cc1[N+](=O)[O-])c1ccc(C(N)=O)cc1 917859694 BQFNUPFEVMDWBU-UHFFFAOYSA-N 475.448 5.140 5 20 JKBD CC(C)Oc1cccc([C@H](C)NC(=O)c2ccccc2NC(=O)c2ccc([N+](=O)[O-])cc2Cl)c1 918583682 YWZBGEWZRKPAQK-INIZCTEOSA-N 481.936 5.779 5 20 JKBD O=C(NC1(c2ccc(NC(=O)c3cccc4cc[nH]c34)cc2)CCC1)c1ccc([N+](=O)[O-])cc1F 1789093662 DNPIYBKNAOFCAW-UHFFFAOYSA-N 472.476 5.277 5 20 JKBD Cc1cncc(C(=O)NC2(c3ccc(NC(=O)C4(c5cccc([N+](=O)[O-])c5)CCC4)cc3)CCC2)c1 1790475993 QTFVKERBGPTCNL-UHFFFAOYSA-N 484.556 5.168 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)Nc1ccc(C2(NC(=O)c3ccnc(C(F)F)c3)CCC2)cc1 1790771085 OMUPFZOMFQNWMG-UHFFFAOYSA-N 498.461 5.436 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)NC1(c2ccc(NC(=O)c3onc4ccccc34)cc2)CCC1 1790907457 RNYWADQKOYZUGF-UHFFFAOYSA-N 488.475 5.245 5 20 JKBD Cc1cc(C(=O)N2CCCC[C@H]2C2CCN(C(=O)c3cc4cc([N+](=O)[O-])ccc4s3)CC2)c(C)o1 1825879606 KCQAQWDWBJCXHK-QFIPXVFZSA-N 495.601 5.566 5 20 JKBD O=C(Cc1ccc(Cl)cc1[N+](=O)[O-])N1CCC([C@@H]2CCCCN2C(=O)/C=C/C2CCCC2)CC1 1830347141 VYXNHIBPUNKVAV-HDFUYHJRSA-N 488.028 5.157 5 20 JKBD CC1=CC[C@H](C(=O)N2CCC([C@H]3CCCCN3C(=O)c3cc(Cl)cc([N+](=O)[O-])c3C)CC2)CC1 1830735726 LEYYOUVYNCLASF-NZQKXSOJSA-N 488.028 5.536 5 20 JKBD O=C(c1cc2cc([N+](=O)[O-])ccc2s1)N1CCC([C@H]2CCCCN2C(=O)C2CC3(CCC3)C2)CC1 1832478393 QSHBHGPKMZHERW-JOCHJYFZSA-N 495.645 5.623 5 20 JKBD COc1ccc([N+](=O)[O-])cc1NC(=O)[C@@H](C)OC(=O)[C@@H](Sc1ccccc1)c1ccccc1 10588838 QJCHWHBTKMBHJA-ZHRRBRCNSA-N 466.515 5.007 5 20 JKBD CSc1ccc([N+](=O)[O-])c(C(=O)O[C@H](C(=O)Nc2ccc(C)cc2[N+](=O)[O-])c2ccccc2)c1 16196167 KOQOSZCQSMPYOR-NRFANRHFSA-N 481.486 5.070 5 20 JKBD CCCn1c(S[C@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)nc2cc(Cl)ccc2c1=O 17723480 BWAFHMLJTNOHFJ-GFCCVEGCSA-N 471.926 5.271 5 20 JKBD CCCCCn1c(SCc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)nc2sc3c(c2c1=O)CCC3 21609563 VUBCJPDCPWVJFZ-UHFFFAOYSA-N 497.602 5.387 5 20 JKBD COC(=O)c1sc2[nH]c(/C(Cl)=C/c3ccc(-c4ccc([N+](=O)[O-])cc4)s3)nc(=O)c2c1C 23605874 NUGOJOZNCIXUKJ-ZROIWOOFSA-N 487.946 5.453 5 20 JKBD O=C(C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1)N1CCC[C@@H]1Cc1ccccc1 25041418 INKGYUQZUINWMN-HXUWFJFHSA-N 461.484 5.064 5 20 JKBD COc1ccc(Oc2ccc([N+](=O)[O-])cc2C(=O)Nc2cc3c(cc2Cl)OCCCO3)cc1 33166692 HNPULELFJURCLH-UHFFFAOYSA-N 470.865 5.463 5 20 JKBD COc1cc(C(=O)Nc2cc(Cl)ccc2Oc2ccccc2)c([N+](=O)[O-])cc1OC(F)F 45644688 GGMVWGFBEJSUSG-UHFFFAOYSA-N 464.808 5.903 5 20 JKBD CSc1ccc([N+](=O)[O-])c(C(=O)Nc2ccccc2NC(=O)c2ccc(C(C)(C)C)cc2)c1 59306969 MHKLHKUAHQOLCD-UHFFFAOYSA-N 463.559 6.119 5 20 JKBD O=C(Cc1nc(COc2ccc([N+](=O)[O-])cc2Cc2ccccc2)cs1)Nc1ccccc1 72036809 WHCPNMQLLKMOPP-UHFFFAOYSA-N 459.527 5.402 5 20 JKBD O=C(Cn1c2ccccc2c(=O)c2ccccc21)Nc1cccc(COc2ccc3c(c2)OCO3)c1 107985239 XKHCACYWMYSXEC-UHFFFAOYSA-N 478.504 5.101 5 20 JKBD O=C(Nc1ccccc1C(=O)N1CCN(c2ccc(Cl)cc2)CC1)c1ccc([N+](=O)[O-])cc1Cl 109221130 NPFSHXDBLTULOI-UHFFFAOYSA-N 499.354 5.116 5 20 JKBD Cc1ccc([C@H](CNC(=O)c2ccc(N[C@H](C)c3ccccn3)c([N+](=O)[O-])c2)N2CCCC2)cc1 109504848 YLCPWRCHUJWTAN-IBVKSMDESA-N 473.577 5.038 5 20 JKBD COc1cc(CNC2CCN(Cc3ccc(F)cc3)CC2)ccc1OCc1ccc([N+](=O)[O-])cc1 302978713 URLKXIZLSGLXDI-UHFFFAOYSA-N 479.552 5.076 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)NCc2cn(-c3ccccc3)nc2-c2ccccc2)cc1SC 303213652 SKKWQVVWEAQHEX-UHFFFAOYSA-N 474.542 5.108 5 20 JKBD Cc1cc(C)c2c(-c3ccccc3)nc(S[C@@H](C)c3nnc(-c4ccc([N+](=O)[O-])cc4)o3)n2n1 501631250 UKLJVDRVFPKNSK-INIZCTEOSA-N 472.530 5.825 5 20 JKBD COc1ccc(-c2[nH]c3ccccc3c2CCC(=O)N2c3ccc([N+](=O)[O-])cc3C[C@H]2C)c(OC)c1 504376307 ITRYNODPKYPEJR-QGZVFWFLSA-N 485.540 5.671 5 20 JKBD COc1ccc2cc(CNCc3ccc(OC)c(OCc4ccc([N+](=O)[O-])cc4)c3)ccc2c1 517542832 QKEYJMAQMMAMHZ-UHFFFAOYSA-N 458.514 5.634 5 20 JKBD O=C(CSc1ncccc1[N+](=O)[O-])N(Cc1ccc(F)cc1)c1nc(-c2ccccc2)cs1 520087948 MWFDLYUIJMXIPG-UHFFFAOYSA-N 480.546 5.578 5 20 JKBD CC(C)(C)c1ccc(Oc2ccc(CNC3CCN(C(=O)c4ccoc4)CC3)cc2[N+](=O)[O-])cc1 520208021 XENLHNGBHJDKET-UHFFFAOYSA-N 477.561 5.672 5 20 JKBD CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)NC1CCN(Cc2ccc(Cl)c(Cl)c2)CC1 520934938 VKNXNMZXFQTTFI-UHFFFAOYSA-N 479.408 5.486 5 20 JKBD C[C@@H]1c2ccsc2CCN1C(=O)C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1 590655424 SMCDTYSDNYUYOF-WDMNMGCXSA-N 475.595 6.343 5 20 JKBD COc1ccc(Br)cc1-c1nc2ccc([N+](=O)[O-])cc2c(-c2ccccc2)c1CC(=O)O 603804048 BAEHXDBFZYCILH-UHFFFAOYSA-N 493.313 5.875 5 20 JKBD C[C@H]1C[C@@H]1c1ccc(CN(C(=O)C2CCN(c3ccc(C(F)(F)F)cc3[N+](=O)[O-])CC2)C2CC2)o1 603877455 JJVKKVAHMFALLN-YWZLYKJASA-N 491.510 5.738 5 20 JKBD O=C(N[C@@H](CC(F)(F)F)c1ccccc1)N1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 604103655 BKEFMRCMZJLOHH-INIZCTEOSA-N 490.404 5.139 5 20 JKBD CCCCN(C(=O)c1ccc(N[C@H](C)c2ccccn2)c([N+](=O)[O-])c1)[C@@H](C)c1ccc(C)o1 604491519 WPEQFXCDPRQNKO-MOPGFXCFSA-N 450.539 6.068 5 20 JKBD O=C1Nc2cc(Cl)ccc2[C@H]1C1CCN(C(=O)c2cc([N+](=O)[O-])ccc2Oc2ccccc2)CC1 608970882 FGXDSNJSIHCHGO-XMMPIXPASA-N 491.931 5.629 5 20 JKBD C[C@@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccc(Sc2nncs2)c(Cl)c1 609106937 DFWIMAHEZBFIEK-SNVBAGLBSA-N 452.970 5.370 5 20 JKBD C[C@H](NC(=O)Cn1c2ccccc2c(=O)c2ccccc21)c1ccc(NC(=O)Nc2ccccc2)cc1 613849950 XUTKAPOIFRWSAL-FQEVSTJZSA-N 490.563 5.676 5 20 JKBD CCSc1ccc(C(=O)O[C@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2ccccc2)cn1 727922841 BTUPTLYDJAOPFM-FQEVSTJZSA-N 471.922 5.292 5 20 JKBD O=C(c1ccc(N2C(=O)c3ccccc3C2=O)cc1)N(CC1CC1)c1ccc(Cl)c([N+](=O)[O-])c1 728167688 ZMTXPNXHJMCLAX-UHFFFAOYSA-N 475.888 5.106 5 20 JKBD O=C(OCc1nc2ccccc2c2ccccc12)C1CCN(C(=O)c2cccc3ccccc23)CC1 732663482 WTWVPJOMGSGVLW-UHFFFAOYSA-N 474.560 6.137 5 20 JKBD Cc1cccc2c(=O)nc(/C(Cl)=C\c3ccc(-c4ccc([N+](=O)[O-])cc4Br)o3)[nH]c12 747201110 NSSSGHNJBKNZMX-LICLKQGHSA-N 486.709 5.899 5 20 JKBD COc1cc(C(=O)Oc2ccccc2Oc2ccccn2)c([N+](=O)[O-])cc1OCc1cscn1 748676395 WQDHBZWIQFQGAH-UHFFFAOYSA-N 479.470 5.045 5 20 JKBD O=C(/C=C/c1ccc(-c2ccccc2Cl)s1)N1CCN(C(=O)c2ccc([N+](=O)[O-])s2)CC1 915600700 WGYGQOJUZFZAPV-RMKNXTFCSA-N 487.990 5.036 5 20 JKBD O=C(CCNc1ccccc1[N+](=O)[O-])C(c1nc2ccccc2s1)c1nc2ccccc2s1 916844833 FFPYKUXCYYUCHT-UHFFFAOYSA-N 474.567 6.017 5 20 JKBD CN(C(=O)c1c2c(nc3ccccc13)/C(=C\c1cccc([N+](=O)[O-])c1)CCC2)c1ccc(C(N)=O)cc1 917860395 JQROGQVQAAVUQV-SILNSSARSA-N 492.535 5.395 5 20 JKBD O=C(OCC[C@H]1CCCCN1C(=O)c1csc(-c2ccc(F)cc2)n1)c1cccc([N+](=O)[O-])c1 918632505 IHVDSHFYZLPTEZ-LJQANCHMSA-N 483.521 5.099 5 20 JKBD O=C(COC(=O)CCCc1ccc(Cl)c(Cl)c1)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 919489498 UGBIJGHTTJQJPW-UHFFFAOYSA-N 479.238 5.425 5 20 JKBD C[C@@H](Nc1ccc(C(=O)OCc2csc(Cc3ccccc3)n2)cc1[N+](=O)[O-])c1ccccn1 920543462 FBGRYZNVXUEYOO-QGZVFWFLSA-N 474.542 5.567 5 20 JKBD Cc1ccc(C)c2c(C)c(C(=O)O[C@H](C)C(=O)Nc3ccc([N+](=O)[O-])cc3C(F)(F)F)oc12 920649132 BIECUNWBHXCSNU-CYBMUJFWSA-N 464.396 5.469 5 20 JKBD CCc1ncccc1C(=O)Nc1ccc(C2(NC(=O)CSc3ccccc3[N+](=O)[O-])CCC2)cc1 1787095804 IDYAWCVMBLVYDR-UHFFFAOYSA-N 490.585 5.092 5 20 JKBD COc1cc(CC(=O)Nc2ccc(C3(NC(=O)[C@H](C)c4ccccc4)CCC3)cc2)ccc1[N+](=O)[O-] 1790480167 CAEGWTYPKMDBRC-LJQANCHMSA-N 487.556 5.084 5 20 JKBD C[C@@H]1CC[C@H](C(=O)NC2(c3ccc(NC(=O)c4cc5cc([N+](=O)[O-])ccc5s4)cc3)CCC2)O1 1791010379 LQXLTUFFOHEACK-FOIQADDNSA-N 479.558 5.125 5 20 JKBD O=C(CCc1cccc([N+](=O)[O-])c1)N1CCC([C@@H]2CCCCN2C(=O)c2cccc3ccoc23)CC1 1830987028 HHQXDYLRTKEDKU-VWLOTQADSA-N 489.572 5.207 5 20 JKBD O=C(C[C@@H]1C[C@@H]2CC[C@H]1C2)N1CCC([C@@H]2CCCCN2C(=O)/C=C/c2ccccc2[N+](=O)[O-])CC1 1832903819 LHYNSIRJXJTKJR-HSDWTIDQSA-N 479.621 5.054 5 20 JKBD O=C(CSc1nnc(Cc2ccccc2)n1-c1ccccc1)Nc1ccc(Cl)cc1[N+](=O)[O-] 12105362 QQOSKLIYPFDZKG-UHFFFAOYSA-N 479.949 5.151 5 20 JKBD Cc1cc(-c2nc3ccc([N+](=O)[O-])cc3c(-c3ccccc3)c2Cl)c(C)n1[C@@H]1CCS(=O)(=O)C1 15454036 CQDOZDWWDNERAF-LJQANCHMSA-N 495.988 5.908 5 20 JKBD C[C@H](Sc1nnc(-c2ccccc2Cl)n1C1CCCC1)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 17657232 DFFNNGUHWPTBKP-AWEZNQCLSA-N 496.980 6.525 5 20 JKBD Cc1csc(SCc2ccccc2C(=O)O[C@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)n1 17717758 SVVZTUFMFBQLHQ-CQSZACIVSA-N 482.543 5.620 5 20 JKBD C[C@H](OC(=O)c1ccc(-c2nc3ccccc3s2)s1)C(=O)Nc1ccccc1[N+](=O)[O-] 21736971 DGDLNTICLGSPCA-LBPRGKRZSA-N 453.501 5.117 5 20 JKBD Cc1nn(Cc2ccc(C(=O)Nc3ccc(SCc4cccnc4)cc3)cc2)c(C)c1[N+](=O)[O-] 22067755 WBMGQURXOKYULU-UHFFFAOYSA-N 473.558 5.396 5 20 JKBD O=C(C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)N(Cc1cccs1)C1CC1 30301699 XHHDJXDRTOVNJY-JXAWBTAJSA-N 475.595 6.388 5 20 JKBD CC(=O)Nc1cccc(Nc2nnc(Sc3ccc(C(F)(F)F)cc3[N+](=O)[O-])s2)c1 43727590 AFRODCIRKVKOQQ-UHFFFAOYSA-N 455.443 5.318 5 20 JKBD O=c1c2ccccc2c(-c2cccs2)nn1CN(Cc1ccccc1[N+](=O)[O-])CC(F)(F)F 71966626 WVRQWXYQINWVHW-UHFFFAOYSA-N 474.464 5.055 5 20 JKBD Cc1c(NC(=O)c2ccccc2SCC(=O)NC23CC4CC(CC(C4)C2)C3)cccc1[N+](=O)[O-] 104743875 BCPQYIYQAWCJBJ-UHFFFAOYSA-N 479.602 5.333 5 20 JKBD C[C@@H](NC(=O)c1cc([N+](=O)[O-])ccc1N1CCCCC1)c1ccc(OCc2cccnc2)cc1 108126292 OBSPGQYRMNWSGE-LJQANCHMSA-N 460.534 5.050 5 20 JKBD COc1ccc(/C=C2/N=C(S/C=C\c3ccc([N+](=O)[O-])o3)N(c3cccc(OC)c3)C2=O)cc1 214748697 MXJPHGJPOQJMAA-UYEGHHEMSA-N 477.498 5.353 5 20 JKBD COc1ccc([N+](=O)[O-])cc1NC(=O)c1nc(-c2cccs2)n(-c2cccc(C(F)(F)F)c2)n1 485373094 ABEAHPWZHWIHPB-UHFFFAOYSA-N 489.435 5.184 5 20 JKBD O=C(Nc1cnn(Cc2ccncc2)c1)c1ccccc1Sc1ccc(C(F)(F)F)cc1[N+](=O)[O-] 503768504 XVBXYQYZPGFRIU-UHFFFAOYSA-N 499.474 5.657 5 20 JKBD COc1cc(CNCc2ccc(Br)cc2)c([N+](=O)[O-])cc1OCc1ccccc1 507928214 CISJCPCLIPAQAF-UHFFFAOYSA-N 457.324 5.235 5 20 JKBD COc1cc(C(=O)N2CCC(CCc3ccccc3)CC2)c([N+](=O)[O-])cc1OCc1cscn1 509876207 BXAIFMFWOXBNAG-UHFFFAOYSA-N 481.574 5.124 5 20 JKBD O=C(NCc1ccc(N2CCCC2)nc1)c1cc([N+](=O)[O-])ccc1Sc1ccc(Cl)cc1 515496560 WEMKZISGZRCOAO-UHFFFAOYSA-N 468.966 5.325 5 20 JKBD CCCOc1ccc(NC(=O)c2ccc(NS(=O)(=O)c3ccc(C)c([N+](=O)[O-])c3)cc2)c(C)c1 515991307 DYRWZBOLWTWCAK-UHFFFAOYSA-N 483.546 5.054 5 20 JKBD O=C(Cn1cc([N+](=O)[O-])cn1)N(c1ccc(Oc2ccccc2)cc1)c1nc2ccccc2s1 516476141 XHCRGJNYMVZFOC-UHFFFAOYSA-N 471.498 5.558 5 20 JKBD COc1cc(C(=O)NCCc2ccc3ccccc3n2)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 519205277 PIAZVTFHTZZBBZ-UHFFFAOYSA-N 477.904 5.570 5 20 JKBD CC[C@@H](C(=O)N1CCC(NCc2ccc(-c3ccc(OC)cc3[N+](=O)[O-])o2)CC1)c1ccccc1 520964887 DOJAHKUZJKTFLF-HSZRJFAPSA-N 477.561 5.138 5 20 JKBD Cc1ccc(NC(=O)c2ccc(N3C[C@@H](C)C[C@@H](C)C3)c([N+](=O)[O-])c2)cc1NC(=O)c1ccncc1 521393141 WFDSHQORPCFHKO-HDICACEKSA-N 487.560 5.285 5 20 JKBD CS(=O)(=O)c1ccc(C(=O)Nc2ccc(Oc3cc(Cl)ccc3Cl)c(F)c2)cc1[N+](=O)[O-] 521548805 JFEPGQNAQQPEQV-UHFFFAOYSA-N 499.303 5.489 5 20 JKBD O=C(Nc1cccc(/C=C2\CCn3c2nc2ccc([N+](=O)[O-])cc2c3=O)c1)c1ccccc1Cl 603781355 MMCCBDGHIAZVRU-FOWTUZBSSA-N 472.888 5.155 5 20 JKBD O=C(CN(Cc1ccc(Cl)cc1)C(=O)c1c[nH]c2ccc([N+](=O)[O-])cc12)Nc1ccccc1F 608852719 BOCGRDPRITZIDL-UHFFFAOYSA-N 480.883 5.150 5 20 JKBD C[C@H]1CN(c2ccc(NC(=O)c3cc([N+](=O)[O-])ccc3N3CCCC3)cc2C(F)(F)F)C[C@H](C)O1 728036931 FGZBJAZVPPPXQD-HOTGVXAUSA-N 492.498 5.080 5 20 JKBD O=C(COC(=O)c1ccc([N+](=O)[O-])cc1Cl)Nc1cc(C(F)(F)F)ccc1N1CCCCC1 747910853 GTFHRZSVUVMQDE-UHFFFAOYSA-N 485.846 5.053 5 20 JKBD COc1ccc([C@@H]2CCCCCN2C(=O)COC(=O)c2csc(-c3cccc([N+](=O)[O-])c3)n2)cc1 747954685 CWYNKHPCHUBTIX-QFIPXVFZSA-N 495.557 5.028 5 20 JKBD CCCN(CC(=O)Nc1cc(Cl)ccc1Cl)C(=O)c1cc([N+](=O)[O-])ccc1Br 751053636 FDUALBAGATXIIH-UHFFFAOYSA-N 489.153 5.155 5 20 JKBD CCOC(=O)c1sc(-c2cccc([N+](=O)[O-])c2)cc1NC(=O)c1cc(SC)ccc1[N+](=O)[O-] 756173507 XWDGYHBTXINCOU-UHFFFAOYSA-N 487.515 5.382 5 20 JKBD CC1=C(C(=O)Nc2ccc(C)cc2C)[C@H](c2ccc(-c3ccccc3[N+](=O)[O-])s2)NC(=S)N1 812920123 USTSOQASXNZXFT-QFIPXVFZSA-N 478.599 5.372 5 20 JKBD CC(C)OC(=O)C[C@@H](NC(=O)Nc1ccc(SC(F)F)cc1)c1ccccc1[N+](=O)[O-] 915301077 NYIXOEWSMUNWKJ-MRXNPFEDSA-N 453.467 5.114 5 20 JKBD C[C@@H](OC(=O)Cc1csc(-c2ccc(Cl)s2)n1)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl 920676962 RRESATZMVWVOAK-SECBINFHSA-N 486.358 5.200 5 20 JKBD Cc1occc1C(=O)NC1(c2ccc(NC(=O)Cc3ccc(Cl)cc3[N+](=O)[O-])cc2)CCC1 1786116550 QLFGKQTVGVPUHX-UHFFFAOYSA-N 467.909 5.140 5 20 JKBD O=C(/C=C/c1ccc([N+](=O)[O-])o1)Nc1ccc(C2(NC(=O)c3cccc4ncccc34)CCC2)cc1 1786205042 ZPPGLBKBLHDEGF-ACCUITESSA-N 482.496 5.197 5 20 JKBD CN(C)c1ccc([N+](=O)[O-])c(C(=O)NC2(c3ccc(NC(=O)CCCC(F)(F)F)cc3)CCC2)c1 1786623171 YZHWHVNHHUFWKS-UHFFFAOYSA-N 492.498 5.141 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)c3cc4cc([N+](=O)[O-])ccc4s3)CCC2)cc1)c1ccncc1 1787312318 SDHYRKKGHYABQG-UHFFFAOYSA-N 472.526 5.266 5 20 JKBD Cc1c[nH]c(C)c1CCC(=O)NC1(c2ccc(NC(=O)c3cc(F)cc([N+](=O)[O-])c3)cc2)CCC1 1790695969 YERQMQBGVYNLFS-UHFFFAOYSA-N 478.524 5.059 5 20 JKBD O=C(CCc1c[nH]c2ccccc12)NC1(c2ccc(NC(=O)c3cc(O)cc([N+](=O)[O-])c3)cc2)CCC1 1790754976 OXNJQSDNLSOMFZ-UHFFFAOYSA-N 498.539 5.162 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)Nc1ccc(C2(NC(=O)c3ccoc3Cl)CCC2)cc1 1790772622 YDVAPOWTZPNLHO-UHFFFAOYSA-N 471.872 5.350 5 20 JKBD O=C(C[C@@H]1C[C@@H]2CC[C@H]1C2)Nc1ccc(C2(NC(=O)c3cc(F)cc([N+](=O)[O-])c3)CCC2)cc1 1791325420 IGBBBBZKAZPQNR-SQNIBIBYSA-N 465.525 5.308 5 20 JKBD O=C(c1cc2cc([N+](=O)[O-])ccc2s1)N1CCC2(CCCN(C(=O)c3cccnc3Cl)C2)CC1 1804659686 CZLYEAUAJQNZIM-UHFFFAOYSA-N 498.992 5.017 5 20 JKBD O=C(/C=C/c1ccccc1[N+](=O)[O-])N1CCC([C@H]2CCCCN2C(=O)c2cc3ccccc3o2)CC1 1828191813 WTPCRZSQNSDYKG-MDRMPYQZSA-N 487.556 5.288 5 20 JKBD CCCCC[C@H](C)C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cc(N(C)C)ccc2[N+](=O)[O-])CC1 1829648247 GVWZOIVLQSJUTB-RDPSFJRHSA-N 486.657 5.111 5 20 JKBD C[C@@H]1C[C@]1(C)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)CC1 1830223038 CTTZHKGPIFVKJW-YNSGVOSJSA-N 469.607 5.089 5 20 JKBD O=C(/C=C/C1CCCCC1)N1CCC([C@H]2CCCCN2C(=O)Cc2cc(F)ccc2[N+](=O)[O-])CC1 1832890108 FARINBHOWBMITH-XJCKULRNSA-N 485.600 5.033 5 20 JKBD CC(=O)N(c1nc(COC(=O)c2cccc([N+](=O)[O-])c2)cs1)c1c(C)cc(C)cc1Cl 11025775 NGWPTUCAGMYROE-UHFFFAOYSA-N 459.911 5.363 5 20 JKBD CC1CCN(c2ccc(C(=O)Nc3ccc(NC(=O)C4CC4)cc3C(F)(F)F)cc2[N+](=O)[O-])CC1 12226544 OQFCDZWCSKIHDB-UHFFFAOYSA-N 490.482 5.451 5 20 JKBD CCNc1ccc(C(=O)OCc2csc(N(C(C)=O)c3ccc(C)c(C)c3)n2)cc1[N+](=O)[O-] 14072725 CQWQNHYGUHXMIE-UHFFFAOYSA-N 468.535 5.142 5 20 JKBD COc1cc(CN(C)C(=O)c2cc(SC)ccc2[N+](=O)[O-])ccc1OCc1ccccc1 18134806 UQFCAHHWWRAADG-UHFFFAOYSA-N 452.532 5.177 5 20 JKBD C[C@@H](OC(=O)c1ccccc1SCc1ccco1)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 18411041 VMWCZLAAMKZQDF-CYBMUJFWSA-N 494.447 5.683 5 20 JKBD Cn1c(SCC(=O)N[C@H](c2ccc(F)cc2)c2cccs2)nc2cc3ccccc3cc2c1=O 19417885 UEYCTOLDVYZYIV-XMMPIXPASA-N 489.597 5.285 5 20 JKBD O=C(CSc1nnc(-c2ccc(F)cc2)c2ccccc12)Nc1cc(Cl)ccc1[N+](=O)[O-] 20852884 WHCBCYAIAMIZRF-UHFFFAOYSA-N 468.897 5.728 5 20 JKBD CSc1ccc([N+](=O)[O-])c(C(=O)Nc2nnc(SCc3ccc(Cl)cc3)s2)c1 24466064 WWVWHDVXGLBYNU-UHFFFAOYSA-N 452.970 5.366 5 20 JKBD O=C(NCc1ccc(C(=O)N2CCCC2)cc1)c1ccc(NCc2ccccc2Cl)c([N+](=O)[O-])c1 25326760 BJORCVQCBJNQLG-UHFFFAOYSA-N 492.963 5.026 5 20 JKBD O=C(COC(=O)Cc1csc(-c2ccc(C(F)(F)F)cc2)n1)Nc1ccc(Cl)cc1[N+](=O)[O-] 25661555 MBXPWNTXYHMGJK-UHFFFAOYSA-N 499.854 5.115 5 20 JKBD Cc1cc([N+](=O)[O-])ccc1NC(=O)CCSc1nnc(-c2ccc(F)cc2)n1Cc1ccccc1 26369516 RBPGMYKKTBDIIF-UHFFFAOYSA-N 491.548 5.470 5 20 JKBD COc1ccc(Oc2ccc([N+](=O)[O-])cc2C(=O)Nc2ccc(NC(=O)c3ccco3)cc2)cc1 30698228 DTFWANVKTVGOIE-UHFFFAOYSA-N 473.441 5.493 5 20 JKBD CC(=O)Nc1cccc(CNC(=O)c2ccc(Sc3nc4ccccc4s3)c([N+](=O)[O-])c2)c1 32361741 MCVMHJGWMCBFAM-UHFFFAOYSA-N 478.555 5.244 5 20 JKBD C[C@@H](Nc1ccc(C(=O)N(Cc2cccc(F)c2)C[C@H]2CCCO2)cc1[N+](=O)[O-])c1ccccn1 109589173 AQLUSWIYUOIMGQ-XMSQKQJNSA-N 478.524 5.123 5 20 JKBD O=C1c2ccccc2N[C@H](c2ccc(Oc3ccc(F)cc3)c([N+](=O)[O-])c2)N1Cc1cccnc1 489289148 NHYHXKMLQPOSHI-VWLOTQADSA-N 470.460 5.688 5 20 JKBD CCN(Cc1cc(Br)ccc1F)C(=O)c1ccc(Cn2nc(C)c([N+](=O)[O-])c2C)cc1 498991289 UJBGEUVBMXWHKH-UHFFFAOYSA-N 489.345 5.020 5 20 JKBD CN(CCc1ccncc1)C(=O)c1c2c(nc3ccccc13)/C(=C\c1ccc([N+](=O)[O-])cc1)CCC2 499945900 PAOJVXDSVUEXJL-QOCHGBHMSA-N 478.552 5.730 5 20 JKBD COc1cc(C(=O)Nc2ccc(NC(=O)c3ccc(F)cc3)cc2C(F)(F)F)ccc1[N+](=O)[O-] 508922297 MALOIDHSCPCOQX-UHFFFAOYSA-N 477.370 5.266 5 20 JKBD COc1cc(C(=O)Nc2ccc(Cl)c(C(F)(F)F)c2)c([N+](=O)[O-])cc1OCc1cscn1 509893759 MKINJOWATNFSTE-UHFFFAOYSA-N 487.843 5.563 5 20 JKBD O=C(CCCn1c(=O)oc2cc([N+](=O)[O-])ccc21)Nc1ccccc1Oc1ccc(Cl)cc1 516780143 LNMPGACHMWJPTL-UHFFFAOYSA-N 467.865 5.367 5 20 JKBD C[C@@H](c1ccccn1)N(C)C(=O)C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1 520088335 NFLGYYWFWDNYCS-STZPCZCHSA-N 458.543 5.750 5 20 JKBD O=C(Nc1ncc(Cc2ccc(Br)cc2)s1)c1c[nH]c2cc([N+](=O)[O-])ccc12 520473279 XOSUWWIWJYUNKQ-UHFFFAOYSA-N 457.309 5.138 5 20 JKBD Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)C[C@H](NC(=O)c1ccccc1Cl)c1ccccc1 603501290 FOQPEZQNSMOONI-NRFANRHFSA-N 451.910 5.365 5 20 JKBD CCCC(=O)NC1CCN(C(=O)c2ccccc2Sc2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 603744119 PMYHKJVGZBAHTA-UHFFFAOYSA-N 495.523 5.286 5 20 JKBD C[C@@H](c1ccccc1)n1c(SCC(=O)Nc2ccc([N+](=O)[O-])cc2Cl)nnc1-c1ccccc1 603917225 GQASZDMJXWUQJG-INIZCTEOSA-N 493.976 5.847 5 20 JKBD C[C@H](NC(=O)c1cc([N+](=O)[O-])ccc1Sc1ccc(Cl)cc1)c1ccc(-n2cncn2)cc1 604467561 KJWZBQUIJSQEMR-HNNXBMFYSA-N 479.949 5.471 5 20 JKBD O=C(Nc1cccnc1)c1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2Oc2ccccc2)cc1Cl 608874978 OHSRBWGIKOTTCO-UHFFFAOYSA-N 488.887 5.940 5 20 JKBD C[C@H](c1cc2ccccc2o1)N(C)C(=O)CSc1nc2cc3ccccc3cc2c(=O)n1C 613972910 KXHBAORTHGJXIY-MRXNPFEDSA-N 457.555 5.145 5 20 JKBD CCn1c(COC(=O)c2ccc(N[C@@H](C)c3ccccn3)c([N+](=O)[O-])c2)nc2cc(F)ccc21 727515060 GUTAOWRNPZOISE-HNNXBMFYSA-N 463.469 5.029 5 20 JKBD O=C(NCCc1cn(-c2ccccc2)nc1-c1ccc(Cl)cc1)c1cc(F)c(F)cc1[N+](=O)[O-] 727710403 KHHNCJJLJMCQAQ-UHFFFAOYSA-N 482.874 5.352 5 20 JKBD O=C(Nc1ccc(F)cc1-c1ccc(Cl)cc1)[C@H]1CC(=O)N(c2ccc(F)c([N+](=O)[O-])c2)C1 728484456 NADWOCGZOPUDKR-AWEZNQCLSA-N 471.847 5.185 5 20 JKBD O=C(Cc1ccc(NC(=O)c2ccc(Br)cc2)cc1)OCc1c(F)cccc1[N+](=O)[O-] 728993711 KVEQDQMBXRDQLS-UHFFFAOYSA-N 487.281 5.035 5 20 JKBD COc1ccc(NC(=O)COC(=O)c2oc3ccccc3c2CSc2cccs2)c([N+](=O)[O-])c1 742980485 UPVNESLHKZQVMS-UHFFFAOYSA-N 498.538 5.499 5 20 JKBD CC(=O)N(c1nc(COC(=O)c2cc([N+](=O)[O-])ccc2C)cs1)c1c(C)cc(C)cc1C 743000416 NJPFBNJYUBMNAW-UHFFFAOYSA-N 453.520 5.327 5 20 JKBD Cc1ccc(NC(=O)[C@H](OC(=O)c2nc(C(C)C)ncc2Cl)c2ccccc2)c([N+](=O)[O-])c1 744674508 FAPHXUMKCXEALV-HXUWFJFHSA-N 468.897 5.007 5 20 JKBD C[C@H](OC(=O)C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)C(=O)NC1CCCC1 748579058 JVNAGQRAWCGNDC-KXGFGANYSA-N 479.558 5.126 5 20 JKBD Cc1c(C(=O)N(CCc2ccccc2)c2nc3ccccc3s2)cc([N+](=O)[O-])c(C)c1[N+](=O)[O-] 748604750 MSWGFUSWHITHLC-UHFFFAOYSA-N 476.514 5.619 5 20 JKBD CN(Cc1nc(O)c2c(-c3ccccc3Cl)csc2n1)Cc1cc([N+](=O)[O-])ccc1Cl 788465109 ZGEKWGMFDOWUOY-UHFFFAOYSA-N 475.357 5.911 5 20 JKBD C[C@H](NC(=O)[C@@H](C)OC(=O)Cn1c2ccccc2c(=O)c2ccccc21)c1ccc2ccccc2c1 858085443 SNLXLVJRJPVWGM-VQTJNVASSA-N 478.548 5.117 5 20 JKBD CCOc1cc([N+](=O)[O-])c(-c2nc(-c3cccc(NC(=O)OC(C)(C)C)c3)no2)cc1OC 904634788 QDTOLRQZYYPRCL-UHFFFAOYSA-N 456.455 5.066 5 20 JKBD C[C@@H](OC(=O)c1sc2cc(C(F)(F)F)ccc2c1Cl)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 914963438 HIFRHVNHCXWCLH-SECBINFHSA-N 497.838 6.450 5 20 JKBD Cc1ccc(OCCCC(=O)Nc2ccc(CNC(=O)c3cc(Cl)ccc3[N+](=O)[O-])cc2)cc1 916070747 VAPSTPYAPGUOQE-UHFFFAOYSA-N 481.936 5.284 5 20 JKBD COc1ccc(N2C(=S)N[C@@H](c3cccs3)C(C(=O)Nc3ccc([N+](=O)[O-])cc3)=C2C)cc1 916167920 HHKBHJBABKRVJF-NRFANRHFSA-N 480.571 5.013 5 20 JKBD COc1cccc(Nc2nn(CN(Cc3ccccc3[N+](=O)[O-])CC(F)(F)F)c(=S)s2)c1 917450610 LYKYLKKVACOFSW-UHFFFAOYSA-N 485.513 5.356 5 20 JKBD CCCC(=O)Nc1c(Cl)cc(Cl)cc1C(=O)OCC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-] 919558814 UNBKTUVELUZOLI-UHFFFAOYSA-N 488.711 5.089 5 20 JKBD Cc1ccc(NC(=O)c2cccc(C(F)(F)F)c2)cc1NC(=O)Cn1ncc2ccc([N+](=O)[O-])cc21 920845385 SWXZOVJCMBTBHN-UHFFFAOYSA-N 497.433 5.163 5 20 JKBD O=C(CCOc1ccccc1)Nc1ccc(C2(NC(=O)CCc3cccc([N+](=O)[O-])c3)CCC2)cc1 1787674235 HZUYVPXQJKJIKY-UHFFFAOYSA-N 487.556 5.131 5 20 JKBD O=C(/C=C/c1cc2ccccc2o1)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C1(c2cccc([N+](=O)[O-])c2)CCC1 1800040958 QCRLEYYVUSUTKF-MVACIEJFSA-N 499.567 5.114 5 20 JKBD CC[C@@H](C(=O)N1CCCC2(CCN(C(=O)c3c(F)ccc([N+](=O)[O-])c3C)CC2)C1)c1ccccc1 1809015973 IKICWRMCAMVIOJ-OAQYLSRUSA-N 481.568 5.081 5 20 JKBD CC(C)[C@@H](C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cccc(F)c2[N+](=O)[O-])[nH]n1)c1ccccc1 1814931828 QPRQWCVJOATSQG-FYYLOGMGSA-N 493.539 5.203 5 20 JKBD Cc1ccsc1C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cc3cc([N+](=O)[O-])ccc3s2)n[nH]1 1821610831 ILYHWULWLXPSKE-QGZVFWFLSA-N 495.586 5.522 5 20 JKBD Cc1cc(C(=O)N2CCCC[C@H]2C2CCN(C(=O)c3cc(Cl)cc([N+](=O)[O-])c3C)CC2)c(C)o1 1825879868 OFXQVEFVOHDBBQ-QFIPXVFZSA-N 487.984 5.314 5 20 JKBD O=C(c1cccc(F)c1[N+](=O)[O-])N1CCC([C@H]2CCCCN2C(=O)c2cccc3ccccc23)CC1 1828009748 LGQHDRRNUFJEMA-RUZDIDTESA-N 489.547 5.434 5 20 JKBD Cc1c(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)[C@@H]3CCC[C@H]3C)CC2)cc(Cl)cc1[N+](=O)[O-] 1830736100 QQGOQACHPOYIBG-BSLALVQMSA-N 476.017 5.226 5 20 JKBD CCC(C)(C)C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cccc([N+](=O)[O-])c2Br)CC1 1831388090 UYUMYUIUQZRWTM-SFHVURJKSA-N 494.430 5.027 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)N1CCC([C@H]2CCCCN2C(=O)CCc2ccccc2F)CC1 1832396226 YTAQGLGYAJEQRH-XMMPIXPASA-N 499.558 5.048 5 20 JKBD Cn1c(SCC(=O)Nc2ccccc2SC(F)F)nc2cc3ccccc3cc2c1=O 10669470 GUOSGQDYCBHHHW-UHFFFAOYSA-N 457.527 5.132 5 20 JKBD COc1cc(C(=O)Nc2ccc(Br)c(C(F)(F)F)c2)c([N+](=O)[O-])cc1OC(F)F 10961160 MBPMDKLZXWNQBA-UHFFFAOYSA-N 485.159 5.238 5 20 JKBD C[C@H](OC(=O)c1cc(Cl)ccc1Cl)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 11029969 MOYWSAKKUAAJAB-QMMMGPOBSA-N 451.184 5.104 5 20 JKBD CSc1ccc(NC(=O)COC(=O)c2ccccc2NC(=O)c2ccc([N+](=O)[O-])cc2Cl)cc1 11710369 ZHJPQURIYDXESN-UHFFFAOYSA-N 499.932 5.018 5 20 JKBD CC(C)C(=O)Nc1ccc(NC(=O)Cc2cn(-c3ccccc3)nc2-c2ccc([N+](=O)[O-])cc2)cc1 14895833 VNVVILWGOCJLRE-UHFFFAOYSA-N 483.528 5.223 5 20 JKBD CCN(CC)C(=O)c1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2Sc2ccc(Cl)cc2)cc1 16000838 NUVNDVCYMVBGNS-UHFFFAOYSA-N 483.977 6.134 5 20 JKBD CC(C)CCn1c(S[C@@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)nc2ccccc2c1=O 17719603 XACHWSYEIXQNTP-HNNXBMFYSA-N 465.535 5.254 5 20 JKBD Cc1occc1-c1nnc(S[C@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)n1-c1ccccc1 21138666 ATGHQZKCTUNRJV-CQSZACIVSA-N 483.937 5.517 5 20 JKBD C[C@H](Sc1nc2ccccc2n1C(F)F)C(=O)Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1 25980090 MXPMOHOWEIBUQP-NSHDSACASA-N 475.502 5.582 5 20 JKBD CC(C)(C)NC(=O)c1ccc(NC(=O)Cc2cn(-c3ccccc3)nc2-c2ccc([N+](=O)[O-])cc2)cc1 31072827 CPKSZDZQJHGCKA-UHFFFAOYSA-N 497.555 5.157 5 20 JKBD O=C(C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1)N(Cc1cccs1)C[C@@H]1CCCO1 104929069 UQCMMRPGULAVEJ-SFHVURJKSA-N 497.539 5.099 5 20 JKBD COc1ccc([N+](=O)[O-])cc1NC(=O)c1sc(NC(=O)c2ccc(F)cc2Cl)cc1C 107660122 WYOFOFBGDMTZNR-UHFFFAOYSA-N 463.874 5.270 5 20 JKBD Cc1ccc2nc(-c3ccc(NC(=O)Cn4nc(-c5cccc([N+](=O)[O-])c5)ccc4=O)cc3)sc2c1 195741412 MNHRAMDYSJIRIN-UHFFFAOYSA-N 497.536 5.042 5 20 JKBD C[C@@H]1CN(c2ccccc2NC(=O)c2ccc(N[C@H](C)c3ccccn3)c([N+](=O)[O-])c2)C[C@@H](C)O1 410054357 JSBSFADXTMVWJA-GUDVDZBRSA-N 475.549 5.029 5 20 JKBD C[C@H]1CCCN(c2ccc(C(=O)Nc3ccccc3NC(=O)C[C@@H]3C=CCC3)cc2[N+](=O)[O-])C1 410092982 FXWSKFWVSIAGEI-RBUKOAKNSA-N 462.550 5.378 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)N[C@@H](C)c2ccc(OCc3ccc(F)cc3)cc2)cc1SC 485564820 XOYNVEWTFAYUFU-HNNXBMFYSA-N 470.522 5.534 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Cl)[C@@H](c1ccccc1)N1CCO[C@H](c2ccccc2)C1 492512459 DAQWKRKUAAEULT-XZOQPEGZSA-N 451.910 5.002 5 20 JKBD COc1cccc(CNC(=O)C/C(=C/c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)c1OC 498920352 ZBQOIHLIWYACKA-RGEXLXHISA-N 489.553 5.469 5 20 JKBD C[C@H](Nc1ccc(CC(=O)N2CCCc3ccccc32)cc1)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl 504420680 YITGIHVCFVWRMH-KRWDZBQOSA-N 492.963 5.209 5 20 JKBD CCOc1cc(C(=O)Nc2ncc(Cc3cccc(Br)c3)s2)c([N+](=O)[O-])cc1OC 505421958 TVHWOEFMDQRSJY-UHFFFAOYSA-N 492.351 5.064 5 20 JKBD COc1cc(C(=O)N(Cc2ccco2)c2ccccc2)c([N+](=O)[O-])cc1OCc1cscn1 512298525 GYSAZQMEAYBTRI-UHFFFAOYSA-N 465.487 5.079 5 20 JKBD O=[N+]([O-])c1ccc(-c2noc(CSc3nnc(Cc4ccccc4)n3-c3ccccc3)n2)cc1 515244510 REBLUMAIYJTZDI-UHFFFAOYSA-N 470.514 5.109 5 20 JKBD CC(=O)N(c1ccc(C)cc1)c1nc(CSc2nc3ccccc3c3nc4ccccc4n23)cs1 515598902 KKIRQDFJQICQJR-UHFFFAOYSA-N 495.633 6.778 5 20 JKBD CCCNC(=O)c1cccc(CNCc2ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])cc2)c1 518764577 UTEQOWIDTHSWFA-UHFFFAOYSA-N 453.926 5.470 5 20 JKBD O=C(Cn1c2ccccc2c(=O)c2ccccc21)Nc1ccc(Cn2cnc3ccccc32)cc1 520080199 YUNQXJVSZKNJCW-UHFFFAOYSA-N 458.521 5.191 5 20 JKBD COc1cc(OCC(=O)Nc2ccccc2Oc2ncc(Cl)cc2Cl)ccc1[N+](=O)[O-] 520589488 NQZDJAORLHXSHT-UHFFFAOYSA-N 464.261 5.115 5 20 JKBD O=[N+]([O-])c1ccc(-c2nn(-c3ccccc3)cc2CN[C@H](c2ccccc2)[C@H]2CCCO2)cc1 520962180 STOMYOIVCVTPHD-XNMGPUDCSA-N 454.530 5.457 5 20 JKBD COc1cc(CNCc2ccc(-c3csc(C)n3)cc2)c([N+](=O)[O-])cc1OCC(F)(F)F 521831866 SMEDCUFJKFDXBC-UHFFFAOYSA-N 467.469 5.266 5 20 JKBD CN(C[C@@H]1CCCO[C@@H]1c1ccccc1)C(=O)c1cc([N+](=O)[O-])ccc1Sc1ccccc1 604519687 OLOBPYZWZCNEHT-NBGIEHNGSA-N 462.571 5.986 5 20 JKBD CC(C)CCSc1ccc(C(=O)N2CCC(c3nc(-c4ccccn4)no3)CC2)cc1[N+](=O)[O-] 608809010 FDWDWHFTCYSCSG-UHFFFAOYSA-N 481.578 5.198 5 20 JKBD Cc1cc(O[C@@H](C)c2ccccc2)ccc1NC(=O)N1CCN(C(=O)c2ccc([N+](=O)[O-])s2)CC1 609080069 AQJQKIZNIVUCRD-SFHVURJKSA-N 494.573 5.095 5 20 JKBD Cc1ccc(NC(=O)[C@@H](OC(=O)Cc2c[nH]c3cc(C)ccc23)c2ccccc2)c([N+](=O)[O-])c1 726222919 HNWWRHVJKSALKZ-VWLOTQADSA-N 457.486 5.159 5 20 JKBD O=C(CCC(=O)c1ccc2ccc3cccc4ccc1c2c34)Nc1cc2c(cc1Cl)NC(=O)CO2 727755151 PQPHJYCSKXJBHM-UHFFFAOYSA-N 482.923 6.170 5 20 JKBD Cc1cc(O[C@H](C)c2ccccc2)ccc1NC(=O)[C@@H]1CC(=O)N(c2ccc(F)c([N+](=O)[O-])c2)C1 728010799 JQJMJZRPKMALHL-IEBWSBKVSA-N 477.492 5.174 5 20 JKBD O=C(Nc1ccc(N2CCc3sccc3C2)cc1)C1CCN(c2ccccc2[N+](=O)[O-])CC1 748653988 WWBGKMRWQXVAJA-UHFFFAOYSA-N 462.575 5.074 5 20 JKBD CC[C@H](C)n1c(S[C@H](C)C(=O)Nc2cc([N+](=O)[O-])ccc2Cl)nnc1-c1ccccc1 749752023 OKXXTOSSPBOTJZ-UONOGXRCSA-N 459.959 5.597 5 20 JKBD CSc1ccc(C(=O)c2ccccc2C(=O)O[C@H](C)C(=O)Nc2cccc(C)c2)cc1[N+](=O)[O-] 777422313 VYAZVTGGLDKQDN-MRXNPFEDSA-N 478.526 5.040 5 20 JKBD Cc1cc(C)c(NC(=O)c2ccc(NS(=O)(=O)c3ccc(Cl)c([N+](=O)[O-])c3)cc2)c(C)c1 791034306 IIXSDAQWSYABHQ-UHFFFAOYSA-N 473.938 5.227 5 20 JKBD O=C(Nc1cc(-c2nnc3n2CCCCC3)ccc1Cl)c1cc([N+](=O)[O-])ccc1N1CCCCC1 819418612 KGBXPTPRZYFSQV-UHFFFAOYSA-N 494.983 5.476 5 20 JKBD COc1c([N+](=O)[O-])cc(N[C@@H]2CCSc3c(F)cccc32)c([N+](=O)[O-])c1Br 836198981 QHUUJNGAELQIBY-SNVBAGLBSA-N 458.265 5.062 5 20 JKBD C[C@@H](Sc1nnc(-c2ccncc2)n1Cc1ccccc1)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl 843536945 MBEIVGMJGKDABG-OAHLLOKOSA-N 494.964 5.069 5 20 JKBD COc1ccccc1-c1nnc(S[C@H](C(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)c2ccccc2)o1 849210505 MPWBPZYDLCOXOW-FQEVSTJZSA-N 496.932 5.779 5 20 JKBD COc1cc2[nH]c(/C(Cl)=C\c3ccc(Oc4ccc(F)cc4)c([N+](=O)[O-])c3)nc(=O)c2cc1OC 916127035 WUHVCULGSNBMMV-RQZCQDPDSA-N 497.866 5.517 5 20 JKBD CC(=O)N(c1ccc(Cl)cc1)c1nc(COC(=O)c2cc3cc([N+](=O)[O-])ccc3s2)cs1 918990434 IYYSNYPNYYDXJN-UHFFFAOYSA-N 487.946 5.961 5 20 JKBD Cc1c(C(=O)O[C@H](C)C(=O)N2c3ccccc3Sc3ccccc32)cc([N+](=O)[O-])cc1[N+](=O)[O-] 919227975 UDDDWOZKGLTTJI-CQSZACIVSA-N 479.470 5.186 5 20 JKBD CC(C)c1ccccc1NC(=O)[C@@H](C)OC(=O)c1ccc(N[C@H](C)c2ccccn2)c([N+](=O)[O-])c1 920548786 SQEFVXMHZIKGAI-QZTJIDSGSA-N 476.533 5.470 5 20 JKBD C[C@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)O[C@H](C)C(=O)Nc1ccccc1Cc1ccccc1 920779303 RVIFOBNEYXXJKK-SJORKVTESA-N 482.920 5.177 5 20 JKBD CC(C)c1nn2ccccc2c1C(=O)Nc1ccc(C2(NC(=O)c3ccc([N+](=O)[O-])o3)CCC2)cc1 1788394596 JYWFEOFDQADKPX-UHFFFAOYSA-N 487.516 5.020 5 20 JKBD Cc1nscc1C(=O)NC1(c2ccc(NC(=O)c3cc4cc([N+](=O)[O-])ccc4s3)cc2)CCC1 1791009977 DVWQIUPKWKLNLA-UHFFFAOYSA-N 492.582 5.636 5 20 JKBD Cc1cccc(/C=C/C(=O)NC2(c3ccc(NC(=O)/C=C/c4ccccc4[N+](=O)[O-])cc3)CCC2)n1 1792315313 AQMMJJFSAXKHHA-AMRBXKIKSA-N 482.540 5.159 5 20 JKBD Cc1ccc(-c2ccccc2C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)/C=C/c2ccc([N+](=O)[O-])o2)cc1 1793277111 VNFZUPOKPMAABN-JUOQVHBBSA-N 485.540 5.128 5 20 JKBD Cc1ccc(CC(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2ccc(Oc4ccccc4)cc2)C3)cc1[N+](=O)[O-] 1800139394 OBCNABZAJNZXJO-BKFWDETESA-N 499.567 5.190 5 20 JKBD O=C(CCC1CCC1)N1CCCC[C@@H]1c1cc(NC(=O)C2(c3cccc([N+](=O)[O-])c3)CCC2)n[nH]1 1820840345 BBQAOSHWHNACJK-JOCHJYFZSA-N 479.581 5.012 5 20 JKBD Cc1cc(Cl)cc(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)c3cccc(F)c3[N+](=O)[O-])n[nH]2)c1 1821175269 ZDIMDPUBOKFYIS-LJQANCHMSA-N 485.903 5.039 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cccc(Cl)c2)[nH]n1 1821286595 AAWLCBXWGXWYJN-LJQANCHMSA-N 485.903 5.039 5 20 JKBD Cc1cc2cccc(C(=O)N3CCCC[C@@H]3c3cc(NC(=O)/C=C/c4ccccc4[N+](=O)[O-])n[nH]3)c2[nH]1 1823505168 XFUWCFFLXDMMFZ-MDRMPYQZSA-N 498.543 5.127 5 20 JKBD O=C(c1ccc(F)cc1)N1CCC([C@H]2CCCCN2C(=O)C2(c3cccc([N+](=O)[O-])c3)CCC2)CC1 1830292891 KWFHFLMWCHTVJZ-RUZDIDTESA-N 493.579 5.089 5 20 JKBD C/C=C(\C)C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)CC1 1831061266 QYRNHMNEEZOICL-QPHYPNAHSA-N 455.580 5.009 5 20 JKBD CC[C@H]1CC[C@H](C(=O)N2CCCC[C@H]2C2CCN(C(=O)c3cc([N+](=O)[O-])ccc3N(C)C)CC2)CC1 1831695375 SAGXXXPHMLCRHH-XTJBDQBJSA-N 498.668 5.111 5 20 JKBD O=C(c1c(Cl)cccc1Cl)N1CC2(CCCN2C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)C1 1845739242 ACWCUDITUSDTMK-UHFFFAOYSA-N 490.368 5.247 5 20 JKBD Cc1ccc(NC(=O)[C@@H](C)OC(=O)c2ccccc2C(=O)c2ccc(Cl)c([N+](=O)[O-])c2)cc1F 15710281 POFUJSHTSDOFSR-CQSZACIVSA-N 484.867 5.111 5 20 JKBD CSc1ccc([N+](=O)[O-])c(C(=O)OCc2csc(N(C(C)=O)c3cccc(Cl)c3)n2)c1 16196878 FWGVFZLAXQXSPD-UHFFFAOYSA-N 477.951 5.468 5 20 JKBD Cc1csc(SCc2ccccc2C(=O)O[C@@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2C)n1 22163257 IKGLXBNGIBYNSD-HNNXBMFYSA-N 471.560 5.144 5 20 JKBD C[C@H](Sc1nnc(-c2cccs2)n1Cc1ccccc1)C(=O)Nc1ccc(F)c([N+](=O)[O-])c1 36802155 LJKCRWLRBJXAQW-AWEZNQCLSA-N 483.550 5.222 5 20 JKBD CC(C)CCSc1ccc(C(=O)N2CCC(C(=O)c3cc(F)ccc3F)CC2)cc1[N+](=O)[O-] 108156072 BAQIYNTWPKHTCP-UHFFFAOYSA-N 476.545 5.746 5 20 JKBD CNC(=O)c1cc(NC(=O)c2ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])cc2)ccc1Cl 108728714 WHYOPLZOSLSCLR-UHFFFAOYSA-N 460.273 5.306 5 20 JKBD C[C@@H](Nc1ccc(C(=O)NCc2ccc(CN3CCCCC3)cc2)cc1[N+](=O)[O-])c1ccccn1 108785981 FHARBPSDFLSINS-HXUWFJFHSA-N 473.577 5.079 5 20 JKBD COc1cc(C(=O)N[C@@H](c2ccc(Cl)cc2)c2cccs2)c([N+](=O)[O-])cc1OC(F)F 117302245 GDGZDYDVFVAZPF-SFHVURJKSA-N 468.865 5.439 5 20 JKBD C[C@@H](Sc1nnc(/C=C/c2ccccc2)[nH]1)C(=O)Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1 253491831 NXLAKSOWCPXVGM-PLSXKVAHSA-N 478.559 5.126 5 20 JKBD O=C(Nc1cc([N+](=O)[O-])ccc1OC(F)F)c1ccccc1-c1ncc(-c2ccccc2)o1 483007876 AZFFSKJDCCJHBJ-UHFFFAOYSA-N 451.385 5.771 5 20 JKBD O=c1c2c3c(sc2nc(Sc2ccc([N+](=O)[O-])c4cnccc24)n1C[C@H]1CCCO1)CCCC3 497727645 OMEVSAQTLMXYDP-CQSZACIVSA-N 494.598 5.123 5 20 JKBD O=C(CSc1nnc(-c2ccc(F)cc2)c2ccccc12)Nc1ccc(Cl)cc1[N+](=O)[O-] 499829841 MOXSRDYMAURDJK-UHFFFAOYSA-N 468.897 5.728 5 20 JKBD Cc1cc(NC(=O)c2ccc(F)cc2Cl)sc1C(=O)N1c2ccc([N+](=O)[O-])cc2C[C@@H]1C 504324878 NICKIHYNUHJNJH-LBPRGKRZSA-N 473.913 5.601 5 20 JKBD C[C@H](Nc1ccc(C(=O)NCCc2c(Cl)cccc2Cl)cc1[N+](=O)[O-])c1ccccn1 507650656 QBFKMUONGSVFLA-AWEZNQCLSA-N 459.333 5.442 5 20 JKBD CSc1ccc(C(=O)c2ccccc2C(=O)Nc2ccc(NC3CCOCC3)cc2)cc1[N+](=O)[O-] 513061172 IANYOEWKFKTTCR-UHFFFAOYSA-N 491.569 5.391 5 20 JKBD O=C(N[C@H]1CCSc2ccc(Cl)cc21)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 520664081 AOAQXKQVZITVHG-KRWDZBQOSA-N 499.942 5.837 5 20 JKBD CN(CCc1ccccn1)C(=O)c1c2c(nc3ccccc13)/C(=C\c1cccc([N+](=O)[O-])c1)CCC2 524488681 MKRQVLOJWUSLQM-UZYVYHOESA-N 478.552 5.730 5 20 JKBD Cc1ccc(NC(=O)[C@@H](Sc2nnc(-c3ccoc3C)o2)c2ccccc2)c([N+](=O)[O-])c1 592947607 REKMVYUMIXVJEY-IBGZPJMESA-N 450.476 5.327 5 20 JKBD O=C1c2cc(Cl)ccc2N[C@H](c2csc(-c3cccc([N+](=O)[O-])c3)n2)N1c1ccncc1 602757026 MUAAYCDRGBABNL-FQEVSTJZSA-N 463.906 5.538 5 20 JKBD Cc1c([C@H](C)NC(=O)CSc2ccc(C(F)(F)F)cc2[N+](=O)[O-])cnn1-c1ccc(F)cc1 603548966 VXSZAWJTUMSBKF-LBPRGKRZSA-N 482.459 5.216 5 20 JKBD O=C(Nc1cc([N+](=O)[O-])ccc1OC(F)F)c1ccc(Oc2ccc(C(F)(F)F)cn2)cc1 603638463 PJUVTAJKLXOVHS-UHFFFAOYSA-N 469.322 5.655 5 20 JKBD Cc1ccc(S(=O)(=O)Nc2ccc(NC(=O)[C@@H]3CCC[C@H](C(F)(F)F)C3)cc2)cc1[N+](=O)[O-] 603780471 DKRSUFDWQCYFLZ-CABCVRRESA-N 485.484 5.011 5 20 JKBD C[C@@H]1CCCN(c2ccc(C(=O)Nc3ccccc3COCc3ccccc3)cc2[N+](=O)[O-])C1 603912012 IIMNWZOYKSAVBW-HXUWFJFHSA-N 459.546 5.800 5 20 JKBD COc1c(Br)cc(Cl)cc1NC(=O)N(Cc1ccc([N+](=O)[O-])cc1)C(C)C 609210926 UOYXTGVXXLPDJA-UHFFFAOYSA-N 456.724 5.462 5 20 JKBD Cc1ccsc1C(=O)Nc1ccc(OC(=O)c2csc(-c3ccc([N+](=O)[O-])cc3)n2)cc1 729215703 FLJSPQWXVQZBJN-UHFFFAOYSA-N 465.512 5.560 5 20 JKBD O=C(c1c2c(nc3ccccc13)/C(=C\c1ccc([N+](=O)[O-])cc1)CCC2)N1CCC[C@@H](C2OCCO2)C1 729361632 YJQOLIONYMALSF-OJLMNSMJSA-N 499.567 5.245 5 20 JKBD O=C(Nc1ccc(=O)n(Cc2ccc(Cl)c(Cl)c2)c1)c1ccc(Cl)c([N+](=O)[O-])c1 743695315 GNMJBWVDRMGQDX-UHFFFAOYSA-N 452.681 5.017 5 20 JKBD C[C@H](OC(=O)Cn1ccc2cc([N+](=O)[O-])ccc21)C(=O)Nc1c(Cl)cc(Cl)cc1Cl 744623156 KHSBMEXCHOXEFD-JTQLQIEISA-N 470.696 5.080 5 20 JKBD CC(C)(C)OC(=O)N1CCC[C@H]1[C@H]1CCCN(C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)C1 749658426 DBEUWHFGMSGKHQ-YJBOKZPZSA-N 459.568 5.061 5 20 JKBD CC(C)Cn1cc([C@@H]2N(c3cc(Cl)c(C(F)(F)F)cc3[N+](=O)[O-])CC23CCOCC3)cn1 849477829 BXYOZERVVKLCMD-IBGZPJMESA-N 472.895 5.478 5 20 JKBD O=[N+]([O-])c1ccc(/C=C(/Cc2nc(Cc3ccncc3)no2)c2nc3ccccc3s2)cc1 904933841 RZVDDWUYKDFWLF-AQTBWJFISA-N 455.499 5.357 5 20 JKBD Cc1ccc(NC(=O)[C@H](OC(=O)c2sccc2Br)c2ccccc2)c([N+](=O)[O-])c1 919343950 RMCCVSQJXBVNMA-QGZVFWFLSA-N 475.320 5.264 5 20 JKBD Cc1cc(F)ccc1C(=O)NC1(c2ccc(NC(=O)/C=C/c3ccc([N+](=O)[O-])o3)cc2)CCC1 1786208276 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494.375 5.350 5 20 JKBD COc1cc(NC(=O)C/C(=C/c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)cc(OC)c1 15075751 PPLADQNOHCSUSX-BOPFTXTBSA-N 475.526 5.791 5 20 JKBD CSc1ccc([N+](=O)[O-])c(C(=O)Oc2ccc(NC(=O)c3cc([N+](=O)[O-])ccc3Cl)cc2)c1 16260749 BCRHIIDCXIIRNB-UHFFFAOYSA-N 487.877 5.350 5 20 JKBD C[C@@H](Sc1nnc(-c2ccccc2)c(-c2ccccc2)n1)C(=O)Nc1ccccc1[N+](=O)[O-] 33941615 MMVIXVLWCYFXGI-MRXNPFEDSA-N 457.515 5.233 5 20 JKBD Cc1ccccc1N(C(=O)CCCn1c(=O)oc2cc([N+](=O)[O-])ccc21)c1nc2ccccc2s1 104948019 JYCKCRJOGWWKDU-UHFFFAOYSA-N 488.525 5.566 5 20 JKBD Cc1cc(OCc2cccc(F)c2)ccc1NC(=O)[C@H]1CCCN1C(=O)c1ccc([N+](=O)[O-])c(C)c1 112518714 HAGMOUKYADLHKM-RUZDIDTESA-N 491.519 5.173 5 20 JKBD CN(Cc1cccc(C(F)(F)F)c1)C1CCN(C(=O)c2ccc([N+](=O)[O-])cc2Cl)CC1 302973413 DNDBLPMQMLEEMK-UHFFFAOYSA-N 455.864 5.004 5 20 JKBD O=C(NC1(c2cccc(Br)c2)CCC1)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-] 490225853 VVHBQGSYZSCRQM-UHFFFAOYSA-N 473.245 5.108 5 20 JKBD CCOc1cc(NC(=O)c2cnn(-c3cccc(Cl)c3)c2C(C)C)c([N+](=O)[O-])cc1OCC 498376281 OKIYXUWUWXVDFW-UHFFFAOYSA-N 472.929 5.607 5 20 JKBD O=C(Nc1cccc(Cl)c1)N1CCCN(C(=O)c2ccc(Nc3ccccc3)c([N+](=O)[O-])c2)CC1 499075948 OFYMRRVXEQXOPN-UHFFFAOYSA-N 493.951 5.372 5 20 JKBD Cn1cnnc1Sc1ccc(C(=O)N[C@@H](c2ccccc2)c2cccc(Cl)c2)cc1[N+](=O)[O-] 501445123 CQEOJGUXFOCCEV-NRFANRHFSA-N 479.949 5.047 5 20 JKBD Cc1csc(Sc2ccc(C(=O)Nc3cc(F)ccc3OC[C@H]3CCCO3)cc2[N+](=O)[O-])n1 502394846 VSOQKIQJXNDBLW-MRXNPFEDSA-N 489.550 5.460 5 20 JKBD C[C@H](NC(=O)c1ccc(Sc2nncn2C)c([N+](=O)[O-])c1)c1ccccc1Oc1ccccc1 506152399 HMYQORYGRVSDSB-INIZCTEOSA-N 475.530 5.158 5 20 JKBD CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)N[C@@H](Cn1cnc2ccccc21)c1ccc(F)cc1 509276725 LZZCSRZRVRLRLG-DEOSSOPVSA-N 475.524 5.445 5 20 JKBD CSc1ccccc1NC(=O)CN(C)C(=O)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1 514527624 WVFFZTZSONGXEE-UHFFFAOYSA-N 485.949 5.473 5 20 JKBD Cc1ccc([N+](=O)[O-])cc1NC(=O)CNc1ccc(C(=O)N(C)C2CCCCC2)c(Cl)c1 515658581 BPYFJDROJUJSNQ-UHFFFAOYSA-N 458.946 5.012 5 20 JKBD O=C(CCCOc1ccccc1)Nc1ccc(CNC(=O)c2cc3cc([N+](=O)[O-])ccc3o2)cc1 603761987 VNOYZIRYAMOBDN-UHFFFAOYSA-N 473.485 5.069 5 20 JKBD O=[N+]([O-])c1cc2c(O)ncnc2cc1NCc1ccc(Oc2ccc(Oc3ccccc3)cc2)nc1 603870666 STERLFZTXLWGRD-UHFFFAOYSA-N 481.468 5.835 5 20 JKBD O=C(c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1)N1CCCO[C@@H](c2ccccc2)C1 609230252 BBTQBGZBMDKUMF-HSZRJFAPSA-N 452.894 5.644 5 20 JKBD O=C(NCc1ccccn1)c1ccc(NC(=O)c2cc3ccccc3c3cccnc23)cc1Cl 611967381 BKHJAZHVUIOLMV-UHFFFAOYSA-N 466.928 5.619 5 20 JKBD Cc1ccc(C)c(NC(=O)[C@@H](OC(=O)c2cc([N+](=O)[O-])ccc2Br)c2ccccc2)c1 725985285 JTAZYYLDVPUJEY-NRFANRHFSA-N 483.318 5.511 5 20 JKBD Cc1ccc2c(CC(=O)O[C@@H](C(=O)Nc3ccc([N+](=O)[O-])cc3Cl)c3ccccc3)c[nH]c2c1 726223437 LLAHLVFHAAEPRM-XMMPIXPASA-N 477.904 5.504 5 20 JKBD O=C(Nc1nc2ccccc2n1Cc1cccc(C(F)(F)F)c1)c1cc([N+](=O)[O-])ccc1F 728000135 YSAPKNVQZMMISH-UHFFFAOYSA-N 458.371 5.403 5 20 JKBD C[C@H](OC(=O)c1c(Cl)cccc1[N+](=O)[O-])C(=O)Nc1ccc(OCc2ccccc2)cc1 730644721 FGXTTWMNTWZHGE-HNNXBMFYSA-N 454.866 5.011 5 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VJYFARHCHLDZCI-UHFFFAOYSA-N 493.507 5.164 5 20 JKBD O=C(NC1(c2ccc(NC(=O)C3(c4cccc([N+](=O)[O-])c4)CCC3)cc2)CCC1)[C@H]1C[C@]1(F)Cl 1790476329 BRAJDANBASPMQG-CJFMBICVSA-N 485.943 5.075 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)Nc1ccc(C2(NC(=O)c3ccc4nccnc4c3)CCC2)cc1 1790771130 RJRGJNVKEIWNNY-UHFFFAOYSA-N 499.502 5.047 5 20 JKBD C[C@H](Cc1ccc(F)cc1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cc3cc([N+](=O)[O-])ccc3s1)C2 1801491027 YOLOJVLXZIFSNM-HUJKARHJSA-N 495.576 5.079 5 20 JKBD CC(C)[C@H]1CC[C@H](C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cc4cc([N+](=O)[O-])ccc4s2)C3)CC1 1801817378 CKYXXYLZJOJDPM-SMWGBGATSA-N 483.634 5.524 5 20 JKBD Cc1c(C(=O)N2CCC3(CCCN(C(=O)[C@H](F)c4ccccc4)C3)CC2)cc(Cl)cc1[N+](=O)[O-] 1806524732 FJLDTFWOIHDGPU-JOCHJYFZSA-N 487.959 5.112 5 20 JKBD O=C(CSc1ccccc1[N+](=O)[O-])Nc1cc([C@@H]2CCCCN2C(=O)CCC2CCCC2)[nH]n1 1822312710 OZYGEVUJLHTXKI-IBGZPJMESA-N 485.610 5.073 5 20 JKBD Cc1ccc(F)cc1C(=O)N1CCCC[C@@H]1C1CCN(C(=O)CSc2ccccc2[N+](=O)[O-])CC1 1823895432 VPVHYKTYOZNFBZ-JOCHJYFZSA-N 499.608 5.068 5 20 JKBD O=C(c1cccc(F)c1[N+](=O)[O-])N1CCC([C@@H]2CCCCN2C(=O)c2cc3ccoc3s2)CC1 1827413701 OOWQROZKPAXKSB-IBGZPJMESA-N 485.537 5.089 5 20 JKBD Cc1ccc(/C=C/C(=O)O[C@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)c(Br)c1 17747662 YYPLBNHFDFMMSE-UTSBKAFOSA-N 458.268 5.033 5 20 JKBD C[C@H](OC(=O)c1ccc(COc2ccc3ccccc3c2)o1)C(=O)Nc1ccccc1[N+](=O)[O-] 25049910 MHYLHSYLGZSQNZ-INIZCTEOSA-N 460.442 5.104 5 20 JKBD COc1ccc([N+](=O)[O-])cc1NC(=O)[C@H](C)Sc1nnc(-c2ccc(F)cc2)n1-c1ccccc1 28797748 FSJMWWAXLNROJH-HNNXBMFYSA-N 493.520 5.110 5 20 JKBD Cc1csc(Sc2ccc(C(=O)Nc3cccc(NC(=O)c4ccncc4)c3)cc2[N+](=O)[O-])n1 31966017 FKFXPYQGUOLEKI-UHFFFAOYSA-N 491.554 5.411 5 20 JKBD O=C(Cc1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1)Nc1nnc(-c2ccsc2)s1 108448490 GPBFXAWBBKYXKB-UHFFFAOYSA-N 488.554 5.209 5 20 JKBD C[C@@H](Nc1ccc(C(=O)Nc2cc3c(cc2Cl)OCCCO3)cc1[N+](=O)[O-])c1ccccn1 108788127 PDQYIRQQFBHBJR-CQSZACIVSA-N 468.897 5.230 5 20 JKBD CC(C)(CNC(=O)C1CCN(c2ccccc2[N+](=O)[O-])CC1)c1ccc(Cl)c(Cl)c1 109594631 ZUMSAXIATVCOIK-UHFFFAOYSA-N 450.366 5.212 5 20 JKBD Cc1nc([N+](=O)[O-])cn1CCC(=O)N(c1ccc(Cl)c(Cl)c1)c1nc2ccccc2s1 488274650 UXZLHOJULXBBHE-UHFFFAOYSA-N 476.345 5.771 5 20 JKBD CSc1ccc([N+](=O)[O-])c(C(=O)Nc2ccc(CN3C(=O)Cc4ccc(Cl)cc43)cc2)c1 498884224 NKRZJOMHDPIHIA-UHFFFAOYSA-N 467.934 5.312 5 20 JKBD C[C@H](Sc1nc(-c2cccs2)c(-c2cccs2)[nH]1)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 501339226 XSKXSNYISCRYSL-LBPRGKRZSA-N 481.584 6.678 5 20 JKBD CCOc1cc(C(=O)Nc2cc(C(=O)Nc3ccccc3)ccc2Cl)c([N+](=O)[O-])cc1OC 502715319 LSIOKUPIEBKLHB-UHFFFAOYSA-N 469.881 5.160 5 20 JKBD CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccc(C(=O)N(C)C2CCCCC2)c(Cl)c1 509223459 AZZDCKZEPLFBSI-UHFFFAOYSA-N 487.000 6.095 5 20 JKBD COc1ccc(CNCc2cc(Br)cs2)cc1OCc1ccc([N+](=O)[O-])cc1 512853799 CQQJYCUPYIFRRW-UHFFFAOYSA-N 463.353 5.296 5 20 JKBD C[C@H](Sc1nnc(-c2ccccc2)n1[C@@H](C)c1ccccc1)C(=O)Nc1ccc([N+](=O)[O-])cc1 515488826 YBXWLMNGFJZVAM-ROUUACIJSA-N 473.558 5.582 5 20 JKBD O=C(Nc1cccc(OCc2cccnc2)c1)c1ccc(NCc2ccccc2)c([N+](=O)[O-])c1 515580005 CPVLEXJDEOZVSA-UHFFFAOYSA-N 454.486 5.433 5 20 JKBD CNc1ccc(C(=O)Nc2cc(NC(=O)c3cccc(C(F)(F)F)c3)ccc2C)cc1[N+](=O)[O-] 518889423 IFTOLYIXSAACPN-UHFFFAOYSA-N 472.423 5.468 5 20 JKBD O=[N+]([O-])c1cc(CNCC2(c3ccc4c(c3)OCO4)CCOCC2)ccc1Oc1ccc(F)cc1 520215961 IRGBPXONPWRCGD-UHFFFAOYSA-N 480.492 5.093 5 20 JKBD O=C(NCc1ccc(NC(=O)c2c[nH]c3ccc([N+](=O)[O-])cc23)cc1)c1ccc(Br)cc1 520771422 HNHWIFNFNOGZTK-UHFFFAOYSA-N 493.317 5.021 5 20 JKBD C[C@H](Nc1ccc(C(=O)Nc2ccc(OCC(F)(F)C(F)F)nc2)cc1[N+](=O)[O-])c1ccccn1 521497793 QEMDUEAXDPMDSC-ZDUSSCGKSA-N 493.417 5.089 5 20 JKBD CCOc1cc(NC(=O)Cc2csc(-c3ccc(C(F)(F)F)cc3)n2)c([N+](=O)[O-])cc1OCC 591743027 XWQPNLDSBMVQLO-UHFFFAOYSA-N 495.479 5.716 5 20 JKBD COC(=O)c1ccc(CNC(=O)C/C(=C\c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)cc1 603468789 ZREYAWJQPOVKPU-XSFVSMFZSA-N 487.537 5.238 5 20 JKBD Cc1ccc(OCCCC(=O)Nc2ccc(CNC(=O)c3ccc([N+](=O)[O-])cc3Cl)cc2)cc1 603761978 VDCLCLNDSHZNFK-UHFFFAOYSA-N 481.936 5.284 5 20 JKBD O=C(C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)NCc1cc(-c2ccccc2)no1 604113768 FOJPWCKETAKJMT-ZHZULCJRSA-N 496.548 6.107 5 20 JKBD C[C@H](Nc1ccc(C(=O)N(C)C[C@H]2CCCO[C@H]2c2ccccc2)cc1[N+](=O)[O-])c1ccccn1 604519717 QVKKTBVHJPANCR-WSNOQYBDSA-N 474.561 5.403 5 20 JKBD COC(=O)c1ccccc1C(=O)c1ccc(N(C)C[C@H]2CCCO[C@@H]2c2ccccc2)c([N+](=O)[O-])c1 604520421 MPVVQENKSGTKGL-JIPXPUAJSA-N 488.540 5.217 5 20 JKBD CCc1sc(NC(=O)c2cc(OCC(F)(F)F)ccc2[N+](=O)[O-])nc1-c1ccc(OC)cc1 609202371 FFGSKYAMSPFFFF-UHFFFAOYSA-N 481.452 5.483 5 20 JKBD COc1ccc(CSCC(=O)Oc2ccc(NC(=O)c3ccc(C)cc3)cc2)cc1[N+](=O)[O-] 726961886 QSBNTZGYMRKSKS-UHFFFAOYSA-N 466.515 5.003 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)O[C@H](C(=O)Nc2ccc(F)cc2)c2ccccc2)cc1SC 728650156 DIQLJQHMICBFRC-NRFANRHFSA-N 470.478 5.001 5 20 JKBD CCOc1cc([C@H](C[N+](=O)[O-])c2c[nH]c3ccccc23)ccc1OS(=O)(=O)C1CCCCC1 731215029 FIFLFQVLDIWYKV-NRFANRHFSA-N 472.563 5.017 5 20 JKBD Cc1csc(Sc2ccc(C(=O)O[C@H](C)c3nnc(-c4ccc(F)cc4)o3)cc2[N+](=O)[O-])n1 746140219 KINUURYYEFIMSS-GFCCVEGCSA-N 486.506 5.618 5 20 JKBD C[C@H](NC(=O)[C@@H](C)OC(=O)c1csc(-c2ccc([N+](=O)[O-])cc2)n1)c1cccc2ccccc12 747956667 JDRTVFZKBALHBR-JKSUJKDBSA-N 475.526 5.294 5 20 JKBD CC(=O)N(c1nc(COc2cc(C=O)ccc2[N+](=O)[O-])cs1)c1c(C)cc(C)cc1Cl 748153853 CQCJTRVKAQWCEG-UHFFFAOYSA-N 459.911 5.398 5 20 JKBD CCOc1cc(/C=C(/C(=O)OCc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)c2ccccc2)ccc1O 786189249 FVQYMZLUOVHGCW-KGENOOAVSA-N 487.468 5.033 5 20 JKBD CCN(Cc1ccc(C(F)(F)F)cc1)C(=O)c1ccc(Cn2nc(C)c([N+](=O)[O-])c2C)cc1 914486234 MVLQASFBOIUYOM-UHFFFAOYSA-N 460.456 5.138 5 20 JKBD COc1ccc(Oc2ccc([N+](=O)[O-])cc2C(=O)O[C@H](C)C(=O)N2CCC[C@@H]2c2cccs2)cc1 915443118 YRJFBOUOSMJGNH-IIBYNOLFSA-N 496.541 5.366 5 20 JKBD O=C(OCC(=O)N1CCc2sccc2[C@H]1c1ccccc1)c1cc2cc([N+](=O)[O-])ccc2s1 918990072 DXMRCSPOMRCRIH-HSZRJFAPSA-N 478.551 5.202 5 20 JKBD O=C(/C=C/c1ccc([N+](=O)[O-])o1)Nc1ccc(C2(NC(=O)[C@H]3C[C@H]3c3ccc(F)cc3)CCC2)cc1 1786205612 LABNZMHQONSDFZ-XPHCTPJTSA-N 489.503 5.278 5 20 JKBD Cc1occc1C(=O)Nc1ccc(C2(NC(=O)c3cc(Br)ccc3[N+](=O)[O-])CCC2)cc1 1787364572 NYXNCSGMPFZOGC-UHFFFAOYSA-N 498.333 5.320 5 20 JKBD CC(C)=CCCC(=O)Nc1ccc(C2(NC(=O)Cc3cc(F)ccc3[N+](=O)[O-])CCC2)cc1 1790453378 CKQWCLKPLSIKNC-UHFFFAOYSA-N 453.514 5.157 5 20 JKBD C[C@]1(C(=O)NC2(c3ccc(NC(=O)c4cc5cc([N+](=O)[O-])ccc5s4)cc3)CCC2)CC1(F)F 1791010798 ZFBCTEXMTRTZTH-JOCHJYFZSA-N 485.512 5.603 5 20 JKBD O=C(CSc1ccccc1[N+](=O)[O-])Nc1ccc(C2(NC(=O)c3ccccc3F)CCC2)cc1 1791522928 HUCBMXULWRIWON-UHFFFAOYSA-N 479.533 5.274 5 20 JKBD Cc1c(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)C[C@H](C)c2ccccc2)cc(Cl)cc1[N+](=O)[O-] 1801751731 AFUDQEFHVUBYIW-KQLYMOGASA-N 469.969 5.002 5 20 JKBD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)/C=C/c1ccccc1[N+](=O)[O-])c1c(F)cc(Cl)cc1Cl 1804345438 LRUMOXMGVMPELG-ORIYUZMUSA-N 492.334 5.006 5 20 JKBD O=C(Cc1ccc(Cl)cc1[N+](=O)[O-])N1CCCC2(CCN(C(=O)c3ccc(Cl)s3)CC2)C1 1805480637 SHGNHLREGQFLAU-UHFFFAOYSA-N 496.416 5.051 5 20 JKBD Cc1ccc(CC(=O)N2CCC([C@@H]3CCCCN3C(=O)c3ccc(Cl)s3)CC2)cc1[N+](=O)[O-] 1825856859 LMAMEDYCQJHWIY-IBGZPJMESA-N 490.025 5.094 5 20 JKBD Cc1c(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)Cc3cccs3)CC2)cc(Cl)cc1[N+](=O)[O-] 1830735451 KTLNOUXCRACHEY-OAQYLSRUSA-N 490.025 5.094 5 20 JKBD Cc1cc(O)c([N+](=O)[O-])cc1C(=O)N1CCCC[C@H]1C1CCN(C(=O)C[C@H](C)c2ccccc2)CC1 1830789348 GWYXQORIOSOCAY-CYFREDJKSA-N 493.604 5.036 5 20 JKBD O=C(/C=C/c1ccccc1[N+](=O)[O-])N1CCC([C@H]2CCCCN2C(=O)c2cccc3ccncc23)CC1 1830866894 JOCFKNPAXFTAIB-TYBKAHOSSA-N 498.583 5.090 5 20 JKBD O=C(CCC1CCCC1)N1CCC([C@H]2CCCCN2C(=O)/C=C/c2ccccc2[N+](=O)[O-])CC1 1832903211 VIXUNTZENPTUJY-DQRYEYLNSA-N 467.610 5.198 5 20 JKBD COc1cc2c(cc1NC(=O)COC(=O)c1ccc(Br)c([N+](=O)[O-])c1)oc1ccccc12 9848936 UZKAXBWWQGBWAP-UHFFFAOYSA-N 499.273 5.061 5 20 JKBD CCOc1ccc([C@@H](CNC(=O)c2ccc([N+](=O)[O-])s2)c2c[nH]c3ccccc23)cc1OC 16176473 GDNNRUFKNHYLPS-QGZVFWFLSA-N 465.531 5.107 5 20 JKBD CC1=C(C(=O)Nc2ccccc2)[C@@H](c2ccc(Cl)c([N+](=O)[O-])c2)NC(=O)N1Cc1cccs1 16495202 AYORILMGIDCYRD-OAQYLSRUSA-N 482.949 5.489 5 20 JKBD CC(=O)Nc1ccc(S[C@@H](C(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)c2ccccc2)cc1 16553341 BGLLBWITUHFYNC-OAQYLSRUSA-N 455.923 5.679 5 20 JKBD Cc1csc(Sc2ccc(C(=O)Nc3ccc(C(=O)Nc4nccs4)cc3)cc2[N+](=O)[O-])n1 24913468 HSEZCLXPPDTAQG-UHFFFAOYSA-N 497.583 5.472 5 20 JKBD COc1ccccc1NS(=O)(=O)c1cc([N+](=O)[O-])ccc1N[C@@H](C)c1ccccc1OC(F)F 26718503 BRBFMUXPYUDIMZ-AWEZNQCLSA-N 493.488 5.179 5 20 JKBD O=C(CCCn1c(=O)oc2cc([N+](=O)[O-])ccc21)Nc1ccc(-c2nc3ccccc3s2)cc1 26783482 RXZASGJMENRXNV-UHFFFAOYSA-N 474.498 5.198 5 20 JKBD CCOc1cc([N+](=O)[O-])c(C(=O)Nc2ncc(Cc3cccc(C)c3Cl)s2)cc1OC 26979747 LOTKVPDPQSKZPK-UHFFFAOYSA-N 461.927 5.264 5 20 JKBD O=C(CCCNC(=O)c1ccco1)Nc1cc([N+](=O)[O-])ccc1Nc1cccc(C(F)(F)F)c1 32531796 YGPLTPRHUBVVOZ-UHFFFAOYSA-N 476.411 5.099 5 20 JKBD COc1cccc(Oc2ccc(CNC(=O)c3ccc(N[C@H](C)c4ccccn4)c([N+](=O)[O-])c3)cn2)c1 108828103 PFLRATRCZFFZHD-GOSISDBHSA-N 499.527 5.289 5 20 JKBD O=C(Nc1cc(F)cc(N2CCOCC2)c1)c1ccc(NCc2ccccc2Cl)c([N+](=O)[O-])c1 216405702 PSRQCCKVKGQYJJ-UHFFFAOYSA-N 484.915 5.088 5 20 JKBD C[C@@H](Nc1ccc(C(=O)Nc2c(F)cccc2Oc2ccccc2)cc1[N+](=O)[O-])c1ccccn1 410032424 CNQCOUQOZODMAG-QGZVFWFLSA-N 472.476 6.347 5 20 JKBD CCn1c(SCc2nnc(C(=O)Nc3ccc(C)cc3)s2)nc2cc3ccccc3cc2c1=O 498090365 GDARFYREEDIUMU-UHFFFAOYSA-N 487.610 5.274 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)N[C@H](C)c2sc(-c3ccc(C)cc3)nc2C)cc1SC 502485996 PVWCRAYHXPKBAF-CYBMUJFWSA-N 457.577 5.557 5 20 JKBD O=C1CCc2cc([N+](=O)[O-])c(Sc3nnc(-c4ccc(F)cc4)n3Cc3ccccc3)cc2N1 506812034 KVJHAKZROIXXOI-UHFFFAOYSA-N 475.505 5.077 5 20 JKBD Cc1ccc([C@@H](NC(=O)c2ccc([N+](=O)[O-])cc2I)c2ccccc2)cc1 508761252 FXUQPQOXOGNQBJ-FQEVSTJZSA-N 472.282 5.027 5 20 JKBD COc1cc(C(=O)Nc2cc(-c3cccc(C)c3)nn2Cc2ccccc2)c([N+](=O)[O-])cc1OC 515000364 KJHSWNPHYZNYNX-UHFFFAOYSA-N 472.501 5.085 5 20 JKBD Cc1nc2c3ccccc3nn2c(C)c1CCC(=O)Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1 517322126 QQFWXDXUTCDDOS-UHFFFAOYSA-N 472.530 5.102 5 20 JKBD O=[N+]([O-])c1ccc(-c2ccc(CNCc3cccc(COCc4ccco4)c3)o2)c(Br)c1 520951880 RHNHUUZFEBNHEW-UHFFFAOYSA-N 497.345 6.217 5 20 JKBD C[C@@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)Nc1ccc(Br)cc1Br 521274923 TWCLPNJQQSGXER-MRVPVSSYSA-N 478.524 5.179 5 20 JKBD Cc1csc(Sc2ccc(NC(=O)[C@H]3CCCN3C(=O)c3ccc([N+](=O)[O-])c(C)c3)c(C)c2)n1 549331150 AZPUTQNTIGNMPU-OAQYLSRUSA-N 496.614 5.371 5 20 JKBD COc1cc(C(=O)N2CCC[C@@H]2c2ccc(O)cc2)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 604485681 RBEKXNKZSGDXKE-LJQANCHMSA-N 468.893 5.732 5 20 JKBD O=C(COc1cccc([N+](=O)[O-])c1)Nc1ccccc1OCc1ncc(-c2cccc(Cl)c2)o1 608851262 XRYFQIJYBYDRTH-UHFFFAOYSA-N 479.876 5.500 5 20 JKBD CC(C)(C)OC(=O)N1CCc2cc(NC(=O)Cn3c4ccccc4c(=O)c4ccccc43)ccc21 726509600 SQZUROMMXFKGMF-UHFFFAOYSA-N 469.541 5.091 5 20 JKBD C[C@@H](NC(=O)CCC(=O)c1ccc2ccc3cccc4ccc1c2c34)c1cccc(NS(C)(=O)=O)c1 727756228 VXNKANPGIOVOEF-GOSISDBHSA-N 498.604 5.796 5 20 JKBD O=C(COc1ccccc1OCC(F)(F)F)N(CC1CC1)c1ccc(Cl)c([N+](=O)[O-])c1 728167232 UIPMDDOFUJPMBD-UHFFFAOYSA-N 458.820 5.011 5 20 JKBD O=C(N[C@H](c1ccccc1)c1ccc2c(c1)CCCO2)c1cc([N+](=O)[O-])ccc1Br 730504649 ZYRUHIODNXGSDK-JOCHJYFZSA-N 467.319 5.202 5 20 JKBD O=C(Nc1ccccc1C(=O)NCCc1c[nH]c2cc(F)ccc12)c1ccc([N+](=O)[O-])cc1Cl 747766091 SLGSIHQRAJBBJI-UHFFFAOYSA-N 480.883 5.093 5 20 JKBD COc1cccc(-c2nc(COC(=O)c3csc(-c4ccc([N+](=O)[O-])cc4)n3)cs2)c1OC 747954986 RGQJBBSNWRNBMD-UHFFFAOYSA-N 483.527 5.216 5 20 JKBD C[C@@H](OC(=O)Cn1c2ccccc2c(=O)c2ccccc21)c1ccc(NC(=O)c2ccccc2)cc1 748014175 KORRXKOSKJHBGA-HXUWFJFHSA-N 476.532 5.711 5 20 JKBD O=C(Nc1ccc(NC2CCCCC2)cc1)c1cc([N+](=O)[O-])ccc1I 749385717 PBMKNVVDFBNHHA-UHFFFAOYSA-N 465.291 5.196 5 20 JKBD C[C@H](OC(=O)/C=C\c1ccc(Cl)s1)C(=O)Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1 829068039 YSFHBEXAUPNARK-JYKYSHPRSA-N 463.924 5.017 5 20 JKBD O=C(Nc1cc(Cl)c([N+](=O)[O-])cc1OCc1ccccc1)c1ccc(C(F)(F)F)cn1 844281427 ZXRTWABWNVFUCW-UHFFFAOYSA-N 451.788 5.493 5 20 JKBD CC(C)Cn1cc([C@@H]2N(Cc3cc(Cl)cc(Cl)c3[N+](=O)[O-])CC23CCOCC3)cn1 849481969 STOONPGHSSJHMO-FQEVSTJZSA-N 453.370 5.108 5 20 JKBD Cc1cc([N+](=O)[O-])ccc1NC(=O)COC(=O)c1ccccc1-c1ncc(-c2ccccc2F)o1 899990941 YPOFPZYMRNOCEE-UHFFFAOYSA-N 475.432 5.160 5 20 JKBD O=C(Nc1ccccc1C(=O)Nc1ccc(Br)cc1O)c1ccc([N+](=O)[O-])cc1Cl 915198227 FUGZHFWODOUHGA-UHFFFAOYSA-N 490.697 5.221 5 20 JKBD Cc1cc(Cc2cnc(NC(=O)c3cc([N+](=O)[O-])ccc3F)s2)ccc1Br 921160885 BBIZZZBNQSYSBU-UHFFFAOYSA-N 450.289 5.104 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)c3ccc([N+](=O)[O-])cc3F)CCC2)cc1)c1ccc(Cl)o1 1788880953 RKAVRNSWOICXMJ-UHFFFAOYSA-N 457.845 5.042 5 20 JKBD Cc1nc(C(=O)NC2(c3ccc(NC(=O)/C=C/c4ccccc4[N+](=O)[O-])cc3)CCC2)sc1C 1792317257 HUZBDDMRMMCQIH-MDWZMJQESA-N 476.558 5.129 5 20 JKBD O=[N+]([O-])c1cc2c(c(CSc3nnc(-c4ccc(Cl)cc4)n3-c3ccccc3)c1)OCOC2 8641477 UEGMKQUBQNRTFR-UHFFFAOYSA-N 480.933 5.655 5 20 JKBD Cc1ccc(-c2cc(C(=O)OCC(=O)Nc3c(C)cccc3[N+](=O)[O-])c3cnn(C(C)C)c3n2)s1 11260388 KOUGHGZBTXGRFA-UHFFFAOYSA-N 493.545 5.061 5 20 JKBD Cc1nc(-c2ccc(C(F)(F)F)cc2)sc1C(=O)O[C@@H](C)C(=O)Nc1ccccc1[N+](=O)[O-] 25664270 QIUMJHGXEFITDD-LBPRGKRZSA-N 479.436 5.230 5 20 JKBD COc1cc(C(=O)Nc2nc(-c3ccc[nH]3)cs2)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 28253825 WLDRXWZRYTVBHV-UHFFFAOYSA-N 470.894 5.753 5 20 JKBD C[C@H](OC(=O)Cc1coc2ccc3ccccc3c12)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl 28937215 MHIQWVPVVMNTFQ-ZDUSSCGKSA-N 452.850 5.261 5 20 JKBD CN(C(=O)c1ccc(NC(=O)N2CCN(c3ccc([N+](=O)[O-])cc3)CC2)cc1Cl)C1CCCCC1 71942380 ARBKRMIWGSYTGX-UHFFFAOYSA-N 499.999 5.007 5 20 JKBD Cc1nc(COc2cccc(C(=O)N(Cc3ccccc3[N+](=O)[O-])CC(F)(F)F)c2)cs1 106188075 PMTHAGDMOJBKKV-UHFFFAOYSA-N 465.453 5.143 5 20 JKBD CC1CCN(c2ccc(C(=O)Nc3ccccc3NC(=O)c3ccccc3)cc2[N+](=O)[O-])CC1 106256494 PGYZZBDYUCKBAS-UHFFFAOYSA-N 458.518 5.336 5 20 JKBD C[C@@H](Nc1ccc(C(=O)Nc2ccc(C(=O)N3CCCCCC3)cc2)cc1[N+](=O)[O-])c1ccccn1 108884797 PNTAXNPBANFYMT-LJQANCHMSA-N 487.560 5.431 5 20 JKBD C[C@@H](Nc1ccc(C(=O)Nc2ccc(-c3cn4ccsc4n3)cc2)cc1[N+](=O)[O-])c1ccccn1 506030716 KJEFTJFLCUTSDR-MRXNPFEDSA-N 484.541 5.791 5 20 JKBD O=C(Cn1c2ccccc2c(=O)c2ccccc21)NCC1(c2cccc(C(F)(F)F)c2)CCOCC1 507888844 NDAYPQRIGWJOQY-UHFFFAOYSA-N 494.513 5.038 5 20 JKBD COc1cc(CNCc2ccc(Sc3ccc(C)cc3)c([N+](=O)[O-])c2)cc(OC)c1OC 511833596 GRZINORFMXESQO-UHFFFAOYSA-N 454.548 5.370 5 20 JKBD COCCN(C(=O)c1ccc(Oc2ccccc2)cc1)c1nc(-c2ccc([N+](=O)[O-])cc2)cs1 514472092 HYDQVUGQSZPRHX-UHFFFAOYSA-N 475.526 5.804 5 20 JKBD O=[N+]([O-])c1cc(CSc2nnc(Cn3cnc4ccccc43)n2-c2ccccc2Cl)cs1 515592605 VPDYKFMEONGDEE-UHFFFAOYSA-N 482.978 5.581 5 20 JKBD O=[N+]([O-])c1cccc(N(Cc2coc(-c3ccc(F)cc3)n2)S(=O)(=O)c2ccc(F)c(F)c2)c1 603438861 OICQBYYIYUKGGD-UHFFFAOYSA-N 489.431 5.063 5 20 JKBD O=C(C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)NCCc1ccccc1F 603820728 WWHOCYBAUVZAMY-CYVLTUHYSA-N 461.518 5.633 5 20 JKBD O=C(CCOc1ccccc1[N+](=O)[O-])N[C@@H](c1ccccc1)c1ccc2nc(C(F)(F)F)[nH]c2c1 603951116 BFOSTDNYBMLHBX-QFIPXVFZSA-N 484.434 5.165 5 20 JKBD O=C(c1ccc(C(F)(F)F)cc1)N1CCN(C(=O)c2cc3ccccc3c3cccnc23)CC1 643153087 PAPLXDBRSGZYNM-UHFFFAOYSA-N 463.459 5.005 5 20 JKBD C[C@H](OC(=O)c1cc([N+](=O)[O-])ccc1Br)C(=O)N1c2ccccc2Sc2ccccc21 725985623 VBGIJNCWYSRQAV-ZDUSSCGKSA-N 499.342 5.732 5 20 JKBD Cc1onc(-c2c(Cl)cccc2Cl)c1C(=O)Nc1cc(-c2cccc([N+](=O)[O-])c2)[nH]n1 729528892 IKTWTJGZBHPINX-UHFFFAOYSA-N 458.261 5.507 5 20 JKBD C[C@@H](OC(=O)c1cc(-c2ccc(C(F)(F)F)cc2)no1)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl 730858592 SBIQDKPEJVVKTJ-SNVBAGLBSA-N 483.786 5.106 5 20 JKBD CC[C@@H](C)Sc1ccc(NC(=O)[C@H]2CC(=O)N(c3ccc(F)c([N+](=O)[O-])c3)C2)c(C(F)(F)F)c1 748656380 GUMKFJXHLQQALU-OLZOCXBDSA-N 499.486 5.635 5 20 JKBD CCOc1ccc([C@@H](NC(=O)c2cc([N+](=O)[O-])ccc2Br)C(C)C)cc1OCC 750601880 LTUJXRIVLZDVIT-FQEVSTJZSA-N 465.344 5.282 5 20 JKBD CSc1ccccc1NC(=O)[C@@H](C)OC(=O)c1cc([N+](=O)[O-])ccc1Sc1nc(C)cs1 849132840 ZEZAGPYRDDGRRN-CYBMUJFWSA-N 489.600 5.417 5 20 JKBD CC(C)(C)OC(=O)Nc1cccc(-c2noc([C@H]3CCCN3C(=O)c3ccc([N+](=O)[O-])s3)n2)c1 904636025 OXYLFGMKEVCCLB-OAHLLOKOSA-N 485.522 5.031 5 20 JKBD O=C(Nc1ccc(NC(=O)c2cc(Cl)ccc2[N+](=O)[O-])c(C(F)(F)F)c1)c1ccoc1 916069066 QRLBQLAJBIVCHN-UHFFFAOYSA-N 453.760 5.365 5 20 JKBD O=C(N[C@H](c1ccc(Cl)cc1)c1cccs1)c1cc([N+](=O)[O-])ccc1I 916425468 YGPGWZFQLFASBP-QGZVFWFLSA-N 498.729 5.434 5 20 JKBD C[C@@H](OC(=O)CCCc1c[nH]c2ccccc12)C(=O)Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1 916582038 XXVHJSPYOJNGHD-OAHLLOKOSA-N 478.530 5.093 5 20 JKBD Cc1cc(C(=O)O[C@@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2ccccc2)cc([N+](=O)[O-])c1 920902898 LWSBSESRLUVPRE-HXUWFJFHSA-N 469.837 5.002 5 20 JKBD O=C(/C=C/c1ccoc1)Nc1ccc(C2(NC(=O)CSc3ccccc3[N+](=O)[O-])CCC2)cc1 1786749847 VNMDAXACKNEXGU-IZZDOVSWSA-N 477.542 5.127 5 20 JKBD O=C(Cc1cccc([N+](=O)[O-])c1)NC1(c2ccc(NC(=O)c3cccc4ncccc34)cc2)CCC1 1788903974 IYPVMMZGVIGVOT-UHFFFAOYSA-N 480.524 5.133 5 20 JKBD Cc1c(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cccc(C(F)(F)F)c2)cc(Cl)cc1[N+](=O)[O-] 1799646081 NPTLSXCLDPCAQS-BCDXTJNWSA-N 495.885 5.141 5 20 JKBD O=C(/C=C/c1ccccc1[N+](=O)[O-])Nc1cc([C@@H]2CCCCN2C(=O)c2sccc2Cl)[nH]n1 1823504442 LYXFOUUPBOVJKF-BLGFXRMMSA-N 485.953 5.052 5 20 JKBD O=C(c1cc2[nH]ccc2s1)N1CCC([C@H]2CCCCN2C(=O)CCc2cccc([N+](=O)[O-])c2)CC1 1824839508 JNAAUJZKLFAKJA-JOCHJYFZSA-N 494.617 5.004 5 20 JKBD Cc1ccc2[nH]c(C(=O)N3CCCC[C@@H]3C3CCN(C(=O)c4ccc([N+](=O)[O-])cc4F)CC3)cc2c1 1828123584 WWIUERAQRPGLFG-RUZDIDTESA-N 492.551 5.071 5 20 JKBD O=C(O[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Br)c1ccccc1)C1CCCCC1 10626712 SNJYOCLGMDZLOI-LJQANCHMSA-N 461.312 5.161 5 20 JKBD C[C@@H](OC(=O)CCC(=O)c1ccc2ccccc2c1)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 10975454 UHWZNKYKKUICHK-CQSZACIVSA-N 488.418 5.300 5 20 JKBD C[C@@H](OCCCNC(=O)c1ccccc1NC(=O)c1ccc([N+](=O)[O-])cc1Cl)c1ccccc1 15372877 QNYBUMLHHNNOFD-QGZVFWFLSA-N 481.936 5.398 5 20 JKBD COc1cc(CSc2nnc(-c3cccnc3)n2Cc2ccccc2)c([N+](=O)[O-])cc1OC(F)F 24972945 WWWKJDSFAYHZII-UHFFFAOYSA-N 499.499 5.199 5 20 JKBD COc1ccc([C@@H]2[C@@H](C(=O)Nc3cc([N+](=O)[O-])ccc3C)CCC(=O)N2c2ccc(OC)cc2)cc1 36774296 OFDYNUWQVXOAMF-JYFHCDHNSA-N 489.528 5.043 5 20 JKBD Cc1c(C(=O)Nc2nc(-c3cc(Cl)ccc3Cl)cs2)cc([N+](=O)[O-])cc1[N+](=O)[O-] 72102618 XLSSXJQENPLFFI-UHFFFAOYSA-N 453.263 5.494 5 20 JKBD O=C(Nc1ccc(N2CCOCC2)cc1C(F)(F)F)c1ccc(Nc2ccccc2)c([N+](=O)[O-])c1 108242236 CJHKKLUZFJOWGN-UHFFFAOYSA-N 486.450 5.446 5 20 JKBD Cc1cccc(NC(=O)[C@@H]2CCCN(C(=O)c3ccc(Oc4ccc(Cl)cc4[N+](=O)[O-])cc3)C2)n1 108864818 POBXKGSZDYPLPB-GOSISDBHSA-N 494.935 5.235 5 20 JKBD COc1cc(C(=O)Nc2cc(C)ccc2NC(C)=O)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 110706459 MBFDNJWJRVTPRW-UHFFFAOYSA-N 469.881 5.568 5 20 JKBD CC1CCN(c2ccc(C(=O)Nc3cc(C(=O)N(C)C(C)C)ccc3Cl)cc2[N+](=O)[O-])CC1 303150598 SPPUZIWZDKJIDV-UHFFFAOYSA-N 472.973 5.217 5 20 JKBD C[C@@H]1CCCN(c2ccc(C(=O)Nc3ccccc3NC(=O)Cc3cccs3)cc2[N+](=O)[O-])C1 409979247 KUVITDLEBHLTIX-QGZVFWFLSA-N 478.574 5.326 5 20 JKBD Cc1ccc(-c2csc(NC(=O)COc3ccc(Oc4ccccn4)cc3)n2)cc1[N+](=O)[O-] 483489527 NMZLGJKQFZPSGH-UHFFFAOYSA-N 462.487 5.232 5 20 JKBD O=C(Nc1ccc(OC(F)F)cc1OC(F)F)c1csc(-c2cccc([N+](=O)[O-])c2)n1 498617871 DMQASWHCRIFSNT-UHFFFAOYSA-N 457.361 5.173 5 20 JKBD COc1ccc(CSCC(=O)N[C@H](C)c2sc(-c3ccccc3)nc2C)cc1[N+](=O)[O-] 509605297 PQACQTYALXFJDX-CQSZACIVSA-N 457.577 5.146 5 20 JKBD COc1ccc(N(C(=O)c2ccc(Sc3nc(C)cs3)c([N+](=O)[O-])c2)C(C)C)cc1F 509811666 WKLUJORTUPIWFY-UHFFFAOYSA-N 461.540 5.714 5 20 JKBD O=C(C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)N1CCCC[C@H]1c1ncc[nH]1 509974899 ZSCXDTHFWGHAMA-RHYRFBSLSA-N 473.558 5.612 5 20 JKBD CCc1ccc(-c2csc(NC(=O)c3ccc([N+](=O)[O-])cc3I)n2)cc1 511508581 VPKAVHXVFVBXGE-UHFFFAOYSA-N 479.299 5.138 5 20 JKBD Cc1cc(N[C@@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2C(F)(F)F)ccc1NC(=O)c1ccco1 511686190 WVIADMQMTOHTDV-ZDUSSCGKSA-N 476.411 5.206 5 20 JKBD CCOc1cc(C(=O)N[C@@H](c2ccc(C(C)C)cc2)c2cccs2)c([N+](=O)[O-])cc1OC 512461146 AGOVPLFFAQJIHF-QHCPKHFHSA-N 454.548 5.706 5 20 JKBD COc1cc(C(=O)N(Cc2ccccc2)CC2CCC2)c([N+](=O)[O-])cc1OCc1cscn1 512940840 QZZUAWKQGUTAJN-UHFFFAOYSA-N 467.547 5.081 5 20 JKBD COc1cc(C(=O)Nc2ccc3nc(-c4cc(F)ccc4F)[nH]c3c2)c([N+](=O)[O-])cc1OC(F)F 516128339 MQGHSXJZVTXFMP-UHFFFAOYSA-N 490.369 5.279 5 20 JKBD CCc1nc(CN(C)C(=O)c2ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])c(OC)c2)cs1 516778082 PTZBATAVIQNTTK-UHFFFAOYSA-N 461.927 5.340 5 20 JKBD C[C@@H](NCc1ccc(Oc2ccc(C(C)(C)C)cc2)c([N+](=O)[O-])c1)c1nnc2n1CCCCC2 517538844 MODDNKSHRNCYSG-GOSISDBHSA-N 463.582 5.853 5 20 JKBD O=C(Cn1c2ccccc2c(=O)c2ccccc21)Nc1nc2c(s1)C[C@H](c1ccccc1)CC2 520019718 GWQPWHBHKRDPNE-LJQANCHMSA-N 465.578 5.522 5 20 JKBD C[C@H](NC(=O)C(=O)Nc1ccc(Oc2ccccc2)cc1C(F)(F)F)c1cccc([N+](=O)[O-])c1 520081979 HDQCPNFUZBTPLM-AWEZNQCLSA-N 473.407 5.222 5 20 JKBD COc1ccc([N+](=O)[O-])c(C(=O)Nc2cc(C(=O)Nc3cccc(C(F)(F)F)c3)ccc2C)c1 520489084 MMPJVQLVVQVPIS-UHFFFAOYSA-N 473.407 5.435 5 20 JKBD O=C(Nc1ccc(Oc2ccccc2)cc1C(F)(F)F)c1ccc(N2CCCC2)c([N+](=O)[O-])c1 520674709 GYNRUZWREWPCJD-UHFFFAOYSA-N 471.435 6.258 5 20 JKBD CCC(=O)Nc1ccc(N[C@@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Br)c2ccccc2)cc1 520741035 IQEIEZIXHFQWLW-JOCHJYFZSA-N 497.349 5.498 5 20 JKBD Cc1ccc(-c2nnc(NC(=O)c3ccc(N[C@H](C)c4ccccn4)c([N+](=O)[O-])c3)s2)c(C)c1 521328020 JGONAEGCDSNJFR-MRXNPFEDSA-N 474.546 5.551 5 20 JKBD CCN(Cc1cccc(F)c1)C(=O)c1ccc(C(=O)N(CC)Cc2cccc(F)c2)c([N+](=O)[O-])c1 556344158 GAEQQWQTYGCNNX-UHFFFAOYSA-N 481.499 5.198 5 20 JKBD Cc1ccc(C(=O)Nc2ccccc2OCc2ncc(-c3cccc(Cl)c3)o2)cc1[N+](=O)[O-] 608851188 UXENSOFWNMJMIB-UHFFFAOYSA-N 463.877 6.043 5 20 JKBD O=C1CCc2cc([N+](=O)[O-])c(NCc3ccccc3-c3ccc(Cn4cccn4)cc3)cc2N1 608908994 JHAPJSUSDZVKEF-UHFFFAOYSA-N 453.502 5.003 5 20 JKBD O=C(c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1)N1CCO[C@H](c2cccc(F)c2)C1 608964974 POJCDWRNZBQHQF-QFIPXVFZSA-N 456.857 5.393 5 20 JKBD Cc1sc(NC(=O)c2cc(Br)cnc2Cl)nc1-c1cccc([N+](=O)[O-])c1 726502930 LIHMZMSTYLEMJA-UHFFFAOYSA-N 453.705 5.090 5 20 JKBD Cc1nc(-c2cccc(NC(=O)c3ccc(N[C@@H](C)c4ccccn4)c([N+](=O)[O-])c3)c2)[nH]c1C 746880573 BZGHHFPPCYJXCS-KRWDZBQOSA-N 456.506 5.422 5 20 JKBD Cc1ccc([C@@H](NC(=O)COC(=O)c2csc(-c3cccc([N+](=O)[O-])c3)n2)c2cccs2)cc1 747961869 LQGCRWQEMQDSGO-JOCHJYFZSA-N 493.566 5.151 5 20 JKBD CN(Cc1ccccc1)c1ccc(NC(=O)c2ccc([N+](=O)[O-])cc2I)cc1 751099588 WVHDGKRMTLKDPW-UHFFFAOYSA-N 487.297 5.088 5 20 JKBD Cc1cccc(C(=O)OCC(=O)N2c3ccccc3Sc3ccc(Cl)cc32)c1[N+](=O)[O-] 777748653 WUQQONGADQXBBM-UHFFFAOYSA-N 454.891 5.543 5 20 JKBD Cc1nc2ccccc2c(-c2ccccc2)c1CC(=O)OCC(=O)Nc1ccc([N+](=O)[O-])cc1Cl 800367923 UPRGWNNXOHAFRC-UHFFFAOYSA-N 489.915 5.496 5 20 JKBD CCCC(=O)Nc1cccc(CNC(=O)c2ccccc2NC(=O)c2ccc([N+](=O)[O-])cc2Cl)c1 918591748 ZUXLXISDOJHVLA-UHFFFAOYSA-N 494.935 5.169 5 20 JKBD Cc1ccccc1OCCCN(C)C(=O)c1ccccc1NC(=O)c1ccc([N+](=O)[O-])cc1Cl 918663557 QZXAROKNZNVJJG-UHFFFAOYSA-N 481.936 5.350 5 20 JKBD C[C@@H](OC(=O)C1CCN(c2ccccc2[N+](=O)[O-])CC1)c1cccc(NC(=O)c2ccccc2)c1 918841770 VSEDFQMPOCGHMC-LJQANCHMSA-N 473.529 5.368 5 20 JKBD O=C(C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)NCCc1ccc([N+](=O)[O-])cc1 919855202 JATLAOVEVPSWJZ-CYVLTUHYSA-N 488.525 5.402 5 20 JKBD COc1cc(C(=O)OCc2ccc(Cl)c(Cl)c2)c([N+](=O)[O-])cc1OCc1cscn1 919978488 AAFGTASZYANPCP-UHFFFAOYSA-N 469.302 5.303 5 20 JKBD O=C(Cc1cccc([N+](=O)[O-])c1)Nc1ccc(C2(NC(=O)c3ccc4cc[nH]c4c3)CCC2)cc1 1785792086 RMVUWVAIDYDBLY-UHFFFAOYSA-N 468.513 5.067 5 20 JKBD O=C(Cn1ccc2ccc([N+](=O)[O-])cc21)NC1(c2ccc(NC(=O)[C@H]3CCC(F)(F)C3)cc2)CCC1 1785799562 FICBGMZIZQNWGM-SFHVURJKSA-N 496.514 5.119 5 20 JKBD Cc1ccc(CC(=O)Nc2ccc(C3(NC(=O)C4(c5cccc([N+](=O)[O-])c5)CCC4)CCC3)cc2)cn1 1786939919 NKGDIFNLVRFNLM-UHFFFAOYSA-N 498.583 5.097 5 20 JKBD O=C(NC1(c2ccc(NC(=O)[C@H]3C[C@H]3c3ccc(Cl)cc3)cc2)CCC1)c1ccc([N+](=O)[O-])[nH]1 1789154100 LAXBGDUKXHRYOV-PMACEKPBSA-N 478.936 5.128 5 20 JKBD COc1cc(C(=O)NC2(c3ccc(NC(=O)C4(F)CCCCC4)cc3)CCC2)cc([N+](=O)[O-])c1OC 1789161684 FOIPAYJIKWKEND-UHFFFAOYSA-N 499.539 5.032 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)[C@H]3CCC=CO3)CCC2)cc1)c1cc2cc([N+](=O)[O-])ccc2s1 1791010728 SMDFUPZCCYWSNO-HXUWFJFHSA-N 477.542 5.250 5 20 JKBD Cc1ccc(CCC(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)CCc2cccc([N+](=O)[O-])c2)C3)c2ccccc12 1804609985 XXSRXHQROAJTBA-QEIWAGNOSA-N 499.611 5.260 5 20 JKBD O=C(Nc1cc([C@@H]2CCCCN2C(=O)[C@@H]2CCC[C@H]3CCCC[C@@H]32)[nH]n1)c1cccc(F)c1[N+](=O)[O-] 1821169437 HKFLNQNKKLZKEO-FOUBCARRSA-N 497.571 5.369 5 20 JKBD C[C@@H]1C[C@@]1(C)C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)CC1 1831061117 MRORSNZFLMHOKH-UHUZZHMISA-N 469.607 5.089 5 20 JKBD O=C(c1sccc1Cl)N1CCC([C@H]2CCCCN2C(=O)/C=C/c2ccccc2[N+](=O)[O-])CC1 1832903895 HKGWOICHAPYDDN-NDDJGDGRSA-N 488.009 5.256 5 20 JKBD C[C@H](Sc1nnc(-c2ccc(Cl)cc2)n1C)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 9532134 MPICDSAGBBRXLM-JTQLQIEISA-N 485.875 5.182 5 20 JKBD C[C@@H](Sc1nnc(-c2ccccc2F)n1C1CC1)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl 9637462 RLXWCOFWFNBGLS-LLVKDONJSA-N 461.906 5.100 5 20 JKBD C[C@@H](Sc1nnc(NCc2ccccc2)s1)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 11409237 LOIUMVQMMHONME-LLVKDONJSA-N 483.497 5.197 5 20 JKBD CCN(CC(=O)Nc1ccccc1OC)C(=O)c1ccc(Sc2ccc(C)cc2)c([N+](=O)[O-])c1 14999833 NLSGVOSIFXGRFH-UHFFFAOYSA-N 479.558 5.164 5 20 JKBD Cc1ccc(Sc2ccc(C(=O)Nc3cc(S(C)(=O)=O)ccc3C)cc2[N+](=O)[O-])cc1 15815493 UEJKIKBJBBRXMR-UHFFFAOYSA-N 456.545 5.019 5 20 JKBD O=C(Nc1ccc(OC(F)F)cc1)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 15993323 ZXCFXGTUVCASDG-UHFFFAOYSA-N 459.371 5.070 5 20 JKBD Cc1nn(-c2ccccc2)c2sc(C(=O)O[C@@H](C)c3nnc(-c4ccc([N+](=O)[O-])cc4)o3)cc12 17529581 HXWOPFPPYLZQHY-AWEZNQCLSA-N 475.486 5.272 5 20 JKBD Cc1ccc(C)c(OCc2nnc(S[C@@H](C)c3nnc(-c4ccc([N+](=O)[O-])cc4)o3)o2)c1 17717101 WVIFVQJRQBTICE-AWEZNQCLSA-N 453.480 5.077 5 20 JKBD Cc1occc1-c1nnc(SCCCOc2ccc([N+](=O)[O-])cc2)n1Cc1ccccc1 71971127 WFIHECALQNPKHP-UHFFFAOYSA-N 450.520 5.364 5 20 JKBD CSc1ccc(C(=O)N(Cc2ccccn2)c2ccc(Br)cc2)cc1[N+](=O)[O-] 195702455 RMRXAHPIKZNFKS-UHFFFAOYSA-N 458.337 5.321 5 20 JKBD CC1CCN(C(=O)c2ccc(NC(=O)c3ccc(NCc4ccccc4)c([N+](=O)[O-])c3)cc2)CC1 492220151 TUYRZBCXOQUOMK-UHFFFAOYSA-N 472.545 5.331 5 20 JKBD O=C(c1ccc(Cl)cc1)N1CCCN(C(=O)c2cc([N+](=O)[O-])ccc2Sc2ccccc2)CC1 508021343 MGOTXQMHBVHJCA-UHFFFAOYSA-N 495.988 5.388 5 20 JKBD CCOc1cc(CNCc2ccc(C)cc2C)ccc1OCc1cc([N+](=O)[O-])cc2c1OCOC2 509609723 RXLIUKYBEJSCAJ-UHFFFAOYSA-N 478.545 5.346 5 20 JKBD C[C@@H](c1ccc2ccccc2c1)N(C(=O)c1ccc(Sc2nncn2C)c([N+](=O)[O-])c1)C1CC1 509866076 QFKKEJVEIWGBJL-INIZCTEOSA-N 473.558 5.394 5 20 JKBD O=C(c1ccc(Sc2nc3ccccc3s2)c([N+](=O)[O-])c1)N1CCC[C@H]1c1cccnc1 514843303 MSPYEISLSUCSNS-SFHVURJKSA-N 462.556 5.728 5 20 JKBD CCc1ccc(CN[C@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Br)c2ccccc2)s1 515521749 UKAJBNRELIEPLA-FQEVSTJZSA-N 474.380 5.451 5 20 JKBD COc1ccc([C@@H](Cc2ccccc2C)NC(=O)c2ccc(Cl)cc2[N+](=O)[O-])cc1OC 521505772 GSHWVMAFSCQNFU-HXUWFJFHSA-N 454.910 5.288 5 20 JKBD O=C(Cc1csc(-c2cccc(C(F)(F)F)c2)n1)Nc1cc(-c2cccc([N+](=O)[O-])c2)[nH]n1 523832529 ZWABQMYGJVPIEH-UHFFFAOYSA-N 473.436 5.308 5 20 JKBD Cn1ccnc1Sc1ccc(NC(=O)CSc2ccc(C(F)(F)F)cc2[N+](=O)[O-])cc1 566751295 RGZNAYMLBUYIQM-UHFFFAOYSA-N 468.482 5.229 5 20 JKBD O=C(Nc1ccnn1Cc1ccc(C(F)(F)F)cc1)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-] 603733440 YYZWQSSTIVQBMG-UHFFFAOYSA-N 488.344 5.052 5 20 JKBD COc1cc(C(=O)N[C@H](c2ccc(C(C)(C)C)cc2)C(F)(F)F)c([N+](=O)[O-])cc1OC(F)F 604257476 NBVZZYBAEDSWPE-QGZVFWFLSA-N 476.398 5.536 5 20 JKBD COc1ccc(Sc2ccc(NC(=O)c3cc4c(cc3[N+](=O)[O-])OCCO4)cc2Cl)cc1 604456830 JILRFKKDAMVOLZ-UHFFFAOYSA-N 472.906 5.432 5 20 JKBD CCOc1ccc([C@@H](CNC(=O)c2c[nH]c3ccc([N+](=O)[O-])cc23)c2c[nH]c3ccccc23)cc1OC 604545822 PTEPVIXCBCDHDW-OAQYLSRUSA-N 498.539 5.527 5 20 JKBD C[C@@H](Nc1ccc(C(=O)Nc2cccc(-c3n[nH]c(C4CC4)n3)c2)cc1[N+](=O)[O-])c1ccccn1 608851225 VUCSFWILXUONPP-OAHLLOKOSA-N 469.505 5.078 5 20 JKBD Cc1ccc(-c2csc(NC(=O)C3CCN(c4nc5ccccc5s4)CC3)n2)cc1[N+](=O)[O-] 608934830 FMNBCTBJSVNQKO-UHFFFAOYSA-N 479.587 5.492 5 20 JKBD COc1ccc(CSCC(=O)Nc2ccc(N[C@H](C)c3ccccc3)cc2)cc1[N+](=O)[O-] 609071824 GKASYPJIKAZQFA-QGZVFWFLSA-N 451.548 5.648 5 20 JKBD Cc1cc(Sc2ncccn2)ccc1NC(=O)N[C@H](CC(=O)OC(C)C)c1ccccc1[N+](=O)[O-] 609207755 SGDRFDOTWWDCQE-HXUWFJFHSA-N 495.561 5.049 5 20 JKBD CC(C)n1c(SCC(=O)c2cccc([N+](=O)[O-])c2)nnc1-c1ccc(Cl)cc1Cl 612428374 DKCFALHWOMAHOJ-UHFFFAOYSA-N 451.335 5.716 5 20 JKBD Cc1ccc(-c2csc(NC(=O)c3cc(C(C)C)nc4c3cnn4C(C)C)n2)cc1[N+](=O)[O-] 619729706 UYGARBGCJYJUBY-UHFFFAOYSA-N 464.551 5.728 5 20 JKBD Cc1ccc(C(C)C)c(Oc2ccc(CNCc3ccc(-n4cncn4)nc3)cc2[N+](=O)[O-])c1 725845585 AQIUJHYVSLRKJS-UHFFFAOYSA-N 458.522 5.084 5 20 JKBD O=C(Nc1cc(Cl)c([N+](=O)[O-])cc1OCc1ccccc1)c1ccc(F)cc1Br 743853743 LDGDDVARAUNERO-UHFFFAOYSA-N 479.689 5.981 5 20 JKBD CC(=O)N(c1nc(COC(=O)c2ccccc2[N+](=O)[O-])cs1)c1c(C)cc(C)cc1Cl 797106225 XDFWYADATRHSGK-UHFFFAOYSA-N 459.911 5.363 5 20 JKBD O=[N+]([O-])c1cc(CNc2ccc([C@@H](O)C(F)(F)F)cc2)ccc1Oc1ccccc1Cl 864043654 NBHVMPKJIWIQMG-HXUWFJFHSA-N 452.816 6.248 5 20 JKBD Cc1ccc(NC(=O)Cc2noc(-c3ccc(NCc4ccccc4Cl)c([N+](=O)[O-])c3)n2)cc1 904253360 KNPXVBQTIFAQSE-UHFFFAOYSA-N 477.908 5.400 5 20 JKBD Cc1cc(-c2cc(C(=O)OCCOc3ccccc3[N+](=O)[O-])c3cnn(C(C)C)c3n2)c(C)o1 918927986 NILHVVPWGHBXCN-UHFFFAOYSA-N 464.478 5.033 5 20 JKBD Cc1noc([C@@H](C)OC(=O)C/C(=C\c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)n1 926630692 IBUHRWWCNIARPW-KWWJGWKXSA-N 450.476 5.131 5 20 JKBD O=C(Cc1cccc([N+](=O)[O-])c1)Nc1ccc(C2(NC(=O)[C@@H]3[C@H]4Sc5ccccc5[C@@H]43)CCC2)cc1 1785793688 UMHHOBRRPMBRQS-ZNZIZOMTSA-N 499.592 5.159 5 20 JKBD Cc1c(C(=O)NC2(c3ccc(NC(=O)c4ccnn4C(C)C)cc3)CCC2)cc(Cl)cc1[N+](=O)[O-] 1789802561 WVKADIWFIHXONG-UHFFFAOYSA-N 495.967 5.396 5 20 JKBD CCOc1ccccc1C(=O)Nc1ccc(C2(NC(=O)Cc3ccc([N+](=O)[O-])cc3F)CCC2)cc1 1790240838 PLMHYQHGBZMFPA-UHFFFAOYSA-N 491.519 5.123 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)Nc1ccc(C2(NC(=O)c3ccncc3Cl)CCC2)cc1 1790772462 RSYPQBIXKYEODF-UHFFFAOYSA-N 482.899 5.152 5 20 JKBD Cc1cc(Cl)cc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cc(Cl)cc([N+](=O)[O-])c2C)c1 1800713609 UNZHOTIJUFIGBE-REPLKXPHSA-N 476.360 5.084 5 20 JKBD O=C(Nc1cc([C@H]2CCCCN2C(=O)c2cccc3c2oc2ccccc23)[nH]n1)c1ccc([N+](=O)[O-])o1 1814312847 PZPYWKUTHFWPDA-LJQANCHMSA-N 499.483 5.430 5 20 JKBD O=C(CCC1CCCC1)Nc1cc([C@H]2CCCCN2C(=O)Cc2ccc(Cl)cc2[N+](=O)[O-])[nH]n1 1816689528 DIOVWBAQVBZAOX-HXUWFJFHSA-N 487.988 5.177 5 20 JKBD Cc1cscc1C(=O)N1CCCC[C@@H]1c1cc(NC(=O)C2(c3cccc([N+](=O)[O-])c3)CCC2)n[nH]1 1820840309 BJLNFGKZNPGFHC-OAQYLSRUSA-N 493.589 5.116 5 20 JKBD CCC[C@H]1CC[C@H](C(=O)Nc2cc([C@@H]3CCCCN3C(=O)/C=C/c3ccc([N+](=O)[O-])o3)[nH]n2)CC1 1822099474 XDTRALRLYLKKRU-FRIRNCEESA-N 483.569 5.223 5 20 JKBD O=C(CSc1ccccc1[N+](=O)[O-])Nc1cc([C@@H]2CCCCN2C(=O)c2ccc(Cl)cc2)[nH]n1 1822313282 OASFQCMHWWEQIC-SFHVURJKSA-N 499.980 5.070 5 20 JKBD O=C(CCc1cccc([N+](=O)[O-])c1)N1CCC([C@H]2CCCCN2C(=O)c2cccc(Cl)c2)CC1 1829969327 AWODRKNMQCRQMG-XMMPIXPASA-N 483.996 5.114 5 20 JKBD Cc1ncccc1C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)CC1 1831060314 ROTFXHOAOKNPIX-JOCHJYFZSA-N 492.601 5.060 5 20 JKBD Cc1cc(O)c([N+](=O)[O-])cc1C(=O)N1CCC([C@H]2CCCCN2C(=O)C[C@@H](C)c2ccccc2)CC1 1831510062 QFBVEVNQFZBDIS-NTKDMRAZSA-N 493.604 5.036 5 20 JKBD CC(C)c1ccccc1NC(=O)[C@H](C)OC(=O)c1ccccc1C(=O)c1ccc(Cl)c([N+](=O)[O-])c1 15710237 RXFGSOYDTAIUBP-INIZCTEOSA-N 494.931 5.787 5 20 JKBD O=C(COC(=O)c1csc(-c2ccc(Cl)cc2)n1)Nc1ccc(C(F)(F)F)cc1[N+](=O)[O-] 16457238 ZNIYCPZKOARDCT-UHFFFAOYSA-N 485.827 5.186 5 20 JKBD Cc1nn(C)c2sc(C(=O)O[C@H](C(=O)Nc3ccc([N+](=O)[O-])cc3Cl)c3ccccc3)cc12 21697257 NSILUENKHNBDMV-IBGZPJMESA-N 484.921 5.042 5 20 JKBD C[C@@H](Sc1nnc(-c2ccc(C(C)(C)C)cc2)n1C)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl 22213574 QQQUQOXBAPMYLM-CYBMUJFWSA-N 473.986 5.461 5 20 JKBD Cc1cc(Br)c(NC(=O)COc2ccc(Cl)cc2[N+](=O)[O-])c(Br)c1 25201274 GIKQTUUAGXHBOH-UHFFFAOYSA-N 478.524 5.099 5 20 JKBD O=C(OCc1nc2ccccc2n1C(F)F)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 25552386 BRIALFPFQPJTQZ-UHFFFAOYSA-N 498.408 5.318 5 20 JKBD COc1ccc(-c2nnc(SCCC(=O)Nc3ccc([N+](=O)[O-])cc3C)n2-c2ccccc2)cc1 26363809 YCDULZXRCKUJRF-UHFFFAOYSA-N 489.557 5.280 5 20 JKBD COc1ccc(NC(=O)CCSc2nnc(-c3ccc(C(C)(C)C)cc3)o2)c([N+](=O)[O-])c1 26409141 JFDSPHPUWJLQEC-UHFFFAOYSA-N 456.524 5.072 5 20 JKBD CC(C)CCSc1ccc(C(=O)N2CCC[C@@H](c3nc4ccccc4o3)C2)cc1[N+](=O)[O-] 27375316 IVUJWVIPJHHFBN-GOSISDBHSA-N 453.564 5.894 5 20 JKBD Cc1ccc([N+](=O)[O-])cc1NC(=O)CNc1ccc(NC(=O)c2ccc(F)cc2)cc1C(F)(F)F 69627755 AEWRFAZCCKPKKJ-UHFFFAOYSA-N 490.413 5.364 5 20 JKBD CSc1ccc([N+](=O)[O-])c(C(=O)Nc2ccccc2Oc2ncc(Cl)cc2Cl)c1 107810700 KAKOMARAQUUUNE-UHFFFAOYSA-N 450.303 6.063 5 20 JKBD C[C@@H](Nc1ccc(C(=O)N2CCC(c3c[nH]c4ccccc34)CC2)cc1[N+](=O)[O-])c1ccccn1 108787459 PDPMJJMYADFPPN-GOSISDBHSA-N 469.545 5.664 5 20 JKBD O=[N+]([O-])c1cc(CN[C@H](CN2CCOCC2)c2ccccc2)ccc1Oc1ccccc1Cl 216504036 XSEMDMNQDSAJBN-JOCHJYFZSA-N 467.953 5.204 5 20 JKBD CN(Cc1nccn1C(F)F)C(=O)C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1 491739548 KRAPEHJHTXZTGQ-FOWTUZBSSA-N 483.500 5.385 5 20 JKBD Cc1cc(C(=O)N2CCCC2)ccc1NC(=O)c1ccc(NCc2ccccc2)c([N+](=O)[O-])c1 498503739 FDVAMZKAQXVQAT-UHFFFAOYSA-N 458.518 5.004 5 20 JKBD O=C(Nc1ccccc1OCc1cscn1)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1 503473197 VWBHBIOLRTWCBC-UHFFFAOYSA-N 481.917 6.328 5 20 JKBD COc1ccc(-c2nn(Cc3ccccc3)cc2C(=O)Nc2cc([N+](=O)[O-])ccc2OC(F)F)cc1 514501684 SNPMMRYRJKFFCD-UHFFFAOYSA-N 494.454 5.369 5 20 JKBD CCc1cccc(CC)c1NC(=O)N1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 514507025 ZSAVLWSQAVGVNT-UHFFFAOYSA-N 450.461 5.093 5 20 JKBD CCNc1ccc(C(=O)N(Cc2ccccc2)[C@@H](C)c2cccc(NC(C)=O)c2)cc1[N+](=O)[O-] 514943206 KKHIGNUESRVESA-SFHVURJKSA-N 460.534 5.389 5 20 JKBD COCCc1ccc(Oc2ccc(NC(=O)Cn3c4ccccc4c(=O)c4ccccc43)cc2)cc1 520806531 GOJRKCJALMQKFK-UHFFFAOYSA-N 478.548 5.775 5 20 JKBD CSc1ccc(-c2csc(NC(=O)c3ccc([N+](=O)[O-])cc3I)n2)cc1 523004868 LGWLWRRADMKFKL-UHFFFAOYSA-N 497.339 5.297 5 20 JKBD CCOc1ccc(CCC2CCN(C(=O)C3CCN(c4ccccc4[N+](=O)[O-])CC3)CC2)cc1 588724187 YOXSABKABHWFOS-UHFFFAOYSA-N 465.594 5.081 5 20 JKBD COc1ccc(C[C@H](N[C@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2ccccc2)cc1OC 608980576 DOCYHNSLSFHUCN-ZHRRBRCNSA-N 483.952 5.166 5 20 JKBD CC(=O)Nc1cccc(COC(=O)C/C(=C/c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)c1 725918317 HQKZLMXTPNTHGN-MOSHPQCFSA-N 487.537 5.837 5 20 JKBD COc1ccc(OC)c(NC(=S)/C(=C(/O)c2ccc([N+](=O)[O-])cc2)[n+]2ccc(C(C)(C)C)cc2)c1 726569461 IKAKXPILCUHTGA-UHFFFAOYSA-O 494.593 5.520 5 20 JKBD COc1cc(C(=O)N(c2ccc3[nH]ccc3c2)[C@@H](C)CC(C)C)c([N+](=O)[O-])cc1OC(F)F 726917154 VKWRLMVEQGGVFO-AWEZNQCLSA-N 461.465 5.768 5 20 JKBD Cc1ccc(-c2nc(C)c(C(=O)O[C@H](C)c3nnc(-c4ccc([N+](=O)[O-])cc4)o3)s2)c(C)c1 746597567 OORJEOPLKPOFDP-OAHLLOKOSA-N 464.503 5.612 5 20 JKBD C[C@H](OC(=O)Cn1c2ccccc2c(=O)c2ccccc21)c1ccccc1NC(=O)c1ccccc1 748021106 SOMFKMFHGKZPIZ-FQEVSTJZSA-N 476.532 5.711 5 20 JKBD CCOc1cc(NC(=O)NCc2ccc(-c3csc(C)n3)cc2)c([N+](=O)[O-])cc1OCC 749210884 VWZDUKOUBGPMBQ-UHFFFAOYSA-N 456.524 5.146 5 20 JKBD C[C@@H](Nc1ccc(-c2nc(-c3ccc(Br)cc3)no2)cc1[N+](=O)[O-])c1ccccn1 904717829 RRGXSYBSSQRMPA-CYBMUJFWSA-N 466.295 5.642 5 20 JKBD CC1=C(C(=O)Nc2ccc(C)cc2Cl)[C@H](c2cc([N+](=O)[O-])c(F)cc2F)NC(=O)N1CC1CC1 916725619 DVHLTPGWDJFWIT-NRFANRHFSA-N 490.894 5.224 5 20 JKBD Cc1ccc(NS(=O)(=O)c2ccc(Cl)c(C(=O)N[C@@H](C)c3cccc([N+](=O)[O-])c3)c2)cc1C 918135713 JBACYOGMCVZZPC-INIZCTEOSA-N 487.965 5.157 5 20 JKBD O=C(Nc1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2N2CCCCC2)cc1Cl)c1ccco1 918171221 UXJUQRBBCVTXGK-UHFFFAOYSA-N 468.897 5.336 5 20 JKBD Cc1sc2ncnc(SCCC(=O)N(C)Cc3cc([N+](=O)[O-])ccc3Cl)c2c1C 919696616 RCCQQRKTBRGSQU-UHFFFAOYSA-N 450.973 5.011 5 20 JKBD C[C@@H](Nc1ccc(C(=O)Nc2cccc(COc3ccccc3)c2)cc1[N+](=O)[O-])c1ccccn1 919755008 GNWOWBKXTHJGER-LJQANCHMSA-N 468.513 5.994 5 20 JKBD CC(=O)N(c1ccc(C(F)(F)F)cc1)c1nc(COC(=O)c2ccc(C)c([N+](=O)[O-])c2)cs1 920495862 JDLPZHCLYAYLOI-UHFFFAOYSA-N 479.436 5.420 5 20 JKBD COc1cccc(/C=C/C(=O)NC2(c3ccc(NC(=O)/C=C/c4ccc([N+](=O)[O-])o4)cc3)CCC2)c1 1786208211 NUJMRMOEDNSKDN-IRBLODBNSA-N 487.512 5.057 5 20 JKBD O=C(Cc1cc([N+](=O)[O-])ccc1F)Nc1ccc(C2(NC(=O)c3ccc4ccoc4c3)CCC2)cc1 1786672985 XXUFEYZXNLLKNY-UHFFFAOYSA-N 487.487 5.471 5 20 JKBD COc1cscc1C(=O)Nc1ccc(C2(NC(=O)CCc3cccc([N+](=O)[O-])c3)CCC2)cc1 1788825559 PVQAGVDWZVRBKE-UHFFFAOYSA-N 479.558 5.045 5 20 JKBD O=C(Cc1ccc([N+](=O)[O-])cc1F)NC1(c2ccc(NC(=O)c3ccc4ncccc4c3)cc2)CCC1 1788908546 XDUBWAXVEGWFSJ-UHFFFAOYSA-N 498.514 5.273 5 20 JKBD O=C(/C=C/c1ccc([N+](=O)[O-])o1)NC1(c2ccc(NC(=O)CCCCn3cccc3)cc2)CCC1 1789601561 WQMQGBYMYQYJQN-ACCUITESSA-N 476.533 5.007 5 20 JKBD CC(C)c1ccc(C(=O)N2CCCC[C@H]2c2cc(NC(=O)c3cc(F)cc([N+](=O)[O-])c3)n[nH]2)cc1 1821167847 XGYGOZULJVQFGY-QFIPXVFZSA-N 479.512 5.200 5 20 JKBD CC[C@H]1CC[C@H](C(=O)N2CCCC[C@H]2C2CCN(C(=O)Cc3cc([N+](=O)[O-])ccc3F)CC2)CC1 1831691758 NPMTUODIHLPOQD-OWHZGTRUSA-N 487.616 5.113 5 20 JKBD O=C([C@H]1C[C@H]1c1ccc(Cl)cc1)N1CC2(CCCN2C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)C1 1845739214 YADWYXBREMAXFU-PMACEKPBSA-N 495.988 5.084 5 20 JKBD Cc1cc2occ(CC(=O)O[C@H](C)C(=O)Nc3ccc([N+](=O)[O-])cc3C(F)(F)F)c2cc1C 9436537 ZSJFFQKPKMHGQI-CYBMUJFWSA-N 464.396 5.090 5 20 JKBD COc1cc(CSc2nn(-c3ccc(Cl)cc3)c(=S)s2)c([N+](=O)[O-])cc1OC(F)F 12723478 SVYDYUXWRPGGAM-UHFFFAOYSA-N 491.950 6.127 5 20 JKBD Cn1cnnc1Sc1ccc(C(=O)Nc2ccc(-c3nc4ccccc4s3)cc2)cc1[N+](=O)[O-] 14576750 CKRVZIBIPBBKNS-UHFFFAOYSA-N 488.554 5.404 5 20 JKBD CC(C)N(Cc1nnc(-c2ccccc2Cl)o1)C(=O)Cn1c2ccccc2c(=O)c2ccccc21 14808687 WWDSEWSAVXPXNZ-UHFFFAOYSA-N 486.959 5.295 5 20 JKBD O=C(C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)Nc1ccc(F)cc1F 15004420 KKVSNHFEXCLYDQ-PTNGSMBKSA-N 451.454 6.052 5 20 JKBD O=C(CSc1ncnc2sc(-c3ccccc3)cc12)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 23560454 AJMWAYDLNCUSAB-UHFFFAOYSA-N 490.488 6.016 5 20 JKBD C[C@@H](Nc1ccc(NC(=O)CCCn2c(=O)oc3cc([N+](=O)[O-])ccc32)cc1Cl)c1ccccc1 302969603 CYWDWZYKYQZINX-MRXNPFEDSA-N 494.935 5.748 5 20 JKBD CCOc1cc(CNc2ccc(C)cc2)ccc1OCc1cc([N+](=O)[O-])cc2c1OCOC2 477203101 JHULEZCTFPDKPH-UHFFFAOYSA-N 450.491 5.360 5 20 JKBD O=C(Nc1ccc(S(=O)(=O)C2CCCC2)cc1)c1cc([N+](=O)[O-])ccc1Sc1ccccc1 482287353 OZAAHISKWYYUGE-UHFFFAOYSA-N 482.583 5.715 5 20 JKBD COc1cc(C(=O)Nc2ccc(F)cc2-c2ccc(F)cc2)c([N+](=O)[O-])cc1OCc1cscn1 485704548 FMWYYFAOLMTOAD-UHFFFAOYSA-N 497.479 5.836 5 20 JKBD COc1cc(C(=O)Nc2nnc(C(F)(F)F)s2)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 491397857 VRFJNBUYJSYGLJ-UHFFFAOYSA-N 474.804 5.172 5 20 JKBD O=C(Nc1ccc(Oc2ccncc2)c(Cl)c1)c1ccc([N+](=O)[O-])cc1I 504762379 NRTVESPPUXVGIW-UHFFFAOYSA-N 495.660 5.292 5 20 JKBD O=C(c1cc(NCC2(c3cccc(C(F)(F)F)c3)CCOCC2)ccc1[N+](=O)[O-])N1CCCC1 505589573 FISQRJDTAXQCEU-UHFFFAOYSA-N 477.483 5.010 5 20 JKBD CNC(=O)c1ccc(N[C@@H](c2ccccc2)c2ccc(Br)cc2F)c([N+](=O)[O-])c1 506995157 ORCOSCOLASPWPO-FQEVSTJZSA-N 458.287 5.058 5 20 JKBD Cc1sc2ncnc(Sc3ccccc3C(=O)NCCc3ccc([N+](=O)[O-])cc3)c2c1C 507801844 PCSFRWHXDLKVAR-UHFFFAOYSA-N 464.572 5.340 5 20 JKBD COc1cc(C(=O)N(Cc2ccc([C@H]3C[C@H]3C)o2)C2CC2)c([N+](=O)[O-])cc1OCc1cscn1 512343291 NVWCHMJTZCKNDF-KDOFPFPSSA-N 483.546 5.160 5 20 JKBD CC(C)[C@H](NC(=O)c1ccc(N[C@@H](C)c2ccccn2)c([N+](=O)[O-])c1)c1nc2ccccc2[nH]1 516178552 JHPYDPUNGWQYMK-HJPURHCSSA-N 458.522 5.166 5 20 JKBD COc1cc([C@H](C)NCc2ccc(-c3ccc([N+](=O)[O-])cc3Br)o2)cc(OC)c1OC 517537437 WYAOGIQYMSOQIB-ZDUSSCGKSA-N 491.338 5.494 5 20 JKBD Cc1ccc(C(C)C)c(Oc2ccc(CNCc3nncn3-c3ccccc3)cc2[N+](=O)[O-])c1 521819534 QJKGLIPEBSRFLQ-UHFFFAOYSA-N 457.534 5.689 5 20 JKBD Cc1ccc(CN2CCSCC2)cc1NC(=O)c1ccc(N[C@H](C)c2ccccn2)c([N+](=O)[O-])c1 522204657 KGPLJBOLNXAFDJ-LJQANCHMSA-N 491.617 5.272 5 20 JKBD CCCCn1nccc1NC(=O)C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1 522587453 NWONTKKEONPCLV-SDXDJHTJSA-N 461.547 5.771 5 20 JKBD CCOC(=O)c1sc(-c2cccc([N+](=O)[O-])c2)cc1NC(=O)c1cnc(-c2ccccn2)s1 524243593 UFUBTCZHLHPHBY-UHFFFAOYSA-N 480.527 5.271 5 20 JKBD O=C(Nc1ccc(F)c(Cl)c1)c1ccc(C(=O)Nc2ccc(F)c(Cl)c2)c([N+](=O)[O-])c1 524353267 VSFQWESYNDXVBL-UHFFFAOYSA-N 466.227 5.684 5 20 JKBD C[C@H](Sc1nnc(-c2ccccc2)n1[C@@H](C)c1ccccc1)C(=O)Nc1cccc([N+](=O)[O-])c1 603917406 PPRZFSJKCVJYHC-ROUUACIJSA-N 473.558 5.582 5 20 JKBD COc1cc(C(=O)Nc2ccc(C(=O)N3CCCC[C@H]3C)c(Cl)c2)c([N+](=O)[O-])cc1OC(F)F 603987611 RUWGQIWWHUVJEW-GFCCVEGCSA-N 497.882 5.125 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Cl)[C@H](N[C@H]1CCc2c(Cl)cccc21)c1ccccc1 604403755 QBJZDAZTNBMOFJ-RBBKRZOGSA-N 456.329 5.859 5 20 JKBD O=[N+]([O-])c1ccc(-c2ccc(CNCc3ccc(Oc4ccc(F)cc4)nc3)o2)c(Br)c1 608836272 YQUUZTBRDWWHBX-UHFFFAOYSA-N 498.308 6.234 5 20 JKBD Cc1ccc(C(=O)N2CCC(NCc3ccc(Oc4ccccc4Cl)c([N+](=O)[O-])c3)CC2)cc1 608983078 BLVDTNGWMQHWHV-UHFFFAOYSA-N 479.964 5.743 5 20 JKBD C[C@H](NC(=O)Nc1ccc(CNC(=O)c2ccc(C(F)(F)F)cc2)cc1)c1cccc([N+](=O)[O-])c1 609356253 MLNSANIVDVNRTN-HNNXBMFYSA-N 486.450 5.426 5 20 JKBD O=C(O[C@@H](C(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1)c1ccccc1)c1nccc2ccccc12 743199402 IAFPKBCGUDAYKV-JOCHJYFZSA-N 461.861 5.333 5 20 JKBD COc1ccc(-c2noc(CCCC(=O)N(CC3CC3)c3ccc(Cl)c([N+](=O)[O-])c3)n2)cc1 745344754 LWDYBDRNVMXWSQ-UHFFFAOYSA-N 470.913 5.073 5 20 JKBD Cc1onc(-c2c(F)cccc2Cl)c1C(=O)O[C@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl 766522900 PUBMEIYVJHZUFE-SNVBAGLBSA-N 482.251 5.188 5 20 JKBD Cc1nc(COC(=O)c2c3c(nc4ccccc24)/C(=C/c2cccc([N+](=O)[O-])c2)CCC3)no1 783148635 GLXOAFGZCVLJCP-SFQUDFHCSA-N 456.458 5.068 5 20 JKBD C[C@@H](SCc1ccccc1)C(=O)Oc1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2Cl)cc1 916037281 VXOGIEMNGMUXQL-OAHLLOKOSA-N 470.934 5.728 5 20 JKBD O=C(Nc1cc([N+](=O)[O-])c(F)cc1F)[C@H](Oc1cccc(Br)c1)c1ccccc1 916042507 CENIHKSHOGOFCE-LJQANCHMSA-N 463.234 5.394 5 20 JKBD CC(=O)Nc1cccc(NC(=O)[C@H](OC(=O)c2cc([N+](=O)[O-])ccc2Oc2ccccc2)C(C)C)c1 919193574 WSSYHBUETSJADR-XMMPIXPASA-N 491.500 5.166 5 20 JKBD CC(=O)Nc1cc(NC(=O)c2ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])cc2)c(F)cc1F 921156858 ZPKGLIIXPOHBQL-UHFFFAOYSA-N 461.808 5.529 5 20 JKBD Cc1cccnc1CCC(=O)Nc1ccc(C2(NC(=O)/C=C/c3ccccc3[N+](=O)[O-])CCC2)cc1 1786797162 CYIUVHPFTBDMLE-OQLLNIDSSA-N 484.556 5.078 5 20 JKBD O=C(Cc1cc(F)ccc1[N+](=O)[O-])NC1(c2ccc(NC(=O)c3ccc4ncccc4c3)cc2)CCC1 1788909547 TUXGBGSUYAVPAU-UHFFFAOYSA-N 498.514 5.273 5 20 JKBD Cc1cccc(Cl)c1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cc3cc([N+](=O)[O-])ccc3s1)C2 1800493591 IVVVXHMOQPKIQA-BJWYYQGGSA-N 483.977 5.337 5 20 JKBD Cc1c(C(=O)N2CCC3(CCCN(C(=O)CCC4CCCC4)C3)CC2)cc(Cl)cc1[N+](=O)[O-] 1808954420 RAENGAYGTRQVQE-UHFFFAOYSA-N 476.017 5.372 5 20 JKBD CCCCC[C@H](C)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)Cn2ccc3ccc([N+](=O)[O-])cc32)n[nH]1 1815074275 AJXQKVVWXWKVNY-PGRDOPGGSA-N 494.596 5.181 5 20 JKBD Cc1c(F)cccc1C(=O)N1CCCC[C@@H]1C1CCN(C(=O)CSc2ccccc2[N+](=O)[O-])CC1 1823926638 HFOURQIPADPVQQ-JOCHJYFZSA-N 499.608 5.068 5 20 JKBD O=C(CCc1cccc([N+](=O)[O-])c1)N1CCC([C@@H]2CCCCN2C(=O)c2ccccc2C2CC2)CC1 1832554589 NLANVGDVXRSLHX-MHZLTWQESA-N 489.616 5.338 5 20 JKBD Cc1cccc(C(=O)N2CCCC[C@H]2C2CCN(C(=O)c3cc(F)cc([N+](=O)[O-])c3)CC2)c1Cl 1832602872 GKULOOFTVCPCPQ-QFIPXVFZSA-N 487.959 5.243 5 20 JKBD Cc1ccc(NC(=O)[C@@H](Sc2nnc(-c3ccc(Cl)cc3)n2C)c2ccccc2)c([N+](=O)[O-])c1 9459198 ZGRNXMQNGGJMFO-NRFANRHFSA-N 493.976 5.824 5 20 JKBD O=C(CSc1nc2ccc([N+](=O)[O-])cc2s1)N1N=C(c2cccs2)C[C@@H]1c1ccco1 10592503 JTMGCNWCMYDXTJ-OAHLLOKOSA-N 470.557 5.329 5 20 JKBD COc1ccc(NC(=O)[C@H](OC(=O)c2cc([N+](=O)[O-])ccc2Cl)c2ccccc2)cc1Cl 10665332 VARCGGYZLUCQJA-HXUWFJFHSA-N 475.284 5.447 5 20 JKBD COc1cc(C(=O)Nc2ccc3c(c2)NC(=O)CS3)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 24297138 MEAUWRAHUJUNDB-UHFFFAOYSA-N 485.905 5.346 5 20 JKBD C[C@H](OC(=O)c1ccc(COc2ccc(F)cc2)o1)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 25019263 FOVJMMQXFUEBKV-LBPRGKRZSA-N 496.369 5.109 5 20 JKBD O=C(c1ccccc1)N1CCCN(C(=O)c2ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])cc2)CC1 31640057 KRQYDHUIKQMJQP-UHFFFAOYSA-N 479.920 5.029 5 20 JKBD COC(=O)c1ccc(Cl)c(NC(=O)c2ccc(Sc3nc(C)cs3)c([N+](=O)[O-])c2)c1 60391452 LMVMJTKPDSRPNZ-UHFFFAOYSA-N 463.924 5.203 5 20 JKBD O=C(Nc1ccnn1Cc1cccc2ccccc12)c1ccc(Br)c([N+](=O)[O-])c1 71924717 PUXDSBMIYZGDAW-UHFFFAOYSA-N 451.280 5.008 5 20 JKBD O=[N+]([O-])c1ccccc1CN(Cn1nc(C2CC2)n(Cc2ccccc2)c1=S)CC(F)(F)F 71966583 WREOESOOHZYXHY-UHFFFAOYSA-N 477.512 5.270 5 20 JKBD O=C(Nc1ccccc1C(=O)Nc1ccc(Br)cc1F)c1ccc([N+](=O)[O-])cc1Cl 72111830 JTZVOHHECLLPAZ-UHFFFAOYSA-N 492.688 5.654 5 20 JKBD O=C(Nc1nc(-c2ccc(Cl)cc2)cs1)c1cc([N+](=O)[O-])ccc1I 106279685 XUMMJNKUBJBCRK-UHFFFAOYSA-N 485.690 5.229 5 20 JKBD CC(C)c1ccccc1-n1c(SCC(=O)c2cccc([N+](=O)[O-])c2)nnc1-c1cccnc1 216804620 KOJFUHXBBDOQJB-UHFFFAOYSA-N 459.531 5.336 5 20 JKBD O=C(C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)NCc1cnn(-c2ccccc2)c1 483137172 SNGUZSGVNRCKKO-KGENOOAVSA-N 495.564 5.637 5 20 JKBD Cc1ccc(C(=O)Nc2ccccc2)cc1NC(=O)CSc1ccc(C(F)(F)F)cc1[N+](=O)[O-] 483179588 OKXJPMCNOAFWOP-UHFFFAOYSA-N 489.475 5.905 5 20 JKBD O=C(C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)NCc1ccc(F)cc1F 498918996 NGJQHZMFZYBXID-GZTJUZNOSA-N 465.481 5.730 5 20 JKBD CC(C)n1ncc2c(C(=O)Nc3cc(-c4cccc([N+](=O)[O-])c4)[nH]n3)cc(-c3ccccc3)nc21 499016423 LAKJBOMTPKAPEQ-UHFFFAOYSA-N 467.489 5.230 5 20 JKBD CCOC(=O)CC1CCN(C(=O)c2ccc(Sc3nc4ccccc4s3)c([N+](=O)[O-])c2)CC1 502911315 GGIVHGJOPWYLRT-UHFFFAOYSA-N 485.587 5.161 5 20 JKBD C[C@@H](Nc1ccc(C(=O)N(Cc2cccs2)C[C@H]2CCCO2)cc1[N+](=O)[O-])c1ccccn1 506164522 SKKOCUWVDNZJLL-IEBWSBKVSA-N 466.563 5.046 5 20 JKBD CCN(C(=O)c1ccc(N[C@@H](C)c2ccccn2)c([N+](=O)[O-])c1)c1ccc(Br)cc1 506207346 YCNDRVFWAPBISS-HNNXBMFYSA-N 469.339 5.592 5 20 JKBD COCCN(C(=O)c1csc(-c2ccc(OC)cc2)n1)c1nc(-c2ccc([N+](=O)[O-])cc2)cs1 506830986 SUBVEKJEWSQOOG-UHFFFAOYSA-N 496.570 5.144 5 20 JKBD COCCn1ccc(NC(=O)c2c3c(nc4ccccc24)/C(=C/c2ccc([N+](=O)[O-])cc2)CCC3)n1 507148885 JKUITRCOEAFQTH-HTXNQAPBSA-N 483.528 5.115 5 20 JKBD C[C@@H](NC(=O)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-])c1cc(F)c(Cl)cc1Cl 511803677 AJRGJTYMIDKVKZ-MRVPVSSYSA-N 455.191 5.473 5 20 JKBD CC(C)c1ccccc1-n1c(SCC(=O)c2ccc([N+](=O)[O-])cc2)nnc1-c1cccnc1 512934181 PVKCNBWMWOGBRV-UHFFFAOYSA-N 459.531 5.336 5 20 JKBD COc1ccc(NC(=O)[C@H](C)Sc2nnc(-c3ccc(F)cc3)c3ccccc23)c([N+](=O)[O-])c1 513241880 MFBBDBXHIRWTQY-AWEZNQCLSA-N 478.505 5.472 5 20 JKBD Cc1nn(C(C)(C)C)c2nc(C3CC3)cc(C(=O)Nc3cc([N+](=O)[O-])ccc3OC(F)F)c12 514567476 KOUKXKKBAJURTD-UHFFFAOYSA-N 459.453 5.134 5 20 JKBD O=C(Nc1nc2ccccc2s1)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 514620602 MOSJMCPKJFENEG-UHFFFAOYSA-N 450.442 5.078 5 20 JKBD COC(=O)c1ccccc1C(=O)c1ccc(N[C@@H](C)c2ccc(NC(=O)C3CC3)cc2)c([N+](=O)[O-])c1 515363215 VBNNZORJUNPBMN-INIZCTEOSA-N 487.512 5.134 5 20 JKBD O=[N+]([O-])c1ccc(-c2nn(-c3ccccc3)cc2CNCc2ccc(Br)s2)cc1 518269485 DALVINLWARSBDL-UHFFFAOYSA-N 469.364 5.561 5 20 JKBD C[C@@H](N[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1)c1ccc2c(c1)CCC(=O)N2 518472663 UKTLYDTWQWLYOH-OYLFLEFRSA-N 478.936 5.164 5 20 JKBD Cc1cc(C(=O)N2CCCC[C@H]2C)ccc1NC(=O)c1ccc(N2CCC[C@H](C)C2)c([N+](=O)[O-])c1 520680756 GQZKBBMMOCJEHE-AZUAARDMSA-N 478.593 5.406 5 20 JKBD COc1ccc(-c2nc(NC(=O)c3cc(OCC(F)(F)F)ccc3[N+](=O)[O-])sc2C)cc1 603727412 QUNFFTCEUMHWBF-UHFFFAOYSA-N 467.425 5.229 5 20 JKBD Cc1cc(NC(=O)c2ccccc2Cl)sc1C(=O)Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1 603946562 MZMXYRSWDZKSJI-UHFFFAOYSA-N 498.973 6.246 5 20 JKBD C[C@H](c1ccc2ccccc2c1)N(C(=O)CCCn1c(=O)oc2cc([N+](=O)[O-])ccc21)C1CC1 604349834 JBJVNHUUELXPLT-QGZVFWFLSA-N 459.502 5.188 5 20 JKBD CC1CCN(c2ccc(C(=O)N(C)C[C@H]3CCCO[C@@H]3c3ccccc3)cc2[N+](=O)[O-])CC1 604519161 PJHUSSMDFKMUMM-RCZVLFRGSA-N 451.567 5.071 5 20 JKBD COc1ccc(CN[C@@H](C)c2nc3ccccc3n2C(F)F)cc1OCc1ccc([N+](=O)[O-])cc1 609006459 FONDARYHCXQLJI-INIZCTEOSA-N 482.487 5.778 5 20 JKBD Cn1c(=O)oc2cc(NC(=O)c3ccc(Sc4nc5ccccc5s4)c([N+](=O)[O-])c3)ccc21 609107845 YAEYDFDSVXZWOC-UHFFFAOYSA-N 478.511 5.053 5 20 JKBD C[C@H](NC(=O)N[C@@H]1c2cc(Br)ccc2SC[C@H]1C)c1cccc([N+](=O)[O-])c1 609199869 RQFHEMNVNPCWKJ-SOZUMNATSA-N 450.358 5.201 5 20 JKBD O=[N+]([O-])c1ccc(Sc2nnc(-c3ccc(F)cc3)n2Cc2ccccc2)c2ccncc12 619677001 WUSOAOUISIIIMQ-UHFFFAOYSA-N 457.490 5.740 5 20 JKBD Cc1ccc(Cl)c(NC(=S)/C(=C(/O)c2ccc([N+](=O)[O-])cc2)[n+]2cccc(CO)c2)c1Cl 728559128 ZSTHXJWWRXTHQX-UHFFFAOYSA-O 491.376 5.313 5 20 JKBD C[C@@H](Nc1ccc(C(=O)Nc2ccc(-n3cnc4ccccc43)nc2)cc1[N+](=O)[O-])c1ccccn1 729246306 CJYZAAGXGKJLTK-QGZVFWFLSA-N 479.500 5.149 5 20 JKBD CCCS(=O)(=O)c1ccccc1S[C@H](C)C(=O)N(CC1CC1)c1ccc(Cl)c([N+](=O)[O-])c1 730488757 PLODNVPYFDYQCX-OAHLLOKOSA-N 497.038 5.356 5 20 JKBD Cc1cccc([N+](=O)[O-])c1NC(=O)COC(=O)c1oc2ccccc2c1CSc1cccs1 742979770 AWRGZSCLFOIQGY-UHFFFAOYSA-N 482.539 5.799 5 20 JKBD Cc1noc2nc(C3CC3)cc(C(=O)Oc3ccc4c(-c5ccc([N+](=O)[O-])cc5)cc(=O)oc4c3)c12 835791371 IUOQFOGIKTZKDG-UHFFFAOYSA-N 483.436 5.309 5 20 JKBD O=C(c1ccc(Cl)cc1NCc1c(Br)cccc1[N+](=O)[O-])N1CCCCC1 863997098 QFXZYJYXEVSUHH-UHFFFAOYSA-N 452.736 5.249 5 20 JKBD CCOc1cc(-c2nc(-c3ccc(Cn4cnc5ccccc54)cc3)no2)c([N+](=O)[O-])cc1OC 904474859 GBQAMNYPUPLUKV-UHFFFAOYSA-N 471.473 5.117 5 20 JKBD CC(C)(C)c1nnc(COC(=O)C/C(=C\c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)o1 914797643 BGAVJWMNTUCOSN-FOWTUZBSSA-N 478.530 5.559 5 20 JKBD CC1=C(C(=O)Nc2ccccc2C(F)(F)F)[C@H](c2cc([N+](=O)[O-])c(F)cc2F)NC(=O)N1C1CC1 916724993 KBPASNLJGUNBEM-IBGZPJMESA-N 496.392 5.033 5 20 JKBD CC(=O)N(c1ccc(C(F)(F)F)cc1)c1nc(COC(=O)c2c(C)cccc2[N+](=O)[O-])cs1 920503739 VFPSPMGGMAPHOH-UHFFFAOYSA-N 479.436 5.420 5 20 JKBD C[C@@H](OC(=O)c1ccc(N[C@H](C)c2ccccn2)c([N+](=O)[O-])c1)C(=O)Nc1ccc2ccccc2c1 920546482 YLNVQIRIWRMGFE-QZTJIDSGSA-N 484.512 5.500 5 20 JKBD O=C(/C=C/c1ccccc1[N+](=O)[O-])NC1(c2ccc(NC(=O)C3CCC(F)(F)CC3)cc2)CCC1 1786245561 CBRRCKNROSWZAY-IZZDOVSWSA-N 483.515 5.568 5 20 JKBD Cc1ccc(/C=C/C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cc4cc([N+](=O)[O-])ccc4s2)C3)s1 1802908056 UFFFULGIIJUDOC-IQTOUSACSA-N 481.599 5.145 5 20 JKBD O=C(Nc1cc([C@H]2CCCCN2C(=O)CCc2cccc([N+](=O)[O-])c2)[nH]n1)c1cc(Cl)ccc1F 1814618248 ANGDVDOVXYZZQI-OAQYLSRUSA-N 499.930 5.049 5 20 JKBD CC(C)=CCCC(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cc3cc([N+](=O)[O-])ccc3s2)n[nH]1 1821611073 LTJWVMGPVRTVEM-IBGZPJMESA-N 481.578 5.585 5 20 JKBD O=C(c1cccc(F)c1[N+](=O)[O-])N1CCC([C@@H]2CCCCN2C(=O)CCCc2ccccc2F)CC1 1824166597 LHTMMOLEPDBSDT-DEOSSOPVSA-N 499.558 5.129 5 20 JKBD Cc1cc(F)c(F)c(C(=O)N2CCC([C@H]3CCCCN3C(=O)CCc3cccc([N+](=O)[O-])c3)CC2)c1 1824843579 QGRCFFUAUXFYGZ-XMMPIXPASA-N 499.558 5.048 5 20 JKBD CC(C)c1csc(C(=O)N2CCC([C@H]3CCCCN3C(=O)/C=C/c3ccccc3[N+](=O)[O-])CC2)n1 1832902928 FUYFGESBELOMJY-NELJVSICSA-N 496.633 5.121 5 20 JKBD CCN(C(=O)[C@@H](C)OC(=O)c1ccccc1C(=O)c1ccc(Cl)c([N+](=O)[O-])c1)c1ccccc1 3556458 DVGGYFKBRQHAGO-MRXNPFEDSA-N 480.904 5.078 5 20 JKBD O=C(CCCSc1ccc(Cl)cc1)Nc1ncc(S(=O)(=O)c2ccc([N+](=O)[O-])cc2)s1 9910587 VPNWPJGZAGWDDC-UHFFFAOYSA-N 498.007 5.049 5 20 JKBD CC(=O)N(c1cccc(C(F)(F)F)c1)c1nc(COC(=O)c2ccc(Cl)c([N+](=O)[O-])c2)cs1 11025127 DCLLHUUBQAQDIX-UHFFFAOYSA-N 499.854 5.765 5 20 JKBD C[C@@H](OC(=O)c1ccc2c(c1)C[C@H](c1ccccc1)OC2=O)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 17899403 TWPWDMLZHMUXBK-IVZQSRNASA-N 485.452 5.017 5 20 JKBD CCN(CC)c1ccc(-c2nnc(S[C@H](C)C(=O)Nc3cccc([N+](=O)[O-])c3C)n2CC)cc1 25367688 YFOGXRRJNIXJDQ-QGZVFWFLSA-N 482.610 5.147 5 20 JKBD Cc1nn(CC(C)C)c(C)c1CCC(=O)Oc1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2Cl)cc1 29478427 DDHVNQAENNTGNI-UHFFFAOYSA-N 498.967 5.508 5 20 JKBD COc1cc(C(=O)Nc2ccc(C(=O)N3CCCC3)cc2)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 45869056 KLGFGYAMOAWXIE-UHFFFAOYSA-N 495.919 5.537 5 20 JKBD Cc1nn(C)c(C)c1[C@@H](C)C(=O)Nc1cc([N+](=O)[O-])ccc1Nc1cccc(C(F)(F)F)c1 476681601 IRTISDXDYKCQGC-GFCCVEGCSA-N 461.444 5.450 5 20 JKBD Cc1ccccc1-c1nnc(SCC(=O)Nc2ccc([N+](=O)[O-])cc2Cl)n1Cc1ccco1 479816074 XGBGAIHSIOXPLR-UHFFFAOYSA-N 483.937 5.187 5 20 JKBD CCCNC(=O)c1cccc(CNC(=O)c2ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])cc2)c1 484101555 QXCXZHGNOHUKEN-UHFFFAOYSA-N 467.909 5.110 5 20 JKBD CCC[C@H](NC(=O)C(=O)Nc1cc([N+](=O)[O-])ccc1OC(F)F)c1ccc(Cl)c(Cl)c1 486900828 ZDRPSUOUFVZBDT-AWEZNQCLSA-N 476.263 5.099 5 20 JKBD Cc1nc([N+](=O)[O-])cn1CCC(=O)N(c1ccc(Oc2ccccc2)cc1)c1nc2ccccc2s1 488377043 WJVFIXCROYNFEH-UHFFFAOYSA-N 499.552 6.257 5 20 JKBD COc1ccc(N(C(=O)c2ccc(N[C@@H](C)c3ccccn3)c([N+](=O)[O-])c2)[C@H](C)C2CC2)cc1 499600651 YTFYPYZCWZELJP-ZWKOTPCHSA-N 460.534 5.617 5 20 JKBD CCOc1cc(C(=O)Nc2ccc(Sc3nc4ccccc4[nH]3)cc2)c([N+](=O)[O-])cc1OC 503005389 NRNRBAIAZCGNLB-UHFFFAOYSA-N 464.503 5.282 5 20 JKBD CC(C)N(CC(=O)Nc1ccc(Cl)cc1C(F)(F)F)C(=O)c1ccc([N+](=O)[O-])cc1Cl 504794296 AXFXBXMUHSWBNV-UHFFFAOYSA-N 478.254 5.410 5 20 JKBD CCOc1ccc(Oc2ccc(Cl)cc2NC(=O)Cn2cnc(-c3ccc([N+](=O)[O-])cc3)n2)cc1 508513086 NRPQYNZRNXIJTG-UHFFFAOYSA-N 493.907 5.336 5 20 JKBD O=[N+]([O-])c1cc(CSc2nnc(-c3cccnc3)n2-c2ccc(Br)cc2)cs1 510862465 MPWHCCPUAXXMRF-UHFFFAOYSA-N 474.365 5.354 5 20 JKBD CC(C)Oc1ccc([N+](=O)[O-])cc1CSc1nnc(-c2ccccc2)n1Cc1ccco1 511063110 GOQKVBPSRAJUFK-UHFFFAOYSA-N 450.520 5.574 5 20 JKBD O=C(Cc1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1)Nc1cccc(-c2cnco2)c1 511868231 OVMPINWJQDUTIR-UHFFFAOYSA-N 465.469 5.284 5 20 JKBD COc1ccc([N+](=O)[O-])cc1NC(=O)[C@H](Oc1ccc(Br)cc1)c1ccccc1 515160481 RRORGPYUEXMZCX-HXUWFJFHSA-N 457.280 5.125 5 20 JKBD COc1ccc(F)cc1[C@H](C)N[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1 515525472 RXEVYWZOIJPKHU-FPTDNZKUSA-N 457.889 5.427 5 20 JKBD C[C@H](Nc1ccc(C(=O)NC[C@H](c2ccccc2Cl)N2CCCC2)cc1[N+](=O)[O-])c1ccccn1 516170027 XNDPLZQWBYIYRH-AVRWGWEMSA-N 493.995 5.383 5 20 JKBD C[C@@H](Nc1ccc(C(=O)Nc2nnc(-c3ccccc3Cl)s2)cc1[N+](=O)[O-])c1ccccn1 516211707 WLQBZKRZKOZWLU-CYBMUJFWSA-N 480.937 5.587 5 20 JKBD COc1cc(C(=O)Nc2ccc3nc(-c4ccccc4Cl)[nH]c3c2)c([N+](=O)[O-])cc1OC 516369337 RUMKOELOYRLPSU-UHFFFAOYSA-N 452.854 5.061 5 20 JKBD COCCOc1cc([N+](=O)[O-])c(C(=O)Nc2ccccc2Oc2ccc(Cl)cc2)cc1OC 518654131 AWZPYCPIVKNHST-UHFFFAOYSA-N 472.881 5.327 5 20 JKBD COc1ccc(-c2cnc(CCC(=O)Nc3nc(-c4cccc([N+](=O)[O-])c4)c(C)s3)o2)cc1 520078585 DYMQZZGKZNNYMK-UHFFFAOYSA-N 464.503 5.262 5 20 JKBD Cc1ccc(NC(=O)[C@H](Sc2nnc(-c3ccc(Cl)cc3)o2)c2ccccc2)c([N+](=O)[O-])c1 588960007 WXAILICZAUWMDP-HXUWFJFHSA-N 480.933 6.079 5 20 JKBD Cc1ccc(NC(=O)[C@H](Sc2nccn2Cc2ccccc2)c2ccccc2)c([N+](=O)[O-])c1 588998342 ABBNEGSAPWJHGO-HSZRJFAPSA-N 458.543 5.620 5 20 JKBD COc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H](c1ccccc1)c1ccc2nc(C(F)(F)F)[nH]c2c1 592948595 GROQUTUILISCRX-FQEVSTJZSA-N 470.407 5.018 5 20 JKBD C[C@@H]1CCCN(c2ccc(C(=O)N3CCC[C@@H](c4nc5ccccc5s4)C3)cc2[N+](=O)[O-])C1 603437192 BZRQOZAWBLKXPP-IEBWSBKVSA-N 464.591 5.461 5 20 JKBD CN(CC(=O)Nc1ccccc1)C(=O)C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1 603596641 REUGUJMFJKLQFI-CYVLTUHYSA-N 486.553 5.232 5 20 JKBD O=C(c1ccc(NCc2ccccc2Cl)c([N+](=O)[O-])c1)N1CCC[C@H](OCC(F)(F)F)C1 603981757 LMXUYLFTBQRUOF-INIZCTEOSA-N 471.863 5.044 5 20 JKBD CCN(Cc1ccc(-c2ccc(C(F)(F)F)cc2)o1)C(=O)CCn1nc(C)c([N+](=O)[O-])c1C 608812480 QQUZHZAHKHRBMB-UHFFFAOYSA-N 464.444 5.126 5 20 JKBD Cc1ccc(Sc2ccc(C(=O)N3CCC(CN4C[C@H](C)O[C@@H](C)C4)CC3)cc2[N+](=O)[O-])cc1 608855200 ZPHWPGMRIIWZEJ-PMACEKPBSA-N 483.634 5.016 5 20 JKBD Cc1ccc(NC(=O)c2ccc(NCCc3nccn3Cc3ccccc3)c([N+](=O)[O-])c2)cc1 608972517 SIUWSBBGCYBJCF-UHFFFAOYSA-N 455.518 5.055 5 20 JKBD Cc1ccc(CNC(=O)C2CCN(C(=O)c3cc4ccccc4c4cccnc34)CC2)cc1F 613899767 OJKOQKFBZYDZFG-UHFFFAOYSA-N 455.533 5.004 5 20 JKBD CC(=O)N(c1ccc(C(F)(F)F)cc1)c1nc(COC(=O)c2c(Cl)cccc2[N+](=O)[O-])cs1 730643521 DCLMTWGWJZBFHT-UHFFFAOYSA-N 499.854 5.765 5 20 JKBD O=C(Nc1cc(Cl)c([N+](=O)[O-])cc1OCc1ccccc1)c1cc(F)ccc1Br 750583187 POWCPUUARZZPMS-UHFFFAOYSA-N 479.689 5.981 5 20 JKBD O=C(N[C@@H](c1ccccc1)c1cc2ccccc2o1)c1cc([N+](=O)[O-])ccc1Br 751076187 SQCUHANHANPNBB-NRFANRHFSA-N 451.276 5.623 5 20 JKBD CCCOc1cc(NC(=O)C[C@@H]2c3ccccc3C=CN2C(C)=O)c([N+](=O)[O-])cc1OCCC 790522970 SULCBRAIYCOIHI-OAQYLSRUSA-N 467.522 5.075 5 20 JKBD CCC(CC)c1cc[n+](/C(C(=S)N[C@@H]2C[C@H]3CC[C@H]2C3)=C(/O)c2ccc(C)c([N+](=O)[O-])c2)cc1 912844125 NDJNJEQXPRVBDY-AVCGJXAMSA-O 480.654 6.084 5 20 JKBD O=C(O)/C=C\c1ccc(NC(=O)C/C(=C\c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)cc1 914730737 IEMGNWLYTKIIJF-NQHSUEJOSA-N 485.521 5.872 5 20 JKBD CC[C@H](C)N1C(=O)N[C@@H](c2ccc([N+](=O)[O-])cc2)C(C(=O)Nc2ccccc2C(F)(F)F)=C1C 916169719 HGVVTFYISMSBQT-RBZFPXEDSA-N 476.455 5.391 5 20 JKBD Cc1cccc(C)c1NC(=O)CCCOC(=O)c1cc([N+](=O)[O-])ccc1N1CCC(C)CC1 916621822 JNBASXJACZNKLF-UHFFFAOYSA-N 453.539 5.024 5 20 JKBD C[C@H](c1ccccc1)n1c(SCC(=O)Nc2ccc(F)c([N+](=O)[O-])c2)nnc1-c1ccccc1 917253979 BMRYVCDIMQDLGN-MRXNPFEDSA-N 477.521 5.333 5 20 JKBD C[C@H](OC(=O)[C@@H](C)Oc1ccc(Cl)c(Cl)c1)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 919443584 RXPDSFNUCHYMQV-VHSXEESVSA-N 495.237 5.258 5 20 JKBD O=C(O[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Br)c1ccccc1)c1cc(F)ccc1F 919902149 YUXVGNVFWROLHO-IBGZPJMESA-N 491.244 5.172 5 20 JKBD COc1cc(C2SCCS2)ccc1OC(=O)[C@@H](C)Oc1ccc(Cl)cc1[N+](=O)[O-] 920789763 CHPNQRMPDPBQIO-LLVKDONJSA-N 455.941 5.108 5 20 JKBD C[C@H](Nc1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2I)cc1)c1ccccc1 920810406 WWTJJGPRIIQRLO-AWEZNQCLSA-N 487.297 5.625 5 20 JKBD Cc1ccc(-c2cc(C(=O)NC3(c4ccc(NC(=O)c5ccc([N+](=O)[O-])o5)cc4)CCC3)c[nH]2)cc1 1785747933 GUEKQNQCJUMBRJ-UHFFFAOYSA-N 484.512 5.553 5 20 JKBD Cc1cc(C(=O)NC2(c3ccc(NC(=O)Cc4ccc(Cl)cc4[N+](=O)[O-])cc3)CCC2)cnc1C 1786115137 XHPQXOFZLSKAOD-UHFFFAOYSA-N 492.963 5.250 5 20 JKBD O=C(Cc1cc([N+](=O)[O-])ccc1F)Nc1ccc(C2(NC(=O)c3ccnc(C(F)F)c3)CCC2)cc1 1786672960 WQSHIOFKBGEMGL-UHFFFAOYSA-N 498.461 5.057 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cc3ccoc3s2)CC1 1827413251 HMBHZUGSZLBNJW-HXUWFJFHSA-N 499.564 5.397 5 20 JKBD Cc1ccc(C(=O)O[C@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Br)c2ccccc2)s1 10647520 JTYKHCGPPNIHKR-SFHVURJKSA-N 475.320 5.264 5 20 JKBD COc1cc(C(=O)Nc2ccccc2Br)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 16027459 KAYFRJVMVUYLHL-UHFFFAOYSA-N 477.698 6.064 5 20 JKBD C[C@@H](Sc1nc2scc(-c3cccs3)c2c(=O)n1C)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 17667870 UAIBGDNVFRNYGQ-LLVKDONJSA-N 497.583 5.535 5 20 JKBD COc1ccc(NC(=O)[C@@H](C)OC(=O)c2ccccc2SCc2cccs2)c([N+](=O)[O-])c1 18529548 VFDJQBZPMVYWQD-CQSZACIVSA-N 472.544 5.141 5 20 JKBD Cc1cc([N+](=O)[O-])ccc1NC(=O)CSc1nnc(COc2ccccc2C)n1-c1ccccc1 23557470 ARUKINAJLQFRFD-UHFFFAOYSA-N 489.557 5.102 5 20 JKBD Cc1cccc([N+](=O)[O-])c1NC(=O)COC(=O)c1ccc(-c2nc3ccccc3s2)s1 28786283 QJCLYZZDXFAABR-UHFFFAOYSA-N 453.501 5.037 5 20 JKBD O=C(Cc1csc(-c2ccccc2Cl)n1)Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1 57810010 UDDZLXGUYVREKI-UHFFFAOYSA-N 456.936 5.676 5 20 JKBD C[C@H](Nc1ccc(C(=O)Nc2ccc(Oc3ccc(F)cc3)nc2)cc1[N+](=O)[O-])c1ccccn1 108862783 URRAEMOQCLZAET-INIZCTEOSA-N 473.464 5.742 5 20 JKBD COc1ccc(Oc2ccc([N+](=O)[O-])cc2C(=O)Nc2ccc(Oc3ncccn3)cc2C)cc1 109181498 HQOIZCMXHHOONC-UHFFFAOYSA-N 472.457 5.539 5 20 JKBD O=C(Nc1ccc(CNCc2cn(-c3ccccc3)nc2-c2ccc([N+](=O)[O-])cc2)cc1)c1ccco1 218161366 NTZKGWRMBACALJ-UHFFFAOYSA-N 493.523 5.583 5 20 JKBD O=C(Nc1ncc(Cc2ccc(C(F)(F)F)cc2)s1)c1ccn(-c2cccc([N+](=O)[O-])c2)n1 221376952 NQCYVRKGOMJPKT-UHFFFAOYSA-N 473.436 5.099 5 20 JKBD O=C(C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)NCC[C@H]1C(=O)Nc2ccccc21 491196373 QVYPFGFBUUHDIY-WOBAJENOSA-N 498.564 5.377 5 20 JKBD O=C(Cn1c2ccccc2c(=O)c2ccccc21)N[C@H](c1ccccc1)c1cccc(Cl)c1 501447856 FTRJENKZDGOIHD-HHHXNRCGSA-N 452.941 5.714 5 20 JKBD COc1ccc(Br)cc1[C@H]1CCCN1C(=O)c1ccc(SC)c([N+](=O)[O-])c1 504894538 JFLZXTGDSFVFFL-OAHLLOKOSA-N 451.342 5.065 5 20 JKBD CCOc1ccc([C@@H]2CCCN2C(=O)c2ccc(N[C@@H](C)c3ccccn3)c([N+](=O)[O-])c2)cc1 506071228 PIWNNMNSCCAMFO-UUOWRZLLSA-N 460.534 5.539 5 20 JKBD C[C@@H](Nc1ccc(C(=O)Nc2nc3cc(F)c(F)cc3s2)cc1[N+](=O)[O-])c1ccccn1 512045809 MWHXVBBRMXNWSW-LLVKDONJSA-N 455.446 5.303 5 20 JKBD O=C(Cn1c2ccccc2c(=O)c2ccccc21)N[C@@H](c1ccc(Cl)cc1)c1ccsc1 512252551 KZOJWCFIMPUVSW-VWLOTQADSA-N 458.970 5.775 5 20 JKBD O=C(Nc1cc(-c2cc(Br)ccc2Cl)[nH]n1)c1ccc([N+](=O)[O-])cc1Cl 523975960 CFQPEXNKGKTCIO-UHFFFAOYSA-N 456.083 5.307 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1F)c1nc(-c2cccs2)n(-c2cccc(C(F)(F)F)c2)n1 524228168 HBKFDIYQOHMQSX-UHFFFAOYSA-N 477.399 5.314 5 20 JKBD CC(=O)CCc1ccc2oc(C(=O)Nc3nc(-c4cccc([N+](=O)[O-])c4)c(C)s3)c(C)c2c1 603996902 JDTBZAWFPFYXQM-UHFFFAOYSA-N 463.515 5.855 5 20 JKBD O=C(CCNc1ccc(C(F)(F)F)cc1[N+](=O)[O-])Nc1ccc(NC(=O)c2ccco2)c(Cl)c1 604119713 MEYAKRACERLMCW-UHFFFAOYSA-N 496.829 5.553 5 20 JKBD O=C(c1c2c(nc3ccccc13)/C(=C/c1ccc([N+](=O)[O-])cc1)CCC2)N1CC[C@@H](N2CCCC2)C1 608906284 WFXCOPNZJGPXEW-KBDUWVRBSA-N 482.584 5.330 5 20 JKBD Cc1ccc(NC(=O)c2ccc(NC3CCN(C(=O)CCc4ccccc4)CC3)c([N+](=O)[O-])c2)cc1 608973109 ZNMOSHLKHYUMGN-UHFFFAOYSA-N 486.572 5.191 5 20 JKBD O=C(Nc1ccc(OC(=O)c2csc(-c3ccc([N+](=O)[O-])cc3)n2)cc1)c1ccsc1 728886852 UOFMEZAAUNVWKS-UHFFFAOYSA-N 451.485 5.251 5 20 JKBD O=[N+]([O-])c1ccc2nc(Sc3nnc(COc4ccccc4Cl)n3C3CC3)sc2c1 731209073 RAPVHTNJHRYGIZ-UHFFFAOYSA-N 459.940 5.515 5 20 JKBD CCN(CCc1ccccn1)C(=O)c1ccc(Sc2nc3ccccc3s2)c([N+](=O)[O-])c1 746831183 UKEBJSNEIMGMIU-UHFFFAOYSA-N 464.572 5.456 5 20 JKBD CC(=O)N(c1cccc(Cl)c1)c1nc(COC(=O)c2c[nH]c3cc([N+](=O)[O-])ccc23)cs1 756766934 DBUSWDRCZYUXFS-UHFFFAOYSA-N 470.894 5.228 5 20 JKBD O=C(COC(=O)/C=C\c1ccc([N+](=O)[O-])cc1)Nc1c(Cl)c(Cl)cc(Cl)c1Cl 798128552 ZEGXQVLVDVHEQJ-UTCJRWHESA-N 464.088 5.404 5 20 JKBD CC1=C(C(=O)Nc2ccc(C)cc2C)[C@@H](c2ccc(-c3ccc([N+](=O)[O-])cc3)s2)NC(=S)N1 818329405 WUVKXPSZVZAWDW-JOCHJYFZSA-N 478.599 5.372 5 20 JKBD CN(Cc1cc([N+](=O)[O-])ccc1Cl)C(=O)Cc1csc(-c2ccc(C(F)(F)F)cc2)n1 818889212 ZBKLZDMTUQDYBV-UHFFFAOYSA-N 469.872 5.592 5 20 JKBD C[C@@H](OC(=O)c1ccc(N2CCCC2)c([N+](=O)[O-])c1)C(=O)N1c2ccccc2Sc2ccccc21 822594201 IQVVHSZWJFPPEK-QGZVFWFLSA-N 489.553 5.570 5 20 JKBD COC1CCN(c2ccc(NCc3ccc(C(F)(F)F)cc3[N+](=O)[O-])cc2C(F)(F)F)CC1 864028190 QHZOOHSYIVEUAQ-UHFFFAOYSA-N 477.405 5.860 5 20 JKBD CC(C)N(Cc1nnc(-c2cccc([N+](=O)[O-])c2)o1)C(=O)c1cc2c(s1)-c1ccccc1OC2 864239357 INIAGYXXMDFYJV-UHFFFAOYSA-N 476.514 5.317 5 20 JKBD O=[N+]([O-])c1ccc(C(F)(F)c2nc(-c3cc(Br)cc(Br)c3)no2)cc1 904913913 KJWLJYCORDEICS-UHFFFAOYSA-N 475.043 5.310 5 20 JKBD O=C(O)/C=C/c1ccc(NC(=O)C/C(=C/c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)cc1 914730736 IEMGNWLYTKIIJF-DTWMHPQNSA-N 485.521 5.872 5 20 JKBD C[C@@H](c1ccccc1)n1c(SCC(=O)Nc2cc([N+](=O)[O-])ccc2Cl)nnc1-c1ccccc1 917254429 PXKMWIWXPUOXAC-INIZCTEOSA-N 493.976 5.847 5 20 JKBD Cc1ccc(/C(O)=C(/C(=S)Nc2ccc3ccccc3c2)[n+]2cccc(CO)c2)cc1[N+](=O)[O-] 917609550 ICEZOUPWYZHAGS-UHFFFAOYSA-O 472.546 5.160 5 20 JKBD CCc1cccc[n+]1/C(C(=S)Nc1ccc2ccccc2c1)=C(/O)c1cccc([N+](=O)[O-])c1 917609645 CJJNSQUJZMHACT-UHFFFAOYSA-O 456.547 5.921 5 20 JKBD O=C(Cc1cccc(C(F)(F)F)c1)Nc1ccc(C2(NC(=O)c3ccc([N+](=O)[O-])o3)CCC2)cc1 1791185870 HYOWYDZZEIIBHU-UHFFFAOYSA-N 487.434 5.197 5 20 JKBD CC1(C)CCC(CC(=O)N2CC[C@H](CNC(=O)c3cccc(F)c3[N+](=O)[O-])[C@@H]2c2cccnc2)CC1 1811320020 GGAMLKCDBKIZCF-YKSBVNFPSA-N 496.583 5.055 5 20 JKBD O=C(c1cc2cc([N+](=O)[O-])ccc2s1)N1CCC([C@H]2CCCCN2C(=O)/C=C/C2CC2)CC1 1824215992 WJNGVHRQBMAWTM-VHTFYLNKSA-N 467.591 5.009 5 20 JKBD Cc1c(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)Cc3ccccc3)CC2)cc(Cl)cc1[N+](=O)[O-] 1830736715 ZAOJHPUKIAXYGR-HSZRJFAPSA-N 483.996 5.033 5 20 JKBD O=C(c1cc2ccoc2s1)N1CCC([C@H]2CCCCN2C(=O)Cc2ccc([N+](=O)[O-])cc2F)CC1 1831291398 UTRUTRYMZJILNX-OAQYLSRUSA-N 499.564 5.018 5 20 JKBD CCCCCn1c(S[C@@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)nc2cc(Cl)ccc2c1=O 17728090 VOLODYNPODJCNC-AWEZNQCLSA-N 499.980 6.052 5 20 JKBD Cc1cc(C)cc(-n2ccnc2S[C@@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2C(F)(F)F)c1 23052345 PRHREJCEWBNUOF-AWEZNQCLSA-N 464.469 5.535 5 20 JKBD O=C(NC1C[C@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1)c1cc([N+](=O)[O-])ccc1NCc1ccccc1 32041674 DGSASVVIMJUNPR-HUUCEWRRSA-N 489.416 5.846 5 20 JKBD O=C1CCc2cc(F)c(NC(=O)c3ccc(NCc4ccccc4Cl)c([N+](=O)[O-])c3)cc2N1 33218456 VWETUULUOVEKAS-UHFFFAOYSA-N 468.872 5.136 5 20 JKBD Cc1sc(NC(=O)CCc2ncc(-c3ccc(F)cc3F)o2)nc1-c1cccc([N+](=O)[O-])c1 195704200 PSOZUSYILXFDQS-UHFFFAOYSA-N 470.457 5.531 5 20 JKBD O=C(N[C@H](c1ccccc1)c1ccncc1)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 247314144 JNJSOZASQIZMAA-HSZRJFAPSA-N 484.478 5.131 5 20 JKBD C[C@H]1C[C@@H](C)CN(c2ccc(C(=O)Nc3ccc(C(=O)Nc4nccs4)cc3)cc2[N+](=O)[O-])C1 302929940 GBEXSAHQABREHD-IYBDPMFKSA-N 479.562 5.038 5 20 JKBD CCN1CCC(n2nccc2NCc2ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])cc2)CC1 303235915 ZRPIQDCBYPUISX-UHFFFAOYSA-N 455.946 5.506 5 20 JKBD COc1cc(C(=O)Nc2ccc(C(N)=O)c(Cl)c2)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 482254175 AUPNVSSIQXFSSB-UHFFFAOYSA-N 476.272 5.054 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)NCc2ccc(-c3ccc4c(c3)CCCO4)cc2)cc1SC 483493389 GPEYMUOGXHTCMV-UHFFFAOYSA-N 464.543 5.247 5 20 JKBD CCOc1cc(C(=O)Nc2ccc(S[C@@H](C)CC)cc2C(F)(F)F)c([N+](=O)[O-])cc1OC 499600811 ZPRHTFYREQKTND-LBPRGKRZSA-N 472.485 6.164 5 20 JKBD C[C@H]1Cc2cc([N+](=O)[O-])ccc2N1C(=O)c1ccc(CNC(=O)C23CC4CC(CC(C4)C2)C3)cc1 504286154 JXNJVMNOXKWGFR-IULQDFHISA-N 473.573 5.019 5 20 JKBD Cc1nc(NC(=O)c2ccc(N[C@@H](C)c3ccccn3)c([N+](=O)[O-])c2)sc1Cc1cccc(F)c1 507421707 FQSPXDXSKOIYLQ-HNNXBMFYSA-N 491.548 5.910 5 20 JKBD COc1cccc(Oc2ccc(NC(=O)c3ccc([N+](=O)[O-])cc3I)cc2)c1 511784641 HQMWDTHSCGHADA-UHFFFAOYSA-N 490.253 5.253 5 20 JKBD O=C(Cc1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1)Nc1ccc(O)c2ccccc12 514319897 CKRLDGKMKQKIQW-UHFFFAOYSA-N 464.481 5.488 5 20 JKBD COCCN(C(=O)Cc1coc2cc(C)c(C)cc12)c1nc(-c2ccc([N+](=O)[O-])cc2)cs1 514620444 KTHTWEDUVXNRLD-UHFFFAOYSA-N 465.531 5.303 5 20 JKBD CCCC(=O)Nc1cccc(NC(=O)c2ccc(N[C@H](C)c3ccccn3)c([N+](=O)[O-])c2)c1C 517912470 MMCJKUPTCLYCSM-QGZVFWFLSA-N 461.522 5.462 5 20 JKBD Cc1ccc(-c2csc(NC(=O)Cc3csc(Cc4ccc(F)cc4)n3)n2)cc1[N+](=O)[O-] 518949680 VHQYVZIDFVDRGZ-UHFFFAOYSA-N 468.535 5.394 5 20 JKBD COc1cc(C(=O)Nc2ccccc2N(C)Cc2ccccc2)c([N+](=O)[O-])cc1OC(F)F 520101372 NHOINWLIBCXXHP-UHFFFAOYSA-N 457.433 5.094 5 20 JKBD C[C@@H]1CCCN(c2ccc(C(=O)Nc3ccc(C(=O)Nc4ccccc4)cc3)cc2[N+](=O)[O-])C1 520916457 KHCRWPWTXBIHMD-GOSISDBHSA-N 458.518 5.336 5 20 JKBD CC(C)Sc1ccc([N+](=O)[O-])cc1C(=O)N1C[C@H]2CC[C@H]1[C@@H]1CN(Cc3ccccc3)C[C@H]21 594660279 KFJQJHJRPSMJAY-CDIGIKMISA-N 465.619 5.078 5 20 JKBD COc1cc2c(cc1OC)[C@@H](c1cccs1)N(C(=O)Nc1cc([N+](=O)[O-])ccc1C)CC2 603643180 VJTBWRFHZPBTMO-QFIPXVFZSA-N 453.520 5.162 5 20 JKBD CC(C)OC(=O)C[C@@H](NC(=O)Nc1cccc(NC(=O)c2cccs2)c1)c1ccccc1[N+](=O)[O-] 603653936 MNWWZQNUAOPKRV-LJQANCHMSA-N 496.545 5.113 5 20 JKBD COc1cc(/C=C(\c2ccncc2)c2ccc([N+](=O)[O-])cc2)cc(Br)c1OC(F)F 603894456 VTGOVCMLFMVPKE-YVLHZVERSA-N 477.261 5.951 5 20 JKBD C[C@H]1CCCN(c2ccc(C(=O)Nc3ccc(C(=O)Nc4cccnc4)c(Cl)c3)cc2[N+](=O)[O-])C1 608874416 FTZXUWZNEFPIRL-INIZCTEOSA-N 493.951 5.384 5 20 JKBD CSCc1ccc(NC(=O)C2CCN(c3ccc(C(F)(F)F)cc3[N+](=O)[O-])CC2)cc1 608953515 HNDQWCOFMSZCIM-UHFFFAOYSA-N 453.486 5.332 5 20 JKBD Cc1nn(C)c(Oc2cccnc2)c1NC(=O)c1ccc(SCCC(C)C)c([N+](=O)[O-])c1 608962127 WPOGNKWLVPEJNW-UHFFFAOYSA-N 455.540 5.215 5 20 JKBD Cc1ccc(C(=O)N2CCSCC2)cc1NC(=O)c1ccc(Nc2ccccc2)c([N+](=O)[O-])c1 608962250 BZRQYOHYGQZTFW-UHFFFAOYSA-N 476.558 5.088 5 20 JKBD O=c1ccc(-c2cccc([N+](=O)[O-])c2)nn1CN1CCCC[C@@H]1c1ccc(C(F)(F)F)cc1 726787246 PUCXDKPMOGPIOZ-OAQYLSRUSA-N 458.440 5.022 5 20 JKBD Cc1ccccc1NC(=O)[C@@H]1CCc2ccccc2N1C(=O)c1cc([N+](=O)[O-])c(C)c([N+](=O)[O-])c1C 726918813 MAKVCUBQMQYULL-QFIPXVFZSA-N 488.500 5.029 5 20 JKBD O=C(c1cccc(-n2nccc2C(F)(F)F)c1)N(CC1CC1)c1ccc(Cl)c([N+](=O)[O-])c1 728165397 ITWNPGCOAGNFSC-UHFFFAOYSA-N 464.831 5.510 5 20 JKBD COc1ccc(C)cc1NC(=O)[C@H](OC(=O)c1cc(SC)c(OC)cc1[N+](=O)[O-])c1ccccc1 728651378 VHEYQZWVVHQDPK-HSZRJFAPSA-N 496.541 5.179 5 20 JKBD O=C1CCc2cc(NC(=S)Nc3ccc([N+](=O)[O-])cc3)ccc2N1Cc1ccc(Cl)cc1 743584573 QRXZMLHVTZWVAH-UHFFFAOYSA-N 466.950 5.537 5 20 JKBD O=C(Cc1csc(-c2ccccc2Cl)n1)Oc1ccc(NC(=O)c2cccc([N+](=O)[O-])c2)cc1 743886047 FTOIKXNIOIXHQE-UHFFFAOYSA-N 493.928 5.772 5 20 JKBD Cc1cccc([N+](=O)[O-])c1NC(=O)COC(=O)c1csc(-c2ccc(Cl)c(Cl)c2)n1 744605343 UKHIPUFAAKYNSO-UHFFFAOYSA-N 466.302 5.129 5 20 JKBD CC(=O)c1cccc(O[C@@H](C)C(=O)Nc2cc(Cl)c([N+](=O)[O-])cc2OCc2ccccc2)c1 745043097 NWONFFLRGQGTMW-INIZCTEOSA-N 468.893 5.436 5 20 JKBD O=C(N[C@@H](COc1ccccc1F)c1ccccc1)c1cc([N+](=O)[O-])ccc1Br 751090169 ZEFUKPSDHSCTNK-IBGZPJMESA-N 459.271 5.047 5 20 JKBD O=C(Nc1cccc(CSc2ccccn2)c1)c1cc([N+](=O)[O-])ccc1I 751120056 FQBPACIWLIJRTG-UHFFFAOYSA-N 491.310 5.139 5 20 JKBD O=C(Nc1cc([N+](=O)[O-])c(F)cc1F)c1c2c(nc3ccccc13)CCN(Cc1ccccc1)C2 897447352 GHGJCINIZWLVCH-UHFFFAOYSA-N 474.467 5.232 5 20 JKBD COc1ccc(CN2CCc3c(ncn3CCc3ccccc3)C2)cc1OCc1ccc([N+](=O)[O-])cc1 929067983 XVOJOMWFPFHELS-UHFFFAOYSA-N 498.583 5.180 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)c3cc4c(Cl)cncc4s3)CCC2)cc1)c1ccc([N+](=O)[O-])o1 1785747501 ARRIZETWGGOAFU-UHFFFAOYSA-N 496.932 5.512 5 20 JKBD O=C(/C=C/c1ccc([N+](=O)[O-])o1)NC1(c2ccc(NC(=O)[C@@H](F)c3ccccc3)cc2)CCC1 1786609881 LWFAHGBVJHUDKS-BWSGXRDBSA-N 463.465 5.046 5 20 JKBD Cc1nc2ccncc2cc1C(=O)NC1(c2ccc(NC(=O)c3cc(F)cc([N+](=O)[O-])c3)cc2)CCC1 1790697785 SBPZTDZOGOMZLJ-UHFFFAOYSA-N 499.502 5.047 5 20 JKBD O=C(/C=C\c1c[nH]c2ccccc12)N1CCCC2(CCN(C(=O)/C=C/c3ccccc3[N+](=O)[O-])CC2)C1 1806882138 UGSCWCYMVPJXEC-FAEGWCMCSA-N 498.583 5.034 5 20 JKBD O=C(/C=C/c1ccccc1[N+](=O)[O-])Nc1cc([C@@H]2CCCCN2C(=O)c2ccc(Cl)c(F)c2)[nH]n1 1823503144 KEIVRGHMDMHWGO-ZUURVNMSSA-N 497.914 5.130 5 20 JKBD Cc1c(Cl)cccc1C(=O)N1CCC([C@H]2CCCCN2C(=O)Cc2cccc([N+](=O)[O-])c2)CC1 1823677416 ZTTSDKFRLJZMGV-XMMPIXPASA-N 483.996 5.033 5 20 JKBD C/C(=C\c1cccs1)C(=O)N1CCC([C@@H]2CCCCN2C(=O)Cc2cc([N+](=O)[O-])ccc2F)CC1 1824945966 AARIBXMQRZMGRD-UFIOJNINSA-N 499.608 5.061 5 20 JKBD COc1ccc(Br)cc1-c1nc(COC(=O)CCNc2ccccc2[N+](=O)[O-])cs1 11314793 MJWDZLGULPKKKA-UHFFFAOYSA-N 492.351 5.035 5 20 JKBD Cc1csc(SCc2ccccc2C(=O)O[C@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2C)n1 22163253 IKGLXBNGIBYNSD-OAHLLOKOSA-N 471.560 5.144 5 20 JKBD C[C@@H](Sc1nnc(C2CC2)n1-c1ccccc1)C(=O)Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1 28797910 CENFUTADHUCINN-CQSZACIVSA-N 492.586 5.296 5 20 JKBD O=C(CSc1nnc(-c2ccc(F)cc2)c2ccccc12)Nc1ccc([N+](=O)[O-])cc1Cl 36186484 QMIDCERMSSEVLF-UHFFFAOYSA-N 468.897 5.728 5 20 JKBD Cc1csc(Sc2ccc(NC(=O)Cn3c4ccccc4c(=O)c4ccccc43)c(C)c2)n1 72066723 ZZUOFLBTUDPQEG-UHFFFAOYSA-N 471.607 6.018 5 20 JKBD COc1cc(C(=O)Nc2ccccc2CN2CCc3ccccc32)c([N+](=O)[O-])cc1OC(F)F 117352536 SHJAODQRGAXQQN-UHFFFAOYSA-N 469.444 5.020 5 20 JKBD O=[N+]([O-])c1ccc(-c2nn(-c3ccccc3)cc2CNCCCc2nc3ccccc3[nH]2)cc1 217132142 PCBRTRKHLHVCOT-UHFFFAOYSA-N 452.518 5.046 5 20 JKBD O=C(NC1CC1)c1ccc(CN(Cc2ccco2)C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)cc1 219948782 YGIBSAWAGJBRBF-UHFFFAOYSA-N 475.526 5.137 5 20 JKBD C[C@H]1CCC[C@@H](C)N1C(=O)c1cc(Cl)ccc1NC(=O)c1ccc(N2CCCC2)c([N+](=O)[O-])c1 302948221 LXDFXVLZHNQZMD-CALCHBBNSA-N 484.984 5.504 5 20 JKBD COc1ccc(CSCC(=O)N[C@@H](c2ccccc2)c2ccc3c(c2)CCCO3)cc1[N+](=O)[O-] 410036960 FHBDILVOPXDBJS-SANMLTNESA-N 478.570 5.067 5 20 JKBD CN(CCCCCc1cc(-c2ccccc2)n[nH]1)C(=O)c1csc(-c2ccc([N+](=O)[O-])cc2)n1 478403951 XCQVDLXDJUQPMF-UHFFFAOYSA-N 475.574 5.593 5 20 JKBD O=C(Nc1nc(-c2cc(Cl)ccc2Cl)cs1)c1cc2c(cc1[N+](=O)[O-])OCCO2 484493888 XDUOGLMKRUNPPG-UHFFFAOYSA-N 452.275 5.049 5 20 JKBD Cc1nc([N+](=O)[O-])cn1CCC(=O)Nc1ccc(Oc2cc(Cl)ccc2Cl)c(F)c1 488624127 HCNHSMJWCPOOKH-UHFFFAOYSA-N 453.257 5.367 5 20 JKBD COc1cccc([C@H](CNC(=O)Nc2ccc([N+](=O)[O-])cc2)c2c[nH]c3ccccc23)c1OC 503696475 MZGFANQVBFDYSU-NRFANRHFSA-N 460.490 5.047 5 20 JKBD COc1cc(C(=O)NCc2ccc(Oc3ccccc3)cc2)c([N+](=O)[O-])cc1OCc1cscn1 504919385 NKIYREHJCPCXNV-UHFFFAOYSA-N 491.525 5.361 5 20 JKBD CC(C)OC(=O)C[C@H](NC(=O)Nc1ccc(C(=O)Nc2ccccc2)cc1)c1ccccc1[N+](=O)[O-] 506657199 PXSPGCXKATXTOU-QFIPXVFZSA-N 490.516 5.052 5 20 JKBD C[C@H](NC(=O)c1ccc(N[C@H](C)c2ccccn2)c([N+](=O)[O-])c1)c1cccc(OCc2ccccn2)c1 509518260 FKENHMHFBHFJLB-VQTJNVASSA-N 497.555 5.628 5 20 JKBD CCCC[C@H](NC(=O)Nc1ccc([N+](=O)[O-])cc1Cl)C(=O)Nc1cccc(N2CCCC2)c1 510628610 PFCYRPCKDNAUGC-NRFANRHFSA-N 473.961 5.167 5 20 JKBD CCOc1cc(NC(=O)c2cc3sc(N(CC)CC)nc3s2)c([N+](=O)[O-])cc1OCC 512301849 VRKWPGYYWNAOHZ-UHFFFAOYSA-N 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C[C@@H](OC(=O)CCc1ccc(Cl)c(Cl)c1)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 725981644 XOZPXDAEFNIAOD-SNVBAGLBSA-N 479.238 5.423 5 20 JKBD O=C(CCC(=O)c1ccc2ccc3cccc4ccc1c2c34)Nc1ccn(Cc2ccccn2)n1 727756593 OWJIVBAWEYJVPA-UHFFFAOYSA-N 458.521 5.825 5 20 JKBD C[C@H](Nc1ccc(C(=O)OCc2coc(-c3ccc(F)c(F)c3)n2)cc1[N+](=O)[O-])c1ccccn1 728624724 JYVKPIIDJLCIDZ-AWEZNQCLSA-N 480.427 5.453 5 20 JKBD C[C@H](OC(=O)c1csc(-c2cccc([N+](=O)[O-])c2)n1)c1ccc(NC(=O)c2ccccc2)cc1 748016909 PRLOJLAKULKIHD-INIZCTEOSA-N 473.510 5.889 5 20 JKBD Cc1oc(-c2ccccc2)nc1CC(=O)Oc1ccc2c(-c3ccc([N+](=O)[O-])cc3)cc(=O)oc2c1 818839083 SUXXAOJVRQBNCH-UHFFFAOYSA-N 482.448 5.480 5 20 JKBD CC1=C(C(=O)Nc2ccc([N+](=O)[O-])cc2)[C@H](c2ccc3ncccc3c2)NC(=O)N1Cc1cccs1 840197450 ZAUINNURVAUXJT-DEOSSOPVSA-N 499.552 5.384 5 20 JKBD Cc1cc(C(=O)COC(=O)Cn2c3ccccc3c(=O)c3ccccc32)c(C)n1[C@@H](C)c1ccccc1 841977455 DZHGWRCWGJOHED-NRFANRHFSA-N 492.575 5.608 5 20 JKBD O=C(CNc1cc([N+](=O)[O-])ccc1OC(F)F)Nc1c(Cl)c(Cl)cc(Cl)c1Cl 917815368 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JKBD O=C([C@H]1CCCCC1(F)F)N1CCC([C@@H]2CCCCN2C(=O)/C=C/c2ccccc2[N+](=O)[O-])CC1 1832899726 FKPUPBZVCGITNZ-LVIAPQIJSA-N 489.563 5.053 5 20 JKBD C[C@H](OC(=O)CSc1ccc([N+](=O)[O-])cc1)C(=O)Nc1c(Cl)cc(Cl)cc1Cl 9352370 PFZUIJNDJXPLKY-VIFPVBQESA-N 463.726 5.218 5 20 JKBD C[C@H](OC(=O)c1sc2cc(F)ccc2c1Cl)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 11443921 ZEVZQZVOOXJOIK-QMMMGPOBSA-N 490.818 5.805 5 20 JKBD COc1cc(CSc2nnc3c(Cl)cc(C(F)(F)F)cn23)c([N+](=O)[O-])cc1OC(F)F 12938984 BXSZSZYJCAUSPU-UHFFFAOYSA-N 484.790 5.212 5 20 JKBD COCCN(C(=O)c1oc2ccccc2c1CSC)c1nc(-c2ccc([N+](=O)[O-])cc2)cs1 14790423 RANQZMQWKKJEPU-UHFFFAOYSA-N 483.571 5.621 5 20 JKBD CC(C)N(Cc1nnc(-c2cccc([N+](=O)[O-])c2)o1)C(=S)Nc1cccc(Br)c1 16943400 NZQOFZXGUGIYGX-UHFFFAOYSA-N 476.356 5.015 5 20 JKBD Cc1cccc(C)c1OCc1nnc(SCC(=O)Nc2ccccc2[N+](=O)[O-])n1-c1ccccc1 22035107 AXSBGDKKKUEKTF-UHFFFAOYSA-N 489.557 5.102 5 20 JKBD CCc1cccc(CC)c1NC(=O)COC(=O)c1cc([N+](=O)[O-])ccc1Sc1nc(C)cs1 28832352 WJASRJKOLXUOQK-UHFFFAOYSA-N 485.587 5.431 5 20 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452.517 5.387 5 20 JKBD O=C(Nc1ncc(Cc2cccc(Br)c2)s1)c1c[nH]c2ccc([N+](=O)[O-])cc12 513353046 GZKFDJHGQAPZDN-UHFFFAOYSA-N 457.309 5.138 5 20 JKBD O=C(Cc1nnc(O)c2ccccc12)Nc1cc([N+](=O)[O-])ccc1Nc1cccc(C(F)(F)F)c1 514654603 PMMRFBWESRDOFE-UHFFFAOYSA-N 483.406 5.187 5 20 JKBD O=C(NCc1cccc(CN2CCCC2=O)c1)c1cc([N+](=O)[O-])ccc1Sc1ccc(Cl)cc1 518110141 PXMKLGAEAJBKJI-UHFFFAOYSA-N 495.988 5.452 5 20 JKBD CC(C)C[C@@H](NC(=O)c1ccc(N[C@@H](C)c2ccccn2)c([N+](=O)[O-])c1)c1nc2ccccc2[nH]1 520614516 QSKMSBCLLWMCOK-GAJHUEQPSA-N 472.549 5.556 5 20 JKBD COc1cc([C@H](C)NCc2ccc(-c3cccc([N+](=O)[O-])c3)o2)ccc1OCc1ccncc1 520955803 UHUXCOBYRFENNV-SFHVURJKSA-N 459.502 5.688 5 20 JKBD O=[N+]([O-])c1ccc(-c2ccc(CN[C@H]3CCSc4ccc(F)cc43)o2)c(Br)c1 521822009 PDWKYLIGYWLIAF-SFHVURJKSA-N 463.328 6.083 5 20 JKBD C[C@H](Sc1nnc(-c2ccc(Cl)cc2)o1)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 588966215 KIYDHSQHMVUUML-VIFPVBQESA-N 472.832 5.436 5 20 JKBD O=C(NCCNc1ccc(C(F)(F)F)cc1[N+](=O)[O-])c1cnc2ccccc2c1C(F)(F)F 603084512 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5.197 5 20 JKBD Cc1ccc(NC(=O)[C@H](OC(=O)c2cccc(NC(=O)c3ccco3)c2)c2ccccc2)c([N+](=O)[O-])c1 919532719 HOBMWWIILMZGSN-XMMPIXPASA-N 499.479 5.285 5 20 JKBD O=C(Nc1ccc(OC(=O)C2(c3cccc(F)c3)CCOCC2)cc1)c1cc([N+](=O)[O-])ccc1Cl 919976622 PWWJADOAJYHOGG-UHFFFAOYSA-N 498.894 5.293 5 20 JKBD COc1ccc([N+](=O)[O-])c(C(=O)Nc2ccc(NC(=O)c3ccccc3)cc2C(F)(F)F)c1 920279988 XBCJSSZRLSXQCP-UHFFFAOYSA-N 459.380 5.127 5 20 JKBD Cc1sc(=O)n(CC(=O)Oc2ccc(-c3ccccc3)cc2[N+](=O)[O-])c1-c1ccc(F)cc1 920330635 LDVZSKRNJWZAMB-UHFFFAOYSA-N 464.474 5.205 5 20 JKBD C[C@@H](OC(=O)[C@@H](C)SCc1ncc(-c2ccc(Cl)cc2)o1)C(=O)Nc1ccc([N+](=O)[O-])cc1 920671056 KNXIHNWCHAUVPP-ZIAGYGMSSA-N 489.937 5.095 5 20 JKBD Cc1ccc2[nH]c(C(=O)NC3(c4ccc(NC(=O)/C=C/c5ccc([N+](=O)[O-])o5)cc4)CCC3)cc2c1 1786207378 GPKFSVZHIJGUFD-DHZHZOJOSA-N 484.512 5.439 5 20 JKBD Cc1cc(CCC(=O)Nc2ccc(C3(NC(=O)/C=C/c4ccccc4[N+](=O)[O-])CCC3)cc2)ccn1 1786741687 CYBWWQGXFHIDMV-RIYZIHGNSA-N 484.556 5.078 5 20 JKBD O=C(/C=C/c1ccccc1[N+](=O)[O-])Nc1ccc(C2(NC(=O)[C@@]3(F)CCCC=C3F)CCC2)cc1 1792318976 CEWFAUCXLCTGMI-OYGPHJITSA-N 481.499 5.488 5 20 JKBD O=C(CCC1CCC1)Nc1cc([C@@H]2CCCCN2C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)[nH]n1 1815052534 WEWKVJLCERFIID-IBGZPJMESA-N 481.578 5.419 5 20 JKBD O=C(Nc1cc([C@H]2CCCCN2C(=O)Cc2cccc([N+](=O)[O-])c2)[nH]n1)c1cccc2ccccc12 1818450997 QXKLAJXYXJOSNK-XMMPIXPASA-N 483.528 5.020 5 20 JKBD O=C(c1cc2sccc2s1)N1CCC([C@@H]2CCCCN2C(=O)c2ccc([N+](=O)[O-])o2)CC1 1823614627 PKFNPACWTYONPX-HNNXBMFYSA-N 473.576 5.011 5 20 JKBD O=C(c1cc(F)cc([N+](=O)[O-])c1)N1CCC([C@H]2CCCCN2C(=O)c2cccc3ccccc23)CC1 1828009566 FOQSCTRPSFZDCQ-AREMUKBSSA-N 489.547 5.434 5 20 JKBD Cc1c(C(=O)N2CCC([C@@H]3CCCCN3C(=O)c3ccc([N+](=O)[O-])cc3F)CC2)oc2ccccc12 1830495510 BOTNCYRJUCVVQG-QHCPKHFHSA-N 493.535 5.336 5 20 JKBD Cc1c(C(=O)N2CCCC[C@H]2C2CCN(C(=O)CCC(F)(F)F)CC2)cc(Cl)cc1[N+](=O)[O-] 1830736383 WEUBRWNDKOVBFP-SFHVURJKSA-N 489.922 5.132 5 20 JKBD COc1cc(C(=O)N2CCC([C@H]3CCCCN3C(=O)c3ccc(C4CC4)cc3)CC2)ccc1[N+](=O)[O-] 1830752619 PMVGFYXTBNWOFA-XMMPIXPASA-N 491.588 5.028 5 20 JKBD C[C@@H](OC(=O)CCc1ncc(-c2ccccc2Cl)o1)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl 12253918 XDEFTEHWFHCGFM-GFCCVEGCSA-N 478.288 5.060 5 20 JKBD CCCOc1ccc(-c2csc(NC(=O)c3ccc(Sc4nncn4C)c([N+](=O)[O-])c3)n2)cc1 14657320 JCCUKAYDSGZIBY-UHFFFAOYSA-N 496.574 5.039 5 20 JKBD O=C1c2ccccc2N[C@@H](c2ccc(-c3ccc([N+](=O)[O-])cc3Cl)o2)N1C[C@H]1CCCO1 15503655 MAFQAWYREHJBLF-IVZQSRNASA-N 453.882 5.254 5 20 JKBD C[C@@H](Sc1nc2ccc([N+](=O)[O-])cc2s1)C(=O)Nc1ccc(Cl)cc1C(F)(F)F 16054207 SLTJEMCMSOGFTE-MRVPVSSYSA-N 461.874 5.996 5 20 JKBD O=C(COC(=O)c1csc(-c2ccc(Cl)cc2)n1)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 16457212 FPFBUWXEASNNCZ-UHFFFAOYSA-N 485.827 5.186 5 20 JKBD C[C@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)O[C@H](C)C(=O)Nc1ccc(Cl)cc1C(F)(F)F 17048801 AIJNLFRUORNYLL-MNOVXSKESA-N 476.860 5.318 5 20 JKBD C[C@H](OC(=O)c1sc2cc(Cl)ccc2c1Cl)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 17529454 JQCTZIOBQPCFGE-VIFPVBQESA-N 464.286 6.084 5 20 JKBD C[C@@H](Sc1nn(-c2ccc(Cl)cc2)c(=S)s1)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 17662033 ZALMBKVIZWFMTC-SNVBAGLBSA-N 477.980 6.128 5 20 JKBD CSc1ccc(C(=O)c2ccccc2C(=O)Nc2cnc3c(cnn3C(C)C)c2)cc1[N+](=O)[O-] 26555068 IHOGZVMQTKOXEQ-UHFFFAOYSA-N 475.530 5.126 5 20 JKBD COc1cc([N+](=O)[O-])ccc1NC(=O)CSc1nc(C)nc2sc(-c3ccccc3)cc12 28416550 VPVUJZWSCMUPLV-UHFFFAOYSA-N 466.544 5.314 5 20 JKBD C[C@H](OC(=O)Cc1coc2ccc3ccccc3c12)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl 28937235 FCGSZWDRWJYTOX-ZDUSSCGKSA-N 452.850 5.261 5 20 JKBD C[C@H](NC(=O)Cn1c2ccccc2c(=O)c2ccccc21)c1ccc(OCc2cccnc2)cc1 32678158 UUWLOZXPCDYJLK-FQEVSTJZSA-N 463.537 5.006 5 20 JKBD Cc1ccc(NC(=O)Nc2ccccc2)cc1NC(=O)Cn1c2ccccc2c(=O)c2ccccc21 107518377 XYSPRQAXSCUZBE-UHFFFAOYSA-N 476.536 5.746 5 20 JKBD O=C(Nc1ccc(C(=O)N2CCc3cc([N+](=O)[O-])ccc32)cc1)c1cc(Cl)cc(Cl)c1 478136566 XTPPHAARAKPZHO-UHFFFAOYSA-N 456.285 5.357 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)N[C@H](C)c2ccc(NC(=O)Nc3ccccc3)cc2)cc1SC 484694290 GYWBVCAGHFWSSP-OAHLLOKOSA-N 480.546 5.460 5 20 JKBD O=C(Cc1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1)Nc1ccc(-c2cnco2)cc1 487477189 NDTDOEONGCGGRX-UHFFFAOYSA-N 465.469 5.284 5 20 JKBD O=C(Cn1c2ccccc2c(=O)c2ccccc21)Nc1ncc(Cc2ccc(F)c(F)c2)s1 487712653 ULKPOQWOWKNABS-UHFFFAOYSA-N 461.493 5.119 5 20 JKBD O=C(Nc1ccc(CN2C(=O)Cc3ccc(Cl)cc32)cc1)c1cc2cccc([N+](=O)[O-])c2[nH]1 498870950 DZOUMOBAZZBLOX-UHFFFAOYSA-N 460.877 5.071 5 20 JKBD CN(CCc1ccccc1)C(=O)C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1 502030050 ZCFRKSFXFBLTHT-FXBPSFAMSA-N 457.555 5.836 5 20 JKBD CN(C(=O)c1ccc(N2CCCC2)c([N+](=O)[O-])c1)[C@H]1CCSc2ccc(Br)cc21 504558247 BWIHOHCQRUTZTH-KRWDZBQOSA-N 476.396 5.267 5 20 JKBD CCCS(=O)(=O)N1CCC(NCc2ccc(Oc3cc(C)ccc3C(C)C)c([N+](=O)[O-])c2)CC1 509618983 OKKXFJMDBBJPNB-UHFFFAOYSA-N 489.638 5.113 5 20 JKBD COc1cc(C(=O)N(C)[C@H](C)c2cc3ccccc3o2)c([N+](=O)[O-])cc1OCc1cscn1 512668565 MFFIFFQCSQEMMU-CQSZACIVSA-N 467.503 5.218 5 20 JKBD O=C(c1oc2ccccc2c1CSCc1ccccc1)N1CCN(c2ccc([N+](=O)[O-])nc2)CC1 514997053 BFRGGAVZFGOJHF-UHFFFAOYSA-N 488.569 5.132 5 20 JKBD COCCN(CC(F)(F)F)C(=O)c1ccc(Sc2nc3ccccc3s2)c([N+](=O)[O-])c1 519876798 VMJUFXRFVROPIO-UHFFFAOYSA-N 471.482 5.007 5 20 JKBD CN(Cc1ccc(C(F)(F)F)cc1)C(=O)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 598951621 FNXTZMBRODPIRZ-UHFFFAOYSA-N 489.416 5.507 5 20 JKBD Cc1ccc(NC(=O)C/C(=C/c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)cc1C(N)=O 608948082 SXRPIAXAYPDGQO-ATVHPVEESA-N 472.526 5.181 5 20 JKBD O=C(c1ccc(C(=O)N(Cc2cccs2)C2CC2)c([N+](=O)[O-])c1)N(Cc1cccs1)C1CC1 609043749 PYLZRMRALISTLO-UHFFFAOYSA-N 481.599 5.327 5 20 JKBD O=C(NCc1ccc(F)c(Cl)c1)c1ccc(C(=O)NCc2ccc(F)c(Cl)c2)c([N+](=O)[O-])c1 609045281 ZLSKLIOBPDEBOT-UHFFFAOYSA-N 494.281 5.040 5 20 JKBD COc1ccc(CN(Cc2ccc(OC)cc2)C(=O)C2CCN(c3ccccc3[N+](=O)[O-])CC2)cc1 609130363 YLIREPNLESBJLO-UHFFFAOYSA-N 489.572 5.057 5 20 JKBD O=C(CCC(=O)N1CCN(Cc2ccccn2)CC1)c1ccc2ccc3cccc4ccc1c2c34 729259478 OKKBJJNHBQKWGD-UHFFFAOYSA-N 461.565 5.286 5 20 JKBD CC1=C(C(=O)Nc2ccccc2C)[C@@H](c2ccc(-c3ccccc3[N+](=O)[O-])s2)NC(=S)N1 812920077 SMTGEWVTGKTTBM-OAQYLSRUSA-N 464.572 5.063 5 20 JKBD O=[N+]([O-])c1cc(CNc2ccc([C@H](O)C(F)(F)F)cc2)ccc1Oc1ccccc1Cl 864043640 NBHVMPKJIWIQMG-FQEVSTJZSA-N 452.816 6.248 5 20 JKBD Cc1noc(C)c1CN(C)C(=O)C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1 915194828 ACDKBHCANKYCQG-PDGQHHTCSA-N 462.531 5.399 5 20 JKBD COc1ccc(Oc2ccc([N+](=O)[O-])cc2C(=O)O[C@@H](C)c2nnc(-c3ccccc3)o2)cc1 915443160 ZDCSORXBFAJYDW-HNNXBMFYSA-N 461.430 5.364 5 20 JKBD C[C@H](Sc1nnc(-c2ccccc2)n1[C@@H](C)c1ccccc1)C(=O)Nc1ccc(F)c([N+](=O)[O-])c1 917254089 GTSHPHXIXHVAON-IRXDYDNUSA-N 491.548 5.721 5 20 JKBD CN(C)c1ccc([N+](=O)[O-])cc1C(=O)NC1(c2ccc(NC(=O)[C@]3(F)CCCC=C3F)cc2)CCC1 1792377808 OKNUIRXMTZCOQB-SANMLTNESA-N 498.530 5.154 5 20 JKBD CC(C)[C@H](C(=O)N1CCCC2(CCN(C(=O)c3ccc([N+](=O)[O-])o3)CC2)C1)c1ccc(Cl)cc1 1805634180 XPNOALMYQIJPQU-QFIPXVFZSA-N 487.984 5.126 5 20 JKBD Cc1cc(Cl)ccc1C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cc(F)cc([N+](=O)[O-])c2)CC1 1830612956 NMCBMIOFHHISJA-HSZRJFAPSA-N 487.959 5.243 5 20 JKBD CC(C)c1ccc(CC(=O)N2CCCC[C@H]2C2CCN(C(=O)Cc3cccc([N+](=O)[O-])c3)CC2)cc1 1831593926 CUUGOCGLABYLSD-MHZLTWQESA-N 491.632 5.123 5 20 JKBD CC/C=C(\C)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cc(Cl)cc([N+](=O)[O-])c2C)CC1 1832519636 NTUIPOXXZKQDET-QLKYELJLSA-N 461.990 5.146 5 20 JKBD Cc1ccc(C(=O)CCC(=O)O[C@@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2ccccc2)cc1 8929527 NTDNYXQXJFENRS-XMMPIXPASA-N 480.904 5.443 5 20 JKBD O=C(COC(=O)C1(c2ccc(Cl)cc2)CCCC1)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 11582893 IMQKIKKFCNRGQV-UHFFFAOYSA-N 470.831 5.261 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Cl)[C@@H](NCCc1ccc(OC(F)F)cc1)c1ccccc1 15502194 XUMCFXQJNIBDBD-NRFANRHFSA-N 475.879 5.362 5 20 JKBD Cc1ccc([N+](=O)[O-])cc1NC(=O)COC(=O)c1ccccc1-c1ncc(-c2ccccc2)o1 19164872 IVHNVDQEKAERSM-UHFFFAOYSA-N 457.442 5.021 5 20 JKBD Cc1ccc(NC(=O)[C@H](OC(=O)c2csc(-c3ccc(F)cc3)n2)c2ccccc2)c([N+](=O)[O-])c1 19616570 SLTHTNHPFCANLT-JOCHJYFZSA-N 491.500 5.703 5 20 JKBD CC(C)NC(=O)Cc1ccc(N[C@@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2ccccc2)cc1 27007233 HTZHFFFHQZTCQE-XMMPIXPASA-N 480.952 5.107 5 20 JKBD COc1cc(C(=O)NCc2cccc(N3CCCC3=O)c2)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 32311065 QRMOAMBVMDGIHR-UHFFFAOYSA-N 495.919 5.106 5 20 JKBD CN(Cc1ccc(Cl)s1)C(=O)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 32502666 MLCQNYCYKGJYPN-UHFFFAOYSA-N 461.893 5.204 5 20 JKBD COc1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2C)cc1NC(=O)c1ccc(Cl)cc1F 303079740 UFPWWYWCRSEIGE-UHFFFAOYSA-N 457.845 5.209 5 20 JKBD O=C(C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)Nc1ccc2c(c1)C(=O)NC2 478299777 DTCZLVXSVQZOJA-BOPFTXTBSA-N 470.510 5.017 5 20 JKBD CCCc1ccc([C@H](NC(=O)c2cc(SC)c(OC)cc2[N+](=O)[O-])c2cccs2)cc1 482019256 XTCOQWUCIUBQDP-QFIPXVFZSA-N 456.589 5.859 5 20 JKBD Cc1cc(NC(=O)c2ccc(N3C[C@@H](C)C[C@@H](C)C3)c([N+](=O)[O-])c2)ccc1NC(=O)c1ccco1 490149583 UDKLMCSZBTXXMH-CALCHBBNSA-N 476.533 5.483 5 20 JKBD CC(=O)Nc1cccc2c1CCCN2C(=O)c1ccc(NCc2ccccc2Cl)c([N+](=O)[O-])c1 491206563 FYJDBHPQSRACCJ-UHFFFAOYSA-N 478.936 5.412 5 20 JKBD CC(=O)Nc1cc(C(=O)Nc2cc([N+](=O)[O-])ccc2Nc2cccc(C(F)(F)F)c2)ccc1F 506005497 XPRHIFGTGZPBGG-UHFFFAOYSA-N 476.386 5.707 5 20 JKBD CC(C)N(Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1)Cc1ccc(-c2ccc(F)cc2)s1 516308115 JIYWHFZHEDGZFV-UHFFFAOYSA-N 452.511 5.923 5 20 JKBD O=C(C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)N1CCC[C@@H]1c1ccccn1 516667714 QGPIHKLISLJBOF-SSZMPNMXSA-N 470.554 5.894 5 20 JKBD CC[C@@H](NCc1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1)c1nnc2n1CCCCC2 517551865 UKAUWLCVPBMXAH-LJQANCHMSA-N 455.946 5.599 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Cl)C(=O)NC(c1ccc(Cl)cc1)c1ccc(Cl)cc1 518135892 VHWZUZSPEJYMEV-UHFFFAOYSA-N 478.719 5.399 5 20 JKBD CCS(=O)(=O)c1ccc(C(=O)Nc2cc([N+](=O)[O-])ccc2Nc2cccc(C(F)(F)F)c2)cc1 520920975 HSKZSGQDKARREB-UHFFFAOYSA-N 493.463 5.403 5 20 JKBD COCCN(C(=O)Cc1csc(-c2cccc(F)c2)n1)c1nc(-c2ccc([N+](=O)[O-])cc2)cs1 603820262 ZEFDMAPCZONUNC-UHFFFAOYSA-N 498.561 5.203 5 20 JKBD CC(=O)Nc1ccc(C)cc1NC(=O)C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1 609022656 MXTWJLJBDXPESJ-RGEXLXHISA-N 486.553 6.041 5 20 JKBD O=C(O[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1)c1cc(F)c(Cl)nc1Cl 727522057 UNRWTMWTYYJJOD-INIZCTEOSA-N 498.681 5.626 5 20 JKBD O=C(OCC[C@H]1CCCCN1C(=O)C[C@@H](c1ccccc1)C(F)(F)F)c1cccc([N+](=O)[O-])c1 728516709 ZACBZVDRMVWQEV-CTNGQTDRSA-N 478.467 5.259 5 20 JKBD O=C(OC[C@@H]1CCCN1C(=O)c1ccccc1[N+](=O)[O-])/C(=C\c1ccc(F)cc1)c1cccs1 730704150 NTCXHQAUMZHPHR-SLOMDMAXSA-N 480.517 5.184 5 20 JKBD Cc1ccc(Oc2ccccc2NC(=O)COC(=O)c2cc([N+](=O)[O-])c(C)c([N+](=O)[O-])c2C)cc1 748948636 RGOKFLIRMGRJIE-UHFFFAOYSA-N 479.445 5.016 5 20 JKBD CCn1c(CNC(=O)C/C(=C\c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)nc2ccccc21 818930028 JPUQUBVZFLBIEU-XDJHFCHBSA-N 497.580 5.821 5 20 JKBD Cc1ccc(NC(=O)[C@H](OC(=O)c2ccc(NC(=O)C(C)C)cc2)c2ccccc2)c([N+](=O)[O-])c1 914928995 ASCNIUPEPNGIMH-HSZRJFAPSA-N 475.501 5.035 5 20 JKBD COc1cccc(NC(=O)CSc2ccccc2C(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)c1 916694467 CARPGSMBSRWRJB-UHFFFAOYSA-N 471.922 5.240 5 20 JKBD CC1=C(C(=O)Nc2ccccc2)[C@H](c2cc([N+](=O)[O-])c(F)cc2F)NC(=O)N1CCc1cccs1 916726001 NTENOTRUTPDIIC-QFIPXVFZSA-N 498.511 5.156 5 20 JKBD CC(=O)N(c1ccc(C)cc1)c1nc(/C=C2/C(=O)Nc3cc(Cl)c([N+](=O)[O-])cc32)cs1 917560373 MMWDLXFLUICOCC-FRKPEAEDSA-N 454.895 5.190 5 20 JKBD COc1cc(C(=O)Nc2ccccc2SC[C@@H]2CC2(Cl)Cl)c([N+](=O)[O-])cc1OC 917749895 PJBJXBUODWVOBA-NSHDSACASA-N 457.335 5.150 5 20 JKBD C[C@H]1CCCCN1C(=O)c1ccc(NC(=O)c2ccc(Br)c([N+](=O)[O-])c2)cc1Cl 917761704 IOXJYYNEIAIFOD-LBPRGKRZSA-N 480.746 5.278 5 20 JKBD COc1cccc(C(=O)Oc2ccc(NC(=O)c3cc([N+](=O)[O-])ccc3Cl)cc2)c1OC(F)F 923389900 ADHADNXZGGLCCS-UHFFFAOYSA-N 492.818 5.330 5 20 JKBD CCSc1ncccc1C(=O)Nc1ccc(C2(NC(=O)/C=C/c3ccc([N+](=O)[O-])o3)CCC2)cc1 1785779438 PDGZQAFUYLDFQS-ZRDIBKRKSA-N 492.557 5.156 5 20 JKBD Cc1cncc(C(=O)Nc2ccc(C3(NC(=O)c4cc5cc([N+](=O)[O-])ccc5s4)CCC3)cc2)c1 1787431395 LXVLURGDSIPIRW-UHFFFAOYSA-N 486.553 5.574 5 20 JKBD COc1cc(C(=O)Nc2ccc(C3(NC(=O)[C@@]4(C)CC=CCC4)CCC3)cc2)ccc1[N+](=O)[O-] 1792165949 SPTQUFNHYAKBOR-VWLOTQADSA-N 463.534 5.098 5 20 JKBD Cc1ccc2c(/C=C/C(=O)Nc3ccc(C4(NC(=O)c5ccc([N+](=O)[O-])o5)CCC4)cc3)c[nH]c2c1 1792363342 QKGDMYOBSKDOMT-NYYWCZLTSA-N 484.512 5.439 5 20 JKBD O=C(CCc1cccc([N+](=O)[O-])c1)Nc1cc([C@H]2CCCCN2C(=O)c2cc3ccoc3s2)[nH]n1 1815537871 XPNBSWJRWIUYRF-LJQANCHMSA-N 493.545 5.064 5 20 JKBD O=C(CCc1cccc([N+](=O)[O-])c1)Nc1cc([C@@H]2CCCCN2C(=O)c2cccc(F)c2Cl)[nH]n1 1815538499 LXANAMBOKFAZJL-FQEVSTJZSA-N 499.930 5.049 5 20 JKBD CC/C=C(\C)C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)[nH]n1 1823097560 UJNQINLUJUMFRV-KRPRSCCNSA-N 467.551 5.195 5 20 JKBD O=C(CSc1ccccc1[N+](=O)[O-])N1CCC([C@H]2CCCCN2C(=O)/C=C/c2ccccc2)CC1 1826531309 NRASDHHNCAIWFG-YAOQVBECSA-N 493.629 5.020 5 20 JKBD Cc1ccc([C@H](C)C(=O)N2CCC([C@@H]3CCCCN3C(=O)c3cc(F)cc([N+](=O)[O-])c3)CC2)cc1 1830615429 FASARTVUVSYMDJ-DFBJGRDBSA-N 481.568 5.079 5 20 JKBD Cc1c(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)CCC3CCC3)CC2)cc(Cl)cc1[N+](=O)[O-] 1830734841 UBCQBIIMXHUCID-JOCHJYFZSA-N 476.017 5.370 5 20 JKBD CC(C)=CCCC(=O)N1CCC([C@H]2CCCCN2C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)CC1 1831060885 KQDGUXGLVKCWFF-JOCHJYFZSA-N 483.634 5.789 5 20 JKBD C[C@@H](OC(=O)c1ccc(N2CCCC2)c([N+](=O)[O-])c1)C(=O)Nc1c(Cl)cc(Cl)cc1Cl 10733815 XJAUMTOQVUUXKE-LLVKDONJSA-N 486.739 5.339 5 20 JKBD COc1ccc([N+](=O)[O-])cc1NC(=O)[C@H](C)OC(=O)c1ccccc1-c1ncc(-c2ccccc2)o1 19164839 LYWIDDBHIDFLNJ-INIZCTEOSA-N 487.468 5.109 5 20 JKBD C[C@H](SC1=N/C(=C\c2ccccc2)C(=O)N1c1ccc(F)cc1)C(=O)Nc1ccc([N+](=O)[O-])cc1 23647060 HADLEJIRUAYYFJ-AABCQZNVSA-N 490.516 5.238 5 20 JKBD O=C(NCC[C@H]1C(=O)Nc2ccccc21)c1cc([N+](=O)[O-])ccc1Sc1ccc(Cl)cc1 24392372 JDEQWZAYCUIYLY-GOSISDBHSA-N 467.934 5.255 5 20 JKBD Cc1c(NC(=O)[C@H](C)Sc2ccc([N+](=O)[O-])cc2)cccc1C(=O)N1CCc2sccc2C1 26046819 TUCQDSZZMBKBDL-INIZCTEOSA-N 481.599 5.283 5 20 JKBD O=C(O[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1)c1ccc(C(F)(F)F)nc1 26434653 FZKPFQDQXHUTJI-GOSISDBHSA-N 479.798 5.199 5 20 JKBD Cc1cc(N2CCN(C)CC2)ccc1NC(=O)c1ccc(NCc2ccccc2Cl)c([N+](=O)[O-])c1 26567475 VRSHMEUUCYPWPM-UHFFFAOYSA-N 493.995 5.173 5 20 JKBD CCOc1cc([N+](=O)[O-])c(C(=O)Nc2ncc(Cc3ccc(Br)cc3)s2)cc1OC 28685569 GMUFXGCUWLHBNX-UHFFFAOYSA-N 492.351 5.064 5 20 JKBD Cc1ccc(-n2c(SCc3nnc(-c4ccc([N+](=O)[O-])cc4)o3)nnc2-c2ccccc2)cc1 29829314 ZACZBEKOZKQJGO-UHFFFAOYSA-N 470.514 5.493 5 20 JKBD Cc1sc(NC(=O)Cc2csc(Cc3ccc(F)cc3)n2)nc1-c1cccc([N+](=O)[O-])c1 195697514 YGABVZSEQBAPQR-UHFFFAOYSA-N 468.535 5.394 5 20 JKBD O=C(N[C@H]1CCN2CCC[C@@H]2C1)c1ccccc1Sc1ccc(C(F)(F)F)cc1[N+](=O)[O-] 484934074 LQNAVVSUNMQEER-JKSUJKDBSA-N 465.497 5.121 5 20 JKBD CC(C)(C)S(=O)(=O)Cc1ccc(NC(=O)c2ccc(NCc3ccccc3)c([N+](=O)[O-])c2)cc1 498048508 UMHLTXAKQQVZHI-UHFFFAOYSA-N 481.574 5.173 5 20 JKBD CC[C@H](C)NC(=O)c1cccc(CNC(=O)c2cc([N+](=O)[O-])ccc2Sc2ccccc2)c1 500031606 WGSQBAITFRRNBW-KRWDZBQOSA-N 463.559 5.204 5 20 JKBD C[C@H](NC(=O)c1ccc(Sc2nc3ccccc3s2)c([N+](=O)[O-])c1)c1nnc2n1CCCCC2 502798435 KIKHGJRHGJFBGC-AWEZNQCLSA-N 494.602 5.165 5 20 JKBD CC(=O)Nc1ccc(Br)cc1NC(=O)c1ccc(N2C[C@@H](C)C[C@H](C)C2)c([N+](=O)[O-])c1 506143513 JCJNUHDZDBCMSD-KBPBESRZSA-N 489.370 5.050 5 20 JKBD C[C@@H](Nc1ccc(C(=O)N2CCC[C@@H]2Cc2c(F)cccc2Cl)cc1[N+](=O)[O-])c1ccccn1 507388447 KAWYBGBJTOCBGC-SJLPKXTDSA-N 482.943 5.803 5 20 JKBD COc1ccc([C@H](C)N[C@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2ccccc2)cc1F 511072376 KAGGKAUJEUSJQK-FPTDNZKUSA-N 457.889 5.427 5 20 JKBD O=C(C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)NCc1ccc(F)c(F)c1 514396079 LIZUDVBDQHQMEW-BOPFTXTBSA-N 465.481 5.730 5 20 JKBD Cc1cc(C(=O)NC2CCCCC2)ccc1NC(=O)Cn1c2ccccc2c(=O)c2ccccc21 515645774 OJMKDIYUFHWRRS-UHFFFAOYSA-N 467.569 5.164 5 20 JKBD CSc1ccc(C(=O)c2ccccc2C(=O)Nc2ccc(-n3cccn3)c(F)c2)cc1[N+](=O)[O-] 518278028 GQRFYHWWQRDIEC-UHFFFAOYSA-N 476.489 5.125 5 20 JKBD COc1cc(CNCc2ccc(-n3ccnc3C)c(F)c2)ccc1OCc1ccc([N+](=O)[O-])cc1 518778721 XTHUMKBRFPODLV-UHFFFAOYSA-N 476.508 5.105 5 20 JKBD Cc1ccc([N+](=O)[O-])cc1C(=O)Nc1nnc(SCc2c(Cl)cccc2Cl)s1 520015406 VZQYJTHIPMCUFU-UHFFFAOYSA-N 455.348 5.606 5 20 JKBD CS(=O)(=O)Cc1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2Sc2ccc(Cl)cc2)cc1 520168341 NSXUBCCIJWRIKO-UHFFFAOYSA-N 476.963 5.196 5 20 JKBD COCCN(C(=O)Cc1c[nH]c2cc(Cl)ccc12)c1nc(-c2ccc([N+](=O)[O-])cc2)cs1 524100586 VKSQRZYWQPZQBJ-UHFFFAOYSA-N 470.938 5.075 5 20 JKBD C[C@H](Nc1ccc(C(=O)NCC(C)(C)N[C@H](C)c2ccccc2)cc1[N+](=O)[O-])c1ccccn1 552344038 UJQZRIGBHYTPQY-MOPGFXCFSA-N 461.566 5.022 5 20 JKBD C[C@@H](Nc1cccc(NC(=O)c2cccs2)c1)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 602384442 DPJPYCMKBQEFBO-GFCCVEGCSA-N 478.452 5.367 5 20 JKBD Cc1c(CSc2nnc(CN3CCCCC3)n2-c2ccc(OC(F)F)cc2)cccc1[N+](=O)[O-] 603722097 FBDPKRUIHYXHOK-UHFFFAOYSA-N 489.548 5.364 5 20 JKBD C[C@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)N[C@@H](C)c1cccc(NC(=O)c2ccccc2)c1 604442730 QOOMEGVWTXROAN-HOTGVXAUSA-N 467.909 5.145 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Cl)[C@H](NC[C@@H]1CCCN(Cc2ccccc2)C1)c1ccccc1 604474093 HIWWNBYVPYXQGC-HFZDXXHNSA-N 493.007 5.430 5 20 JKBD CCOc1cc(NC(=O)N(C)C[C@H]2CCCO[C@H]2c2ccccc2)c([N+](=O)[O-])cc1OCC 604522378 XIMQRBJWCKRRFX-JPYJTQIMSA-N 457.527 5.024 5 20 JKBD CCOCc1cccc(NC(=O)N2CCN(Cc3ccc(-c4ccccc4[N+](=O)[O-])s3)CC2)c1 608840947 JJHVCIAXIAOJRI-UHFFFAOYSA-N 480.590 5.210 5 20 JKBD CSc1ccc([N+](=O)[O-])c(C(=O)N2c3ccccc3CC[C@@H]2C(=O)Nc2ccccc2C)c1 608872828 RPHIHUPQRYDXEV-HSZRJFAPSA-N 461.543 5.225 5 20 JKBD O=C(O[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1)c1ccc(Cl)nc1Cl 747936251 BAHYOLJNWIHBTG-QGZVFWFLSA-N 480.691 5.487 5 20 JKBD CC(C)CCSc1ccc(-c2nc([C@@H]3CCC(=O)N(CC4CCC4)C3)no2)cc1[N+](=O)[O-] 856563542 AMPZHYZPEHPNCH-GOSISDBHSA-N 458.584 5.289 5 20 JKBD C[C@@H](OC(=O)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-])c1nc2ccccc2n1C(F)F 917947003 RJPZKKYXNORPGT-SNVBAGLBSA-N 459.327 5.199 5 20 JKBD C[C@H](OC(=O)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-])C(=O)Nc1cccc(Cl)c1Cl 919195455 IHSGKAOUYKBYFZ-VIFPVBQESA-N 481.210 5.027 5 20 JKBD C[C@H](Nc1ccc(C(=O)Nc2nnc(C3CCCCC3)s2)cc1[N+](=O)[O-])c1ccccn1 919745008 UDWSQRAUMVQBEA-AWEZNQCLSA-N 452.540 5.314 5 20 JKBD C[C@H](Nc1ccc(C(=O)O[C@H](C(=O)Nc2ccccc2)c2ccccc2)cc1[N+](=O)[O-])c1ccccn1 920544528 CELVUIBZPLQXQS-SIBVEZHUSA-N 496.523 5.700 5 20 JKBD COc1ccc(NC(=O)OC(C)(C)C)c(NC(=O)[C@@H](C)Oc2ccc(Cl)cc2[N+](=O)[O-])c1 920819535 ROCBPHIPSWDEDZ-GFCCVEGCSA-N 465.890 5.010 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)C3(c4cccc([N+](=O)[O-])c4)CCC3)CCC2)cc1)C1=CCCS1 1786413836 VHYSZRPFRYCIFQ-UHFFFAOYSA-N 477.586 5.171 5 20 JKBD O=C(Cc1cccc([N+](=O)[O-])c1)NC1(c2ccc(NC(=O)c3ccc4cnccc4c3)cc2)CCC1 1789010731 PSKXCYHJVXYNAT-UHFFFAOYSA-N 480.524 5.133 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)c3ccc([N+](=O)[O-])[nH]3)CCC2)cc1)c1cc(F)cc(C(F)(F)F)c1 1790648913 ZNWWXJKQBUYNJR-UHFFFAOYSA-N 490.413 5.142 5 20 JKBD Cc1ccc(CC(=O)NC2(c3ccc(NC(=O)c4nc5ccccc5o4)cc3)CCC2)cc1[N+](=O)[O-] 1790851933 WZMGJNLWGJDUOP-UHFFFAOYSA-N 484.512 5.035 5 20 JKBD CC(=O)Nc1ccc(C(=O)NC2(c3ccc(NC(=O)/C=C/c4ccccc4[N+](=O)[O-])cc3)CCC2)cc1 1792319205 KRIXSBSFUXVXJO-CXUHLZMHSA-N 498.539 5.014 5 20 JKBD O=C(Nc1cc([C@@H]2CCCCN2C(=O)Cc2cccc([N+](=O)[O-])c2)[nH]n1)[C@@H]1CCC[C@H]2CCCC[C@@H]21 1818927382 UTSQDMYCKYTKDY-SPHCQZIESA-N 493.608 5.159 5 20 JKBD Cc1ccc(CC(=O)Nc2cc([C@H]3CCCCN3C(=O)c3ccccc3C3CC3)[nH]n2)cc1[N+](=O)[O-] 1820921897 XSBNHAKFFKUEDA-HSZRJFAPSA-N 487.560 5.052 5 20 JKBD Cc1cc(Cl)cc(C(=O)N2CCCC[C@H]2c2cc(NC(=O)c3cc(F)cc([N+](=O)[O-])c3)n[nH]2)c1 1821169343 VMVGBBNZVQCWFN-FQEVSTJZSA-N 485.903 5.039 5 20 JKBD CC(C)(C)CC(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cc(Br)ccc2[N+](=O)[O-])CC1 1826337701 CJNVFEPKWQHHKK-LJQANCHMSA-N 494.430 5.027 5 20 JKBD O=C(c1ccc([N+](=O)[O-])o1)N1CCC([C@H]2CCCCN2C(=O)c2ccc(Cl)c(Cl)c2)CC1 1829973214 ADSNSDAYMLCYAW-GOSISDBHSA-N 480.348 5.042 5 20 JKBD Cc1ccc(C(=O)N2CCCC[C@H]2C2CCN(C(=O)CSc3ccccc3[N+](=O)[O-])CC2)cc1C 1830007992 RYHQISAJCOBUOP-QHCPKHFHSA-N 495.645 5.237 5 20 JKBD C[C@@H](CC(=O)N1CCC([C@H]2CCCCN2C(=O)Cc2ccc([N+](=O)[O-])cc2F)CC1)c1ccccc1 1831294805 RAJPKHWCDKISKJ-RXFWQSSRSA-N 495.595 5.090 5 20 JKBD C[C@H](OC(=O)c1ccccc1C(=O)c1ccc(Cl)c([N+](=O)[O-])c1)C(=O)N[C@@H](C)c1ccc(F)cc1 11029312 TYUXNSFTQKKCRH-GJZGRUSLSA-N 498.894 5.041 5 20 JKBD COCCN(C(=O)c1cccc(Cl)c1Cl)c1nc(-c2ccc([N+](=O)[O-])cc2)cs1 14790558 ZSUIQYYWKBDVTO-UHFFFAOYSA-N 452.319 5.318 5 20 JKBD CN(CC(=O)Nc1ccccc1Cl)C(=O)c1ccc(NCc2ccccc2Cl)c([N+](=O)[O-])c1 16177557 YTPMDKKLGFUUOM-UHFFFAOYSA-N 487.343 5.224 5 20 JKBD COc1ccc([C@H](CNC(=O)C2CCN(c3ccccc3[N+](=O)[O-])CC2)c2c[nH]c3ccccc23)cc1 18074479 MGSVVUCDFGMIAZ-DEOSSOPVSA-N 498.583 5.249 5 20 JKBD O=C(Nc1cccc(Oc2cnccn2)c1)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1 33136585 BPUSURQJZOEALN-UHFFFAOYSA-N 462.849 5.875 5 20 JKBD COc1ccc([C@H]2[C@H](C(=O)Nc3cc([N+](=O)[O-])ccc3C)CCC(=O)N2c2ccc(OC)cc2)cc1 36774297 OFDYNUWQVXOAMF-BVAGGSTKSA-N 489.528 5.043 5 20 JKBD COC(=O)c1ccc([N+](=O)[O-])c(OCc2csc(N(C(C)=O)c3c(C)cc(C)cc3C)n2)c1 107757278 FZKZENNVTXYJRV-UHFFFAOYSA-N 469.519 5.027 5 20 JKBD CCOc1cc(C(=O)N(Cc2ccccn2)c2ccc(Br)cc2)c([N+](=O)[O-])cc1OC 108327429 SETAZZCMDFGVOD-UHFFFAOYSA-N 486.322 5.007 5 20 JKBD CSc1ccc(C(=O)c2ccccc2C(=O)Nc2ccc(F)cc2Br)cc1[N+](=O)[O-] 500045200 JHACYICNXZIVAE-UHFFFAOYSA-N 489.322 5.702 5 20 JKBD COc1cc(/C=C(/CC(=O)O)c2nc3ccccc3o2)ccc1OCc1ccc([N+](=O)[O-])cc1 502317945 DGKUKIMBYZUGCN-PDGQHHTCSA-N 460.442 5.339 5 20 JKBD Cc1cccc(CN(Cc2ccco2)C(=O)c2ccc(N[C@@H](C)c3ccccn3)c([N+](=O)[O-])c2)c1 506176585 WWCCYSLPQOMBFU-FQEVSTJZSA-N 470.529 5.907 5 20 JKBD COc1cc(CN[C@H](c2ccc(F)cc2)[C@@H]2CCCO2)ccc1OCc1ccc([N+](=O)[O-])cc1 507910631 ABMGSKQTDPVOPG-AZGAKELHSA-N 466.509 5.331 5 20 JKBD Cc1cc(C)n(-c2ccc(CNCc3ccc(Oc4ccccc4Cl)c([N+](=O)[O-])c3)cn2)n1 509568821 KHQXRWMOFSRNRA-UHFFFAOYSA-N 463.925 5.528 5 20 JKBD CCN(C(=O)c1cc(OC)c(OCc2cscn2)cc1[N+](=O)[O-])[C@H](C)c1ccc(F)cc1 512205426 ZAADBWJCJRTFHH-CQSZACIVSA-N 459.499 5.001 5 20 JKBD C[C@@H](Sc1nc2ccccc2c2nc3ccccc3n12)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 514846772 XTLXLGVMBVVSJB-CQSZACIVSA-N 468.498 5.847 5 20 JKBD COc1ccc(-c2nc(C(=O)Nc3nc(-c4cccc([N+](=O)[O-])c4)c(C)s3)cs2)cc1OC 515621997 CYGATKPZPCTRFV-UHFFFAOYSA-N 482.543 5.420 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Cl)[C@H](NCc1cc(F)ccc1Br)c1ccccc1 515735782 HDVRGJPABAGHOD-HXUWFJFHSA-N 492.732 5.619 5 20 JKBD COc1cc(C(=O)N(Cc2cccs2)Cc2cccs2)c([N+](=O)[O-])cc1OC(F)F 585689366 CIJGGVWBJYORIX-UHFFFAOYSA-N 454.476 5.170 5 20 JKBD O=C(C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)NCc1ccc(Cl)o1 591721860 NLZXEFYBSRTGSG-RVDMUPIBSA-N 453.907 5.698 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Cl)[C@@H](Nc1ccc(CN2CCCC2=O)cc1)c1ccccc1 604045791 WZDABJSINFUATB-DEOSSOPVSA-N 478.936 5.163 5 20 JKBD Cc1cc(C)nc(-n2nc(C)cc2NC(=O)c2ccc(NCc3ccccc3Cl)c([N+](=O)[O-])c2)n1 608943449 NPGSMRWJKXLSRI-UHFFFAOYSA-N 491.939 5.014 5 20 JKBD O=C(c1ccc(NCc2ccccc2Cl)c([N+](=O)[O-])c1)N1CCO[C@H](c2ccccc2F)C1 608962859 KSODHBOBQUOTPW-QHCPKHFHSA-N 469.900 5.213 5 20 JKBD CCOc1ccc(OCC)c(NC(=S)/C(=C(/O)c2cccc([N+](=O)[O-])c2)[n+]2ccccc2)c1 726962832 HFUAMNGWBQHSNM-UHFFFAOYSA-O 466.539 5.003 5 20 JKBD O=C(N[C@H](Cc1c[nH]c2ccccc12)C(=O)OCc1csc([N+](=O)[O-])c1)c1ccc2ccccc2c1 746751839 WHVIHFOQJNFZLR-XMMPIXPASA-N 499.548 5.375 5 20 JKBD Cc1cc(-c2cc(C(=O)O[C@@H](C)C(=O)Nc3cc([N+](=O)[O-])ccc3Cl)c3c(C)noc3n2)c(C)o1 813320083 UNJPVAAYJZGGIU-ZDUSSCGKSA-N 498.879 5.154 5 20 JKBD CC(C)(C)OC(=O)NC(C)(C)c1noc(-c2ccc(NCc3ccccc3)c([N+](=O)[O-])c2)n1 904761293 DNFXHKJXIWDOGV-UHFFFAOYSA-N 453.499 5.017 5 20 JKBD CCOC(=O)/C(=C/c1ccc(-c2cccc([N+](=O)[O-])c2)o1)c1nc(O)c2c(C)c(C)sc2n1 916126796 KLKOHGKXROOQNA-GZTJUZNOSA-N 465.487 5.286 5 20 JKBD COc1cc(C(=O)O[C@H](c2cc(C)cc(C)c2)C(F)(F)F)c([N+](=O)[O-])cc1OCc1cscn1 919994229 PWWSJMAIIXRKGG-HXUWFJFHSA-N 496.463 5.716 5 20 JKBD C[C@H](OC(=O)c1ccc(N[C@@H](C)c2ccccn2)c([N+](=O)[O-])c1)C(=O)c1cccc(Cl)c1 920547576 OQNAWZXPKISCIE-GJZGRUSLSA-N 453.882 5.245 5 20 JKBD CC1=C(C(=O)Nc2cccc([N+](=O)[O-])c2)[C@H](c2ccc(O)c(Cl)c2)NC(=O)N1Cc1cccs1 921300491 XHFHJDPPVTWOCF-NRFANRHFSA-N 498.948 5.195 5 20 JKBD COC(=O)c1ccc2c(O)nc(/C=C/c3ccc(-c4ccc(Cl)cc4[N+](=O)[O-])o3)nc2c1 1321414318 YORPKTWULZFRLL-WEVVVXLNSA-N 451.822 5.114 5 20 JKBD O=C(NC1(c2ccc(NC(=O)c3cccc4ccccc34)cc2)CCC1)c1ccc([N+](=O)[O-])o1 1788892113 MORJDRLANIGIHO-UHFFFAOYSA-N 455.470 5.403 5 20 JKBD COc1cc(C(=O)NC2(c3ccc(NC(=O)[C@@]4(C)CC=CCC4)cc3)CCC2)cc([N+](=O)[O-])c1OC 1791992967 YFYYFVBDJKYDSF-SANMLTNESA-N 493.560 5.106 5 20 JKBD COc1cc(C(=O)Nc2ccc(C3(NC(=O)CCCCn4cccc4)CCC3)cc2)ccc1[N+](=O)[O-] 1792165873 SEHOHWUJUXOKPN-UHFFFAOYSA-N 490.560 5.023 5 20 JKBD CN(C)c1ccc([N+](=O)[O-])cc1C(=O)NC1(c2ccc(NC(=O)[C@@]3(F)CCCC=C3F)cc2)CCC1 1792377807 OKNUIRXMTZCOQB-AREMUKBSSA-N 498.530 5.154 5 20 JKBD Cc1cc(O)c([N+](=O)[O-])cc1C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cccc3ccccc23)n[nH]1 1818454431 WZWMGTLJYDABML-JOCHJYFZSA-N 499.527 5.105 5 20 JKBD CC(C)c1ccc(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)c3cc(F)cc([N+](=O)[O-])c3)n[nH]2)cc1 1821167846 XGYGOZULJVQFGY-JOCHJYFZSA-N 479.512 5.200 5 20 JKBD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2ccccc2F)[nH]n1)c1cc2cc([N+](=O)[O-])ccc2s1 1821609959 QJRAGACUMZXNMB-IBGZPJMESA-N 493.520 5.291 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cccc3cc[nH]c23)CC1 1828316760 QUFMMYYBHQEWCS-QHCPKHFHSA-N 492.551 5.071 5 20 JKBD Cc1cc(Cl)cc(C(=O)N2CCC([C@H]3CCCCN3C(=O)c3ccc([N+](=O)[O-])cc3F)CC2)c1 1830497278 CRTDEUDGGLGODI-HSZRJFAPSA-N 487.959 5.243 5 20 JKBD COc1ccc(-c2nnc(S[C@H](C(=O)Nc3ccc(C)cc3[N+](=O)[O-])c3ccccc3)o2)cc1 8633411 JTULVNZGBZCEPV-NRFANRHFSA-N 476.514 5.434 5 20 JKBD COc1ccc(OC)c(NC(=O)[C@H](C)Sc2nc3ccccc3c3nc4ccccc4n23)c1 8760711 DUPYNNCSWBPRED-HNNXBMFYSA-N 458.543 5.172 5 20 JKBD O=C(COC(=O)c1ccccc1CSc1nc2ccccc2o1)Nc1cc([N+](=O)[O-])ccc1Cl 9556085 NUARGJLIFWVONL-UHFFFAOYSA-N 497.916 5.477 5 20 JKBD Cc1c(C(=O)O[C@@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2ccccc2)cccc1[N+](=O)[O-] 11397336 KUVGLFDYHRRREJ-HXUWFJFHSA-N 469.837 5.002 5 20 JKBD COc1ccc(OC)c(-c2csc(NC(=O)CSc3ccc(C(F)(F)F)cc3[N+](=O)[O-])n2)c1 14791567 VUFDLPGEESQIHU-UHFFFAOYSA-N 499.492 5.485 5 20 JKBD COc1cc(CN(C)C(=O)c2ccc(SC)c([N+](=O)[O-])c2)ccc1OCc1ccccc1 18134617 JJJXSIJITKXCCF-UHFFFAOYSA-N 452.532 5.177 5 20 JKBD C[C@H](OC(=O)C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)C(=O)NC1CCCC1 18494246 JVNAGQRAWCGNDC-IYWFSZBXSA-N 479.558 5.126 5 20 JKBD CC(=O)N(c1ccc(Cl)c(Cl)c1)c1nc(COC(=O)c2ccccc2[N+](=O)[O-])cs1 23953074 OEAQCQWXRJGTQU-UHFFFAOYSA-N 466.302 5.400 5 20 JKBD CCOc1cc(C(=O)Nc2sc3c(c2-c2nc4ccccc4[nH]2)CCCC3)c([N+](=O)[O-])cc1OC 104957137 PXKQXRSJNSTSHN-UHFFFAOYSA-N 492.557 5.738 5 20 JKBD Cc1cc(NC(=O)CCc2ncc(-c3ccc(Cl)cc3Cl)o2)n(-c2ccc([N+](=O)[O-])cc2)n1 105583094 BNLSTCUQDOLCOY-UHFFFAOYSA-N 486.315 5.622 5 20 JKBD CCc1cc(=O)[nH]c(-c2cccc(NC(=O)c3ccc(Sc4nc(C)cs4)c([N+](=O)[O-])c3)c2)n1 107964977 DYNXBEMJLKDMJN-UHFFFAOYSA-N 493.570 5.076 5 20 JKBD CC(C)[C@@H](NC(=O)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1)c1nc(C2CC2)no1 110697941 SHGXLFGKFDCXJN-LJQANCHMSA-N 456.886 5.428 5 20 JKBD C[C@H]1CN(Cc2ccccc2NC(=O)c2ccc(NCc3ccccc3)c([N+](=O)[O-])c2)C[C@@H](C)O1 117731952 UQIPSVJHOWQAMX-BGYRXZFFSA-N 474.561 5.068 5 20 JKBD O=c1c2ccc(C(F)(F)F)cc2nc2n1CC/C2=C/c1ccc(-c2ccccc2[N+](=O)[O-])o1 208900539 CPJHDNRWMBSDDJ-QBFSEMIESA-N 453.376 5.528 5 20 JKBD COc1cc(C(=O)NC[C@@H]2CCCO[C@@H]2c2ccccc2)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 409572639 CMHOTTCLUVZBHH-UQBPGWFLSA-N 496.947 5.947 5 20 JKBD Cc1ccc2c(c1C)OC[C@H]2N[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Br)c1ccccc1 477036356 UHGOJOOXHVAVMD-YADHBBJMSA-N 496.361 5.377 5 20 JKBD Cc1ccc(Sc2ccc(C(=O)N(C)[C@H](C)c3ccc(-n4cncn4)cc3)cc2[N+](=O)[O-])cc1 499205122 YPONIUXCSPLFFA-GOSISDBHSA-N 473.558 5.468 5 20 JKBD CSc1ccc([N+](=O)[O-])c(C(=O)N(C)CCCCCc2cc(-c3cccc(F)c3)no2)c1 499715250 WIBQXRHVURXGLH-UHFFFAOYSA-N 457.527 5.596 5 20 JKBD COc1cc(C(=O)Nc2ccc(-c3nc(C)cs3)cc2)c([N+](=O)[O-])cc1OCc1cscn1 506044628 SXTVAGNYHYFSEA-UHFFFAOYSA-N 482.543 5.323 5 20 JKBD CC(=O)Nc1ccc(Br)cc1NC(=O)c1ccc(N2C[C@H](C)C[C@@H](C)C2)c([N+](=O)[O-])c1 506143641 JCJNUHDZDBCMSD-ZIAGYGMSSA-N 489.370 5.050 5 20 JKBD O=C(c1ccc(Nc2ccccc2)c([N+](=O)[O-])c1)N1CCC[C@H](c2nc(-c3cccc(F)c3)no2)C1 507990249 RANFZSBOVDCQGO-IBGZPJMESA-N 487.491 5.547 5 20 JKBD CN(C)C(=O)c1ccc(Cl)c(NC(=O)c2cc([N+](=O)[O-])ccc2Sc2ccc(Cl)cc2)c1 512331000 WQRXBRNOKYEVDT-UHFFFAOYSA-N 490.368 6.007 5 20 JKBD COCCOc1ccc(NC(=O)C/C(=C\c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)cc1 512493981 MFATZBIVTMIHHW-KNTRCKAVSA-N 489.553 5.799 5 20 JKBD C[C@@H](SCc1ncc(-c2ccc(Cl)cc2)o1)C(=O)Nc1cc2c(cc1[N+](=O)[O-])OCCCO2 512976859 BNEPZLOTKMDGJE-CYBMUJFWSA-N 489.937 5.325 5 20 JKBD Cc1ccc(S(=O)(=O)Nc2ccc(C(=O)Nc3ccccc3-c3cccs3)cc2)cc1[N+](=O)[O-] 514389340 KDYKGQNJEDUZGI-UHFFFAOYSA-N 493.566 5.685 5 20 JKBD C[C@@H](c1cccs1)N(Cc1ccccc1)C(=O)CCCn1c(=O)oc2cc([N+](=O)[O-])ccc21 515370904 MLPDGZNOQUBRSN-KRWDZBQOSA-N 465.531 5.134 5 20 JKBD Cc1c(NC(=O)[C@H](C)Sc2nnc(-c3ccccc3)n2[C@H](C)c2ccccc2)cccc1[N+](=O)[O-] 515574034 CQTXNBRBKJMRKZ-MOPGFXCFSA-N 487.585 5.890 5 20 JKBD COCCOc1ccc(NC(=O)c2ccccc2C(=O)c2ccc(SC)c([N+](=O)[O-])c2)c(C)c1 515616485 JLECTGDKEHLNKD-UHFFFAOYSA-N 480.542 5.134 5 20 JKBD Cc1cc(C)n([C@H](C)C(=O)Nc2ccc(NC(=O)c3cc4cc([N+](=O)[O-])ccc4s3)cc2Cl)n1 521540185 RJMVLGOXNVVCAJ-CQSZACIVSA-N 497.964 5.728 5 20 JKBD C[C@H](Sc1n[nH]c(/C=C\c2ccccc2)n1)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 598953752 XNERDVTVJONLLB-UMAGTOLTSA-N 463.441 5.021 5 20 JKBD CCc1nc2ccc(C(=O)N(CCOC)c3nc(-c4ccc([N+](=O)[O-])cc4)cs3)cc2nc1CC 603461232 HNNXQTNQWPIIGU-UHFFFAOYSA-N 491.573 5.080 5 20 JKBD COc1cccc([C@H](CNC(=O)c2cc3cc([N+](=O)[O-])ccc3o2)c2c[nH]c3ccccc23)c1OC 603780877 PZKFZPDYVGDWMZ-NRFANRHFSA-N 485.496 5.401 5 20 JKBD COc1ccc([C@H](CNC(=O)[C@H](C)Sc2ccc([N+](=O)[O-])cc2)c2c[nH]c3ccccc23)cc1 603819592 NIWKDUCRBXXPOM-SBUREZEXSA-N 475.570 5.514 5 20 JKBD C[C@@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)N(c1ccccc1)c1nc2ccccc2s1 604446669 NVGZLOZIGWGHCL-CQSZACIVSA-N 453.907 5.990 5 20 JKBD CC(=O)N(C)c1ccc(NC(=O)C/C(=C/c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)cc1 604478823 AKIAOORFMUJDFH-CYVLTUHYSA-N 486.553 5.757 5 20 JKBD Cc1[nH]nc(NC(=O)c2ccc(NCc3ccccc3Cl)c([N+](=O)[O-])c2)c1-c1ccccc1 604532960 DLPLUMIHJLWKIT-UHFFFAOYSA-N 461.909 5.811 5 20 JKBD C[C@@H]1CCCN(c2ccc(C(=O)Nc3ccc(-c4noc(C(F)(F)F)n4)cc3)cc2[N+](=O)[O-])C1 608875821 VNZAEPUNVOJGRF-CYBMUJFWSA-N 475.427 5.152 5 20 JKBD CCOc1cc(C(=O)Nc2nc(C3CC3)c(Cc3ccc(F)cc3)s2)c([N+](=O)[O-])cc1OC 608902200 JJORVWTZYVXIPM-UHFFFAOYSA-N 471.510 5.318 5 20 JKBD O=C(C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)NCc1nc(-c2ccccc2)n[nH]1 726776016 YUPIBPLCICAWGX-XMHGGMMESA-N 496.552 5.237 5 20 JKBD O=C(Nc1ccc(N2CCCC2)cc1)c1ccc(C(=O)Nc2ccc(N3CCCC3)cc2)c([N+](=O)[O-])c1 727848606 NGKHMDZUSPBSHN-UHFFFAOYSA-N 499.571 5.300 5 20 JKBD Cc1nc(-c2ccc(F)cc2)sc1[C@H](C)NC(=O)c1cc([N+](=O)[O-])c(C)c([N+](=O)[O-])c1C 729418646 AMQDFCLDEKISHI-LBPRGKRZSA-N 458.471 5.182 5 20 JKBD C[C@H](OC(=O)c1csc(-c2ccc(Cl)c(Cl)c2)n1)C(=O)Nc1ccccc1[N+](=O)[O-] 744604404 FQJMGWPVEXBMKE-JTQLQIEISA-N 466.302 5.209 5 20 JKBD CCOc1cc(C(=O)Nc2nc3ccc(SC(F)F)cc3s2)c([N+](=O)[O-])cc1OC 747416591 XNNLWLZGCFMZAA-UHFFFAOYSA-N 455.464 5.179 5 20 JKBD O=C(COC(=O)c1csc(-c2cccc([N+](=O)[O-])c2)n1)Nc1ccc(Cl)cc1C(F)(F)F 747962419 OTVNKFCBNVZYOF-UHFFFAOYSA-N 485.827 5.186 5 20 JKBD CSc1ccc(C(=O)c2ccccc2C(=O)OCc2ccc3ccccc3n2)cc1[N+](=O)[O-] 750899344 COBTYGLTBHKQOS-UHFFFAOYSA-N 458.495 5.453 5 20 JKBD Cc1ccc(Oc2ccccc2NC(=O)c2cc([N+](=O)[O-])ccc2I)cc1 915275893 AQXNGPXGTHRHNT-UHFFFAOYSA-N 474.254 5.552 5 20 JKBD CCOc1ccc(C(=O)OCc2csc(N(C(C)=O)c3ccc(Cl)cc3)n2)cc1[N+](=O)[O-] 918995070 WOJUMQFQCXASBT-UHFFFAOYSA-N 475.910 5.145 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Cl)[C@@H](Nc1cccc(N2CCCCC2)c1)c1ccccc1 920061823 JITQICGRRBQAHC-DEOSSOPVSA-N 464.953 6.030 5 20 JKBD Cc1c(F)cccc1C(=O)Nc1ccc(C2(NC(=O)/C=C/c3ccc([N+](=O)[O-])o3)CCC2)cc1 1785953587 JZBDLMIVAIUYAV-ZRDIBKRKSA-N 463.465 5.096 5 20 JKBD O=C(COC1CCCCC1)Nc1ccc(C2(NC(=O)CSc3ccccc3[N+](=O)[O-])CCC2)cc1 1786017003 XZIPIQZRBSLPFM-UHFFFAOYSA-N 497.617 5.170 5 20 JKBD O=C(Cc1ccc(Cl)cc1[N+](=O)[O-])Nc1ccc(C2(NC(=O)c3ccoc3Cl)CCC2)cc1 1786115590 AEDCNUMQYVQGLN-UHFFFAOYSA-N 488.327 5.485 5 20 JKBD COc1cc(C(=O)NC2(c3ccc(NC(=O)[C@@H](F)c4ccccc4)cc3)CCC2)ccc1[N+](=O)[O-] 1786616929 WHENHCLAQOIENH-QHCPKHFHSA-N 477.492 5.062 5 20 JKBD Cc1c(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)[C@@H]3CCC[C@H]3C)n[nH]2)cc(Cl)cc1[N+](=O)[O-] 1818958880 IKSKDHNEUIPOIY-VVFCZOMOSA-N 473.961 5.022 5 20 JKBD Cc1ccncc1C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)CC1 1827901676 AJHRMOZTXVXKPW-QFIPXVFZSA-N 492.601 5.060 5 20 JKBD C[C@@H](OC(=O)c1c(Cl)ccc(Cl)c1Cl)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl 3458360 CCIWWROULOYOTL-SSDOTTSWSA-N 452.077 5.392 5 20 JKBD CCn1c(S[C@@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2C(F)(F)F)nnc1-c1ccc(Cl)cc1 9071799 PDIOJZIPDPIRFC-NSHDSACASA-N 499.902 5.665 5 20 JKBD Cc1cc([N+](=O)[O-])ccc1NC(=O)CSc1nnc(Nc2ccc(OC(F)(F)F)cc2)s1 22181007 CXDFONAMZVZVMF-UHFFFAOYSA-N 485.469 5.128 5 20 JKBD CCn1c(S[C@@H](C)C(=O)Nc2cc([N+](=O)[O-])ccc2Cl)nc2sc3c(c2c1=O)CCCC3 23597264 JQBWYACPFYLJBW-NSHDSACASA-N 493.010 5.038 5 20 JKBD O=C(OCC(=O)N1N=C(c2cc3ccccc3o2)C[C@@H]1c1ccco1)c1ccc(Cl)c([N+](=O)[O-])c1 24458892 MWUXGZHPAYJJFE-LJQANCHMSA-N 493.859 5.122 5 20 JKBD CCOc1ncccc1CNC(=O)C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1 30307767 DUGRIRLVGSFTOH-RGEXLXHISA-N 474.542 5.245 5 20 JKBD CC(=O)N(c1nc(COc2ccc([N+](=O)[O-])cc2C=O)cs1)c1c(C)cc(C)cc1Cl 31701892 HOETUCWRNGGKCK-UHFFFAOYSA-N 459.911 5.398 5 20 JKBD Cc1cc(C)n(-c2ccc(CNC(=O)[C@@H](C)Sc3ccc([N+](=O)[O-])cc3)c(C(F)(F)F)c2)n1 72037092 DKPRZYDWTKZWAR-OAHLLOKOSA-N 478.496 5.213 5 20 JKBD Cc1csc(Sc2ccc(C(=O)Nc3ccc(N(C)C)cc3C(F)(F)F)cc2[N+](=O)[O-])n1 106219235 QUZNKXSWPXVOOL-UHFFFAOYSA-N 482.509 5.848 5 20 JKBD Cc1c(NC(=O)c2ccccc2)cccc1NC(=O)c1ccc(N2C[C@@H](C)C[C@H](C)C2)c([N+](=O)[O-])c1 409453743 PUFZTPYRRXZJQY-OALUTQOASA-N 486.572 5.890 5 20 JKBD Cc1csc(Sc2ccc(C(=O)Nc3ccccc3-c3n[nH]c(C(C)C)n3)cc2[N+](=O)[O-])n1 492660069 XHIOXOIWUZVGPC-UHFFFAOYSA-N 480.575 5.672 5 20 JKBD C[C@@H](Nc1ccc(C(=O)NCc2ccc(Oc3ccccc3)nc2)cc1[N+](=O)[O-])c1ccccn1 503450910 YPVNBQFYUCXGRX-GOSISDBHSA-N 469.501 5.280 5 20 JKBD COc1cc(C(=O)N(Cc2ccc([N+](=O)[O-])cc2)C(C)C)cc(OC)c1OCc1ccccc1 509702532 ZXZFXOCIIKTCGS-UHFFFAOYSA-N 464.518 5.242 5 20 JKBD COc1ccc(Cl)c(NC(=O)c2ccccc2C(=O)c2ccc(SC)c([N+](=O)[O-])c2)c1 513301679 NEIPHGDHCQLBFA-UHFFFAOYSA-N 456.907 5.462 5 20 JKBD COCCN(C(=O)c1cc2ccc(F)cc2nc1C)c1nc(-c2ccc([N+](=O)[O-])cc2)cs1 514653192 CJEKPIBQCPLSBK-UHFFFAOYSA-N 466.494 5.007 5 20 JKBD CN(C)S(=O)(=O)c1ccc(-c2csc(NC(=O)c3cc4ccccc4c4cccnc34)n2)cc1 515282940 XKSOWMYTQCGWSB-UHFFFAOYSA-N 488.594 5.014 5 20 JKBD CN(C(=O)c1ccc(NC(=O)CCOc2ccccc2[N+](=O)[O-])cc1Cl)C1CCCCC1 515620026 ADPXBQZTICOHTF-UHFFFAOYSA-N 459.930 5.061 5 20 JKBD COc1ccc(Oc2ccc([N+](=O)[O-])cc2C(=O)Nc2ccc(C(=O)NC(C)C)c(C)c2)cc1 518185019 NRSJYEADODTUAL-UHFFFAOYSA-N 463.490 5.095 5 20 JKBD CC(C)N1CCC[C@H](CNC(=O)c2ccccc2Sc2ccc(C(F)(F)F)cc2[N+](=O)[O-])C1 520151207 FLRFOXNCJMFNRI-MRXNPFEDSA-N 481.540 5.615 5 20 JKBD O=[N+]([O-])c1ccc(-c2ccc(CNCc3csc(-c4ccccc4)n3)o2)c(Br)c1 520204210 UUZZCIUHLSVRDG-UHFFFAOYSA-N 470.348 6.031 5 20 JKBD COc1ccc(NC(=O)c2ccc(Cl)cc2[N+](=O)[O-])cc1OCc1ccc2ccccc2n1 524413427 FFQITPQKYPAQMJ-UHFFFAOYSA-N 463.877 5.636 5 20 JKBD COc1cc(C(=O)N[C@H](c2ccccc2)c2ccc(Cl)c(Cl)c2)c([N+](=O)[O-])cc1OC(F)F 604006506 IUCATXXYDCZUNJ-HXUWFJFHSA-N 497.281 6.031 5 20 JKBD C[C@H](Nc1ccc(C(=O)N2CCC(CN(C)Cc3ccccc3)CC2)cc1[N+](=O)[O-])c1ccccn1 608964763 XVSQQUUZXSNNCX-NRFANRHFSA-N 487.604 5.147 5 20 JKBD CSCCc1ccc(N[C@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2ccccc2)cc1 609041521 JJWHDLBNFXNUSN-QFIPXVFZSA-N 455.967 5.946 5 20 JKBD O=C(COc1ccc([N+](=O)[O-])c(F)c1)Nc1ccc(NC(=O)c2ccccc2F)cc1C(F)(F)F 745765822 LIMRUYRDCPVLPK-UHFFFAOYSA-N 495.360 5.162 5 20 JKBD Cc1csc(Sc2ccc(NC(=O)c3cc([N+](=O)[O-])ccc3Br)cc2)n1 751093371 HQTQYZIEQVXNFQ-UHFFFAOYSA-N 450.339 5.526 5 20 JKBD COC1(c2noc(C/C(=C\c3ccc([N+](=O)[O-])cc3)c3nc4ccccc4s3)n2)CCCC1 904832792 BHKNOOGCBHSBKW-SAPNQHFASA-N 462.531 5.787 5 20 JKBD COCc1ccccc1C(=O)O[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Br)c1ccccc1 914807255 JMMFQVAPDRKZDX-NRFANRHFSA-N 499.317 5.041 5 20 JKBD CC[C@@H](C)N1C(=O)N[C@H](c2ccc([N+](=O)[O-])cc2)C(C(=O)Nc2ccccc2C(F)(F)F)=C1C 916169722 HGVVTFYISMSBQT-ZUOKHONESA-N 476.455 5.391 5 20 JKBD O=C(Cn1c2ccccc2c(=O)c2ccccc21)OCC(=O)c1ccc2c(c1)Cc1ccccc1-2 919056153 WLOWKTGIGSLLGZ-UHFFFAOYSA-N 459.501 5.152 5 20 JKBD Cc1nc(C(=O)NC2(c3ccc(NC(=O)c4cc(Cl)cc([N+](=O)[O-])c4C)cc3)CCC2)cs1 1790773705 GBVRHENVZIPCTO-UHFFFAOYSA-N 484.965 5.383 5 20 JKBD CC/C=C(\C)C(=O)NC1(c2ccc(NC(=O)CSc3ccccc3[N+](=O)[O-])cc2)CCC1 1791522895 DLGBSCDRQOSGON-REZTVBANSA-N 453.564 5.177 5 20 JKBD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)Cc1ccc2ccccc2c1)c1cc2cc([N+](=O)[O-])ccc2s1 1795541313 LKPDYMQDSLXPDP-NUNAXRQHSA-N 499.592 5.457 5 20 JKBD Cc1cccc(C(=O)N2CCCC3(CCN(C(=O)C4(c5cccc([N+](=O)[O-])c5)CCC4)CC3)C2)c1F 1805075736 KJBWTEZCVAVPNS-UHFFFAOYSA-N 493.579 5.009 5 20 JKBD O=C(Nc1cc([C@H]2CCCCN2C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)[nH]n1)[C@@H]1CC=CCC1 1814793223 ZQYXLEQOHXUEPN-DNVCBOLYSA-N 479.562 5.195 5 20 JKBD Cc1cscc1C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cc3cc([N+](=O)[O-])ccc3s2)n[nH]1 1821609636 JOEXVAPIPUPQGY-GOSISDBHSA-N 495.586 5.522 5 20 JKBD Cc1cc(CCCC(=O)N2CCC([C@@H]3CCCCN3C(=O)CC(C)C)CC2)c([N+](=O)[O-])cc1F 1826340383 ULEHKEFDAYASJJ-QHCPKHFHSA-N 475.605 5.031 5 20 JKBD O=C(Oc1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2Cl)cc1)c1ccc(Br)cc1F 15605095 ACTFPXJUVNYPNM-UHFFFAOYSA-N 493.672 5.621 5 20 JKBD C[C@@H](OC(=O)CSc1cc(Cl)ccc1Cl)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 17527817 DPXBMICIXHJAID-SNVBAGLBSA-N 454.291 5.348 5 20 JKBD O=C(Nc1ccccc1C(=O)OCc1cc(-c2ccccc2)on1)c1ccc([N+](=O)[O-])cc1Cl 18980626 SECJDISNLGVBHA-UHFFFAOYSA-N 477.860 5.513 5 20 JKBD C[C@H](N[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Br)c1ccccc1)c1ccccc1 21818283 UUJNCBDMTOURNE-BTYIYWSLSA-N 454.324 5.388 5 20 JKBD COc1cc(C(=O)N[C@H](c2ccccc2)c2nccn2C)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 23774415 UUIYUYCAKKHDMM-HSZRJFAPSA-N 492.919 5.302 5 20 JKBD Cn1ccnc1[C@@H](NC(=O)c1ccc(NCc2ccccc2Cl)c([N+](=O)[O-])c1)c1ccccc1 23775384 CBYWFTAFQZGCPY-QHCPKHFHSA-N 475.936 5.113 5 20 JKBD Cc1nn(-c2ccc(F)cc2)cc1CN[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1 30511719 FEQIBYRMEUAQHR-DEOSSOPVSA-N 493.926 5.351 5 20 JKBD COc1ccc(-c2nnc(SCc3nc(-c4cccc([N+](=O)[O-])c4)no3)n2-c2ccccc2)cc1 31841169 WKFAIORQYGBJNZ-UHFFFAOYSA-N 486.513 5.193 5 20 JKBD C[C@@H]1CN(C(=O)c2ccccc2NC(=O)c2ccc([N+](=O)[O-])cc2Cl)C[C@H](c2ccccc2)O1 109046426 BYOYAVBTKNTFHZ-WAIKUNEKSA-N 479.920 5.103 5 20 JKBD Cc1sc(NC(=O)c2cccc(NC(=O)c3cccs3)c2)nc1-c1cccc([N+](=O)[O-])c1 195703973 OYLDRYSPZKBIAM-UHFFFAOYSA-N 464.528 5.593 5 20 JKBD COc1cc(/C=C(/Cl)c2nc3scc(-c4cccs4)c3c(=O)[nH]2)cc([N+](=O)[O-])c1O 229928372 QVTIHVMQGZDLGC-VZUCSPMQSA-N 461.908 5.072 5 20 JKBD O=C(Nc1ccc(-c2cnco2)cc1)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 487532424 FLDJVUPCVNUNGZ-UHFFFAOYSA-N 460.412 5.124 5 20 JKBD C[C@H]1C[C@H](C)CN(c2ccc(C(=O)Nc3ccc(CS(=O)(=O)C(C)(C)C)cc3)cc2[N+](=O)[O-])C1 497781513 GWJNLZYKVZPUIQ-ROUUACIJSA-N 487.622 5.043 5 20 JKBD CSc1ccc(Cl)cc1NC(=O)N[C@H](CC(=O)OC(C)C)c1ccccc1[N+](=O)[O-] 520437510 UQMDFGHPYNBPNA-OAHLLOKOSA-N 451.932 5.175 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Cl)[C@H](NC[C@@H]1CCOc2ccccc21)c1ccccc1 521774359 LUHCISREQLSIAS-GAJHUEQPSA-N 451.910 5.084 5 20 JKBD Cc1sc(C(=O)Nc2nc3cc(C(F)(F)F)ccc3n2Cc2ccco2)cc1[N+](=O)[O-] 603507077 UNWHNBDESGSICA-UHFFFAOYSA-N 450.398 5.227 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Cl)[C@H](NCc1cc(Br)ccc1F)c1ccccc1 603632183 OVVWCJSOOLLPLV-HXUWFJFHSA-N 492.732 5.619 5 20 JKBD CCOC(=O)C[C@H](c1ccccc1)C1CCN(C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)CC1 603830204 QBUJWTJHUAXKJO-LJQANCHMSA-N 459.930 5.229 5 20 JKBD CCc1nc2cc(N[C@@H](C(=O)Nc3ccc([N+](=O)[O-])cc3Br)c3ccccc3)ccc2o1 604048223 XUORHSPEXZVWFZ-JOCHJYFZSA-N 495.333 5.853 5 20 JKBD C[C@H](Nc1ccc(NC(=O)c2ccco2)c(Cl)c1)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 604127258 OYSYGGWKEJXDSQ-NSHDSACASA-N 496.829 5.551 5 20 JKBD CCOc1ccc(NC(=O)c2ccc(N[C@@H](C)c3ccccn3)c([N+](=O)[O-])c2)cc1OCC 604295063 DXVVFWZDMBCIBF-INIZCTEOSA-N 450.495 5.213 5 20 JKBD O=C(c1c2c(nc3ccccc13)/C(=C\c1cccc([N+](=O)[O-])c1)CCC2)N1CCC[C@@H](c2cc[nH]n2)C1 608813475 XEMVNURNRNJHBW-OYQOIYBLSA-N 493.567 5.763 5 20 JKBD C[C@H](NCc1ccc(-c2ccccc2[N+](=O)[O-])o1)c1cc2c(cc1Br)OCCO2 608836399 CEGMBUZFGLIVLJ-ZDUSSCGKSA-N 459.296 5.239 5 20 JKBD O=C(N[C@H](c1ccccc1)c1ccc2nc(C(F)(F)F)[nH]c2c1)c1c[nH]c2ccc([N+](=O)[O-])cc12 608853176 QOBCYLCFVYYXLP-OAQYLSRUSA-N 479.418 5.491 5 20 JKBD O=C(c1cc(NC2CCN(Cc3ccc(Cl)c(Cl)c3)CC2)ccc1[N+](=O)[O-])N1CCCC1 609431191 FSICMWZUBFZFPU-UHFFFAOYSA-N 477.392 5.214 5 20 JKBD CCOc1ccc(NC(=O)CNc2ccccc2NC23CC4CC(CC(C4)C2)C3)c([N+](=O)[O-])c1 726185998 ROEXSMSXAGPTLE-UHFFFAOYSA-N 464.566 5.425 5 20 JKBD CC1CCN(c2ccc([N+](=O)[O-])cc2C(=O)N2CCC(=C3C(=O)Nc4cc(Cl)ccc43)CC2)CC1 726378540 VJYTUYRZLJXMKJ-UHFFFAOYSA-N 494.979 5.126 5 20 JKBD C[C@@H](NCc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1)C(=O)Nc1cccc(N2CCCC2)c1 726605455 DLJRICJQQCHDGS-MRXNPFEDSA-N 468.941 5.225 5 20 JKBD Cc1cc(Cc2cnc(NC(=O)c3cc(F)c(F)cc3[N+](=O)[O-])s2)ccc1Br 727709001 PRHXUPAZDYOSSN-UHFFFAOYSA-N 468.279 5.244 5 20 JKBD Cc1nn(Cc2ccc(C(=O)Nc3ccccc3NC(=O)OC(C)(C)C)cc2)c(C)c1[N+](=O)[O-] 727805432 LOLICLWCXBXOKN-UHFFFAOYSA-N 465.510 5.056 5 20 JKBD COc1cc(C(=O)O[C@@H](C)c2ccc(C(F)(F)F)cc2)c([N+](=O)[O-])cc1OCc1cscn1 728334075 MNRJFTOFASOAPU-LBPRGKRZSA-N 482.436 5.576 5 20 JKBD CC(C)Oc1ccccc1CC(=O)Oc1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2Cl)cc1 748604191 DIDGWXCFLDECPQ-UHFFFAOYSA-N 468.893 5.436 5 20 JKBD CCOc1cc([C@@H](C[N+](=O)[O-])c2c[nH]c3ccccc23)ccc1OS(=O)(=O)Cc1ccc(F)cc1 824981338 SBGPHWIYXXFGAG-JOCHJYFZSA-N 498.532 5.023 5 20 JKBD Cn1c(C(=O)O[C@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2ccccc2)cc(Cl)c1Cl 914614557 KUCVVWYQUTWRGV-KRWDZBQOSA-N 482.707 5.430 5 20 JKBD Cc1cc(NC(=O)c2cccc(F)c2)sc1C(=O)O[C@@H](C)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 915592839 VQFCUHXBZVGRFS-ZDUSSCGKSA-N 496.476 5.324 5 20 JKBD COc1ccc(/C=C(/Cl)c2nc(=O)c3ccccc3[nH]2)cc1OCc1ccc([N+](=O)[O-])cc1 917036722 NJIKSLZSXVQXQN-XDHOZWIPSA-N 463.877 5.156 5 20 JKBD CCOc1cc(-c2ccccc2)sc1C(=O)O[C@@H](C)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 919452362 SQHFJINHLUAGME-AWEZNQCLSA-N 465.487 5.690 5 20 JKBD CC(C)(C)Oc1ccc(C(=O)Nc2ccc(C3(NC(=O)c4ccc([N+](=O)[O-])[nH]4)CCC3)cc2)cc1 1790685688 QZVQPWJECDPXJR-UHFFFAOYSA-N 476.533 5.162 5 20 JKBD O=C(NC1(c2ccc(NC(=O)[C@H]3C[C@@]3(F)Cl)cc2)CCC1)c1cc2cc([N+](=O)[O-])ccc2s1 1791675831 AXYLZYRJPAOCFG-HXOBKFHXSA-N 487.940 5.482 5 20 JKBD CC(C)[C@@H](C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc([N+](=O)[O-])cc1F)c1ccc(Cl)cc1 1800352485 LFASCIRGKYYIOH-ISJRUSPKSA-N 487.959 5.079 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2ccc(Cl)cc2)n[nH]1 1820563537 JTWWZWAJEJLKBH-IBGZPJMESA-N 485.903 5.039 5 20 JKBD Cc1c(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)[C@H](F)c3ccccc3)[nH]n2)cc(Cl)cc1[N+](=O)[O-] 1821289761 KPIZQYMKHPDTOO-SIKLNZKXSA-N 499.930 5.296 5 20 JKBD O=C(Nc1cc([C@H]2CCCCN2C(=O)[C@@H]2CC=CCC2)[nH]n1)c1cc2cc([N+](=O)[O-])ccc2s1 1821610871 IYCJZDSHJCYJND-DNVCBOLYSA-N 479.562 5.195 5 20 JKBD CCCCC[C@H](C)C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cc([N+](=O)[O-])ccc2N(C)C)CC1 1830766885 SLLYICQKHWRAGS-RDPSFJRHSA-N 486.657 5.111 5 20 JKBD C[C@@H](Sc1nnc(-c2ccccc2F)n1Cc1ccccc1)C(=O)Nc1ccccc1[N+](=O)[O-] 9331083 BBDMNVUIMWSKGH-MRXNPFEDSA-N 477.521 5.160 5 20 JKBD Cc1cccc([N+](=O)[O-])c1NC(=O)CSc1nnc(Cc2ccccc2)n1-c1ccc(Cl)cc1 9570497 ZQLUVPMQJGXJDY-UHFFFAOYSA-N 493.976 5.459 5 20 JKBD CC(C)c1ccc(-c2csc(NC(=O)c3ccc(S(C)(=O)=O)c([N+](=O)[O-])c3)n2)c(C(C)C)c1 14345526 ITVQJIAGHUUMMK-UHFFFAOYSA-N 487.603 5.621 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Cl)[C@H](NCCc1ccc(OC(F)F)cc1)c1ccccc1 15502192 XUMCFXQJNIBDBD-OAQYLSRUSA-N 475.879 5.362 5 20 JKBD Cc1[nH]c2ccccc2c1C(=O)COC(=O)c1ccccc1NC(=O)c1ccc([N+](=O)[O-])cc1Cl 21119842 AORBMPACFXYROC-UHFFFAOYSA-N 491.887 5.330 5 20 JKBD Cc1occc1-c1nnc(SCC(=O)Nc2ccc(Cl)cc2[N+](=O)[O-])n1-c1ccccc1 22033445 JULGLERQGOBRRI-UHFFFAOYSA-N 469.910 5.128 5 20 JKBD O=C(c1ccccc1[N+](=O)[O-])N(C[C@H]1CCCO1)c1nc(-c2cccc(C(F)(F)F)c2)cs1 26131579 LXGWBVWOIXOGQO-MRXNPFEDSA-N 477.464 5.563 5 20 JKBD COc1cc([C@H](C)NC(=O)C2CCN(c3ccccc3[N+](=O)[O-])CC2)ccc1OC1CCCC1 107881723 HDTVLSSFMPKBFZ-SFHVURJKSA-N 467.566 5.019 5 20 JKBD O=C(Nc1ccc(CNCc2ccc(Oc3ccccc3Cl)c([N+](=O)[O-])c2)cc1)c1ccco1 218161280 IXWBJFRZSNGAEU-UHFFFAOYSA-N 477.904 6.176 5 20 JKBD CC(C)(C)[C@H](NC(=O)CCCn1c(=O)oc2cc([N+](=O)[O-])ccc21)c1cccc(C(F)(F)F)c1 303172595 RTWAGXBFCOYNOM-HXUWFJFHSA-N 479.455 5.205 5 20 JKBD C[C@H](Oc1cccc(Cl)c1Cl)C(=O)N(Cc1ccccc1[N+](=O)[O-])CC(F)(F)F 486065318 ANJZFPGOVFUYAQ-NSHDSACASA-N 451.228 5.260 5 20 JKBD COc1ccc(Oc2ccc([N+](=O)[O-])cc2C(=O)Nc2cccc(OCc3cscn3)c2)cc1 504989688 ZDFARZVXXFCGPN-UHFFFAOYSA-N 477.498 5.684 5 20 JKBD CCn1c(S[C@@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2C(F)(F)F)nnc1-c1cccc(C)c1 515302410 VSDGOOYDCMDVID-ZDUSSCGKSA-N 479.484 5.320 5 20 JKBD COc1ccc([C@H]2Nc3cc(Cl)ccc3C(=O)N2C)cc1OCc1ccc([N+](=O)[O-])cc1 515598104 WMORZIAKGRMMKS-QFIPXVFZSA-N 453.882 5.032 5 20 JKBD CC[C@H](NC(=O)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])c(OC)c1)c1nnc2n1CCCCC2 518123525 IHHAXMSEHLGYAT-KRWDZBQOSA-N 499.955 5.248 5 20 JKBD Cc1cc(C)n([C@@H](C)C(=O)Nc2ccc(NC(=O)N[C@@H](C)c3cccc([N+](=O)[O-])c3)cc2Cl)n1 519501101 HNXILQBFYKVZEC-HOTGVXAUSA-N 484.944 5.144 5 20 JKBD Cc1ccc(NC(=O)c2ccccc2)cc1NC(=O)c1ccc(Cn2nc(C)c([N+](=O)[O-])c2C)cc1 603774376 SCBKLTSGEGLWME-UHFFFAOYSA-N 483.528 5.269 5 20 JKBD COc1ccc(-c2nc(C)c(C(=O)Nc3nc(-c4ccc(C)c([N+](=O)[O-])c4)cs3)s2)cc1OC 619729641 RDVZXDKXSODIFS-UHFFFAOYSA-N 496.570 5.728 5 20 JKBD COc1cc([C@H]2Nc3ccccc3C(=O)N2CC(F)(F)F)ccc1OCc1ccc([N+](=O)[O-])cc1 726875142 NEVRRXOEMMLDTH-QFIPXVFZSA-N 487.434 5.311 5 20 JKBD C[C@H](OC(=O)c1csc(-c2ccc(Cl)c(Cl)c2)n1)C(=O)Nc1ccc([N+](=O)[O-])cc1 744597548 VYPPWFZNXDYXCD-JTQLQIEISA-N 466.302 5.209 5 20 JKBD COc1ccccc1C(=O)Nc1ccc(OC(=O)c2csc(-c3ccc([N+](=O)[O-])cc3)n2)cc1 747624907 HPZPBEOEBHAAHB-UHFFFAOYSA-N 475.482 5.198 5 20 JKBD CCN(C(=O)COC(=O)c1csc(-c2ccc([N+](=O)[O-])cc2)n1)c1cccc2ccccc12 747954771 FWGDGLXEIWPFLS-UHFFFAOYSA-N 461.499 5.081 5 20 JKBD CSc1ccc(C(=O)c2ccccc2C(=O)O[C@@H](C)C(=O)Nc2cccc(C)c2)cc1[N+](=O)[O-] 777422312 VYAZVTGGLDKQDN-INIZCTEOSA-N 478.526 5.040 5 20 JKBD C[C@H](Sc1nnc(-c2ccc(OC(F)F)cc2)o1)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl 849205870 WCSWYCRAENSJDC-VIFPVBQESA-N 470.841 5.019 5 20 JKBD Cc1ccc(N(Cc2nnc(-c3ccccc3)o2)S(=O)(=O)c2ccc(Cl)c([N+](=O)[O-])c2)c(C)c1 849213958 VFDCUOFFQYZFEB-UHFFFAOYSA-N 498.948 5.311 5 20 JKBD Cc1c(NC(=O)[C@H](C)OC(=O)c2csc(-c3ccc(C(C)C)cc3)n2)cccc1[N+](=O)[O-] 900266502 FXSAUBYCTWUZSR-HNNXBMFYSA-N 453.520 5.334 5 20 JKBD CCC(CC)c1cc[n+](/C(C(=S)N[C@H]2C[C@H]3CC[C@H]2C3)=C(/O)c2cccc([N+](=O)[O-])c2)cc1 912845583 VSYUSFYYLBYHOA-NYDSKATKSA-O 466.627 5.775 5 20 JKBD CC(C)c1c(C(=O)O[C@@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)cnn1-c1cccc(Cl)c1 914640847 DACABHKKNHONNL-AWEZNQCLSA-N 481.896 5.525 5 20 JKBD O=C(OCC(=O)N(Cc1ccccc1)c1nc(-c2ccc(F)cc2)cs1)c1ccc([N+](=O)[O-])cc1 916600066 JHNQGZUHESEJLJ-UHFFFAOYSA-N 491.500 5.248 5 20 JKBD O=C(/C=C\c1cnc2ccccc2n1)Nc1cc(Cl)c([N+](=O)[O-])cc1OCc1ccccc1 916827434 ITYCSMZHCJGIPY-KHPPLWFESA-N 460.877 5.422 5 20 JKBD COc1ccc(NC(=O)c2cc(Cl)ccc2[N+](=O)[O-])cc1NC(=O)c1ccc(Cl)cc1F 917787153 HVYABYHKFMIWFH-UHFFFAOYSA-N 478.263 5.554 5 20 JKBD COc1cc(C(=O)Nc2nc(C)c(-c3ccccc3)s2)c([N+](=O)[O-])cc1OCc1cscn1 919966208 AEJRAFLWKGMQTP-UHFFFAOYSA-N 482.543 5.323 5 20 JKBD O=C(Oc1ccc(-c2ccccc2)cc1[N+](=O)[O-])C1CCN(C(=O)c2ccc(Cl)s2)CC1 920330250 WFSXOHVABASZPP-UHFFFAOYSA-N 470.934 5.435 5 20 JKBD C[C@H](Nc1ccc(C(=O)OCc2coc(-c3cccs3)n2)cc1[N+](=O)[O-])c1ccccn1 920543741 IKZTYWUZAWKHNI-AWEZNQCLSA-N 450.476 5.236 5 20 JKBD C[C@H](Nc1ccc(C(=O)OCc2nc(-c3cccc(Cl)c3)no2)cc1[N+](=O)[O-])c1ccccn1 920543802 ANFVRIZKKLUMSB-AWEZNQCLSA-N 479.880 5.223 5 20 JKBD C[C@H](NC(=O)c1ccc(NCc2ccccc2Cl)c([N+](=O)[O-])c1)c1ccc(N2CCOC2=O)cc1 920952426 OCBFNIVJUHGUTJ-INIZCTEOSA-N 494.935 5.308 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)c3cccnc3-c3ccccc3)CCC2)cc1)c1ccc([N+](=O)[O-])o1 1785749018 YBZKWRMCBGJYFN-UHFFFAOYSA-N 482.496 5.311 5 20 JKBD O=C(NC1(c2ccc(NC(=O)c3cccc4cc[nH]c34)cc2)CCC1)c1cc(F)cc([N+](=O)[O-])c1 1789094088 UPWKCIWZZYBBBD-UHFFFAOYSA-N 472.476 5.277 5 20 JKBD CCOc1ccccc1C(=O)Nc1ccc(C2(NC(=O)Cc3cc([N+](=O)[O-])ccc3F)CCC2)cc1 1790239673 AOOYTTDKBTZGOU-UHFFFAOYSA-N 491.519 5.123 5 20 JKBD Cc1ccc(C(=O)Nc2ccc(C3(NC(=O)Cn4ccc5ccc([N+](=O)[O-])cc54)CCC3)cc2)cc1O 1790608925 COQANGZQJFDBIU-UHFFFAOYSA-N 498.539 5.011 5 20 JKBD Cc1ccc(C(=O)N2CCC3(CCCN(C(=O)CCc4cccc([N+](=O)[O-])c4)C3)CC2)cc1Cl 1806486782 XYCHEYPNDKUWNF-UHFFFAOYSA-N 483.996 5.034 5 20 JKBD Cc1cc(C(=O)Nc2cc([C@H]3CCCCN3C(=O)c3cc(Cl)cc([N+](=O)[O-])c3C)[nH]n2)c(C)o1 1816416110 CYTWSRWPBKYRHE-LJQANCHMSA-N 485.928 5.109 5 20 JKBD O=C(Nc1cc([C@@H]2CCCCN2C(=O)CCc2cccc([N+](=O)[O-])c2)[nH]n1)c1c(F)cccc1Cl 1820428896 FDULRJNJXNGWCG-FQEVSTJZSA-N 499.930 5.049 5 20 JKBD O=C(Nc1cc([C@H]2CCCCN2C(=O)CCC2CCC2)[nH]n1)c1cc2cc([N+](=O)[O-])ccc2s1 1821612401 WGDAWMMFYNOSHB-LJQANCHMSA-N 481.578 5.419 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cc3sccc3[nH]2)CC1 1830733584 MXHPCXSYVXHGRD-NRFANRHFSA-N 498.580 5.132 5 20 JKBD CCC[C@H]1CC[C@H](C(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3cc(O)cc([N+](=O)[O-])c3)CC2)CC1 1831561114 BBOAWYCXYBUCGK-DZRGJMJISA-N 485.625 5.140 5 20 JKBD CCc1cc2ccccc2c2c1op(N1CCCCC1)oc1c(CC)cc3ccccc3c12 2382215213 MTTWQFICTAYMPK-UHFFFAOYSA-N 455.538 8.843 5 20 JKBD Cc1c(C(=O)N2CCC(c3nc4cc(Cl)ccc4s3)CC2)cc([N+](=O)[O-])cc1[N+](=O)[O-] 10235716 BKSNULPAJRLCMK-UHFFFAOYSA-N 460.899 5.094 5 20 JKBD C[C@@H](Sc1nnc(NCCc2ccccc2)s1)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 10775979 PTCGSYWVKLWEHJ-GFCCVEGCSA-N 497.524 5.239 5 20 JKBD O=C(c1ccccc1[N+](=O)[O-])N(C[C@@H]1CCCO1)c1nc(-c2ccc(Br)cc2)cs1 14819576 FXWNFGHRQCRWHL-INIZCTEOSA-N 488.363 5.307 5 20 JKBD CCCOc1ccccc1NC(=O)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 15998276 UOLGDXGFZAUBLA-UHFFFAOYSA-N 451.445 5.258 5 20 JKBD COc1cc2c(cc1NC(=O)COC(=O)c1cc(SC)ccc1[N+](=O)[O-])oc1ccccc12 16196247 MEXNZBARLAIYDX-UHFFFAOYSA-N 466.471 5.020 5 20 JKBD Cc1ccc(-c2csc3ncnc(SCc4nnc(-c5ccc([N+](=O)[O-])cc5)o4)c23)cc1 29842718 SZOWXBSDUSAVIJ-UHFFFAOYSA-N 461.528 5.917 5 20 JKBD COc1ccc2[nH]cc(C3CCN(C(=O)c4cc([N+](=O)[O-])ccc4N4CCC(C)CC4)CC3)c2c1 108890031 SDCICLBNLCKHHM-UHFFFAOYSA-N 476.577 5.341 5 20 JKBD Cc1ccc(-c2csc(NC(=O)Cc3ccc(OCc4c(C)noc4C)cc3)n2)cc1[N+](=O)[O-] 217145602 CYHPTINKRUYZJU-UHFFFAOYSA-N 478.530 5.392 5 20 JKBD O=C(C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1)N(C1CC1)[C@H]1CCc2ccccc21 303014089 XSDJWQUAKAZYHU-NRFANRHFSA-N 473.495 5.509 5 20 JKBD CC(C)NC(=O)Nc1ccccc1NC(=O)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1 484786119 GQOLESUFILPIDV-UHFFFAOYSA-N 468.897 5.823 5 20 JKBD Cc1nc(CN(C(=O)c2cc(OCC(F)(F)F)ccc2[N+](=O)[O-])c2ccc(F)cc2)cs1 487887846 RELSBGIYHXGISL-UHFFFAOYSA-N 469.416 5.287 5 20 JKBD COc1cc(C(=O)NCc2ccc(-c3ccc4c(c3)CCCO4)cc2)c([N+](=O)[O-])cc1OC(F)F 499445736 XBACBTIJSNQVGE-UHFFFAOYSA-N 484.455 5.127 5 20 JKBD C[C@H](Nc1ccc(C(=O)N(C)Cc2ccccc2-c2ccccc2)cc1[N+](=O)[O-])c1ccccn1 506561480 NPTJNYHYMBTNBU-FQEVSTJZSA-N 466.541 6.102 5 20 JKBD Cc1cc([N+](=O)[O-])ccc1C(=O)Nc1nnc(SCc2c(Cl)cccc2Cl)s1 510930055 FSZBQCAMTDQDJQ-UHFFFAOYSA-N 455.348 5.606 5 20 JKBD COc1cc(C(=O)Nc2c(C)cc(Br)cc2C)c([N+](=O)[O-])cc1OCc1cscn1 512187893 SUONHQMAIXJPCT-UHFFFAOYSA-N 492.351 5.271 5 20 JKBD CCOc1cc(NC(=O)C(=O)N[C@@H](c2ccc(Cl)cc2)C2CCCC2)c([N+](=O)[O-])cc1OCC 517288285 LKBGFBLYKWAPGC-JOCHJYFZSA-N 489.956 5.032 5 20 JKBD COc1ccc([C@@H]2CCCN2C(=O)COc2ccc(-c3ccccc3)cc2[N+](=O)[O-])c(OC)c1 518658534 DDXDYWNUYOSJBQ-QFIPXVFZSA-N 462.502 5.022 5 20 JKBD O=[N+]([O-])c1ccc(-c2nn(-c3ccccc3)cc2CNC[C@H]2CCCO[C@H]2c2ccccc2)cc1 520960603 GGURUZORWOCBBB-LXFBAYGMSA-N 468.557 5.705 5 20 JKBD CC1CCN(c2ccc(C(=O)N3CCC[C@H](c4nc(-c5ccc(F)cc5)no4)C3)cc2[N+](=O)[O-])CC1 522584315 PEWFTALDNZPQRP-FQEVSTJZSA-N 493.539 5.040 5 20 JKBD COc1ccc(CC(=O)N(c2cccc(Cl)c2)c2nc3ccccc3s2)cc1[N+](=O)[O-] 524089518 OPPAVXMFROHWPK-UHFFFAOYSA-N 453.907 5.774 5 20 JKBD Cn1ccnc1-c1cccc(NC(=O)C/C(=C\c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)c1 524328706 YNMXDZCLIDMCGK-HMMYKYKNSA-N 495.564 6.174 5 20 JKBD CCOc1cc([N+](=O)[O-])c(C(=O)Nc2sc3c(c2C(=O)c2cccs2)CCCC3)cc1OC 591355746 QFEMICGCNAZBMP-UHFFFAOYSA-N 486.571 5.487 5 20 JKBD CC(C)(C)c1ccc(C(=O)Nc2ccc(NC(=O)c3ccccc3)cc2C(F)(F)F)cc1[N+](=O)[O-] 603742821 COSJIQDBQCTKDQ-UHFFFAOYSA-N 485.462 6.416 5 20 JKBD O=C(Nc1cccc(Cn2cccnc2=O)c1)c1cc([N+](=O)[O-])ccc1Sc1ccc(Cl)cc1 604119186 RFBYBGNZXBZUSA-UHFFFAOYSA-N 492.944 5.257 5 20 JKBD COc1cc(C(=O)Nc2cccc(-c3nc(C)cs3)c2)c([N+](=O)[O-])cc1OCc1cscn1 608808308 APSWRXZQYJGWRA-UHFFFAOYSA-N 482.543 5.323 5 20 JKBD O=C(Nc1ccccc1-c1cccs1)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 619733229 QAHXAWNFZUJNRD-UHFFFAOYSA-N 475.492 6.197 5 20 JKBD CC(=O)N(c1nc(COC(=O)c2cc3cccc([N+](=O)[O-])c3[nH]2)cs1)c1cccc(C)c1C 728330848 UHHKXKALEGEXNY-UHFFFAOYSA-N 464.503 5.191 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)N(c2ccc(Nc3ccccc3)cc2)C(C)C)cc1SC 728468489 KZMSWDSLRWIYMN-UHFFFAOYSA-N 451.548 6.124 5 20 JKBD O=C(Nc1ccc(OC(=O)[C@@H]2CCCN2Cc2ccccc2)cc1)c1cc([N+](=O)[O-])ccc1Cl 745839214 UWYXUERJGBAJJE-QHCPKHFHSA-N 479.920 5.071 5 20 JKBD CCN(c1ccc(C(=O)O[C@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2C(F)(F)F)cc1)C(C)C 746617962 DBZDLMATCPZOQT-CQSZACIVSA-N 467.444 5.032 5 20 JKBD Cc1ccccc1NC(=O)c1cc2ccccc2cc1OS(=O)(=O)c1cccc([N+](=O)[O-])c1 748805496 DSCCVGHVLAHEPF-UHFFFAOYSA-N 462.483 5.076 5 20 JKBD Cc1noc2nc(C3CC3)cc(C(=O)Nc3cc(Cl)c([N+](=O)[O-])cc3OCc3ccccc3)c12 836498939 OFPGYZZIMHPYAK-UHFFFAOYSA-N 478.892 5.802 5 20 JKBD COc1cc(NCc2ccc(Cl)cc2[N+](=O)[O-])c(C(=O)N2[C@@H](C)CCC[C@H]2C)cc1OC 864003278 HSOIEPMUDCZOHE-GASCZTMLSA-N 461.946 5.281 5 20 JKBD Cc1ccc(-c2cc(C(=O)Oc3ccc(NC(=O)c4cc([N+](=O)[O-])ccc4Cl)cc3)n[nH]2)o1 916950740 BKBIKEMQYWSXEN-UHFFFAOYSA-N 466.837 5.011 5 20 JKBD CC(C)c1ccc(C(=O)Nc2sccc2C(=O)OCc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)cc1 919399552 DWFRCGSKYSGMKH-UHFFFAOYSA-N 492.513 5.439 5 20 JKBD CC(=O)N(c1ccc(C(F)(F)F)cc1)c1nc(COC(=O)c2ccc([N+](=O)[O-])cc2Cl)cs1 920497466 KABCVCLRYXSXKR-UHFFFAOYSA-N 499.854 5.765 5 20 JKBD COc1ccc(NC(=O)[C@H](C)OC(=O)c2csc(-c3ccc(Cl)cc3Cl)n2)c([N+](=O)[O-])c1 921225938 XIIWWAKOXIJSKZ-JTQLQIEISA-N 496.328 5.218 5 20 JKBD COc1cc(CN2CCc3c(ncn3CCc3ccccc3)C2)ccc1OCc1ccc([N+](=O)[O-])cc1 929067584 SPVXGSNYAHZDSY-UHFFFAOYSA-N 498.583 5.180 5 20 JKBD O=C(/C=C/c1cc2ccccc2o1)NC1(c2ccc(NC(=O)c3ccc([N+](=O)[O-])o3)cc2)CCC1 1785750671 MFYDOFWJHFJNCW-ZRDIBKRKSA-N 471.469 5.395 5 20 JKBD COc1cc(F)c(C(=O)NC2(c3ccc(NC(=O)c4cc(F)cc([N+](=O)[O-])c4)cc3)CCC2)c(F)c1 1790699517 VGEYKDRQOKOLBQ-UHFFFAOYSA-N 499.445 5.082 5 20 JKBD O=C(CCC1CCC1)NC[C@@H]1CCN(C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)[C@H]1c1cccnc1 1803377064 BAVKMMLZGYQOJR-DFBJGRDBSA-N 492.601 5.104 5 20 JKBD C[C@H](C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2ccc([N+](=O)[O-])cc2F)[nH]n1)c1ccc(Cl)cc1 1814660667 MZWXRAXVKPAUHI-QKKBWIMNSA-N 499.930 5.220 5 20 JKBD CCC[C@H]1CC[C@H](C(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3ccc(O)c([N+](=O)[O-])c3)CC2)CC1 1831562576 UKJXHVTXKNARDK-KJXAQDMKSA-N 485.625 5.140 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)N1CCC([C@@H]2CCCCN2C(=O)CCc2ccc(F)cc2)CC1 1831689965 BJCRPNKEFYNGDX-DEOSSOPVSA-N 499.558 5.048 5 20 JKBD COc1ccc(NC(=O)[C@H](C)Sc2ncnc3sc(-c4ccccc4)cc23)c([N+](=O)[O-])c1 16763171 RKDOQLYVDHQYHA-ZDUSSCGKSA-N 466.544 5.394 5 20 JKBD CC(=O)CCc1ccc2oc(C(=O)O[C@H](C)c3nnc(-c4ccc([N+](=O)[O-])cc4)o3)c(C)c2c1 17662584 MLYJWWJRPFWROQ-OAHLLOKOSA-N 463.446 5.139 5 20 JKBD CCSc1nnc(S[C@H](C(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)c2ccccc2)s1 22041959 ZISWETIQJMFUKN-HNNXBMFYSA-N 466.997 5.684 5 20 JKBD CCc1ccccc1NC(=O)[C@H](C)OC(=O)c1ccc(Sc2nc(C)cs2)c([N+](=O)[O-])c1 23968919 GRKKSBJKHQUDIP-AWEZNQCLSA-N 471.560 5.257 5 20 JKBD O=C(Nc1cccc(NC(=O)c2cc([N+](=O)[O-])ccc2NCc2ccccc2)c1)c1cccs1 24033303 SSJIKVBGJAOYHF-UHFFFAOYSA-N 472.526 5.773 5 20 JKBD C[C@@H](c1ccccc1)n1c(SCC(=O)Nc2cc([N+](=O)[O-])ccc2Cl)nc2ccccc2c1=O 28831037 NMZHHIHETXAWGA-HNNXBMFYSA-N 494.960 5.298 5 20 JKBD C[C@H](c1nc2ccccc2s1)N(C)C(=O)Cc1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1 32341867 BMFNLRHQWYLWMA-GOSISDBHSA-N 497.580 5.819 5 20 JKBD O=C(C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1)N1CCC[C@@H]1c1cccc2ccccc12 72024368 BGANZORFSXZVTI-HSZRJFAPSA-N 497.517 6.347 5 20 JKBD O=C(Cc1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1)N1CCC(OCc2ccccc2)CC1 105307424 VDHKZXRUJUEOCX-UHFFFAOYSA-N 496.567 5.198 5 20 JKBD C[C@@H](Nc1ccc(C(=O)Nc2ccc(Oc3ccc(F)cc3)nc2)cc1[N+](=O)[O-])c1ccccn1 108862785 URRAEMOQCLZAET-MRXNPFEDSA-N 473.464 5.742 5 20 JKBD O=C(c1cc(NC[C@@H](c2ccccc2)N2CCc3sccc3C2)ccc1[N+](=O)[O-])N1CCCC1 302953115 KOVDNWKWZIVLBO-DEOSSOPVSA-N 476.602 5.104 5 20 JKBD COc1cc([C@@H](C)NC(=O)c2ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])cc2)cc(OC)c1OC 482490293 TTWZXDUNFPRJIN-CQSZACIVSA-N 486.908 5.557 5 20 JKBD Cc1nn(-c2ccc(C(=O)N(Cc3ccccc3[N+](=O)[O-])CC(F)(F)F)cc2)c(C)c1Cl 486126958 YSPPMIRQHGFWSG-UHFFFAOYSA-N 466.847 5.255 5 20 JKBD COc1ccc(CNCc2ccc(OCc3ccc([N+](=O)[O-])cc3)c(OC)c2)cc1Br 508060632 IBHTUYBJBXVSDP-UHFFFAOYSA-N 487.350 5.243 5 20 JKBD Cc1sc(NC(=O)C2(c3ccc(Cl)cc3)CCOCC2)nc1-c1cccc([N+](=O)[O-])c1 512312411 HDDGDBPHBGHHJR-UHFFFAOYSA-N 457.939 5.367 5 20 JKBD O=C(NCc1cccc(NC(=O)N2CCCC2)c1)c1cc([N+](=O)[O-])ccc1Sc1ccccc1 512583213 RAGMQXZHULMXIO-UHFFFAOYSA-N 476.558 5.304 5 20 JKBD COc1cc(C(=O)N(C)[C@@H](C)c2cc3ccccc3o2)c([N+](=O)[O-])cc1OCc1cscn1 512668554 MFFIFFQCSQEMMU-AWEZNQCLSA-N 467.503 5.218 5 20 JKBD CN(CCCCCc1cc(-c2ccccc2)n[nH]1)C(=O)C1CCN(c2ccccc2[N+](=O)[O-])CC1 517105213 IYZQMXRVVGGECK-UHFFFAOYSA-N 475.593 5.073 5 20 JKBD Cc1ccc(C(N)=O)cc1NC(=O)c1c2c(nc3ccccc13)/C(=C/c1cccc([N+](=O)[O-])c1)CCC2 521810175 RVIILHJTHQNEEB-XMHGGMMESA-N 492.535 5.680 5 20 JKBD C[C@H](CCO)n1c(C(F)(F)F)nc2cc(NCc3ccc(C(F)(F)F)cc3[N+](=O)[O-])ccc21 600860666 MPXLNWMNBMAPSP-LLVKDONJSA-N 476.377 5.538 5 20 JKBD O=C(C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)N[C@@H]1CCCc2nc(O)ccc21 603461320 SZIILQGPXJKVLA-PVGBUVFQSA-N 486.553 5.430 5 20 JKBD COc1cc(C(=O)N(C)Cc2nc3ccccc3[nH]2)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 603502640 XCJRLZGMSYBRJK-UHFFFAOYSA-N 466.881 5.198 5 20 JKBD O=C(NCc1ccc(Oc2ccc(Oc3ccccc3)cc2)nc1)c1cc2c(cc1[N+](=O)[O-])OCO2 603986484 CGKZXHRVDLDHSF-UHFFFAOYSA-N 485.452 5.233 5 20 JKBD CCOc1cc(Br)c(NC(=O)[C@H](C)Oc2ccc(Cl)cc2[N+](=O)[O-])cc1OCC 604443817 PXDWUSFEFWEYOD-NSHDSACASA-N 487.734 5.214 5 20 JKBD C[C@@H](c1cccs1)N(C)C(=O)c1ccc(C(=O)N(C)[C@H](C)c2cccs2)cc1[N+](=O)[O-] 609044968 XLOVENPDRXIFEK-CABCVRRESA-N 457.577 5.384 5 20 JKBD C[C@H](N[C@@H](C)c1cc(F)c(Cl)cc1Cl)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 610246674 UMFRPCUKCYAMNU-IUCAKERBSA-N 468.234 5.737 5 20 JKBD O=C(Nc1nc(-c2ccccc2)c(C(=O)c2ccccc2)s1)c1cc(F)c(F)cc1[N+](=O)[O-] 727707142 HVAMDBGQTCBCTN-UHFFFAOYSA-N 465.437 5.480 5 20 JKBD Cc1ccc(C(=O)Nc2cccc(C(F)(F)F)c2)cc1NC(=O)c1cc(F)c(F)cc1[N+](=O)[O-] 727710607 RYJWCHLADKTAPZ-UHFFFAOYSA-N 479.361 5.705 5 20 JKBD Cc1ccc(C(=O)c2ccccc2C(=O)O[C@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)cc1C 800441365 NQSMUBIBBPWGHX-MRXNPFEDSA-N 480.904 5.280 5 20 JKBD COc1cccc(/C=C(\CC(=O)Nc2cc([N+](=O)[O-])c(F)cc2F)c2nc3ccccc3s2)c1 897464706 PPVDJMTXJIUSMN-OQLLNIDSSA-N 481.480 6.061 5 20 JKBD CC1=C(C(=O)Nc2ccc(F)cc2)[C@H](c2cc([N+](=O)[O-])c(F)cc2F)NC(=S)N1c1ccccc1 916723083 GCWHLVWBSMJNHA-QFIPXVFZSA-N 498.486 5.361 5 20 JKBD C[C@@H](OC(=O)c1cc(C2CC2)nc2ccccc12)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 917239652 XDKAMVUVCOKNCK-GFCCVEGCSA-N 473.407 5.223 5 20 JKBD O=C(C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)Nc1ccc2oc(=O)ccc2c1 918670310 JIPNCIBTSDZLBO-AQTBWJFISA-N 483.505 5.880 5 20 JKBD CC(=O)Nc1cc(C(=O)O[C@@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2ccccc2)ccc1C 919177474 RYXLUNGDERFEAX-JOCHJYFZSA-N 481.892 5.052 5 20 JKBD CC(=O)N(c1ccc(Cl)c(Cl)c1)c1nc(COC(=O)c2cc([N+](=O)[O-])ccc2F)cs1 919251347 AVEGHTSVCCWQAZ-UHFFFAOYSA-N 484.292 5.539 5 20 JKBD C[C@H](Sc1ccc(Br)cc1)C(=O)O[C@@H](C)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 919469420 ZIQBWQDDZLYXKZ-RYUDHWBXSA-N 478.324 5.192 5 20 JKBD O=C(NC1(c2ccc(NC(=O)c3ccc([N+](=O)[O-])o3)cc2)CCC1)c1cc2cc(F)c(F)cc2[nH]1 1785750545 KLISZURHAKATRF-UHFFFAOYSA-N 480.427 5.009 5 20 JKBD COc1cc(C(=O)NC2(c3ccc(NC(=O)/C=C/c4ccsc4)cc3)CCC2)ccc1[N+](=O)[O-] 1786944658 IVGLPQBUQNCWRV-XCVCLJGOSA-N 477.542 5.126 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)[C@@H]3C[C@H]3c3ccccc3)CCC2)cc1)c1cc([N+](=O)[O-])cc2c1OCC2 1790045593 YCYNGHQUQWTDOF-BJKOFHAPSA-N 497.551 5.081 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)c3c[nH]c4cccc(Cl)c34)CCC2)cc1)c1ccc([N+](=O)[O-])[nH]1 1790185583 HKZRYXOGXVQWEB-UHFFFAOYSA-N 477.908 5.119 5 20 JKBD Cc1cc2cccc(C(=O)NC3(c4ccc(NC(=O)c5cc(O)cc([N+](=O)[O-])c5)cc4)CCC3)c2[nH]1 1790756132 NLTWGJXAOWWSQX-UHFFFAOYSA-N 484.512 5.152 5 20 JKBD Cc1cc2[nH]c(C(=O)NC3(c4ccc(NC(=O)c5cc(O)cc([N+](=O)[O-])c5)cc4)CCC3)cc2s1 1790756393 DADKMJWMRXHGKY-UHFFFAOYSA-N 490.541 5.213 5 20 JKBD CC1=CC[C@@H](C(=O)NC2(c3ccc(NC(=O)Cc4ccc([N+](=O)[O-])cc4F)cc3)CCC2)CC1 1791183387 CRZOUBAOIMYZIX-GOSISDBHSA-N 465.525 5.157 5 20 JKBD Cc1cc(O)c([N+](=O)[O-])cc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc2c1oc1ccccc12 1801203542 LYYNWBCBIBCLNI-BCDXTJNWSA-N 499.523 5.074 5 20 JKBD COc1cc(C)c(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)c(C)c1 1801206829 KDSKJNMQMWHHTM-REPLKXPHSA-N 493.585 5.001 5 20 JKBD Cc1ccc2cc(C(=O)Nc3cc([C@H]4CCCCN4C(=O)c4ccc([N+](=O)[O-])o4)[nH]n3)sc2c1 1821525071 MTMWFOSKAPQQDX-MRXNPFEDSA-N 479.518 5.054 5 20 JKBD Cc1c(Cl)cccc1C(=O)N1CCCC[C@H]1C1CCN(C(=O)/C=C/c2ccc([N+](=O)[O-])o2)CC1 1823914265 LANCBUUFYFRZIT-RCHCNPRSSA-N 485.968 5.096 5 20 JKBD CC(C)[C@H](C(=O)N1CCCC[C@H]1C1CCN(C(=O)Cc2cccc([N+](=O)[O-])c2)CC1)c1ccccc1 1824237114 YEJZPVOLVHLDRG-XCZPVHLTSA-N 491.632 5.197 5 20 JKBD Cc1ccsc1C(=O)N1CCCC[C@@H]1C1CCN(C(=O)Cc2ccc(Cl)cc2[N+](=O)[O-])CC1 1825781239 UXAXYJUDLKLMAO-HXUWFJFHSA-N 490.025 5.094 5 20 JKBD Cc1ccc(C(=O)N2CCC([C@H]3CCCCN3C(=O)c3cc4cc([N+](=O)[O-])ccc4s3)CC2)cn1 1831059124 DIXHCEZDUIAALI-JOCHJYFZSA-N 492.601 5.060 5 20 JKBD O=C(c1ccc(Cl)c(F)c1)N1CCC([C@@H]2CCCCN2C(=O)/C=C/c2ccccc2[N+](=O)[O-])CC1 1832903953 IYZKXMNLJGFCCP-NMXNWIABSA-N 499.970 5.334 5 20 JKBD C[C@@H](NC(=O)c1ccccc1NC(=O)Cn1c2ccccc2c(=O)c2ccccc21)c1ccccc1 11250125 SANOWJAZXOQFLV-HXUWFJFHSA-N 475.548 5.284 5 20 JKBD CC(=O)N(c1nc(COC(=O)c2cccc([N+](=O)[O-])c2C)cs1)c1c(C)cc(C)cc1Cl 11397483 LJYWEILXXUCRLU-UHFFFAOYSA-N 473.938 5.672 5 20 JKBD CCOC(=O)C1CCN(C(=O)c2c3c(nc4ccccc24)/C(=C/c2cccc([N+](=O)[O-])c2)CCC3)CC1 14213060 XIGHCFNAFSXAFH-HEHNFIMWSA-N 499.567 5.435 5 20 JKBD C[C@@H](NC(=O)CSc1ccc(C(F)(F)F)cc1[N+](=O)[O-])c1ccccc1OC(F)F 26021177 YLVAXARRKKEDIZ-SNVBAGLBSA-N 450.385 5.185 5 20 JKBD Cc1ccc(NC(=O)C2CC2)cc1NC(=O)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 46893547 BAACIAYENODOFQ-UHFFFAOYSA-N 490.482 5.126 5 20 JKBD Cc1ccc(OC2CCN(C(=O)c3ccc(N[C@@H](C)c4ccccn4)c([N+](=O)[O-])c3)CC2)cc1C 108830524 SUYDVZXAQTZNGG-FQEVSTJZSA-N 474.561 5.463 5 20 JKBD Cc1nc(-c2ccc(NC(=O)Cc3cn(-c4ccccc4)nc3-c3ccc([N+](=O)[O-])cc3)cc2)oc1C 115720391 OJBGUGAZKBTZIV-UHFFFAOYSA-N 493.523 5.901 5 20 JKBD O=C(Nc1cc(C(=O)N2CCCCC2)ccc1Cl)c1csc(-c2cccc([N+](=O)[O-])c2)n1 303174097 SBKXHBSGBVPVMT-UHFFFAOYSA-N 470.938 5.250 5 20 JKBD Cc1ccc2c(c1C)OC[C@H]2N[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1 477031272 HCLPTUIYTGZSLK-YADHBBJMSA-N 451.910 5.268 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)Nc2ccc(CN3C(=O)Cc4ccc(Cl)cc43)cc2)cc1SC 483646422 UDNIUHCNILTTRD-UHFFFAOYSA-N 497.960 5.320 5 20 JKBD CCOc1cc(CN[C@@H](C)c2cc(C)cc(C)c2)ccc1OCc1cc([N+](=O)[O-])cc2c1OCOC2 500477413 VJRYFZPMMAXBME-FQEVSTJZSA-N 492.572 5.907 5 20 JKBD COc1ccccc1-c1nnc(SCC(=O)c2ccc([N+](=O)[O-])cc2)n1CCc1ccccc1 500730476 NCFRLMMGQDGGHK-UHFFFAOYSA-N 474.542 5.080 5 20 JKBD O=C(Nc1ccc(CC(=O)N2CCc3ccccc32)cc1)c1csc(-c2cccc([N+](=O)[O-])c2)n1 501692473 VRXWWUOWERBDQS-UHFFFAOYSA-N 484.537 5.102 5 20 JKBD C[C@@H](Nc1ccc(C(=O)N[C@H](C)c2ccccc2OC(F)F)cc1[N+](=O)[O-])c1ccccn1 506190395 MQKAXNKAXXEFJS-HUUCEWRRSA-N 456.449 5.255 5 20 JKBD CC(C)OC(=O)C[C@@H](NC(=O)Nc1ccccc1OC1CCCC1)c1ccccc1[N+](=O)[O-] 510410489 CFUQMVZRAFXBHB-HXUWFJFHSA-N 455.511 5.121 5 20 JKBD COc1ccc([C@H]2CCCN2C(=O)C/C(=C\c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)cc1 515004957 KTIRXZJFIILAKX-MXTHXHGZSA-N 499.592 6.508 5 20 JKBD CC(C)N(Cc1ccc(Cl)c(Cl)c1)C(=O)C1CCN(c2ccccc2[N+](=O)[O-])CC1 515628585 GXXSOVZRNYBFFS-UHFFFAOYSA-N 450.366 5.555 5 20 JKBD Cc1ccc(Sc2ccc(C(=O)Nc3ccc(-c4nc(=O)cc(C)[nH]4)cc3)cc2[N+](=O)[O-])cc1 523418017 RXHQGBPJDNMGPR-UHFFFAOYSA-N 472.526 5.365 5 20 JKBD C[C@@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)Nc1cc(-c2nnc3n2CCCCC3)ccc1Cl 591557679 GHCCCRKDVMIJOY-CQSZACIVSA-N 471.970 5.352 5 20 JKBD COc1ccc(CSc2nnc(COc3ccccc3F)n2-c2ccccc2)cc1[N+](=O)[O-] 603722339 HDSHBHJHAQLQSQ-UHFFFAOYSA-N 466.494 5.195 5 20 JKBD CSc1nc(-c2ccc(F)cc2)nc(C)c1C(=O)Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1 603749843 BXWLHQYXGLYQSY-UHFFFAOYSA-N 481.534 5.597 5 20 JKBD CC(=O)N(c1ccc(Cl)cc1)c1nc(/C=C(\c2ccncc2)c2ccc([N+](=O)[O-])cc2)cs1 603946000 ZWUWLROQYQOWJO-UCQKPKSFSA-N 476.945 6.373 5 20 JKBD COc1ccc(NC(=O)Nc2ccc([N+](=O)[O-])cc2Cl)cc1NC(=O)c1cccc(F)c1 604427102 WSYXWTAAPCQHHK-UHFFFAOYSA-N 458.833 5.292 5 20 JKBD COCCn1ncc2ccc(NC(=O)c3ccc(Oc4ccc(Cl)cc4[N+](=O)[O-])c(OC)c3)cc21 604457643 JJYHQFVPOBGLCJ-UHFFFAOYSA-N 496.907 5.298 5 20 JKBD CCC[C@@H](NC(=O)c1cc(OC)c(OC(F)F)cc1[N+](=O)[O-])c1ccc(Cl)c(Cl)c1 604498366 VXETZGQTGGLMHV-CQSZACIVSA-N 463.264 5.783 5 20 JKBD COc1ccc(Br)c(NC(=O)c2ccc(Sc3nc(C)cs3)c([N+](=O)[O-])c2)c1 604542995 SQRAFGWPYIFDBU-UHFFFAOYSA-N 480.365 5.534 5 20 JKBD Cc1nn(CCC(=O)N(Cc2ccccc2)c2nc(-c3ccc(F)cc3)cs2)c(C)c1[N+](=O)[O-] 608802323 QKFNDBRRFKCBAF-UHFFFAOYSA-N 479.537 5.294 5 20 JKBD COc1cc(C(=O)NCc2sc(-c3ccccc3)nc2C)c([N+](=O)[O-])cc1OCc1cscn1 608954670 SWBIXWFEXFLMPQ-UHFFFAOYSA-N 496.570 5.001 5 20 JKBD COc1ccc(CC(=O)NC[C@@H](c2ccccc2Cl)c2c[nH]c3ccccc23)cc1[N+](=O)[O-] 609010071 WVLLUFGHXKGTJP-IBGZPJMESA-N 463.921 5.229 5 20 JKBD O=C(O[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1)c1oc2ccccc2c1CO 726017845 OSVCPRYQWNXRMY-NRFANRHFSA-N 480.860 5.024 5 20 JKBD O=C(Nc1cccc(CC[C@@H](O)c2ccccc2)c1)C1CCN(c2ccccc2[N+](=O)[O-])CC1 727760387 ITYUXWYGIGCXKF-AREMUKBSSA-N 459.546 5.116 5 20 JKBD CC(=O)N(c1ccc(C)c(C)c1)c1nc(COC(=O)c2c(Cl)cccc2[N+](=O)[O-])cs1 730642365 CXVNRVKAXGNNTE-UHFFFAOYSA-N 459.911 5.363 5 20 JKBD COc1cc(C(=O)Nc2ccc(N3CCCC3)c(Cl)c2)c([N+](=O)[O-])cc1OCc1cscn1 730839592 MIASDYUUMYJOPL-UHFFFAOYSA-N 488.953 5.145 5 20 JKBD CCN(CCc1ccccn1)C(=O)c1cc([N+](=O)[O-])ccc1N1CCC(Cc2ccccc2)CC1 746832156 GZHUWTHLSSCKTR-UHFFFAOYSA-N 472.589 5.154 5 20 JKBD Cc1cc(C(=O)[C@H](C)OC(=O)c2csc(-c3ccc([N+](=O)[O-])cc3)n2)c(C)n1Cc1ccco1 747954654 CMXOMVWICLQTQL-INIZCTEOSA-N 479.514 5.206 5 20 JKBD COc1ccc(-c2cc3[nH]c(/C(Cl)=C/c4ccc([N+](=O)[O-])c(O)c4)nc(=O)c3s2)cc1 748146553 JYANTNCBDPDZLF-ZSOIEALJSA-N 455.879 5.011 5 20 JKBD CC1CCN(c2ccc([N+](=O)[O-])cc2C(=O)NC2C[C@@H](C(F)(F)F)C[C@H](C(F)(F)F)C2)CC1 914743482 AMXSINVTGWDUTE-KBPBESRZSA-N 481.437 5.470 5 20 JKBD Cc1cccc(NC(=O)c2ccccc2NC(=O)c2ccc(N[C@@H](C)c3ccccn3)c([N+](=O)[O-])c2)c1 919680152 AMWDQJHMIFUCSX-IBGZPJMESA-N 495.539 5.976 5 20 JKBD O=C(NCC1(c2cccc(C(F)(F)F)c2)CCOCC1)c1cc([N+](=O)[O-])ccc1N1CCCCC1 920010023 OTHUFECQWCBLBN-UHFFFAOYSA-N 491.510 5.082 5 20 JKBD COc1ccc(-c2[nH]c3ccccc3c2CCC(=O)Nc2cc([N+](=O)[O-])c(F)cc2F)c(OC)c1 920026209 SUAGBPPPYUXTIB-UHFFFAOYSA-N 481.455 5.610 5 20 JKBD C[C@H](Nc1ccc(C(=O)OCC(=O)N(C)[C@@H](C)c2ccc(Cl)cc2)cc1[N+](=O)[O-])c1ccccn1 920544226 JUBABFMPHCCPMM-IRXDYDNUSA-N 496.951 5.193 5 20 JKBD C[C@@H](Nc1ccc(C(=O)N(C)c2ccccc2-c2ccccc2)cc1[N+](=O)[O-])c1ccccn1 920819673 JOXTYLDDGFZKER-LJQANCHMSA-N 452.514 6.107 5 20 JKBD O=C(/C=C\c1ccc2ccccc2n1)Oc1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2Cl)cc1 923384523 GTEAYNBAWVDAFS-ZROIWOOFSA-N 473.872 5.668 5 20 JKBD Cc1ccc2oc(C(=O)Nc3ccc(C4(NC(=O)c5ccc([N+](=O)[O-])cc5F)CCC4)cc3)cc2n1 1788322301 JATNZXMEBYJIGU-UHFFFAOYSA-N 488.475 5.245 5 20 JKBD CCCc1onc(C)c1C(=O)NC1(c2ccc(NC(=O)/C=C/c3ccccc3[N+](=O)[O-])cc2)CCC1 1792317672 DCWRIHQZTFZIGH-XNTDXEJSSA-N 488.544 5.305 5 20 JKBD O=C(/C=C/c1ccccc1[N+](=O)[O-])Nc1ccc(C2(NC(=O)c3ccc(C(F)(F)F)[nH]3)CCC2)cc1 1792317834 RHMGQTOTXPUWHS-AWNIVKPZSA-N 498.461 5.403 5 20 JKBD Cc1ccc(CCC(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)cc1F 1801205823 CYMXOESEFINVLA-ACDBMABISA-N 495.576 5.142 5 20 JKBD O=C(Cc1ccccc1Cl)N1CCC([C@H]2CCCCN2C(=O)CCc2cccc([N+](=O)[O-])c2)CC1 1824838427 HTJWNSXXCQSNBK-RUZDIDTESA-N 498.023 5.043 5 20 JKBD Cc1cc(Cl)cc(C(=O)N2CCC([C@H]3CCCCN3C(=O)c3cc(F)cc([N+](=O)[O-])c3)CC2)c1 1830616182 UVXDJFGUKFZWTM-HSZRJFAPSA-N 487.959 5.243 5 20 JKBD C[C@H](NC(=O)c1ccc(NCc2ccccc2)c([N+](=O)[O-])c1)c1nc2ccccc2n1C(F)F 9758841 NUJMEBYPPVMKCI-HNNXBMFYSA-N 465.460 5.443 5 20 JKBD O=C(COC(=O)/C=C/c1ccc([N+](=O)[O-])cc1)Nc1c(Cl)c(Cl)cc(Cl)c1Cl 10757518 ZEGXQVLVDVHEQJ-ZZXKWVIFSA-N 464.088 5.404 5 20 JKBD COc1cc(C(=O)O[C@H](C)C(=O)Nc2ccccc2C)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 10911917 SPPWQAOPHFEXDK-OAHLLOKOSA-N 484.892 5.542 5 20 JKBD Cc1ccc(-n2c(SCC(=O)Nc3c(C)cccc3[N+](=O)[O-])nnc2-c2ccccc2)cc1 11196577 HFYMIIZHZXSCQE-UHFFFAOYSA-N 459.531 5.190 5 20 JKBD Cc1nn(-c2ccccc2)c(C)c1NC(=O)CNc1cc([N+](=O)[O-])ccc1Nc1ccccc1 15333119 IQYQYVFSFMXUIM-UHFFFAOYSA-N 456.506 5.192 5 20 JKBD COc1ccc(OC)c([C@@H](C)N[C@@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2ccccc2)c1 15509381 HFECAMICHKOKOR-IQMFZBJNSA-N 469.925 5.296 5 20 JKBD Cc1c(NC(=O)Cc2ccc(NS(=O)(=O)c3ccc(Cl)c(Cl)c3)cc2)cccc1[N+](=O)[O-] 15790730 RCODIIYJLFYKBL-UHFFFAOYSA-N 494.356 5.192 5 20 JKBD Cc1cccc(-c2nnc([C@H](C)OC(=O)c3ccc(NCc4ccccc4)c([N+](=O)[O-])c3)o2)c1 17656719 VPPMABQFCYWVJD-KRWDZBQOSA-N 458.474 5.483 5 20 JKBD Cc1cc(C)c2c(-n3cccc3)c(C(=O)O[C@H](C)c3nnc(-c4ccc([N+](=O)[O-])cc4)o3)sc2n1 17899373 PDLOPCZTYDXQCL-OAHLLOKOSA-N 489.513 5.580 5 20 JKBD Cc1ccc(C)c(C(=O)COC(=O)c2ccccc2NC(=O)c2ccc([N+](=O)[O-])cc2Cl)c1 21122204 VVZHNGDIOPVXKI-UHFFFAOYSA-N 466.877 5.157 5 20 JKBD Cc1ccsc1CN(C)[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Br)c1ccccc1 21793379 GRVPFSRFAZAEML-HXUWFJFHSA-N 474.380 5.539 5 20 JKBD CCn1c(SCC(=O)c2ccc(NC(=O)C(C)C)cc2)nc2cc3ccccc3cc2c1=O 22178816 XTMCSWWRZVBTKS-UHFFFAOYSA-N 459.571 5.139 5 20 JKBD CC(=O)N(c1nc(COc2ccc([N+](=O)[O-])cc2Cl)cs1)c1c(C)cc(C)cc1Cl 23552384 XBEHRWUNTOTHNW-UHFFFAOYSA-N 466.346 6.239 5 20 JKBD C[C@H](Sc1nnc(-c2ccc(Cl)cc2)n1Cc1ccco1)C(=O)Nc1ccc([N+](=O)[O-])cc1 23600705 DPACRMFKCJEOMV-AWEZNQCLSA-N 483.937 5.267 5 20 JKBD COc1ccccc1NC(=O)COC(=O)c1ccc(Sc2nc3ccccc3s2)c([N+](=O)[O-])c1 26426580 YMPHJYALGMJWIL-UHFFFAOYSA-N 495.538 5.160 5 20 JKBD Cc1cccc(N(Cc2ccccc2)C(=O)c2ccc(Sc3nncn3C)c([N+](=O)[O-])c2)c1 26904177 LZXFBZWFSUVTQT-UHFFFAOYSA-N 459.531 5.030 5 20 JKBD C[C@H](N[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Br)c1ccccc1)c1ccc2c(c1)OCO2 30500880 ZLGHDGIKWHTPBB-FPTDNZKUSA-N 498.333 5.117 5 20 JKBD C[C@@H](NC(=O)Cn1c2ccccc2c(=O)c2ccccc21)c1cccc(NC(=O)c2ccccc2)c1 71898869 JTXHTAIBHBMODH-HXUWFJFHSA-N 475.548 5.284 5 20 JKBD O=C(c1oc2ccccc2c1CSc1ncccn1)N(CC1CC1)c1ccc(Cl)c([N+](=O)[O-])c1 97544016 LOXUBNSILMOZPV-UHFFFAOYSA-N 494.960 6.134 5 20 JKBD C[C@H](CCc1ccc(Br)cc1)NC(=O)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-] 108771825 MOCBFDRDLUGFPY-GFCCVEGCSA-N 475.261 5.050 5 20 JKBD C[C@@H]1CCCN(c2ccc(C(=O)N(Cc3nnc(-c4ccc(Cl)cc4)o3)C3CC3)cc2[N+](=O)[O-])C1 115056695 RIPFQQCLHRZBOI-MRXNPFEDSA-N 495.967 5.339 5 20 JKBD COc1ccc([C@@H](Cc2ccc(F)cc2)NC(=O)c2cc(SC)c(OC)cc2[N+](=O)[O-])cc1 483402603 FPGQKBKZUUPQFQ-HXUWFJFHSA-N 470.522 5.187 5 20 JKBD Cc1onc(-c2ccccc2)c1-c1nnc(CSc2nc3ccccc3c3nc4ccccc4n23)o1 486473788 SJFFBIAYFSMRJW-UHFFFAOYSA-N 490.548 6.341 5 20 JKBD C[C@@H](NC(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccc(NC(=O)Nc2ccccc2)cc1 502670556 QGQFTNMRLYDPKO-CQSZACIVSA-N 453.886 5.775 5 20 JKBD O=C(C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)NCCc1cccc(F)c1 503242339 MFHAOKIYZLAXDR-XMHGGMMESA-N 461.518 5.633 5 20 JKBD Cc1ccc(-c2csc(NC(=O)C3CCC(NC(=O)CC4CCCC4)CC3)n2)cc1[N+](=O)[O-] 508803031 SAWZYLGKDSSZLX-UHFFFAOYSA-N 470.595 5.221 5 20 JKBD C[C@H](NC(=O)Nc1ccc(NC(=O)c2ccc(F)cc2)cc1C(F)(F)F)c1cccc([N+](=O)[O-])c1 509972236 NEMYIZHRPFKPOC-ZDUSSCGKSA-N 490.413 5.888 5 20 JKBD O=C(Nc1cccc(F)c1)c1cccc(NC(=O)c2cc(OCC(F)(F)F)ccc2[N+](=O)[O-])c1 515449308 VCIVMYNMJYEVFU-UHFFFAOYSA-N 477.370 5.180 5 20 JKBD O=C(Nc1cccc(COCc2ccco2)c1)c1ccc(NCc2ccccc2)c([N+](=O)[O-])c1 515823046 YXJWKSMUIRWCOM-UHFFFAOYSA-N 457.486 5.769 5 20 JKBD O=[N+]([O-])c1ccc(-c2ccc(CNCc3ccccc3-n3ccnc3)o2)c(Br)c1 518758638 HHAOREVUAPMQCI-UHFFFAOYSA-N 453.296 5.093 5 20 JKBD C[C@@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)Nc1ccccc1-c1nc2ccccc2s1 520438232 NEUQYCMIHRJCJC-CYBMUJFWSA-N 453.907 5.931 5 20 JKBD O=C(Cc1ccc(NCc2ccc(C(F)(F)F)cc2[N+](=O)[O-])cc1)N1CCc2ccccc21 600854440 RBBPDOUWOSGENK-UHFFFAOYSA-N 455.436 5.358 5 20 JKBD C[C@@H](c1cc2ccccc2o1)N(C)C(=O)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 603459663 JUMSMQBYWBMJMK-HNNXBMFYSA-N 475.467 5.796 5 20 JKBD C[C@H](Nc1ccc(C(=O)N(C)Cc2ccc(Cl)cc2Cl)cc1[N+](=O)[O-])c1ccccn1 604295564 YLGCVNMKOHVWCT-AWEZNQCLSA-N 459.333 5.742 5 20 JKBD O=C(c1csc(-c2cccc([N+](=O)[O-])c2)n1)N1CCc2[nH]c3ccc(Br)cc3c2C1 604518806 QOOVPKFQOASXAX-UHFFFAOYSA-N 483.347 5.161 5 20 JKBD COc1ccc(NC(=O)C/C(=C\c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)c(C)c1 608898727 YXORNQQWMIBSGW-NBVRZTHBSA-N 459.527 6.091 5 20 JKBD Cc1ccccc1[C@@H]1CCN(C(=O)c2ccc(C(=O)N3CC[C@H](c4ccccc4C)C3)cc2[N+](=O)[O-])C1 609044642 JWXNEVDVXYRJMY-BJKOFHAPSA-N 497.595 5.471 5 20 JKBD C[C@H](OC(=O)c1c(Cl)cccc1[N+](=O)[O-])C(=O)Nc1ccccc1Sc1ccccc1 730643939 XEEIQOWMLLMOCB-AWEZNQCLSA-N 456.907 5.583 5 20 JKBD O=C(CCc1ncc(-c2ccc(Cl)cc2Cl)o1)OCCOc1ccc([N+](=O)[O-])cc1 742876018 RZGKVVDOYRADCB-UHFFFAOYSA-N 451.262 5.111 5 20 JKBD Nc1ccc(Cl)c(C(=O)O[C@@H](C(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)c2ccccc2)c1 745515437 SCEHQIUWHMBDOG-LJQANCHMSA-N 460.273 5.021 5 20 JKBD O=[N+]([O-])c1ccccc1-c1ccc(/C=C(\c2nc3ccccc3[nH]2)S(=O)(=O)c2ccccc2)o1 745997588 CWLOOTFLTAGUTD-LFVJCYFKSA-N 471.494 5.703 5 20 JKBD CCc1cccc(CC)c1NC(=O)[C@H](C)OC(=O)c1csc(-c2ccc([N+](=O)[O-])cc2)n1 747957211 LIKHNNGPBNGDLG-AWEZNQCLSA-N 453.520 5.027 5 20 JKBD C[C@@H](OC(=O)c1ccc(Sc2nncn2C)c([N+](=O)[O-])c1)c1ccccc1-c1ccccc1 748038331 XXDDEWOTACKUOZ-MRXNPFEDSA-N 460.515 5.460 5 20 JKBD Cc1ccc(C)c(NC(=O)[C@H](OC(=O)c2cc([N+](=O)[O-])c(C)c([N+](=O)[O-])c2C)c2ccccc2)c1 748951854 ROKDRUZPHMWFNE-HSZRJFAPSA-N 477.473 5.273 5 20 JKBD CC(=O)Nc1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2N2CCC(Cc3ccccc3)CC2)cc1 864794239 HVWUFDSERRHSEE-UHFFFAOYSA-N 472.545 5.265 5 20 JKBD COc1ccc(/C=C2/N=C(SCc3cc(F)ccc3[N+](=O)[O-])N(c3cccc(OC)c3)C2=O)cc1 915791618 RYFFCQUGCQABOQ-WSDLNYQXSA-N 493.516 5.428 5 20 JKBD O=C(Cn1ccc2ccc([N+](=O)[O-])cc21)NC1(c2ccc(NC(=O)[C@@H]3CC=CCC3)cc2)CCC1 1786075016 YGZYPHSGKRRMTB-HXUWFJFHSA-N 472.545 5.040 5 20 JKBD Cc1ccc(C(=O)Nc2ccc(C3(NC(=O)/C=C/c4ccccc4[N+](=O)[O-])CCC3)cc2)c(C)n1 1789967937 ANEAPBOJKNSHSE-OQLLNIDSSA-N 470.529 5.068 5 20 JKBD O=C(/C=C/c1cccs1)NC1(c2ccc(NC(=O)c3cc([N+](=O)[O-])cc4c3OCC4)cc2)CCC1 1790046443 ITKPEWAPKOIJQD-CMDGGOBGSA-N 489.553 5.052 5 20 JKBD O=C(C[C@@H]1C[C@@H]2CC[C@H]1C2)NC1(c2ccc(NC(=O)c3nc4cc([N+](=O)[O-])ccc4[nH]3)cc2)CCC1 1790827678 PHKVNPCSFVZVEC-SQNIBIBYSA-N 487.560 5.045 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)[C@@H]3[C@@H]4C=CS[C@@H]34)CCC2)cc1)c1cc2cc([N+](=O)[O-])ccc2s1 1791010393 MXMWBMMBMMJOSL-VLCRHTCISA-N 491.594 5.432 5 20 JKBD CC(C)(C)CCCCCC(=O)N1CCC2(CCCN(C(=O)Cc3cc([N+](=O)[O-])ccc3F)C2)CC1 1806657035 KBCBBYBOXSJRRU-UHFFFAOYSA-N 489.632 5.504 5 20 JKBD O=C(Nc1cc([C@@H]2CCCCN2C(=O)/C=C/c2ccc([N+](=O)[O-])o2)[nH]n1)[C@@H]1CCC[C@H]2CCCC[C@@H]21 1818926830 BVUMPXASHNVPRR-CXAVYJEYSA-N 495.580 5.223 5 20 JKBD O=C(c1cc2cc(F)ccc2s1)N1CCC([C@H]2CCCCN2C(=O)c2ccc([N+](=O)[O-])o2)CC1 1823614593 OLYQEWXEIUISQO-GOSISDBHSA-N 485.537 5.089 5 20 JKBD O=C(C1CCC(F)(F)CC1)N1CCC([C@@H]2CCCCN2C(=O)/C=C/c2ccccc2[N+](=O)[O-])CC1 1832899645 DOUHTRSVIAOXPG-UVIRAJKCSA-N 489.563 5.053 5 20 JKBD Cc1cc2occ(CC(=O)O[C@@H](C)C(=O)Nc3ccc([N+](=O)[O-])cc3C(F)(F)F)c2cc1C 9436535 ZSJFFQKPKMHGQI-ZDUSSCGKSA-N 464.396 5.090 5 20 JKBD C[C@H](Sc1nnc(Nc2ccccc2F)s1)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 10316394 ANHYPNBCPDUIBL-VIFPVBQESA-N 487.460 5.467 5 20 JKBD COc1cc(C(=O)Nc2cc(Cl)ccc2N2CCCCC2)c([N+](=O)[O-])cc1OC(F)F 10810002 LFDURGLOUTWIFE-UHFFFAOYSA-N 455.845 5.101 5 20 JKBD Cc1c(C(=O)O[C@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2ccccc2)cccc1[N+](=O)[O-] 11397335 KUVGLFDYHRRREJ-FQEVSTJZSA-N 469.837 5.002 5 20 JKBD O=C(O[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Br)c1ccccc1)c1c[nH]c2ccccc12 17117682 PMGAUIPZMQTSLG-OAQYLSRUSA-N 494.301 5.375 5 20 JKBD CC(C)(C)c1ccc(C(=O)Nc2ccccc2NC(=O)c2ccc(Cl)cc2[N+](=O)[O-])cc1 30582519 ADYDQLFROXAWHD-UHFFFAOYSA-N 451.910 6.050 5 20 JKBD Cc1nc(CSc2ccccc2C(=O)Nc2nc(-c3ccc(C)c([N+](=O)[O-])c3)cs2)cs1 69525531 IMFYOQHKTPMINN-UHFFFAOYSA-N 482.612 6.336 5 20 JKBD COc1ccc(Oc2ccc([N+](=O)[O-])cc2C(=O)N2CCC(C(=O)c3cc(F)ccc3F)CC2)cc1 108154193 DJFVMWFWOAJLQX-UHFFFAOYSA-N 496.466 5.409 5 20 JKBD C[C@H](Nc1ccc(C(=O)Nc2ccc(-n3ccnc3)c(Cl)c2)cc1[N+](=O)[O-])c1ccccn1 116614897 CQANNMMCSWVALH-HNNXBMFYSA-N 462.897 5.254 5 20 JKBD C[C@@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)NC1CCN(Cc2ccc(Cl)c(Cl)c2)CC1 303377367 UYTARVQLTLLODK-CQSZACIVSA-N 468.406 5.163 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)Nc2cc(Cl)ccc2OCC(F)(F)F)cc1SC 482074516 YUAXHJZGAJACTJ-UHFFFAOYSA-N 450.822 5.172 5 20 JKBD COc1cc(C(=O)Nc2ccc3oc(C(F)(F)F)nc3c2)c([N+](=O)[O-])cc1OCc1cscn1 494012095 MVVVIPCWSVKZCB-UHFFFAOYSA-N 494.407 5.051 5 20 JKBD Cc1nn(Cc2ccc(C(=O)N(C)[C@@H](C)c3ccc(Cl)c(Cl)c3)cc2)c(C)c1[N+](=O)[O-] 498992715 YFKYSZUDQJYWQJ-AWEZNQCLSA-N 461.349 5.596 5 20 JKBD O=C(Nc1ccc(Br)cc1)C1CCN(C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)CC1 505002679 KYRGKADVWIUAJN-UHFFFAOYSA-N 488.363 5.063 5 20 JKBD C[C@@H](Nc1ccc(C(=O)N2CCC[C@H]2Cc2c(F)cccc2Cl)cc1[N+](=O)[O-])c1ccccn1 507388437 KAWYBGBJTOCBGC-AEFFLSMTSA-N 482.943 5.803 5 20 JKBD O=C(Nc1cccc(OCc2cscn2)c1)c1cc([N+](=O)[O-])ccc1NCc1ccccc1 509167065 LFBKTFAGMUCWGF-UHFFFAOYSA-N 460.515 5.495 5 20 JKBD O=C(Nc1cc(-c2cccc([N+](=O)[O-])c2)[nH]n1)c1oc2ccccc2c1CSc1ncccn1 517100004 JBOKXPCXYVGHFD-UHFFFAOYSA-N 472.486 5.066 5 20 JKBD O=C(Nc1nc(-c2ccc(Cl)cc2Cl)cs1)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-] 518170756 CONIJIXVMLOIOR-UHFFFAOYSA-N 492.262 6.219 5 20 JKBD Cc1cc(Oc2ncccn2)ccc1NC(=O)c1cc([N+](=O)[O-])ccc1Sc1ccccc1 518944782 CQNVPQRTAYDCCZ-UHFFFAOYSA-N 458.499 5.889 5 20 JKBD Cc1nc([N+](=O)[O-])cn1CCC(=O)Nc1ccc(Oc2ccnc3cc(Cl)ccc23)c(F)c1 524387383 AVOFUPYHFCPJEX-UHFFFAOYSA-N 469.860 5.262 5 20 JKBD CC(=O)c1cccc(NC(=O)C/C(=C\c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)c1 603470266 CRSSQCREXDNLPH-CPNJWEJPSA-N 457.511 5.977 5 20 JKBD C[C@H]1CCCCN1C(=O)c1ccc(NC(=O)c2ccc(NC3CC3)c([N+](=O)[O-])c2)cc1Cl 603986517 DTBDDEOCSAFGGL-AWEZNQCLSA-N 456.930 5.089 5 20 JKBD C[C@@H]1CCN(C(=O)C2CCN(c3ccc(C(F)(F)F)cc3[N+](=O)[O-])CC2)[C@@H]2CCCC[C@@H]12 604102555 JGMOPYMWZAWOEI-AYOQOUSVSA-N 453.505 5.257 5 20 JKBD CCOc1cc(C(=O)N2CCC(c3c[nH]c4c(CC)cccc34)CC2)c([N+](=O)[O-])cc1OC 604193231 IFVPDYVBCUNTLV-UHFFFAOYSA-N 451.523 5.066 5 20 JKBD COc1ccc(CC(=O)Nc2cccc(NC(=O)Nc3cccc(C(F)(F)F)c3)c2)cc1[N+](=O)[O-] 609012069 LIQMPLUKPWTOJE-UHFFFAOYSA-N 488.422 5.447 5 20 JKBD O=C(Nc1ccc(Sc2nncs2)c(Cl)c1)c1csc(-c2ccc([N+](=O)[O-])cc2)n1 609107240 JOZXHHPNMYNHIT-UHFFFAOYSA-N 475.964 5.627 5 20 JKBD C[C@H](c1cccc([N+](=O)[O-])c1)S(=O)(=O)C(c1ccc(Cl)cc1)c1ccc(Cl)cc1 609251550 KLNWUWZNSMHFPI-CQSZACIVSA-N 450.343 6.167 5 20 JKBD O=C(Nc1cc2c(cc1Cl)OCCCO2)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 619226836 UQMLCSQDWAPKBQ-UHFFFAOYSA-N 499.873 5.283 5 20 JKBD C[C@H](OC(=O)[C@H]1C[C@@H]1c1cccc2ccccc12)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 730872050 CBANBQYAIFJZCR-BKTGTZMESA-N 472.419 5.441 5 20 JKBD CC(=O)Nc1ccc(C2=N/C(=C/c3ccc(Oc4ccccc4Cl)c([N+](=O)[O-])c3)C(=O)O2)cc1 746016060 KIQDIHXIGUMZFN-XDHOZWIPSA-N 477.860 5.343 5 20 JKBD Cc1cccc(C(C)C)c1NC(=O)COC(=O)c1ccc(N2CCC[C@H](C)C2)c([N+](=O)[O-])c1 783521223 GJRZKPQFHRNNQQ-KRWDZBQOSA-N 453.539 5.058 5 20 JKBD C[C@@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccc(-c2nnc3n2CCCCCC3)cc1 811388522 SWUVCEKPHMYNRN-MRXNPFEDSA-N 451.552 5.089 5 20 JKBD Cc1oc(-c2ccccc2)nc1COC(=O)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 841794914 SKPFCPHGJXFUEZ-UHFFFAOYSA-N 489.450 5.537 5 20 JKBD Cc1csc(Sc2ccc(C(=O)OCC(=O)Nc3ccccc3C(F)(F)F)cc2[N+](=O)[O-])n1 849120044 NBBMYUXRNLXIMM-UHFFFAOYSA-N 497.476 5.325 5 20 JKBD Cc1oc2cc(OS(=O)(=O)c3ccc(Cl)cc3[N+](=O)[O-])ccc2c(=O)c1-c1ccccc1 913074606 NRVWGUNBURXUEM-UHFFFAOYSA-N 471.874 5.098 5 20 JKBD C[C@H](OC(=O)c1ccc(NC(=O)Nc2ccccc2)cc1)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 913268312 ZNAZBQMGWGCDHU-HNNXBMFYSA-N 473.445 5.207 5 20 JKBD O=C(O[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1)c1cc2ccccc2c(Cl)n1 915445737 FIXSZBHKIWMDQV-NRFANRHFSA-N 496.306 5.987 5 20 JKBD CC1=C(C(=O)Nc2ccccc2C(F)(F)F)[C@H](c2ccc([N+](=O)[O-])cc2)NC(=O)N1CC(C)C 916167659 FFVRLDRZUUKNMU-FQEVSTJZSA-N 476.455 5.249 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)c3ccc([N+](=O)[O-])cc3F)CCC2)cc1)c1ccc2ncccc2c1 1788908268 QUGHBPSNWRLOIV-UHFFFAOYSA-N 484.487 5.344 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)Nc1ccc(C2(NC(=O)Cc3cccnc3Cl)CCC2)cc1 1790771060 NHKCIIYTPBCRQX-UHFFFAOYSA-N 496.926 5.081 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)Nc1ccc(C2(NC(=O)/C=C/c3ccccc3N)CCC2)cc1 1790771073 OGSLEWUPUGTOAY-VGOFMYFVSA-N 488.519 5.086 5 20 JKBD Cc1c(Cl)cccc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(Cl)cc([N+](=O)[O-])c1C 1800708767 FJPGBPWMECPTEU-BJWYYQGGSA-N 476.360 5.084 5 20 JKBD Cc1c(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)[C@@H]2CCC[C@H]4CCCC[C@H]42)C3)cc(Cl)cc1[N+](=O)[O-] 1800712190 YAKOQGIQMMRCFH-MNVGVQDPSA-N 488.028 5.415 5 20 JKBD CCCCC[C@H](C)C(=O)N1CCCC[C@H]1c1cc(NC(=O)Cn2ccc3ccc([N+](=O)[O-])cc32)n[nH]1 1815074266 AJXQKVVWXWKVNY-AVRDEDQJSA-N 494.596 5.181 5 20 JKBD O=C(c1ccccc1C1CC1)N1CCC([C@@H]2CCCCN2C(=O)Cc2cc([N+](=O)[O-])ccc2F)CC1 1824948088 QNTWYDKMLPSOEO-SANMLTNESA-N 493.579 5.087 5 20 JKBD O=C(c1cc2cc([N+](=O)[O-])ccc2s1)N1CC2(CCCN2C(=O)c2cc3sccc3s2)C1 1844034280 YJGHTKLCZKEODR-UHFFFAOYSA-N 483.596 5.217 5 20 JKBD COc1ccc(N2C(=O)/C(=C\c3cccs3)N=C2SCc2ccccc2[N+](=O)[O-])cc1Cl 8953065 MJEKUZBSRDLMHK-LDADJPATSA-N 485.974 5.995 5 20 JKBD O=C(/C=C/c1ccc([N+](=O)[O-])cc1)O[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1 10757431 MLMREOSKVBZGHO-SYZXBLONSA-N 481.848 5.093 5 20 JKBD Cc1ccc(NC(=O)[C@@H](OC(=O)c2ccccc2OC(F)F)c2ccccc2)c([N+](=O)[O-])c1 21123017 ZPFYKKPSILAWCU-FQEVSTJZSA-N 456.401 5.041 5 20 JKBD C[C@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccc(NC(=O)c2ccco2)cc1C(F)(F)F 22182077 QVXNMJIOVGCPPE-LBPRGKRZSA-N 479.436 5.578 5 20 JKBD C[C@@H](Sc1nncn1-c1cccc(Cl)c1)C(=O)Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1 24844130 UUGHHWWCWILOKW-GFCCVEGCSA-N 486.966 5.072 5 20 JKBD CCN(Cc1cccc(NC(=O)c2ccccc2C(=O)c2ccc(SC)c([N+](=O)[O-])c2)c1)C(C)=O 27042359 ZCSSDTKVCLHJKR-UHFFFAOYSA-N 491.569 5.168 5 20 JKBD O=C(Nc1cccc(CN[C@@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2ccccc2)c1)C1CCC1 28384108 APFMBAHPZPVQDL-XMMPIXPASA-N 492.963 5.456 5 20 JKBD O=[N+]([O-])c1ccc(-c2nnc(CSc3nnc(-c4cccs4)n3-c3ccccc3)o2)cc1 29826638 MOYZQNDPISHYID-UHFFFAOYSA-N 462.516 5.246 5 20 JKBD C[C@@H](Nc1ccc(C(=O)Nc2ccc(Cl)cc2C(=O)N2CCCC2)cc1[N+](=O)[O-])c1ccccn1 116667314 IBZILEKHLYVUKJ-MRXNPFEDSA-N 493.951 5.305 5 20 JKBD CCOc1cc(NC(=O)C23C[C@H]4C[C@@H](CC(Br)(C4)C2)C3)c([N+](=O)[O-])cc1OCC 217059020 RDLXUQXQOHLKNB-RKOMNEFPSA-N 467.360 5.065 5 20 JKBD O=C(C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1)N1CC=C(c2ccc(F)cc2)CC1 302837439 MMJDPCVIKFNPHT-UHFFFAOYSA-N 477.458 5.285 5 20 JKBD O=C(Nc1ccc(NCc2nc(-c3cccc([N+](=O)[O-])c3)no2)c(C(F)(F)F)c1)c1ccccc1 303019699 OLNOEOGUYFDTGT-UHFFFAOYSA-N 483.406 5.528 5 20 JKBD O=C(Cn1c2ccccc2c(=O)c2ccccc21)NC[C@H](c1ccccc1)N1CCc2sccc2C1 484822519 RDZIYGNIVQOUPI-HHHXNRCGSA-N 493.632 5.132 5 20 JKBD O=C(c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1)N1CC=C(c2c[nH]c3ncccc23)CC1 485355895 IGYWBGFNRPDOHM-UHFFFAOYSA-N 474.904 5.846 5 20 JKBD Cc1csc(Sc2ccc(C(=O)N[C@H](c3ccccc3)c3ccncc3)cc2[N+](=O)[O-])n1 486767193 DOWNBRRVSQUVMB-OAQYLSRUSA-N 462.556 5.425 5 20 JKBD CN(C(=O)c1ccc(Cl)cc1)c1ccc(NC(=O)c2csc(-c3cccc([N+](=O)[O-])c3)n2)cc1 496611263 KJJDUYRKKLXRPW-UHFFFAOYSA-N 492.944 5.901 5 20 JKBD Cc1nn(Cc2ccc(C(=O)N(C)[C@H](C)c3ccc(C(F)(F)F)cc3)cc2)c(C)c1[N+](=O)[O-] 498943983 QPGALCMUQXVBDY-OAHLLOKOSA-N 460.456 5.308 5 20 JKBD CC(C)CCOC1CCN(C(=O)C/C(=C\c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)CC1 500563978 KPQOTLKEHGWQMW-HEHNFIMWSA-N 493.629 6.189 5 20 JKBD C[C@H](Nc1ccc(C(=O)N(C)Cc2cc(Cl)cc(Cl)c2)cc1[N+](=O)[O-])c1ccccn1 507392852 QSKGDXZHLXCCFX-AWEZNQCLSA-N 459.333 5.742 5 20 JKBD O=C(Cc1ccc([N+](=O)[O-])cc1)Nc1ccc(NC(=O)c2ccc(F)cc2)cc1C(F)(F)F 514442519 RAHZABGPOVUSFP-UHFFFAOYSA-N 461.371 5.186 5 20 JKBD O=C(C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)NCCc1ccc2ccccc2n1 520103014 CJVBQLAWMMYZKU-FXBPSFAMSA-N 494.576 6.042 5 20 JKBD Cc1ccc(Sc2ccc(CNC3CCN(C(=O)c4ccco4)CC3)cc2[N+](=O)[O-])cc1 520208005 WOEZRFVCDGOXFN-UHFFFAOYSA-N 451.548 5.042 5 20 JKBD Cc1cc(C(=O)NC2CCCC2)ccc1NC(=O)c1ccc(N2CCC[C@@H](C)C2)c([N+](=O)[O-])c1 520465017 CMFLOPZGOMHKBW-QGZVFWFLSA-N 464.566 5.064 5 20 JKBD COc1cc(C)ccc1Oc1ccc(NC(=O)c2ccc(N[C@@H](C)c3ccccn3)c([N+](=O)[O-])c2)cn1 523298570 RPNYILKRNSXHHE-SFHVURJKSA-N 499.527 5.920 5 20 JKBD Cc1csc([C@H](C)NC(=O)C/C(=C\c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)n1 524323143 OUXUWBDCCDLOCB-VUVCFOEZSA-N 464.572 5.778 5 20 JKBD Cc1ccc(C[C@@H]2CCCN(C(=O)c3ccc(N[C@@H](C)c4ccccn4)c([N+](=O)[O-])c3)C2)cc1 580668700 NFUBVKFRUPMHQD-UNMCSNQZSA-N 458.562 5.566 5 20 JKBD COc1cc(C(=O)Nc2cc(-c3cccc(C)c3)nn2-c2ccccc2)c([N+](=O)[O-])cc1OC(F)F 585714869 LTDJBEPZMMLBSJ-UHFFFAOYSA-N 494.454 5.618 5 20 JKBD O=C(NCCCn1ccnc1)c1c2c(nc3ccccc13)/C(=C\c1cccc([N+](=O)[O-])c1)CCC2 590781139 RYRLVCVHDPIRQD-SILNSSARSA-N 467.529 5.037 5 20 JKBD Cc1cc(Br)ccc1NC(=O)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 598740236 PKBXOOAITZYGRY-UHFFFAOYSA-N 486.288 5.540 5 20 JKBD Cn1ccnc1C(=O)c1ccc(N2CCC[C@@H]2c2ccc(F)c(C(F)(F)F)c2)c([N+](=O)[O-])c1 600852292 JNJKWEDFPJOQEH-QGZVFWFLSA-N 462.403 5.059 5 20 JKBD CC(C)Oc1ncccc1CNC(=O)C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1 603761169 NEIOQFWBYRAVNE-ZHZULCJRSA-N 488.569 5.634 5 20 JKBD C[C@@H](Sc1nc2ccc(C(F)(F)F)cc2[nH]1)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 603938221 NYDLPGGDDPWVRO-MRVPVSSYSA-N 478.374 5.628 5 20 JKBD CCN(C(=O)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1)c1nc2ccccc2s1 603942181 KHCQKZNXUSCTAR-UHFFFAOYSA-N 478.496 5.493 5 20 JKBD COc1ccc(-c2nc(C)c(C(=O)Nc3nc(-c4cccc([N+](=O)[O-])c4)c(C)s3)s2)cc1OC 603997502 LSQMLMLNYRXKGP-UHFFFAOYSA-N 496.570 5.728 5 20 JKBD O=C(Cn1c(Cc2ccccc2)nc2ccccc21)N(Cc1ccccc1[N+](=O)[O-])CC(F)(F)F 604242875 FURREDUCWYHTPH-UHFFFAOYSA-N 482.462 5.126 5 20 JKBD Cc1ccc(NC(=O)c2cccc(C(F)(F)F)c2)cc1NC(=O)COc1cccc([N+](=O)[O-])c1 604449358 DMKPRIWBNXDPNK-UHFFFAOYSA-N 473.407 5.192 5 20 JKBD COc1cc(C(=O)Nc2ccc(O[C@H](C)c3ccccc3)cc2C)c([N+](=O)[O-])cc1OC(F)F 609066414 FRSDKQDFBQQWKD-OAHLLOKOSA-N 472.444 5.906 5 20 JKBD O=C(C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)Nc1cccc(-c2nc(=O)o[nH]2)c1 609171656 LAFPHVBTLDVNTO-ATVHPVEESA-N 499.508 5.117 5 20 JKBD CCC[C@H](NC(=O)C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)c1ccccn1 609179958 XSJRPWREQGKWKO-JHNUBAFKSA-N 472.570 6.188 5 20 JKBD CC(C)(C)c1nc(CC(=O)O[C@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2ccccc2)cs1 726835197 RZBMSOBUEIVXAV-FQEVSTJZSA-N 487.965 5.468 5 20 JKBD CC(C)(C)c1cc[n+](/C(C(=S)Nc2ccc(Cl)nc2)=C(/O)c2cccc([N+](=O)[O-])c2)cc1 727161034 ZFKRGQMEFWMMAC-UHFFFAOYSA-O 469.974 5.552 5 20 JKBD O=C(c1ccc(-c2noc(C(F)(F)F)n2)cc1)N(CC1CC1)c1ccc(Cl)c([N+](=O)[O-])c1 730490503 YEYXSABUOBQNJM-UHFFFAOYSA-N 466.803 5.374 5 20 JKBD Cc1cc(C(=O)O[C@@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2C(F)(F)F)cc(C)c1OC(F)F 730858646 PEXYQKYPXNOVOA-NSHDSACASA-N 476.354 5.016 5 20 JKBD CCN(c1ccccc1)S(=O)(=O)c1ccc(Oc2ccc(C=O)cc2Cl)c([N+](=O)[O-])c1 742564057 MMRMAYITIJYZAH-UHFFFAOYSA-N 460.895 5.068 5 20 JKBD C[C@H](OC(=O)c1csc(-c2cccc([N+](=O)[O-])c2)n1)C(=O)Nc1ccc(Cl)cc1Cl 747961893 AASZVDKXRFXJHW-JTQLQIEISA-N 466.302 5.209 5 20 JKBD O=C(Nc1nc(-c2ccc(Cl)cc2Cl)cs1)c1cc([N+](=O)[O-])ccc1Br 751050871 UUAPGFCKZCPCBJ-UHFFFAOYSA-N 473.135 6.040 5 20 JKBD O=C(Nc1ccc2[nH]c(-c3ccc(F)cc3)nc2c1)c1cc([N+](=O)[O-])ccc1Br 751086937 NEABMHUHEKRHRV-UHFFFAOYSA-N 455.243 5.292 5 20 JKBD O=C(Nc1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2Br)cc1)c1ccc(Cl)cc1 751104534 YCBQSEURRJCYAU-UHFFFAOYSA-N 474.698 5.515 5 20 JKBD CC(C)c1noc2ncc(C(=O)Oc3ccc4c(-c5ccc([N+](=O)[O-])cc5)cc(=O)oc4c3)cc12 821892365 CMVPMKWYCGTKLT-UHFFFAOYSA-N 471.425 5.247 5 20 JKBD Cc1c(NC(=O)[C@@H](C)OC(=O)/C(=C\c2ccc(F)cc2)c2cccs2)cccc1[N+](=O)[O-] 825738972 VWVJGRIMALVXPO-QLENYVDCSA-N 454.479 5.215 5 20 JKBD COc1ccc(-c2ccc(CN3CC4(CCOCC4)[C@@H]3c3cnn(CC(C)C)c3)o2)c([N+](=O)[O-])c1 849478991 LNUIXALQWADTDD-VWLOTQADSA-N 480.565 5.070 5 20 JKBD Cc1c(NC(=O)CC2(CC(=O)Nc3cccc([N+](=O)[O-])c3C)CCCC2)cccc1[N+](=O)[O-] 867437533 XFORKLUUQGGDIH-UHFFFAOYSA-N 454.483 5.038 5 20 JKBD O=C(Cc1ccccc1)Nc1cc(NC(=O)c2cc([N+](=O)[O-])ccc2N2CCCCC2)ccc1F 916504663 QRQYYOOKBRMRQB-UHFFFAOYSA-N 476.508 5.158 5 20 JKBD CC(C)c1cccc(NC(=S)/C(=C(/O)c2cccc([N+](=O)[O-])c2)[n+]2ccc3c(c2)CCCC3)c1 917616305 VZKRPEFACGYGCN-UHFFFAOYSA-O 474.606 6.208 5 20 JKBD O=C(C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)NCc1ccc([N+](=O)[O-])cc1 917791024 YODBVDAPKXBGHH-QGOAFFKASA-N 474.498 5.360 5 20 JKBD Cc1ccc(NC(=O)c2nnc(COC(=O)c3cc([N+](=O)[O-])ccc3Oc3ccccc3)s2)cc1 919193134 RHKDWMJAPGMOGI-UHFFFAOYSA-N 490.497 5.156 5 20 JKBD CC(=O)N(c1ccc(Cl)c(Cl)c1)c1nc(COC(=O)c2csc([N+](=O)[O-])c2)cs1 919367856 CCSZIXPORKBWDI-UHFFFAOYSA-N 472.331 5.461 5 20 JKBD CCOc1cc(-c2ccccc2)sc1C(=O)OCc1nnc(-c2ccc([N+](=O)[O-])cc2)o1 919452400 UWQOPVWKUKXJQW-UHFFFAOYSA-N 451.460 5.129 5 20 JKBD CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)c1ccc(N[C@H](C)c2ccccn2)c([N+](=O)[O-])c1 919869077 IKDAPKGBJGYIQQ-QGZVFWFLSA-N 463.494 5.122 5 20 JKBD COc1ccc(-c2[nH]c3ccccc3c2CCC(=O)Oc2ccc(OC)cc2[N+](=O)[O-])c(OC)c1 920021951 RHGANDBQKPJARO-UHFFFAOYSA-N 476.485 5.307 5 20 JKBD CC(=O)N(c1ccc(Cl)c(Cl)c1)c1nc(COC(=O)CNc2ccccc2[N+](=O)[O-])cs1 920604440 GUUBSRMTHXKGEL-UHFFFAOYSA-N 495.344 5.198 5 20 JKBD CC(=O)N(c1cccc(C(F)(F)F)c1)c1nc(COc2cc(Cl)ccc2[N+](=O)[O-])cs1 920992939 UILCJFGVBPTROO-UHFFFAOYSA-N 471.844 5.987 5 20 JKBD O=C(Oc1cc(Cl)ccc1[N+](=O)[O-])[C@H]1CCCN(C(=O)c2ccc(Cl)c(Cl)c2)C1 921134038 LVZKIVVLJQBNLL-LBPRGKRZSA-N 457.697 5.013 5 20 JKBD O=C(Cc1ccc(Cl)cc1[N+](=O)[O-])NC1(c2ccc(NC(=O)[C@@H]3CCC(F)(F)C3)cc2)CCC1 1785799579 FRORTHSPTZOVIN-MRXNPFEDSA-N 491.922 5.360 5 20 JKBD CC1=CC[C@@H](C(=O)Nc2ccc(C3(NC(=O)c4ccc([N+](=O)[O-])cc4F)CCC3)cc2)CC1 1789115211 QJBLNCLHBDYYRC-QGZVFWFLSA-N 451.498 5.228 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)c3cccc(Cl)c3)CCC2)cc1)c1cc(O)cc([N+](=O)[O-])c1 1790757121 ZDVFNBZGQBHYJP-UHFFFAOYSA-N 465.893 5.015 5 20 JKBD O=C(CCc1cccc([N+](=O)[O-])c1)NC1(c2ccc(NC(=O)c3nc4ccccc4o3)cc2)CCC1 1790850537 JIDYUUBBIVCGGK-UHFFFAOYSA-N 484.512 5.117 5 20 JKBD O=C(CCc1cccc([N+](=O)[O-])c1)NC1(c2ccc(NC(=O)c3cccc4ccncc34)cc2)CCC1 1790857899 VVVDCIMVWXVKAX-UHFFFAOYSA-N 494.551 5.524 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)[C@@H]3CCCS3)CCC2)cc1)c1cc2cc([N+](=O)[O-])ccc2s1 1791009880 BTNCWLNYIVTTKR-FQEVSTJZSA-N 481.599 5.453 5 20 JKBD O=C(CC(F)(F)F)NC1(c2ccc(NC(=O)c3cc4cc([N+](=O)[O-])ccc4s3)cc2)CCC1 1791011168 MNGAMKJDEPTWQY-UHFFFAOYSA-N 477.464 5.510 5 20 JKBD COc1ccccc1C(=O)NC1(c2ccc(NC(=O)CSc3ccccc3[N+](=O)[O-])cc2)CCC1 1791522942 KEOGHVSQLLWUKD-UHFFFAOYSA-N 491.569 5.143 5 20 JKBD CC(C)(C)CCCCCC(=O)N1CC[C@@H](CNC(=O)Cc2cccc([N+](=O)[O-])c2)[C@H]1c1cccnc1 1802382160 OOTWCJOMYKIDQB-WNCULLNHSA-N 494.636 5.235 5 20 JKBD CC[C@@H](C)[C@H](C(=O)N1CCCC2(CCN(C(=O)Cc3cccc([N+](=O)[O-])c3)CC2)C1)c1ccccc1 1809153530 JRKVFPJMDQXPCA-AMGIVPHBSA-N 491.632 5.198 5 20 JKBD CC[C@H](C)[C@H](C(=O)N1CCCC2(CCN(C(=O)Cc3cccc([N+](=O)[O-])c3)CC2)C1)c1ccccc1 1809153533 JRKVFPJMDQXPCA-CUNXSJBXSA-N 491.632 5.198 5 20 JKBD Cc1ccccc1C(=O)N1CCCC[C@H]1C1CCN(C(=O)Cc2ccc(Cl)cc2[N+](=O)[O-])CC1 1829942430 HCQCAWUWTIRJKL-QHCPKHFHSA-N 483.996 5.033 5 20 JKBD CCC(C)(C)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cc(Br)ccc2[N+](=O)[O-])CC1 1831387165 IAMZOSWJYXXRFE-LJQANCHMSA-N 494.430 5.027 5 20 JKBD CCn1c(Cc2ccccc2)nnc1S[C@H](C)C(=O)Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1 9629266 PVJFCSJSJXGSNR-OAHLLOKOSA-N 494.602 5.040 5 20 JKBD Cc1nc(COc2cccc(C(=O)Nc3nc(-c4cccc([N+](=O)[O-])c4)cs3)c2)cs1 16706782 CMEOFPRORSQBBP-UHFFFAOYSA-N 452.517 5.315 5 20 JKBD COc1ccc([N+](=O)[O-])cc1NC(=O)CCSc1nnc(-c2cccs2)n1Cc1ccccc1 26220867 MCKDRJXJLHESSR-UHFFFAOYSA-N 495.586 5.093 5 20 JKBD O=C(COC(=O)CSc1cccc2cccc(Cl)c12)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 28810528 HWKGGMYYCYRZRV-UHFFFAOYSA-N 498.866 5.694 5 20 JKBD CCOc1ccc2nc(NC(=O)c3ccc(N[C@H](C)c4ccccn4)c([N+](=O)[O-])c3)sc2c1 72016419 IYYCGXFSENWNFG-CQSZACIVSA-N 463.519 5.424 5 20 JKBD CC[C@@H](NC(=O)c1ccc(N[C@H](C)c2ccccn2)c([N+](=O)[O-])c1)c1ccccc1OC(F)F 108779496 BCHYMMUUFLXCLZ-CRAIPNDOSA-N 470.476 5.645 5 20 JKBD CSc1ccc(C(=O)c2ccccc2C(=O)N2CCC(COc3ccccc3)CC2)cc1[N+](=O)[O-] 410128671 ULLOKFIJLACFSM-UHFFFAOYSA-N 490.581 5.479 5 20 JKBD COc1cccc(/C=C(\CC(=O)Nc2ccc(OC)cc2[N+](=O)[O-])c2nc3ccccc3s2)c1 480949694 XJNVLFNSYBOYIJ-SFQUDFHCSA-N 475.526 5.791 5 20 JKBD O=C(C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)Nc1cccc(N2CCNC2=O)c1 482418124 ZZKZECGDLDXLQR-NBVRZTHBSA-N 499.552 5.304 5 20 JKBD COc1cc(C)ccc1Oc1ccc(NC(=O)c2cc(SC)c(OC)cc2[N+](=O)[O-])cn1 482815582 XEZHOFYUQLWWHE-UHFFFAOYSA-N 455.492 5.082 5 20 JKBD CC(=O)Nc1cccc(NC(=O)C/C(=C/c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)c1C 484277441 BUWRZKNWABWWGU-RGEXLXHISA-N 486.553 6.041 5 20 JKBD Cc1cc(NC(=O)c2ccc(N3C[C@H](C)C[C@@H](C)C3)c([N+](=O)[O-])c2)ccc1NC(=O)c1ccco1 490149584 UDKLMCSZBTXXMH-IAGOWNOFSA-N 476.533 5.483 5 20 JKBD Cc1ccc(C(=O)C2CCN(C(=O)c3ccc(N4C[C@H](C)C[C@@H](C)C4)c([N+](=O)[O-])c3)CC2)cc1 490742912 AHJTYENZSSOXQE-WOJBJXKFSA-N 463.578 5.121 5 20 JKBD COc1cc(C(=O)N(C)c2ccc([N+](=O)[O-])cc2)ccc1OCc1ccc(Br)cc1 514430849 GQIBXYWPPICNAL-UHFFFAOYSA-N 471.307 5.222 5 20 JKBD O=C(c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1)N(C[C@H]1CCCO1)[C@H]1CCSC1 514493138 JSAMAZORQXXNAX-PKOBYXMFSA-N 462.955 5.167 5 20 JKBD CN(C[C@H]1CCCOC1)C(=O)C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1 517409408 YBIBQCIHAKJRIF-ZJYZBMPFSA-N 451.548 5.020 5 20 JKBD O=C(Nc1cccc(OC[C@@H]2CCCO2)c1)c1cc([N+](=O)[O-])ccc1Sc1ccccc1 519959356 NVRRHDFKLCPLGU-FQEVSTJZSA-N 450.516 5.556 5 20 JKBD O=C(CCNc1ccc(C(F)(F)F)cc1[N+](=O)[O-])Nc1cccc(NC(=O)c2cccs2)c1 591681662 WQXVKPQRBMGEQZ-UHFFFAOYSA-N 478.452 5.368 5 20 JKBD CC1CCN(c2ccc(C(=O)Nc3ccc(F)c(-c4nnc5n4CCCCC5)c3)cc2[N+](=O)[O-])CC1 600814177 AHTIEQGACZXYQR-UHFFFAOYSA-N 492.555 5.207 5 20 JKBD O=C(Nc1ccc2c(c1)OC1(CCCCC1)O2)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-] 603682819 CYDPLIFASIGQBU-UHFFFAOYSA-N 452.385 5.220 5 20 JKBD COc1ccc(NC(=O)c2ccc(N[C@@H](C)c3ccccn3)c([N+](=O)[O-])c2)c(Br)c1 608899992 HJZROHNWRQHCBO-ZDUSSCGKSA-N 471.311 5.186 5 20 JKBD Cc1ccc(NC(=O)c2ccc(N3CCC(c4nc(-c5ccccc5)no4)CC3)c([N+](=O)[O-])c2)cc1 609143673 FVZUCKUQOJGUDX-UHFFFAOYSA-N 483.528 5.590 5 20 JKBD COc1ccc(NC(=S)/C(=C(/O)c2ccc(C)c([N+](=O)[O-])c2)[n+]2ccc3c(c2)CCCC3)cc1F 726576222 OBDNFNDQJHFEKN-UHFFFAOYSA-O 494.568 5.541 5 20 JKBD COc1ccc([C@H]2Nc3ccccc3C(=O)N2CC(F)(F)F)cc1OCc1ccc([N+](=O)[O-])cc1 726874985 FAPLWUDBARZWIF-QFIPXVFZSA-N 487.434 5.311 5 20 JKBD COc1ccc(NC(=S)/C(=C(/O)c2ccc([N+](=O)[O-])cc2)[n+]2ccc3c(c2)CCCC3)cc1Cl 726961863 LXJDXBKSCHGYLC-UHFFFAOYSA-O 496.996 5.746 5 20 JKBD Cc1occc1-c1cc(NC(=O)c2cc([N+](=O)[O-])ccc2Sc2ccc(Cl)cc2)n(CCO)n1 727316475 BPJFUZQMDQJZCW-UHFFFAOYSA-N 498.948 5.409 5 20 JKBD CCOc1ccc(N(C(=O)c2cc([N+](=O)[O-])ccc2Cl)C2CCN(CC(F)(F)F)CC2)cc1 729241202 BMOCPEVFVUBGJQ-UHFFFAOYSA-N 485.890 5.320 5 20 JKBD O=C(Oc1ccc(C(=O)N2CCc3sccc3C2)cc1)c1csc(-c2cccc([N+](=O)[O-])c2)n1 731334346 JRYGMXAEWBSKAQ-UHFFFAOYSA-N 491.550 5.198 5 20 JKBD CC(C)c1cc(C(=O)N(CC2CC2)c2ccc(Cl)c([N+](=O)[O-])c2)c2cnn(C(C)C)c2n1 745344621 GITRIESLOHJUGB-UHFFFAOYSA-N 455.946 5.754 5 20 JKBD CC(C)Cc1nc(C(=O)Oc2ccc(NC(=O)c3cc([N+](=O)[O-])ccc3Cl)cc2)cs1 745744214 SZDFOJSWHCQNLF-UHFFFAOYSA-N 459.911 5.375 5 20 JKBD C[C@H](OC(=O)CSc1nnc(-c2ccc(Cl)cc2)n1Cc1ccco1)c1cccc([N+](=O)[O-])c1 811809424 RFMRCAXEZZUYDN-HNNXBMFYSA-N 498.948 5.545 5 20 JKBD C[C@@H](OC(=O)c1nc(-c2ccccc2)n2c1CCCCC2)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl 914915882 FWQJLPPHZNTUFJ-OAHLLOKOSA-N 482.924 5.022 5 20 JKBD Cc1ccc(C(=O)O[C@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)cc1NC(=O)c1ccccc1 915019449 LCBCOLBWVACEMX-MRXNPFEDSA-N 472.457 5.124 5 20 JKBD Cc1ccc(C(=O)O[C@@H](C)C(=O)Nc2cc([N+](=O)[O-])ccc2Cl)cc1NC(=O)c1ccccc1F 915517689 TXAICQWYNCJXAB-AWEZNQCLSA-N 499.882 5.132 5 20 JKBD CCn1c(S[C@H](C(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)c2ccccc2)nnc1-c1ccccn1 916663625 DDBAUHCKQPMLEA-FQEVSTJZSA-N 494.964 5.394 5 20 JKBD O=C(Oc1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2Cl)cc1)c1ccc(-c2cnco2)cc1 918213893 LQRORFQFXLJXJV-UHFFFAOYSA-N 463.833 5.375 5 20 JKBD Cc1ccc([N+](=O)[O-])cc1NC(=O)COC(=O)c1csc(-c2ccc(Cl)cc2Cl)n1 921225191 SRZNFPIEXDJTJW-UHFFFAOYSA-N 466.302 5.129 5 20 JKBD O=C(/C=C\c1nc2ccccc2s1)Oc1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2Cl)cc1 923384293 CXDDTLWWJAZPEK-QXMHVHEDSA-N 479.901 5.729 5 20 JKBD C[C@@H](C(=O)NC1(c2ccc(NC(=O)c3ccc([N+](=O)[O-])[nH]3)cc2)CCC1)c1ccc(Cl)cc1 1790183605 KLHAIRANWMMLQH-OAHLLOKOSA-N 466.925 5.128 5 20 JKBD CCc1ncsc1C(=O)Nc1ccc(C2(NC(=O)CSc3ccccc3[N+](=O)[O-])CCC2)cc1 1790201141 DASOWIFHGHJYHY-UHFFFAOYSA-N 496.614 5.154 5 20 JKBD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc2cc([N+](=O)[O-])ccc2s1)c1cc(F)cc(Cl)c1 1801208484 HGWXDRORKGMMJA-BCDXTJNWSA-N 487.940 5.168 5 20 JKBD Cc1cc(CCCC(=O)N2CCCC3(CCN(C(=O)[C@@H]4CCC[C@@H]4C)CC3)C2)c([N+](=O)[O-])cc1F 1805821570 WFXYEZDNZVCLNY-SIKLNZKXSA-N 487.616 5.032 5 20 JKBD Cc1cc(C(=O)N2CC[C@H](CNC(=O)CCCCCC(C)(C)C)[C@H]2c2cccnc2)ncc1[N+](=O)[O-] 1812807180 MWDSCWLLLGUMTF-PXDATVDWSA-N 495.624 5.009 5 20 JKBD O=C(CCc1cccc([N+](=O)[O-])c1)Nc1cc([C@H]2CCCCN2C(=O)c2ccc(Cl)c(F)c2)[nH]n1 1815538844 ZKYJBVQBBXAPLR-OAQYLSRUSA-N 499.930 5.049 5 20 JKBD O=C(c1cccc2ccccc12)N1CCC([C@H]2CCCCN2C(=O)c2cc(O)cc([N+](=O)[O-])c2)CC1 1830705133 SNJDJCGRUUTWTI-AREMUKBSSA-N 487.556 5.001 5 20 JKBD C/C(=C\c1ccc(C)o1)C(=O)N1CCC([C@H]2CCCCN2C(=O)c2c(F)ccc([N+](=O)[O-])c2C)CC1 1830734103 XOCXGHFIKABCAL-GQRCBVMOSA-N 497.567 5.281 5 20 JKBD COc1cc(-c2nnc(CSc3nc4ccccc4c4nc5ccccc5n34)o2)cc(OC)c1OC 8760675 SUSIMRLEIFECIG-UHFFFAOYSA-N 499.552 5.404 5 20 JKBD COc1ccc([C@@H]2CCCCCN2C(=O)c2ccc(Cn3nc(C)c([N+](=O)[O-])c3C)cc2)cc1 24393055 FIGIIYQHJFPMNJ-DEOSSOPVSA-N 462.550 5.223 5 20 JKBD Cc1cc(NC(=O)c2ccc(F)cc2Cl)sc1C(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1 108278064 YIPWECILAHVHLI-UHFFFAOYSA-N 468.293 5.915 5 20 JKBD C[C@@H](Nc1ccc(C(=O)Nc2ncccc2OCC2CCCCC2)cc1[N+](=O)[O-])c1ccccn1 109862262 COAHAZXNONLZTM-GOSISDBHSA-N 475.549 5.769 5 20 JKBD O=C(Nc1nnc(SCc2cccs2)s1)c1csc(-c2cccc([N+](=O)[O-])c2)n1 215935806 RNUBLIDRNPTDFV-UHFFFAOYSA-N 461.575 5.176 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)Nc2ccc(-c3nc4c(Cl)cccc4[nH]3)cc2)cc1SC 484397137 MLODIOKTPJJNIC-UHFFFAOYSA-N 468.922 5.774 5 20 JKBD COc1cc(F)ccc1NC(=O)C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1 499953602 BIABXDJWQKWIPA-FOWTUZBSSA-N 463.490 5.922 5 20 JKBD Cc1nc(-c2ccccc2)sc1[C@@H](C)NC(=O)c1ccc(N[C@H](C)c2ccccn2)c([N+](=O)[O-])c1 507543271 ATDTZFIHUDHPDF-IAGOWNOFSA-N 487.585 6.086 5 20 JKBD CS(=O)(=O)c1cc(C(=O)Nc2ccc(Oc3ccccc3)cc2C(F)(F)F)cc([N+](=O)[O-])c1 519097782 MWVGTUZEJGVXNL-UHFFFAOYSA-N 480.420 5.062 5 20 JKBD Cc1ccc(NC(=O)c2ccc(N[C@@H](CO)c3cccc(C(F)(F)F)c3)c([N+](=O)[O-])c2)cc1 600853450 WIFBCEMNSURHOJ-FQEVSTJZSA-N 459.424 5.320 5 20 JKBD CCOc1cc([N+](=O)[O-])c(C(=O)Nc2ccccc2Oc2ncc(Cl)cc2Cl)cc1OC 603673199 JZGBKLKORMRWDE-UHFFFAOYSA-N 478.288 5.749 5 20 JKBD COc1cc(C(=O)Nc2nc(-c3cccc([N+](=O)[O-])c3)c(C)s2)ccc1OCc1cscn1 603997865 UYFCDRHLZTUSBT-UHFFFAOYSA-N 482.543 5.323 5 20 JKBD O=C(NCc1noc(-c2cccs2)n1)c1cc([N+](=O)[O-])ccc1Sc1ccc(Cl)cc1 604485873 HTCLYJRJQQPKMU-UHFFFAOYSA-N 472.935 5.441 5 20 JKBD Cc1nn(Cc2ccc(C(=O)Nc3cc(Br)ccc3Cl)cc2)c(C)c1[N+](=O)[O-] 608945267 BIVKFHYWUBTVBR-UHFFFAOYSA-N 463.719 5.125 5 20 JKBD O=C(c1ccccc1Sc1ccc(C(F)(F)F)cc1[N+](=O)[O-])N1CCC[C@@H](c2ncc[nH]2)C1 609025592 TVBPJGOZPKJJNK-CQSZACIVSA-N 476.480 5.508 5 20 JKBD Cc1ccc(/C(O)=C(/C(=S)Nc2ccccc2-c2ccccc2)[n+]2cccc(O)c2)cc1[N+](=O)[O-] 725763761 MMEQALFYRSACJS-UHFFFAOYSA-O 484.557 5.887 5 20 JKBD CC(=O)N(c1ccc(C(F)(F)F)cc1)c1nc(COC(=O)c2cc([N+](=O)[O-])ccc2C)cs1 742994837 QPEOSYWBFLBRIB-UHFFFAOYSA-N 479.436 5.420 5 20 JKBD C[C@H](OC(=O)c1csc(-c2ccc(Cl)c(Cl)c2)n1)C(=O)Nc1ccc(F)c([N+](=O)[O-])c1 744597238 QDHFRWDPHNKTBL-VIFPVBQESA-N 484.292 5.348 5 20 JKBD O=C(OCC1CCN(c2ccc([N+](=O)[O-])cn2)CC1)[C@H](Sc1ccccc1)c1ccccc1 750425382 BODOHBWNISNGAN-XMMPIXPASA-N 463.559 5.283 5 20 JKBD O=C(OCc1cc(-c2cccs2)on1)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 750437145 CIXDHKYQPWCRKP-UHFFFAOYSA-N 481.452 5.290 5 20 JKBD O=C(OCc1nnc(-c2ccc([N+](=O)[O-])cc2)o1)c1cc([N+](=O)[O-])ccc1Sc1ccccc1 778961462 RXLVMLFWOKWTEG-UHFFFAOYSA-N 478.442 5.061 5 20 JKBD C[C@H](OC(=O)c1sc(-c2ccco2)nc1-c1ccccc1)C(=O)Nc1ccccc1[N+](=O)[O-] 900281586 HUBIIHBVEFMSIO-AWEZNQCLSA-N 463.471 5.162 5 20 JKBD CC(C)(C)OC(=O)Nc1ccc(F)c(NC(=O)CCNc2ccc(C(F)(F)F)cc2[N+](=O)[O-])c1 915152417 XGPZVDUPAKFXQR-UHFFFAOYSA-N 486.422 5.540 5 20 JKBD Cc1c(C(=O)O[C@@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2ccccc2)oc2c1C(=O)CCC2 915454062 ZTSXXXVBXCHRKT-JOCHJYFZSA-N 482.876 5.205 5 20 JKBD CC(=O)N(c1nc(COC(=O)[C@H](C)Sc2ccc([N+](=O)[O-])cc2)cs1)c1ccc(C)cc1C 916522848 QZCONZWXOLIWCG-INIZCTEOSA-N 485.587 5.577 5 20 JKBD COc1ccc(N2C(=S)N[C@H](c3csc([N+](=O)[O-])c3)C(C(=O)Nc3ccc(F)cc3)=C2C)cc1 917378658 LZDUGHPEDVVZFJ-OAQYLSRUSA-N 498.561 5.153 5 20 JKBD Cc1c(C(=O)Nc2cc(Cl)c([N+](=O)[O-])cc2OCc2ccccc2)cnn1Cc1ccccc1 919682856 RAUWPAQKHBUUCY-UHFFFAOYSA-N 476.920 5.633 5 20 JKBD COc1cc(/C=C\C(=O)N(Cc2ccc([N+](=O)[O-])cc2)C(C)C)ccc1OCc1c(C)noc1C 919869251 UVUZCLFERALPEM-LCYFTJDESA-N 479.533 5.238 5 20 JKBD COc1cc(C(=O)N(C)c2ccc(C(C)(C)C)cc2)c([N+](=O)[O-])cc1OCc1cscn1 919883774 CMABOHBNGKUMCF-UHFFFAOYSA-N 455.536 5.213 5 20 JKBD CCN(CC)[C@@H](C(=O)NC1(c2ccc(NC(=O)c3ccc([N+](=O)[O-])o3)cc2)CCC1)c1ccccc1 1785751097 OUBDPJIOQUCBCY-XMMPIXPASA-N 490.560 5.019 5 20 JKBD O=C(/C=C/c1ccc([N+](=O)[O-])o1)NC1(c2ccc(NC(=O)C3CCC(F)(F)CC3)cc2)CCC1 1786242623 MRRPBAHFTKHVNE-SOFGYWHQSA-N 473.476 5.161 5 20 JKBD Cc1cc(CCCC(=O)NC2(c3ccc(NC(=O)c4ocnc4C)cc3)CCC2)c([N+](=O)[O-])cc1F 1787474520 ZVNKFHICXKGVQK-UHFFFAOYSA-N 494.523 5.109 5 20 JKBD O=C(/C=C/c1ccccc1[N+](=O)[O-])NC1(c2ccc(NC(=O)c3nccc4occc34)cc2)CCC1 1788342886 BXIJYBRFUPONJS-IZZDOVSWSA-N 482.496 5.197 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)Nc1ccc(C2(NC(=O)CCc3ccco3)CCC2)cc1 1790771096 OWDOWTIUVAECEC-UHFFFAOYSA-N 465.481 5.016 5 20 JKBD O=C(/C=C/c1ccc([N+](=O)[O-])o1)NC1(c2ccc(NC(=O)c3cc(F)cc(F)c3F)cc2)CCC1 1792124436 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21900813 QMPSTCPFFGAEJJ-OKILXGFUSA-N 478.471 5.307 5 20 JKBD COc1cc(C(=O)Nc2cccc(-c3nnco3)c2)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 24697336 IBKHLDAJCPWXJJ-UHFFFAOYSA-N 466.837 5.351 5 20 JKBD Cc1nn(Cc2ccc(C(=O)Nc3ccccc3SC3CCCC3)cc2)c(C)c1[N+](=O)[O-] 25265994 XJMKBRWIURHPOE-UHFFFAOYSA-N 450.564 5.743 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Cl)[C@H](NCc1cccnc1OC1CCCC1)c1ccccc1 30514906 IZBLLQWXLHKYCN-HSZRJFAPSA-N 480.952 5.434 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Cl)[C@H](c1ccccc1)N1CCC(OCc2ccccc2)CC1 477131546 HDSARHUNYDXSLC-VWLOTQADSA-N 479.964 5.609 5 20 JKBD CCOC(=O)c1sc(N(Cc2ccc(F)cc2)C(=O)CSc2ccc([N+](=O)[O-])cc2)nc1C 493176014 KRVWQJQBXTXHIT-UHFFFAOYSA-N 489.550 5.001 5 20 JKBD COc1ccc(-c2nc(CSCc3cc([N+](=O)[O-])cc4c3OCOC4)cs2)c(OC)c1 497865906 WSYMEGLIVSELNY-UHFFFAOYSA-N 460.533 5.035 5 20 JKBD C[C@H](Sc1nnc(-c2ccccc2)c2ccccc12)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 501181213 YDBPEOAATLURIJ-HNNXBMFYSA-N 455.499 6.108 5 20 JKBD CCN(C(=O)c1ccc(N[C@H](C)c2ccccn2)c([N+](=O)[O-])c1)c1ccc(Br)cc1 506207347 YCNDRVFWAPBISS-OAHLLOKOSA-N 469.339 5.592 5 20 JKBD CCN(C(=O)c1ccc(N[C@H](C)c2ccccn2)c([N+](=O)[O-])c1)[C@H](C)c1cc2ccccc2o1 509700700 ULISVVCACZLUCY-QZTJIDSGSA-N 458.518 6.132 5 20 JKBD COc1ccc(C)cc1C1(CNC(=O)c2cc([N+](=O)[O-])ccc2Sc2ccccc2)CCOCC1 510187039 VXOGLCFAZSWPFI-UHFFFAOYSA-N 492.597 5.541 5 20 JKBD Cc1csc(N(CC(F)(F)F)C(=O)c2ccc(NCc3ccccc3Cl)c([N+](=O)[O-])c2)n1 512638292 ICVSFQCDGPUCMU-UHFFFAOYSA-N 484.887 5.834 5 20 JKBD C[C@@H](NC(=O)Cc1ccc(NC(=O)c2ccc(Br)cc2)cc1)c1cccc([N+](=O)[O-])c1 515681678 CPVFEUKOPOJIEX-OAHLLOKOSA-N 482.334 5.030 5 20 JKBD CC(=O)Nc1ccc(Cl)c(NC(=O)c2ccc(NCc3ccccc3Cl)c([N+](=O)[O-])c2)c1 515728235 AGOJEAATOTVOCY-UHFFFAOYSA-N 473.316 5.724 5 20 JKBD CC1CCN(CCCCNC(=O)C/C(=C/c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)CC1 516325631 PTFKWMWQMCNJQM-PYCFMQQDSA-N 492.645 5.764 5 20 JKBD O=C(Nc1cccc(C(=O)Nc2ccccn2)c1)c1ccc(Nc2ccccc2)c([N+](=O)[O-])c1 522251616 RJZAZMDQMWFKNP-UHFFFAOYSA-N 453.458 5.238 5 20 JKBD O=C(Nc1ccc(F)cc1)N[C@@H]1CCN(C(=O)c2ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])cc2)C1 523207338 ZJVIEXCFFWTTLX-LJQANCHMSA-N 498.898 5.216 5 20 JKBD O=C(N[C@@H](c1ccccc1)c1ccc2nc(C(F)(F)F)[nH]c2c1)c1ccc(Cl)cc1[N+](=O)[O-] 592948552 CAZCWSMHNUPVTP-IBGZPJMESA-N 474.826 5.663 5 20 JKBD COc1ccc(CNCc2cn(Cc3ccccc3)nc2-c2ccc(Cl)cc2)cc1[N+](=O)[O-] 604473798 JLEIGMUGZWWGBR-UHFFFAOYSA-N 462.937 5.458 5 20 JKBD CCOc1c(Cl)cc(CNCc2ccc(-c3ccc([N+](=O)[O-])cc3Br)o2)cc1OC 608836009 CGWIWJMKESULGN-UHFFFAOYSA-N 495.757 5.968 5 20 JKBD Cc1ccc(-c2csc(NC(=O)c3cnc(Cc4ccc(F)cc4)s3)n2)cc1[N+](=O)[O-] 608896193 RZUOBFQRISRICM-UHFFFAOYSA-N 454.508 5.465 5 20 JKBD CSc1ccc(C(=O)c2ccccc2C(=O)N2CCO[C@H](c3ccc(F)c(F)c3)C2)cc1[N+](=O)[O-] 608965300 UGCFXMMXXPBUKT-QFIPXVFZSA-N 498.507 5.040 5 20 JKBD COc1ccc(Oc2ccc([N+](=O)[O-])cc2C(=O)N2CCC(CN(C)C(=O)OC(C)(C)C)CC2)cc1 728894442 FZRNENYPBHVCCR-UHFFFAOYSA-N 499.564 5.115 5 20 JKBD CC(=O)Nc1ccc(C2=N/C(=C/c3ccc(Oc4ccc(Cl)cc4[N+](=O)[O-])cc3)C(=O)O2)cc1 746016120 OTKVQQPOWJJAAO-UDWIEESQSA-N 477.860 5.343 5 20 JKBD O=C(C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)OCc1nnc(-c2ccccc2)o1 748579658 QPGDGYQVZWBDJQ-XMHGGMMESA-N 498.520 5.929 5 20 JKBD CC(C)n1ncc2c(C(=O)N(C)Cc3cc([N+](=O)[O-])ccc3Cl)cc(-c3cccs3)nc21 809864005 XJFLSQDJMVIMJD-UHFFFAOYSA-N 469.954 5.575 5 20 JKBD O=C(COc1ccc2c(-c3ccc([N+](=O)[O-])cc3)cc(=O)oc2c1)Nc1ccccc1Cl 844160939 OOXPGWZIBPAVRK-UHFFFAOYSA-N 450.834 5.039 5 20 JKBD CC(=O)Nc1ccc(NC(=O)c2ccc(NCc3ccccc3Cl)c([N+](=O)[O-])c2)cc1C 892704853 LFKUXNUCQVDMKP-UHFFFAOYSA-N 452.898 5.379 5 20 JKBD COc1cc(-c2nc(C3(NC(=O)OC(C)(C)C)CCC3)no2)c([N+](=O)[O-])cc1OCc1ccccc1 904555308 KRJZKNBKGLPXND-UHFFFAOYSA-N 496.520 5.136 5 20 JKBD Cc1ccc(S(=O)(=O)Oc2ccc(NC(=O)c3cc([N+](=O)[O-])ccc3Cl)cc2)c2cccnc12 906487356 YJCFFBDQYJXHJA-UHFFFAOYSA-N 497.916 5.125 5 20 JKBD Cc1sc(NC(=O)c2ccc(N3CCC(C)CC3)c([N+](=O)[O-])c2)c(C(N)=O)c1-c1ccccc1 918562870 ULWOKPXVPUJGKM-UHFFFAOYSA-N 478.574 5.219 5 20 JKBD CCN(CC)C(=O)c1ccccc1NC(=O)c1ccc(Sc2nc(C)cs2)c([N+](=O)[O-])c1 919874261 MIQYELCYHKJROD-UHFFFAOYSA-N 470.576 5.245 5 20 JKBD COc1ccc(C(=O)Nc2ccc(C3(NC(=O)c4cc(Cl)cc([N+](=O)[O-])c4C)CCC3)cc2)nc1 1788861024 GHELRIPALRVKDI-UHFFFAOYSA-N 494.935 5.022 5 20 JKBD O=C(NC1(c2ccc(NC(=O)c3cc4cccc(F)c4s3)cc2)CCC1)c1ccc([N+](=O)[O-])[nH]1 1788983677 ZQBMWCUJDVGKLT-UHFFFAOYSA-N 478.505 5.338 5 20 JKBD CC1(C)CCC(CC(=O)Nc2ccc(C3(NC(=O)c4ccc([N+](=O)[O-])[nH]4)CCC3)cc2)CC1 1790570396 DPKRXFGXNNAYBH-UHFFFAOYSA-N 452.555 5.277 5 20 JKBD COc1ccc(Cl)c(C(=O)Nc2ccc(C3(NC(=O)/C=C/c4ccc([N+](=O)[O-])o4)CCC3)cc2)c1 1792084007 LGSMUJBWWZAARY-DHZHZOJOSA-N 495.919 5.311 5 20 JKBD O=C(Cc1ccc(Cl)cc1[N+](=O)[O-])N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H]1CCC[C@@H]2CCCC[C@H]21 1797869603 MYTRCMBBQRYNOZ-HFJIGHFISA-N 488.028 5.035 5 20 JKBD CC[C@H](C)[C@@H](C(=O)N1CCCC2(CCN(C(=O)Cc3cccc([N+](=O)[O-])c3)CC2)C1)c1ccccc1 1809153536 JRKVFPJMDQXPCA-WXVAWEFUSA-N 491.632 5.198 5 20 JKBD CCCCC[C@@H](C)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)Cn2ccc3ccc([N+](=O)[O-])cc32)n[nH]1 1815074277 AJXQKVVWXWKVNY-XMSQKQJNSA-N 494.596 5.181 5 20 JKBD Cc1cccc(Cl)c1C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cccc(F)c2[N+](=O)[O-])[nH]n1 1821144369 AUGRYZKQOASWGQ-GOSISDBHSA-N 485.903 5.039 5 20 JKBD O=C(/C=C/c1ccccc1[N+](=O)[O-])N1CCC([C@H]2CCCCN2C(=O)Cc2ccccc2Cl)CC1 1826477281 XAPBIDKSQLOJCC-JHUUHBRDSA-N 496.007 5.124 5 20 JKBD Cc1cc(C(=O)Nc2ccc(Cl)c(S(=O)(=O)Nc3ccccc3Cl)c2)ccc1[N+](=O)[O-] 15501233 DFFYCHKGAMXWLZ-UHFFFAOYSA-N 480.329 5.263 5 20 JKBD O=C(NCCc1cn2ccccc2n1)c1ccccc1Sc1ccc(C(F)(F)F)cc1[N+](=O)[O-] 29981859 DBQXBFBIKIBBBT-UHFFFAOYSA-N 486.475 5.385 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Cl)[C@@H](NCc1cccnc1OC1CCCC1)c1ccccc1 30514902 IZBLLQWXLHKYCN-QHCPKHFHSA-N 480.952 5.434 5 20 JKBD CCOc1ccc([C@H](CNC(=O)c2cc([N+](=O)[O-])ccc2C)c2c[nH]c3ccccc23)cc1OC 72042873 FYYNICMQAUGEAP-QFIPXVFZSA-N 473.529 5.354 5 20 JKBD Cc1cc(SC2CCCCC2)ccc1NC(=O)CCCn1c(=O)oc2cc([N+](=O)[O-])ccc21 303036798 PDLORVADFTZGKN-UHFFFAOYSA-N 469.563 5.655 5 20 JKBD O=C(CCc1nc2cc(C(F)(F)F)ccc2s1)Nc1cc([N+](=O)[O-])ccc1OC(F)F 409799040 ZBXHUBLUOPGGOA-UHFFFAOYSA-N 461.368 5.396 5 20 JKBD COc1cc([C@H](C)NC(=O)c2cc(SC)c(OC)cc2[N+](=O)[O-])ccc1OCc1ccccc1 483464482 LSOYUAMFFFNMKZ-INIZCTEOSA-N 482.558 5.404 5 20 JKBD Cc1csc(Sc2ccc(C(=O)NCCC(=O)Nc3cccc(Cl)c3C)cc2[N+](=O)[O-])n1 505326524 VDDUKTPSXYZZOU-UHFFFAOYSA-N 490.994 5.231 5 20 JKBD CCCc1ccc([C@H](NC(=O)c2cc(OC)c(OCC)cc2[N+](=O)[O-])c2cccs2)cc1 507206377 ZDMYQVZDIVJSIX-QHCPKHFHSA-N 454.548 5.536 5 20 JKBD COc1cccc([C@@H](CNC(=O)c2cc3cccc([N+](=O)[O-])c3[nH]2)c2c[nH]c3ccccc23)c1OC 511998923 LTKUBNSWBCNSNA-HXUWFJFHSA-N 484.512 5.137 5 20 JKBD CCOc1cc(CN[C@@H]2CCc3c(C)cccc32)ccc1OCc1cc([N+](=O)[O-])cc2c1OCOC2 518275874 WUNVBRLEGTWIQH-RUZDIDTESA-N 490.556 5.525 5 20 JKBD COc1ccc(CC[C@H]2CCCCN2C(=O)Cn2c3ccccc3c(=O)c3ccccc32)cc1OC 522371328 JBALPYNTKBQFJY-JOCHJYFZSA-N 484.596 5.186 5 20 JKBD COc1ccc([C@@H](NC(=O)c2ccc(N[C@H](C)c3ccccn3)c([N+](=O)[O-])c2)c2ccccc2)cc1 604296273 MTLPAQPHLAFMJM-WINIVTDRSA-N 482.540 5.691 5 20 JKBD CN(C(=O)c1ccc(Nc2ccccc2)c([N+](=O)[O-])c1)[C@@H](c1cccc(F)c1)c1cnn(C)c1 608799776 IFTWPIQTQBUAMR-DEOSSOPVSA-N 459.481 5.073 5 20 JKBD CCC[C@@H](NC(=O)c1cc(OC)c(OC(F)F)cc1[N+](=O)[O-])c1cccc(C(F)(F)F)c1 608851430 UAESHUXLZONAAW-CQSZACIVSA-N 462.371 5.495 5 20 JKBD CC(C)(C)c1csc(CCN[C@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2ccccc2)n1 609222188 XBLHRSZEDUWPRH-NRFANRHFSA-N 472.998 5.514 5 20 JKBD Cc1ccc(-c2csc(NC(=O)c3c(-c4ccccc4Cl)noc3C)n2)cc1[N+](=O)[O-] 619729394 YMORXFDKLNPFQC-UHFFFAOYSA-N 454.895 5.896 5 20 JKBD C[C@@H](Nc1ccc(C(=O)Nc2ccccc2SC(F)(F)F)cc1[N+](=O)[O-])c1ccccn1 726534388 AFBAEWKASUWUQK-CYBMUJFWSA-N 462.453 6.027 5 20 JKBD O=C(Nc1nc(Cc2ccccc2)c(-c2ccccc2)s1)c1cc(F)c(F)cc1[N+](=O)[O-] 727709228 YPYVNJCGSWMZLN-UHFFFAOYSA-N 451.454 5.840 5 20 JKBD O=C(O[C@@H](C(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1)c1ccccc1)[C@H]1CCOc2ccccc21 728358997 NIEOTLXYBVEMMN-PGRDOPGGSA-N 466.877 5.038 5 20 JKBD O=C(Nc1ccccc1C(=O)N[C@@H]1CCCOc2ccccc21)c1ccc([N+](=O)[O-])cc1Cl 749861538 BJDFMUZHPJYYMW-HXUWFJFHSA-N 465.893 5.144 5 20 JKBD CC(=O)N(c1nc(COC(=O)CSc2ccccc2[N+](=O)[O-])cs1)c1ccc(C)cc1C 819011846 YJQDWGISUSDFTK-UHFFFAOYSA-N 471.560 5.188 5 20 JKBD C[C@@H](OC(=O)c1cc([N+](=O)[O-])ccc1N1CCCC1)C(=O)Nc1ccccc1-c1ccccc1 846285429 SUQGWSJVSDAVSZ-GOSISDBHSA-N 459.502 5.046 5 20 JKBD CC(C)[C@@H](OC(=O)Cn1c2ccccc2c(=O)c2ccccc21)C(=O)Nc1ccccc1C(F)(F)F 915385412 XGJRVYBSLIKIGZ-RUZDIDTESA-N 496.485 5.380 5 20 JKBD O=C(CSc1ccccc1C(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1)NCC1CCCCC1 916694556 GMPGQZNZSJTSNN-UHFFFAOYSA-N 461.971 5.289 5 20 JKBD O=[N+]([O-])c1cc(C(F)(F)F)c(Cl)cc1Sc1nnc(N2CCCC2)n1Cc1ccco1 917033804 JRHURUAZRLRKFS-UHFFFAOYSA-N 473.864 5.251 5 20 JKBD Cn1ccc(COC(=O)c2c3c(nc4ccccc24)/C(=C\c2cccc([N+](=O)[O-])c2)CCC3)cc1=O 918873668 VDMASORCHDUABX-ZHZULCJRSA-N 481.508 5.076 5 20 JKBD CC(=O)N(c1nc(COC(=O)c2cc([N+](=O)[O-])ccc2F)cs1)c1c(C)cc(C)cc1Cl 919251495 WETGNLPCLDFVHB-UHFFFAOYSA-N 477.901 5.502 5 20 JKBD COc1cc(C(=O)NC[C@@H]2CCCC[C@H]2C(C)(C)C)c([N+](=O)[O-])cc1OCc1cscn1 920042574 ZEWACZIAHYKAGN-MAUKXSAKSA-N 461.584 5.221 5 20 JKBD Cc1c(C(=O)N(Cc2nnc(-c3cccc([N+](=O)[O-])c3)o2)C(C)C)sc2cccc(F)c12 921240597 DLGMOVXTWYJEIX-UHFFFAOYSA-N 454.483 5.358 5 20 JKBD CCc1ncccc1C(=O)NC1(c2ccc(NC(=O)Cc3ccc(Cl)cc3[N+](=O)[O-])cc2)CCC1 1786114906 MJLATXUEFFGCHV-UHFFFAOYSA-N 492.963 5.196 5 20 JKBD COc1ccc(CC(=O)NC2(c3ccc(NC(=O)CCCC(F)(F)F)cc3)CCC2)c([N+](=O)[O-])c1 1786621664 QVHCLDKPYNSAFP-UHFFFAOYSA-N 493.482 5.013 5 20 JKBD Cc1cc[nH]c1C(=O)Nc1ccc(C2(NC(=O)c3cc(Br)ccc3[N+](=O)[O-])CCC2)cc1 1787103429 ZMGIDHHESQSVPZ-UHFFFAOYSA-N 497.349 5.055 5 20 JKBD Cc1cccc(C)c1SCC(=O)Nc1ccc(C2(NC(=O)c3ccc([N+](=O)[O-])o3)CCC2)cc1 1789643376 QMVMPJPZGBMVNP-UHFFFAOYSA-N 479.558 5.345 5 20 JKBD Cc1c(C(=O)N2CCCC[C@H]2c2cc(NC(=O)[C@@H](F)c3ccccc3)n[nH]2)cc(Cl)cc1[N+](=O)[O-] 1815557394 VSZMZEDQJPGMHU-UGKGYDQZSA-N 499.930 5.296 5 20 JKBD O=C(Nc1cc([C@@H]2CCCCN2C(=O)/C=C/c2ccccc2[N+](=O)[O-])[nH]n1)c1cc2ccccc2o1 1818634229 UYNYOAPCWKQWNO-IWGBCORSSA-N 485.500 5.083 5 20 JKBD C[C@@H](C(=O)N1CCC([C@@H]2CCCCN2C(=O)Cc2ccc(Cl)cc2[N+](=O)[O-])CC1)c1ccccc1 1824157706 BERVBUKLANHEAW-DVECYGJZSA-N 498.023 5.214 5 20 JKBD CCC[C@@H](C(=O)N1CCCC[C@H]1C1CCN(C(=O)/C=C/c2ccccc2[N+](=O)[O-])CC1)n1cccc1 1827635145 XOAJCCATBIPENW-NYUHFOLESA-N 492.620 5.071 5 20 JKBD Cc1ccc(CC(=O)N2CCCC[C@H]2C2CCN(C(=O)c3sccc3Cl)CC2)cc1[N+](=O)[O-] 1830364403 AEKLPKIZEJLHAB-FQEVSTJZSA-N 490.025 5.094 5 20 JKBD O=C(/C=C/c1ccccc1[N+](=O)[O-])N1CCC([C@@H]2CCCCN2C(=O)c2cccc3ccncc23)CC1 1830866891 JOCFKNPAXFTAIB-GIPLCNRYSA-N 498.583 5.090 5 20 JKBD Cc1ccc([N+](=O)[O-])cc1NC(=O)CSc1nnc(-c2ccccc2Cl)n1Cc1ccccc1 8989088 KIMYTZXNJSYGJD-UHFFFAOYSA-N 493.976 5.594 5 20 JKBD COc1cc2c(cc1OC)CN([C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1)CC2 16554167 DRYKEJKIAQWAKG-DEOSSOPVSA-N 481.936 5.004 5 20 JKBD Cc1cccc(Nc2nnc(S[C@@H](C)c3nnc(-c4ccc([N+](=O)[O-])cc4)o3)s2)c1C 17533481 MRYJMABPLBGYAZ-ZDUSSCGKSA-N 454.537 5.710 5 20 JKBD CC(C)n1ncc2c(C(=O)O[C@H](C)c3nnc(-c4ccc([N+](=O)[O-])cc4)o3)cc(-c3ccccc3)nc21 17709242 GILXJMDQGWJWJR-MRXNPFEDSA-N 498.499 5.555 5 20 JKBD C[C@@H](Sc1nnc(N2CCCC2)n1-c1ccccc1Cl)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 17880597 NJAYHZZRXDUAKK-CQSZACIVSA-N 497.968 5.332 5 20 JKBD Cc1ccc([C@@H](NC(=O)CSc2nc3cc4ccccc4cc3c(=O)n2C)c2cccs2)cc1 17982003 QGDPRZTVZSSAII-RUZDIDTESA-N 485.634 5.455 5 20 JKBD C[C@H](Sc1nnc(-c2ccccc2)c2ccccc12)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl 20991814 CATLXXYXTJQJNJ-AWEZNQCLSA-N 464.934 5.978 5 20 JKBD O=C(CSc1ncnc2scc(-c3ccc(F)cc3)c12)Nc1ccc([N+](=O)[O-])cc1Cl 21122977 QKXUJLHTPDHMNM-UHFFFAOYSA-N 474.926 5.790 5 20 JKBD C[C@@H](c1nnc(SCc2nc(-c3cccc([N+](=O)[O-])c3)no2)n1-c1ccccc1)N1CCCCC1 31844536 MMHJGVXRQVTJIX-KRWDZBQOSA-N 491.577 5.065 5 20 JKBD CS(=O)(=O)Cc1ccc(C(=O)Nc2cc([N+](=O)[O-])ccc2Nc2cccc(C(F)(F)F)c2)cc1 32531790 CPHVYULKKVVLGA-UHFFFAOYSA-N 493.463 5.154 5 20 JKBD Cc1csc(Sc2ccc(C(=O)Nc3ccc(NC(=O)c4cccs4)cc3)cc2[N+](=O)[O-])n1 501768827 WPFYLWHTACDEFV-UHFFFAOYSA-N 496.595 6.077 5 20 JKBD O=C(Nc1cccc(NC(=O)c2ccc([N+](=O)[O-])s2)c1)Nc1cccc(C(F)(F)F)c1 510295514 ADQTZSBNRUOOCB-UHFFFAOYSA-N 450.398 5.571 5 20 JKBD CCOc1cc(NC(=O)c2cnn(-c3ccccc3C)c2C(F)(F)F)c([N+](=O)[O-])cc1OCC 514901366 BKDODWNFIFHXTQ-UHFFFAOYSA-N 478.427 5.157 5 20 JKBD O=C(CSc1ccccc1C(=O)NCc1ccc([N+](=O)[O-])cc1)Nc1cc(Cl)cc(Cl)c1 516131697 AEXWPZHMSBDMGA-UHFFFAOYSA-N 490.368 5.562 5 20 JKBD Cc1cccc2c1CC[C@@H]2N[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Br)c1ccccc1 517934326 PDBZJHJANVSARV-GMAHTHKFSA-N 480.362 5.623 5 20 JKBD O=[N+]([O-])c1ccc(-c2ccc(CN[C@H]3CCCOc4ccc(F)cc43)o2)c(Br)c1 518771815 FYRHENORJHCKGZ-IBGZPJMESA-N 461.287 5.760 5 20 JKBD Cc1ccc(-c2csc(NC(=O)c3cnc4ccccc4c3C(F)(F)F)n2)cc1[N+](=O)[O-] 591888467 NGUDKWNZYGVMNB-UHFFFAOYSA-N 458.421 5.846 5 20 JKBD COc1ccc([C@@H](CNC(=O)[C@H](C)Sc2ccc([N+](=O)[O-])cc2)c2c[nH]c3ccccc23)cc1 603819590 NIWKDUCRBXXPOM-GAJHUEQPSA-N 475.570 5.514 5 20 JKBD C[C@@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)Nc1ccc(NC(=O)Nc2ccccc2)cc1 604447369 XUAWVUZFOXECRH-CQSZACIVSA-N 454.870 5.298 5 20 JKBD C[C@H](Nc1ccc(C(=O)N2CCCC[C@H]2Cc2ccc(F)cc2)cc1[N+](=O)[O-])c1ccccn1 609187682 UBLIKVTXBZIPKJ-AVRDEDQJSA-N 462.525 5.539 5 20 JKBD CC(C)(C)OC(=O)N[C@@H](C(=O)Oc1ccc(NC(=O)c2cccc([N+](=O)[O-])c2)cc1)c1ccccc1 727121718 MPZDSFRRJPRGPF-JOCHJYFZSA-N 491.500 5.019 5 20 JKBD COc1ccc(C)cc1NC(=O)[C@@H](OC(=O)c1cc(SC)c(OC)cc1[N+](=O)[O-])c1ccccc1 728651379 VHEYQZWVVHQDPK-QHCPKHFHSA-N 496.541 5.179 5 20 JKBD O=C(Nc1ccc2nc(-c3cc(F)ccc3F)[nH]c2c1)c1cc([N+](=O)[O-])ccc1Br 751095778 MXZCBZDQBQZKRD-UHFFFAOYSA-N 473.233 5.431 5 20 JKBD O=C(Nc1ccc(Cl)cn1)C1CCN(c2cc(Cl)c(C(F)(F)F)cc2[N+](=O)[O-])CC1 917390804 KVDJTLDTACSYNZ-UHFFFAOYSA-N 463.243 5.171 5 20 JKBD C[C@@H](Nc1ccc(C(=O)OCC(=O)c2ccc(Cl)cc2Cl)cc1[N+](=O)[O-])c1ccccn1 920544615 DGLYZKRHFNWHNZ-CYBMUJFWSA-N 474.300 5.509 5 20 JKBD C[C@H](OC(=O)c1ccc(N[C@H](C)c2ccccn2)c([N+](=O)[O-])c1)C(=O)N1CCC[C@H]1c1cccs1 920546339 YHIBSQLNDBVVND-WWMYMODYSA-N 494.573 5.133 5 20 JKBD O=C(Cc1cccc([N+](=O)[O-])c1)Nc1ccc(C2(NC(=O)C[C@@H]3C[C@@H]4CC[C@H]3C4)CCC2)cc1 1785795217 CZVLYNXKOPDDNP-HKBOAZHASA-N 461.562 5.098 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)c3cc(Br)ccc3[N+](=O)[O-])CCC2)cc1)c1ccco1 1787271329 MFNQYWZREBHRIJ-UHFFFAOYSA-N 484.306 5.012 5 20 JKBD COc1cc(CC(=O)Nc2ccc(C3(NC(=O)/C=C/c4ccsc4)CCC3)cc2)ccc1[N+](=O)[O-] 1790477859 MAXMBVICNOHWBE-ONNFQVAWSA-N 491.569 5.055 5 20 JKBD CN(C)c1ccc([N+](=O)[O-])cc1C(=O)Nc1ccc(C2(NC(=O)C3(F)CCCCC3)CCC2)cc1 1790794141 GKZVUXUTSGVLOW-UHFFFAOYSA-N 482.556 5.081 5 20 JKBD O=C(/C=C/c1ccccc1[N+](=O)[O-])Nc1ccc(C2(NC(=O)c3cc4sccn4c3)CCC2)cc1 1792317671 CXKUIOWWYOTPFU-IZZDOVSWSA-N 486.553 5.370 5 20 JKBD CC(C)(C)CCCCCC(=O)NC[C@@H]1CCN(C(=O)c2ccc(O)c([N+](=O)[O-])c2)[C@H]1c1cccnc1 1812809412 QINYRTZIPZVWAP-OFVILXPXSA-N 496.608 5.012 5 20 JKBD Cc1ccc(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)CSc3ccccc3[N+](=O)[O-])n[nH]2)cc1C 1822312613 BYXFTCXWQXCDDQ-HXUWFJFHSA-N 493.589 5.033 5 20 JKBD Cc1c(C(=O)N2CCC([C@@H]3CCCCN3C(=O)/C=C/c3ccoc3)CC2)cc(Cl)cc1[N+](=O)[O-] 1825055522 JSKRHACFIHKZAP-BDNZGDGKSA-N 485.968 5.096 5 20 JKBD O=C(/C=C/c1ccccc1[N+](=O)[O-])N1CCC([C@H]2CCCCN2C(=O)c2sccc2Cl)CC1 1829446654 WJXGGOQWPMDQOF-NDDJGDGRSA-N 488.009 5.256 5 20 JKBD O=C(c1cc2cc([N+](=O)[O-])ccc2s1)N1CCC([C@@H]2CCCCN2C(=O)c2ccc(F)cc2)CC1 1830021682 ONBQYTARZWEQFY-QFIPXVFZSA-N 495.576 5.496 5 20 JKBD Cc1cc2[nH]c(C(=O)N3CCC([C@H]4CCCCN4C(=O)c4ccc([N+](=O)[O-])cc4F)CC3)cc2s1 1830498860 LQAGBZWYNHRPDK-JOCHJYFZSA-N 498.580 5.132 5 20 JKBD Cc1ccc(F)c(C(=O)N2CCCC[C@H]2C2CCN(C(=O)CSc3ccccc3[N+](=O)[O-])CC2)c1 1830557629 JRIQNJBBDBPCLE-QFIPXVFZSA-N 499.608 5.068 5 20 JKBD O=C(c1ccc(O)cc1)N1CCC([C@H]2CCCCN2C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)CC1 1831060663 DFYZPOMMIRUFEG-JOCHJYFZSA-N 493.585 5.062 5 20 JKBD Cc1ccc(CC(=O)N2CCC([C@@H]3CCCCN3C(=O)C3(C)CCCCC3)CC2)cc1[N+](=O)[O-] 1831797822 GMCMFIKOKKYOIC-QHCPKHFHSA-N 469.626 5.036 5 20 JKBD C[C@]1(C(=O)N2CCCC[C@H]2C2CCN(C(=O)c3cc4cc([N+](=O)[O-])ccc4s3)CC2)CC1(F)F 1832810119 PVDOZKUYHAZJKW-FDDCHVKYSA-N 491.560 5.088 5 20 JKBD CC(C)C(=O)Nc1ccc(NC(=O)c2ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])cc2)cc1 16017044 MSPOGPOQZQUYKI-UHFFFAOYSA-N 453.882 5.887 5 20 JKBD CCOc1ccc([C@H]2CCCN2C(=O)C2CCN(c3ccc(C(F)(F)F)cc3[N+](=O)[O-])CC2)cc1 16141836 AGVQZKRPKUVNNR-OAQYLSRUSA-N 491.510 5.592 5 20 JKBD Cc1ccc(-c2nnc([C@H](C)OC(=O)c3ccccc3C(=O)c3ccc(Cl)c([N+](=O)[O-])c3)o2)cc1 17528581 BIAVWIPMJNAHRA-HNNXBMFYSA-N 491.887 5.756 5 20 JKBD Cc1ccc(-c2nnc([C@H](C)OC(=O)c3ccc(NCc4ccccc4)c([N+](=O)[O-])c3)o2)cc1 17656728 PMROXFXWBDJTAE-KRWDZBQOSA-N 458.474 5.483 5 20 JKBD COc1cccc([C@@H](CNC(=O)Nc2cccc([N+](=O)[O-])c2)c2c[nH]c3ccccc23)c1OC 24367332 FFIMUPKKIFPNTK-OAQYLSRUSA-N 460.490 5.047 5 20 JKBD Cc1c(C(=O)Nc2nc(-c3cccc([N+](=O)[O-])c3)cs2)sc2nc(C(F)(F)F)ccc12 71873216 OWWVKNNSVVYBQH-UHFFFAOYSA-N 464.450 5.908 5 20 JKBD C[C@@H](Nc1ccc(C(=O)Nc2ccc(CCN3CCCC3)cc2)cc1[N+](=O)[O-])c1ccccn1 108917047 UBXMOBRBDFSIIE-LJQANCHMSA-N 459.550 5.054 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)Nc2ccc(Sc3nnc(C)s3)cc2C)cc1SC 483549578 DKIIDGQGCLPTKP-UHFFFAOYSA-N 462.578 5.197 5 20 JKBD COc1ccc([C@H](NC(=O)c2ccc([N+](=O)[O-])cc2Cl)c2ccccc2)cc1Br 485258866 QBYWKVCAVVDMQO-HXUWFJFHSA-N 475.726 5.539 5 20 JKBD COc1cc(C(=O)Nc2cnccc2Oc2ccccc2)c([N+](=O)[O-])cc1OCc1cscn1 499620283 DTEWKMQQAKLZNX-UHFFFAOYSA-N 478.486 5.079 5 20 JKBD CSc1ccc(NC(=O)Cn2cc(NC(=O)c3cc4ccccc4c4cccnc34)cn2)cc1 501101365 BCGIGGDEQSRKKH-UHFFFAOYSA-N 467.554 5.197 5 20 JKBD COCCN(CC(F)F)C(=O)c1ccccc1Sc1ccc(C(F)(F)F)cc1[N+](=O)[O-] 504905001 ADOGJJUDRIMBLO-UHFFFAOYSA-N 464.412 5.119 5 20 JKBD C[C@@H](Nc1ccc(C(=O)N[C@@H]2CCSc3c(F)cccc32)cc1[N+](=O)[O-])c1ccccn1 506087627 SBNAEPPYDIEXJJ-AUUYWEPGSA-N 452.511 5.269 5 20 JKBD COc1cc(C(=O)Nc2nc(-c3ccccc3C)cs2)c([N+](=O)[O-])cc1OCc1cscn1 511152421 JDUMWRJJDBMQSS-UHFFFAOYSA-N 482.543 5.323 5 20 JKBD Cc1ccc(Sc2ccc(CNCc3ccc(-n4nc(C)cc4C)nc3)cc2[N+](=O)[O-])cc1 512850522 STYDGUDXPBDLRA-UHFFFAOYSA-N 459.575 5.542 5 20 JKBD COC(=O)c1ccc([N+](=O)[O-])c(OCc2csc(N(C(C)=O)c3cccc(C(F)(F)F)c3)n2)c1 515289261 UWLWMJJRCOQKFJ-UHFFFAOYSA-N 495.435 5.120 5 20 JKBD CCN(C[C@@H]1CCCO1)C(=O)C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1 520107396 NMJBWFONLLWBFJ-GJPUVDBCSA-N 451.548 5.163 5 20 JKBD C[C@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)Nc1cccc(NC(=O)Nc2ccccc2)c1 520439127 QGWQUBZOJPEQOG-AWEZNQCLSA-N 454.870 5.298 5 20 JKBD O=C(c1cc2cc([N+](=O)[O-])ccc2s1)N1CCC[C@@H](c2nc(-c3ccc(F)cc3)no2)C1 523282553 SBHAYHCEYJUPBH-CQSZACIVSA-N 452.467 5.018 5 20 JKBD CCCN1Cc2cccc(NC(=O)C3CCN(c4ccc(C(F)(F)F)cc4[N+](=O)[O-])CC3)c2C1 524066144 XXBUHRCPBSITLQ-UHFFFAOYSA-N 476.499 5.194 5 20 JKBD CC(C)Oc1cccc([C@H](C)N[C@@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2ccccc2)c1 604044814 COGGTZRTXSFUDM-BXKMTCNYSA-N 467.953 6.066 5 20 JKBD COc1cc(C(=O)N(Cc2ccco2)Cc2ccc(C)s2)c([N+](=O)[O-])cc1OCc1cscn1 604457008 DCXXYRNJWRTBJJ-UHFFFAOYSA-N 499.570 5.444 5 20 JKBD COc1ccc(C2(NC(=O)c3ccc(Oc4ccc(Cl)cc4[N+](=O)[O-])cc3)CCOCC2)cc1 604569252 VSEBFGZWANIPHO-UHFFFAOYSA-N 482.920 5.485 5 20 JKBD CC(=O)Nc1ccc(NC(=O)Cc2cn(-c3ccccc3)nc2-c2ccc([N+](=O)[O-])cc2)c(Cl)c1 609018525 FARBFYTUUXHKMI-UHFFFAOYSA-N 489.919 5.241 5 20 JKBD C[C@@H](NC(=O)c1ccc(C(=O)N[C@H](C)c2c(F)cccc2F)c([N+](=O)[O-])c1)c1c(F)cccc1F 609044073 UWGKCJKAMOPMOX-CHWSQXEVSA-N 489.425 5.133 5 20 JKBD COc1ccc(NC(=O)c2c[nH]c3cc([N+](=O)[O-])ccc23)cc1OCc1ccc2ccccc2n1 609074202 LOCIYCFPQASRAS-UHFFFAOYSA-N 468.469 5.464 5 20 JKBD O=C(C1CCN(c2ccccc2[N+](=O)[O-])CC1)N1CCc2sccc2[C@H]1c1cccs1 609549694 KDTKIOOYJGDCPJ-QFIPXVFZSA-N 453.589 5.109 5 20 JKBD Cc1ccc(Sc2ccc(CN[C@@H](C)c3ccc(N4CCOC4=O)cc3)cc2[N+](=O)[O-])cc1 725848449 SRHJDISLHDFADX-SFHVURJKSA-N 463.559 5.862 5 20 JKBD CN(Cc1cn(-c2ccccc2)nc1-c1cccs1)C(=O)c1cc(F)c(F)cc1[N+](=O)[O-] 727706685 XYXKVBHUSGQYPK-UHFFFAOYSA-N 454.458 5.059 5 20 JKBD CC(=O)N(c1ccc(Cl)cc1)c1nc(COC(=O)[C@H](C)Sc2ccc([N+](=O)[O-])cc2)cs1 918875998 VUQZDCCEOGQHGC-ZDUSSCGKSA-N 491.978 5.613 5 20 JKBD O=C(/C=C/c1ccc([N+](=O)[O-])o1)Nc1ccc(C2(NC(=O)C34CCC(CC3)CC4)CCC2)cc1 1786208234 QSILNFRWBWGSBW-SOFGYWHQSA-N 463.534 5.306 5 20 JKBD COc1ccsc1C(=O)NC1(c2ccc(NC(=O)CCc3cccc([N+](=O)[O-])c3)cc2)CCC1 1786602091 AOLVOVDCXOFFKT-UHFFFAOYSA-N 479.558 5.045 5 20 JKBD O=C(NC1(c2ccc(NC(=O)c3ccncc3-c3ccccc3)cc2)CCC1)c1ccc([N+](=O)[O-])[nH]1 1789934537 FQVPDOFAXTZVSG-UHFFFAOYSA-N 481.512 5.046 5 20 JKBD CC(C)CCC(=O)Nc1ccc(C2(NC(=O)Cn3ccc4ccc([N+](=O)[O-])cc43)CCC2)cc1 1791251688 QJBYKKMOELKAOD-UHFFFAOYSA-N 462.550 5.120 5 20 JKBD Cc1cc(CCCC(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2ccc4occc4c2)C3)c([N+](=O)[O-])cc1F 1793403531 WYTHOOSFAXCUBI-KOUNCHBCSA-N 493.535 5.063 5 20 JKBD Cc1c(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)[C@@H]2CCC[C@H]3CCCC[C@@H]32)cc(Cl)cc1[N+](=O)[O-] 1797875053 OEBZKNHVFXYUPS-FKOZLKKJSA-N 488.028 5.415 5 20 JKBD C[C@@H](CC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cc3cc([N+](=O)[O-])ccc3s1)C2)c1ccccc1 1801752703 SAIRVOZBDWCGNB-DVWBAYGPSA-N 477.586 5.255 5 20 JKBD Cc1ccc(CC(=O)N2CCCC[C@@H]2C2CCN(C(=O)C[C@@H](C)c3ccccc3)CC2)cc1[N+](=O)[O-] 1830365256 ZXESAABPAOPQBL-ATIYNZHBSA-N 491.632 5.259 5 20 JKBD CC(C)CCC(=O)N1CCCC[C@@H]1C1CCN(C(=O)C2(c3cccc([N+](=O)[O-])c3)CCC2)CC1 1831383151 YMFMFUWOBCGYLC-XMMPIXPASA-N 469.626 5.072 5 20 JKBD O=C(c1cc(F)cc(Cl)c1)N1CCC([C@H]2CCCCN2C(=O)/C=C/c2ccccc2[N+](=O)[O-])CC1 1832903473 DVSUXGMCLUPEMW-UPWIVDSGSA-N 499.970 5.334 5 20 JKBD O=C(CSc1nnc(-c2ccccc2Cl)n1Cc1ccccc1)Nc1cc([N+](=O)[O-])ccc1F 8989209 VGIPOUVKXOQFIH-UHFFFAOYSA-N 497.939 5.425 5 20 JKBD COc1ccc(C(=O)OCc2csc(N(C(C)=O)c3ccc(Cl)c(Cl)c3)n2)cc1[N+](=O)[O-] 11341799 JCARUDNRVDWXCQ-UHFFFAOYSA-N 496.328 5.408 5 20 JKBD Cc1cccc([N+](=O)[O-])c1NC(=O)CSc1nnc(Cc2cccs2)n1CCc1ccccc1 12743881 JPKFQENVMNOUDP-UHFFFAOYSA-N 493.614 5.121 5 20 JKBD C[C@H](OC(=O)c1cc2cc([N+](=O)[O-])ccc2s1)C(=O)Nc1ccc(Cl)cc1C(F)(F)F 16800357 YVUWZFQHDNEIQP-VIFPVBQESA-N 472.828 5.666 5 20 JKBD C[C@H](Sc1nnc(Cc2cccs2)n1C1CC1)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 17273344 KIROLACIDWPRGK-NSHDSACASA-N 497.524 5.312 5 20 JKBD Cc1onc(-c2ccccc2)c1-c1nnc(CSc2nc3cc4ccccc4cc3c(=O)n2C)o1 24970329 WCJCLSMUEBEYPM-UHFFFAOYSA-N 481.537 5.392 5 20 JKBD CN(C)[C@H](CNC(=O)c1ccccc1Sc1ccc(C(F)(F)F)cc1[N+](=O)[O-])c1ccsc1 25815089 GFHODYDRZHATMO-GOSISDBHSA-N 495.548 5.859 5 20 JKBD O=C(C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)NCCc1nc2ccccc2[nH]1 30015324 TVXFXQUOOPEJQR-SDXDJHTJSA-N 483.553 5.370 5 20 JKBD Cc1onc(-c2ccccc2)c1-c1nnc(COc2ccc([N+](=O)[O-])cc2Cc2ccccc2)o1 31767674 SSKZOCDFUJLWQN-UHFFFAOYSA-N 468.469 5.778 5 20 JKBD COc1ccc([C@@H](C)N(C)C(=O)Cc2cn(-c3ccccc3)nc2-c2ccc([N+](=O)[O-])cc2)cc1 105776871 KDMSFRVBZVEAJH-LJQANCHMSA-N 470.529 5.218 5 20 JKBD O=C(CSc1ccc([N+](=O)[O-])cc1)N(Cc1ccc(Cl)c(Cl)c1)Cc1ccccn1 109206429 HNCRKGNLLOCSLS-UHFFFAOYSA-N 462.358 5.618 5 20 JKBD Cc1csc(Sc2ccc(C(=O)N3CCC(Oc4ccc(F)cc4F)CC3)cc2[N+](=O)[O-])n1 195641561 BWISWOUEIJLRBX-UHFFFAOYSA-N 491.541 5.473 5 20 JKBD CCc1c(-c2ccncc2)n[nH]c1NC(=O)c1ccc(Sc2nc(C)cs2)c([N+](=O)[O-])c1 302994981 HHNLEYQYEIAXOC-UHFFFAOYSA-N 466.548 5.111 5 20 JKBD CCOc1cc([N+](=O)[O-])c(C(=O)Nc2sc3c(c2C(=O)c2ccco2)CC[C@H](C)C3)cc1OC 503088900 VMWLUQHPOYNGHW-ZDUSSCGKSA-N 484.530 5.265 5 20 JKBD CSc1ccc([C@H](CNC(=O)N(C)Cc2ccccc2[N+](=O)[O-])N2CCc3sccc3C2)cc1 505168360 VBXBJCRFWVARLD-QHCPKHFHSA-N 496.658 5.319 5 20 JKBD Cc1nnc(Sc2ccc(NC(=O)c3ccc(NCc4ccccc4)c([N+](=O)[O-])c3)c(C)c2)s1 505941430 BDUZJZLFHMTMDJ-UHFFFAOYSA-N 491.598 6.079 5 20 JKBD O=C(NC[C@H]1CCCO1)c1cccc(CNCc2ccc(Oc3ccccc3Cl)c([N+](=O)[O-])c2)c1 509572587 XQPZXBQWSPAPJO-OAQYLSRUSA-N 495.963 5.239 5 20 JKBD Cc1cccc(-c2nc(C(C)C)no2)c1NC(=O)c1ccc(SCCC(C)C)c([N+](=O)[O-])c1 510079954 VEEWZHTVEBZJOH-UHFFFAOYSA-N 468.579 6.467 5 20 JKBD CCOc1ccc(Oc2cc(CNc3ccc([N+](=O)[O-])c(C(=O)N4CCCC4)c3)ccn2)cc1 515433892 ITIGKKKTZFUJRT-UHFFFAOYSA-N 462.506 5.029 5 20 JKBD COc1ccc(NC(=O)c2ccc(N3C[C@@H](C)C[C@@H](C)C3)c([N+](=O)[O-])c2)cc1OCc1cccnc1 515498018 GNLUHFKEVLHCCI-KDURUIRLSA-N 490.560 5.312 5 20 JKBD O=[N+]([O-])c1ccc(-c2ccc(CN[C@@H](c3ccccc3)c3nccs3)o2)c(Br)c1 518785241 TYZWQCQWTHRBRS-FQEVSTJZSA-N 470.348 5.953 5 20 JKBD O=C(Nc1cc([N+](=O)[O-])ccc1OC(F)F)c1cc(-c2ccc(F)cc2)nc2onc(C3CC3)c12 524316293 YGPOKLVSXOTHIA-UHFFFAOYSA-N 484.390 5.668 5 20 JKBD CCOC(=O)c1c(NC(=O)c2csc([N+](=O)[O-])c2)sc(C(=O)Nc2ccc(C)cc2C)c1C 603750260 HUJNCXOUCUCWAV-UHFFFAOYSA-N 487.559 5.324 5 20 JKBD Cc1csc(Sc2ccc(C(=O)Nc3ccnn3Cc3ccccc3)cc2[N+](=O)[O-])n1 603820291 ZDJUEMBNLFZPFL-UHFFFAOYSA-N 451.533 5.008 5 20 JKBD CCCCCNC(=O)C1CCN(C(=O)c2ccc(NCc3ccccc3Cl)c([N+](=O)[O-])c2)CC1 603890510 XUXFNHUHAPNAQN-UHFFFAOYSA-N 487.000 5.019 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Br)[C@@H](Nc1cccc(OC(F)F)c1)c1ccccc1 604045546 SIHJZLAURCEVND-IBGZPJMESA-N 492.276 5.751 5 20 JKBD Cc1csc(Sc2ccc(C(=O)Nc3ccc(C(=O)N4CCC(C)CC4)cc3)cc2[N+](=O)[O-])n1 604120108 ZBRFGLTYPYQFJZ-UHFFFAOYSA-N 496.614 5.635 5 20 JKBD C[C@@H](Nc1ccc(C(=O)N2CCC(N3c4ccccc4C[C@H]3C)CC2)cc1[N+](=O)[O-])c1ccccn1 604309611 VPFIDFMMCRBSIJ-WOJBJXKFSA-N 485.588 5.219 5 20 JKBD COc1ccc(Cl)c(NC(=O)C2CCN(c3ccc(C(F)(F)F)cc3[N+](=O)[O-])CC2)c1 604447483 HIYRRSPIRUKYPD-UHFFFAOYSA-N 457.836 5.131 5 20 JKBD CCOc1ccc(-n2c(Sc3ccc([N+](=O)[O-])c4cnccc34)nnc2-c2cccnc2)cc1 619673884 AGGYTIXWXCZTKY-UHFFFAOYSA-N 470.514 5.336 5 20 JKBD C[C@H](Sc1ncccc1C(=O)OCc1nc2ccccc2c2ccccc12)C(=O)N1CCCC1 726223981 OJXIHHJPQSDTJN-SFHVURJKSA-N 471.582 5.243 5 20 JKBD COC(=O)c1sc2ccccc2c1COC(=O)c1csc(-c2cccc([N+](=O)[O-])c2)n1 726815326 ZNFYKPCHSCUUIN-UHFFFAOYSA-N 454.485 5.077 5 20 JKBD CC(=O)CCc1ccc2oc(C(=O)N(CC3CC3)c3ccc(Cl)c([N+](=O)[O-])c3)c(C)c2c1 728166980 QZCIIDUPBOMWAB-UHFFFAOYSA-N 454.910 5.881 5 20 JKBD CN(C)C1CCN(c2ccc(NC(=O)c3cc([N+](=O)[O-])ccc3Sc3ccccc3)cc2F)CC1 728256951 VTXVDDLPOFMELR-UHFFFAOYSA-N 494.592 5.668 5 20 JKBD Cc1ccc(C(=O)Nc2ccccc2)cc1NC(=O)c1ccc(Br)c([N+](=O)[O-])c1 916072121 QFUQRIGABGPHRO-UHFFFAOYSA-N 454.280 5.170 5 20 JKBD O=c1c2cc([N+](=O)[O-])ccc2nc2n1CC/C2=C\c1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1 916127403 SHTRRLHUXHPINH-FMIVXFBMSA-N 464.821 5.071 5 20 JKBD O=C(Nc1ccccc1COCc1ccccc1)c1cc([N+](=O)[O-])ccc1I 916398602 AJDGOAUPUPUPQW-UHFFFAOYSA-N 488.281 5.169 5 20 JKBD CC(=O)N(c1ccc(C(F)(F)F)cc1)c1nc(COC(=O)c2ccc([N+](=O)[O-])c(C)c2)cs1 920497330 KMUKQAQPZMKUHC-UHFFFAOYSA-N 479.436 5.420 5 20 JKBD CC(=O)N(c1ccc(C(F)(F)F)cc1)c1nc(COC(=O)c2cc([N+](=O)[O-])ccc2Cl)cs1 920497749 NREUJSJSLIENKG-UHFFFAOYSA-N 499.854 5.765 5 20 JKBD COC(=O)/C=C/c1ccc(Sc2nnc(-c3cccc(C)c3)n2Cc2ccco2)c([N+](=O)[O-])c1 931413680 CTKRWOPGSDPKHW-PKNBQFBNSA-N 476.514 5.140 5 20 JKBD Cc1noc(C)c1C(=O)Nc1ccc(C2(NC(=O)c3cc4cc([N+](=O)[O-])ccc4s3)CCC2)cc1 1787332431 ZGLKBKOMEMZBLR-UHFFFAOYSA-N 490.541 5.476 5 20 JKBD O=C(NC1(c2ccc(NC(=O)c3n[nH]cc3[N+](=O)[O-])cc2)CCC1)c1ccc(Oc2ccccc2)cc1 1789689313 DXEUBQLDBFULBC-UHFFFAOYSA-N 497.511 5.172 5 20 JKBD O=C(Cn1ccc2ccc([N+](=O)[O-])cc21)NC1(c2ccc(NC(=O)c3ccccc3F)cc2)CCC1 1790214681 FRVQYQHQVQNWLC-UHFFFAOYSA-N 486.503 5.137 5 20 JKBD CN(C)c1ccc([N+](=O)[O-])cc1C(=O)Nc1ccc(C2(NC(=O)C(C)(C)C(C)(F)F)CCC2)cc1 1790791875 MDWDRPBSLBGEGL-UHFFFAOYSA-N 488.535 5.090 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)[C@@H]3[C@H]4C=CS[C@H]43)CCC2)cc1)c1cc2cc([N+](=O)[O-])ccc2s1 1791010392 MXMWBMMBMMJOSL-STZQEDGTSA-N 491.594 5.432 5 20 JKBD O=C(NC1(c2ccc(NC(=O)[C@@H]3C[C@@H]3c3ccccc3)cc2)CCC1)c1cc([N+](=O)[O-])cc2c1OCC2 1791533980 PKMWOGIQWPIFAB-DNQXCXABSA-N 497.551 5.081 5 20 JKBD C[C@H](CC(=O)N1CCC([C@H]2CCCCN2C(=O)/C=C/c2ccc([N+](=O)[O-])o2)CC1)c1ccccc1 1824278472 JDMOMVCNXZVSIX-UDLMQIBTSA-N 479.577 5.015 5 20 JKBD O=C(c1cccc(F)c1[N+](=O)[O-])N1CCC([C@@H]2CCCCN2C(=O)/C=C/C2CCCCC2)CC1 1830355290 BXZXFLMUDQRMHS-OTOIZHKDSA-N 471.573 5.104 5 20 JKBD C[C@@H](CC(=O)N1CCCC[C@@H]1C1CCN(C(=O)Cc2ccc([N+](=O)[O-])cc2F)CC1)c1ccccc1 1831510414 SWZPETLNHHUSQO-RXFWQSSRSA-N 495.595 5.090 5 20 JKBD O=C(Nc1ncc(Cc2cc(C(F)(F)F)cc(C(F)(F)F)c2)s1)c1ccccc1[N+](=O)[O-] 22865580 IHCJQVMAYNPUGL-UHFFFAOYSA-N 475.370 5.932 5 20 JKBD COc1ccc([N+](=O)[O-])cc1NC(=O)CCSc1nnc(-c2ccco2)n1C1CCCCC1 26352650 VSCSOMHERVNEIY-UHFFFAOYSA-N 471.539 5.081 5 20 JKBD Cc1cc([N+](=O)[O-])ccc1NC(=O)CCSc1nnc(-c2ccc(Cl)cc2)n1Cc1ccco1 26369750 PVXDYWKPVQUZTB-UHFFFAOYSA-N 497.964 5.577 5 20 JKBD CCn1c(S[C@@H](C(=O)N2CCc3sccc3C2)C(C)C)nc2cc3ccccc3cc2c1=O 31747545 AUBZSDZPWRJSGA-HSZRJFAPSA-N 477.655 5.333 5 20 JKBD O=C(Nc1cccc(/C=C(\c2ccncc2)c2ccc([N+](=O)[O-])cc2)c1)c1ccccc1Cl 215737627 UHLIJGVQYWMUBL-ULJHMMPZSA-N 455.901 6.484 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)N(C)[C@H]2CCSc3ccc(Br)cc32)cc1SC 504571721 AUZBNIYTICHXBS-AWEZNQCLSA-N 483.409 5.397 5 20 JKBD CCCC1CCC(N(C(=O)c2cc(OC)c(OCc3cscn3)cc2[N+](=O)[O-])C(C)C)CC1 504845950 MFCSRGGRVZHAAY-UHFFFAOYSA-N 475.611 5.848 5 20 JKBD C[C@H](Nc1ccc(C(=O)Nc2cc(Cl)ccc2OCC(F)(F)F)cc1[N+](=O)[O-])c1ccccn1 506137105 NVRGEUIWMMMPBT-ZDUSSCGKSA-N 494.857 6.010 5 20 JKBD C[C@H](c1nnc(-c2ccccc2)o1)N1CCN(Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)CC1 513783851 GMMKYRZIGKFDAX-GOSISDBHSA-N 475.574 5.252 5 20 JKBD O=C(N[C@@H](CC(F)(F)F)c1ccccc1)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 516542545 AGODDRBXSLJYFO-KRWDZBQOSA-N 489.416 5.640 5 20 JKBD O=C(Nc1cc(Cl)ccc1Cl)[C@@H]1CCCCN1C(=O)CSc1ccc([N+](=O)[O-])cc1 523444120 WWFNZXVAAMPXNM-SFHVURJKSA-N 468.362 5.014 5 20 JKBD CCOc1cc([N+](=O)[O-])c(C(=O)Nc2cc(C3CCCC3)nn2-c2ccccc2)cc1OC 585715302 SLYSUSITVRYBQZ-UHFFFAOYSA-N 450.495 5.098 5 20 JKBD Cc1ccc(S(=O)(=O)Nc2ccc(NC(=O)CCCc3c[nH]c4ccccc34)cc2)cc1[N+](=O)[O-] 603502019 PDYHXYGJMIUTBQ-UHFFFAOYSA-N 492.557 5.147 5 20 JKBD CCCOc1cc(NC(=O)N2CCC[C@@H](C(=O)Nc3ccccc3)C2)c([N+](=O)[O-])cc1OCCC 603652569 IDFKESWCKFHLFV-GOSISDBHSA-N 484.553 5.055 5 20 JKBD C[C@@H](NC(=O)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-])c1ccc(OCc2cccnc2)cc1 603692142 RBNFMWRUVFTGGF-OAHLLOKOSA-N 475.423 5.001 5 20 JKBD Cc1csc(Sc2ccc(C(=O)N3CCCO[C@H](c4ccccc4)C3)cc2[N+](=O)[O-])n1 609231319 YFMBNOAZGCMKHK-IBGZPJMESA-N 455.561 5.115 5 20 JKBD Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)Cc1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1 750553919 IEVNBIARCHAAPA-UHFFFAOYSA-N 471.473 5.154 5 20 JKBD CC(=O)Nc1cccc(NC(=S)/C(=C(/O)c2ccc([N+](=O)[O-])cc2)[n+]2ccc(C(C)(C)C)cc2)c1 913141541 ZUNQOQBLPLNTNO-UHFFFAOYSA-O 491.593 5.462 5 20 JKBD Cc1cc(=O)oc2cc(OCc3ccc(C(=O)Nc4cc([N+](=O)[O-])ccc4OC(F)F)cc3)ccc12 915283881 YNGNBGDHZQIJDG-UHFFFAOYSA-N 496.422 5.442 5 20 JKBD Cc1nc2ccccc2c(-c2ccccc2)c1CC(=O)OCc1nc(-c2ccc([N+](=O)[O-])cc2)no1 918977913 JJGYBFHEIVMDLB-UHFFFAOYSA-N 480.480 5.454 5 20 JKBD COc1ccc([C@H](CNC(=O)COc2cc(Cl)ccc2[N+](=O)[O-])c2c[nH]c3ccccc23)cc1 920993222 ZDRWEQFBEINHQI-FQEVSTJZSA-N 479.920 5.065 5 20 JKBD Cc1oc2cc(O)ccc2c1C(=O)NC1(c2ccc(NC(=O)c3ccc([N+](=O)[O-])o3)cc2)CCC1 1785748712 CXMUYEPXNGLAHM-UHFFFAOYSA-N 475.457 5.010 5 20 JKBD COc1ccc([C@H]2C[C@H]2C(=O)NC2(c3ccc(NC(=O)Cc4cccc([N+](=O)[O-])c4)cc3)CCC2)cc1 1785791485 DQLJJQYNEQCHBO-CLJLJLNGSA-N 499.567 5.084 5 20 JKBD CNc1ccc(C(=O)NC2(c3ccc(NC(=O)Cc4ccc(Cl)cc4[N+](=O)[O-])cc3)CCC2)cc1 1786116584 SXEZATBGZYOOPL-UHFFFAOYSA-N 492.963 5.280 5 20 JKBD Cc1c(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2oc3ccccc3c2C)cc(Cl)cc1[N+](=O)[O-] 1797418475 VIBBXBCFMIXGFM-BCDXTJNWSA-N 481.936 5.177 5 20 JKBD O=C(c1cc(F)cc([N+](=O)[O-])c1)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)C1(c3cccc(Cl)c3)CCCC1)C2 1800526370 NZEGSGUYMMDEIU-KOUNCHBCSA-N 499.970 5.151 5 20 JKBD CC1(C)CCC(CC(=O)N2CCCC[C@H]2C2CCN(C(=O)Cc3cccc([N+](=O)[O-])c3)CC2)CC1 1830421939 QBBNPRNCZTXJFM-VWLOTQADSA-N 483.653 5.364 5 20 JKBD CCCCC[C@@H](C)C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cc([N+](=O)[O-])ccc2N(C)C)CC1 1830766886 SLLYICQKHWRAGS-YKSBVNFPSA-N 486.657 5.111 5 20 JKBD Cc1cc2[nH]c(C(=O)N3CCCC[C@H]3C3CCN(C(=O)c4ccc([N+](=O)[O-])cc4F)CC3)cc2s1 1830889892 HFZYQPNPQRRHBM-QFIPXVFZSA-N 498.580 5.132 5 20 JKBD Cc1noc(C)c1CSc1ccccc1C(=O)O[C@H](C)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl 8712719 MFFJTZFPINYWDG-CQSZACIVSA-N 489.937 5.329 5 20 JKBD CCc1ccc(N(C(C)=O)c2nc(COC(=O)c3ccc(SC)c([N+](=O)[O-])c3)cs2)cc1 9620763 BGOJGZRUNJVEPP-UHFFFAOYSA-N 471.560 5.377 5 20 JKBD COc1cc(C(=O)Nc2ccc(NC(=O)C3CC3)cc2)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 12435183 GZIKNBSLRCMJTH-UHFFFAOYSA-N 481.892 5.650 5 20 JKBD CC(C)N(Cc1nnc(-c2cccc([N+](=O)[O-])c2)o1)C(=O)COc1ccc2oc3c(c2c1)CCCC3 16014804 NZXGRGBMZWENSQ-UHFFFAOYSA-N 490.516 5.086 5 20 JKBD CCOc1ccc([C@H]2CCCN2C(=O)CSc2ccc(C(F)(F)F)cc2[N+](=O)[O-])cc1 16141620 ISBKZKQIYRYPII-QGZVFWFLSA-N 454.470 5.468 5 20 JKBD Cc1ccc(C)c(NC(=O)[C@H](C)OC(=O)c2ccc(Sc3nc(C)cs3)c([N+](=O)[O-])c2)c1 16903560 SZPKEEVDUBRPCL-HNNXBMFYSA-N 471.560 5.312 5 20 JKBD Cc1cccc(NC(=O)[C@H](C)OC(=O)c2ccccc2C(=O)c2ccc(Cl)c([N+](=O)[O-])c2)c1C 22669798 GGMWAJHDLSXKRM-INIZCTEOSA-N 480.904 5.280 5 20 JKBD CCOc1cc(C(=O)N(C/C=C/c2ccccc2)c2ccc3c(c2)OCCO3)c([N+](=O)[O-])cc1OC 26791509 RBYKWQRZPLFCEG-JXMROGBWSA-N 490.512 5.134 5 20 JKBD O=C(Nc1cccc(NC(=O)C2CC2)c1)c1cc([N+](=O)[O-])ccc1Sc1ccc(Cl)cc1 29167995 STDJUYXJPLFTJQ-UHFFFAOYSA-N 467.934 6.000 5 20 JKBD O=C(Cc1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1)N(Cc1cccs1)C1CC1 30841281 OALHUNNDXOLAQH-UHFFFAOYSA-N 458.543 5.243 5 20 JKBD Cc1c(NC(=O)c2cccc(NC(=O)Cc3ccc(Br)cc3)c2)cccc1[N+](=O)[O-] 31817209 DWKASXNJCBVOHF-UHFFFAOYSA-N 468.307 5.099 5 20 JKBD O=C(Cc1ccc([N+](=O)[O-])cc1)Nc1ccc(NC(=O)c2ccccc2F)cc1C(F)(F)F 59253991 ZMVFDYSWNYVUAT-UHFFFAOYSA-N 461.371 5.186 5 20 JKBD Cc1csc(Sc2ccc(C(=O)N(Cc3ccco3)CC(F)(F)F)cc2[N+](=O)[O-])n1 105174508 ZAUGSUTXWLYCBD-UHFFFAOYSA-N 457.455 5.309 5 20 JKBD C[C@H](Cc1cccc(Br)c1)NC(=O)c1ccc(N[C@H](C)c2ccccn2)c([N+](=O)[O-])c1 195676483 AXBLXNBQJLVYFX-HZPDHXFCSA-N 483.366 5.286 5 20 JKBD CC(C)Cc1ccc(C(=O)C2CCN(C(=O)c3csc(-c4cccc([N+](=O)[O-])c4)n3)CC2)cc1 215798336 RCITZGACDNDRKB-UHFFFAOYSA-N 477.586 5.652 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)N[C@@H](C)c2ccc(Oc3ccccc3)c(F)c2)cc1SC 483462331 FSUCPMBNNAMLGR-AWEZNQCLSA-N 456.495 5.748 5 20 JKBD CCOc1ccccc1-c1nnc(S[C@H](C)C(=O)Nc2nc(-c3cccc([N+](=O)[O-])c3)cs2)o1 488608280 DMXRMYUXDOWOTL-CYBMUJFWSA-N 497.558 5.286 5 20 JKBD C[C@@H](c1cc(F)ccc1F)N(C)C(=O)Cc1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1 498564852 WUFKVLHGUMFSEL-KRWDZBQOSA-N 476.483 5.488 5 20 JKBD O=C(Nc1cccc(NC(=O)c2cc(OCC(F)(F)F)ccc2[N+](=O)[O-])c1)c1ccccc1 500275808 VXJPMJUFQGUDOU-UHFFFAOYSA-N 459.380 5.041 5 20 JKBD COCCN(C(=O)c1cc(C)c(OC(F)F)c(C)c1)c1nc(-c2ccc([N+](=O)[O-])cc2)cs1 503082380 FQSDVCPAKXMQFN-UHFFFAOYSA-N 477.489 5.230 5 20 JKBD COc1ccc([N+](=O)[O-])c(C(=O)Nc2nc(-c3ccc(OCc4ccccc4)cc3)cs2)c1 505088726 CLKFLZAEJNHSHW-UHFFFAOYSA-N 461.499 5.558 5 20 JKBD COc1cc(C(=O)N(C)[C@@H](C)c2nc3ccccc3s2)c([N+](=O)[O-])cc1OCc1cscn1 512301910 WEULWHOUODCLAA-ZDUSSCGKSA-N 484.559 5.082 5 20 JKBD O=C(c1csc(-c2ccc(Cl)s2)n1)N(Cc1ccccc1[N+](=O)[O-])CC(F)(F)F 512983458 RFZAZROKOTXRCE-UHFFFAOYSA-N 461.874 5.638 5 20 JKBD CSc1ccc(C(=O)c2ccccc2C(=O)NCCc2ccc3ccccc3n2)cc1[N+](=O)[O-] 520961823 DGVAXTDQWJRZNO-UHFFFAOYSA-N 471.538 5.068 5 20 JKBD O=C(C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)N1CCC[C@@H]1c1cccs1 603451598 INCROFYZWZOPDA-WOBAJENOSA-N 475.595 6.560 5 20 JKBD CCOc1cc([N+](=O)[O-])c(C(=O)Nc2nc(Cc3ccccc3)c(-c3ccccc3)s2)cc1OC 603742844 GLANQRWAJBEAEK-UHFFFAOYSA-N 489.553 5.969 5 20 JKBD Cc1nnc(-c2ccccc2NC(=O)c2ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])cc2)o1 603744128 RLQYPZNOEIWMDM-UHFFFAOYSA-N 450.838 5.651 5 20 JKBD CSc1ccc(C(=O)N[C@@H](C)c2ccc(NC(=O)Nc3ccccc3)cc2)cc1[N+](=O)[O-] 603900400 GIUQYGAGVKTMIE-HNNXBMFYSA-N 450.520 5.452 5 20 JKBD O=C(Nc1ccc(Cl)c(C(=O)NC2CC2)c1)c1ccc(NCc2ccccc2Cl)c([N+](=O)[O-])c1 603970284 QASGLRSLTDSXQB-UHFFFAOYSA-N 499.354 5.658 5 20 JKBD CCOc1ccc([C@H](C)NCc2ccc(-c3ccc([N+](=O)[O-])cc3Br)o2)cc1OC 608836558 SDFVFZFKLXWNQU-AWEZNQCLSA-N 475.339 5.875 5 20 JKBD CCOc1cc(C(=O)Nc2ccc(OCc3cccc(Cl)c3)cc2C)c([N+](=O)[O-])cc1OC 609062455 QQXKMEBQVFWTFS-UHFFFAOYSA-N 470.909 5.795 5 20 JKBD O=C(Nc1cc2c(cc1Cl)OCCO2)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1 619216603 VHXOERBQGJYBJG-UHFFFAOYSA-N 461.257 5.717 5 20 JKBD C[C@H]1CN(c2ccc(NC(=O)c3ccc(Cl)cc3[N+](=O)[O-])cc2C(F)(F)F)C[C@H](C)O1 728038513 KADSSEMKZIDFCU-RYUDHWBXSA-N 457.836 5.133 5 20 JKBD Cc1ccc(CN(Cn2nc(-c3cccc([N+](=O)[O-])c3)ccc2=O)[C@H]2CCc3ccccc32)cc1 747075721 HUFMKECAVIUWDO-MHZLTWQESA-N 466.541 5.274 5 20 JKBD CC1=C(C(=O)Nc2cccc(Cl)c2)[C@@H](c2ccc([N+](=O)[O-])o2)NC(=S)N1c1ccccc1 812514838 KZLOIFNSGYONBX-HXUWFJFHSA-N 468.922 5.190 5 20 JKBD CC(C)N(Cc1nnc(-c2cccc([N+](=O)[O-])c2)o1)C(=O)c1ccc(OCc2ccccc2)cc1 864242465 GRCNJNUOIRACAL-UHFFFAOYSA-N 472.501 5.275 5 20 JKBD O=[N+]([O-])c1cc(C(F)(F)F)ccc1-c1nc(-c2ccc(-n3cnc4ccccc43)nc2)no1 904487931 NFDNKBRUVPDOMK-UHFFFAOYSA-N 452.352 5.065 5 20 JKBD C[C@@H](Sc1ccc([N+](=O)[O-])cc1)c1nc(-c2cccc(Cn3cnc4ccccc43)c2)no1 904489182 CSJLDMHFXMWBJB-MRXNPFEDSA-N 457.515 5.896 5 20 JKBD CC(C)N(Cc1nnc(-c2cccc([N+](=O)[O-])c2)o1)C(=O)CCCCc1nc2ccccc2s1 917513242 SNCCAIKGGMACGD-UHFFFAOYSA-N 479.562 5.405 5 20 JKBD O=C(COC(=O)c1c[nH]cc1-c1ccc(Cl)s1)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 919589220 GAZYMVYITCFQNZ-UHFFFAOYSA-N 473.816 5.119 5 20 JKBD C[C@H](Nc1ccc(C(=O)Nc2ccc(N3CCCCC3)c(Cl)c2)cc1[N+](=O)[O-])c1ccccn1 919770279 OEBJHTGRDWTEID-KRWDZBQOSA-N 479.968 6.059 5 20 JKBD COc1ccc2c(c1)CCC[C@H]2CC(=O)O[C@@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 920665191 WMHRWQYRMHQRGS-ZFWWWQNUSA-N 480.439 5.003 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)c3cccc4c3oc3ccccc34)CCC2)cc1)c1nc[nH]c1[N+](=O)[O-] 1788614266 PYAVIDZSEXRRQS-UHFFFAOYSA-N 495.495 5.279 5 20 JKBD O=C(CCc1cccc([N+](=O)[O-])c1)NC1(c2ccc(NC(=O)c3ccc4c(c3)COC4)cc2)CCC1 1789034027 JIHJQWRCYKRIOR-UHFFFAOYSA-N 485.540 5.006 5 20 JKBD O=C(NC1(c2ccc(NC(=O)c3cccc4cc[nH]c34)cc2)CCC1)c1cc([N+](=O)[O-])cc2c1OCC2 1789093660 DCRVKRNSVSKLSC-UHFFFAOYSA-N 496.523 5.073 5 20 JKBD O=C(NC1(c2ccc(NC(=O)[C@H]3C[C@@H]3c3ccc(Cl)cc3)cc2)CCC1)c1ccc([N+](=O)[O-])o1 1789151392 LCOHHJBNJYEPJF-UXHICEINSA-N 479.920 5.393 5 20 JKBD Cc1cc(C(=O)NC2(c3ccc(NC(=O)[C@@H](C)Sc4cccs4)cc3)CCC2)ncc1[N+](=O)[O-] 1789416963 ATUBGSKKYXQVTF-MRXNPFEDSA-N 496.614 5.288 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)[C@@H]3CCCCC3(F)F)CCC2)cc1)c1cccc(F)c1[N+](=O)[O-] 1790700295 YUSRHSHBOQPWMB-SFHVURJKSA-N 475.467 5.307 5 20 JKBD O=C(Cc1cc(F)ccc1[N+](=O)[O-])Nc1ccc(C2(NC(=O)[C@@H]3CCCCC3(F)F)CCC2)cc1 1792308438 OVDMQSLDOCFCJX-FQEVSTJZSA-N 489.494 5.236 5 20 JKBD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc2occc2c1)c1cc2cc([N+](=O)[O-])ccc2s1 1797567253 LZOXOTWHBUPQDD-REPLKXPHSA-N 475.526 5.121 5 20 JKBD Cc1c(C(=O)N2CCC3(CCCN(C(=O)C4CCC(F)(F)CC4)C3)CC2)cc(Cl)cc1[N+](=O)[O-] 1805761049 OVFSLCACTJVXHJ-UHFFFAOYSA-N 497.970 5.227 5 20 JKBD Cc1c(Cl)cccc1C(=O)N1CCC([C@@H]2CCCCN2C(=O)/C=C/c2ccc([N+](=O)[O-])o2)CC1 1824275686 GFAQXOJPVVNQDI-RCHCNPRSSA-N 485.968 5.096 5 20 JKBD CCn1c(S[C@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)nc2sc3c(c2c1=O)CCCC3 17670355 WNFFDONDKFJAEM-GFCCVEGCSA-N 483.575 5.168 5 20 JKBD Cc1cccc([N+](=O)[O-])c1NC(=O)CSc1nnc(Nc2ccc(OC(F)(F)F)cc2)s1 22181011 ULLJNDPCHSAWTL-UHFFFAOYSA-N 485.469 5.128 5 20 JKBD C[C@H](OC(=O)c1ccc(Br)c([N+](=O)[O-])c1)C(=O)Nc1ccccc1Oc1ccccc1 22184111 KRTFTALCQNASHM-AWEZNQCLSA-N 485.290 5.334 5 20 JKBD Cc1nn(Cc2ccc(C(=O)N3CCCc4cc(C(F)(F)F)ccc43)cc2)c(C)c1[N+](=O)[O-] 24471084 WMKFALFYLFGIRC-UHFFFAOYSA-N 458.440 5.068 5 20 JKBD C[C@@H](OC(=O)/C(=C/c1ccc(F)cc1)c1cccs1)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl 28672671 AMSZSOOJXJAGDB-VVBXCHJUSA-N 474.897 5.560 5 20 JKBD Cc1c(NC(=O)c2ccc(N[C@@H](C)c3ccccn3)c([N+](=O)[O-])c2)cccc1C(=O)Nc1ccccc1 68804445 YPCZAUOEGQIDPQ-IBGZPJMESA-N 495.539 5.976 5 20 JKBD O=C(COc1cccc([N+](=O)[O-])c1)Nc1ccc(NC(=O)c2ccc(F)cc2)cc1C(F)(F)F 69643962 HBMMLEFTAOCNIU-UHFFFAOYSA-N 477.370 5.023 5 20 JKBD CC(C)Oc1ccc([N+](=O)[O-])cc1CSc1nnc(-c2c[nH]c3ccccc23)n1C[C@H]1CCCO1 78443199 LNRMVHXIUFRBJA-LJQANCHMSA-N 493.589 5.593 5 20 JKBD O=C(COc1ccccc1C(=O)Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1)Nc1ccccc1F 104674171 WOVNLHCSHPWYNH-UHFFFAOYSA-N 492.488 5.127 5 20 JKBD COc1cc(C(=O)Nc2cccc(-c3nccn3C)c2)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 117331671 SUCOIQHFJUQEAF-UHFFFAOYSA-N 478.892 5.702 5 20 JKBD O=C(NCc1ccnc(N2CCCCC2)c1)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1 486336532 FDJQYPNPGUGHKU-UHFFFAOYSA-N 466.925 5.356 5 20 JKBD CCOc1cc([N+](=O)[O-])c(C(=O)N[C@H](c2ccc(F)cc2)c2ccccc2Cl)cc1OC 502335169 AKIBNJAGQIAAHX-JOCHJYFZSA-N 458.873 5.314 5 20 JKBD CCOc1c(Br)cc(Cl)cc1NC(=O)c1ccc(N2CCCC2)c([N+](=O)[O-])c1 504802414 UFZVLDSOIORBNX-UHFFFAOYSA-N 468.735 5.262 5 20 JKBD COc1ccc([C@@H]2CCN(C(=O)c3ccc(Oc4ccc(Cl)cc4[N+](=O)[O-])c(OC)c3)C2)cc1 504925991 WIROGEYAYNYJPS-GOSISDBHSA-N 482.920 5.687 5 20 JKBD COc1cc(C(=O)N[C@@H](C)c2ccccc2Oc2ccccc2)c([N+](=O)[O-])cc1OC(F)F 506183046 JGWIXCKDQIMMHU-AWEZNQCLSA-N 458.417 5.488 5 20 JKBD C[C@H](Nc1ccc(C(=O)NCc2ccc(Oc3ccc(F)cc3)nc2)cc1[N+](=O)[O-])c1ccccn1 507402403 KYNWPQOGZYUTTC-KRWDZBQOSA-N 487.491 5.419 5 20 JKBD O=C(Cn1c2ccccc2c(=O)c2ccccc21)Nc1ncc(Cc2ccc(F)cc2F)s1 511456362 XFFXHRYPCKCDIE-UHFFFAOYSA-N 461.493 5.119 5 20 JKBD C[C@@H](Nc1ccc(C(=O)N2CCC(Nc3ccc(F)cc3)CC2)cc1[N+](=O)[O-])c1ccccn1 512159963 VAHZNAMGOBTNDO-QGZVFWFLSA-N 463.513 5.019 5 20 JKBD CC[C@@H](c1ccc(F)cc1)N(Cc1cccc(F)c1)C(=O)c1ccc(-n2cncn2)c([N+](=O)[O-])c1 512311219 XTIOBBXYUZYXGR-QFIPXVFZSA-N 477.471 5.247 5 20 JKBD CCc1cc(Oc2ccc(S(=O)(=O)c3ccccc3)cc2)nc(-c2ccc([N+](=O)[O-])cc2)n1 512706667 CUKDIFJWOXAYOU-UHFFFAOYSA-N 461.499 5.239 5 20 JKBD CCOc1cc(NC(=O)c2csc(-c3ccc(Cl)s3)n2)c([N+](=O)[O-])cc1OCC 512971837 MLAUCIOSDMYNBW-UHFFFAOYSA-N 453.929 5.483 5 20 JKBD COc1cc(C)ccc1Oc1ccc(F)cc1NC(=O)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-] 513042667 ZNHFPKAHXNDWOV-UHFFFAOYSA-N 494.397 6.037 5 20 JKBD COC(=O)c1cc(C(=O)Nc2ccc(Oc3ccccc3)cc2C(F)(F)F)cc([N+](=O)[O-])c1 519091401 YHCJFSRYJMTPBA-UHFFFAOYSA-N 460.364 5.445 5 20 JKBD CN(c1ccccc1)c1ccc(CN[C@H](c2ccc(Cl)cc2)c2nccn2C)cc1[N+](=O)[O-] 520209859 LVSQKSVINSDVSS-XMMPIXPASA-N 461.953 5.629 5 20 JKBD O=[N+]([O-])c1ccc(-c2nn(-c3ccccc3)cc2CNC[C@H]2CCCO[C@@H]2c2ccccc2)cc1 520960605 GGURUZORWOCBBB-QDPGVEIFSA-N 468.557 5.705 5 20 JKBD COCCc1ccc(Oc2ccc(N[C@@H](C)C(=O)Nc3ccc([N+](=O)[O-])cc3Cl)cc2)cc1 521732984 ATDVYALLINNCAO-INIZCTEOSA-N 469.925 5.669 5 20 JKBD O=[N+]([O-])c1ccc(-c2nn(-c3ccccc3)cc2CNCCc2nccn2Cc2ccccc2)cc1 521820336 LIKYWALMRUDGOF-UHFFFAOYSA-N 478.556 5.025 5 20 JKBD Cc1ccc([C@@H](C)N[C@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Br)c2ccccc2)cc1 604047600 KLNDJLPDYRTALK-ZHRRBRCNSA-N 468.351 5.696 5 20 JKBD C[C@H]1C[C@@H](C)CN(c2ccc(C(=O)N3C[C@@H](C(F)(F)F)C[C@@H](C(F)(F)F)C3)cc2[N+](=O)[O-])C1 604257913 OJJCKNLHPVJZML-SDSIWUNFSA-N 481.437 5.280 5 20 JKBD O=c1c(Cl)c(N[C@H](c2ccccc2)c2ccc(F)cc2)cnn1-c1ccc([N+](=O)[O-])cc1 608830907 HCTYGCXMOVDCMS-JOCHJYFZSA-N 450.857 5.135 5 20 JKBD COc1ccc(CNc2ccc(C(=O)Nc3ccc(C)cc3)cc2[N+](=O)[O-])cc1OC(F)F 608973078 WTMNBJYONJZNPD-UHFFFAOYSA-N 457.433 5.378 5 20 JKBD Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)CCSCc1nc(O)c2c3c(sc2n1)CCCC3 610860202 VJRWZGSCIKWPIU-UHFFFAOYSA-N 472.592 5.063 5 20 JKBD O=C(OCc1nnc(-c2c(Cl)cccc2Cl)o1)c1cc2cc([N+](=O)[O-])ccc2s1 726636634 XPPHLPCKVNBWCR-UHFFFAOYSA-N 450.259 5.523 5 20 JKBD Cc1nn(CCC(=O)O[C@@H](C)c2nc3cc(Cl)ccc3n2Cc2ccccc2)c(C)c1[N+](=O)[O-] 726647139 IIRJZNDAZPNCGU-KRWDZBQOSA-N 481.940 5.154 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Cl)[C@H](Nc1cccc(SC(F)F)c1)c1ccccc1 727465279 YQADGRUQGYKJIG-LJQANCHMSA-N 463.893 6.355 5 20 JKBD CCS(=O)(=O)Nc1ccc(NC(=O)CCC(=O)c2ccc3ccc4cccc5ccc2c3c45)cc1C 727768116 STFZTLRATZUPJW-UHFFFAOYSA-N 498.604 6.256 5 20 JKBD O=C(NCc1ccccc1-c1ccc(Cn2ccnc2)cc1)c1ccc(Br)c([N+](=O)[O-])c1 728842077 IVQFPUVEEYHMMB-UHFFFAOYSA-N 491.345 5.199 5 20 JKBD O=C(COC(=O)[C@@H]1C[C@H]1c1cccc2ccccc12)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 730876526 POOSKQQGMRSOTP-ZWKOTPCHSA-N 458.392 5.052 5 20 JKBD C[C@@H](OC(=O)c1cnc(-c2ccccc2Cl)s1)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 747954326 ZUGLMCRVSBPCES-SNVBAGLBSA-N 499.854 5.575 5 20 JKBD O=[N+]([O-])c1ccc2nc(SCc3nnc(-c4ccc(Br)s4)o3)sc2c1 748127189 ZBHZHVQQINWPTN-UHFFFAOYSA-N 455.340 5.371 5 20 JKBD CC(C)(C)OC(=O)N1CCC[C@H]1[C@H]1CCCCN1C(=O)c1csc(-c2cccc([N+](=O)[O-])c2)n1 751413888 UVYHYLDVUBMICD-UXHICEINSA-N 486.594 5.113 5 20 JKBD Cc1cc(C(N)=O)ccc1NC(=O)C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1 915174179 FAUYNWFGZDRMGU-AQTBWJFISA-N 472.526 5.181 5 20 JKBD Cc1ccc2nc(-c3ccc(NC(=O)COC(=O)c4ccc([N+](=O)[O-])cc4F)cc3)sc2c1 919568392 NQJNSCRMUKTDTP-UHFFFAOYSA-N 465.462 5.115 5 20 JKBD C[C@H](Nc1ccc(C(=O)O[C@H](C(=O)N2CCCCC2)c2ccccc2)cc1[N+](=O)[O-])c1ccccn1 920545428 RDNDZQPYXCKNGO-DFBJGRDBSA-N 488.544 5.074 5 20 JKBD C[C@H](Nc1ccc(C(=O)OCc2c(F)c(F)c(F)c(F)c2F)cc1[N+](=O)[O-])c1ccccn1 920546526 KLSCDDSYFOTVRZ-JTQLQIEISA-N 467.350 5.215 5 20 JKBD O=C(Cc1cccc([N+](=O)[O-])c1)Nc1ccc(C2(NC(=O)c3cccc4ccoc34)CCC2)cc1 1785795431 NPCAOWGFCFKBNQ-UHFFFAOYSA-N 469.497 5.331 5 20 JKBD C[C@@H](CC(=O)N1CCCC[C@@H]1c1cc(NC(=O)CCc2cccc([N+](=O)[O-])c2)n[nH]1)c1ccccc1 1815538440 JRLKKDRYUPPXLY-YADARESESA-N 489.576 5.137 5 20 JKBD C/C(=C\c1ccc(C)o1)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)/C=C/c2ccccc2[N+](=O)[O-])[nH]n1 1819493065 CJEPEHXBOUIYCK-GQQZTTJISA-N 489.532 5.028 5 20 JKBD CC(C)c1ccc(C(=O)Nc2cc([C@H]3CCCCN3C(=O)c3cc(F)cc([N+](=O)[O-])c3)[nH]n2)cc1 1820592420 SDLZGNSDRLGEID-JOCHJYFZSA-N 479.512 5.200 5 20 JKBD O=C(c1cccc(F)c1[N+](=O)[O-])N1CCC([C@@H]2CCCCN2C(=O)c2cccc(F)c2Cl)CC1 1830572762 WVNJRUPZSXEXPW-FQEVSTJZSA-N 491.922 5.074 5 20 JKBD CC(C)/C=C/C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)CC1 1832512427 BKSMSRYKQAPXTJ-JLXBBBJOSA-N 469.607 5.255 5 20 JKBD CC(C)Cn1c(S[C@@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)nnc1-c1ccccc1F 8651069 KWNLSPLZTVBWRE-ZDUSSCGKSA-N 477.949 5.421 5 20 JKBD CSc1ccc(C(=O)c2ccccc2C(=O)OCc2cccc3cccnc23)cc1[N+](=O)[O-] 11225126 YOCSIOWZXXQOHD-UHFFFAOYSA-N 458.495 5.453 5 20 JKBD CCOC(=O)c1c(-c2ccc(OC)cc2)csc1NC(=O)c1ccc([N+](=O)[O-])cc1Cl 22923461 AFZPYOBXGALOLG-UHFFFAOYSA-N 460.895 5.414 5 20 JKBD Cc1sc(NC(=O)c2ccc(N[C@@H](C)c3ccccn3)c([N+](=O)[O-])c2)nc1-c1ccc(F)cc1 72016627 ZCLNRYGQOIZKSK-AWEZNQCLSA-N 477.521 5.986 5 20 JKBD Cc1ccc(-c2csc(NC(=O)CCc3ncc(-c4ccccc4F)o3)n2)cc1[N+](=O)[O-] 105472746 XJWXKQGHURFHCU-UHFFFAOYSA-N 452.467 5.392 5 20 JKBD Cn1cnnc1Sc1ccc(C(=O)N[C@@H](c2ccc(Cl)cc2)c2ccsc2)cc1[N+](=O)[O-] 108945116 BGSQXEGABUJEQY-IBGZPJMESA-N 485.978 5.109 5 20 JKBD CN(CCCc1cc(-c2ccccc2)no1)C(=O)CSc1ccc(C(F)(F)F)cc1[N+](=O)[O-] 110116797 VSSUREQWCBMIJP-UHFFFAOYSA-N 479.480 5.452 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)Nc2ncc(Cc3ccc(C)c(Cl)c3)s2)cc1SC 303234852 ZSSJWVWUNAWPMF-UHFFFAOYSA-N 463.968 5.587 5 20 JKBD C[C@@H](Nc1ccc(C(=O)Nc2cccc(C(=O)N(C)c3ccccc3)c2)cc1[N+](=O)[O-])c1ccccn1 410053013 RCVRALNIFTVARN-LJQANCHMSA-N 495.539 5.692 5 20 JKBD CCOc1ccc(N(CC)C(=O)C2CCN(c3ccc(C(F)(F)F)cc3[N+](=O)[O-])CC2)cc1 482027250 VJYQKDKLTSKYQJ-UHFFFAOYSA-N 465.472 5.282 5 20 JKBD O=C(c1csc(-c2ccc([N+](=O)[O-])cc2)n1)N1CCC(c2nc3cc(Cl)ccc3o2)CC1 497496001 FYUURGRJWCDULS-UHFFFAOYSA-N 468.922 5.533 5 20 JKBD O=C(Nc1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2Sc2ccccc2)cc1)c1cccs1 501771766 QJRXLISVJYMJQK-UHFFFAOYSA-N 475.551 6.312 5 20 JKBD CCOc1cc(F)ccc1NC(=O)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 502030688 IUZLESBQLHFVIJ-UHFFFAOYSA-N 455.408 5.007 5 20 JKBD O=C(NCCCc1nc(-c2ccncc2)cs1)c1ccc(NCc2ccccc2)c([N+](=O)[O-])c1 503095086 BIPZBCZAMULYBU-UHFFFAOYSA-N 473.558 5.088 5 20 JKBD COc1ccc(CN[C@H](c2ccccc2)c2nccs2)cc1OCc1ccc([N+](=O)[O-])cc1 507915583 UTLPZRKFJHLHKX-XMMPIXPASA-N 461.543 5.518 5 20 JKBD COc1ccc(CN[C@H](c2ccccc2)c2ccncc2)cc1OCc1ccc([N+](=O)[O-])cc1 511525029 YSMQBKNBWWIKOR-HHHXNRCGSA-N 455.514 5.457 5 20 JKBD COc1cc(C(=O)N(Cc2ccc([C@@H]3C[C@@H]3C)o2)C2CC2)c([N+](=O)[O-])cc1OCc1cscn1 512343290 NVWCHMJTZCKNDF-KBXCAEBGSA-N 483.546 5.160 5 20 JKBD CCCN(C(=O)c1ccc(Cn2nc(C)c([N+](=O)[O-])c2C)cc1)[C@H](C)c1ccccc1OC 514495628 NFMWAILQOOKIFX-GOSISDBHSA-N 450.539 5.078 5 20 JKBD COCCN(C(=O)[C@H](C)Sc1ccccc1Cl)c1nc(-c2ccc([N+](=O)[O-])cc2)cs1 515438160 SHVHVAQQXFOZOY-AWEZNQCLSA-N 477.995 5.532 5 20 JKBD O=[N+]([O-])c1ccc(-c2ccc(CN[C@@H]3CCSc4ccc(F)cc43)o2)c(Br)c1 521822008 PDWKYLIGYWLIAF-GOSISDBHSA-N 463.328 6.083 5 20 JKBD COc1ccc([N+](=O)[O-])c(C(=O)Nc2nc(C3CC3)c(Cc3cccc(C(F)(F)F)c3)s2)c1 523852370 LGIWFQHXJORSBX-UHFFFAOYSA-N 477.464 5.799 5 20 JKBD C[C@@H](Nc1ccc(C(=O)Nc2ccc(Oc3ccccc3)nc2)cc1[N+](=O)[O-])c1ccccn1 555209622 BDLAFEGXPSZYMN-QGZVFWFLSA-N 455.474 5.603 5 20 JKBD Cc1ccc(C[C@H]2CCCN(C(=O)c3ccc(N[C@H](C)c4ccccn4)c([N+](=O)[O-])c3)C2)cc1 580668697 NFUBVKFRUPMHQD-IFMALSPDSA-N 458.562 5.566 5 20 JKBD C[C@@H]1CCCN(c2ccc(C(=O)N3CCC[C@@H]3c3nc4ccccc4s3)cc2[N+](=O)[O-])C1 598675167 UHJJZJBQSAARJL-OXQOHEQNSA-N 450.564 5.418 5 20 JKBD CCN1CCN(c2ccc(NC(=O)c3cc([N+](=O)[O-])ccc3Sc3ccccc3)c(C)c2)CC1 602213387 JDLFQDYEBJFDIW-UHFFFAOYSA-N 476.602 5.449 5 20 JKBD COc1cc(C(=O)Nc2ccc3c4c(cccc24)CC3)c([N+](=O)[O-])cc1OCc1cscn1 604385112 PNGHANKCAPKZJA-UHFFFAOYSA-N 461.499 5.143 5 20 JKBD COc1ccc(-c2ccc(CN[C@@H]3C[C@@H](C(F)(F)F)C[C@@H](C(F)(F)F)C3)o2)c([N+](=O)[O-])c1 608835919 YXEKFRAOCIPIFV-ITGUQSILSA-N 466.378 5.863 5 20 JKBD C[C@H](SCc1cc([N+](=O)[O-])cc2c1OCOC2)c1nc(O)c2c(-c3ccco3)csc2n1 619555038 NDLNOMYDQUXVLM-NSHDSACASA-N 471.516 5.426 5 20 JKBD CCC(CC)c1cc[n+](/C(C(=S)N[C@@H](C)c2cccs2)=C(/O)c2ccc(C)c([N+](=O)[O-])c2)cc1 726582036 ZWNKZPIZSMKYTO-SFHVURJKSA-O 496.678 6.718 5 20 JKBD CC(=O)N(c1nc(COC(=O)c2cc(Cl)ccc2[N+](=O)[O-])cs1)c1cccc(C)c1C 754673213 UGYOMMYKQYTZFM-UHFFFAOYSA-N 459.911 5.363 5 20 JKBD CC(C)N(C)Cc1cc(O[C@H]2CCN(C(=O)c3cc([N+](=O)[O-])ccc3SC3CCCC3)C2)ccn1 856653817 PHAVJGMFUGYQLB-QFIPXVFZSA-N 498.649 5.158 5 20 JKBD CC(C)N(Cc1nnc(-c2cccc([N+](=O)[O-])c2)o1)C(=O)c1cc(-c2ccccc2)nc2ccccc12 864244839 QKMPSMJHTKKRMA-UHFFFAOYSA-N 493.523 5.911 5 20 JKBD COc1ccc(NC(=O)c2nnc(/C(Cl)=C/c3ccc(-c4ccc([N+](=O)[O-])cc4)s3)s2)cc1 912965554 UZQJOZZGBIFNGT-PDGQHHTCSA-N 498.973 6.173 5 20 JKBD Cc1cccc(C)c1OCCC(=O)Oc1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2Cl)cc1 914711516 GCSUWHCEUPMCPT-UHFFFAOYSA-N 468.893 5.492 5 20 JKBD O=C(Nc1ccc(C(=O)Nc2cc([N+](=O)[O-])c(F)cc2F)cc1)c1cc(Cl)cc(Cl)c1 914869213 CPEKACZXEQHXQJ-UHFFFAOYSA-N 466.227 5.684 5 20 JKBD O=C(Nc1cc(Cl)c([N+](=O)[O-])cc1OCc1ccccc1)c1cc(F)c(F)c(F)c1F 916827701 ROLWPMMBWMPNHK-UHFFFAOYSA-N 454.763 5.636 5 20 JKBD Cc1ccc(CC(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2ccccc2Oc2ccccc2)cc1[N+](=O)[O-] 1799551201 BRFYOHQMOHFDAA-NUNAXRQHSA-N 499.567 5.190 5 20 JKBD COc1cc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cccc3c2oc2ccccc23)ccc1[N+](=O)[O-] 1801204216 RPSSXJLXPIGPSC-REPLKXPHSA-N 499.523 5.068 5 20 JKBD C[C@H](Sc1ccccc1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc2cc([N+](=O)[O-])ccc2s1 1801205868 FCQMJWKIWNZUEN-KANFNMMFSA-N 495.626 5.242 5 20 JKBD CC1(C)CCC(CC(=O)NC[C@@H]2CCN(C(=O)c3cc(F)cc([N+](=O)[O-])c3)[C@@H]2c2cccnc2)CC1 1808902375 KPUXBKMXBCCWLV-NBGIEHNGSA-N 496.583 5.055 5 20 JKBD CC1=CC[C@H](C(=O)NC[C@H]2CCN(C(=O)c3cc(Cl)cc([N+](=O)[O-])c3C)[C@@H]2c2cccnc2)CC1 1809481873 AMWRHBXPJAAIGE-MFSJNOQSSA-N 496.995 5.018 5 20 JKBD O=C(CCC1CCCC1)Nc1cc([C@@H]2CCCCN2C(=O)CSc2ccccc2[N+](=O)[O-])[nH]n1 1816694384 CNAYSHXRSXKQKA-IBGZPJMESA-N 485.610 5.073 5 20 JKBD Cc1cc(C(=O)N2CCCC[C@H]2c2cc(NC(=O)c3cc(Cl)cc([N+](=O)[O-])c3C)n[nH]2)c(C)o1 1821291064 NQVFSNPEZCIFDR-IBGZPJMESA-N 485.928 5.109 5 20 JKBD O=C(c1cc2cc([N+](=O)[O-])ccc2s1)N1CC2(CCCN2C(=O)c2c[nH]c3cccc(Cl)c23)C1 1844146030 CLIPEICIUVOYGY-UHFFFAOYSA-N 494.960 5.075 5 20 JKBD COc1cc(COC(=O)c2sc(-c3cccs3)nc2C)c([N+](=O)[O-])cc1OC(F)F 11118573 QTFQAKOXKIZAGT-UHFFFAOYSA-N 456.448 5.055 5 20 JKBD Cc1ccc(Nc2nnc(SCc3nnc(-c4ccc([N+](=O)[O-])cc4)o3)s2)cc1Cl 16325380 SXVYZKUKZSBPIP-UHFFFAOYSA-N 460.928 5.494 5 20 JKBD CCOc1cc([N+](=O)[O-])c(C(=O)Nc2ccc(Cc3nc4ccccc4s3)cc2)cc1OC 17589387 HXZRKHZPGGJQNU-UHFFFAOYSA-N 463.515 5.455 5 20 JKBD COc1cc(CSc2nnc(NCc3ccc(F)cc3)s2)c([N+](=O)[O-])cc1OC(F)F 25855415 RYLVOILBBRWFPV-UHFFFAOYSA-N 472.470 5.100 5 20 JKBD O=C(Nc1ccccc1C(=O)Nc1cccc(CN2CCCCC2)c1)c1ccc([N+](=O)[O-])cc1Cl 27140885 WYIUPSZBQZVUSK-UHFFFAOYSA-N 492.963 5.739 5 20 JKBD CC(C)CCSc1ccc(C(=O)N[C@H](c2ccccc2F)c2nccn2C)cc1[N+](=O)[O-] 29999393 WHIYLVALMSHLFF-OAQYLSRUSA-N 456.543 5.125 5 20 JKBD Cc1cc(C(=O)Nc2ccc(NC(=O)c3ccc(F)cc3)cc2C(F)(F)F)ccc1[N+](=O)[O-] 58910488 YRXQZIBTDGEDCY-UHFFFAOYSA-N 461.371 5.566 5 20 JKBD Cc1sc(NC(=O)c2ccc(-n3c(C)nc4ccccc4c3=O)cc2)nc1-c1cccc([N+](=O)[O-])c1 195703959 OWPIFTLNGVHXNB-UHFFFAOYSA-N 497.536 5.287 5 20 JKBD C[C@@H](OC(=O)c1c2c(nc3ccccc13)/C(=C\c1ccco1)CC2)C(=O)Nc1ccccc1[N+](=O)[O-] 213749800 ZECQIWRZRAXOHQ-CFBLSMTOSA-N 483.480 5.407 5 20 JKBD COc1ccc(COc2cccc(F)c2)cc1NC(=O)C1CCN(c2ccccc2[N+](=O)[O-])CC1 303024075 VGKWDMGGQANBRL-UHFFFAOYSA-N 479.508 5.177 5 20 JKBD C[C@@H](Nc1ccc(C(=O)N[C@H](C)c2nc(-c3ccccc3)cs2)cc1[N+](=O)[O-])c1ccccn1 410288339 KTZIVODFDIHUBG-IAGOWNOFSA-N 473.558 5.777 5 20 JKBD COc1cc(C(=O)N[C@@H](c2ccccc2)c2ccc(Br)cc2F)c([N+](=O)[O-])cc1OC 489487180 UBLQZBNNBQDRPR-NRFANRHFSA-N 489.297 5.033 5 20 JKBD COc1cc([C@@H](C)NC(=O)c2csc(-c3cccc([N+](=O)[O-])c3)n2)ccc1OCc1ccncc1 498601213 QZKBPAYJHXCFAQ-MRXNPFEDSA-N 490.541 5.192 5 20 JKBD Cc1ccc(C(=O)N2C[C@@H](C)C[C@@H](C)C2)cc1NC(=O)c1csc(-c2ccc([N+](=O)[O-])cc2)n1 498781443 RLMAFTADTVGLLD-IYBDPMFKSA-N 478.574 5.397 5 20 JKBD CC(C)c1ccc(-c2nc(C[S@@](=O)Cc3cc([N+](=O)[O-])cc4c3OCOC4)cs2)cc1 501258940 ADBORXCPLQGRSD-HKBQPEDESA-N 458.561 5.157 5 20 JKBD O=C(Nc1ccc(OC[C@@H]2CCCO2)cc1)c1cc([N+](=O)[O-])ccc1Sc1ccccc1 502043097 SGHKRCFJORMSEL-FQEVSTJZSA-N 450.516 5.556 5 20 JKBD CN1CCC(CN(C)C(=O)c2c3c(nc4ccccc24)/C(=C/c2ccc([N+](=O)[O-])cc2)CCC3)CC1 505720559 PUBHPQLMUAORHT-RELWKKBWSA-N 484.600 5.434 5 20 JKBD CSc1ccc([N+](=O)[O-])c(C(=O)Nc2cc3c(cc2Sc2ccccc2)OCCO3)c1 509267140 JJARGTQNNKVCIE-UHFFFAOYSA-N 454.529 5.491 5 20 JKBD CCCCN(C(=O)c1cc([N+](=O)[O-])cn1C)c1nc(-c2ccc(Cl)cc2Cl)cs1 514708675 HOXLZBZGXZSYFE-UHFFFAOYSA-N 453.351 5.811 5 20 JKBD COc1ccc([N+](=O)[O-])cc1NC(=O)c1oc2ccccc2c1CSc1ccc(F)cc1 519069551 HDABJLRTFBPUGO-UHFFFAOYSA-N 452.463 6.033 5 20 JKBD O=C(C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1)N1Cc2ccccc2-c2ccccc2C1 522428031 XNWGLXJGOXOGIF-UHFFFAOYSA-N 495.501 6.039 5 20 JKBD COc1ccc([N+](=O)[O-])cc1CNC(=O)c1ccccc1Sc1ncnc2sc(C)c(C)c12 550767208 NETDVAKHFXIDDV-UHFFFAOYSA-N 480.571 5.306 5 20 JKBD COC(=O)c1cccc(NC(=O)c2ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])c(OC)c2)c1C 603478043 KWICYUZNRGREBL-UHFFFAOYSA-N 470.865 5.396 5 20 JKBD O=C(C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)N1CCN(C2CCCC2)CC1 603554151 PPEKFGDYXBWMAI-LVZFUZTISA-N 476.602 5.222 5 20 JKBD COc1cc(C(=O)Nc2cc([N+](=O)[O-])ccc2C)ccc1OCc1ccc(Br)s1 603637525 XOVHOBIFTUIYKH-UHFFFAOYSA-N 477.336 5.567 5 20 JKBD COc1ccc(NC(=O)CCNc2ccccc2[N+](=O)[O-])cc1NC(=O)c1ccc(Cl)cc1F 603998257 STHFEFRCVYGURE-UHFFFAOYSA-N 486.887 5.089 5 20 JKBD COc1cc(C(=O)N(Cc2ccc(Cl)c(Cl)c2)C2CC2)c([N+](=O)[O-])cc1OC(F)F 603999762 MVVMRRQWJZROIV-UHFFFAOYSA-N 461.248 5.316 5 20 JKBD CC[C@@H](C)C(=O)Nc1cccc(CN[C@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2ccccc2)c1 604044632 BFLZDMAEKRICHZ-OSPHWJPCSA-N 494.979 5.702 5 20 JKBD CCOc1cc(CNCc2cccc(Cl)c2)ccc1OCc1cc([N+](=O)[O-])cc2c1OCOC2 604476543 PMQPFLWKWMJYTH-UHFFFAOYSA-N 484.936 5.382 5 20 JKBD C[C@H](C[C@H]1CCCO1)NC(=O)c1ccccc1Sc1ccc(C(F)(F)F)cc1[N+](=O)[O-] 608820652 ZFWPVQQHRLHVRG-UKRRQHHQSA-N 454.470 5.452 5 20 JKBD O=C(C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1)N1CCC[C@@H](c2ccccc2)CC1 608968491 RDGOZKKPVBNGOO-LJQANCHMSA-N 475.511 5.626 5 20 JKBD Cc1ccc(-c2csc(NC(=O)c3cccc(NC(=O)c4cccs4)c3)n2)cc1[N+](=O)[O-] 619729683 MTFMCWWDJKYUHF-UHFFFAOYSA-N 464.528 5.593 5 20 JKBD C[C@H](Nc1ccc(C(=O)Nc2ccc(SC(C)(C)C)cc2)cc1[N+](=O)[O-])c1ccccn1 726758274 UUTIEMXUMWFZSH-INIZCTEOSA-N 450.564 6.306 5 20 JKBD CCC(CC)c1cc[n+](/C(C(=S)Nc2ccc(Cl)nc2)=C(/O)c2ccc([N+](=O)[O-])cc2)cc1 727161619 HRCUZILILIGFTI-UHFFFAOYSA-O 484.001 6.158 5 20 JKBD CC(C)(C)OC(=O)N1CCC[C@H](N(Cc2ccccc2)C(=S)Nc2ccc([N+](=O)[O-])cc2)C1 730439102 XDXDPNRPZOKXKD-NRFANRHFSA-N 470.595 5.193 5 20 JKBD CC(=O)N(C)c1ccc(N[C@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2ccccc2)cc1 744264763 OUYLMDSSVBTEMU-QFIPXVFZSA-N 452.898 5.023 5 20 JKBD C[C@@H](Nc1ccc(N2CCCCCC2)cc1)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 747515844 UQIRAGHJSFYNDN-OAHLLOKOSA-N 450.461 5.433 5 20 JKBD C[C@H](NC(=O)c1cc([N+](=O)[O-])ccc1Br)c1ccc(NC(=O)c2ccc(F)cc2)cc1 751096526 CJNVNJIAOSDWED-ZDUSSCGKSA-N 486.297 5.240 5 20 JKBD CNc1ccc(C(=O)OCC(=O)N2c3ccccc3Sc3ccc(Cl)cc32)cc1[N+](=O)[O-] 780081060 QLIHBQZXKGMCKR-UHFFFAOYSA-N 469.906 5.276 5 20 JKBD CCOc1cc(/C=C(\C(=O)OCC(=O)Nc2ccc(Cl)cc2[N+](=O)[O-])c2ccccc2)ccc1O 786213159 ZKFYOJNHFXCPFM-UNOMPAQXSA-N 496.903 5.075 5 20 JKBD Cc1oc(-c2cccs2)nc1CC(=O)Nc1cc(Cl)c([N+](=O)[O-])cc1OCc1ccccc1 818895684 VJHSIMFNZDFCRQ-UHFFFAOYSA-N 483.933 6.033 5 20 JKBD Cc1cccc(NC(=O)[C@@H](C)OC(=O)C2CCN(c3ccc(C(F)(F)F)cc3[N+](=O)[O-])CC2)c1C 856393200 NAFYHFMFRPYRHD-MRXNPFEDSA-N 493.482 5.017 5 20 JKBD CCCOc1ccccc1NC(=O)c1ccc(NS(=O)(=O)c2ccc(Cl)c([N+](=O)[O-])c2)cc1 873134557 BEVHUCUXDLLBHO-UHFFFAOYSA-N 489.937 5.090 5 20 JKBD Cc1cc(C)n(-c2ccc(-c3noc(-c4ccc(N[C@@H](C)c5ccccn5)c([N+](=O)[O-])c4)n3)cn2)n1 904522259 PXVNWRAOZWYVFL-KRWDZBQOSA-N 482.504 5.077 5 20 JKBD C[C@@H](OC(=O)CCOc1ccc(Cl)c(Cl)c1)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 914962474 PVIGBLKGPUAQGX-LLVKDONJSA-N 452.250 5.025 5 20 JKBD Cc1ccc(NC(=S)Nc2ccc(NS(=O)(=O)c3ccc(C)c([N+](=O)[O-])c3)cc2)c(C)c1 916119942 BKUUICSYTDFUKY-UHFFFAOYSA-N 470.576 5.130 5 20 JKBD Cc1ccc(C(C)C)c(O[C@@H](C)C(=O)N(Cc2nnc(-c3cccc([N+](=O)[O-])c3)o2)C(C)C)c1 916370015 ZIHFCKLWIZTQRD-SFHVURJKSA-N 466.538 5.281 5 20 JKBD C[C@@H](Nc1ccc(C(=O)OCc2coc(-c3cccc(Cl)c3)n2)cc1[N+](=O)[O-])c1ccccn1 920544627 DLRJINAPIJULMU-OAHLLOKOSA-N 478.892 5.828 5 20 JKBD O=C(CCOc1ccccc1F)Oc1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2Cl)cc1 923513958 IDYQXTRSFYHTKQ-UHFFFAOYSA-N 458.829 5.014 5 20 JKBD O=C(CSc1ccccc1[N+](=O)[O-])NC1(c2ccc(NC(=O)c3ccccc3F)cc2)CCC1 1790215667 TUXLSMHQJAJJOV-UHFFFAOYSA-N 479.533 5.274 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)C3(c4cccc([N+](=O)[O-])c4)CCC3)CCC2)cc1)[C@H]1C[C@@]1(F)Cl 1791675150 QBMZLYRVSGMJOB-NLFFAJNJSA-N 485.943 5.075 5 20 JKBD CC1(C(=O)NC[C@H]2CCN(C(=O)c3cc4cc([N+](=O)[O-])ccc4s3)[C@H]2c2cccnc2)CCCC1 1802625745 TXRWEYGHOFCBPH-JPYJTQIMSA-N 492.601 5.104 5 20 JKBD CC1(C)CCC(CC(=O)N2CC[C@H](CNC(=O)c3cc(F)cc([N+](=O)[O-])c3)[C@H]2c2cccnc2)CC1 1811306918 XFOHIKNNDFNGAN-CJFMBICVSA-N 496.583 5.055 5 20 JKBD CCC[C@H]1CC[C@H](C(=O)NC[C@H]2CCN(C(=O)c3cc(F)cc([N+](=O)[O-])c3)[C@@H]2c2cccnc2)CC1 1812790068 OTDUGAHCZQYRMX-JJPBMRITSA-N 496.583 5.055 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2ccc(Cl)s2)[nH]n1 1821283761 ZICPLYOPXYLVBP-OAHLLOKOSA-N 491.932 5.100 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cc3ccoc3s2)CC1 1827413250 HMBHZUGSZLBNJW-FQEVSTJZSA-N 499.564 5.397 5 20 JKBD Cc1cc(C(=O)N2CCC([C@@H]3CCCCN3C(=O)C3(c4cccc([N+](=O)[O-])c4)CCC3)CC2)c(C)o1 1830291619 QQFSKJSWZSGOTL-VWLOTQADSA-N 493.604 5.160 5 20 JKBD C/C(=C\c1cccs1)C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cc(F)cc([N+](=O)[O-])c2)CC1 1830613249 VXOOHJZYAKJUMF-ILAWTMEDSA-N 485.581 5.132 5 20 JKBD Cc1cc(F)cc(C(=O)N2CCC([C@@H]3CCCCN3C(=O)CSc3ccccc3[N+](=O)[O-])CC2)c1 1831777209 IZUSFUMVGWUKJN-QFIPXVFZSA-N 499.608 5.068 5 20 JKBD O=C(NCc1ccc(NC(=O)c2ccco2)cc1)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1 11145801 UKCRBIZSMKRHBB-UHFFFAOYSA-N 491.887 5.816 5 20 JKBD COc1c(Br)cc(Cl)cc1NC(=O)c1ccc(Br)c([N+](=O)[O-])c1 14555632 CUQKHEFTHNWRQH-UHFFFAOYSA-N 464.497 5.034 5 20 JKBD COc1ccccc1CNC(=O)C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1 15653516 VNIDMNIEERNZHO-RGEXLXHISA-N 459.527 5.460 5 20 JKBD CCOc1ccccc1NC(=O)[C@H](OC(=O)c1cc(Cl)ccc1[N+](=O)[O-])c1ccccc1 23515099 WYISKTXDLYEINP-OAQYLSRUSA-N 454.866 5.184 5 20 JKBD O=C(OCc1nnc(-c2ccc([N+](=O)[O-])cc2)o1)c1c(NC(=O)C2CCCCC2)sc2c1CCC2 23947821 DMMUKDMILYNXAV-UHFFFAOYSA-N 496.545 5.071 5 20 JKBD CCN(Cc1cccc(NC(=O)c2ccc(Sc3nc(C)cs3)c([N+](=O)[O-])c2)c1)C(C)=O 27037916 UXRXHFNVLUIUIL-UHFFFAOYSA-N 470.576 5.132 5 20 JKBD CCOc1ccccc1NC(=O)[C@@H](Sc1nc2ccc([N+](=O)[O-])cc2s1)c1ccccc1 28302998 FSYNBXOTEGLXHL-NRFANRHFSA-N 465.556 6.075 5 20 JKBD Cc1noc(C)c1COc1ccc(CC(=O)Nc2ccc([N+](=O)[O-])cc2C(=O)c2ccccc2)cc1 217563807 WCURVOUUSGBVOY-UHFFFAOYSA-N 485.496 5.191 5 20 JKBD Cc1nc(S[C@H](C)C(=O)Nc2nc(-c3cccc([N+](=O)[O-])c3)cs2)c2ccccc2n1 255927434 SJFYSTOYXHLMEZ-GFCCVEGCSA-N 451.533 5.089 5 20 JKBD C[C@@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)N[C@H]1CCCc2nc(-c3ccc(F)cc3)sc21 303258182 OSYZCSJOFBWMEF-ACJLOTCBSA-N 457.552 5.532 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)N(Cc2ccccn2)c2ccc(Br)cc2)cc1SC 483464544 MSPPIEFTDIEDTO-UHFFFAOYSA-N 488.363 5.330 5 20 JKBD O=C(c1ccc(NCc2ccccc2)c([N+](=O)[O-])c1)N1CCC(c2nc3cc(Cl)ccc3o2)CC1 485400490 CZKUWBOUVLVMNO-UHFFFAOYSA-N 490.947 6.021 5 20 JKBD O=C(Cn1c2ccccc2c(=O)c2ccccc21)NC1(c2cccc(Br)c2)CCC1 490265041 WBFNOLXESGTUCZ-UHFFFAOYSA-N 461.359 5.113 5 20 JKBD CCN(C(=O)c1csc(-c2cccc([N+](=O)[O-])c2)n1)[C@H]1CCN([C@@H](C)c2ccccc2)C1 501942159 BKQCNXLNRGCLKC-UWJYYQICSA-N 450.564 5.016 5 20 JKBD C[C@@H](Nc1ccc(C(=O)Nc2nc(-c3cccs3)cs2)cc1[N+](=O)[O-])c1ccccn1 507154061 GZXYOCNSITYTEU-CYBMUJFWSA-N 451.533 5.600 5 20 JKBD C[C@H](Nc1ccc(C(=O)Nc2cc(Cl)ccc2OC[C@@H]2CCCO2)cc1[N+](=O)[O-])c1ccccn1 509814311 SZFVEZXRXMJPJC-LPHOPBHVSA-N 496.951 5.626 5 20 JKBD C[C@H](Nc1cccc(COCC(F)(F)C(F)F)c1)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl 511029661 PHWZRNZCXNHJBU-NSHDSACASA-N 463.815 5.104 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Br)[C@H](NCCCOc1ccccc1)c1ccccc1 514691886 NJMRFHGPOVHVNC-JOCHJYFZSA-N 484.350 5.096 5 20 JKBD COCCN(C(=O)Cc1coc(-c2ccc(Cl)cc2)n1)c1nc(-c2ccc([N+](=O)[O-])cc2)cs1 517154444 TZAHNGXOJDHYAS-UHFFFAOYSA-N 498.948 5.249 5 20 JKBD COc1ccc(CNCc2cccc(NC(=O)c3ccc(Cl)cc3Cl)c2)cc1[N+](=O)[O-] 518776014 QNOBQJZCVMRAPO-UHFFFAOYSA-N 460.317 5.452 5 20 JKBD CC(C)CCSc1ccc(C(=O)N2CCC(NC(=O)Nc3ccc(F)cc3)CC2)cc1[N+](=O)[O-] 520039628 WGBIRIIGEMJVTO-UHFFFAOYSA-N 488.585 5.298 5 20 JKBD CS(=O)(=O)c1cc(C(=O)Nc2ccc(Oc3ccccc3C(F)(F)F)c(F)c2)cc([N+](=O)[O-])c1 521290823 PCHSLIFMKLFQEC-UHFFFAOYSA-N 498.410 5.201 5 20 JKBD O=C(Cc1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2NCc2ccccc2)cc1)Nc1ccccc1F 524386151 NDWSGXGZNCXLLT-UHFFFAOYSA-N 498.514 5.780 5 20 JKBD CCOc1cc(NC(=O)N2CCC(c3nc4ccccc4s3)CC2)c([N+](=O)[O-])cc1OCC 603651237 BYFDTWXESDUXQA-UHFFFAOYSA-N 470.551 5.413 5 20 JKBD CCOc1cc([N+](=O)[O-])c(C(=O)Nc2ccc(-c3nc4c(Cl)cccc4[nH]3)cc2)cc1OC 608947958 KTUKISWOELEBCE-UHFFFAOYSA-N 466.881 5.451 5 20 JKBD COc1nc(C)cc(C)c1CNC(=O)C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1 608972100 SZZSRLIIJPFSPE-UYRXBGFRSA-N 488.569 5.472 5 20 JKBD CC[C@H](NCc1ccc(-c2ccc([N+](=O)[O-])cc2Br)o1)c1nnc2n1CCCCC2 609006792 WZSQCXKWFZVOLS-SFHVURJKSA-N 474.359 5.176 5 20 JKBD Cc1c(N[C@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2C(F)(F)F)cccc1OCC(F)(F)F 609041944 PKFCUGCIHXMRDD-LLVKDONJSA-N 465.350 5.302 5 20 JKBD CC(C)OC(=O)C[C@H](NC(=O)Nc1cccc(C(=O)c2ccccc2)c1)c1ccccc1[N+](=O)[O-] 609210922 UHOCUICIDRXNCM-QFIPXVFZSA-N 475.501 5.030 5 20 JKBD CCN(Cc1ccc(OCc2cccs2)c(OC)c1)C(=O)c1c[nH]c2cc([N+](=O)[O-])ccc12 609600267 PUKKRCFOLJBWHS-UHFFFAOYSA-N 465.531 5.388 5 20 JKBD O=C(Cn1c2ccccc2c(=O)c2ccccc21)Nc1cc(C2CCCC2)nn1-c1ccccc1 648858102 GNUAWWBYDKLDHL-UHFFFAOYSA-N 462.553 5.637 5 20 JKBD COc1ccc(/C=C(/Cl)c2nc(=O)c3cc(Cl)ccc3[nH]2)cc1OCc1ccc([N+](=O)[O-])cc1 730584369 VCRHRNMZZRCSHW-VXLYETTFSA-N 498.322 5.809 5 20 JKBD CC(C)[C@H](OC(=O)c1csc(-c2ccc([N+](=O)[O-])cc2)n1)C(=O)N1CCSc2ccccc21 747957327 NZXRYOFTCCBSQP-FQEVSTJZSA-N 483.571 5.039 5 20 JKBD CCc1nnc(COC(=O)c2c3c(nc4ccccc24)/C(=C\c2ccc([N+](=O)[O-])cc2)CCC3)o1 808349533 XTIDOTYWPJVAID-VKAVYKQESA-N 470.485 5.322 5 20 JKBD O=C(C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)Nc1ccc(F)c(C(=O)O)c1 914729479 IICYGCHMEWDIJC-PTNGSMBKSA-N 477.473 5.611 5 20 JKBD C[C@@H](OC(=O)c1ccccc1N(C)C(=O)c1ccc(Br)o1)c1cccc([N+](=O)[O-])c1 920158772 PPYIOQGKLMIOFX-CYBMUJFWSA-N 473.279 5.145 5 20 JKBD O=C(Cc1cn(-c2ccccc2)nc1-c1ccc(F)cc1)Nc1cc([N+](=O)[O-])c(F)cc1F 920814890 DSFIQZTZZURUMI-UHFFFAOYSA-N 452.392 5.046 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)c3cccc(F)c3Cl)CCC2)cc1)c1ccc([N+](=O)[O-])o1 1785751187 SLTXRBGNJZAODE-UHFFFAOYSA-N 457.845 5.042 5 20 JKBD O=C(NC1(c2ccc(NC(=O)c3cc(-c4ccccc4)on3)cc2)CCC1)c1ccc(O)c([N+](=O)[O-])c1 1785785359 MZFUSIWXDLFZJE-UHFFFAOYSA-N 498.495 5.017 5 20 JKBD Cc1cc(C(=O)NC2(c3ccc(NC(=O)c4ccc5occc5c4)cc3)CCC2)ncc1[N+](=O)[O-] 1789049409 ZXTPWCUCHWOOMR-UHFFFAOYSA-N 470.485 5.106 5 20 JKBD CN(C)c1ccc([N+](=O)[O-])cc1C(=O)NC1(c2ccc(NC(=O)C[C@@H]3C[C@@H]4CC[C@H]3C4)cc2)CCC1 1791325556 MRKIIMABNYWVBI-AABGKKOBSA-N 490.604 5.235 5 20 JKBD Cc1ccc(CCC(=O)Nc2ccc(C3(NC(=O)c4cc(F)cc([N+](=O)[O-])c4)CCC3)cc2)c(C)n1 1791772481 RJNVXJZNXLNSAQ-UHFFFAOYSA-N 490.535 5.126 5 20 JKBD Cc1ccc([C@@H](C)C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)cc1 1801206756 HOJYOZJECTXDRO-RZXSNQJFSA-N 477.586 5.173 5 20 JKBD Cc1ccc(-c2ccccc2C(=O)N2CCCC[C@H]2c2cc(NC(=O)c3ccc([N+](=O)[O-])o3)n[nH]2)cc1 1814312059 VNRUWBBUMOWZLM-QFIPXVFZSA-N 499.527 5.506 5 20 JKBD Cc1occc1C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)[nH]n1 1816437126 ZOGFQFNLARDQCY-SFHVURJKSA-N 479.518 5.054 5 20 JKBD Cc1c(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3cccc(F)c3[N+](=O)[O-])CC2)oc2ccccc12 1828128481 SNHHGFSKEXOFGQ-JOCHJYFZSA-N 493.535 5.336 5 20 JKBD O=C(CCc1cccc([N+](=O)[O-])c1)N1CCC([C@@H]2CCCCN2C(=O)c2ccccc2Cl)CC1 1829891998 BSHRDQOOANEHBK-DEOSSOPVSA-N 483.996 5.114 5 20 JKBD C/C(=C\c1cccs1)C(=O)N1CCC([C@H]2CCCCN2C(=O)Cc2cc(F)ccc2[N+](=O)[O-])CC1 1832885175 KEJLQXYCGUNALX-KEWFZMHCSA-N 499.608 5.061 5 20 JKBD CC(=O)CCc1ccc2oc(C(=O)O[C@H](C)C(=O)Nc3ccc([N+](=O)[O-])cc3Cl)c(C)c2c1 8807209 ZVDVUVBCWSXUMI-CQSZACIVSA-N 472.881 5.008 5 20 JKBD C[C@@H](OC(=O)c1ccccc1C(=O)c1ccc(Cl)c([N+](=O)[O-])c1)C(=O)N1CCCc2ccccc21 11029248 FULHASUPHIPKKB-MRXNPFEDSA-N 492.915 5.004 5 20 JKBD Cc1oc(-c2cccs2)nc1COC(=O)c1ccccc1NC(=O)c1ccc([N+](=O)[O-])cc1Cl 11145543 WUDSTQOLYKPVIY-UHFFFAOYSA-N 497.916 5.882 5 20 JKBD C[C@@H](OC(=O)c1nc(Cl)c(Cl)c(Cl)c1Cl)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl 12682693 HOFCYNXRPUBIAA-RXMQYKEDSA-N 487.510 5.441 5 20 JKBD C[C@H](OC(=O)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1)C(=O)Nc1ccccc1Cl 17109876 JSFJVHDMRDMSLX-ZDUSSCGKSA-N 499.873 5.054 5 20 JKBD NC(=S)/C(=C\c1ccc(Oc2ccccc2Cl)c([N+](=O)[O-])c1)c1nc2ccccc2[nH]1 17476342 GVKPVSFEEDIBIP-SDNWHVSQSA-N 450.907 5.744 5 20 JKBD COc1ccc([N+](=O)[O-])cc1C(=O)OCc1csc(N(C(C)=O)c2c(C)cc(C)cc2Cl)n1 19285027 ZZNYSOSGTYNOMH-UHFFFAOYSA-N 489.937 5.372 5 20 JKBD O=C(CCSc1nnc(-c2cccs2)n1Cc1ccccc1)Nc1ccccc1[N+](=O)[O-] 26220877 MMARIAFJVWMXKW-UHFFFAOYSA-N 465.560 5.084 5 20 JKBD O=C(Nc1ccccc1C(=O)Nc1ccc(Br)cc1)c1ccc([N+](=O)[O-])cc1Cl 29507356 WWAJKXJCQQOYRN-UHFFFAOYSA-N 474.698 5.515 5 20 JKBD C[C@@H](OC(=O)c1ccc2nc(Cl)ccc2c1)C(=O)Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1 107661326 WVAGKQGUJVKUAZ-GFCCVEGCSA-N 482.905 5.104 5 20 JKBD Cc1noc(C)c1COc1ccc(CC(=O)Nc2nc(-c3cccc([N+](=O)[O-])c3)c(C)s2)cc1 195703841 FPVIUBJAKNICMY-UHFFFAOYSA-N 478.530 5.392 5 20 JKBD COc1ccccc1C[C@H]1CCCN1C(=O)c1ccc(N[C@H](C)c2ccccn2)c([N+](=O)[O-])c1 302981620 KMYIAKZNPVVQBU-WIYYLYMNSA-N 460.534 5.019 5 20 JKBD O=C(c1csc(-c2ccc([N+](=O)[O-])cc2)n1)N1CCCC[C@@H]1c1nc(-c2ccccc2)no1 303231169 VPEWYBLEDVGTHR-LJQANCHMSA-N 461.503 5.136 5 20 JKBD C[C@H](Nc1ccc(C(=O)NC[C@@H]2CCCO[C@@H]2c2ccccc2)cc1[N+](=O)[O-])c1ccccn1 409571659 QZTKDGLXUHGTFL-CTIGNXTNSA-N 460.534 5.061 5 20 JKBD C[C@@H](c1ccc(C(F)(F)F)cc1)N(C)C(=O)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-] 480124202 LRRXDUBVDZPDOY-NSHDSACASA-N 450.335 5.388 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)N(Cc2cc(Br)ccc2F)C2CC2)cc1SC 482623510 KKXDRTKMJCHIMU-UHFFFAOYSA-N 469.332 5.032 5 20 JKBD Cc1ccc(C(=O)Nc2ccccc2)cc1NC(=O)c1ccc(NCc2ccccc2)c([N+](=O)[O-])c1 483212267 WWGXWGMZRKXFLV-UHFFFAOYSA-N 480.524 6.020 5 20 JKBD Cc1ccc(Br)cc1NC(=O)CCNC(=O)c1cc2ccccc2c2cccnc12 499488195 PIVOXPPBBAHBEQ-UHFFFAOYSA-N 462.347 5.218 5 20 JKBD COc1cc(CN[C@H]2CCOc3c(Cl)cccc32)ccc1OCc1ccc([N+](=O)[O-])cc1 507902499 KCAIWSZUYPSYNV-NRFANRHFSA-N 454.910 5.449 5 20 JKBD Cc1ccc(N(C(=O)c2cc([N+](=O)[O-])cc(S(C)(=O)=O)c2)c2nc3ccccc3s2)c(C)c1 508579037 PPJPJRBNLBUZAV-UHFFFAOYSA-N 481.555 5.203 5 20 JKBD COc1cccc(Oc2ccc(N[C@@H](C)C(=O)Nc3ccc([N+](=O)[O-])cc3C(F)(F)F)cc2)c1 511006858 AGFRGSPLBCTDLB-AWEZNQCLSA-N 475.423 5.854 5 20 JKBD CCCC(=O)Nc1cccc(NC(=O)c2cc([N+](=O)[O-])ccc2Oc2ccc(OC)cc2)c1C 512855757 IGRAKVUTCRLYMS-UHFFFAOYSA-N 463.490 5.695 5 20 JKBD O=C(Nc1nc2ccc(OCC(F)(F)F)cc2s1)C1CCN(c2ccccc2[N+](=O)[O-])CC1 515422269 MEVWSOAOYMXBOL-UHFFFAOYSA-N 480.468 5.001 5 20 JKBD CSc1ccc(C(=O)c2ccccc2C(=O)Nc2cccc(-c3ncc(C)o3)c2)cc1[N+](=O)[O-] 517510583 HQDOMUVRXYUPGZ-UHFFFAOYSA-N 473.510 5.763 5 20 JKBD O=[N+]([O-])c1cc(S(=O)(=O)Nc2ccccc2)ccc1NCc1ccc(Oc2cccnc2)c(F)c1 518688453 WPCBPFSRUBONGN-UHFFFAOYSA-N 494.504 5.334 5 20 JKBD COc1ccc(Br)c(NC(=O)c2ccc(N3C[C@@H](C)C[C@H](C)C3)c([N+](=O)[O-])c2)c1 523356345 AKDSSSRUZFADKB-KBPBESRZSA-N 462.344 5.101 5 20 JKBD CCOc1cc(NC(=O)c2cccc(NC(=O)c3ccc(F)cc3)c2)c([N+](=O)[O-])cc1OCC 603616564 FLHZZPJWKCWURF-UHFFFAOYSA-N 467.453 5.036 5 20 JKBD CCOc1cc([N+](=O)[O-])c(C(=O)N[C@H](C)c2sc(-c3ccc(F)cc3)nc2C)cc1OC 609186652 YBIOKOAOPHNUAR-GFCCVEGCSA-N 459.499 5.064 5 20 JKBD Cc1ccc(-c2nc(C)c([C@H](C)N[C@@H](C)C(=O)Nc3ccc([N+](=O)[O-])cc3Cl)s2)cc1 609352756 BYOCCDYRRMHDOQ-ZFWWWQNUSA-N 458.971 5.666 5 20 JKBD COc1ccc(OC)c(NC(=S)/C(=C(/O)c2ccc([N+](=O)[O-])cc2)[n+]2ccc3c(c2)CCCC3)c1 726569867 KZIMCBJUSHIOGL-UHFFFAOYSA-O 492.577 5.102 5 20 JKBD COc1ccccc1[C@H](NCc1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1)c1nccn1C 726607253 LNYZFQUOZDFQLO-MHZLTWQESA-N 494.555 5.069 5 20 JKBD COc1ccc([N+](=O)[O-])cc1C(=O)Nc1ccc(NC(=O)OC(C)(C)C)cc1C(F)(F)F 729654977 BYDVUYHSBXIPMR-UHFFFAOYSA-N 455.389 5.222 5 20 JKBD O=C(C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)NCc1ccnc(-n2ccnc2)c1 743958848 KTUCALJYUBGDFT-DEDYPNTBSA-N 496.552 5.032 5 20 JKBD C[C@H](NC(=O)[C@@H](C)OC(=O)c1csc(-c2ccc([N+](=O)[O-])cc2)n1)c1ccc2c(c1)CCCC2 747958179 UUJWXSBHKVGBRC-JKSUJKDBSA-N 479.558 5.020 5 20 JKBD Cn1c(COc2ccccc2Cl)nnc1Sc1cc(Cl)c(C(F)(F)F)cc1[N+](=O)[O-] 799766466 ZVYWDUOOROCJHM-UHFFFAOYSA-N 479.267 5.779 5 20 JKBD COc1ccc(-c2nc(COc3ccc4c(-c5ccc([N+](=O)[O-])cc5)cc(=O)oc4c3)co2)cc1 873960912 MQMZUOMVQJGXCC-UHFFFAOYSA-N 470.437 5.611 5 20 JKBD O=[N+]([O-])c1c(-c2nc(-c3ccc(-n4cnc5ccccc54)nc3)no2)ccnc1-c1ccccc1 904487899 DQRIYQINNQGQPP-UHFFFAOYSA-N 461.441 5.108 5 20 JKBD O=[N+]([O-])c1cc(Cl)ccc1OCCc1nc(-c2ccc(Oc3ccc(F)cc3)nc2)no1 904509435 DVHNHFFSTSWSNB-UHFFFAOYSA-N 456.817 5.246 5 20 JKBD O=[N+]([O-])c1ccc(-c2nc(-c3nc(-c4ccc(Oc5ccc(F)cc5)nc4)no3)cs2)cc1 904510141 LCRSXERBKSEASO-UHFFFAOYSA-N 461.434 5.762 5 20 JKBD COc1ccc(Oc2ccc([N+](=O)[O-])cc2C(=O)O[C@@H](C)c2nnc(-c3cccc(C)c3)o2)cc1 915250270 RKNAHRCSUWIJFC-INIZCTEOSA-N 475.457 5.672 5 20 JKBD COc1ccc(N2C(=S)N[C@H](c3cccs3)C(C(=O)Nc3ccc([N+](=O)[O-])cc3)=C2C)cc1 916167921 HHKBHJBABKRVJF-OAQYLSRUSA-N 480.571 5.013 5 20 JKBD CO[C@@H](C(=O)NC1(c2ccc(NC(=O)CCc3cccc([N+](=O)[O-])c3)cc2)CCC1)c1ccccc1 1786602390 NWFPLDQFXDZULR-AREMUKBSSA-N 487.556 5.049 5 20 JKBD O=C(Cc1cc([N+](=O)[O-])ccc1F)NC1(c2ccc(NC(=O)c3cccc4cccnc34)cc2)CCC1 1788909731 PFXRAIBVTYDWKB-UHFFFAOYSA-N 498.514 5.273 5 20 JKBD O=C(NC1(c2ccc(NC(=O)C3(c4cccc([N+](=O)[O-])c4)CCC3)cc2)CCC1)[C@@H]1[C@H]2C=CS[C@H]21 1790476643 PVRRBTMOVFBVMK-DNVJHFABSA-N 489.597 5.026 5 20 JKBD O=C(Cc1cc(F)ccc1[N+](=O)[O-])Nc1ccc(C2(NC(=O)c3scnc3C3CC3)CCC2)cc1 1792308469 RFNIYIWEIYAKNS-UHFFFAOYSA-N 494.548 5.058 5 20 JKBD Cc1csc(C(=O)N2CCCC3(CCN(C(=O)c4cc(Cl)cc([N+](=O)[O-])c4C)CC3)C2)c1 1806242139 HKTOICDGJKKXAD-UHFFFAOYSA-N 475.998 5.085 5 20 JKBD O=C(c1cccc(F)c1[N+](=O)[O-])N1CCC([C@H]2CCCCN2C(=O)c2c(F)cccc2Cl)CC1 1829899011 ISHUAIYFXVTAKI-HXUWFJFHSA-N 491.922 5.074 5 20 JKBD C[C@@H](OC(=O)Cc1ccc(-c2ccccc2)cc1)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 10715697 KMSFKQBYJSRCBH-OAHLLOKOSA-N 472.419 5.394 5 20 JKBD C[C@H](Sc1nnc(-c2ccccc2)n1-c1ccc(F)cc1)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 17532881 SEFXUWZAEFLFJE-HNNXBMFYSA-N 488.504 5.885 5 20 JKBD CCOc1cc(/C=C(\Cl)c2nc3cc([N+](=O)[O-])ccc3[nH]2)cc(Br)c1OC 18064332 DXJUSKJCZPZHSK-QPEQYQDCSA-N 452.692 5.378 5 20 JKBD CCCCc1ccc(-n2nnnc2S[C@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2C(F)(F)F)cc1 21352813 ZFIAWFKUOIOOCZ-CYBMUJFWSA-N 494.499 5.051 5 20 JKBD C[C@@H](OC(=O)Cn1c2ccccc2c(=O)c2ccccc21)C(=O)N[C@H](C)c1cccc2ccccc12 28775142 SFKVUEKOKZNWPO-WOJBJXKFSA-N 478.548 5.117 5 20 JKBD Cc1csc(Sc2ccc(C(=O)Nc3ccccc3Br)cc2[N+](=O)[O-])n1 28882180 MNZHNHWOZHCANK-UHFFFAOYSA-N 450.339 5.526 5 20 JKBD CC(C)[C@H](Sc1nc2cc3ccccc3cc2c(=O)n1C)C(=O)Nc1ccccc1Cl 32328353 GWZMZMSWDZSRDA-NRFANRHFSA-N 451.979 5.496 5 20 JKBD C[C@@H](Nc1ccc(C(=O)c2ccccc2)cc1[N+](=O)[O-])c1cc(F)ccc1N1CCC(O)CC1 78656497 DOBAPXJFSVORHI-QGZVFWFLSA-N 463.509 5.099 5 20 JKBD O=C(c1cc(NC[C@H](c2ccccc2)N2CCc3sccc3C2)ccc1[N+](=O)[O-])N1CCCC1 302953117 KOVDNWKWZIVLBO-XMMPIXPASA-N 476.602 5.104 5 20 JKBD C[C@@H](N[C@H](Cc1cccc(F)c1)c1cccc(F)c1)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 303015496 SAXRWUNAZBZJFB-JLCFBVMHSA-N 493.432 5.792 5 20 JKBD CCOc1cc(C(=O)N[C@H](C)c2ccc(NC(=O)Nc3ccccc3)cc2)c([N+](=O)[O-])cc1OC 480773078 DVNANSXNXGMWTE-MRXNPFEDSA-N 478.505 5.137 5 20 JKBD C[C@@H](NC(=O)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1)c1ccc(NC(=O)NC2CC2)cc1 483209839 PSJJLEMFUOKXJY-OAHLLOKOSA-N 494.935 5.815 5 20 JKBD COc1cc(Cc2nc(O)c3cc4ccccc4cc3n2)cc(Br)c1OCC(F)(F)F 498851701 MDVSKFYOFBRKMW-UHFFFAOYSA-N 493.279 5.792 5 20 JKBD COc1cc(C(=O)Nc2cccc(C(=O)c3ccccc3)c2)c([N+](=O)[O-])cc1OCc1cscn1 505404172 DVJCTAYAPAWPAB-UHFFFAOYSA-N 489.509 5.122 5 20 JKBD C[C@@H](Nc1ccc(C(=O)Nc2nc(-c3ccc(F)c(F)c3)cs2)cc1[N+](=O)[O-])c1ccccn1 506233561 HMCDYKLHPGIYGV-CYBMUJFWSA-N 481.484 5.817 5 20 JKBD O=C(Nc1cccc(N2CCCC2)c1)N1CCN(Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)CC1 506635763 MGOKVSWAUNWTMX-UHFFFAOYSA-N 491.617 5.273 5 20 JKBD C[C@H](Nc1ccc(C(=O)N(C)Cc2ccccc2N2CCCC2)cc1[N+](=O)[O-])c1ccccn1 507158396 DNYFVBVRQXNCTE-IBGZPJMESA-N 459.550 5.035 5 20 JKBD C[C@H](Nc1ccc(C(=O)Nc2cccc(COCc3ccco3)c2)cc1[N+](=O)[O-])c1ccccn1 507393230 TXEXKMSUNURHDX-SFHVURJKSA-N 472.501 5.725 5 20 JKBD COc1cc(CN[C@@H](c2ccc(F)cc2)[C@H]2CCCO2)ccc1OCc1ccc([N+](=O)[O-])cc1 507910632 ABMGSKQTDPVOPG-RSXGOPAZSA-N 466.509 5.331 5 20 JKBD O=C(Nc1ccccc1Oc1ccccc1Cl)c1ccc([N+](=O)[O-])cc1I 508785978 UFJNIHWNXYIFSE-UHFFFAOYSA-N 494.672 5.897 5 20 JKBD CCn1c(SCC(=O)N(C)[C@H](C)c2ccc(F)c(F)c2)nc2cc3ccccc3cc2c1=O 510383924 HXBNWUSUDJEDJD-OAHLLOKOSA-N 467.541 5.160 5 20 JKBD C[C@@H](Sc1nnc(-c2ccc(OC(F)F)cc2)o1)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl 515311056 FTSZWVBXBXAPKG-SECBINFHSA-N 470.841 5.019 5 20 JKBD Cc1cc(C(=O)Nc2cc(NC(=O)c3cccc(C(F)(F)F)c3)ccc2C)cc([N+](=O)[O-])c1 521289570 ZDPAJVJCIWSPBX-UHFFFAOYSA-N 457.408 5.735 5 20 JKBD Cc1nn(-c2ccccc2)cc1CCCNC(=O)c1ccc(N[C@H](C)c2ccccn2)c([N+](=O)[O-])c1 551928001 CHBPEJMDVWAFOI-HXUWFJFHSA-N 484.560 5.020 5 20 JKBD CSc1ccc(C(=O)c2ccccc2C(=O)NCc2cc(-c3ccccc3)on2)cc1[N+](=O)[O-] 572305939 GYFXFMCZQMYZLR-UHFFFAOYSA-N 473.510 5.133 5 20 JKBD COc1cc(C(=O)Nc2ccc(-c3nc4ccccc4s3)cc2)c([N+](=O)[O-])cc1OC(F)F 585704763 JGYGETRPRLFZGK-UHFFFAOYSA-N 471.441 5.734 5 20 JKBD Cc1nn(Cc2ccc(C(=O)N(CCc3ccccc3F)C3CCCC3)cc2)c(C)c1[N+](=O)[O-] 603531497 ZRBNSMRLPRVQJK-UHFFFAOYSA-N 464.541 5.223 5 20 JKBD CSc1ccc(C(=O)c2ccccc2C(=O)Nc2ccc(C)c(NC(C)=O)c2)cc1[N+](=O)[O-] 603774440 HNXAZEZIZRFIRI-UHFFFAOYSA-N 463.515 5.067 5 20 JKBD O=C(CCCn1c(=O)oc2cc([N+](=O)[O-])ccc21)N(Cc1ccccc1)c1ccc(Cl)cc1 603990550 YCUBFHCDZXKCND-UHFFFAOYSA-N 465.893 5.170 5 20 JKBD O=C(Nc1cccc(C(=O)N2CCCCC2)c1)c1cc([N+](=O)[O-])ccc1Sc1ccccc1 603991010 SIMFDCOZZWCXML-UHFFFAOYSA-N 461.543 5.624 5 20 JKBD CCCOc1ccc(CN[C@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2ccccc2)cc1 604045720 MDTVETKPHJBJHS-QHCPKHFHSA-N 453.926 5.507 5 20 JKBD CN1CCC2(CC1)C[C@@H](NC(=O)c1cc([N+](=O)[O-])ccc1Oc1ccccc1)c1ccccc1O2 604104015 YEDTVOVSVLHVHE-HSZRJFAPSA-N 473.529 5.105 5 20 JKBD Cc1ccc(NC(=O)c2ccc(Nc3ccc(F)c(NC(=O)c4ccoc4C)c3)c([N+](=O)[O-])c2)cc1 608972709 AMYKGHSBXGEPMK-UHFFFAOYSA-N 488.475 6.192 5 20 JKBD Cc1c(C(=O)Nc2ccc(N[C@@H](C)c3ccccc3)c(Cl)c2)nnn1-c1cccc([N+](=O)[O-])c1 609072444 QEYXEWIZLSOXEK-HNNXBMFYSA-N 476.924 5.563 5 20 JKBD C[C@@H](Nc1ccc(C(=O)Oc2cccc(OCC(F)(F)F)c2)cc1[N+](=O)[O-])c1ccccn1 727053106 MBCLENRQTSAZIY-CQSZACIVSA-N 461.396 5.323 5 20 JKBD CC(C)[C@H](Sc1ccccc1)C(=O)O[C@@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 727212931 SGVMUKSENIAQRU-UGSOOPFHSA-N 470.469 5.301 5 20 JKBD C[C@H](Oc1cc(Cl)cc(Cl)c1)C(=O)O[C@H](C)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 727216796 DGVPVNUZTSYTLH-MNOVXSKESA-N 452.250 5.023 5 20 JKBD COc1ccccc1C[C@@H](C)CC(=O)Oc1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2Cl)cc1 730469008 CRCVPSMGAMMCQB-MRXNPFEDSA-N 482.920 5.683 5 20 JKBD CC(C)[C@@H](OC(=O)c1csc(-c2ccc([N+](=O)[O-])cc2)n1)C(=O)Nc1ccc2c(c1)CCC2 747958212 VVAWUENRWVEVCP-OAQYLSRUSA-N 465.531 5.027 5 20 JKBD O=C(Nc1cc(C(F)(F)F)ccc1N1CCCCC1)c1cc([N+](=O)[O-])ccc1Br 751046214 KHGIYQKWKGEZPN-UHFFFAOYSA-N 472.261 5.619 5 20 JKBD O=[N+]([O-])c1cc(C(F)(F)F)ccc1N1CCC(c2nc(-c3ccc(Br)cn3)no2)CC1 904848311 IOEJOUPJDIZGTP-UHFFFAOYSA-N 498.259 5.205 5 20 JKBD COc1cc(C(=O)NC[C@@H]2CCCC[C@@H]2C(C)(C)C)c([N+](=O)[O-])cc1OCc1cscn1 920042576 ZEWACZIAHYKAGN-YJBOKZPZSA-N 461.584 5.221 5 20 JKBD CC1=C(C(=O)Nc2cccc([N+](=O)[O-])c2)[C@@H](c2ccc(O)c(Cl)c2)NC(=O)N1Cc1cccs1 921300492 XHFHJDPPVTWOCF-OAQYLSRUSA-N 498.948 5.195 5 20 JKBD COc1ccc(CC(=O)NC2(c3ccc(NC(=O)/C=C/c4ccsc4)cc3)CCC2)c([N+](=O)[O-])c1 1786943969 GGQVRMWJEATYOJ-XCVCLJGOSA-N 491.569 5.055 5 20 JKBD CCc1oncc1C(=O)Nc1ccc(C2(NC(=O)C3(c4cccc([N+](=O)[O-])c4)CCC3)CCC2)cc1 1787557410 NYUQKQXHMAIZQF-UHFFFAOYSA-N 488.544 5.015 5 20 JKBD O=C(Cc1ccccc1C(F)(F)F)Nc1ccc(C2(NC(=O)c3ccc([N+](=O)[O-])o3)CCC2)cc1 1787749464 KIWPOQCTHCXLIV-UHFFFAOYSA-N 487.434 5.197 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)c3cc4sccc4s3)CCC2)cc1)c1ccc([N+](=O)[O-])[nH]1 1790186510 XXCLJVGFUUOURT-UHFFFAOYSA-N 466.544 5.261 5 20 JKBD O=C(NC1(c2ccc(NC(=O)C3(c4cccc([N+](=O)[O-])c4)CCC3)cc2)CCC1)[C@@H]1CCC(F)(F)C1 1790477532 VMVOQWHVVLTJEH-GOSISDBHSA-N 497.542 5.586 5 20 JKBD Cc1cc(CCCC(=O)N2CCCC[C@H]2C2CCN(C(=O)c3occc3C)CC2)c([N+](=O)[O-])cc1F 1824370100 NCYOWJXYMWWTPX-QHCPKHFHSA-N 499.583 5.200 5 20 JKBD O=C(c1c(F)cccc1Cl)N1CCC([C@@H]2CCCCN2C(=O)c2ccc([N+](=O)[O-])cc2F)CC1 1830499443 XNCRTYPAIKWEND-NRFANRHFSA-N 491.922 5.074 5 20 JKBD CCCCC[C@H](C)C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cc(N(C)C)ccc2[N+](=O)[O-])CC1 1831467153 VFINIJFWKIBEPD-RDPSFJRHSA-N 486.657 5.111 5 20 JKBD C[C@H](CC(=O)N1CCCC[C@@H]1C1CCN(C(=O)Cc2cc(F)ccc2[N+](=O)[O-])CC1)c1ccccc1 1831509649 FNNJOEZHXPKRFV-CJFMBICVSA-N 495.595 5.090 5 20 JKBD C[C@H](NC[C@@H](c1ccccc1)c1c[nH]c2ccccc12)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl 19623274 ZEAXLOZOUSTQJP-JXFKEZNVSA-N 462.937 5.478 5 20 JKBD C[C@@H](Sc1nc2cc3ccccc3cc2c(=O)n1C)C(=O)Nc1c(Cl)cc(Cl)cc1Cl 22253578 LAPDSXZLVHHSCP-LLVKDONJSA-N 492.815 6.166 5 20 JKBD O=C(Nc1ccccc1)c1nnc(/C(Cl)=C/c2ccc(-c3ccc([N+](=O)[O-])cc3Cl)o2)s1 22608400 UGUSGFSSBXINFD-BOPFTXTBSA-N 487.324 6.349 5 20 JKBD CC(=O)Nc1ccc(N[C@@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Br)c2ccccc2)cc1 23864486 UZMVFPFURDRGDX-OAQYLSRUSA-N 483.322 5.108 5 20 JKBD COc1ccc(-c2nnc(SCCC(=O)Nc3ccccc3[N+](=O)[O-])n2C2CCCCC2)cc1 26368255 MDCVDVDANYRTGZ-UHFFFAOYSA-N 481.578 5.488 5 20 JKBD Cc1ccc(NC(=O)CN(c2ccccc2)S(=O)(=O)c2ccc(Cl)c([N+](=O)[O-])c2)c(Cl)c1 68938022 IDKNAUBOJQKMEF-UHFFFAOYSA-N 494.356 5.044 5 20 JKBD C[C@H](NC(=O)c1csc(-c2ccc([N+](=O)[O-])cc2)n1)c1cccc(NC(=O)c2ccccc2)c1 496354426 BJQQRAQFHLJYKP-INIZCTEOSA-N 472.526 5.462 5 20 JKBD Cc1nnc(SCc2c(C(=O)N(C)Cc3ccccc3[N+](=O)[O-])oc3ccccc23)s1 499387259 HBYZZUHDPCRWDD-UHFFFAOYSA-N 454.533 5.065 5 20 JKBD O=C(Nc1ccccc1COCc1ccccc1)c1ccc([N+](=O)[O-])cc1I 508974053 AEISLRFONMNNCJ-UHFFFAOYSA-N 488.281 5.169 5 20 JKBD C[C@H](NCc1ccc(Oc2ccccc2Cl)c([N+](=O)[O-])c1)c1ccc2c(c1)NC(=O)CO2 509601713 PUYLTTHTVSMNNI-AWEZNQCLSA-N 453.882 5.222 5 20 JKBD COc1cc(C(=O)N[C@@H](c2ccccc2)c2ccc(C)cc2)c([N+](=O)[O-])cc1OCc1cscn1 512583785 VDUSPDFCMQDAQY-VWLOTQADSA-N 489.553 5.467 5 20 JKBD O=C(NCc1cn2ccccc2n1)c1ccccc1Sc1ccc(C(F)(F)F)cc1[N+](=O)[O-] 516836277 CRWQGDASNZXKRN-UHFFFAOYSA-N 472.448 5.343 5 20 JKBD CC(C)C[C@H](NC(=O)c1ccc(N[C@@H](C)c2ccccn2)c([N+](=O)[O-])c1)c1nc2ccccc2[nH]1 520614518 QSKMSBCLLWMCOK-SBUREZEXSA-N 472.549 5.556 5 20 JKBD Cc1nn(CCC(=O)Nc2cccc(NC(=O)Nc3cccc(C(F)(F)F)c3)c2)c(C)c1[N+](=O)[O-] 523272210 KICYHSSVYHWWCV-UHFFFAOYSA-N 490.442 5.100 5 20 JKBD O=[N+]([O-])c1cccc(-c2noc(CN[C@@H](c3ccccc3)c3ccc(Br)cc3)n2)c1 560973350 GFXQSZFZFFMQMR-NRFANRHFSA-N 465.307 5.287 5 20 JKBD COc1ccc(N(Cc2ccccc2)C(=O)CSCc2ccc(OC)c([N+](=O)[O-])c2)cc1 603565693 NYLRJPJNXVXATO-UHFFFAOYSA-N 452.532 5.079 5 20 JKBD NC(=O)c1cc(NC(=O)c2c3c(nc4ccccc24)/C(=C\c2ccc([N+](=O)[O-])cc2)CCC3)ccc1F 603571592 FPORHCDGMLONCV-VKAVYKQESA-N 496.498 5.510 5 20 JKBD O=C(Nc1ccc(C(=O)N(Cc2ccccc2[N+](=O)[O-])CC(F)(F)F)cc1)c1cccs1 603613845 QLWJRKAWQPPXHD-UHFFFAOYSA-N 463.437 5.113 5 20 JKBD CCOc1cc(NC(=O)N2CCC(c3c[nH]c4ccccc34)CC2)c([N+](=O)[O-])cc1OCC 603651464 RDTXWRBYXDHSKI-UHFFFAOYSA-N 452.511 5.285 5 20 JKBD Cc1cccc(NC(=O)Nc2cccc(CNc3ccc(C(=O)NC(C)C)cc3[N+](=O)[O-])c2)c1 603870582 AIMJKKYZBNOUJB-UHFFFAOYSA-N 461.522 5.298 5 20 JKBD O=C(NC(c1ccc(Cl)cc1)c1ccc(Cl)cc1)c1ccc(-n2cncn2)c([N+](=O)[O-])c1 603976126 ZPQHDQAMPFUUCR-UHFFFAOYSA-N 468.300 5.002 5 20 JKBD COc1cc(C(=O)N2Cc3ccccc3-c3ccccc32)c([N+](=O)[O-])cc1OCc1cscn1 604387916 PQYCRPKPSDVONR-UHFFFAOYSA-N 473.510 5.466 5 20 JKBD O=C1CCCN1Cc1ccc(CNCc2ccc(-c3ccc([N+](=O)[O-])cc3Br)o2)cc1 608836065 HSVHUQDLUBMGSP-UHFFFAOYSA-N 484.350 5.030 5 20 JKBD CC[C@@H](C(=O)N1CCC(NCc2ccc(-c3ccccc3[N+](=O)[O-])s2)CC1)c1ccccc1 608836876 NDTBMNVTTNZRQB-JOCHJYFZSA-N 463.603 5.598 5 20 JKBD Cn1c(=O)oc2cc(NC(=O)C/C(=C/c3ccc([N+](=O)[O-])cc3)c3nc4ccccc4s3)ccc21 609107848 YBMTYNSRXKEJTL-VBKFSLOCSA-N 486.509 5.219 5 20 JKBD CC(C)CCSc1ccc(C(=O)N2CCC(c3nc(-c4ccccc4)no3)CC2)cc1[N+](=O)[O-] 609141567 BIFUWRBLNYQIGY-UHFFFAOYSA-N 480.590 5.803 5 20 JKBD COc1ccc(CC[C@@H]2CCCCN2C(=O)c2ccc(Br)c([N+](=O)[O-])c2)cc1OC 726150264 HPPPYLOFWPRHMB-KRWDZBQOSA-N 477.355 5.002 5 20 JKBD CCCC(=O)Nc1cccc(NC(=O)N2CCN(c3ccc([N+](=O)[O-])cc3C(F)(F)F)CC2)c1C 727590426 DHOAGAXMQDUIIB-UHFFFAOYSA-N 493.486 5.015 5 20 JKBD O=C(C[C@@H](c1ccccc1)N1CCOC1=O)Nc1cc(Cl)c([N+](=O)[O-])cc1OCc1ccccc1 728233437 YXVUVFDLPPUXMV-NRFANRHFSA-N 495.919 5.349 5 20 JKBD O=c1cc(-c2ccc([N+](=O)[O-])cc2)c2ccc(Oc3nc4ccc([N+](=O)[O-])cc4s3)cc2o1 731206053 XXIDTZMQRGGTGB-UHFFFAOYSA-N 461.411 5.678 5 20 JKBD CC[C@H](C)Sc1ccc(NC(=O)[C@@H]2CC(=O)N(c3ccc(F)c([N+](=O)[O-])c3)C2)c(C(F)(F)F)c1 748656382 GUMKFJXHLQQALU-QWHCGFSZSA-N 499.486 5.635 5 20 JKBD CC(C)N(Cc1nnc(-c2cccc([N+](=O)[O-])c2)o1)C(=O)/C=C\c1ccc(-c2ccc(F)cc2)s1 841515278 YDXGEUJWASVKDN-QBFSEMIESA-N 492.532 5.963 5 20 JKBD CC1=C(C(=O)Nc2ccc(F)cc2)[C@@H](c2ccccc2[N+](=O)[O-])NC(=S)N1c1ccccc1 916161050 IKASNNHQMRINKH-JOCHJYFZSA-N 462.506 5.082 5 20 JKBD O=C(OCc1cc([N+](=O)[O-])cc2c1OCOC2)c1c(Cl)cc(C(F)(F)F)cc1Cl 919294947 IBAVAFCNJNLUTP-UHFFFAOYSA-N 452.168 5.144 5 20 JKBD CCCc1nc(COC(=O)C/C(=C\c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)no1 920513578 KBNGOVKKEQDXLL-FOWTUZBSSA-N 464.503 5.214 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)NC1(c2ccc(NC(=O)c3ccnc(Cl)c3)cc2)CCC1 1787385979 RQVQYINIPRYVCR-UHFFFAOYSA-N 482.899 5.152 5 20 JKBD CN(C)c1ccc([N+](=O)[O-])c(C(=O)NC2(c3ccc(NC(=O)c4ccc5cc[nH]c5c4)cc3)CCC2)c1 1788914249 DSWXZIGUCIQHRT-UHFFFAOYSA-N 497.555 5.204 5 20 JKBD Cc1c(C(=O)N2CC[C@H](CNC(=O)C3(C)CCCCC3)[C@H]2c2cccnc2)cc(Cl)cc1[N+](=O)[O-] 1813006568 YCGSAFFGUYGVME-AUSIDOKSSA-N 499.011 5.242 5 20 JKBD C[C@@H]1CCC[C@H]1C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cc3cc([N+](=O)[O-])ccc3s2)n[nH]1 1821610230 WJMSMGXJDFCXHO-LSBZLQRGSA-N 481.578 5.275 5 20 JKBD O=C(Nc1cc([C@H]2CCCCN2C(=O)c2cccc(F)c2)[nH]n1)c1cc2cc([N+](=O)[O-])ccc2s1 1821610476 ZIRDHPXPYWPQDM-LJQANCHMSA-N 493.520 5.291 5 20 JKBD O=C(c1cc(F)cc([N+](=O)[O-])c1)N1CCC([C@H]2CCCCN2C(=O)c2cc(Cl)ccc2F)CC1 1823939147 SXQGOVLIMGOUNC-JOCHJYFZSA-N 491.922 5.074 5 20 JKBD Cc1c(C(=O)N2CCC([C@H]3CCCCN3C(=O)/C=C/c3ccc([N+](=O)[O-])o3)CC2)oc2ccccc12 1824277586 SZHMBSXPIPJUJZ-XBFAEUMISA-N 491.544 5.189 5 20 JKBD CC[C@H](C)CC(=O)N1CCCC[C@H]1C1CCN(C(=O)C2(c3cccc([N+](=O)[O-])c3)CCC2)CC1 1824347498 ZSHSTQQOZILYCE-RDPSFJRHSA-N 469.626 5.072 5 20 JKBD Cc1ccoc1C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cc(Cl)cc([N+](=O)[O-])c2C)CC1 1827740855 FAKVARNMVZMEMB-HXUWFJFHSA-N 473.957 5.005 5 20 JKBD O=C([C@@H]1CCC[C@@H]2CCCC[C@H]21)N1CCC([C@H]2CCCCN2C(=O)c2ccc(O)c([N+](=O)[O-])c2)CC1 1830487845 GLOFVZNBGAGGBC-GDKQOWJMSA-N 497.636 5.140 5 20 JKBD CC[C@H]1CC[C@H](C(=O)N2CCC([C@H]3CCCCN3C(=O)Cc3ccc([N+](=O)[O-])cc3F)CC2)CC1 1831294381 OCTJGSCOHXOSOU-DZRGJMJISA-N 487.616 5.113 5 20 JKBD Cc1ccc([N+](=O)[O-])cc1NC(=O)COC(=O)c1cc2ccccc2cc1OCc1c(C)noc1C 9800517 XVJKFQLFUVMYKY-UHFFFAOYSA-N 489.484 5.036 5 20 JKBD COc1cc(C(=O)N[C@H](c2ccccc2)c2ccc(Cl)cc2)c([N+](=O)[O-])cc1OC(F)F 10967227 SSDQJKJMRRRXCG-HXUWFJFHSA-N 462.836 5.378 5 20 JKBD COc1cc(OC)c(NC(=O)C2CCN(c3ccc(C(F)(F)F)cc3[N+](=O)[O-])CC2)cc1Cl 15949056 LQAHYJCTRGPYKG-UHFFFAOYSA-N 487.862 5.139 5 20 JKBD O=C(CSc1ccc(F)cc1F)Nc1c(Br)cc([N+](=O)[O-])cc1Br 17836344 UUGHANYKUHUIKC-UHFFFAOYSA-N 482.100 5.129 5 20 JKBD C[C@H](Sc1nnc(-c2ccc(Br)cc2)o1)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 104938031 YVTCVCXXTZIFTG-JTQLQIEISA-N 474.296 5.311 5 20 JKBD C[C@H](Sc1ncc(-c2ccccc2)n1CC(F)(F)F)C(=O)Nc1ccc([N+](=O)[O-])cc1 109622958 JQYDEQZBKHVHRQ-ZDUSSCGKSA-N 450.442 5.140 5 20 JKBD Cc1ccc(C(=O)N2C[C@H](C)C[C@@H](C)C2)cc1NC(=O)[C@H](C)Sc1ccc([N+](=O)[O-])cc1 251142972 DUZQEWMMHNEZKK-NUJGCVRESA-N 455.580 5.141 5 20 JKBD C[C@H](Nc1ccc(C(=O)Nc2ccc(SCc3cccnc3)cc2)cc1[N+](=O)[O-])c1ccccn1 302961308 GMYUEMHLRJDLLN-SFHVURJKSA-N 485.569 6.103 5 20 JKBD O=C(CCc1ncc(-c2ccc(Cl)cc2Cl)o1)Nc1cc(-c2cccc([N+](=O)[O-])c2)n[nH]1 302985712 DWGQENHAAJVMAI-UHFFFAOYSA-N 472.288 5.518 5 20 JKBD CCCN(Cc1nnc(-c2ccccc2Cl)o1)C(=O)c1cc(SC)c(OC)cc1[N+](=O)[O-] 482098293 AOJAISFOWPWFPK-UHFFFAOYSA-N 476.942 5.081 5 20 JKBD CSc1ccc(C(=O)c2ccccc2C(=O)Nc2nnc(-c3ccccc3)s2)cc1[N+](=O)[O-] 498784305 RNOMMXAKADVMIU-UHFFFAOYSA-N 476.539 5.319 5 20 JKBD NC(=O)CSc1ccccc1NC(=O)c1ccc(Sc2nc3ccccc3s2)c([N+](=O)[O-])c1 500465505 HOZAPQSPGDQCAG-UHFFFAOYSA-N 496.595 5.185 5 20 JKBD O=C(Nc1ccc(CNCc2ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])cc2)cc1)c1ccncc1 507939109 HJCMIOYQDSGHKJ-UHFFFAOYSA-N 488.931 5.978 5 20 JKBD COc1cc(C(=O)N2CC[C@H](C)Sc3ccc(C(F)(F)F)cc32)c([N+](=O)[O-])cc1OC(F)F 515701928 SNUQVFGNMNKGIY-JTQLQIEISA-N 492.422 5.755 5 20 JKBD Cn1c(SCc2nc(-c3cc(Br)cs3)no2)nc2cc3ccccc3cc2c1=O 515852646 FXWJIVRAXUHADZ-UHFFFAOYSA-N 485.388 5.253 5 20 JKBD C[C@@H](OCCCNC(=O)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1)c1ccccc1 589452042 IYNZHUYIPDJPHC-QGZVFWFLSA-N 479.499 5.114 5 20 JKBD CCCC(=O)Nc1nc2ccc(NC(=O)c3cc(OCC(F)(F)F)ccc3[N+](=O)[O-])cc2s1 604113475 HLWRHXYWKXUJKD-UHFFFAOYSA-N 482.440 5.137 5 20 JKBD COc1ccc(CN[C@@H]2CCc3nc(-c4ccccc4)ncc3C2)cc1OCc1ccc([N+](=O)[O-])cc1 608782176 KVBJUEBDDYEOEJ-XMMPIXPASA-N 496.567 5.287 5 20 JKBD O=[N+]([O-])c1ccc(-c2ccc(CNCc3ccc(COCC(F)(F)F)cc3)o2)c(Br)c1 608835783 PYNPNLINFWCQPO-UHFFFAOYSA-N 499.283 5.986 5 20 JKBD CN(Cc1ccc(Cl)cc1)C(=O)c1ccc(C(=O)N(C)Cc2ccc(Cl)cc2)c([N+](=O)[O-])c1 609043188 DCWQQYZAYFIGFW-UHFFFAOYSA-N 486.355 5.446 5 20 JKBD O=C(Nc1ccccc1C(=O)Nc1cc(C(F)(F)F)ccc1F)c1ccc([N+](=O)[O-])cc1Cl 728150730 DQGNEZRPGQMQJG-UHFFFAOYSA-N 481.789 5.911 5 20 JKBD C[C@H]1CC(=O)c2c(OC(=O)C3CCN(c4ccc(C(F)(F)F)cc4[N+](=O)[O-])CC3)ccc(F)c21 728289580 PHVAFFMLRDZQPH-LBPRGKRZSA-N 480.414 5.265 5 20 JKBD O=C1CCCN1c1ccc(CNCc2ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])cc2)cc1 760939070 JHCPKHAHZXZAEE-UHFFFAOYSA-N 451.910 5.457 5 20 JKBD O=[N+]([O-])c1ccc(/C=C/Sc2nnc(CN3CCCCC3)n2-c2ccc(OC(F)F)cc2)o1 913712745 XRYJBCLXXDIXSV-JLHYYAGUSA-N 477.493 5.119 5 20 JKBD O=C(Nc1ccccc1C(=O)N1CCC([C@@H](O)c2ccccc2)CC1)c1ccc([N+](=O)[O-])cc1Cl 914539208 KOIMUUROXBTWIH-DEOSSOPVSA-N 493.947 5.086 5 20 JKBD C[C@H](OC(=O)c1cccc(OCc2cccs2)c1)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 915464347 USYWQIJMVISUDN-AWEZNQCLSA-N 451.460 5.203 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)NC1(c2ccc(NC(=O)c3cnc4ccoc4c3)cc2)CCC1 1788485301 DQTXJGSQPPWXAF-UHFFFAOYSA-N 488.475 5.245 5 20 JKBD Cc1cc(C(=O)Nc2ccc(C3(NC(=O)CCC4CCCC4)CCC3)cc2)ncc1[N+](=O)[O-] 1788764843 MMNKNBKGXPUXSU-UHFFFAOYSA-N 450.539 5.016 5 20 JKBD CC(C)c1cc(C(=O)Nc2ccc(C3(NC(=O)CCc4cccc([N+](=O)[O-])c4)CCC3)cc2)on1 1790160874 CHBXXUGJZXEDTA-UHFFFAOYSA-N 476.533 5.087 5 20 JKBD O=C(NC1(c2ccc(NC(=O)c3cccc4c3oc3ccccc34)cc2)CCC1)c1nc[nH]c1[N+](=O)[O-] 1791007662 CKAWKMMMIDWQNL-UHFFFAOYSA-N 495.495 5.279 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)C3(c4cccc([N+](=O)[O-])c4)CCC3)CCC2)cc1)[C@@H]1[C@H]2C=CS[C@H]21 1791093620 XURVYZWKVSSURG-DNVJHFABSA-N 489.597 5.026 5 20 JKBD Cc1ccc([C@H](C)C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cc4cc([N+](=O)[O-])ccc4s2)C3)cc1 1801779938 VVKQSIUDMVXZSU-DVWBAYGPSA-N 477.586 5.173 5 20 JKBD Cc1c(C(=O)N2CCC3(CCCN(C(=O)CSC4CCCC4)C3)CC2)cc(Cl)cc1[N+](=O)[O-] 1805987518 AWYRSYGEGOUJES-UHFFFAOYSA-N 494.057 5.077 5 20 JKBD Cc1c(Cl)cccc1C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2ccc([N+](=O)[O-])cc2F)[nH]n1 1814599074 AEBXUSCOZJRJHA-FQEVSTJZSA-N 485.903 5.039 5 20 JKBD CC(C)[C@@H](C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2ccc([N+](=O)[O-])o2)[nH]n1)c1ccc(Cl)cc1 1821856651 GTMDPRDMVNBOAB-PGRDOPGGSA-N 499.955 5.310 5 20 JKBD CC1=CC[C@@H](C(=O)N2CCCC[C@@H]2C2CCN(C(=O)Cc3ccc(Cl)cc3[N+](=O)[O-])CC2)CC1 1828343604 IPKDVCXPKHJDAV-NFBKMPQASA-N 488.028 5.157 5 20 JKBD C[C@@H](OC(=O)CSCc1cccc(Cl)c1)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 10147362 VJMAWYCTTBLBFL-LLVKDONJSA-N 476.860 5.071 5 20 JKBD O=C(Nc1ccc(Cl)c([N+](=O)[O-])c1)[C@H](Sc1nnc(-c2ccc(F)cc2)o1)c1ccccc1 12677879 JVWRFDFEHFWYDI-LJQANCHMSA-N 484.896 5.909 5 20 JKBD Cc1cccc(-n2c(SCC(=O)Nc3c(C)cccc3[N+](=O)[O-])nnc2-c2c[nH]c3ccccc23)c1 20888491 ZEOSZLJYIRZYCS-UHFFFAOYSA-N 498.568 5.671 5 20 JKBD Cc1occc1-c1nnc(S[C@H](C(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)c2ccccc2)n1C 21121818 NNRLDDALJLUNTI-IBGZPJMESA-N 483.937 5.417 5 20 JKBD Cc1occc1-c1nnc(S[C@H](C)C(=O)Nc2ccc(F)c([N+](=O)[O-])c2)n1-c1ccccc1 22100458 SVDPTKSFGOFEKJ-CQSZACIVSA-N 467.482 5.002 5 20 JKBD CC(=O)NCCCc1ccc(-c2csc(NC(=O)c3cc4cc([N+](=O)[O-])ccc4s3)n2)cc1 29346552 QGDCMHKPUKVYBA-UHFFFAOYSA-N 480.571 5.254 5 20 JKBD CC(C)Oc1ccccc1NC(=O)Cc1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1 32285853 OQWQBUSFBCZTTJ-UHFFFAOYSA-N 456.502 5.416 5 20 JKBD Cc1ccc(NC(=O)c2ccc(Sc3nncn3C)c([N+](=O)[O-])c2)c(OCc2ccccc2)c1 68734498 DCGJKSGVJQSCAE-UHFFFAOYSA-N 475.530 5.014 5 20 JKBD Cc1csc(Sc2ccc(C(=O)Nc3ccc(C(=O)N(C)C)c(Cl)c3)cc2[N+](=O)[O-])n1 108908023 FRTZAJNWQUZJJO-UHFFFAOYSA-N 476.967 5.118 5 20 JKBD Cc1cc(Br)cc(Cl)c1NC(=O)c1csc(-c2cccc([N+](=O)[O-])c2)n1 303022876 MDQUAHPVRKHUSU-UHFFFAOYSA-N 452.717 5.695 5 20 JKBD O=C(NC[C@H]1CCCN(C(=O)c2ccc(Nc3ccccc3)c([N+](=O)[O-])c2)C1)Nc1cccc(F)c1 303174038 RZBWUNJKNJQJHX-GOSISDBHSA-N 491.523 5.151 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)NC[C@H](c2ccccc2Cl)c2c[nH]c3ccccc23)cc1SC 482320826 XNAUIRRDFBIYFY-GOSISDBHSA-N 495.988 6.022 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)N[C@@H](c2ccc(F)cc2)c2ccccc2Cl)cc1SC 482984873 MFMKFTGPUBIKHI-NRFANRHFSA-N 460.914 5.637 5 20 JKBD CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)[C@H]1CCCN(C(=O)c2ccc(Cl)c(Cl)c2)C1 509729654 QBGZOCNAZBEALE-SFHVURJKSA-N 478.376 5.191 5 20 JKBD O=C(C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)Nc1ccc(-c2csnn2)cc1 512091166 YHMVDKBCFUGIFI-AQTBWJFISA-N 499.577 6.292 5 20 JKBD Cc1ccc(-c2csc(NC(=O)c3cc(OCC(F)(F)F)ccc3[N+](=O)[O-])n2)c(C)c1 514431703 QSKVYQNBELNFII-UHFFFAOYSA-N 451.426 5.529 5 20 JKBD CC(=O)N1CCC(CNC(=O)c2c3c(nc4ccccc24)/C(=C\c2ccc([N+](=O)[O-])cc2)CCC3)CC1 519114982 VXIPTURXSYWHPG-XLNRJJMWSA-N 498.583 5.008 5 20 JKBD O=C(C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)Nc1ccc(N2CCCC2=O)cc1 603803165 KZAQZTIJTGRVJW-MNDPQUGUSA-N 498.564 5.901 5 20 JKBD C[C@H]1C[C@@H](C)CN(c2ccc(C(=O)Nc3ccc4nc([C@@H]5CCCO5)[nH]c4c3)cc2[N+](=O)[O-])C1 604480820 LXNQBPDYUDOBHT-PXAQALGRSA-N 463.538 5.057 5 20 JKBD O=C(Nc1ccc(C(=O)Nc2cccnc2)c(Cl)c1)c1ccc(Nc2ccccc2)c([N+](=O)[O-])c1 608882642 ZBNDMEYHUXCWTL-UHFFFAOYSA-N 487.903 5.891 5 20 JKBD C[C@H](CN(C)C(=O)c1ccc(C(=O)N(C)C[C@H](C)c2ccccc2)cc1[N+](=O)[O-])c1ccccc1 609044493 ABXMCTKVCZMKGZ-LEWJYISDSA-N 473.573 5.346 5 20 JKBD O=C(Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1)c1ccc(I)cc1Cl 609054432 LFXSSGTXSWZSCS-UHFFFAOYSA-N 485.690 5.229 5 20 JKBD Cc1nc(-c2ccc([C@@H](C)N[C@H](C)C(=O)Nc3ccc([N+](=O)[O-])cc3C(F)(F)F)cc2)cs1 619556406 GZAASBPLRCNJAP-CHWSQXEVSA-N 478.496 5.723 5 20 JKBD O=[N+]([O-])c1ccc(-c2ccc(CNC[C@@H](O)c3ccccc3C(F)(F)F)o2)c(Br)c1 726606793 NCAHXWCUNYHBDC-GOSISDBHSA-N 485.256 5.459 5 20 JKBD COC1CCN(c2ccc(NC(=O)[C@H](C)Sc3ccc([N+](=O)[O-])cc3)cc2C(F)(F)F)CC1 728011404 NETJVKKSQVBEAK-AWEZNQCLSA-N 483.512 5.348 5 20 JKBD CC(C)(C)OC(=O)N1CCC[C@@H]1[C@@H]1CCCCN1C(=O)c1csc(-c2ccc([N+](=O)[O-])cc2)n1 751409124 GVPMYSHAXZHLOZ-VQTJNVASSA-N 486.594 5.113 5 20 JKBD O=C(CSC1=N/C(=C\c2ccccc2)C(=O)N1c1ccc(F)cc1)c1cccc([N+](=O)[O-])c1 752794499 ZYDPBQOXPVOKOV-BKUYFWCQSA-N 461.474 5.094 5 20 JKBD C[C@H](Sc1nc2cc(C(F)(F)F)ccc2s1)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 753855458 VFDOPTHBOGDJCM-VIFPVBQESA-N 452.439 6.127 5 20 JKBD O=C(Nc1cc(OCC(F)(F)F)cc(OCC(F)(F)F)c1)c1cc(Cl)ccc1[N+](=O)[O-] 789923281 ZEJXSSPCVMHNDE-UHFFFAOYSA-N 472.725 5.383 5 20 JKBD CCOc1ccc(C(C)=O)cc1COC(=O)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 825340597 HWHRLUIAYDPDID-UHFFFAOYSA-N 494.466 5.175 5 20 JKBD COc1ccc(-c2nc(Cc3noc([C@@H](C)Oc4ccc(Cl)cc4[N+](=O)[O-])n3)co2)cc1 904330990 AUJGBRDZAPWEIQ-GFCCVEGCSA-N 456.842 5.026 5 20 JKBD O=C(Cn1c2ccccc2c(=O)c2ccccc21)OCc1csc(Cc2ccc(Cl)cc2)n1 915385449 ZNYBDGPGURLIFU-UHFFFAOYSA-N 474.969 5.599 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Cl)[C@H](Nc1ccc(N2CCCCC2)cc1)c1ccccc1 915877397 WHACNPMPDRGPIK-XMMPIXPASA-N 464.953 6.030 5 20 JKBD COc1ccc(CNC(=O)Nc2ccccc2SC[C@@H]2CC2(Cl)Cl)cc1[N+](=O)[O-] 918037814 YXRHKHMNTICZQP-ZDUSSCGKSA-N 456.351 5.211 5 20 JKBD O=C(Nc1cc([N+](=O)[O-])c(F)cc1F)c1ccccc1Sc1ccc(Br)cn1 918564084 VDKBRSIVDZAJQZ-UHFFFAOYSA-N 466.263 5.434 5 20 JKBD Cc1ccc(NC(=O)[C@H](OC(=O)c2nc(-c3ccccc3)cs2)c2ccccc2)c([N+](=O)[O-])c1 919121103 GRSAVSFNJFWMFU-JOCHJYFZSA-N 473.510 5.564 5 20 JKBD COc1cc(C(=O)Oc2c(Cl)cccc2Cl)c([N+](=O)[O-])cc1OCc1cscn1 919979073 QGZMYBVLLMIBGN-UHFFFAOYSA-N 455.275 5.165 5 20 JKBD O=C(Nc1ccc(OC(=O)c2cc(F)c(F)c(F)c2F)cc1)c1cc([N+](=O)[O-])ccc1Cl 923471568 XCHCPBDHYPQBAO-UHFFFAOYSA-N 468.746 5.276 5 20 JKBD C/C(=C\c1ccc(C)o1)C(=O)NC1(c2ccc(NC(=O)Cc3cc([N+](=O)[O-])ccc3F)cc2)CCC1 1786672595 DNJUSRMURSHSHX-SAPNQHFASA-N 491.519 5.415 5 20 JKBD O=C(CCc1ccco1)Nc1ccc(C2(NC(=O)c3cc4cc([N+](=O)[O-])ccc4s3)CCC2)cc1 1786903832 YJCPAYRIGLUIGC-UHFFFAOYSA-N 489.553 5.783 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)Nc1ccc(C2(NC(=O)COCc3ccccc3)CCC2)cc1 1790770608 ITSMFXRBGLOFAN-UHFFFAOYSA-N 491.519 5.007 5 20 JKBD O=C(NC1(c2ccc(NC(=O)c3cc4cc([N+](=O)[O-])ccc4s3)cc2)CCC1)c1cncc(F)c1 1791010974 MEPVFQFNTPQUAO-UHFFFAOYSA-N 490.516 5.405 5 20 JKBD Cc1cc(C(=O)NC2(c3ccc(NC(=O)CSc4ccccc4[N+](=O)[O-])cc3)CCC2)c(C)o1 1791521275 HDRIPYYFZYWLEH-UHFFFAOYSA-N 479.558 5.345 5 20 JKBD O=C(Nc1cc([C@@H]2CCCCN2C(=O)CSc2ccccc2[N+](=O)[O-])[nH]n1)c1cccc(Cl)c1 1820502587 KMBWEGIJIHDIDD-SFHVURJKSA-N 499.980 5.070 5 20 JKBD O=C(c1sccc1Cl)N1CCC([C@@H]2CCCCN2C(=O)CCc2cccc([N+](=O)[O-])c2)CC1 1824841412 IUAGYDUIDPFQQL-NRFANRHFSA-N 490.025 5.176 5 20 JKBD O=C(c1cccs1)N1CCC([C@H]2CCCCN2C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)CC1 1831059945 LQBFCQARUOQHOD-LJQANCHMSA-N 483.615 5.418 5 20 JKBD O=C(c1ccccc1C1CC1)N1CCC([C@H]2CCCCN2C(=O)Cc2cc(F)ccc2[N+](=O)[O-])CC1 1832888350 HCOOGKCZXBWTGO-RUZDIDTESA-N 493.579 5.087 5 20 JKBD O=C(Nc1ccc(NC(=O)C2CC2)cc1)c1ccc(NCc2ccccc2Cl)c([N+](=O)[O-])c1 9897847 XGQBSYSSTUFRSK-UHFFFAOYSA-N 464.909 5.461 5 20 JKBD Cn1c(SCC(=O)Nc2ccc(Br)cc2Cl)nc2cc3ccccc3cc2c1=O 11060628 ZUMNBNRUMXJJFZ-UHFFFAOYSA-N 488.794 5.233 5 20 JKBD C[C@@H](c1nc2ccccc2s1)N(C)C(=O)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 15094628 QFYSGLDKQHHYTF-AWEZNQCLSA-N 492.523 5.659 5 20 JKBD Cc1nn(Cc2ccccc2)c2sc(C(=O)O[C@H](C)c3nnc(-c4ccc([N+](=O)[O-])cc4)o3)cc12 17660453 CSOJCZBTKXEKTP-OAHLLOKOSA-N 489.513 5.331 5 20 JKBD C[C@@H](OC(=O)c1ccc(Nc2ccccc2)c([N+](=O)[O-])c1)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 17892049 NXXFXEZLNDWHRG-CQSZACIVSA-N 475.417 5.215 5 20 JKBD CCCn1c(S[C@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2C)nnc1-c1ccc(Cl)cc1 21669557 RJMUTBZRIWINHA-CQSZACIVSA-N 459.959 5.344 5 20 JKBD C[C@@H](Sc1nnc(-c2ccc(F)cc2)n1Cc1ccccc1)C(=O)Nc1ccc(F)c([N+](=O)[O-])c1 21684681 QJUZTZHOXNJHKE-OAHLLOKOSA-N 495.511 5.299 5 20 JKBD O=C(COc1cccnc1[N+](=O)[O-])N(Cc1ccc(Cl)cc1)C12CC3CC(CC(C3)C1)C2 25021729 OHEOMMGRJHWAOG-UHFFFAOYSA-N 455.942 5.020 5 20 JKBD CCCCn1c(SCc2nc(-c3cccc([N+](=O)[O-])c3)no2)nnc1-c1ccc(OC)cc1 27224445 HABWXVTZCYYIIS-UHFFFAOYSA-N 466.523 5.004 5 20 JKBD Cc1nc(-c2ccc(NC(=O)c3ccc(N[C@H](C)c4ccccn4)c([N+](=O)[O-])c3)cc2)cs1 108788497 DDDMMZHVXLONQA-OAHLLOKOSA-N 459.531 5.847 5 20 JKBD C[C@H](Nc1ccc(C(=O)Nc2nc3c(s2)C(=O)CC(C)(C)C3)cc1[N+](=O)[O-])c1ccccn1 409589033 ZSLOMGJIWVIJBO-ZDUSSCGKSA-N 465.535 5.027 5 20 JKBD O=C(C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)NCCc1cn2ccccc2n1 485382362 JYOUDMKRKYIHPK-CYVLTUHYSA-N 483.553 5.142 5 20 JKBD COc1cc(C(=O)N(Cc2ccccc2)[C@@H](C)c2cccs2)c([N+](=O)[O-])cc1OC(F)F 500612233 UYRSHXCRWDRVPL-AWEZNQCLSA-N 462.474 5.670 5 20 JKBD CC[C@@H](C)Sc1ccc(NC(=O)C(=O)N(C)Cc2ccccc2[N+](=O)[O-])c(C(F)(F)F)c1 501240509 VWZLEAYSGMDZPE-CYBMUJFWSA-N 469.485 5.101 5 20 JKBD COc1ccc(C(=O)N2CCCCCC2)cc1NC(=O)c1ccc(N2CCC(C)CC2)c([N+](=O)[O-])c1 501699755 QYUSQNQXPBOZRN-UHFFFAOYSA-N 494.592 5.108 5 20 JKBD O=C(c1cccc(-n2nccc2C(F)(F)F)c1)N(Cc1ccccc1[N+](=O)[O-])CC(F)(F)F 501937821 JYSNMNZAIUAGDJ-UHFFFAOYSA-N 472.345 5.004 5 20 JKBD O=[N+]([O-])c1ccc(-c2ccc(CNCc3ccccc3-c3ccc(Cn4ccnc4)cc3)o2)cc1 504162625 NBWQCSNZHMMUFP-UHFFFAOYSA-N 464.525 6.056 5 20 JKBD C[C@H](NC(=O)N(C)[C@H]1CCSc2ccc(Br)cc21)c1cccc([N+](=O)[O-])c1 509479333 KSMNOUOTXGWTRW-SJCJKPOMSA-N 450.358 5.297 5 20 JKBD CCOc1cc(CN[C@@H]2CC(C)(C)Cc3oc(C)cc32)ccc1OCCn1c([N+](=O)[O-])cnc1C 509570344 HRUQGWRSSHNLLT-OAQYLSRUSA-N 482.581 5.282 5 20 JKBD COc1ccccc1Oc1ccc(NC(=O)c2cc(OC)c(OC(F)F)cc2[N+](=O)[O-])cc1F 510241050 KBTHRTOGFGYZPO-UHFFFAOYSA-N 478.379 5.397 5 20 JKBD CCN(Cc1ccccc1)C(=O)c1cc(NC(=O)Cc2ccc([N+](=O)[O-])cc2)ccc1Cl 515449347 WQIGAKFSQGLRBS-UHFFFAOYSA-N 451.910 5.092 5 20 JKBD C[C@@H](NC(=O)c1cnn(-c2cccc(C(F)(F)F)c2)c1C(F)(F)F)c1cccc([N+](=O)[O-])c1 515682012 XGVNRYQXQNXZAY-LLVKDONJSA-N 472.345 5.309 5 20 JKBD O=[N+]([O-])c1ccc(-c2ccc(CNCc3cn(-c4ccccc4)nc3-c3ccncc3)s2)cc1 517552609 PYUROVUQBRANHC-UHFFFAOYSA-N 467.554 5.861 5 20 JKBD COc1ccc([N+](=O)[O-])cc1NC(=O)c1cnn(-c2ncc(C(F)(F)F)cc2Cl)c1C(F)F 521709300 UPEDKICYWHUXDP-UHFFFAOYSA-N 491.760 5.046 5 20 JKBD CC(=O)Nc1ccc(Cl)cc1NC(=O)c1ccc(Sc2nc(C)cs2)c([N+](=O)[O-])c1 521844398 DFDSUCCTOMVBEK-UHFFFAOYSA-N 462.940 5.375 5 20 JKBD CCOc1cc(C(=O)Nc2cc(-c3ccc(C)cc3)nn2-c2ccccc2)c([N+](=O)[O-])cc1OC 585719928 HYABMJYXJUJXSP-UHFFFAOYSA-N 472.501 5.416 5 20 JKBD CCOc1ccccc1Oc1ccc(CNc2ccc([N+](=O)[O-])c(C(=O)N3CCCC3)c2)cn1 603943961 SBILABOKCJBITP-UHFFFAOYSA-N 462.506 5.029 5 20 JKBD O=C(NC[C@@H]1CCCOC1)c1c2c(nc3ccccc13)/C(=C/c1cccc([N+](=O)[O-])c1)CCC2 604013660 CNCMJWGGLGACOB-XPFMCRKWSA-N 457.530 5.176 5 20 JKBD Cc1c(NC(=O)[C@@H](C)Nc2ccc(Oc3ncc(Cl)cc3Cl)cc2)cccc1[N+](=O)[O-] 604044737 MWRMSZULYCGFNH-CYBMUJFWSA-N 461.305 5.836 5 20 JKBD CC(C)(C)Oc1ccc(CN[C@@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2ccccc2)cc1 604435246 LWYHBEAZHBUHRO-HSZRJFAPSA-N 467.953 5.895 5 20 JKBD C[C@@H]1CCCN(c2ccc(C(=O)N(C)C[C@H]3CCCO[C@H]3c3ccccc3)cc2[N+](=O)[O-])C1 604519194 RTXTWNRJRFXLCB-QNIAMRLHSA-N 451.567 5.071 5 20 JKBD CN(C)[C@@H](CNCc1ccc(-c2ccc([N+](=O)[O-])cc2Br)o1)c1cccs1 608835514 QCZVULWCKWJTEB-KRWDZBQOSA-N 450.358 5.071 5 20 JKBD COCCN(Cc1cccnc1)C(=O)C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1 609025896 UFDWFMFAGAKRCB-QNGOZBTKSA-N 488.569 5.205 5 20 JKBD CN(C)C(=O)c1ccc(C(=O)Nc2cc([N+](=O)[O-])ccc2Nc2cccc(C(F)(F)F)c2)cc1 609101794 FBFHTDNGVPKDKP-UHFFFAOYSA-N 472.423 5.311 5 20 JKBD Cc1nc(-c2ccc(F)cc2)sc1[C@@H](C)N[C@@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 609221881 HGPVZWDQPDAKLX-YPMHNXCESA-N 496.486 5.862 5 20 JKBD CC[C@H](C)Oc1ccccc1/C=C\C(=O)N(Cc1nnc(-c2cccc([N+](=O)[O-])c2)o1)C(C)C 729825517 JEZRXNZUCPOFCZ-HWOXTHGCSA-N 464.522 5.273 5 20 JKBD Nc1ccc(Cl)c(C(=O)O[C@H](C(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)c2ccccc2)c1 745515436 SCEHQIUWHMBDOG-IBGZPJMESA-N 460.273 5.021 5 20 JKBD Cc1ccc(-c2nnc([C@@H](C)OC(=O)c3cc([N+](=O)[O-])ccc3N3CCC(C)CC3)o2)cc1 746145835 RRUMGNFAXGTFCZ-QGZVFWFLSA-N 450.495 5.108 5 20 JKBD C[C@@H](OC(=O)/C(=C/c1ccc(F)cc1)c1cccs1)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl 772026611 SBPCRUIFQCIRMA-VVBXCHJUSA-N 474.897 5.560 5 20 JKBD COc1cc(-c2nc(CC(=O)NC3CCCCC3)no2)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 904246631 TWJAMQVPRPRJEE-UHFFFAOYSA-N 486.912 5.091 5 20 JKBD COc1ccc(NC(=O)c2ccc(NC(=O)c3cc([N+](=O)[O-])ccc3N3CCCCC3)cc2)cc1 912563362 XYZHWIWBQSCGMI-UHFFFAOYSA-N 474.517 5.098 5 20 JKBD COc1ccc(-c2nn(CN(C)Cc3ccccc3[N+](=O)[O-])c(=S)n2-c2ccc(OC)cc2)cc1 914783520 NJRYEZMKLOQWHH-UHFFFAOYSA-N 491.573 5.085 5 20 JKBD CN(CCCOc1ccc(F)cc1)C(=O)c1ccccc1NC(=O)c1ccc([N+](=O)[O-])cc1Cl 915201058 XUGHGZAWERZICJ-UHFFFAOYSA-N 485.899 5.181 5 20 JKBD O=C(Nc1ccc(F)c(NC(=O)C2CCCCC2)c1)c1ccc(Br)c([N+](=O)[O-])c1 916054032 BLVVUDDANCGEJN-UHFFFAOYSA-N 464.291 5.268 5 20 JKBD O=C(Nc1ccc(NC(=O)c2ccc(Cl)c([N+](=O)[O-])c2)c(C(F)(F)F)c1)c1ccoc1 916069002 NVBQRRCREKILLE-UHFFFAOYSA-N 453.760 5.365 5 20 JKBD O=C(Nc1ccc(F)c([N+](=O)[O-])c1)c1cccnc1Oc1ccc(F)cc1Br 916105694 OAILAHQIVLWGTM-UHFFFAOYSA-N 450.195 5.075 5 20 JKBD CCc1ccc2c(COC(=O)c3ccc(N[C@H](C)c4ccccn4)c([N+](=O)[O-])c3)cc(=O)oc2c1 920544554 CORHMJQPVXWDSB-MRXNPFEDSA-N 473.485 5.189 5 20 JKBD Cc1nc(C)c(C(=O)Nc2ccc(C3(NC(=O)c4cc(Cl)cc([N+](=O)[O-])c4C)CCC3)cc2)o1 1789790882 ZBNSIJZWUBGXRP-UHFFFAOYSA-N 482.924 5.223 5 20 JKBD Cc1cc(CCC(=O)NC2(c3ccc(NC(=O)c4c(F)ccc([N+](=O)[O-])c4C)cc3)CCC2)ccn1 1790770556 ICLCZYJRMOCAFN-UHFFFAOYSA-N 490.535 5.126 5 20 JKBD Cc1nc(C(=O)NC2(c3ccc(NC(=O)c4cc5cc([N+](=O)[O-])ccc5s4)cc3)CCC2)cs1 1791011303 WNZAYIWADMDVOW-UHFFFAOYSA-N 492.582 5.636 5 20 JKBD O=C(CSc1ccccc1[N+](=O)[O-])Nc1ccc(C2(NC(=O)[C@H](F)c3ccccc3)CCC2)cc1 1791521287 HUTLXHZDBFEFLT-XMMPIXPASA-N 493.560 5.532 5 20 JKBD Cc1ccc([C@H](C)C(=O)N2CCC([C@H]3CCCCN3C(=O)Cc3cc(F)ccc3[N+](=O)[O-])CC2)cc1 1832888115 FJMZFVWIPCRPSF-NBGIEHNGSA-N 495.595 5.008 5 20 JKBD CCOc1ccc([C@@H](C)N[C@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Br)c2ccccc2)cc1 11707789 ZATCFHCSYAKQMW-MWTRTKDXSA-N 498.377 5.787 5 20 JKBD CCn1c(SCC(=O)Nc2cccc(Cl)c2Cl)nc2cc3ccccc3cc2c1=O 22177859 XGYURMFNRYXPOJ-UHFFFAOYSA-N 458.370 5.607 5 20 JKBD COc1ccccc1Nc1nn(CN(C)Cc2cc([N+](=O)[O-])ccc2Cl)c(=S)s1 27532879 HDNDQZGWHFXMMB-UHFFFAOYSA-N 451.961 5.077 5 20 JKBD CC(=O)c1cccc(NC(=O)COC(=O)c2ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])cc2)c1 28931162 ZYIJVWFIDXZNBN-UHFFFAOYSA-N 468.849 5.039 5 20 JKBD O=C(c1ccc(NCc2ccccc2Cl)c([N+](=O)[O-])c1)N1CCO[C@H](c2ccc(F)cc2)C1 29115392 DOBRARJXRNGBLC-QHCPKHFHSA-N 469.900 5.213 5 20 JKBD O=C(c1nc(-c2ccccc2)n(-c2ccccc2)n1)N(Cc1ccccc1[N+](=O)[O-])CC(F)(F)F 106189656 NECOLNLHZKUXQN-UHFFFAOYSA-N 481.434 5.047 5 20 JKBD Cc1c(C(=O)N2CC[C@@H](C)Sc3ccc(C(F)(F)F)cc32)nnn1-c1cccc([N+](=O)[O-])c1 195695789 SNHDKHXLFKTVNI-GFCCVEGCSA-N 477.468 5.034 5 20 JKBD Cc1ccc(C(=O)N2C[C@H](C)C[C@@H](C)C2)cc1NC(=O)c1cc2ccccc2c2cccnc12 302949470 JVJVPCLBNXEGIZ-RTBURBONSA-N 451.570 6.067 5 20 JKBD COCCN(C(=O)c1ccc(NCc2ccccc2)c([N+](=O)[O-])c1)c1nc2ccccc2s1 477917515 YZCUCJABASVVPJ-UHFFFAOYSA-N 462.531 5.110 5 20 JKBD O=C(N[C@@H]1CCN2CCC[C@H]2C1)c1c2c(nc3ccccc13)/C(=C\c1cccc([N+](=O)[O-])c1)CCC2 485013249 KPEFVESGHQRJSK-BQDNBEJJSA-N 482.584 5.377 5 20 JKBD CC(C)n1c(SCC(=O)Nc2ccccc2[N+](=O)[O-])nnc1-c1ccc(Cl)cc1Cl 502603021 VFKPVIQOGBAGFY-UHFFFAOYSA-N 466.350 5.472 5 20 JKBD O=C1CCc2cc([N+](=O)[O-])c(Sc3nnc(-c4ccc(Cl)cc4)n3Cc3ccco3)cc2N1 506824930 NVFFXEQHKDLCCY-UHFFFAOYSA-N 481.921 5.184 5 20 JKBD CCN(C(=O)NCCc1ccc([N+](=O)[O-])cc1)[C@H]1CCSc2ccc(Br)cc21 507334995 SPMCKGGSOBSILN-SFHVURJKSA-N 464.385 5.168 5 20 JKBD Cc1ccc(Sc2ccc(CNCc3ccc(N4C[C@H](C)O[C@H](C)C4)nc3)cc2[N+](=O)[O-])cc1 509598643 CUBAPYISACVOLN-BGYRXZFFSA-N 478.618 5.353 5 20 JKBD COc1cc(C(=O)Nc2ccc(Oc3cccc(C)c3)cc2)c([N+](=O)[O-])cc1OCc1cscn1 509892618 FBCOUPGZUQSRJB-UHFFFAOYSA-N 491.525 5.992 5 20 JKBD COCCN(C(=O)COc1cc(Cl)ccc1Cl)c1nc(-c2ccc([N+](=O)[O-])cc2)cs1 514878908 NZQBYPNSBVTCRG-UHFFFAOYSA-N 482.345 5.084 5 20 JKBD CCCC(=O)Nc1cccc(NC(=O)c2ccc(Sc3nc(C)cs3)c([N+](=O)[O-])c2)c1C 516339350 ZKPUBLZRIMXVEN-UHFFFAOYSA-N 470.576 5.810 5 20 JKBD Cc1ccc(NC(=O)c2cccc(C(F)(F)F)c2)cc1NC(=O)c1ccc([N+](=O)[O-])cc1Cl 518890164 MHNLWPCQCCIKPQ-UHFFFAOYSA-N 477.826 6.080 5 20 JKBD CCCN(Cc1nnc(-c2ccccc2Cl)o1)C(=O)[C@H](C)Oc1ccc(Cl)cc1[N+](=O)[O-] 521275677 OLOBJOWPGPPNQO-ZDUSSCGKSA-N 479.320 5.158 5 20 JKBD Cc1ccccc1-c1cc(NCc2ccc(Oc3ccc(F)cc3)c([N+](=O)[O-])c2)n(CCO)n1 521832662 JLKAKAVBZWEJFA-UHFFFAOYSA-N 462.481 5.303 5 20 JKBD O=C(Nc1nc(-c2ccc(OC(F)F)cc2OC(F)F)cs1)c1cc2cc([N+](=O)[O-])ccc2o1 522062458 LLNATDVJOAUSAN-UHFFFAOYSA-N 497.382 5.920 5 20 JKBD O=[N+]([O-])c1ccc2nc(NS(=O)(=O)c3cc(C(F)(F)F)cc(C(F)(F)F)c3)sc2c1 551039594 QNLUYPLCOUELRP-UHFFFAOYSA-N 471.360 5.043 5 20 JKBD COC(=O)c1ccc(F)c(NC(=O)c2cc([N+](=O)[O-])ccc2Sc2ccc(Cl)cc2)c1 592994948 UEFGKECMSXCDDQ-UHFFFAOYSA-N 460.870 5.577 5 20 JKBD O=C(NCCC(=O)N(Cc1ccccc1)c1nc2ccc(Cl)cc2s1)c1ccc([N+](=O)[O-])cc1 600816642 FUYUVQLWYWNUBA-UHFFFAOYSA-N 494.960 5.211 5 20 JKBD Cc1nn(-c2ccc(C(=O)Nc3cc([N+](=O)[O-])ccc3OC(F)F)cc2)c(C)c1Br 603638290 JWHHZZLWCZVUFU-UHFFFAOYSA-N 481.253 5.014 5 20 JKBD Cc1ccc(NC(=O)c2ccccc2)cc1NC(=O)c1ccc(N2CCC(C)CC2)c([N+](=O)[O-])c1 603910341 PYKJROBLXWIJGA-UHFFFAOYSA-N 472.545 5.644 5 20 JKBD CC1CCN(c2ccc(C(=O)Nc3cccc(Cn4ccnc4C(C)C)c3)cc2[N+](=O)[O-])CC1 603927087 QJVCAGBOYAHPHB-UHFFFAOYSA-N 461.566 5.452 5 20 JKBD O=C(Nc1ccc(OC(F)F)c(F)c1)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 603970846 KRHSSCAWXGVCPC-UHFFFAOYSA-N 477.361 5.209 5 20 JKBD CCOc1cc(NC(=O)N(C)C[C@H]2CCCO[C@@H]2c2ccccc2)c([N+](=O)[O-])cc1OCC 604522380 XIMQRBJWCKRRFX-WZONZLPQSA-N 457.527 5.024 5 20 JKBD O=C(Nc1ccc(OC(F)F)cc1)c1ccc(C(=O)Nc2ccc(OC(F)F)cc2)c([N+](=O)[O-])c1 609043321 LGOXZANDSJYRHJ-UHFFFAOYSA-N 493.369 5.302 5 20 JKBD CCOc1cc(NC(=O)c2sc(-c3ccc(OC)cc3)nc2C)c([N+](=O)[O-])cc1OCC 619212817 FZQDTHWKUCCZQZ-UHFFFAOYSA-N 457.508 5.085 5 20 JKBD O=C(Nc1nc(CC(=O)N(CC2CC2)c2ccc(Cl)c([N+](=O)[O-])c2)cs1)c1cccs1 728166366 FMIVHRJDOIULRH-UHFFFAOYSA-N 476.967 5.004 5 20 JKBD COc1cc(C(=O)N(C)c2ccc(N(C)C)cc2)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 728841059 BQFKWDHWJOHZPW-UHFFFAOYSA-N 455.898 5.392 5 20 JKBD COc1cc(C(=O)Nc2cccc(Nc3nc(C)cs3)c2)c([N+](=O)[O-])cc1OCc1cscn1 729336638 NJPJDCQMBIAWSI-UHFFFAOYSA-N 497.558 5.400 5 20 JKBD CC(C)(C)OC(=O)Nc1ccc(NC(=O)c2ccc(Cl)c([N+](=O)[O-])c2)c(C(F)(F)F)c1 729656674 FOBIROFRACUPFX-UHFFFAOYSA-N 459.808 5.866 5 20 JKBD Cc1nc(CCC(=O)O[C@@H](C)c2cccc([N+](=O)[O-])c2)oc1-c1ccc(Br)cc1 730606451 TZOKXVVTKCYYOA-AWEZNQCLSA-N 459.296 5.558 5 20 JKBD C[C@H](OC(=O)CCOc1ccc(Cl)cc1Br)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 743002166 URBDTECSIAZSHG-NSHDSACASA-N 496.701 5.134 5 20 JKBD C[C@H](OC(=O)c1cn(C)nc1-c1ccc([N+](=O)[O-])cc1)c1ccc(NC(=O)c2ccccc2)cc1 748016256 ILIRJMPBYXYYTN-KRWDZBQOSA-N 470.485 5.166 5 20 JKBD COc1cc(C(=O)Nc2ccc(N3CCc4sccc4C3)cc2)c([N+](=O)[O-])cc1OC(F)F 748649971 MUTPPUDTOMZSRL-UHFFFAOYSA-N 475.473 5.081 5 20 JKBD COC(=O)/C=C\c1ccc(N[C@H](C)c2cccc(NC(=O)Cc3ccccc3F)c2)c([N+](=O)[O-])c1 917075310 FATNIQQDEKGZKU-QAAVPBIRSA-N 477.492 5.274 5 20 JKBD COc1ccc(N2C(=S)N[C@H](c3ccc([N+](=O)[O-])cc3)C(C(=O)Nc3cccc(F)c3)=C2C)cc1 917378127 HUUSZYQDUQFMCS-HSZRJFAPSA-N 492.532 5.091 5 20 JKBD CC(C)c1cccc(C(C)C)c1NC(=S)/C(=C(/O)c1cccc([N+](=O)[O-])c1)[n+]1ccccc1 917609987 DSIQGISRJADZTP-UHFFFAOYSA-O 462.595 6.452 5 20 JKBD O=C(COC(=O)c1csc(-c2ccc(Cl)cc2Cl)n1)Nc1ccc(Cl)cc1[N+](=O)[O-] 921221521 BUKSREKSROZSKM-UHFFFAOYSA-N 486.720 5.474 5 20 JKBD Cc1[nH]nc(C(=O)Nc2ccc(C3(NC(=O)c4cc5cc([N+](=O)[O-])ccc5s4)CCC3)cc2)c1F 1787163905 NLJDOMUBSZEUPQ-UHFFFAOYSA-N 493.520 5.042 5 20 JKBD Cc1c(C(=O)NC2(c3ccc(NC(=O)c4ccncc4F)cc3)CCC2)cc(Cl)cc1[N+](=O)[O-] 1788856990 HPJVULXTLSDVPL-UHFFFAOYSA-N 482.899 5.152 5 20 JKBD O=C(NC1(c2ccc(NC(=O)c3c[nH]c4cc(Cl)ccc34)cc2)CCC1)c1ccc([N+](=O)[O-])[nH]1 1788982498 NEHVROZGDGGDKW-UHFFFAOYSA-N 477.908 5.119 5 20 JKBD Cc1cc(O)c([N+](=O)[O-])cc1C(=O)NC1(c2ccc(NC(=O)c3ccc4cnccc4c3)cc2)CCC1 1789015321 PYFVUNJBHVXTRR-UHFFFAOYSA-N 496.523 5.219 5 20 JKBD COc1cc(C(=O)Nc2ccc(C3(NC(=O)CCC4CCCC4)CCC3)cc2)c([N+](=O)[O-])cc1O 1790082864 HUCFNAZRLUISLC-UHFFFAOYSA-N 481.549 5.027 5 20 JKBD COc1ncccc1C(=O)NC1(c2ccc(NC(=O)c3cc(Cl)cc([N+](=O)[O-])c3C)cc2)CCC1 1790774649 VRANMYVLCDNVDX-UHFFFAOYSA-N 494.935 5.022 5 20 JKBD CC(C)[C@@H](C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C1(c2cccc([N+](=O)[O-])c2)CCC1)c1ccccc1 1800038520 FKICNOXCGACXJO-OUJSJNLKSA-N 489.616 5.095 5 20 JKBD Cc1c(C(=O)N2CCC([C@@H]3CCCCN3C(=O)c3cccs3)CC2)cc(Cl)cc1[N+](=O)[O-] 1825778761 DZKWMRWJCHJGIU-IBGZPJMESA-N 475.998 5.165 5 20 JKBD CC[C@@H](C(=O)N1CCC([C@H]2CCCCN2C(=O)c2ccc([N+](=O)[O-])c(OC)c2)CC1)c1ccccc1 1832696821 XNJVQPSGPXSNAW-DNQXCXABSA-N 493.604 5.031 5 20 JKBD CN(Cc1cc([N+](=O)[O-])ccc1Cl)C(=O)c1ccc2c(=O)n(-c3ccccc3F)c(=S)[nH]c2c1 10377357 ZNKWGQVUFIMFQM-UHFFFAOYSA-N 498.923 5.021 5 20 JKBD COC(=O)C1CCN(C(=O)c2c3c(nc4ccccc24)/C(=C/c2ccc([N+](=O)[O-])cc2)CCC3)CC1 14342701 TXEKUWVQNAEBHY-LVZFUZTISA-N 485.540 5.045 5 20 JKBD Cc1c(NC(=O)c2ccc(NS(=O)(=O)c3cc(Cl)ccc3Cl)cc2)cccc1[N+](=O)[O-] 15790975 XKHOLCPIQFGUHK-UHFFFAOYSA-N 480.329 5.263 5 20 JKBD CC1CCN(c2ccc(C(=O)O[C@H](C)C(=O)Nc3ccccc3C(F)(F)F)cc2[N+](=O)[O-])CC1 15816532 RZAQTJMWQXOHAV-OAHLLOKOSA-N 479.455 5.034 5 20 JKBD Cc1ccc(NC(=O)[C@@H](Sc2nnc(-c3ccoc3C)n2C)c2ccccc2)c([N+](=O)[O-])c1 21620414 KQEKAZJCZOEVOD-FQEVSTJZSA-N 463.519 5.072 5 20 JKBD CCOC(=O)c1c(-c2ccc(OC)cc2)csc1NC(=O)c1cc(SC)ccc1[N+](=O)[O-] 24468640 ZYKLVNFQPZGHOV-UHFFFAOYSA-N 472.544 5.483 5 20 JKBD Cc1onc(-c2c(Cl)cccc2Cl)c1C(=O)Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1 71854082 VWHVIEDHJXKLHM-UHFFFAOYSA-N 475.313 6.241 5 20 JKBD CCOc1cc(NC(=O)CCc2ncc(-c3ccc(Cl)cc3)o2)c([N+](=O)[O-])cc1OCC 302983485 ULAQGFUGSOYRBV-UHFFFAOYSA-N 459.886 5.272 5 20 JKBD CCOc1cc(C(=O)N[C@H](c2cccc(C(F)(F)F)c2)C(C)(C)C)c([N+](=O)[O-])cc1OC 303135375 JKQVIXBBMSDINR-LJQANCHMSA-N 454.445 5.538 5 20 JKBD COc1ccc(CN(Cc2ccccc2)C(=O)c2ccc(Cn3nc(C)c([N+](=O)[O-])c3C)cc2)cc1 491566128 BHEOWBYWJROVRV-UHFFFAOYSA-N 484.556 5.308 5 20 JKBD CCOc1cc2c(cc1[C@@H]1C[C@H]1NC(=O)CSc1ccc(C(F)(F)F)cc1[N+](=O)[O-])O[C@H](C)C2 504499984 UUWUWDJPUUAVQO-ISTRZQFTSA-N 496.507 5.100 5 20 JKBD Cc1ccc(N(C(=O)C2CCN(c3ccccc3[N+](=O)[O-])CC2)c2nc3ccccc3s2)c(C)c1 518820075 RPTBWIDQEXGAJO-UHFFFAOYSA-N 486.597 6.403 5 20 JKBD O=C(Nc1ccccc1OCCn1ccnc1)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1 519880983 JSVXRTYMYAIRFE-UHFFFAOYSA-N 478.892 5.568 5 20 JKBD C[C@H]1CCC[C@@H](C)N1C(=O)c1cc(Cl)ccc1NC(=O)c1ccn(-c2ccc([N+](=O)[O-])cc2)n1 520020613 YEARBJYWFHKSDD-IYBDPMFKSA-N 481.940 5.089 5 20 JKBD Cc1nc(CNC(=O)c2ccccc2Sc2ccc(C(F)(F)F)cc2[N+](=O)[O-])nc2ccccc12 522547170 UJUNDAGUHCKUCN-UHFFFAOYSA-N 498.486 5.946 5 20 JKBD Cc1ccc(-c2csc(NC(=O)c3ccc(-c4noc(C(F)(F)F)n4)cc3)n2)cc1[N+](=O)[O-] 609326612 ZLZGOXAJKDMBTC-UHFFFAOYSA-N 475.408 5.348 5 20 JKBD C[C@@H]1CN(c2ccc(NC(=O)c3ccc(N4CCCC4)c([N+](=O)[O-])c3)cc2C(F)(F)F)C[C@@H](C)O1 728010140 DUWVLNGSBKFLDY-HZPDHXFCSA-N 492.498 5.080 5 20 JKBD C[C@@H](Nc1ccc(C(=O)OCc2csc(-c3ccoc3)n2)cc1[N+](=O)[O-])c1ccccn1 731073691 JFWURUXYGOGOJC-CQSZACIVSA-N 450.476 5.236 5 20 JKBD CC[C@@H](C)c1ccccc1NC(=O)[C@@H](C)OC(=O)c1csc(-c2cccc([N+](=O)[O-])c2)n1 747961089 FYONJXNQRXPWAZ-HUUCEWRRSA-N 453.520 5.416 5 20 JKBD Cc1cc(-c2cc(C(=O)O[C@@H](C)C(=O)Nc3ccc(F)c([N+](=O)[O-])c3)c3c(C)noc3n2)c(C)s1 813303796 YNNSWCGDEUCKQV-LBPRGKRZSA-N 498.492 5.108 5 20 JKBD CN(C(=O)c1ccc(-n2nc(SCc3ccccc3)sc2=S)cc1)c1ccc([N+](=O)[O-])cc1 823812407 JJDDVXBKYRTBNX-UHFFFAOYSA-N 494.623 6.140 5 20 JKBD O=C(Nc1ncc(Cc2cccc(Cl)c2Cl)s1)c1cc([N+](=O)[O-])ccc1N1CCOCC1 844776922 ZHCRGHHARVETCW-UHFFFAOYSA-N 493.372 5.038 5 20 JKBD COc1ccc(-c2nc(Cc3noc(-c4csc(-c5ccc([N+](=O)[O-])cc5)n4)n3)co2)cc1 904330949 AEOAWEBJIHAOCC-UHFFFAOYSA-N 461.459 5.023 5 20 JKBD O=C(NCc1ccccc1F)c1cc(NC(=O)c2cc(Cl)ccc2[N+](=O)[O-])ccc1Cl 916086739 BHYUZEBNRBLUOW-UHFFFAOYSA-N 462.264 5.223 5 20 JKBD COC(=O)Nc1ccc(NC(=O)C/C(=C/c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)cc1 916475434 PPEDZEKOXPXDHN-VKAVYKQESA-N 488.525 5.952 5 20 JKBD O=C(CCCn1c(=O)oc2cc([N+](=O)[O-])ccc21)Nc1ccccc1SC[C@H]1CC1(Cl)Cl 917750742 IQPULGHQRQFWKY-CYBMUJFWSA-N 496.372 5.208 5 20 JKBD CCc1ccc(C(=O)Nc2ccc(C3(NC(=O)CSc4ccccc4[N+](=O)[O-])CCC3)cc2)cn1 1787256585 XNHASDXNXZHKGA-UHFFFAOYSA-N 490.585 5.092 5 20 JKBD Cc1cccc(C(=O)Nc2ccc(C3(NC(=O)c4cc5cc([N+](=O)[O-])ccc5s4)CCC3)cc2)n1 1787324835 OGRATEDLWVWTCC-UHFFFAOYSA-N 486.553 5.574 5 20 JKBD Cc1c(Cl)cccc1C(=O)N1CCCC2(CCN(C(=O)CCc3cccc([N+](=O)[O-])c3)CC2)C1 1805095554 REOBSMNTVPUMQI-UHFFFAOYSA-N 483.996 5.034 5 20 JKBD O=C(CCC1CCCC1)N1CCCC2(CCN(C(=O)c3cc4cc([N+](=O)[O-])ccc4s3)CC2)C1 1808953400 DDJSGHSTHMEJGH-UHFFFAOYSA-N 483.634 5.625 5 20 JKBD O=C(c1ccc(Cl)s1)N1CCC([C@H]2CCCCN2C(=O)CCc2cccc([N+](=O)[O-])c2)CC1 1824838471 IITZHBBLGXBZTN-HXUWFJFHSA-N 490.025 5.176 5 20 JKBD CC(C)CCC(=O)N1CCC([C@H]2CCCCN2C(=O)c2cccc([N+](=O)[O-])c2Br)CC1 1830516788 IOBIAQHKQPMGCL-LJQANCHMSA-N 494.430 5.027 5 20 JKBD Cc1cccc(C(=O)N2CCC([C@H]3CCCCN3C(=O)c3cc(F)cc([N+](=O)[O-])c3)CC2)c1Cl 1830615522 JOKCUJSPKXWUKJ-JOCHJYFZSA-N 487.959 5.243 5 20 JKBD Cc1c(C(=O)N2CCCC[C@H]2C2CCN(C(=O)CCC(C)C)CC2)cc(Cl)cc1[N+](=O)[O-] 1830736981 HAKIXCOGYXEAKA-NRFANRHFSA-N 464.006 5.226 5 20 JKBD CC[C@H]1CC[C@H](C(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3cc([N+](=O)[O-])ccc3N(C)C)CC2)CC1 1831695372 SAGXXXPHMLCRHH-QFZWGZQFSA-N 498.668 5.111 5 20 JKBD CC(C)c1cccc(C(C)C)c1NC(=O)COC(=O)c1ccc(Br)c([N+](=O)[O-])c1 9849036 BETRSCVYURKMJU-UHFFFAOYSA-N 463.328 5.400 5 20 JKBD O=C(Nc1nnc(SCc2ccc(Cl)cc2)s1)C1CCN(c2ccccc2[N+](=O)[O-])CC1 16008595 BRTDEIYUMILAPN-UHFFFAOYSA-N 490.010 5.247 5 20 JKBD Cc1ccc(NC(=O)[C@H](C)Sc2nc3ccc([N+](=O)[O-])cc3s2)c(Br)c1 16054225 ROIPPGJWZCHYPO-JTQLQIEISA-N 452.355 5.395 5 20 JKBD C[C@H](OC(=O)c1ccc([N+](=O)[O-])cc1Cl)C(=O)N1c2ccccc2Sc2ccccc21 22668051 WATKOVDNTWDSGB-ZDUSSCGKSA-N 454.891 5.623 5 20 JKBD Cc1c(Cl)cccc1NC(=O)COC(=O)c1ccccc1C(=O)c1ccc(Cl)c([N+](=O)[O-])c1 28278842 NUDQJYLIFASWIM-UHFFFAOYSA-N 487.295 5.237 5 20 JKBD COc1cc(C(=O)Nc2ccc(-n3ccnc3)cc2)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 29920192 PGNYZYFBRSOZOC-UHFFFAOYSA-N 464.865 5.487 5 20 JKBD C[C@H](Sc1nnc(-c2ccccc2)c(-c2ccccc2)n1)C(=O)Nc1ccccc1[N+](=O)[O-] 33941614 MMVIXVLWCYFXGI-INIZCTEOSA-N 457.515 5.233 5 20 JKBD CSc1ccc(C(=O)Nc2ccc(N(C)C(=O)c3ccc(Cl)cc3)cc2)cc1[N+](=O)[O-] 195645394 QMFOIVSDUWCYBM-UHFFFAOYSA-N 455.923 5.499 5 20 JKBD COc1cc(C(=O)Nc2ccc(N(C)C)cc2C)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 482437684 OMBWYTJYORCZTN-UHFFFAOYSA-N 455.898 5.676 5 20 JKBD O=C(CCCNc1ccc([N+](=O)[O-])cc1)Nc1ccc(Cl)c(C(=O)NCc2ccccc2F)c1 484238599 WRRGTBRTNVSBPD-UHFFFAOYSA-N 484.915 5.148 5 20 JKBD CC(=O)Nc1cccc(NC(=O)c2ccccc2Sc2ccc(C(F)(F)F)cc2[N+](=O)[O-])c1C 484285935 SHMHPOBDDCOQAY-UHFFFAOYSA-N 489.475 6.284 5 20 JKBD O=C(C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1)N(Cc1ccco1)C1CCCC1 499585149 LTZYZKHAPGZKDL-UHFFFAOYSA-N 465.472 5.394 5 20 JKBD O=[N+]([O-])c1cc2c(c(CSc3nnc(COc4ccc(Cl)cc4Cl)o3)c1)OCOC2 501073408 ZMXKDMSFHYYMRU-UHFFFAOYSA-N 470.290 5.022 5 20 JKBD Cc1ccc([N+](=O)[O-])cc1C(=O)Nc1ccc(CNC(=O)c2ccc(C(F)(F)F)cc2)cc1 502527107 HELAPQQANJAKQM-UHFFFAOYSA-N 457.408 5.104 5 20 JKBD C[C@H](Nc1ccc(C(=O)NCCc2cccc(Cl)c2Cl)cc1[N+](=O)[O-])c1ccccn1 507401860 KADCYQORMBUNJT-AWEZNQCLSA-N 459.333 5.442 5 20 JKBD CC[C@@H](NCc1ccc(-c2ccc([N+](=O)[O-])cc2)s1)c1ccccc1OCC(=O)N(C)C 517534186 NGZZDBZZXSIJIS-OAQYLSRUSA-N 453.564 5.031 5 20 JKBD Cn1ccnc1[C@@H](NCc1ccc(-c2ccc([N+](=O)[O-])cc2Br)o1)c1cccc(F)c1 520954159 CSJANMBGSUOJSR-NRFANRHFSA-N 485.313 5.369 5 20 JKBD Cc1csc(Sc2ccc(C(=O)N3CCC(N4CCc5ccccc5C4)CC3)cc2[N+](=O)[O-])n1 521719062 DWIWUEHSYFVTDK-UHFFFAOYSA-N 494.642 5.174 5 20 JKBD O=C(Nc1ccccc1OCc1ncc(-c2cccc(Cl)c2)o1)c1n[nH]c2ccc([N+](=O)[O-])cc12 524266798 VWMHXHWMVHEETA-UHFFFAOYSA-N 489.875 5.611 5 20 JKBD C[C@H](CCc1ccco1)NC(=O)C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1 592465290 VGUPPJXYIOJACP-VXNZKSKFSA-N 461.543 5.866 5 20 JKBD CCn1c(SCC(=O)N[C@H](C)c2cccc([N+](=O)[O-])c2)nnc1-c1ccc(Cl)cc1Cl 603900457 LDMVBTLHVUMIPX-GFCCVEGCSA-N 480.377 5.150 5 20 JKBD Cc1ccc(OCCCC(=O)Nc2ccc(CNC(=O)c3ccc(Cl)cc3[N+](=O)[O-])cc2)cc1 603903304 RKSFTRCRQNYFDK-UHFFFAOYSA-N 481.936 5.284 5 20 JKBD CC(C)NC(=O)c1ccc(Cl)c(NC(=O)c2ccc(N3C[C@@H](C)C[C@@H](C)C3)c([N+](=O)[O-])c2)c1 603975398 YFURPYAIJKODDE-IYBDPMFKSA-N 472.973 5.121 5 20 JKBD C[C@H](Nc1ccc(C(=O)N2CCC(N3c4ccccc4C[C@H]3C)CC2)cc1[N+](=O)[O-])c1ccccn1 604309609 VPFIDFMMCRBSIJ-UXHICEINSA-N 485.588 5.219 5 20 JKBD CCOc1ccc(NC(=O)CSc2ccc(C(F)(F)F)cc2[N+](=O)[O-])c(C(F)(F)F)c1 604448376 DKNIKLJYIXGGNS-UHFFFAOYSA-N 468.375 5.762 5 20 JKBD Cc1cc(Sc2ncccn2)ccc1NC(=O)c1ccc(N[C@H](C)c2ccccn2)c([N+](=O)[O-])c1 608895595 XGZALOTVWPLFKD-QGZVFWFLSA-N 486.557 5.665 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Cl)[C@H](c1ccccc1)N1CCO[C@@H](c2ccc(F)c(F)c2)C1 608976188 UELWGGKBHHKBQO-PKTZIBPZSA-N 487.890 5.280 5 20 JKBD O=C(Cn1c2ccccc2c(=O)c2ccccc21)Nc1cccc(CC[C@H](O)c2ccccc2)c1 727762012 GBDBWCHIOAXLKL-NDEPHWFRSA-N 462.549 5.460 5 20 JKBD Cc1csc(SCc2ccccc2C(=O)OC[C@H]2CCCN2C(=O)c2ccccc2[N+](=O)[O-])n1 730702739 CXIHSGDVSJGFDK-GOSISDBHSA-N 497.598 5.114 5 20 JKBD Cn1c(CSc2nc3ccccc3s2)nnc1Sc1nc2ccc([N+](=O)[O-])cc2s1 731208746 JNMQGBGIWARIKR-UHFFFAOYSA-N 472.602 5.386 5 20 JKBD Cc1ccc(-c2ncc(C(=O)OCC(=O)Nc3ccc(C(F)(F)F)cc3[N+](=O)[O-])s2)c(C)c1 747261516 ZCHOMFJAEPUMEF-UHFFFAOYSA-N 479.436 5.149 5 20 JKBD Cc1c(C(=O)Nc2ccc(Cl)cc2C(=O)N2[C@@H](C)CCC[C@H]2C)cc([N+](=O)[O-])c(C)c1[N+](=O)[O-] 748617503 KTSWCLDBJCLMJA-BETUJISGSA-N 488.928 5.429 5 20 JKBD COc1cc(C)ccc1Oc1ccc(F)cc1NC(=O)c1cc([N+](=O)[O-])c(C)c([N+](=O)[O-])c1C 748635802 YUBORTVIIUCABB-UHFFFAOYSA-N 469.425 5.621 5 20 JKBD CC(=O)Nc1ccc(NC(=O)C/C(=C/c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)cc1C 893536236 RUZCRHONRTZMOJ-RGEXLXHISA-N 486.553 6.041 5 20 JKBD COc1ccc(N2C(=S)N[C@H](c3ccccc3[N+](=O)[O-])C(C(=O)Nc3ccc(F)cc3)=C2C)cc1 916167551 ACDQEUPYNVXMSL-HSZRJFAPSA-N 492.532 5.091 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Cl)[C@H](Nc1ccc(OC[C@H]2CCCO2)cc1)c1ccccc1 917937298 DAMAFYNIHLTSNU-ZJSXRUAMSA-N 481.936 5.598 5 20 JKBD CCCOc1ccc(CNC(=O)c2ccccc2NC(=O)c2ccc([N+](=O)[O-])cc2Cl)cc1 918600628 OMOGGTOKFBGSOR-UHFFFAOYSA-N 467.909 5.219 5 20 JKBD C[C@@H](Nc1ccc(C(=O)OCC(=O)C23CC4CC(CC(C4)C2)C3)cc1[N+](=O)[O-])c1ccccn1 920545711 IHJNYFWUQZPDBX-KRGUIMPISA-N 463.534 5.105 5 20 JKBD O=C(NC1(c2ccc(NC(=O)c3cc4cccnc4s3)cc2)CCC1)c1cc(F)cc([N+](=O)[O-])c1 1788971470 UEKCXJHQADTVIK-UHFFFAOYSA-N 490.516 5.405 5 20 JKBD O=C(NC1(c2ccc(NC(=O)[C@@H]3CCC[C@@H]4CCCC[C@H]43)cc2)CCC1)c1ccc([N+](=O)[O-])[nH]1 1789192142 UHVIFQWTBZCBJN-IOMROCGXSA-N 464.566 5.277 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)c3cccc4ccoc34)CCC2)cc1)c1cc([N+](=O)[O-])cc2c1OCC2 1790045586 WYQGCPTWEDFGDG-UHFFFAOYSA-N 497.507 5.337 5 20 JKBD Cc1ccc(CCC(=O)NC2(c3ccc(NC(=O)c4c(F)ccc([N+](=O)[O-])c4C)cc3)CCC2)cn1 1790771398 ZPGWBNGETWWRQO-UHFFFAOYSA-N 490.535 5.126 5 20 JKBD O=C(NC[C@@H]1CCN(C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)[C@H]1c1cccnc1)C1CCCCC1 1806231963 YOCGZCXPROBAQD-CYFREDJKSA-N 492.601 5.104 5 20 JKBD O=C(CSc1ccccc1[N+](=O)[O-])N1CCC([C@H]2CCCCN2C(=O)[C@@H](F)c2ccccc2)CC1 1824862392 YQDLHYOARLKAEC-BWKNWUBXSA-N 499.608 5.017 5 20 JKBD COc1ccc(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3cc(Cl)cc([N+](=O)[O-])c3C)CC2)cc1 1830037682 UNGIOYJHVCSNDN-HSZRJFAPSA-N 499.995 5.112 5 20 JKBD Cc1cccc(C(=O)N2CCC([C@H]3CCCCN3C(=O)c3cccc(F)c3[N+](=O)[O-])CC2)c1Cl 1830622751 NAGOBUNAUBKPQF-OAQYLSRUSA-N 487.959 5.243 5 20 JKBD CCCCC[C@H](C)C(=O)N1CCCC[C@H]1C1CCN(C(=O)Cc2cc(F)ccc2[N+](=O)[O-])CC1 1831468058 IWOTWIGIPAKFGC-CVDCTZTESA-N 475.605 5.113 5 20 JKBD O=C(/C=C/c1ccc([N+](=O)[O-])o1)N1CCC([C@@H]2CCCCN2C(=O)c2ccccc2C2CC2)CC1 1832554674 PUPOZYMHKOZHHO-YKATVRGKSA-N 477.561 5.012 5 20 JKBD COc1ccc(NC(=O)c2ccc(Sc3nc4ccccc4s3)c([N+](=O)[O-])c2)cc1NC(C)=O 27995403 NXJGHQHSQJWVRF-UHFFFAOYSA-N 494.554 5.575 5 20 JKBD COc1ccc(N2C(=O)/C(=C/c3cccs3)N=C2SCc2ccc([N+](=O)[O-])cc2)cc1Cl 34888112 ROJVSUUFUJOEKC-UNOMPAQXSA-N 485.974 5.995 5 20 JKBD O=C(CSc1nnc(-c2ccc(F)cc2)c2ccccc12)Nc1ccc(F)c([N+](=O)[O-])c1 107888307 CRCMGJICHTWIFM-UHFFFAOYSA-N 452.442 5.214 5 20 JKBD COc1ccc(-c2[nH]c3ccccc3c2CCC(=O)OCc2nc(-c3ccc([N+](=O)[O-])cc3)no2)cc1 108800965 GVLPUIPYTIWZSM-UHFFFAOYSA-N 498.495 5.478 5 20 JKBD COc1ccccc1C[C@@H]1CCCN1C(=O)c1ccc(N[C@H](C)c2ccccn2)c([N+](=O)[O-])c1 302981606 KMYIAKZNPVVQBU-NQIIRXRSSA-N 460.534 5.019 5 20 JKBD O=C(CSc1ccc(C(F)(F)F)cc1[N+](=O)[O-])Nc1ccccc1NC(=O)C[C@H]1C=CCC1 303312813 PJKHEGOHDAFZRW-AWEZNQCLSA-N 479.480 5.639 5 20 JKBD O=C(C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)N1CC[C@H]1c1ccccc1 478840334 ZRYABMJOHFCKQZ-UEAVEIDSSA-N 455.539 6.109 5 20 JKBD O=C(Nc1ccc(NS(=O)(=O)c2c(Cl)cccc2Cl)cc1)c1csc([N+](=O)[O-])c1 491030491 WFDISTIUOYWGRC-UHFFFAOYSA-N 472.331 5.016 5 20 JKBD COc1cc(C(=O)N(c2ccc(Cl)c(Cl)c2)C(C)C)c([N+](=O)[O-])cc1OCc1cscn1 505073565 JLKAMSKAOJDUGK-UHFFFAOYSA-N 496.372 6.001 5 20 JKBD O=C(C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)N1CCC[C@H]1c1ccccn1 516667713 QGPIHKLISLJBOF-NMJXDZPISA-N 470.554 5.894 5 20 JKBD O=C(Nc1cccc(CNCc2ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])cc2)c1)[C@H]1CCCO1 518779560 XYZKTHCKYOMQAF-XMMPIXPASA-N 481.936 5.448 5 20 JKBD O=[N+]([O-])c1cc(CNCc2ccc(Oc3cccnc3)c(F)c2)ccc1Oc1ccc(F)cc1 520216479 LFEYMNXURHMYCD-UHFFFAOYSA-N 463.440 6.142 5 20 JKBD Cc1ccc(NC(=O)c2ccc(Nc3ccccc3)c([N+](=O)[O-])c2)cc1NC(=O)c1ccncc1 521490483 OBXKRARABLNQHP-UHFFFAOYSA-N 467.485 5.546 5 20 JKBD CCCn1ccc2cc(NC(=O)c3cc(OC)c(OCc4cscn4)cc3[N+](=O)[O-])ccc21 522161959 TXFSTPQPLKERCI-UHFFFAOYSA-N 466.519 5.256 5 20 JKBD C[C@@H]1CSc2ccc(Br)cc2[C@@H]1NC(=O)Cn1c2ccccc2c(=O)c2ccccc21 591369839 KQZGDVCSKRZMSD-OYLFLEFRSA-N 493.426 5.517 5 20 JKBD CC(C)CNC(=O)c1ccc(NC(=O)Cc2cn(-c3ccccc3)nc2-c2ccc([N+](=O)[O-])cc2)cc1 603970748 DSGSGKJEQFAEHT-UHFFFAOYSA-N 497.555 5.015 5 20 JKBD COc1cccc(-c2nn(Cc3ccccc3)cc2C(=O)N[C@@H](C)c2cccc([N+](=O)[O-])c2)c1 604109103 XEKQLRXZVCAVMN-SFHVURJKSA-N 456.502 5.006 5 20 JKBD CCOCc1cccc(NC(=O)c2ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])c(OC)c2)c1 608807591 PMWKLIGNURRHLY-UHFFFAOYSA-N 456.882 5.838 5 20 JKBD CS(=O)(=O)c1ccc(Oc2ccc(NC(=O)c3csc(-c4ccc([N+](=O)[O-])cc4)n3)cc2)cc1 608809312 AXANZOYXRGHNDK-UHFFFAOYSA-N 495.538 5.166 5 20 JKBD CSc1ccc([N+](=O)[O-])c(C(=O)NCc2ccccc2-c2ccc(Cn3cccn3)cc2)c1 608913612 NKLDKOHRWYRIHM-UHFFFAOYSA-N 458.543 5.159 5 20 JKBD COc1ccc(C[C@@H](N[C@@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)c2ccccc2)cc1OC 608980681 FUHKKUDKTRQANV-HTAPYJJXSA-N 474.517 5.297 5 20 JKBD C[C@H](Nc1ccc(NC(=O)c2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)cc1Cl)c1ccccc1 609072654 XHDACOJTGGMTCQ-INIZCTEOSA-N 475.936 6.074 5 20 JKBD C[C@@H](SCCCOc1ccc([N+](=O)[O-])cc1)c1nc(O)c2c(-c3ccco3)csc2n1 609235664 JOLIDIRQBPDELL-CYBMUJFWSA-N 457.533 5.828 5 20 JKBD Cc1ccc(-c2csc3nc(CSCCOc4ccc([N+](=O)[O-])cc4)nc(O)c23)s1 609388216 VDQTZVYFKOKZEC-UHFFFAOYSA-N 459.574 5.654 5 20 JKBD COc1ccc(NC(=O)[C@H](OC(=O)c2c(Cl)cccc2[N+](=O)[O-])c2ccccc2)cc1Cl 730645948 VJNXZCPCEZGHGX-HXUWFJFHSA-N 475.284 5.447 5 20 JKBD CC1=C(C(=O)Nc2ccccc2C(F)(F)F)[C@H](c2ccc([N+](=O)[O-])o2)NC(=S)N1CC(C)C 812790375 OZUIHGVEDVFIEA-SFHVURJKSA-N 482.484 5.007 5 20 JKBD C[C@@H](OC(=O)c1cc([N+](=O)[O-])ccc1N1CCCC1)C(=O)Nc1c(Cl)cc(Cl)cc1Cl 846285511 VBLORQVAYAEDBZ-LLVKDONJSA-N 486.739 5.339 5 20 JKBD C[C@@H](Oc1cccc(Cl)c1Cl)C(=O)O[C@H](C)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 915496601 XPWYFKMTAIKYMP-GHMZBOCLSA-N 452.250 5.023 5 20 JKBD O=C(/C=C\c1ccc(-c2ccccc2Cl)s1)N1CCN(C(=O)c2ccc([N+](=O)[O-])s2)CC1 915600701 WGYGQOJUZFZAPV-TWGQIWQCSA-N 487.990 5.036 5 20 JKBD Cn1ccc(COC(=O)c2c3c(nc4ccccc24)/C(=C/c2cccc([N+](=O)[O-])c2)CCC3)cc1=O 918873666 VDMASORCHDUABX-XSFVSMFZSA-N 481.508 5.076 5 20 JKBD CC(=O)N(c1ccc(C(F)(F)F)cc1)c1nc(COC(=O)c2ccc([N+](=O)[O-])s2)cs1 920494553 VJVHRLOWRDJMGO-UHFFFAOYSA-N 471.438 5.173 5 20 JKBD O=C(CCc1cccc([N+](=O)[O-])c1)NC1(c2ccc(NC(=O)[C@@H]3CCC(F)(F)C3)cc2)CCC1 1785800950 UDLGUFALYJARDA-GOSISDBHSA-N 471.504 5.097 5 20 JKBD Cc1nc(C(=O)Nc2ccc(C3(NC(=O)c4cc(Cl)cc([N+](=O)[O-])c4C)CCC3)cc2)cs1 1787528838 NXBNWWOMSHOMQC-UHFFFAOYSA-N 484.965 5.383 5 20 JKBD O=C(Cc1cccnc1)Nc1ccc(C2(NC(=O)c3cc4cc([N+](=O)[O-])ccc4s3)CCC2)cc1 1788268891 OSZWUWVTLXATSY-UHFFFAOYSA-N 486.553 5.195 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)c3sccc3Cl)CCC2)cc1)c1ccc(O)c([N+](=O)[O-])c1 1790618850 MCWQILVWDWUHML-UHFFFAOYSA-N 471.922 5.077 5 20 JKBD CC(C)(C)CCCCCC(=O)Nc1ccc(C2(NC(=O)c3nc[nH]c3[N+](=O)[O-])CCC2)cc1 1791382085 SOOFIFHPVOFXHU-UHFFFAOYSA-N 455.559 5.062 5 20 JKBD O=C(CCCn1cccc1)Nc1ccc(C2(NC(=O)Cc3ccc(Cl)cc3[N+](=O)[O-])CCC2)cc1 1791899611 GLMCASNHWICORA-UHFFFAOYSA-N 494.979 5.207 5 20 JKBD Cc1ccc(CCC(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cc(F)cc([N+](=O)[O-])c2)c2ccccc12 1800526474 CUSUMWHCSRTOKO-NUNAXRQHSA-N 489.547 5.080 5 20 JKBD Cc1ccc(CCC(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)s1 1801206209 VQQQIGZJFFIPIH-BCDXTJNWSA-N 483.615 5.064 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cc3ccccc3o2)n[nH]1 1818631993 HTBBVSLBKYXEQD-IBGZPJMESA-N 491.479 5.131 5 20 JKBD Cc1ccc(F)cc1C(=O)N1CCCC[C@H]1C1CCN(C(=O)CSc2ccccc2[N+](=O)[O-])CC1 1823895433 VPVHYKTYOZNFBZ-QFIPXVFZSA-N 499.608 5.068 5 20 JKBD CC1(C(=O)N2CCC([C@H]3CCCCN3C(=O)Cn3ccc4ccc([N+](=O)[O-])cc43)CC2)CCCCC1 1824372405 HTSINHJOPXCRBD-XMMPIXPASA-N 494.636 5.140 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cccc3ccoc23)CC1 1830729783 XNQQGXZZZAYXDQ-QHCPKHFHSA-N 493.535 5.336 5 20 JKBD Cc1cc([N+](=O)[O-])ccc1NC(=O)CSc1nnc(-c2ccc(Cl)cc2)n1-c1ccccc1 8641471 OIUWCWYHBAUROL-UHFFFAOYSA-N 479.949 5.535 5 20 JKBD CC(=O)N(c1ccc(Cl)c(Cl)c1)c1nc(COC(=O)COc2ccccc2[N+](=O)[O-])cs1 11083338 VIIOXGRGGPHLHN-UHFFFAOYSA-N 496.328 5.165 5 20 JKBD C[C@@H](Sc1nnc(Cc2ccccc2)n1-c1ccccc1)C(=O)Nc1ccc(F)c([N+](=O)[O-])c1 12105600 ZEQKHGMTFCJKTE-MRXNPFEDSA-N 477.521 5.025 5 20 JKBD Cc1cc(C)c(NC(=O)CN(C)C(=O)c2ccc(SCCC(C)C)c([N+](=O)[O-])c2)c(C)c1 15622042 SSTCCFMXFDMCOQ-UHFFFAOYSA-N 457.596 5.369 5 20 JKBD C[C@@H](Sc1nnc(COc2ccc(Cl)cc2)o1)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 17654552 FAROPXGSCJUGLW-LLVKDONJSA-N 459.871 5.114 5 20 JKBD C[C@@H](Sc1nnc(Nc2cccc(F)c2)s1)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 22171743 FHPAZZYNUFMVLT-SECBINFHSA-N 487.460 5.467 5 20 JKBD O=C(CCSc1nnc(-c2ccccc2F)n1Cc1ccccc1)Nc1ccccc1[N+](=O)[O-] 26231871 ZBPDXEOWPXATHS-UHFFFAOYSA-N 477.521 5.162 5 20 JKBD Cc1ccc(-n2c(SCc3nnc(-c4ccc([N+](=O)[O-])cc4)o3)nnc2-c2cccc(C)c2)cc1 29830918 FKIHOTIJYFVIOF-UHFFFAOYSA-N 484.541 5.802 5 20 JKBD CC(C)c1ccc(CSc2nnc(SCc3nc(-c4cccc([N+](=O)[O-])c4)no3)s2)cc1 31844249 SMURONZFGCVTNH-UHFFFAOYSA-N 485.616 6.204 5 20 JKBD O=C(Cc1csc(COc2ccc(Cl)cc2)n1)N(Cc1ccccc1[N+](=O)[O-])CC(F)(F)F 106187968 OMUXPTRONDPKIL-UHFFFAOYSA-N 499.898 5.417 5 20 JKBD CC1=NN(c2ccc(C(=O)O[C@H](C(=O)Nc3ccc(C)cc3[N+](=O)[O-])c3ccccc3)cc2)CC1 108765473 OZBLRIAJROXEOU-DEOSSOPVSA-N 472.501 5.026 5 20 JKBD O=C([C@H]1C[C@@H]1c1cccc(Br)c1)N(Cc1ccccc1[N+](=O)[O-])CC(F)(F)F 195747989 PFVPVTMVMPCTCI-CVEARBPZSA-N 457.246 5.052 5 20 JKBD C[C@@H](Cn1ccnc1)NC(=O)c1c2c(nc3ccccc13)/C(=C\c1cccc([N+](=O)[O-])c1)CCC2 481310956 OGOGEYRCLMSGIC-HJHGFDQJSA-N 467.529 5.035 5 20 JKBD CC(C)N1CCC(N(C)C(=O)C/C(=C/c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)CC1 483943649 OLIQVWFGXKCASM-SILNSSARSA-N 478.618 5.466 5 20 JKBD Cc1ccc(C(=O)NC2CCN(C(=O)c3ccc(Oc4ccc(Cl)cc4[N+](=O)[O-])cc3)CC2)s1 497320997 SQTIAXLPCYNYMY-UHFFFAOYSA-N 499.976 5.445 5 20 JKBD CCC(=O)N[C@H]1CCCN(C(=O)c2c3c(nc4ccccc24)/C(=C/c2ccc([N+](=O)[O-])cc2)CCC3)C1 499569394 FOTWAFYBEFZGFZ-NUTRWHQKSA-N 498.583 5.151 5 20 JKBD CN(C(=O)c1csc(-c2ccc([N+](=O)[O-])cc2)n1)[C@H]1CCSc2ccc(Br)cc21 504611940 FGUZWKWPKGMPRD-KRWDZBQOSA-N 490.404 5.790 5 20 JKBD C[C@H]1CN(C(=O)c2ccc(CNCc3ccc(Oc4ccc(F)cc4)c([N+](=O)[O-])c3)cc2)C[C@H](C)O1 507904672 QWIZBKPNRZXROC-OALUTQOASA-N 493.535 5.065 5 20 JKBD Cc1sc(CNC(=O)N(Cc2ccc([N+](=O)[O-])cc2)C(C)C)nc1-c1ccc(Cl)cc1 509446074 DPRVIDBAAIMCAK-UHFFFAOYSA-N 458.971 5.800 5 20 JKBD COc1ccc2[nH]cc(C3=CCN(C(=O)Nc4cc([N+](=O)[O-])ccc4OC(F)F)CC3)c2c1 510822375 VDIJFQLRGCSGOI-UHFFFAOYSA-N 458.421 5.007 5 20 JKBD CCc1nc(CCNC(=O)C/C(=C/c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)cs1 522543731 LQPUGVJLOYVVJG-LGMDPLHJSA-N 478.599 5.513 5 20 JKBD CC(=O)Nc1cccc([C@H](C)N(Cc2ccccc2)C(=O)c2ccc(N3CCCC3)c([N+](=O)[O-])c2)c1 591353012 CFTCVZZJUPEPLZ-FQEVSTJZSA-N 486.572 5.557 5 20 JKBD Cc1cc(C)n(CCCNC(=O)C/C(=C\c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)n1 603468596 PNVGGXLIWGWJDV-HMMYKYKNSA-N 475.574 5.155 5 20 JKBD O=[N+]([O-])c1ccc(-c2noc(CSc3nc(O)c4c(-c5ccc(F)cc5)csc4n3)n2)cc1 603748491 XLQBHHGEUYHNOL-UHFFFAOYSA-N 481.490 5.454 5 20 JKBD COc1ccccc1CN(C(=O)c1ccc(Sc2nc(C)cs2)c([N+](=O)[O-])c1)C1CC1 603986830 ROEVDCMCRRQXDK-UHFFFAOYSA-N 455.561 5.324 5 20 JKBD O=C(c1cc([N+](=O)[O-])ccc1Sc1ccccc1)N1CCC(c2n[nH]c(-c3ccccc3)n2)CC1 608960228 BCJLYAFAWPUGEW-UHFFFAOYSA-N 485.569 5.551 5 20 JKBD Cc1cccc(-c2nnc(S[C@@H](C)C(=O)Nc3nc(-c4cccc([N+](=O)[O-])c4)cs3)o2)c1 614785679 MFOUORMLBXGPKH-ZDUSSCGKSA-N 467.532 5.196 5 20 JKBD C[C@@H](OC(=O)c1cc(F)c(F)cc1[N+](=O)[O-])C(=O)N1c2ccccc2Sc2ccccc21 725936551 FXJJKHJFOZVFFH-GFCCVEGCSA-N 456.426 5.248 5 20 JKBD C[C@H](C(=O)OCC(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F)c1c(Cl)cccc1Cl 726029113 OEUWVBPRWMHQAJ-VIFPVBQESA-N 465.211 5.206 5 20 JKBD Cc1ccc(/C(O)=C(/C(=S)N[C@@H](C)c2ccc(Cl)cc2Cl)[n+]2ccccc2)cc1[N+](=O)[O-] 726571705 XEORMZIROOWEAY-HNNXBMFYSA-O 489.404 6.060 5 20 JKBD O=C(COC(=O)c1csc(-c2cccc([N+](=O)[O-])c2)n1)c1ccc2c(c1)Cc1ccccc1-2 747954601 BGDXVEYUURCSKO-UHFFFAOYSA-N 456.479 5.329 5 20 JKBD Cc1ccc(C(=O)OCC(=O)N2c3ccccc3Sc3ccc(Cl)cc32)cc1[N+](=O)[O-] 848944037 BTTXMNSQNGQXOK-UHFFFAOYSA-N 454.891 5.543 5 20 JKBD COc1ccccc1[C@@H](C)NC(=O)[C@H](C)Oc1ccc2c(-c3ccc([N+](=O)[O-])cc3)cc(=O)oc2c1 851960072 YUDBXCVJKNDSPI-SJORKVTESA-N 488.496 5.022 5 20 JKBD CC(C)(C)OC(=O)Nc1cccc(-c2noc(Cn3c4ccccc4c(=O)c4ccccc43)n2)c1 904631586 JCJFGNOQTNJQOF-UHFFFAOYSA-N 468.513 5.600 5 20 JKBD CC(C)N(Cc1nnc(-c2cccc([N+](=O)[O-])c2)o1)C(=O)c1cc2cc(Br)ccc2o1 915135861 XWUNPSYUPWSFLN-UHFFFAOYSA-N 485.294 5.204 5 20 JKBD O=C(Nc1ccccc1C(=O)Oc1ccc(NC(=O)C2CC2)cc1)c1ccc([N+](=O)[O-])cc1Cl 918601974 CVILENINWPNJQJ-UHFFFAOYSA-N 479.876 5.068 5 20 JKBD CCOc1ccc([C@@H](CNC(=O)c2cc([N+](=O)[O-])ccc2F)c2c[nH]c3ccccc23)cc1OC 919701657 OKUUMUSSMYYRGO-HXUWFJFHSA-N 477.492 5.184 5 20 JKBD CC(=O)N(c1ccc(C)cc1)c1nc(COC(=O)[C@H](C)Oc2ccc(Cl)cc2[N+](=O)[O-])cs1 920778133 KCIHCKHYWWQTHC-AWEZNQCLSA-N 489.937 5.208 5 20 JKBD Cc1cc(C(=O)Nc2ccc(C3(NC(=O)/C=C/c4ccccc4[N+](=O)[O-])CCC3)cc2)cnc1C 1787010920 AXQHBPCBKOUDOT-MDWZMJQESA-N 470.529 5.068 5 20 JKBD Cc1cc(C(=O)Nc2ccc(C3(NC(=O)c4cccc(F)c4[N+](=O)[O-])CCC3)cc2)c(C)o1 1787346400 XACWGNKATBZWPK-UHFFFAOYSA-N 451.454 5.005 5 20 JKBD O=C(NC1(c2ccc(NC(=O)C3(c4cccc([N+](=O)[O-])c4)CCC3)cc2)CCC1)[C@H]1CCC(F)(F)C1 1790477534 VMVOQWHVVLTJEH-SFHVURJKSA-N 497.542 5.586 5 20 JKBD Cc1c(C(=O)NC2(c3ccc(NC(=O)c4cc(O)cc([N+](=O)[O-])c4)cc3)CCC2)oc2ccccc12 1790756168 PUPDCQXFZKUALC-UHFFFAOYSA-N 485.496 5.417 5 20 JKBD O=C(NC1(c2ccc(NC(=O)c3nc4cc([N+](=O)[O-])ccc4[nH]3)cc2)CCC1)c1ccc2cc[nH]c2c1 1790825446 QZLWJTASDAUHMY-UHFFFAOYSA-N 494.511 5.014 5 20 JKBD CC(C)C1(C(=O)Nc2ccc(C3(NC(=O)c4nc5cc([N+](=O)[O-])ccc5[nH]4)CCC3)cc2)CCC1 1792047859 LOAPETOCKOEGGR-UHFFFAOYSA-N 475.549 5.045 5 20 JKBD O=C(/C=C/c1ccccc1[N+](=O)[O-])Nc1ccc(C2(NC(=O)c3cc4ccoc4cn3)CCC2)cc1 1792317489 WRXOQALJUNCTEC-IZZDOVSWSA-N 482.496 5.197 5 20 JKBD CC[C@H](C)[C@@H](C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)Cc1ccc(Cl)cc1[N+](=O)[O-])C2)c1ccccc1 1795568504 RECCKPURUAGHIR-QJHLOFPWSA-N 498.023 5.259 5 20 JKBD Cc1c(C(=O)N2CCC3(CCCN(C(=O)/C=C/c4ccsc4)C3)CC2)cc(Cl)cc1[N+](=O)[O-] 1807204194 PTJXKAPICWJGSC-ONEGZZNKSA-N 488.009 5.176 5 20 JKBD C/C=C/C=C\C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)CC1 1831363992 CECAOLHGCPXCMX-AXVWPGNMSA-N 467.591 5.175 5 20 JKBD Cc1csc(SCc2ccccc2C(=O)O[C@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)n1 9622396 UQWJTZHEJMZKNM-CYBMUJFWSA-N 491.978 5.489 5 20 JKBD O=C(Nc1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2Sc2ccc(Cl)cc2)cc1)c1ccco1 11361629 MTYCJYBIAIYFPL-UHFFFAOYSA-N 493.928 6.497 5 20 JKBD O=C(Nc1ccccc1OC(F)F)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 15993636 GEXJSFBVRYPAAW-UHFFFAOYSA-N 459.371 5.070 5 20 JKBD C[C@H](OC(=O)c1ccc(NCc2ccccc2Cl)c([N+](=O)[O-])c1)C(=O)Nc1cccnc1Cl 16868759 PDMIEZDGNGAPIC-ZDUSSCGKSA-N 489.315 5.093 5 20 JKBD CC(C)c1ccc(CSc2nnc(SCC(=O)Nc3cc([N+](=O)[O-])ccc3Cl)s2)cc1 25132884 POBYNUQNKCQAHY-UHFFFAOYSA-N 495.051 6.246 5 20 JKBD Cc1cc(NC(=O)c2ccco2)sc1C(=O)N(Cc1ccccc1[N+](=O)[O-])CC(F)(F)F 69643556 XXTRHESGGMCZPL-UHFFFAOYSA-N 467.425 5.015 5 20 JKBD CC(C)N(C)C(=O)c1ccc(Cl)c(NC(=O)c2cc([N+](=O)[O-])ccc2Oc2ccccc2)c1 72066657 BUSFCGPRUYULFA-UHFFFAOYSA-N 467.909 5.773 5 20 JKBD Cc1cc([N+](=O)[O-])ccc1C(=O)Nc1ccc(NC(=O)c2ccc(F)cc2)cc1C(F)(F)F 72068851 VLFJVIPACVMYCJ-UHFFFAOYSA-N 461.371 5.566 5 20 JKBD O=C([C@H]1C[C@H]1c1cccc(Br)c1)N(Cc1ccccc1[N+](=O)[O-])CC(F)(F)F 195747991 PFVPVTMVMPCTCI-HOTGVXAUSA-N 457.246 5.052 5 20 JKBD CCc1c(-c2ccncc2)n[nH]c1NC(=O)c1ccc(Sc2ccc(C)cc2)c([N+](=O)[O-])c1 303210495 QVFOUMDWZKLTHS-UHFFFAOYSA-N 459.531 5.654 5 20 JKBD O=C(C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)N1CC[C@@H]1c1ccccc1 478840337 ZRYABMJOHFCKQZ-VUHHOQONSA-N 455.539 6.109 5 20 JKBD CC(=O)Nc1nc2ccc(NC(=O)c3ccc(Sc4nc(C)cs4)c([N+](=O)[O-])c3)cc2s1 488540930 OWBIPRKNJYEAOQ-UHFFFAOYSA-N 485.572 5.331 5 20 JKBD O=C(Cc1ccccc1)Nc1cc(NC(=O)c2cc(OCC(F)(F)F)ccc2[N+](=O)[O-])ccc1F 502810432 VGNWNUVJCNLBHP-UHFFFAOYSA-N 491.397 5.109 5 20 JKBD CN1CCN(C(=O)C/C(=C\c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)c2ccccc2C1 504825332 IQVXQRLMVKWJFR-LTGZKZEYSA-N 484.581 5.614 5 20 JKBD COc1ccccc1N1CC[C@H](CNC(=O)c2cc([N+](=O)[O-])ccc2Sc2ccccc2)C1 504931849 AQHHEQRVJSHXBS-GOSISDBHSA-N 463.559 5.011 5 20 JKBD COc1ccccc1Oc1ccc(NC(=O)c2ccc(N[C@@H](C)c3ccccn3)c([N+](=O)[O-])c2)cc1 506073323 VTNGGGDEOBULLR-SFHVURJKSA-N 484.512 6.216 5 20 JKBD C[C@H](Nc1ccc(C(=O)Nc2ccc(C(=O)Nc3cccnc3)cc2)cc1[N+](=O)[O-])c1ccccn1 506194365 RLRXPJIYSULICI-KRWDZBQOSA-N 482.500 5.063 5 20 JKBD CC[C@@H](C)[C@@H](NC(=O)c1cc(OC)c(OCc2cscn2)cc1[N+](=O)[O-])c1nc2ccccc2[nH]1 512185140 ZRFOFHQYJCOTGT-JLCFBVMHSA-N 495.561 5.032 5 20 JKBD CS(=O)(=O)c1cc(C(=O)Nc2ccc(Oc3ccc(Cl)cc3Cl)c(F)c2)cc([N+](=O)[O-])c1 517900387 ZKUDUTZAHOSCBC-UHFFFAOYSA-N 499.303 5.489 5 20 JKBD Cc1cc(OCc2cccc(Cl)c2)ccc1NC(=O)c1cn(C)nc1-c1ccc([N+](=O)[O-])cc1 524392476 KYNGTLFEQCZUKH-UHFFFAOYSA-N 476.920 5.788 5 20 JKBD COCCN(C(=O)c1cc2c(s1)-c1ccccc1OC2)c1nc(-c2ccc([N+](=O)[O-])cc2)cs1 603461104 OUJBCVZCXVLMRC-UHFFFAOYSA-N 493.566 5.632 5 20 JKBD COCCN(C(=O)Cc1c(Cl)cccc1Cl)c1nc(-c2ccc([N+](=O)[O-])cc2)cs1 603461221 FXKUOTMYAVGWLY-UHFFFAOYSA-N 466.346 5.247 5 20 JKBD C[C@@H](c1ccccc1)n1c(S[C@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2)nnc1-c1ccccc1 603917408 PPRZFSJKCVJYHC-ZWKOTPCHSA-N 473.558 5.582 5 20 JKBD CSc1ccc([N+](=O)[O-])c(C(=O)Nc2nc(C)c(Cc3cccc(Br)c3)s2)c1 603975086 ICYFCHNIZBNZAJ-UHFFFAOYSA-N 478.393 5.687 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Cl)[C@H](NCc1ccc(OC2CCCC2)nc1)c1ccccc1 604046263 VHQWNMYQSSVDLS-XMMPIXPASA-N 480.952 5.434 5 20 JKBD CCOc1ccc(NC(=O)c2ccc(N[C@H](C)c3ccccn3)c([N+](=O)[O-])c2)cc1OCC 604295064 DXVVFWZDMBCIBF-MRXNPFEDSA-N 450.495 5.213 5 20 JKBD C[C@@H](Nc1ccc(C(=O)Nc2ccccc2SCC(F)(F)F)cc1[N+](=O)[O-])c1ccccn1 604300324 MUQUSVZGVSDDTN-CQSZACIVSA-N 476.480 6.070 5 20 JKBD Cn1cc([N+](=O)[O-])cc1C(=O)Nc1ccccc1OCc1ncc(-c2cccc(Cl)c2)o1 608850361 HXZHTTIZGGCTLN-UHFFFAOYSA-N 452.854 5.073 5 20 JKBD Cc1ccc(NC(=O)c2ccc(Oc3ccc(NC(=O)c4ccco4)cc3)c([N+](=O)[O-])c2)cc1 608971223 DCGBYJAWJMVDKE-UHFFFAOYSA-N 457.442 5.793 5 20 JKBD CCOc1cc(C(=O)Nc2ccc(OCc3cccc(C(F)(F)F)c3)cc2)c([N+](=O)[O-])cc1OC 609066197 MGRUHUJYLGUYIV-UHFFFAOYSA-N 490.434 5.852 5 20 JKBD C[C@@H](Nc1ccc(C(=O)Nc2cc(NC(=O)OC(C)(C)C)ccc2F)cc1[N+](=O)[O-])c1ccccn1 727390196 XMLOTQDJHCUEDC-OAHLLOKOSA-N 495.511 5.901 5 20 JKBD O=C(Nc1ccccc1C(=O)OCc1c(F)cccc1[N+](=O)[O-])c1ccccc1Br 728988665 UKZSIXAFEZTBRP-UHFFFAOYSA-N 473.254 5.106 5 20 JKBD O=C(Cn1c2ccccc2c(=O)c2ccccc21)Oc1ccccc1C(=O)NCCCc1ccccc1 729918856 KUZGEAPDOVZOEL-UHFFFAOYSA-N 490.559 5.123 5 20 JKBD C[C@@H](OC(=O)c1occc1CSc1ccccc1)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 792737630 UFNPYISZIMDHGX-CYBMUJFWSA-N 494.447 5.683 5 20 JKBD CSc1ccc(NC(=O)[C@@H](C)Oc2ccc3c(-c4ccc([N+](=O)[O-])cc4)cc(=O)oc3c2)cc1 851958917 KXBUCKNKOMYXBJ-OAHLLOKOSA-N 476.510 5.496 5 20 JKBD COc1cc(-c2nc(-c3ccc(-n4nc(C)cc4C)nc3)no2)c([N+](=O)[O-])cc1OCc1ccccc1 904517383 DWMHYGSBJCJQLJ-UHFFFAOYSA-N 498.499 5.097 5 20 JKBD CCOc1ccc(-c2nc(C(=O)Oc3ccc(NC(=O)c4cccc([N+](=O)[O-])c4)cc3)cs2)cc1 914753153 IKTLDWKHAOLSAH-UHFFFAOYSA-N 489.509 5.589 5 20 JKBD Cc1ccccc1CC(=O)O[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Br)c1ccccc1 916535299 RQVYOOBSXOROTK-QFIPXVFZSA-N 483.318 5.131 5 20 JKBD COc1ccc(N[C@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)cc1NC(=O)c1cccc(F)c1 917933199 CBFIGKCIUCVKHM-CYBMUJFWSA-N 486.887 5.087 5 20 JKBD Cc1nn(Cc2ccccc2)c(Cl)c1C(=O)N(Cc1ccccc1[N+](=O)[O-])CC(F)(F)F 918613944 VWHYJJJLAJQZJI-UHFFFAOYSA-N 466.847 5.006 5 20 JKBD Cc1ccc(NC(=O)c2ccccc2)cc1NC(=O)c1cc([N+](=O)[O-])ccc1N1CCC(C)CC1 918627769 QBIQMXSCWQBUKS-UHFFFAOYSA-N 472.545 5.644 5 20 JKBD COc1ccccc1Oc1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2N2CCCC2)cc1F 919894288 FWTVYRGRJBOQDV-UHFFFAOYSA-N 451.454 5.387 5 20 JKBD O=C(C[C@H]1CCCCO1)Nc1ccc(C2(NC(=O)c3cc4cc([N+](=O)[O-])ccc4s3)CCC2)cc1 1786647858 GITOFBJAVCEKEA-OAQYLSRUSA-N 493.585 5.516 5 20 JKBD Cc1ccc2oc(C(=O)Nc3ccc(C4(NC(=O)Cc5cccc([N+](=O)[O-])c5)CCC4)cc3)cc2n1 1788321076 LNBYEHZQDXXMCJ-UHFFFAOYSA-N 484.512 5.035 5 20 JKBD Cc1noc(C)c1CC(=O)NC1(c2ccc(NC(=O)c3cc(Cl)cc([N+](=O)[O-])c3C)cc2)CCC1 1790773670 FKJDSHKICFZCMX-UHFFFAOYSA-N 496.951 5.152 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)c3ccc([N+](=O)[O-])o3)CCC2)cc1)c1cnc2c(F)c(F)ccc2c1 1790964105 MEJPXLXATLCLBZ-UHFFFAOYSA-N 492.438 5.076 5 20 JKBD C[C@H]1CCC[C@@H]1C(=O)NC1(c2ccc(NC(=O)CSc3ccccc3[N+](=O)[O-])cc2)CCC1 1791522445 TVDKMPGBDFLHAP-PXNSSMCTSA-N 467.591 5.257 5 20 JKBD COc1cc(C(=O)Nc2ccc(C3(NC(=O)[C@@H]4C[C@H]4c4ccccc4)CCC3)cc2)ccc1[N+](=O)[O-] 1792165413 JTABKLBHDZCVFG-XZOQPEGZSA-N 485.540 5.155 5 20 JKBD O=C(CCCc1ccccc1F)N1CCC([C@H]2CCCCN2C(=O)c2ccc([N+](=O)[O-])cc2F)CC1 1830492309 BZEKONWZUVKYEY-RUZDIDTESA-N 499.558 5.129 5 20 JKBD O=C(c1ccc(C2CC2)cc1)N1CCC([C@@H]2CCCCN2C(=O)c2cc(F)cc([N+](=O)[O-])c2)CC1 1830617524 CZPHOIILBODVCV-VWLOTQADSA-N 479.552 5.158 5 20 JKBD Cc1ccc(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)Cc3cccc([N+](=O)[O-])c3)CC2)c(Cl)c1 1832605396 UNUQGFHAEPMAPD-XMMPIXPASA-N 483.996 5.033 5 20 JKBD C[C@@H](C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)c1cc2cc([N+](=O)[O-])ccc2s1)c1ccc(Cl)cc1 1847409809 SIQXFBRKSZQKBH-UAOJZALGSA-N 483.977 5.082 5 20 JKBD Cc1nn(Cc2ccc(C(=O)N3CCC[C@@H]3c3nc4ccccc4s3)cc2)c(C)c1[N+](=O)[O-] 15600566 NOZTVOJXWFIJJZ-HXUWFJFHSA-N 461.547 5.043 5 20 JKBD CCOc1ccc([C@H](CNC(=O)c2cccc([N+](=O)[O-])c2)c2c[nH]c3ccccc23)cc1OC 16176372 CECMNJCIALKZEY-NRFANRHFSA-N 459.502 5.045 5 20 JKBD O=C(CSc1cc(F)ccc1F)Nc1c(Br)cc([N+](=O)[O-])cc1Br 17948299 OWHBGEGDSYVSHE-UHFFFAOYSA-N 482.100 5.129 5 20 JKBD CC(C)N(Cc1nnc(-c2cccc([N+](=O)[O-])c2)o1)C(=S)Nc1ccc(SC(F)F)cc1 18142968 VISKIZMNOBFDEF-UHFFFAOYSA-N 479.534 5.567 5 20 JKBD C[C@H](OC(=O)c1ccc(Br)c([N+](=O)[O-])c1)C(=O)Nc1ccccc1Cc1ccccc1 22184107 YJOIVZGBJBJHNT-HNNXBMFYSA-N 483.318 5.132 5 20 JKBD C[C@@H](Sc1nc(-c2ccc(Cl)cc2)n[nH]1)C(=O)Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1 28807295 XEWJQPFOSYEZKM-LLVKDONJSA-N 486.966 5.276 5 20 JKBD CCOc1cc(C(=O)Nc2nc(Cc3ccccc3)c(-c3ccccc3)s2)c([N+](=O)[O-])cc1OC 107618687 DDNZONLTGDWNLG-UHFFFAOYSA-N 489.553 5.969 5 20 JKBD Cc1cc(NC(=O)c2cccc(F)c2)sc1C(=O)N(Cc1ccccc1[N+](=O)[O-])CC(F)(F)F 195695287 UKCRCRYRFFWCOW-UHFFFAOYSA-N 495.454 5.561 5 20 JKBD CN(CC(F)(F)F)C(=O)c1c2c(nc3ccccc13)/C(=C/c1ccc([N+](=O)[O-])cc1)CCC2 485319256 MIWJDGXOIRHSQY-DTQAZKPQSA-N 455.436 5.654 5 20 JKBD O=C(N[C@H](c1ccccc1)c1cccnc1)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1 485528587 DKTYNAQJFUIIPH-XMMPIXPASA-N 459.889 5.955 5 20 JKBD CC(C)CNC(=O)c1ccc(NC(=O)c2csc(-c3cccc([N+](=O)[O-])c3)n2)cc1Cl 496591675 JPOFJXJTHKCCOM-UHFFFAOYSA-N 458.927 5.010 5 20 JKBD COc1ccc([C@H]2CCN(C(=O)Cc3cn(-c4ccccc4)nc3-c3ccc([N+](=O)[O-])cc3)C2)cc1 504931885 BDEQUOOVQSVCJS-QFIPXVFZSA-N 482.540 5.015 5 20 JKBD Cc1nc(-c2ccccc2)sc1[C@H](C)NC(=O)c1ccc(N[C@@H](C)c2ccccn2)c([N+](=O)[O-])c1 507543274 ATDTZFIHUDHPDF-IRXDYDNUSA-N 487.585 6.086 5 20 JKBD C[C@@H](Nc1ccc(C(=O)Nc2ccccc2COc2ccccc2)cc1[N+](=O)[O-])c1ccccn1 509143441 ZDKGRYYUUSGUHO-LJQANCHMSA-N 468.513 5.994 5 20 JKBD Cc1nc(-c2ccccc2)sc1[C@H](C)NC(=O)c1ccc([N+](=O)[O-])cc1I 511646978 OHRZJDHVEMJJEC-NSHDSACASA-N 493.326 5.122 5 20 JKBD COc1cc(C(=O)N(C)[C@H](C)c2ccc(Cl)c(Cl)c2)c([N+](=O)[O-])cc1OCc1cscn1 512439659 VBWIIUKOJNYVGU-GFCCVEGCSA-N 496.372 5.779 5 20 JKBD O=C(Nc1cccc(NC(=O)c2cc(OCC(F)(F)F)ccc2[N+](=O)[O-])c1)c1cccs1 514561916 UQEACXBRBBPBAR-UHFFFAOYSA-N 465.409 5.102 5 20 JKBD O=C(NCCCc1c[nH]c2ccccc12)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 518590592 PLZMVSNOYCLZKJ-UHFFFAOYSA-N 474.483 5.060 5 20 JKBD CCOc1cc(NC(=O)c2ccccc2OCc2cn3cc(C)ccc3n2)c([N+](=O)[O-])cc1OCC 520925168 RAFWLQQPZQNSPQ-UHFFFAOYSA-N 490.516 5.180 5 20 JKBD O=C(NCCc1nc(-c2ccncc2)cs1)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1 580574520 YCFRVSMVIRSROR-UHFFFAOYSA-N 480.933 5.532 5 20 JKBD CCOc1cc(NC(=O)NCc2sc(-c3ccccc3)nc2C)c([N+](=O)[O-])cc1OCC 608994090 RKEQIOODSYESAN-UHFFFAOYSA-N 456.524 5.146 5 20 JKBD NC(=O)CCN(C(=O)C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)c1ccccc1 613342212 ZIODFPCKZUOOKX-MNDPQUGUSA-N 486.553 5.044 5 20 JKBD C[C@@H](NCc1ccc(Oc2ccccc2Cl)c([N+](=O)[O-])c1)c1cccc(NS(C)(=O)=O)c1 725848978 FMIMINVQGAEMCB-OAHLLOKOSA-N 475.954 5.263 5 20 JKBD O=C(OCc1csc(COc2ccc(Cl)cc2)n1)c1cc([N+](=O)[O-])ccc1Br 725985245 JEOSPVAHFDSENN-UHFFFAOYSA-N 483.727 5.403 5 20 JKBD O=C(c1cc([N+](=O)[O-])ccc1N1CCCCC1)N1CCO[C@@H](c2ccc(Cl)c(Cl)c2)C1 727395123 GXWOXAAZNIZGMG-OAQYLSRUSA-N 464.349 5.106 5 20 JKBD Cc1ccc(C(=O)Nc2cccc(C(F)(F)F)c2)cc1NC(=O)COc1ccc([N+](=O)[O-])c(F)c1 745775107 AQOFLZDICSMVKZ-UHFFFAOYSA-N 491.397 5.331 5 20 JKBD CC[C@H](C)c1ccccc1NC(=O)[C@H](C)OC(=O)c1csc(-c2ccc([N+](=O)[O-])cc2)n1 747958813 VRDAZTCZTOXLQP-GJZGRUSLSA-N 453.520 5.416 5 20 JKBD CCOc1cc([N+](=O)[O-])c(C(=O)Nc2ccccc2C(=O)Nc2cccc(Cl)c2)cc1OC 750717320 HGKQUVWCFIUIRO-UHFFFAOYSA-N 469.881 5.160 5 20 JKBD Cc1cc(NC(=O)c2cc(Cl)ccc2[N+](=O)[O-])n(-c2cc(C(F)(F)F)ccc2Cl)n1 790052172 DQYXBMYQCMQVNE-UHFFFAOYSA-N 459.211 5.667 5 20 JKBD COC(=O)c1occc1COC(=O)C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1 791524392 WIQQVFWWMLJMTK-SFQUDFHCSA-N 478.482 5.258 5 20 JKBD COc1ccc(-n2cnnc2S[C@@H](C(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)c2ccccc2)cc1 849186547 YRBCQRLHRRWPLL-OAQYLSRUSA-N 495.948 5.310 5 20 JKBD CS(=O)(=O)c1ccc(-c2noc(-c3ccc(Oc4ccc(Cl)cc4[N+](=O)[O-])cc3)n2)cc1 904544641 YGRNQGUOWACZHY-UHFFFAOYSA-N 471.878 5.161 5 20 JKBD O=C(C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)Nc1ccc(F)c(C(=O)O)c1 914729480 IICYGCHMEWDIJC-RVDMUPIBSA-N 477.473 5.611 5 20 JKBD Cc1ccc(C(C)C)c(O[C@H](C)C(=O)N(Cc2nnc(-c3cccc([N+](=O)[O-])c3)o2)C(C)C)c1 916370014 ZIHFCKLWIZTQRD-GOSISDBHSA-N 466.538 5.281 5 20 JKBD C[C@H](c1ccccc1)n1c(SCC(=O)Nc2cc(Cl)ccc2[N+](=O)[O-])nnc1-c1ccccc1 917254300 KBZUWMDXKRCBKS-MRXNPFEDSA-N 493.976 5.847 5 20 JKBD Cc1occc1C(=O)Nc1ccc(C2(NC(=O)c3c(F)ccc([N+](=O)[O-])c3C)CCC2)cc1 1787364578 OIDMKVLHNXJEOK-UHFFFAOYSA-N 451.454 5.005 5 20 JKBD CCc1cc(C(=O)Nc2ccc(C3(NC(=O)c4cc(F)cc([N+](=O)[O-])c4)CCC3)cc2)cc(C)n1 1788839821 MTTKGLDWNXFNSS-UHFFFAOYSA-N 476.508 5.061 5 20 JKBD O=C(/C=C/c1ccc([N+](=O)[O-])o1)NC1(c2ccc(NC(=O)c3cccc4cc[nH]c34)cc2)CCC1 1789090430 KNJSRBXXZOQDEO-PKNBQFBNSA-N 470.485 5.130 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)c3nc[nH]c3[N+](=O)[O-])CCC2)cc1)c1ccc(-c2ccccc2)c(F)c1 1790094623 LXMYOPLQJJJVHR-UHFFFAOYSA-N 499.502 5.186 5 20 JKBD Cc1ccc(C(=O)NC2(c3ccc(NC(=O)CSc4ccccc4[N+](=O)[O-])cc3)CCC2)o1 1791521346 KBGDPOCSZZMBSJ-UHFFFAOYSA-N 465.531 5.036 5 20 JKBD O=Cc1ccc(C(=O)NC2(c3ccc(NC(=O)CSc4ccccc4[N+](=O)[O-])cc3)CCC2)s1 1791522390 OSJATEFWUXKEJN-UHFFFAOYSA-N 495.582 5.009 5 20 JKBD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc2ccoc2s1)c1cc2cc([N+](=O)[O-])ccc2s1 1796585079 ZMEQDYSHQSJVCA-MUJYYYPQSA-N 481.555 5.183 5 20 JKBD CC(C)C1(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)Cc3ccc(Cl)cc3[N+](=O)[O-])n[nH]2)CCC1 1814845539 APWKFUFTFFVSGE-LJQANCHMSA-N 487.988 5.032 5 20 JKBD CC1(C)CCC(CC(=O)Nc2cc([C@H]3CCCCN3C(=O)Cc3cccc([N+](=O)[O-])c3)[nH]n2)CC1 1820976554 APPIKVMJGSUUOM-JOCHJYFZSA-N 481.597 5.159 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2ccccc2Cl)[nH]n1 1821287152 MYHMPYQOTMXOOP-IBGZPJMESA-N 485.903 5.039 5 20 JKBD Cc1c(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)[C@@H]3CCC(F)(F)C3)[nH]n2)cc(Cl)cc1[N+](=O)[O-] 1821290288 TZFLRNFIHVJGRV-DYVFJYSZSA-N 495.914 5.021 5 20 JKBD CC(C)C1(C(=O)Nc2cc([C@H]3CCCCN3C(=O)Cc3ccc(Cl)cc3[N+](=O)[O-])[nH]n2)CCC1 1823064012 ZQZFEDJDSDVIPD-LJQANCHMSA-N 487.988 5.032 5 20 JKBD O=C(c1cc2cc([N+](=O)[O-])ccc2s1)N1CCC([C@@H]2CCCCN2C(=O)CCC(F)(F)F)CC1 1826672374 BKVMGNHSNZCWIQ-SFHVURJKSA-N 497.539 5.385 5 20 JKBD O=C(CSc1nc(-c2ccccc2)c(-c2ccccc2)o1)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 8755676 MTKSQXHRJKNKTL-UHFFFAOYSA-N 499.470 6.666 5 20 JKBD CCCn1c(SCC(=O)Nc2cc([N+](=O)[O-])ccc2Cl)nnc1-c1ccc(Cl)cc1 9139802 QTOHWHPSIGKRJP-UHFFFAOYSA-N 466.350 5.301 5 20 JKBD CCN1C/C(=C/c2ccc(-c3cccc([N+](=O)[O-])c3)o2)c2nc3ccccc3c(C(=O)O)c2C1 13339757 QFLRBEZVMRIFGU-LGMDPLHJSA-N 455.470 5.477 5 20 JKBD C[C@@H](Sc1nnc(-c2ccc(F)cc2)n1C[C@H]1CCCO1)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 17715335 VHDQQYXXDWJFPK-AUUYWEPGSA-N 496.524 5.075 5 20 JKBD O=C(OCc1nnc(-c2ccc([N+](=O)[O-])cc2)o1)c1sc(-c2ccccc2)nc1-c1ccccc1 18802307 RUWBVTVGPCYFNW-UHFFFAOYSA-N 484.493 5.792 5 20 JKBD CCN(CC)C(=O)c1cccc(NC(=O)CSc2nc3ccccc3c3nc4ccccc4n23)c1 18951585 RIIFIUJTAWIQRW-UHFFFAOYSA-N 483.597 5.249 5 20 JKBD C[C@@H](Sc1nnc(-c2ccc(F)cc2)n1-c1ccccc1)C(=O)Nc1ccccc1[N+](=O)[O-] 21741816 HWDYMDGPDMFZQS-OAHLLOKOSA-N 463.494 5.101 5 20 JKBD O=C(Nc1ncc(Cc2cccc(Cl)c2Cl)s1)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1 26366394 SABJQQRNUSPRBA-UHFFFAOYSA-N 453.263 5.109 5 20 JKBD Cc1c(C(=O)Nc2ccc(NC(=O)c3ccccc3F)cc2C(F)(F)F)cccc1[N+](=O)[O-] 59253993 UTVUUBQMOMURPI-UHFFFAOYSA-N 461.371 5.566 5 20 JKBD Cc1ccc(NC(=O)[C@H](Sc2ccc(C(=O)N3CCCC3)cn2)c2ccccc2)c([N+](=O)[O-])c1 69547819 NLEOWNLRYSGVSO-HSZRJFAPSA-N 476.558 5.006 5 20 JKBD Cc1nc(NC(=O)c2ccc(N[C@H](C)c3ccccn3)c([N+](=O)[O-])c2)sc1Cc1ccc(F)cc1 108833683 XFIQLUAUQGLVRI-OAHLLOKOSA-N 491.548 5.910 5 20 JKBD O=C(CSc1ccc(C(F)(F)F)cc1[N+](=O)[O-])OCc1nc(-c2cccc(Cl)c2)no1 302630491 AQKKNCWBWJEKEJ-UHFFFAOYSA-N 473.816 5.153 5 20 JKBD O=C(Nc1cccc(OCc2cccc(F)c2)c1)c1ccc([N+](=O)[O-])cc1I 508972279 XNEZPKXQORUMOB-UHFFFAOYSA-N 492.244 5.170 5 20 JKBD O=C(C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)NC[C@H]1CCN(c2ccccc2)C1 512959084 SYDSRNYCVPRUDD-BCIXFCFJSA-N 498.608 5.778 5 20 JKBD CCOC(=O)c1sc(-c2cccc([N+](=O)[O-])c2)cc1NC(=O)c1cc2c(C)nn(C)c2s1 514908736 FTRDSHLKYBSIII-UHFFFAOYSA-N 470.532 5.009 5 20 JKBD O=C(N[C@@H]1CCN(CC(F)(F)F)C1)c1ccccc1Sc1ccc(C(F)(F)F)cc1[N+](=O)[O-] 519937980 PPDBDNUVGADQSE-CYBMUJFWSA-N 493.429 5.131 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Br)[C@@H](NCc1ccc(F)cc1F)c1ccccc1 521766606 AMOXOOSZJACKNN-FQEVSTJZSA-N 476.277 5.105 5 20 JKBD Cc1cc(C(=O)NC2CCCC2)ccc1NC(=O)c1cc([N+](=O)[O-])ccc1NCc1ccccc1 552694636 JTZRGPSRUWNMNT-UHFFFAOYSA-N 472.545 5.440 5 20 JKBD Cc1cc(N2CCCC2)ccc1NC(=O)C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1 602093673 NHNPNTZNXHWGOO-FXBPSFAMSA-N 498.608 6.683 5 20 JKBD CN(Cc1ccccc1[N+](=O)[O-])C(=O)NC[C@H](c1ccccc1Cl)c1c[nH]c2ccccc12 603746272 GULMMIUGXXZHIY-HXUWFJFHSA-N 462.937 5.703 5 20 JKBD COCCN(C(=O)Cc1csc2ccccc12)c1nc(-c2ccc([N+](=O)[O-])cc2)cs1 603750532 QZDLSELODCSMKW-UHFFFAOYSA-N 453.545 5.155 5 20 JKBD CCOc1ccc(N(C(=O)[C@H](C)Sc2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)cc1 603818785 UMNCUUZCAYZOHJ-INIZCTEOSA-N 479.583 6.449 5 20 JKBD Cc1sc(NC(=O)COc2ccc(Cl)c3cccnc23)nc1-c1cccc([N+](=O)[O-])c1 603998920 KUADUJFECIZWON-UHFFFAOYSA-N 454.895 5.246 5 20 JKBD O=C(Nc1ccnn1Cc1cccc(Cl)c1Cl)C1CCN(c2ccccc2[N+](=O)[O-])CC1 610435340 PBAIAWALHXOOOX-UHFFFAOYSA-N 474.348 5.002 5 20 JKBD O=C(OCc1nc(-c2cccc([N+](=O)[O-])c2)no1)c1csc(-c2cccc(C(F)(F)F)c2)n1 725995657 IQRCZVDYGHITLW-UHFFFAOYSA-N 476.392 5.144 5 20 JKBD C[C@@H](NC(=S)/C(=C(/O)c1ccc([N+](=O)[O-])cc1)[n+]1ccccc1)c1ccc(Cl)cc1Cl 726570055 IWVQYPVUBSQOLO-CQSZACIVSA-O 475.377 5.751 5 20 JKBD O=C(Nc1ccc(=O)n(Cc2ccc(Cl)c(Cl)c2)c1)c1cc(Cl)ccc1[N+](=O)[O-] 743695532 IBBXFTDNVCZJIL-UHFFFAOYSA-N 452.681 5.017 5 20 JKBD Cc1ccc(F)c(NC(=S)/C(=C(/O)c2ccc(C)c([N+](=O)[O-])c2)[n+]2ccc3c(c2)CCCC3)c1 744115737 HHEKSCVORUMVAI-UHFFFAOYSA-O 478.569 5.840 5 20 JKBD COc1ccc(Br)cc1[C@H]1CCCN1C(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1 750682322 CODCXJMNEXGRTM-OAHLLOKOSA-N 454.708 5.388 5 20 JKBD Cc1nnc(Sc2ccc(NC(=O)c3cc([N+](=O)[O-])ccc3N3CCCCC3)c(C)c2)s1 751198941 JIPOIHQNWCAIFF-UHFFFAOYSA-N 469.592 5.457 5 20 JKBD O=C(OCC(=O)N1c2ccccc2Sc2ccc(Cl)cc21)c1cc(Cl)ccc1[N+](=O)[O-] 754680042 HSZCGUJPPJCHKB-UHFFFAOYSA-N 475.309 5.888 5 20 JKBD C[C@H](Oc1ccc(Cl)cc1[N+](=O)[O-])c1nc(-c2ccc(OCc3cccnc3)cc2)no1 904466493 RXCNYLLURZJFAS-AWEZNQCLSA-N 452.854 5.412 5 20 JKBD COc1cc(C(=O)NC2(c3ccc(NC(=O)[C@@]4(C)CC=CCC4)cc3)CCC2)ccc1[N+](=O)[O-] 1791993614 FWTXHYUXQJQLAK-VWLOTQADSA-N 463.534 5.098 5 20 JKBD Cc1ccc(CCC(=O)NC2(c3ccc(NC(=O)/C=C/c4ccccc4[N+](=O)[O-])cc3)CCC2)nc1 1792315395 KLAWPRBBMCJFAF-OVCLIPMQSA-N 484.556 5.078 5 20 JKBD O=C(COC(=O)Cn1c2ccccc2c(=O)c2ccccc21)Nc1cc(Cl)c(Cl)cc1Cl 11276047 BBCCSRNYXITBDK-UHFFFAOYSA-N 489.742 5.297 5 20 JKBD Cc1ccc(-c2cnc(CCC(=O)O[C@H](C)C(=O)Nc3ccc([N+](=O)[O-])cc3C(F)(F)F)o2)cc1 11644864 DUSWZMFUIMMCES-CQSZACIVSA-N 491.422 5.080 5 20 JKBD CCN(CC(=O)Nc1c(Cl)cccc1Cl)C(=O)c1ccc(N2CCC(C)CC2)c([N+](=O)[O-])c1 12483563 GUZHTJRSHLBWOR-UHFFFAOYSA-N 493.391 5.239 5 20 JKBD CSc1ccc(C(=O)O[C@H](C)C(=O)Nc2ccc(Cl)cc2C(F)(F)F)cc1[N+](=O)[O-] 16913346 RTXTVLZPZARBEC-SECBINFHSA-N 462.833 5.173 5 20 JKBD Cc1c([C@H](C)NC(=O)C/C(=C/c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)cnn1C 25003933 KWVGDVVXRBQABU-BRYHAGSVSA-N 461.547 5.055 5 20 JKBD COc1ccc(C)cc1CC(=O)O[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1 26682632 ACNZSOFAGVLOAY-QHCPKHFHSA-N 468.893 5.031 5 20 JKBD O=C(CCCn1c(=O)oc2cc([N+](=O)[O-])ccc21)Nc1nc(-c2cc(Cl)sc2Cl)cs1 26793284 PWTKZABZZILEPE-UHFFFAOYSA-N 499.357 5.413 5 20 JKBD Cc1ccc(C(=O)Nc2cccc([N+](=O)[O-])c2)cc1NC(=O)c1ccc(Br)cc1 31809369 NENYHKDTJLAGNU-UHFFFAOYSA-N 454.280 5.170 5 20 JKBD C[C@H](Nc1ccc(C(=O)NC2CC2)cc1[N+](=O)[O-])c1ccc(NC(=O)c2ccc(F)cc2)cc1 59420563 SBCFUNVLYGCQQM-HNNXBMFYSA-N 462.481 5.052 5 20 JKBD COCCN(C(=O)c1cc(Cl)sc1Cl)c1nc(-c2ccc([N+](=O)[O-])cc2)cs1 483290274 CGQTYYXAEVBELS-UHFFFAOYSA-N 458.348 5.380 5 20 JKBD C[C@H](NC(=O)c1ccc(N2CCC[C@@H](C)C2)c([N+](=O)[O-])c1)c1nc2ccccc2n1C(F)F 491396867 QMTDDJVOOBHUFC-CABCVRRESA-N 457.481 5.067 5 20 JKBD CCOc1ccc(-c2csc(NC(=O)c3cc(OCC(F)(F)F)ccc3[N+](=O)[O-])n2)cc1 500275876 WWBGFHLPEZYSON-UHFFFAOYSA-N 467.425 5.310 5 20 JKBD COc1ccc2[nH]cc(C3CCN(C(=O)c4ccc(N5CCC[C@@H](C)C5)c([N+](=O)[O-])c4)CC3)c2c1 509078718 BIXDWLPUTCDURV-GOSISDBHSA-N 476.577 5.341 5 20 JKBD COc1cc(CNCc2coc(-c3cccs3)n2)c([N+](=O)[O-])cc1OCc1ccccc1 509583253 CMYFWWPPUVZKRE-UHFFFAOYSA-N 451.504 5.189 5 20 JKBD CCOc1ccc(Oc2cc(CNC(=O)N(Cc3ccc([N+](=O)[O-])cc3)C(C)C)ccn2)cc1 509753506 ZBFXUAQWUZVHFH-UHFFFAOYSA-N 464.522 5.301 5 20 JKBD CC1CCN(c2nnc(SCc3cc([N+](=O)[O-])ccc3OC(C)C)n2Cc2ccco2)CC1 511076495 XNDJGZGBEJJGTN-UHFFFAOYSA-N 471.583 5.143 5 20 JKBD COCCOc1ccccc1NC(=O)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])c(OC)c1 512143462 FPVVMBPZYLTDDF-UHFFFAOYSA-N 472.881 5.327 5 20 JKBD Cc1ccc(Sc2ccc(C(=O)Nc3ccccc3-n3ncc4c(O)ncnc43)cc2[N+](=O)[O-])cc1 512403505 BMNSLAHMTKRQLY-UHFFFAOYSA-N 498.524 5.141 5 20 JKBD COc1cc(C(=O)N(C)[C@@H](C)c2cccc(C(F)(F)F)c2)c([N+](=O)[O-])cc1OCc1cscn1 512404821 VFVXEMJQEXHYIW-ZDUSSCGKSA-N 495.479 5.491 5 20 JKBD COc1ccc(-c2csc(NC(=O)c3cc(OCC(F)(F)F)ccc3[N+](=O)[O-])n2)cc1Cl 514561593 LFMXQQWAMDNDQZ-UHFFFAOYSA-N 487.843 5.574 5 20 JKBD COCCOc1cc([N+](=O)[O-])c(C(=O)N[C@@H](c2ccc3c(c2)CCCC3)c2cccs2)cc1OC 514879337 CNYADGQIHSGZCJ-VWLOTQADSA-N 496.585 5.088 5 20 JKBD CCCC(=O)Nc1cccc(NC(=O)c2ccccc2C(=O)c2ccc(N(C)C)c([N+](=O)[O-])c2)c1C 516799625 QXCOVLFGXIBHOG-UHFFFAOYSA-N 488.544 5.191 5 20 JKBD COc1cc(C(=O)Nc2c(C(=O)c3ccco3)oc3ccccc23)c([N+](=O)[O-])cc1OC(F)F 585700689 MLGPZMYBCMQWJI-UHFFFAOYSA-N 472.356 5.027 5 20 JKBD Cc1ccc(Sc2ccc(C(=O)N(C)[C@@H](C)c3ccc(S(C)(=O)=O)cc3)cc2[N+](=O)[O-])cc1 603458816 BXHDAQLBCPIVRK-KRWDZBQOSA-N 484.599 5.291 5 20 JKBD CCOc1cc(C(=O)Nc2cc(-c3ccccc3Cl)sc2C(=O)OC)c([N+](=O)[O-])cc1OC 604007103 LEPBLUVJOVXXKO-UHFFFAOYSA-N 490.921 5.423 5 20 JKBD COCCN(C(=O)c1cc2c(Cl)cccc2s1)c1nc(-c2ccc([N+](=O)[O-])cc2)cs1 604231569 VYNBVYNHOSOQNJ-UHFFFAOYSA-N 473.963 5.880 5 20 JKBD COc1cc(CN[C@H](c2ccc3c(c2)OCCO3)C(C)C)ccc1OCc1ccc([N+](=O)[O-])cc1 604478223 YTJYFLBJZUDMQZ-MHZLTWQESA-N 478.545 5.441 5 20 JKBD COc1cc(C(=O)N2CCC[C@H]2c2ccc(O)cc2)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 604485680 RBEKXNKZSGDXKE-IBGZPJMESA-N 468.893 5.732 5 20 JKBD O=[N+]([O-])c1ccc(-c2nnc(CN3CCN([C@H](c4ccccc4)c4ccccc4Cl)CC3)o2)cc1 608856486 LVVOQCKGQUNQBI-RUZDIDTESA-N 489.963 5.205 5 20 JKBD Cn1cnnc1Sc1ccc(C(=O)N2CCCC[C@H]2c2ccccc2C(F)(F)F)cc1[N+](=O)[O-] 608945651 VINOLZXWKDDXHO-KRWDZBQOSA-N 491.495 5.261 5 20 JKBD Cc1ccc(NC(=O)[C@H](OC(=O)c2cc([N+](=O)[O-])ccc2Br)c2ccccc2)cc1 725984561 JTCREOXBCQAAAZ-HXUWFJFHSA-N 469.291 5.203 5 20 JKBD CNC(=O)c1ccc(COC(=O)C/C(=C\c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)cc1 731374691 YDEBVOIMBKSVFJ-XSFVSMFZSA-N 487.537 5.238 5 20 JKBD O=C(Nc1ccccc1C(=O)NCCc1nc2ccccc2s1)c1ccc([N+](=O)[O-])cc1Cl 744388379 QDYOXEXXFJAYSX-UHFFFAOYSA-N 480.933 5.083 5 20 JKBD O=C(Cn1c2ccccc2c(=O)c2ccccc21)OCc1ccc(OCc2cccs2)cc1 746468891 KNQVDMVPOIYRAA-UHFFFAOYSA-N 455.535 5.539 5 20 JKBD CCN(C(=O)c1ccc(NS(=O)(=O)c2ccc(C)c([N+](=O)[O-])c2)cc1)c1ccc(Cl)cc1 914761199 PAKUIWUKEIJIQY-UHFFFAOYSA-N 473.938 5.024 5 20 JKBD O=C(CCCc1nnc(-c2ccccc2)o1)Oc1ccc2c(-c3ccc([N+](=O)[O-])cc3)cc(=O)oc2c1 915275573 GHXPMOZKNSXBHU-UHFFFAOYSA-N 497.463 5.347 5 20 JKBD C[C@@H](OC(=O)c1cc2cc(Br)ccc2o1)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 915424666 VLXYQUWDBIGLPK-SNVBAGLBSA-N 458.224 5.072 5 20 JKBD Cc1oc(-c2cccs2)nc1COC(=O)c1ccc(N[C@H](C)c2ccccn2)c([N+](=O)[O-])c1 920546615 LLRHKACSGHEVHX-CQSZACIVSA-N 464.503 5.545 5 20 JKBD O=C(CCc1ncc(-c2ccccc2Br)o1)Oc1cc(Cl)ccc1[N+](=O)[O-] 921137218 VVBUVHKHAREGAX-UHFFFAOYSA-N 451.660 5.204 5 20 JKBD O=C(NC1(c2ccc(NC(=O)[C@H]3CCCCC3(F)F)cc2)CCC1)c1cc(F)cc([N+](=O)[O-])c1 1786465285 NTOGVFDBMUSXBT-HXUWFJFHSA-N 475.467 5.307 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)c3sc4ccccc4c3Cl)CCC2)cc1)c1n[nH]cc1[N+](=O)[O-] 1789689473 XJFHMOYUDPSKMK-UHFFFAOYSA-N 495.948 5.248 5 20 JKBD O=C(NC1(c2ccc(NC(=O)c3ccoc3Cl)cc2)CCC1)c1ccc([N+](=O)[O-])cc1F 1790206562 BINVYQNPULXVIX-UHFFFAOYSA-N 457.845 5.042 5 20 JKBD COc1c(Cl)cccc1C(=O)Nc1ccc(C2(NC(=O)c3cc(O)cc([N+](=O)[O-])c3)CCC2)cc1 1792146927 KJIVZLNLGYOWNT-UHFFFAOYSA-N 495.919 5.024 5 20 JKBD C[C@H](C(=O)Nc1cc([C@@H]2CCCCN2C(=O)/C=C/c2ccc([N+](=O)[O-])o2)[nH]n1)c1ccc(Cl)cc1 1814656532 XCNOGSGQTKOXHZ-YSWJYSBWSA-N 497.939 5.074 5 20 JKBD O=C(c1ccc2occc2c1)N1CCC([C@H]2CCCCN2C(=O)c2cc(F)cc([N+](=O)[O-])c2)CC1 1830618155 YVNWQENSXNTJEC-HSZRJFAPSA-N 479.508 5.027 5 20 JKBD O=c1c2ccccc2nc(SCc2cc([N+](=O)[O-])cc3c2OCOC3)n1Cc1ccc(Cl)cc1 8749962 ITGGCDLMJPPIKE-UHFFFAOYSA-N 495.944 5.165 5 20 JKBD COc1cc(C(=O)O[C@@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)ccc1OCc1ccccc1 9179904 WGEIIXFAIMOCCL-HNNXBMFYSA-N 484.892 5.020 5 20 JKBD O=C(Nc1ccc(NC(=O)c2ccco2)cc1)c1ccc(NCc2ccccc2)c([N+](=O)[O-])c1 10550620 CLGWYXHCYJDRJQ-UHFFFAOYSA-N 456.458 5.305 5 20 JKBD C[C@H](OC(=O)c1ccccc1C(=O)c1ccc(Cl)cc1)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 17483759 OLNXPSPBXWFLNK-AWEZNQCLSA-N 477.860 5.447 5 20 JKBD C[C@@H](Sc1nnc(-c2ccc(F)cc2)n1Cc1ccccc1)C(=O)Nc1ccc([N+](=O)[O-])cc1 23599669 YXSHZFBNTZBWHH-MRXNPFEDSA-N 477.521 5.160 5 20 JKBD Cc1cc(C(=O)N2CCCC[C@H]2C)ccc1NC(=O)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-] 109249775 OJZYFCCKRQCFSF-OAHLLOKOSA-N 479.455 5.111 5 20 JKBD O=C(C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1)N(Cc1ccccc1)C[C@@H]1CCCO1 115758428 YBGRSDPQHQXEAC-NRFANRHFSA-N 491.510 5.038 5 20 JKBD O=C(Nc1ccc(SCc2cccnc2)cc1)c1ccc([N+](=O)[O-])cc1I 303102480 IHMHWOZOUVHBMG-UHFFFAOYSA-N 491.310 5.139 5 20 JKBD C[C@H](Nc1ccc(C(=O)N(CCc2ccccn2)Cc2ccc(F)cc2)cc1[N+](=O)[O-])c1ccccn1 303148679 MFSGTRYHMDDFAI-FQEVSTJZSA-N 499.546 5.582 5 20 JKBD COc1ccc(Oc2ccc([N+](=O)[O-])cc2C(=O)NC[C@@H]2CCCO[C@H]2c2ccccc2)cc1 409581259 KBUNMIWVKZGDAQ-DFBJGRDBSA-N 462.502 5.293 5 20 JKBD CCCOc1ccccc1Oc1ncccc1CNC(=O)Nc1ccc([N+](=O)[O-])cc1Cl 409750865 DSYIESZUEPUNEP-UHFFFAOYSA-N 456.886 5.546 5 20 JKBD C[C@H](Cn1ccnc1)NC(=O)c1c2c(nc3ccccc13)/C(=C/c1ccc([N+](=O)[O-])cc1)CCC2 481312777 RXDRPENXRAKLIP-KETZHDHUSA-N 467.529 5.035 5 20 JKBD CCOc1cc(C(=O)N[C@H](C)c2ccc(OCc3ccc(F)cc3)cc2)c([N+](=O)[O-])cc1OC 485475292 XPXYOZACJQELFQ-MRXNPFEDSA-N 468.481 5.211 5 20 JKBD O=C(Nc1nc(-c2sccc2Br)cs1)C1CCN(c2ccccc2[N+](=O)[O-])CC1 488554449 MYZZIMPRZYJGAZ-UHFFFAOYSA-N 493.408 5.397 5 20 JKBD COc1cccc([C@H](CNC(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2c[nH]c3ccccc23)c1OC 503677059 RDBLXBSISSZQDI-IBGZPJMESA-N 494.935 5.700 5 20 JKBD O=C(Nc1cccc(NC(=O)c2c[nH]c3ccc([N+](=O)[O-])cc23)c1)c1cccc(C(F)(F)F)c1 505749168 BSGKUCKLUZITAJ-UHFFFAOYSA-N 468.391 5.600 5 20 JKBD COc1ccc2c(-c3ccccc3)c(C(=O)Nc3cc([N+](=O)[O-])ccc3OC(F)F)oc2c1 512345431 GTHWNOPRDSEITK-UHFFFAOYSA-N 454.385 5.870 5 20 JKBD COc1ccc([N+](=O)[O-])c(C(=O)N[C@@H](c2ccccc2)c2ccc3nc(C(F)(F)F)[nH]c3c2)c1 518617897 WDMZWHUXVXGKFS-FQEVSTJZSA-N 470.407 5.018 5 20 JKBD NC(=O)NCc1ccc(NC(=O)c2ccccc2Sc2ccc(C(F)(F)F)cc2[N+](=O)[O-])cc1 519178438 CYABZTKVIGZCKL-UHFFFAOYSA-N 490.463 5.185 5 20 JKBD CC(C)N(Cc1ccco1)C(=O)C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1 521745813 VNGVVWSVGPCEFC-RGEXLXHISA-N 461.543 6.165 5 20 JKBD O=C(NCCOCC(F)(F)F)c1ccccc1Sc1ccc(C(F)(F)F)cc1[N+](=O)[O-] 603455893 BXGQTVVJHGYLBK-UHFFFAOYSA-N 468.375 5.074 5 20 JKBD COc1ccc(NC(=O)c2cc([N+](=O)[O-])c(C)s2)cc1NC(=O)c1ccc(Cl)cc1F 603997677 DDJWWZNRFPUOCZ-UHFFFAOYSA-N 463.874 5.270 5 20 JKBD COc1ccc(CS(=O)(=O)C(c2ccc(Cl)cc2)c2ccc(Cl)cc2)cc1[N+](=O)[O-] 608784453 PZWMWKMSMZGDSO-UHFFFAOYSA-N 466.342 5.615 5 20 JKBD Cc1ccc(-c2nc(CCNC(=O)c3ccc(NCc4ccccc4)c([N+](=O)[O-])c3)co2)cc1 608817996 RIKWWHOLZLGHNQ-UHFFFAOYSA-N 456.502 5.143 5 20 JKBD COc1ccc(-c2ccc(CN[C@H](c3ccc(Cl)cc3)c3nccn3C)o2)c([N+](=O)[O-])c1 608835647 GLIDVAZRPJKMDJ-JOCHJYFZSA-N 452.898 5.130 5 20 JKBD Cc1nn(Cc2ccc(C(=O)Nc3cccc4c3CN(CCC(C)C)C4)cc2)c(C)c1[N+](=O)[O-] 609063384 DXYPCJPDAHMSFG-UHFFFAOYSA-N 461.566 5.070 5 20 JKBD O=[N+]([O-])c1cccc(/C(O)=C(/C(=S)Nc2ccc(Cl)nc2)[n+]2ccc3c(c2)CCCC3)c1 727159252 FBLRICDXSDPZIM-UHFFFAOYSA-O 467.958 5.133 5 20 JKBD Cc1csc(SCc2ccccc2C(=O)Nc2cc(-c3cccc([N+](=O)[O-])c3)[nH]n2)n1 729529045 KSAUPBWFZSYMQJ-UHFFFAOYSA-N 451.533 5.294 5 20 JKBD O=C(COC(=O)c1csc(-c2cccc([N+](=O)[O-])c2)n1)c1ccc(NC(=O)c2ccccc2)cc1 747961785 IQFUGFLAGRAMSG-UHFFFAOYSA-N 487.493 5.010 5 20 JKBD Cc1csc(SCc2ccccc2C(=O)OCC2CCN(c3ccc([N+](=O)[O-])cn3)CC2)n1 750428947 VQMPWGAHMCVCPS-UHFFFAOYSA-N 484.603 5.120 5 20 JKBD O=C(CC12C[C@H]3C[C@@H](CC(O)(C3)C1)C2)O[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1 750507771 JHRYURCYFITVAH-WXQJIMTASA-N 498.963 5.193 5 20 JKBD Cc1cccc2sc(C(=O)N(Cc3nnc(-c4cccc([N+](=O)[O-])c4)o3)C(C)C)c(Cl)c12 822760385 LLMZNGRFCGAOHD-UHFFFAOYSA-N 470.938 5.872 5 20 JKBD CCOc1cc([C@H](C[N+](=O)[O-])c2c[nH]c3ccccc23)ccc1OS(=O)(=O)Cc1ccc(F)cc1 824981339 SBGPHWIYXXFGAG-QFIPXVFZSA-N 498.532 5.023 5 20 JKBD CN(C(=O)c1ccccc1NC(=O)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-])C1CCCCC1 917805438 AWVZOLIJMSOSTE-UHFFFAOYSA-N 479.455 5.193 5 20 JKBD Cc1cc(NC(=O)c2ccccc2Cl)sc1C(=O)OCCOc1ccccc1[N+](=O)[O-] 919164218 UVYIFPPOVSKWBB-UHFFFAOYSA-N 460.895 5.106 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)c3ccc4cnccc4c3)CCC2)cc1)c1cc(F)cc([N+](=O)[O-])c1 1790696594 LSNLUKOUPFYKFL-UHFFFAOYSA-N 484.487 5.344 5 20 JKBD Cc1c(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2oc4ccccc4c2C)C3)cc(Cl)cc1[N+](=O)[O-] 1800711184 APHCIEJJAUDREY-BCDXTJNWSA-N 481.936 5.177 5 20 JKBD O=C(CC1CCCC1)NC[C@H]1CCN(C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)[C@@H]1c1cccnc1 1806196031 WPNXHNXTMUFICH-KBMIEXCESA-N 492.601 5.104 5 20 JKBD CC(C)c1ccc(C(=O)NC[C@H]2CCN(C(=O)/C=C/c3ccccc3[N+](=O)[O-])[C@H]2c2cccnc2)cc1 1811957352 MBABFESDBZRFOF-JGPWACIWSA-N 498.583 5.146 5 20 JKBD O=C(/C=C/c1ccccc1[N+](=O)[O-])Nc1cc([C@@H]2CCCCN2C(=O)c2ccc(Cl)cc2F)[nH]n1 1823501839 WUUIZICIRDWBDO-MAIVGLDJSA-N 497.914 5.130 5 20 JKBD O=C(Cn1ccc2ccc([N+](=O)[O-])cc21)N1CCC([C@H]2CCCCN2C(=O)CCC2CCCC2)CC1 1826264477 FPSWOZCQDQHANJ-RUZDIDTESA-N 494.636 5.140 5 20 JKBD Cc1c(Cl)ccc(C(=O)N2CCC([C@H]3CCCCN3C(=O)c3ccc([N+](=O)[O-])[nH]3)CC2)c1Cl 1829836242 VBTUTZHGBLJZFV-LJQANCHMSA-N 493.391 5.085 5 20 JKBD O=C(c1cccc(F)c1Cl)N1CCC([C@H]2CCCCN2C(=O)/C=C/c2ccccc2[N+](=O)[O-])CC1 1832903922 IOGVWZXWQCBEJM-VDZCTEQFSA-N 499.970 5.334 5 20 JKBD O=C([C@@H]1CCC[C@@H]2CCCC[C@H]21)N1CC2(CCCN2C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)C1 1845739029 FAXIXCMLUNMZIG-IOMROCGXSA-N 481.618 5.233 5 20 JKBD CC(=O)N(c1ccc(Cl)c(Cl)c1)c1nc(COC(=O)c2cccc(C)c2[N+](=O)[O-])cs1 9022244 HUUMRQWQGFCFSR-UHFFFAOYSA-N 480.329 5.708 5 20 JKBD Cc1ccc(-n2c(S[C@@H](C)C(=O)Nc3ccc([N+](=O)[O-])cc3Cl)nnc2-c2ccncc2)cc1 10730306 ZSOQNULSCDIBRL-HNNXBMFYSA-N 494.964 5.319 5 20 JKBD O=C(Cn1c2ccccc2c(=O)c2ccccc21)Nc1ccc(Br)c(C(F)(F)F)c1 11249376 VEXAIOCOVLPFES-UHFFFAOYSA-N 475.264 5.575 5 20 JKBD COCCN(C(=O)c1cc(Cl)ccc1Cl)c1nc(-c2ccc([N+](=O)[O-])cc2)cs1 14790559 PZOCPTTVBWAQGN-UHFFFAOYSA-N 452.319 5.318 5 20 JKBD COc1ccc(C)cc1NC(=O)C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1 15082298 ROKURWMLSLBLJF-JXAWBTAJSA-N 459.527 6.091 5 20 JKBD Cc1cccc(C)c1NC(=O)[C@H](C)OC(=O)c1ccccc1C(=O)c1ccc(Cl)c([N+](=O)[O-])c1 15710300 IWQCCTGNNHOWFV-INIZCTEOSA-N 480.904 5.280 5 20 JKBD CCOc1ccccc1NC(=O)[C@@H](C)OC(=O)c1ccc(Sc2nc(C)cs2)c([N+](=O)[O-])c1 16903621 YXYYHQGJFYAQDJ-CQSZACIVSA-N 487.559 5.094 5 20 JKBD COc1ccc(N2C(=O)CC[C@@H](C(=O)Nc3cc([N+](=O)[O-])ccc3C)[C@H]2c2ccccc2OC)cc1 19161040 JYQXVMGYHBIKCM-ATIYNZHBSA-N 489.528 5.043 5 20 JKBD O=c1c2ccccc2nc(SCc2cc([N+](=O)[O-])cc3c2OCOC3)n1CCCc1ccccc1 21372589 JIKKQZNVNZFLSP-UHFFFAOYSA-N 489.553 5.096 5 20 JKBD O=C(N[C@@H]1CCSc2ccccc21)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 21900311 DQYLHLWDNUGRIR-QGZVFWFLSA-N 465.497 5.183 5 20 JKBD C[C@H](Sc1nnc(-c2ccccc2)n1Cc1ccc2c(c1)OCO2)c1cccc([N+](=O)[O-])c1 22649831 PDGZCNQBTCBZFB-INIZCTEOSA-N 460.515 5.484 5 20 JKBD O=C(NC[C@H](c1cccs1)N1CCCC1)c1cc([N+](=O)[O-])ccc1Sc1ccccc1 32762754 MUPSMDKLBCIJSG-HXUWFJFHSA-N 453.589 5.374 5 20 JKBD CCN(CC)C(=O)c1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2Oc2ccc(OC)cc2)cc1 32830341 RTBXWRWMPNXRBH-UHFFFAOYSA-N 463.490 5.130 5 20 JKBD O=C(Nc1cccc(OCC(F)(F)F)c1)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 116965470 HVJKYXBDCDHOQU-UHFFFAOYSA-N 491.388 5.410 5 20 JKBD O=C(NCC1(c2cccc(C(F)(F)F)c2)CCOCC1)Nc1ccc([N+](=O)[O-])cc1Cl 303000069 MUOJTKVAOCPCGA-UHFFFAOYSA-N 457.836 5.137 5 20 JKBD O=C(Nc1cc([N+](=O)[O-])ccc1Nc1cccc(C(F)(F)F)c1)c1csc(-c2cnccn2)n1 476700152 OCXJHYZLWNHWPP-UHFFFAOYSA-N 486.435 5.523 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)Nc2cc3c(cc2Sc2ccccc2)OCCO3)cc1SC 483603498 CIALVDDJAGEEIT-UHFFFAOYSA-N 484.555 5.500 5 20 JKBD O=C(Nc1cccc(CN2CCCCC2=O)c1)c1cc([N+](=O)[O-])ccc1Sc1ccccc1 497339263 YOBQGBNJIKQIBU-UHFFFAOYSA-N 461.543 5.511 5 20 JKBD COC(=O)c1ccc(COc2ccc(/C=C(\c3ccncc3)c3ccc([N+](=O)[O-])cc3)cc2OC)o1 502202287 DHCAQNOGPPTKKW-HAHDFKILSA-N 486.480 5.546 5 20 JKBD O=C(CCCn1c(=O)oc2cc([N+](=O)[O-])ccc21)N(Cc1ccccc1C(F)(F)F)C1CCCC1 511956448 JPVNIGNOEGVMHW-UHFFFAOYSA-N 491.466 5.273 5 20 JKBD COc1cc(C(=O)Nc2ccccc2-c2cccs2)c([N+](=O)[O-])cc1OCc1cscn1 512295472 UELOAHJJHFTUKM-UHFFFAOYSA-N 467.528 5.620 5 20 JKBD CN(C[C@@H]1CCCOC1)C(=O)c1c2c(nc3ccccc13)/C(=C/c1cccc([N+](=O)[O-])c1)CCC2 518083086 KXJAVGJNWYBYNW-GDUPUGJQSA-N 471.557 5.519 5 20 JKBD CCOc1cc([N+](=O)[O-])c(C(=O)N[C@@H](Cc2ccccc2Cl)c2ccccc2)cc1OC 519876961 NYIJRTRYNRPARE-FQEVSTJZSA-N 454.910 5.369 5 20 JKBD O=C(Nc1ccc(NC(=O)c2ccc([N+](=O)[O-])s2)c(C(F)(F)F)c1)c1ccc(F)cc1 603743005 QVBBSTNNCYFPAW-UHFFFAOYSA-N 453.373 5.319 5 20 JKBD O=C(CSc1nnc(-c2ccc3ccccc3c2)o1)Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1 603946693 VTBMFQQIJAQFQR-UHFFFAOYSA-N 489.538 5.652 5 20 JKBD C[C@@H](Sc1nc(-c2cccs2)nc2ccccc12)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 612745202 QVJQRMUPFKBZAP-CYBMUJFWSA-N 461.528 6.170 5 20 JKBD CCc1ccc(Cl)c(CC)c1NC(=O)CCCOC(=O)c1cc([N+](=O)[O-])ccc1Br 725988429 SSZQZKSNKZHYRH-UHFFFAOYSA-N 497.773 5.711 5 20 JKBD O=C(CCC(=O)c1ccc2ccc3cccc4ccc1c2c34)Nc1ccccc1NC(=O)N1CCCC1 727754976 KLWRKKCTLWKLCF-UHFFFAOYSA-N 489.575 6.813 5 20 JKBD CC(C)[C@H](OC(=O)c1csc(-c2ccc([N+](=O)[O-])cc2)n1)C(=O)Nc1ccc2c(c1)CCC2 747958210 VVAWUENRWVEVCP-NRFANRHFSA-N 465.531 5.027 5 20 JKBD O=C(Nc1ccc(Cl)c(S(=O)(=O)Nc2ccccc2Cl)c1)c1cc(F)ccc1[N+](=O)[O-] 751282143 YOOAEAJMRIQNHH-UHFFFAOYSA-N 484.292 5.094 5 20 JKBD COC(=O)c1ccoc1COC(=O)C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1 817805703 WCXMXXHDUNEUOU-FOWTUZBSSA-N 478.482 5.258 5 20 JKBD Cc1csc(Sc2ccc([N+](=O)[O-])cc2C(=O)O[C@@H](C)C(=O)Nc2c(C)cccc2C(C)C)n1 849132290 ABJGMXKNLZULFI-INIZCTEOSA-N 499.614 6.127 5 20 JKBD CCC(CC)c1cc[n+](/C(C(=S)N[C@H]2C[C@H]3CC[C@H]2C3)=C(/O)c2ccc([N+](=O)[O-])cc2)cc1 912843154 JPTOXYWVOGMOSG-HYVJGQCMSA-O 466.627 5.775 5 20 JKBD CN(c1ccc(F)cc1)S(=O)(=O)c1ccc(Cl)c(C(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)c1 916697800 YQSZBXXNVKVSRJ-UHFFFAOYSA-N 498.319 5.118 5 20 JKBD CC(C)CNC(=O)c1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2N2CCC(C)CC2)cc1Cl 917795166 SFUQXPWQTXFYDQ-UHFFFAOYSA-N 472.973 5.123 5 20 JKBD COc1ccc(COC(=O)[C@H](C)SCc2ncc(-c3ccc(Cl)cc3)o2)cc1[N+](=O)[O-] 920670323 FGMPBNHLDJLAFI-ZDUSSCGKSA-N 462.911 5.277 5 20 JKBD Cc1cccc(-c2cnccc2C(=O)NC2(c3ccc(NC(=O)c4ccc([N+](=O)[O-])o4)cc3)CCC2)c1 1785748823 JVNIMHVNWFPYMQ-UHFFFAOYSA-N 496.523 5.620 5 20 JKBD O=C(/C=C/c1ccc([N+](=O)[O-])o1)Nc1ccc(C2(NC(=O)c3ccc4cnccc4c3)CCC2)cc1 1786207422 KVRAHYGIIZVJOC-CSKARUKUSA-N 482.496 5.197 5 20 JKBD COc1ccsc1C(=O)Nc1ccc(C2(NC(=O)CSc3ccccc3[N+](=O)[O-])CCC2)cc1 1789931573 AQJXWQMIIDHOLW-UHFFFAOYSA-N 497.598 5.205 5 20 JKBD Cc1c(C(=O)Nc2ccc(C3(NC(=O)CCc4ccccn4)CCC3)cc2)cc(Cl)cc1[N+](=O)[O-] 1790774760 ZFFPBIMQRDNVGM-UHFFFAOYSA-N 492.963 5.332 5 20 JKBD CN1CCCC[C@H]1C(=O)NC1(c2ccc(NC(=O)c3cc4cc([N+](=O)[O-])ccc4s3)cc2)CCC1 1791009964 FGUCHKFXKCOQSG-NRFANRHFSA-N 492.601 5.042 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)c3ccc([N+](=O)[O-])o3)CCC2)cc1)c1ccc(OCC2CC2)cc1 1792155220 FYQTTYBOXRSOPS-UHFFFAOYSA-N 475.501 5.038 5 20 JKBD Cc1c(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)c3ccc(F)cc3)n[nH]2)cc(Cl)cc1[N+](=O)[O-] 1820555595 CVEGFWXIKXDLCF-LJQANCHMSA-N 485.903 5.039 5 20 JKBD CC(C)c1ccc(C(=O)Nc2cc([C@H]3CCCCN3C(=O)c3cccc(F)c3[N+](=O)[O-])[nH]n2)cc1 1820591571 CTUKQUDDAUCVHO-OAQYLSRUSA-N 479.512 5.200 5 20 JKBD Cc1ccc([C@H](C)C(=O)N2CCC([C@@H]3CCCCN3C(=O)Cc3cc([N+](=O)[O-])ccc3F)CC2)cc1 1824950133 YZMKAMWCJGQXEV-FNZWTVRRSA-N 495.595 5.008 5 20 JKBD CC1=CC[C@H](C(=O)N2CCCC[C@@H]2C2CCN(C(=O)Cc3ccc(Cl)cc3[N+](=O)[O-])CC2)CC1 1828343606 IPKDVCXPKHJDAV-NZQKXSOJSA-N 488.028 5.157 5 20 JKBD Cc1cccc(C(=O)N2CCC([C@@H]3CCCCN3C(=O)c3cccc(F)c3[N+](=O)[O-])CC2)c1Cl 1830622749 NAGOBUNAUBKPQF-NRFANRHFSA-N 487.959 5.243 5 20 JKBD Cc1c(C(=O)N2CCCC[C@H]2C2CCN(C(=O)Cc3cccs3)CC2)cc(Cl)cc1[N+](=O)[O-] 1830735448 KTLNOUXCRACHEY-NRFANRHFSA-N 490.025 5.094 5 20 JKBD Cc1ccc([C@@H](C)C(=O)N2CCCC[C@@H]2C2CCN(C(=O)Cc3ccc([N+](=O)[O-])cc3F)CC2)cc1 1831531612 YEOSZVKRJGRUNB-FQRUVTKNSA-N 495.595 5.008 5 20 JKBD C[C@H]1CC[C@H](C(=O)N2CCCC[C@@H]2C2CCN(C(=O)Cc3ccc(Cl)cc3[N+](=O)[O-])CC2)CC1 1832368139 XSBYIKKAWJBKGL-KKLQWCBXSA-N 490.044 5.237 5 20 JKBD CC(=O)N(c1cccc(Cl)c1)c1nc(COC(=O)CSc2ccc([N+](=O)[O-])cc2)cs1 9352167 ZKRUAMDBOYOADM-UHFFFAOYSA-N 477.951 5.225 5 20 JKBD CSc1ccc(C(=O)OCc2csc(N(C(C)=O)c3ccc(C)cc3C)n2)cc1[N+](=O)[O-] 9620797 MHSKDGGACKJTEO-UHFFFAOYSA-N 471.560 5.432 5 20 JKBD Cc1ccc(C)c(NC(=O)[C@H](OC(=O)c2ccc(Br)c([N+](=O)[O-])c2)c2ccccc2)c1 9848892 PWHSETAQBBFZOI-OAQYLSRUSA-N 483.318 5.511 5 20 JKBD CCOc1cc(C(=O)Nc2ccc(-c3nc4ccc(C)cc4s3)cc2)c([N+](=O)[O-])cc1OC 15510873 CUXSZQOIWNOLJV-UHFFFAOYSA-N 463.515 5.840 5 20 JKBD Cc1ccc(NC(=O)[C@@H](Sc2nncn2-c2ccccc2F)c2ccccc2)c([N+](=O)[O-])c1 25031025 ZUZRTDWEUHBYDB-NRFANRHFSA-N 463.494 5.095 5 20 JKBD C[C@@H](OC(=O)CCC(=O)c1ccc2c(c1)CCCC2)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 25771183 ROTLGPYRVMXNSH-CQSZACIVSA-N 492.450 5.026 5 20 JKBD CS(=O)(=O)c1cccc(NC(=O)c2ccccc2Sc2ccc(C(F)(F)F)cc2[N+](=O)[O-])c1 25890480 VGVRLQAKYIVTRF-UHFFFAOYSA-N 496.488 5.421 5 20 JKBD Cc1cc(C(=O)Oc2ccc(NC(=O)c3cc([N+](=O)[O-])ccc3Cl)cc2)c2cnn(C(C)C)c2n1 25983492 OMEVSFONGXCYQW-UHFFFAOYSA-N 493.907 5.354 5 20 JKBD O=C(COC(=O)c1c2ccccc2cc2ccccc12)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 28810609 UHTCKRCHLILCCC-UHFFFAOYSA-N 468.387 5.716 5 20 JKBD Cc1nc(-c2ccc([C@H](C)NC(=O)Cn3c4ccccc4c(=O)c4ccccc43)cc2)cs1 30892972 RDTRFNLHKAWNAS-KRWDZBQOSA-N 453.567 5.464 5 20 JKBD COc1cc(CCNC(=O)c2ccccc2-c2ncc(-c3ccccc3F)o2)c([N+](=O)[O-])cc1OC 45948567 WKLWMMIMTOZIFP-UHFFFAOYSA-N 491.475 5.046 5 20 JKBD Cc1c(NC(=O)c2c3c(nc4ccccc24)CCN(Cc2ccccc2)C3)cccc1[N+](=O)[O-] 481374259 DQYQRGOQZXDDPB-UHFFFAOYSA-N 452.514 5.262 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)N2CCC(c3nc4cc(Cl)ccc4s3)CC2)cc1SC 482108413 VXDJYSAODLIIER-UHFFFAOYSA-N 477.995 5.608 5 20 JKBD Cc1ccc(S(C)(=O)=O)cc1C(=O)Nc1cc([N+](=O)[O-])ccc1Nc1cccc(C(F)(F)F)c1 483635900 PDIXVGGEBRBQHU-UHFFFAOYSA-N 493.463 5.321 5 20 JKBD O=C(COC(c1ccccc1)c1ccccc1)N(Cc1ccccc1[N+](=O)[O-])CC(F)(F)F 486136733 ULQYKWFURTZKDM-UHFFFAOYSA-N 458.436 5.292 5 20 JKBD COc1ccc([C@H]2CCN(C(=O)c3ccccc3C(=O)c3ccc(SC)c([N+](=O)[O-])c3)C2)cc1 504884536 BKQVZVUCDPDPCA-IBGZPJMESA-N 476.554 5.186 5 20 JKBD C[C@@H](Nc1ccc(C(=O)Nc2ccccc2CN(C)C2CCCCC2)cc1[N+](=O)[O-])c1ccccn1 506138672 TYJVVHBLDJPMSF-HXUWFJFHSA-N 487.604 6.180 5 20 JKBD O=C(Cc1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1)Nc1ccccc1Br 506639769 NWDYEBQTXYSLPX-UHFFFAOYSA-N 477.318 5.391 5 20 JKBD COCCOc1ccc(NC(=O)c2ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])c(OC)c2)cc1F 508775871 UZFYYFOCRVJLPY-UHFFFAOYSA-N 490.871 5.466 5 20 JKBD O=C(C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)N1CCC[C@@H]1c1cccnc1 515747576 RNQAFZHSPDINOE-HVQRGMKJSA-N 470.554 5.894 5 20 JKBD COc1cc(Cl)ccc1CN[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1 518619641 DBQLBRJSLNMIAG-NRFANRHFSA-N 460.317 5.380 5 20 JKBD Cc1csc(Sc2ccc(C(=O)N[C@@H](c3nc(-c4ccncc4)no3)C(C)C)cc2[N+](=O)[O-])n1 522507241 DNRJLBKGTOJVRR-GOSISDBHSA-N 496.574 5.083 5 20 JKBD O=C(Nc1ccc(F)cc1)C1CCN(C(=O)c2cc([N+](=O)[O-])ccc2Oc2ccccc2)CC1 523568667 BVCLUKYELWVUQW-UHFFFAOYSA-N 463.465 5.017 5 20 JKBD C[C@H]1CN(Cc2csc(NC(=O)c3cc([N+](=O)[O-])ccc3Sc3ccccc3)n2)C[C@@H](C)O1 590766916 AXYUKOCSVYCZDJ-IYBDPMFKSA-N 484.603 5.064 5 20 JKBD C[C@@H]1CCCCN1C(=O)c1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2Sc2ccccc2)cc1 603993140 OWXNKJMDKKCWGL-GOSISDBHSA-N 475.570 6.013 5 20 JKBD CS(=O)(=O)c1cc(C(=O)Nc2ccc(Oc3ccccc3C(F)(F)F)cc2)cc([N+](=O)[O-])c1 604456839 KLOXGQCEDVPFLA-UHFFFAOYSA-N 480.420 5.062 5 20 JKBD CC(C)c1nnc(COC(=O)C/C(=C\c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)o1 726996432 ZNYCLROMPJYNNU-LFIBNONCSA-N 464.503 5.385 5 20 JKBD O=C(O[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1)c1nccc2ccccc12 743200174 XYEVJAQGIYZTNJ-QFIPXVFZSA-N 461.861 5.333 5 20 JKBD O=C(COC(=O)c1csc(-c2cccc([N+](=O)[O-])c2)n1)Nc1cc(Cl)c(Cl)cc1Cl 747961647 HUTBNJWIYOXKMJ-UHFFFAOYSA-N 486.720 5.474 5 20 JKBD Cc1csc(Sc2ccc(C(=O)Nc3ccccc3C(=O)NCc3ccco3)cc2[N+](=O)[O-])n1 798123292 FRGHWPBPMJVJLR-UHFFFAOYSA-N 494.554 5.286 5 20 JKBD COc1cc(C(=O)O[C@H](C)c2nc(-c3cccnc3)no2)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 825130663 CTRNOAAJRLIWGH-CYBMUJFWSA-N 496.863 5.412 5 20 JKBD CC(=O)Nc1cccc([C@@H](C)N(Cc2ccccc2)C(=O)c2ccc(-n3ccnc3)c([N+](=O)[O-])c2)c1 841837609 DMLUXNVGGXXAPD-LJQANCHMSA-N 483.528 5.143 5 20 JKBD Cc1cc(C)c2c(c1)c(C)cc1nnc(SCC(=O)Nc3cc([N+](=O)[O-])ccc3Cl)n12 849209405 ZCAOIGIZUWBUNX-UHFFFAOYSA-N 455.927 5.100 5 20 JKBD CN(C)Cc1ccc(-c2noc(Cc3cn(-c4ccccc4)nc3-c3ccc([N+](=O)[O-])cc3)n2)cc1 904620500 HDDOUZRPGVMQGY-UHFFFAOYSA-N 480.528 5.150 5 20 JKBD Cc1c([N+](=O)[O-])cc(C(=O)Nc2sc3c(c2-c2nc4ccccc4[nH]2)CCCC3)cc1[N+](=O)[O-] 908184753 SHROSBNDKKGQLL-UHFFFAOYSA-N 477.502 5.547 5 20 JKBD CCc1ccccc1NC(=O)[C@H](C)OC(=O)c1cc([N+](=O)[O-])ccc1Oc1ccc(OC)cc1 915250740 XXYWDUBOBFQFSI-INIZCTEOSA-N 464.474 5.142 5 20 JKBD C[C@@H](OC(=O)c1csc(-c2ccc(Cl)cc2Cl)n1)C(=O)Nc1cccc([N+](=O)[O-])c1 921225983 XZENCZAMDKJGGP-SNVBAGLBSA-N 466.302 5.209 5 20 JKBD O=C(Cc1cccc([N+](=O)[O-])c1)Nc1ccc(C2(NC(=O)[C@@H]3C[C@@H]3c3ccccc3)CCC2)cc1 1785795407 NETGZKQEXJLCCV-JWQCQUIFSA-N 469.541 5.075 5 20 JKBD O=C(/C=C/c1cnccn1)NC1(c2ccc(NC(=O)c3cc4cc([N+](=O)[O-])ccc4s3)cc2)CCC1 1791009913 CVOFNVANXRUDPJ-RMKNXTFCSA-N 499.552 5.061 5 20 JKBD C[C@H](Cc1ccco1)C(=O)Nc1ccc(C2(NC(=O)CCc3cccc([N+](=O)[O-])c3)CCC2)cc1 1791909990 VNCOLLCURZVPML-LJQANCHMSA-N 475.545 5.133 5 20 JKBD O=C(CCc1ccccc1Cl)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc2cc([N+](=O)[O-])ccc2s1 1801207483 PAIXGSQXHYUFEX-REPLKXPHSA-N 498.004 5.348 5 20 JKBD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2ccsc2)[nH]n1)c1cc2cc([N+](=O)[O-])ccc2s1 1821610538 CPRXBIDCVYOGNZ-KRWDZBQOSA-N 481.559 5.214 5 20 JKBD O=C(c1cc2cc(F)ccc2s1)N1CCC([C@@H]2CCCCN2C(=O)c2ccc([N+](=O)[O-])o2)CC1 1823614594 OLYQEWXEIUISQO-SFHVURJKSA-N 485.537 5.089 5 20 JKBD CC(C)[C@H]1CC[C@H](C(=O)N2CCC([C@@H]3CCCCN3C(=O)Cc3cccc([N+](=O)[O-])c3)CC2)CC1 1823681726 VEYINXFLXGCUQQ-GVUKDKGQSA-N 483.653 5.219 5 20 JKBD O=C(c1ccoc1Cl)N1CCCC[C@H]1C1CCN(C(=O)C2(c3cccc([N+](=O)[O-])c3)CCC2)CC1 1829863171 SPZWGZOVIRISMT-QFIPXVFZSA-N 499.995 5.196 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)N1CCC([C@@H]2CCCCN2C(=O)[C@@H](C)c2cccs2)CC1 1832144940 DRCJBOFFCXHPIU-UWJYYQICSA-N 487.597 5.141 5 20 JKBD Cc1ccc(C(=O)N2CCC([C@@H]3CCCCN3C(=O)/C=C/c3ccccc3[N+](=O)[O-])CC2)c(F)c1F 1832903703 HYZFXQXJEBFVKD-YUAYGMJFSA-N 497.542 5.128 5 20 JKBD CC(C)Cn1c(SCC(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)nnc1-c1ccccc1F 8651396 MZVDCUNWGAQKDA-UHFFFAOYSA-N 463.922 5.033 5 20 JKBD Cc1nc(CSc2ccccc2C(=O)OCC(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)cs1 11595918 XAHFJNALDPYVTL-UHFFFAOYSA-N 477.951 5.101 5 20 JKBD NC(=O)c1ccc(SCC(=O)N(c2cccc(Cl)c2)c2nc3ccccc3s2)c([N+](=O)[O-])c1 14375278 SNUYPSWHSNVUDA-UHFFFAOYSA-N 498.973 5.414 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Cl)[C@H](NCc1ccc(CN2CCCCC2)cc1)c1ccccc1 15506451 QJGTVAWLBPZZGI-AREMUKBSSA-N 493.007 5.704 5 20 JKBD C[C@H](Sc1nnc(C2CC2)n1-c1ccccc1)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 21366372 AJRHGSBUABHTEA-LBPRGKRZSA-N 477.468 5.191 5 20 JKBD CCc1ccccc1NC(=O)[C@H](C)OC(=O)c1ccccc1C(=O)c1ccc(Cl)c([N+](=O)[O-])c1 22669878 XAJPWAZLRJXRGU-HNNXBMFYSA-N 480.904 5.226 5 20 JKBD Cc1cccc(-c2nnc(SCCC(=O)Nc3ccc([N+](=O)[O-])cc3C)n2Cc2ccco2)c1 26408973 ATTACZFLZZWUNP-UHFFFAOYSA-N 477.546 5.232 5 20 JKBD Cc1cc([N+](=O)[O-])ccc1NC(=O)CSc1nnc(-c2ccccc2Cl)n1Cc1ccccc1 39657668 ITSUMLALBXTQFA-UHFFFAOYSA-N 493.976 5.594 5 20 JKBD CCn1c([C@H](C)NC(=O)C2CCN(c3ccc(C(F)(F)F)cc3[N+](=O)[O-])CC2)nc2ccccc21 72045151 FVPMKGXETVIECV-HNNXBMFYSA-N 489.498 5.077 5 20 JKBD O=C(CCn1cc([N+](=O)[O-])cn1)N(Cc1ccc(F)cc1)c1nc(-c2ccccc2Cl)cs1 109393606 XYOAEWCMWKEGSJ-UHFFFAOYSA-N 485.928 5.331 5 20 JKBD CC(C)N(Cc1ccc(-c2ccc(F)cc2)s1)C(=O)c1ccc(-n2cncn2)c([N+](=O)[O-])c1 115770854 MTZRHIYXFJVBMM-UHFFFAOYSA-N 465.510 5.094 5 20 JKBD Cc1csc(Sc2ccc(C(=O)Nc3cc(NC(=O)C4CC4)ccc3C)cc2[N+](=O)[O-])n1 481923003 RJJOGRXVGSXQSS-UHFFFAOYSA-N 468.560 5.420 5 20 JKBD C[C@H](Sc1nc(-c2ccccc2)c(-c2ccccc2)[nH]1)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 501217822 MIXPRPJZLFMKKX-INIZCTEOSA-N 469.526 6.555 5 20 JKBD C[C@@H](Nc1ccc(C(=O)NCC(c2ccccc2)c2ccccc2)cc1[N+](=O)[O-])c1ccccn1 506022249 REQVAJDPDQXFOH-HXUWFJFHSA-N 466.541 5.725 5 20 JKBD COc1cc(C(=O)Nc2ccc(OC(F)F)c(Cl)c2)c([N+](=O)[O-])cc1OCc1cscn1 509884397 JDABJZGEMOUCTA-UHFFFAOYSA-N 485.852 5.146 5 20 JKBD COc1cc(C(=O)N(C)Cc2cc(Cl)cc(Cl)c2)c([N+](=O)[O-])cc1OCc1cscn1 509945148 RWIPYETVVNKLRI-UHFFFAOYSA-N 482.345 5.218 5 20 JKBD COc1cc(NC(=O)N(Cc2ccc([N+](=O)[O-])cc2)C(C)C)c(OC)cc1NC(=O)c1ccccc1 510031563 WOABQEQZCYAQJJ-UHFFFAOYSA-N 492.532 5.307 5 20 JKBD CN(C)C(=O)c1ccc(NC(=O)c2ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])cc2)cc1Cl 510139979 OCBZXVPITBUFEO-UHFFFAOYSA-N 474.300 5.648 5 20 JKBD CC(C)(C)Cc1noc2nc(C3CC3)cc(C(=O)Nc3cc([N+](=O)[O-])ccc3OC(F)F)c12 514567682 JPBHDTVZIQAEOR-UHFFFAOYSA-N 460.437 5.451 5 20 JKBD CC(=O)Nc1cccc([C@H](C)N(Cc2ccccc2)C(=O)c2ccn(-c3ccc([N+](=O)[O-])cc3)n2)c1 520021919 HTWKHJBZPRSFBN-IBGZPJMESA-N 483.528 5.143 5 20 JKBD O=C(CNC(=O)c1c(Cl)cccc1[N+](=O)[O-])Nc1ccc(Sc2ccccc2)c(Cl)c1 521722460 FXRYVPPFSJFIRM-UHFFFAOYSA-N 476.341 5.421 5 20 JKBD C[C@H]1CCCN(c2ccc(C(=O)Nc3ccc(NC(=O)C4CC4)cc3C(F)(F)F)cc2[N+](=O)[O-])C1 590873012 HOTAOSAZLNZZKM-AWEZNQCLSA-N 490.482 5.451 5 20 JKBD COCCOc1ccc(C(F)(F)F)cc1NC(=O)c1ccc(N2CCC[C@H](C)C2)c([N+](=O)[O-])c1 603444629 PEYFJEGJWPXZPU-HNNXBMFYSA-N 481.471 5.127 5 20 JKBD COc1cc([N+](=O)[O-])ccc1NC(=O)CN[C@H](c1ccccc1)c1ccc(Cl)c(Cl)c1 604011090 VQFDKESIIMJFSR-JOCHJYFZSA-N 460.317 5.228 5 20 JKBD O=C(Nc1cc(OCC(F)(F)F)cc(OCC(F)(F)F)c1)c1cc2cc([N+](=O)[O-])ccc2o1 604077405 PNXOVMPECJDXBO-UHFFFAOYSA-N 478.301 5.476 5 20 JKBD CCN(C[C@H]1CCOC1)C(=O)c1c2c(nc3ccccc13)/C(=C/c1ccc([N+](=O)[O-])cc1)CCC2 604431458 ODQLDQAQTBOCRR-DXAMHKDYSA-N 471.557 5.519 5 20 JKBD O=[N+]([O-])c1cc(CNc2cc(-c3cccs3)nn2CCO)ccc1Oc1ccc(F)cc1 608982729 PXYVYWUMNHXHQQ-UHFFFAOYSA-N 454.483 5.056 5 20 JKBD O=C(Nc1ccc(NC(=O)C2CC2)nc1)c1cc([N+](=O)[O-])ccc1Sc1ccc(Cl)cc1 609427158 GKTSOLAGXCQYDE-UHFFFAOYSA-N 468.922 5.395 5 20 JKBD CCn1cc(NC(=S)/C(=C(/O)c2ccc(C)c([N+](=O)[O-])c2)[n+]2ccc(C(C)(C)C)cc2)cn1 726178972 FFRLXAYIQJLYQW-UHFFFAOYSA-O 466.587 5.028 5 20 JKBD CN(Cc1cc([N+](=O)[O-])ccc1Cl)C(=O)c1cnn(-c2ncccc2Cl)c1C(F)(F)Cl 730960917 CGKXRQIIJVHPGJ-UHFFFAOYSA-N 490.681 5.043 5 20 JKBD C[C@@H](Oc1ccc(F)c(F)c1)C(=O)O[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1 744595989 DXEPQEINYPGRQZ-ASSNKEHSSA-N 490.846 5.217 5 20 JKBD C[C@@H](OC(=O)Cc1csc(-c2ccc(Cl)cc2Cl)n1)C(=O)Nc1ccc(F)c([N+](=O)[O-])c1 747257681 FLBROJYRLBOMNL-SNVBAGLBSA-N 498.319 5.277 5 20 JKBD O=C(O[C@@H](C(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1)c1ccccc1)c1csc(C2CC2)n1 747506948 OBBWKOORFAUTDO-GOSISDBHSA-N 457.895 5.119 5 20 JKBD CC(C)[C@@H](OC(=O)c1csc(-c2cccc([N+](=O)[O-])c2)n1)C(=O)Nc1cc(Cl)ccc1Cl 747960845 CUFFUDBGDDFALK-GOSISDBHSA-N 494.356 5.845 5 20 JKBD O=[N+]([O-])c1ccc(/C=C(/Cc2nc(Cn3cnc4ccccc43)no2)c2nc3ccccc3s2)cc1 904736445 BQJBVAUFSHJWDY-AQTBWJFISA-N 494.536 5.769 5 20 JKBD COc1ccccc1-c1cc(C(=O)Oc2ccc(NC(=O)c3cc([N+](=O)[O-])ccc3Cl)cc2)no1 914873355 MWIFOZSPGSYAKE-UHFFFAOYSA-N 493.859 5.383 5 20 JKBD O=C(OCc1nc(-c2ccc([N+](=O)[O-])cc2)no1)c1cnn(-c2cccc(C(F)(F)F)c2)c1C1CC1 919085820 PABFLUDDGYGUEF-UHFFFAOYSA-N 499.405 5.084 5 20 JKBD Cc1cc(C)c(C(=O)CCCC(=O)O[C@@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)c(C)c1 919454681 VMUWXISYZUUYEY-KRWDZBQOSA-N 451.479 5.227 5 20 JKBD C[C@@H](OC(=O)c1csc(-c2ccc(Cl)s2)n1)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl 920674680 DXDGRQVTWKBNJL-MRVPVSSYSA-N 472.331 5.271 5 20 JKBD Cc1ccc(-c2csc3nc(CSc4nc5ccc([N+](=O)[O-])cc5s4)nc(O)c23)s1 921249178 DBWITVGWOQMVGA-UHFFFAOYSA-N 472.598 6.244 5 20 JKBD Cc1occ(C(F)(F)F)c1C(=O)Nc1ccc(C2(NC(=O)c3ccc([N+](=O)[O-])o3)CCC2)cc1 1788786820 WEKQNCNJARGZEF-UHFFFAOYSA-N 477.395 5.170 5 20 JKBD O=C(CCCCn1cccc1)NC1(c2ccc(NC(=O)c3ccc([N+](=O)[O-])cc3F)cc2)CCC1 1790622284 QNOFVOVXAMXPGC-UHFFFAOYSA-N 478.524 5.154 5 20 JKBD O=C(Cc1ccc([N+](=O)[O-])cc1F)Nc1ccc(C2(NC(=O)c3cccc4cnccc34)CCC2)cc1 1791184180 RTVCEGKOMPORKG-UHFFFAOYSA-N 498.514 5.273 5 20 JKBD COc1cc(C(=O)Nc2ccc(C3(NC(=O)Cc4c[nH]c5ccccc45)CCC3)cc2)ccc1[N+](=O)[O-] 1792165490 CSGSYVBSGGCMAM-UHFFFAOYSA-N 498.539 5.075 5 20 JKBD CN(C)c1ccc([N+](=O)[O-])c(C(=O)NC2(c3ccc(NC(=O)[C@]4(F)CCCC=C4F)cc3)CCC2)c1 1792379286 IHWRDYKOOBQXSB-SANMLTNESA-N 498.530 5.154 5 20 JKBD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc2ccccc12)c1cc2cc([N+](=O)[O-])ccc2s1 1797300016 GRAHNFMDVMSIRT-ACDBMABISA-N 485.565 5.528 5 20 JKBD CC(C)(C)CCCCCC(=O)N1CC[C@@H](CNC(=O)c2cccc(F)c2[N+](=O)[O-])[C@H]1c1cccnc1 1811323503 PKTJXSCYFATDQP-GBXCKJPGSA-N 498.599 5.445 5 20 JKBD CC1=CC[C@@H](C(=O)Nc2cc([C@@H]3CCCCN3C(=O)c3cc4cc([N+](=O)[O-])ccc4s3)[nH]n2)CC1 1818809339 XTKIOBOWRJYYNM-UZLBHIALSA-N 493.589 5.585 5 20 JKBD Cc1c(Cl)cccc1C(=O)N1CCC([C@@H]2CCCCN2C(=O)Cc2cccc([N+](=O)[O-])c2)CC1 1823677415 ZTTSDKFRLJZMGV-DEOSSOPVSA-N 483.996 5.033 5 20 JKBD Cc1ccc(CC(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3sccc3Cl)CC2)cc1[N+](=O)[O-] 1830364405 AEKLPKIZEJLHAB-HXUWFJFHSA-N 490.025 5.094 5 20 JKBD C[C@H](CC(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cccc(F)c2[N+](=O)[O-])CC1)c1ccccc1 1830623450 VEPZITLCLZYRKH-DVECYGJZSA-N 481.568 5.161 5 20 JKBD C[C@H](C(=O)N1CCC([C@H]2CCCCN2C(=O)CSc2ccccc2[N+](=O)[O-])CC1)c1ccccc1 1831777095 CWPKWNTXTZLADN-NZQKXSOJSA-N 495.645 5.110 5 20 JKBD O=C(CSc1nnc(-c2ccccc2F)n1C1CC1)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 9639423 QJLDTEWDEZFYSE-UHFFFAOYSA-N 481.431 5.077 5 20 JKBD O=[N+]([O-])c1cc(S(=O)(=O)N(Cc2cc(-c3cccs3)on2)c2ccccc2)ccc1Cl 14261016 SIHHAAPZQYPYPY-UHFFFAOYSA-N 475.935 5.360 5 20 JKBD CCc1ccc(N(C(=O)Cn2c3ccccc3c(=O)c3ccccc32)c2nc3ccccc3s2)cc1 14729668 XPOQVMUPHXTEQM-UHFFFAOYSA-N 489.600 6.692 5 20 JKBD C[C@@H](OC(=O)c1cc([N+](=O)[O-])ccc1Cl)C(=O)Nc1ccc(Cl)cc1C(F)(F)F 15650861 FCAMXCUIQVEQQH-MRVPVSSYSA-N 451.184 5.104 5 20 JKBD Cc1ccc(NC(=O)[C@@H](C)Sc2nc3ccc([N+](=O)[O-])cc3s2)c(Br)c1 16054223 ROIPPGJWZCHYPO-SNVBAGLBSA-N 452.355 5.395 5 20 JKBD C[C@H](Sc1nnc(CN2CCCCC2)n1-c1ccccc1)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 17718321 KCTLRRULDDMVNP-KRWDZBQOSA-N 491.577 5.065 5 20 JKBD Cc1ccc(NC(=O)[C@H](C)OC(=O)c2ccccc2C(=O)c2ccc(Cl)c([N+](=O)[O-])c2)c(F)c1 22669870 IJKOCLKFNVLBMJ-AWEZNQCLSA-N 484.867 5.111 5 20 JKBD O=C(c1ccc(Sc2nc3ccccc3s2)c([N+](=O)[O-])c1)N1CCC[C@@H]1c1ccncc1 27270141 KWAANVHEFRZNSJ-GOSISDBHSA-N 462.556 5.728 5 20 JKBD O=[N+]([O-])c1cc2c(c(CSc3nnc(-c4ccc(F)cc4)n3Cc3ccccc3)c1)OCOC2 28799070 ZSAZPIRNIMUIAP-UHFFFAOYSA-N 478.505 5.200 5 20 JKBD CC(C)N1CCC(NC(=O)c2ccccc2Sc2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 497509676 WGLISHHCIMWTIW-UHFFFAOYSA-N 467.513 5.367 5 20 JKBD CCC[C@H](NC(=O)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])c(OC)c1)c1nnc2ccccn12 504698351 PJEXQHBULAGZDV-KRWDZBQOSA-N 495.923 5.363 5 20 JKBD O=C(C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1)N1CCO[C@@H](c2ccccc2Cl)C1 505155094 POBJUXTUKPJAAP-OAQYLSRUSA-N 497.901 5.084 5 20 JKBD O=C(Cn1c2ccccc2c(=O)c2ccccc21)N1CCC(c2nc3cc(Cl)ccc3o2)CC1 515576327 SFBPIEPUEMANND-UHFFFAOYSA-N 471.944 5.356 5 20 JKBD COc1ccc(-c2ccc(CN[C@@H](C)c3cnn(-c4ccc(F)cc4)c3C)o2)c([N+](=O)[O-])c1 518276758 NSRDRIWAFGHKSV-HNNXBMFYSA-N 450.470 5.347 5 20 JKBD COc1cc([C@@H](C)Nc2ccc(C(=O)c3nccn3C)cc2[N+](=O)[O-])ccc1OC1CCCC1 520869451 CPAOZNBZROWSEH-MRXNPFEDSA-N 464.522 5.062 5 20 JKBD COC(=O)c1ccccc1C(=O)c1ccc(NCc2csc(Br)c2)c([N+](=O)[O-])c1 521101555 PCQIXYBICDRREK-UHFFFAOYSA-N 475.320 5.049 5 20 JKBD Cc1cc(C(=O)N2CCCC[C@@H]2C)ccc1NC(=O)CSc1ccc(C(F)(F)F)cc1[N+](=O)[O-] 521378068 FMOLAJBBIYNJED-HNNXBMFYSA-N 495.523 5.667 5 20 JKBD Cc1cc(NC(=O)c2ccc(F)cc2Cl)sc1C(=O)Nc1cc(-c2cccc([N+](=O)[O-])c2)[nH]n1 522352080 OPYVWBVNHZDXSS-UHFFFAOYSA-N 499.911 5.652 5 20 JKBD C[C@@H](CNC(=O)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-])c1c(Cl)cccc1Cl 522396735 QXRGWLROPUTVIP-JTQLQIEISA-N 451.228 5.376 5 20 JKBD COc1ccc([N+](=O)[O-])c(C(=O)Nc2ccc3nc(NC(=O)c4ccc(C)s4)sc3c2)c1 523276742 ANGDYYJNLKKRNK-UHFFFAOYSA-N 468.516 5.088 5 20 JKBD CCOc1cc([N+](=O)[O-])c(C(=O)N[C@@H](C)c2ccc(OCc3cccc(C)c3)cc2)cc1OC 524097037 XADQYHGDWIJOKM-SFHVURJKSA-N 464.518 5.381 5 20 JKBD COc1cc(CNC[C@H]2CCCO[C@H]2c2ccccc2)ccc1OCc1ccc([N+](=O)[O-])cc1 524680558 GATUSBNBWTZRJG-KCWPFWIISA-N 462.546 5.440 5 20 JKBD CN(c1ccc(Oc2ccc([N+](=O)[O-])nc2)cc1)S(=O)(=O)c1ccc(Cl)c(C(F)(F)F)c1 579501260 TVCQJLYAFUFCCK-UHFFFAOYSA-N 487.843 5.279 5 20 JKBD Cc1ccc(C(=O)Nc2cc([N+](=O)[O-])ccc2OC(F)F)cc1NC(=O)c1ccccc1F 603637868 BUOPPDRBGMXTLN-UHFFFAOYSA-N 459.380 5.148 5 20 JKBD COc1cc2c(cc1OC)[C@@H](c1cccs1)N(C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)CC2 603646480 LRKCYGHWUFTTPP-NRFANRHFSA-N 473.938 5.507 5 20 JKBD COc1cc2c(cc1OC)[C@@H](c1ccccc1)N(C(=O)c1cc3cc([N+](=O)[O-])ccc3o1)CC2 603730468 FMXVSDATIXCMRK-RUZDIDTESA-N 458.470 5.146 5 20 JKBD Cc1ccc(S(=O)(=O)Nc2ccc(NC(=O)[C@H]3CCC[C@@H](C(F)(F)F)C3)cc2)cc1[N+](=O)[O-] 603780474 DKRSUFDWQCYFLZ-LSDHHAIUSA-N 485.484 5.011 5 20 JKBD CCCOCc1ccccc1CNC(=O)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 603927998 GGVZFXXAVYKILR-UHFFFAOYSA-N 479.499 5.073 5 20 JKBD CCOc1ccc(N(C(=O)CCOc2ccccc2[N+](=O)[O-])c2nc3ccccc3s2)cc1 603946439 GHQRQOHMPFLPLD-UHFFFAOYSA-N 463.515 5.737 5 20 JKBD COc1cc(C(=O)N(CCc2ccccc2)C2CCCC2)c([N+](=O)[O-])cc1OCc1cscn1 604387529 LTUUZZUDFQEYCR-UHFFFAOYSA-N 481.574 5.266 5 20 JKBD Cc1ccc(NC(=O)c2cccc(C(F)(F)F)c2)cc1NC(=O)c1ccc([N+](=O)[O-])cc1F 604449404 PFVSZLFMNKMNCB-UHFFFAOYSA-N 461.371 5.566 5 20 JKBD CCc1ccc(-c2cc(NC(=O)c3cc(OC)c(OC)cc3[N+](=O)[O-])n(-c3ccccc3)n2)cc1 604455707 BMGHBOGDMLGZST-UHFFFAOYSA-N 472.501 5.279 5 20 JKBD Cc1c(NC(=O)c2ccc(N3CCC(C)CC3)c([N+](=O)[O-])c2)cccc1OCC(F)(F)F 609022413 LIHIBJJAXFOGQQ-UHFFFAOYSA-N 451.445 5.333 5 20 JKBD COc1ccccc1-c1nnc(S[C@H](C(=O)Nc2ccc(C)cc2[N+](=O)[O-])c2ccccc2)n1C 619619713 PIGDGDDZLSQWRI-QFIPXVFZSA-N 489.557 5.179 5 20 JKBD Cc1cc(-c2noc([C@H](C)OC(=O)c3csc(-c4ccc([N+](=O)[O-])cc4)n3)n2)ccc1F 747953827 GJWVHJKPMUMVBI-LBPRGKRZSA-N 454.439 5.134 5 20 JKBD O=C(COC(=O)C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)NCc1cccs1 748579258 LTGXXMNTTYCPPU-SFQUDFHCSA-N 493.566 5.056 5 20 JKBD O=C(CSc1nnc(-c2ccccc2F)n1Cc1ccccc1)Nc1ccc(Cl)c([N+](=O)[O-])c1 771457510 MENYDOZINGOWKT-UHFFFAOYSA-N 497.939 5.425 5 20 JKBD C[C@@H](Nc1ccc(-c2nc([C@@H]3CCCN3C(=O)OC(C)(C)C)no2)cc1[N+](=O)[O-])c1ccccn1 904702383 XWDWRYJWNODIKN-BEFAXECRSA-N 480.525 5.285 5 20 JKBD Cc1cc(C(N)=O)ccc1NC(=O)C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1 915174180 FAUYNWFGZDRMGU-QGOAFFKASA-N 472.526 5.181 5 20 JKBD Cc1cc(NC(=O)c2ccccc2Cl)sc1C(=O)O[C@@H](C)C(=O)Nc1cccc([N+](=O)[O-])c1 915580114 JKZHVCNFKNPOSV-ZDUSSCGKSA-N 487.921 5.054 5 20 JKBD Cc1c(C(=O)Oc2ccc(NC(=O)c3cc([N+](=O)[O-])ccc3Cl)cc2)cnn1-c1ccc(F)cc1 916951064 HYSKNMHVAFGKBZ-UHFFFAOYSA-N 494.866 5.353 5 20 JKBD O=[N+]([O-])c1ccccc1CN(Cn1c(C2CC2)nn(-c2ccccc2)c1=S)CC(F)(F)F 917451035 RLEQQCDITCSQNR-UHFFFAOYSA-N 463.485 5.211 5 20 JKBD O=C(Nc1ccc(CN2CCOC2=O)cc1)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1 917789389 JGQQBLNRGUIWLY-UHFFFAOYSA-N 467.865 5.245 5 20 JKBD Cc1ccc(Cn2nc(C)c(C(=O)Nc3nc(-c4cccc([N+](=O)[O-])c4)c(C)s3)c2Cl)cc1 917790322 FQBADIVNJOPKBM-UHFFFAOYSA-N 481.965 5.794 5 20 JKBD O=C(OCC[C@H]1CCCCN1C(=O)c1csc(-c2cccs2)n1)c1cccc([N+](=O)[O-])c1 918635923 VILNIUAJRZHYKR-MRXNPFEDSA-N 471.560 5.022 5 20 JKBD C[C@@H](Nc1ccc(C(=O)OCC(=O)Nc2cccc3ccccc23)cc1[N+](=O)[O-])c1ccccn1 920546959 MGKGSPAWNUDQNN-QGZVFWFLSA-N 470.485 5.112 5 20 JKBD O=C(OCc1cc([N+](=O)[O-])cc2c1OCOC2)c1cccnc1Oc1ccc(Cl)cc1Cl 920911075 ANQBUVQKIZKKLH-UHFFFAOYSA-N 477.256 5.312 5 20 JKBD O=C(NC1(c2ccc(NC(=O)C3CCC(C(F)(F)F)CC3)cc2)CCC1)c1ccc([N+](=O)[O-])o1 1786592494 JJOPXDSSIWXBKF-UHFFFAOYSA-N 479.455 5.304 5 20 JKBD Cc1noc(C)c1CCC(=O)Nc1ccc(C2(NC(=O)c3c(F)ccc([N+](=O)[O-])c3C)CCC2)cc1 1786911903 GNLKHXJMJOEZRJ-UHFFFAOYSA-N 494.523 5.028 5 20 JKBD O=C(NC1(c2ccc(NC(=O)C3CCC3)cc2)CCC1)c1cc(F)cc([N+](=O)[O-])c1Br 1787607722 HMOSBESSKIPZHS-UHFFFAOYSA-N 490.329 5.044 5 20 JKBD O=C(/C=C/c1ccccc1[N+](=O)[O-])NC1(c2ccc(NC(=O)c3ccc4cnccc4c3)cc2)CCC1 1789014797 ONUZSZLHEPRCCE-MDWZMJQESA-N 492.535 5.604 5 20 JKBD COc1ccsc1C(=O)Nc1ccc(C2(NC(=O)/C=C/c3ccccc3[N+](=O)[O-])CCC2)cc1 1789932643 YFTJIAYNXRPJLM-KPKJPENVSA-N 477.542 5.126 5 20 JKBD Cc1c(C(=O)N2CCC3(CCCN(C(=O)CCc4ccsc4)C3)CC2)cc(Cl)cc1[N+](=O)[O-] 1810041910 USUIDBDCAFGZTP-UHFFFAOYSA-N 490.025 5.096 5 20 JKBD CC(C)c1ccc(C(=O)NC[C@@H]2CCN(C(=O)/C=C/c3ccccc3[N+](=O)[O-])[C@@H]2c2cccnc2)cc1 1811957348 MBABFESDBZRFOF-FAWGBHEOSA-N 498.583 5.146 5 20 JKBD O=C(Nc1cc([C@@H]2CCCCN2C(=O)/C=C/c2ccccc2[N+](=O)[O-])[nH]n1)c1ccc(Cl)s1 1816400848 LPDKIGXVZRRPMW-YRYLYKBFSA-N 485.953 5.052 5 20 JKBD Cc1ccc(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)c3ccc([N+](=O)[O-])cc3F)n[nH]2)c(Cl)c1 1821049940 AKFFTDPXDOIKDO-HXUWFJFHSA-N 485.903 5.039 5 20 JKBD C/C(=C\c1cccs1)C(=O)N1CCC([C@H]2CCCCN2C(=O)Cc2ccc(C)c([N+](=O)[O-])c2)CC1 1830361683 GAJRIFNQHDMNRG-ZOSFRFIDSA-N 495.645 5.230 5 20 JKBD CC1(C)CCC(CC(=O)N2CCC([C@H]3CCCCN3C(=O)c3cccc(F)c3[N+](=O)[O-])CC2)CC1 1830621273 KZINSKMOMWUHMJ-HSZRJFAPSA-N 487.616 5.574 5 20 JKBD CCCCC[C@@H](C)C(=O)N1CCC([C@H]2CCCCN2C(=O)CSc2ccccc2[N+](=O)[O-])CC1 1831777904 XTPWPXYHZKWFNJ-IFMALSPDSA-N 489.682 5.523 5 20 JKBD Cc1ccc(C(=O)N2CCC([C@H]3CCCCN3C(=O)CSc3ccccc3[N+](=O)[O-])CC2)cc1C 1831777933 YOWOKZIULQBCAC-HSZRJFAPSA-N 495.645 5.237 5 20 JKBD CC(=O)Nc1ccc(NC(=O)COC(=O)c2cc([N+](=O)[O-])ccc2Sc2ccc(Cl)cc2)cc1 9032297 VXXZFNAKNCZNJF-UHFFFAOYSA-N 499.932 5.153 5 20 JKBD Cc1nn(Cc2ccc(C(=O)Nc3ccnn3Cc3cccc(Cl)c3Cl)cc2)c(C)c1[N+](=O)[O-] 15239983 MWPMETUEBFCSMV-UHFFFAOYSA-N 499.358 5.260 5 20 JKBD CC(=O)N1C=Cc2ccccc2[C@@H]1CC(=O)O[C@@H](C(=O)Nc1ccc(C)cc1[N+](=O)[O-])c1ccccc1 18745583 RKLUUYKAVXEQDL-RPLLCQBOSA-N 499.523 5.090 5 20 JKBD CCOc1ccc([C@@H](C)NC(=O)c2ccccc2NC(=O)c2ccc([N+](=O)[O-])cc2Cl)cc1 25609854 WXROUTXWAFTIBB-OAHLLOKOSA-N 467.909 5.390 5 20 JKBD O=C(Nc1ccccc1)c1nnc(/C(Cl)=C/c2ccc(-c3ccccc3[N+](=O)[O-])s2)s1 45800013 RARFICXYXFOWGY-VBKFSLOCSA-N 468.947 6.164 5 20 JKBD C[C@@H](NC(=O)CSc1ccc(C(F)(F)F)cc1[N+](=O)[O-])c1ccc(OCc2cccnc2)cc1 46774414 ULKVTMRLDUWMPL-OAHLLOKOSA-N 491.491 5.557 5 20 JKBD CC(C)OC(=O)C[C@@H](NC(=O)c1[nH]c2ccc(Cl)cc2c1Cl)c1ccccc1[N+](=O)[O-] 108420413 BBANVVIEBPKQML-MRXNPFEDSA-N 464.305 5.196 5 20 JKBD COCCOc1cc([N+](=O)[O-])c(C(=O)Nc2ccc(F)cc2-c2ccc(Cl)cc2)cc1OC 485678334 OSRQRRUFHNOPQJ-UHFFFAOYSA-N 474.872 5.340 5 20 JKBD CC[C@H](C)C(=O)Nc1cccc(CNC(=O)CSc2ccc(C(F)(F)F)cc2[N+](=O)[O-])c1 500012206 JILCKXRKEKDMIJ-ZDUSSCGKSA-N 469.485 5.007 5 20 JKBD C[C@H]1Cc2cc([N+](=O)[O-])ccc2N1C(=O)[C@@H](C)SCc1ncc(-c2ccc(Cl)cc2)o1 504375723 AXOWVUYCMHICJQ-UONOGXRCSA-N 457.939 5.503 5 20 JKBD Cc1ccc(C(C)C)c(Oc2ccc(CNCc3cccnc3-n3cccn3)cc2[N+](=O)[O-])c1 509587704 SENPSGRNVVOMJR-UHFFFAOYSA-N 457.534 5.689 5 20 JKBD CCOc1cc(NC(=O)N2CCC(Oc3cc(C)ccc3C)CC2)c([N+](=O)[O-])cc1OCC 510416817 YAZVRLVEPYZHNF-UHFFFAOYSA-N 457.527 5.084 5 20 JKBD CN(Cc1cscn1)C(=O)c1c2c(nc3ccccc13)/C(=C\c1cccc([N+](=O)[O-])c1)CCC2 517900382 YICROYPKPJLLFN-PDGQHHTCSA-N 470.554 5.749 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Br)[C@@H](NC[C@H]1CCOc2ccccc21)c1ccccc1 519490722 OLJOBCNGTQNNGF-HXOBKFHXSA-N 496.361 5.193 5 20 JKBD Cc1csc(Sc2ccc(C(=O)N(Cc3ccccc3)Cc3cc[nH]n3)cc2[N+](=O)[O-])n1 520504257 MECTZSDNCIWXOM-UHFFFAOYSA-N 465.560 5.077 5 20 JKBD C[C@@H](C1CC1)n1nccc1NC(=O)C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1 602140959 RNRCEZARLPZLGB-UYPHOHSBSA-N 473.558 5.941 5 20 JKBD CCOc1cc(NC(=O)N2CCC[C@H](c3cc4ccccc4[nH]3)C2)c([N+](=O)[O-])cc1OCC 603827176 FKWIFKPJLBSODZ-KRWDZBQOSA-N 452.511 5.285 5 20 JKBD CN(C(=O)c1ccc(Sc2nc3ccccc3s2)c([N+](=O)[O-])c1)c1ccc(S(C)(=O)=O)cc1 604469973 NYSSJEUDCGVMFJ-UHFFFAOYSA-N 499.595 5.036 5 20 JKBD O=C(NCc1ccncc1)Nc1cccc(CNC(=O)c2cc([N+](=O)[O-])ccc2Oc2ccccc2)c1 608874578 PILIHTPAYXPRNL-UHFFFAOYSA-N 497.511 5.034 5 20 JKBD C[C@@H](Nc1ccc(C(=O)NC2(c3cccc(C(F)(F)F)c3)CC2)cc1[N+](=O)[O-])c1ccccn1 608948811 YSQKLXRMHRPOQR-OAHLLOKOSA-N 470.451 5.601 5 20 JKBD CCn1cnnc1-c1ccccc1NC(=O)c1ccc(Sc2ccc(C)cc2)c([N+](=O)[O-])c1 609164278 KSDJOTZUSDVFOC-UHFFFAOYSA-N 459.531 5.585 5 20 JKBD C[C@H]1CN(c2ccc(NC(=O)c3ccc(N4CCCC4)c([N+](=O)[O-])c3)cc2C(F)(F)F)C[C@H](C)O1 728010139 DUWVLNGSBKFLDY-HOTGVXAUSA-N 492.498 5.080 5 20 JKBD COc1cc(/C=C(/Cl)c2nc(=O)c3sc(-c4ccc(F)cc4)cc3[nH]2)cc([N+](=O)[O-])c1O 747139959 MHQOSUNYUCJQNL-AWNIVKPZSA-N 473.869 5.150 5 20 JKBD O=C(OCc1nc(-c2cccc(C(F)(F)F)c2)no1)c1csc(-c2ccc([N+](=O)[O-])cc2)n1 747957796 BLSNJFZNCPVGIS-UHFFFAOYSA-N 476.392 5.144 5 20 JKBD Cc1cc(C)c(NC(=O)[C@@H](C)OC(=O)c2csc(-c3cccc([N+](=O)[O-])c3)n2)c(Cl)c1 747961873 LRTKTRKBLLCVRI-CYBMUJFWSA-N 459.911 5.173 5 20 JKBD CC1CCN(c2ccc([N+](=O)[O-])cc2C(=O)N2CCC[C@H](c3nc(-c4ccc(F)cc4)no3)C2)CC1 750662452 LRATYVHKDMGASX-IBGZPJMESA-N 493.539 5.040 5 20 JKBD O=C(Cc1cccc(Br)c1)Oc1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2Cl)cc1 751052349 ADLGIYRJFVSXAV-UHFFFAOYSA-N 489.709 5.411 5 20 JKBD COc1ccc(C[C@@H](NC(=O)c2cc([N+](=O)[O-])ccc2Br)c2ccc(OC)cc2)cc1 751060456 BZGABCYETMNRLK-JOCHJYFZSA-N 485.334 5.088 5 20 JKBD CCCCCCn1c(Sc2ccc(S(C)(=O)=O)cc2[N+](=O)[O-])nnc1-c1c[nH]c2ccccc12 800055818 FIFXGXALDOLCDT-UHFFFAOYSA-N 499.618 5.470 5 20 JKBD C[C@@H](OC(=O)c1cc([N+](=O)[O-])ccc1N1CCCCC1)C(=O)Nc1cc(Cl)ccc1Cl 823248271 NOFRWWZXOOMTJU-CYBMUJFWSA-N 466.321 5.076 5 20 JKBD O=C(/C=C/c1ccc(-c2ccccc2Cl)s1)OCc1nnc(-c2ccc([N+](=O)[O-])cc2)o1 900048992 KLSFDOXKSIEERH-ZRDIBKRKSA-N 467.890 5.783 5 20 JKBD Cn1cc(-c2nc(-c3ccc(COc4ccccc4)cc3)no2)c(-c2ccc([N+](=O)[O-])cc2)n1 904446687 SCMFOMPFFRTXFT-UHFFFAOYSA-N 453.458 5.291 5 20 JKBD COc1ccc(Br)cc1-c1nc(COC(=O)CCOc2cccc([N+](=O)[O-])c2)cs1 915451183 UODZGJJVBSWXRP-UHFFFAOYSA-N 493.335 5.002 5 20 JKBD CC1=C(C(=O)Nc2ccccc2C(F)(F)F)[C@@H](c2ccc([N+](=O)[O-])cc2)NC(=O)N1CCC(C)C 916165666 HYRAXIICNNLXGT-OAQYLSRUSA-N 490.482 5.639 5 20 JKBD O=[N+]([O-])c1cc(/C=C(/Cl)c2nc(O)c3c(-c4ccccc4Cl)csc3n2)cs1 917142885 BTZGAOJMILHKIU-WLRTZDKTSA-N 450.328 6.424 5 20 JKBD CC(C)(C)OC(=O)Nc1ccc(C(F)(F)F)cc1NC(=O)c1ccc(-n2ccnc2)c([N+](=O)[O-])c1 918614738 JVYOPUWBZCESAF-UHFFFAOYSA-N 491.426 5.399 5 20 JKBD CC(=O)N(c1ccc(Cl)c(Cl)c1)c1nc(COC(=O)c2ccc([N+](=O)[O-])cc2F)cs1 919569326 UALVVLYCSQKDGO-UHFFFAOYSA-N 484.292 5.539 5 20 JKBD COc1ccc(-c2cnc(COC(=O)c3ccc(N[C@H](C)c4ccccn4)c([N+](=O)[O-])c3)o2)cc1 920896085 XCKGPWWZPVTEQQ-MRXNPFEDSA-N 474.473 5.184 5 20 JKBD CN(C)c1ccc([N+](=O)[O-])c(C(=O)NC2(c3ccc(NC(=O)CCc4ccsc4)cc3)CCC2)c1 1788186148 FFBPTKXEMYSLOA-UHFFFAOYSA-N 492.601 5.103 5 20 JKBD Cc1ccc(C(=O)NC2(c3ccc(NC(=O)c4cc(Br)ccc4[N+](=O)[O-])cc3)CCC2)o1 1790663599 DMXOCXXWSZRBIV-UHFFFAOYSA-N 498.333 5.320 5 20 JKBD Cc1ccc2cc(C(=O)NC3(c4ccc(NC(=O)c5cc(O)cc([N+](=O)[O-])c5)cc4)CCC3)ccc2n1 1790755911 CLKZCQBDHXKKCD-UHFFFAOYSA-N 496.523 5.219 5 20 JKBD C[C@H]1CC[C@H](C(=O)N2CCC([C@H]3CCCCN3C(=O)Cc3ccc(Cl)cc3[N+](=O)[O-])CC2)CC1 1824157715 BLMVNJCZWASVTM-KKLQWCBXSA-N 490.044 5.237 5 20 JKBD Cc1ccc([C@H](C)C(=O)N2CCC([C@H]3CCCCN3C(=O)Cc3cc([N+](=O)[O-])ccc3F)CC2)cc1 1824950137 YZMKAMWCJGQXEV-RXFWQSSRSA-N 495.595 5.008 5 20 JKBD O=C(c1cccc(F)c1[N+](=O)[O-])N1CCC([C@H]2CCCCN2C(=O)/C=C/C2CCCCC2)CC1 1830355289 BXZXFLMUDQRMHS-MDRMPYQZSA-N 471.573 5.104 5 20 JKBD O=C(c1ccc2occc2c1)N1CCC([C@@H]2CCCCN2C(=O)c2ccc([N+](=O)[O-])cc2F)CC1 1830497033 WCDSFIVADMOBRP-QHCPKHFHSA-N 479.508 5.027 5 20 JKBD Cc1csc(Sc2ccc(C(=O)Nc3nc(-c4ccccn4)cs3)cc2[N+](=O)[O-])n1 9656871 ZIRZHGIGUUVRFY-UHFFFAOYSA-N 455.546 5.282 5 20 JKBD Cc1ccc(Cn2c(S[C@H](C)c3nnc(-c4ccc([N+](=O)[O-])cc4)o3)nc3ccccc3c2=O)cc1 17671673 PHXTZJKRSCBSLS-QGZVFWFLSA-N 499.552 5.565 5 20 JKBD Cc1ccc(NC(=O)[C@H](OC(=O)Cc2csc(-c3cccs3)n2)c2ccccc2)c([N+](=O)[O-])c1 17935256 KVFUQUJEMZJPII-JOCHJYFZSA-N 493.566 5.554 5 20 JKBD COc1cc(/C=C(\Cl)c2nc3scc(-c4ccccc4Cl)c3c(=O)[nH]2)cc([N+](=O)[O-])c1O 18064806 APXRNJPTPQOPJN-NSIKDUERSA-N 490.324 5.664 5 20 JKBD O=C(CSc1nnc(-c2ccccc2Cl)n1C1CCCC1)N1CCc2ccc([N+](=O)[O-])cc21 21722851 BFWQJRHZZKWSIP-UHFFFAOYSA-N 483.981 5.303 5 20 JKBD COc1cc(CN(C)C(=O)[C@@H](C)Sc2ccc([N+](=O)[O-])cc2)ccc1OCc1ccccc1 25280980 WQUFIEQOTNPYSL-GOSISDBHSA-N 466.559 5.322 5 20 JKBD Cc1cc(Oc2ncccn2)ccc1NC(=O)c1ccc(N[C@@H](C)c2ccccn2)c([N+](=O)[O-])c1 109182601 XBYSZZNKCAMCRP-KRWDZBQOSA-N 470.489 5.306 5 20 JKBD COC1CCN(c2ccc(NC(=O)c3cc4ccccc4c4cccnc34)cc2C(F)(F)F)CC1 303180420 KPGARVNCNOOUAE-UHFFFAOYSA-N 479.502 6.274 5 20 JKBD Cc1c(NC(=O)c2ccccc2)cccc1NC(=O)c1ccc(N[C@@H](C)c2ccccn2)c([N+](=O)[O-])c1 409913947 ZLZOZTOAFCHOHF-IBGZPJMESA-N 495.539 5.976 5 20 JKBD O=C(Nc1ccccc1C(=O)N1CC[C@H](c2ccccc2F)C1)c1ccc([N+](=O)[O-])cc1Cl 500104558 PBKCRIAFQGLEOI-HNNXBMFYSA-N 467.884 5.269 5 20 JKBD CC[C@H](c1ccc(F)cc1)N(Cc1cccc(F)c1)C(=O)c1ccc(-n2cncn2)c([N+](=O)[O-])c1 512311218 XTIOBBXYUZYXGR-JOCHJYFZSA-N 477.471 5.247 5 20 JKBD Cc1nn(C)c(C(=O)NC[C@H](c2ccccc2)c2c(-c3ccccc3)[nH]c3ccccc23)c1[N+](=O)[O-] 512395651 YTFJPUZAYCNSNR-JOCHJYFZSA-N 479.540 5.347 5 20 JKBD COc1ccc(-c2[nH]c3ccccc3c2CCC(=O)NCc2ccccc2[N+](=O)[O-])c(OC)c1 512783831 RYYCWBLCSDTTNK-UHFFFAOYSA-N 459.502 5.009 5 20 JKBD Cc1csc(-c2ccc(NC(=O)N[C@@H](CC(=O)OC(C)C)c3ccccc3[N+](=O)[O-])cc2)n1 513965993 JMLZZTHJQMWEOZ-IBGZPJMESA-N 468.535 5.231 5 20 JKBD COCCN(C(=O)c1ccc(N2CCCC2)c([N+](=O)[O-])c1)[C@H](C)c1cccc(C(F)(F)F)c1 514534836 HUCSWIHCNXPWGW-MRXNPFEDSA-N 465.472 5.064 5 20 JKBD O=C(C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)N[C@H](c1cccs1)C1CC1 515008691 IFXKMIRZABWUAX-QUWQGLEASA-N 475.595 6.464 5 20 JKBD O=C(Nc1cccc(CNc2ccc(S(=O)(=O)Nc3ccccc3)cc2[N+](=O)[O-])c1)C1CCCC1 515550712 CURKWJQGXKPETF-UHFFFAOYSA-N 494.573 5.136 5 20 JKBD Cn1c([C@H]2CCCCN2C(=O)CSc2ccc(C(F)(F)F)cc2[N+](=O)[O-])nc2ccccc21 515583399 KQYJRPHZTPFIRW-QGZVFWFLSA-N 478.496 5.346 5 20 JKBD COc1cc(C(=O)Nc2sc(C)nc2-c2ccccc2)c([N+](=O)[O-])cc1OCc1cscn1 524379069 PXSHSTOWEFYPQP-UHFFFAOYSA-N 482.543 5.323 5 20 JKBD O=C(Cn1c2ccccc2c(=O)c2ccccc21)N(Cc1ccc2c(c1)CCO2)C1CCCC1 590246900 ALKPMDIARYYYRM-UHFFFAOYSA-N 452.554 5.061 5 20 JKBD Cc1cccc(C(=O)Nc2ccc(Cl)c(S(=O)(=O)Nc3ccccc3Cl)c2)c1[N+](=O)[O-] 591642044 WKSKLLUEESEWHE-UHFFFAOYSA-N 480.329 5.263 5 20 JKBD CN(Cc1nccn1C)C(=O)c1c2c(nc3ccccc13)/C(=C\c1cccc([N+](=O)[O-])c1)CCC2 600832340 XBJMCCCBDICXRX-CYVLTUHYSA-N 467.529 5.026 5 20 JKBD CC(C)Cc1ccc(C(=O)C2CCN(C(=O)c3cc(OCC(F)(F)F)ccc3[N+](=O)[O-])CC2)cc1 603897672 YLTYXNHMINWQDV-UHFFFAOYSA-N 492.494 5.470 5 20 JKBD C[C@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)N[C@H](C)c1ccc(NC(=O)c2ccc(F)cc2)cc1 604443824 QHTFAMPJJWYBOS-CABCVRRESA-N 485.899 5.284 5 20 JKBD C[C@H](Nc1ccc(NC(=O)CSc2ccc(C(N)=O)cc2[N+](=O)[O-])cc1Cl)c1ccccc1 604513522 VMBJYOQONMGIQM-AWEZNQCLSA-N 484.965 5.251 5 20 JKBD Cc1oc(-c2ccsc2)nc1COC(=O)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 726805934 HATGDJCMJNTYKS-UHFFFAOYSA-N 495.479 5.598 5 20 JKBD O=C1/C(=C\c2ccccc2)N=C(SCc2c(F)cccc2[N+](=O)[O-])N1c1ccc(F)cc1 728787493 TUIFLCSAVVOQGR-DEDYPNTBSA-N 451.454 5.550 5 20 JKBD CC(C)N(Cc1nnc(-c2cccc([N+](=O)[O-])c2)o1)C(=O)[C@@H]1C[C@@H]1c1cccc2ccccc12 730740502 SCNRAKFPLQDWMQ-DHIUTWEWSA-N 456.502 5.339 5 20 JKBD CSCC[C@@H](NC(=O)c1ccc(Cl)c([N+](=O)[O-])c1)C(=O)O[C@H](C)c1ccccc1Cl 847431687 VYEOZJICQJCEAM-SJKOYZFVSA-N 471.362 5.058 5 20 JKBD Cc1ccc(F)cc1NC(=O)[C@H](C)Oc1ccc2c(-c3ccc([N+](=O)[O-])cc3)cc(=O)oc2c1 851958941 LYMXGKDOENSEKS-HNNXBMFYSA-N 462.433 5.222 5 20 JKBD COc1ccc(NC(=O)c2nnc(/C(Cl)=C\c3ccc(-c4ccc([N+](=O)[O-])cc4)s3)s2)cc1 912965553 UZQJOZZGBIFNGT-LDADJPATSA-N 498.973 6.173 5 20 JKBD O=C(COC(=O)c1cccnc1Oc1ccc(Cl)cc1Cl)Nc1cc([N+](=O)[O-])ccc1Cl 920913068 SZQYEGWTVHSPML-UHFFFAOYSA-N 496.690 5.538 5 20 JKBD O=C(CSc1ccccc1[N+](=O)[O-])OCc1csc(COc2ccc(Cl)cc2)n1 923399496 CWYZQNHNPRSBOK-UHFFFAOYSA-N 450.925 5.119 5 20 JKBD CC(C)(C)CCCCCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)/C=C/c1ccccc1[N+](=O)[O-])C2 1781932751 YNMGDXYDQUVTTD-XHYPSFNUSA-N 499.652 5.119 5 20 JKBD O=C(Cc1cc([N+](=O)[O-])ccc1F)Nc1ccc(C2(NC(=O)c3cc4sccc4[nH]3)CCC2)cc1 1786672687 KKNNTKFPYJFSMV-UHFFFAOYSA-N 492.532 5.267 5 20 JKBD Cc1cc(CCCC(=O)NC2(c3ccc(NC(=O)[C@@H]4CC4(F)F)cc3)CCC2)c([N+](=O)[O-])cc1F 1789130478 IKONBSUOVIYUPZ-IBGZPJMESA-N 489.494 5.154 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)C34CCC(CC3)CC4)CCC2)cc1)c1ccc([N+](=O)[O-])c2c1OCO2 1790096898 ZUAIHCMAGMRYAJ-UHFFFAOYSA-N 491.544 5.042 5 20 JKBD O=C(NC1(c2ccc(NC(=O)c3nc4cc([N+](=O)[O-])ccc4[nH]3)cc2)CCC1)c1ccc2ccoc2c1 1790827828 SPLLZDLUCIQRGR-UHFFFAOYSA-N 495.495 5.279 5 20 JKBD Cc1ccccc1NCC(=O)NC1(c2ccc(NC(=O)/C=C/c3ccccc3[N+](=O)[O-])cc2)CCC1 1792315676 ORCXJVVVJQOHGU-LFIBNONCSA-N 484.556 5.163 5 20 JKBD O=C(/C=C/c1ccc([N+](=O)[O-])o1)NC1(c2ccc(NC(=O)[C@]3(F)CCCC=C3F)cc2)CCC1 1792374992 KDYDYCMMPMPNCM-LJTKGQTQSA-N 471.460 5.081 5 20 JKBD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc2c1oc1ccccc12)c1ccc([N+](=O)[O-])cc1F 1801203393 IDPMTYURWQTUNU-BJWYYQGGSA-N 487.487 5.199 5 20 JKBD CC/C=C(\C)C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cc(Cl)cc([N+](=O)[O-])c2C)CC1 1830738926 YDDRBUYNPGDZDI-QLKYELJLSA-N 461.990 5.146 5 20 JKBD Cc1csc(Sc2ccc(C(=O)Nc3ccc(NC(=O)C4CC4)cc3)cc2[N+](=O)[O-])n1 10926710 PKRZLJXGWPUCCZ-UHFFFAOYSA-N 454.533 5.112 5 20 JKBD C[C@@H](OC(=O)c1sc2cc(F)ccc2c1Cl)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 11443922 ZEVZQZVOOXJOIK-MRVPVSSYSA-N 490.818 5.805 5 20 JKBD Cc1nc(CSc2ccc(C(=O)OCC(=O)Nc3cc(Cl)ccc3[N+](=O)[O-])cc2)cs1 11698762 JDAZBDGSUPMPRU-UHFFFAOYSA-N 477.951 5.101 5 20 JKBD C[C@@H](OC(=O)CCc1ncc(-c2ccc(Cl)cc2)o1)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl 12259014 FHGHDXNGTCYECW-GFCCVEGCSA-N 478.288 5.060 5 20 JKBD O=C(OCc1csc(-c2ccccn2)n1)c1ccccc1C(=O)c1ccc(Cl)c([N+](=O)[O-])c1 12259719 FWAFQUOYXAOMLX-UHFFFAOYSA-N 479.901 5.355 5 20 JKBD CCOc1c(Br)cc(C(=O)Nc2nc(-c3cccc([N+](=O)[O-])c3)cs2)cc1OC 14376479 BASFNHJFKIHGLP-UHFFFAOYSA-N 478.324 5.140 5 20 JKBD Cc1cccc(C(C)C)c1NC(=O)c1ccc(OS(=O)(=O)c2cccc([N+](=O)[O-])c2)cc1 14739259 YNLJAKHFKZFUAK-UHFFFAOYSA-N 454.504 5.047 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Cl)[C@@H](NCc1ccc(CN2CCCC2)cc1)c1ccccc1 15506319 AFEPKLWQNBIGLU-VWLOTQADSA-N 478.980 5.314 5 20 JKBD O=C(Nc1ccccc1C(=O)NC[C@@H]1CCCO1)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1 15638846 VIGGEWSNZIPZHR-IBGZPJMESA-N 495.919 5.202 5 20 JKBD Cn1ccnc1[C@H](NC(=O)c1ccc(NCc2ccccc2Cl)c([N+](=O)[O-])c1)c1ccccc1F 29999985 ZSENGSUQFYCKIE-HSZRJFAPSA-N 493.926 5.252 5 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HTFGWENOPSMBFH-UHFFFAOYSA-N 461.543 5.543 5 20 JKBD CN(CCc1ccncc1)C(=O)c1c2c(nc3ccccc13)/C(=C\c1cccc([N+](=O)[O-])c1)CCC2 499947396 TVHXXZATXRADIS-PYCFMQQDSA-N 478.552 5.730 5 20 JKBD COC(=O)c1ccccc1C(=O)c1ccc(NC[C@@H]2CCCO[C@@H]2c2ccccc2)c([N+](=O)[O-])c1 513201110 YBNZRCHHHBFCHP-RXFWQSSRSA-N 474.513 5.192 5 20 JKBD Cc1ccc(NC(=O)[C@@H](Sc2nnc(C[C@@H](C)c3ccccc3)o2)c2ccccc2)c([N+](=O)[O-])c1 515309929 ZPBMXKAMDFTTID-KOSHJBKYSA-N 488.569 6.105 5 20 JKBD COc1cccc(-c2cc(NC(=O)c3cc(OC)ccc3[N+](=O)[O-])n(-c3ccc(C)cc3)n2)c1 517877115 LMEFJCGQDGCXSX-UHFFFAOYSA-N 458.474 5.025 5 20 JKBD Cc1ccc(C(=O)Nc2nc3ccc(NC(=O)c4ccc([N+](=O)[O-])cc4C)cc3s2)s1 523276503 RSQZGTIKSHVUES-UHFFFAOYSA-N 452.517 5.387 5 20 JKBD O=C(Nc1ccccc1Br)C1CCN(C(=O)c2cc3ccccc3c3cccnc23)CC1 523567883 ISEORMDILQJMOB-UHFFFAOYSA-N 488.385 5.641 5 20 JKBD O=C(C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)NCCCN1CCCCCC1=O 603452314 QVTPPFHALJPAGN-JZJYNLBNSA-N 492.601 5.044 5 20 JKBD Cc1ccc(NS(=O)(=O)c2ccc(N[C@@H](c3ccccc3)c3ccccn3)c([N+](=O)[O-])c2)c(C)c1 603473092 JWROXWHWMQEMDX-SANMLTNESA-N 488.569 5.609 5 20 JKBD O=C(Nc1ccccc1SCC(F)(F)F)c1ccc([N+](=O)[O-])cc1I 604565860 GLJGFONMYBTLHU-UHFFFAOYSA-N 482.221 5.106 5 20 JKBD C[C@@H](Nc1ccc(C(=O)N2CCCC[C@@H]2Cc2ccc(F)cc2)cc1[N+](=O)[O-])c1ccccn1 609187688 UBLIKVTXBZIPKJ-XMSQKQJNSA-N 462.525 5.539 5 20 JKBD COc1ccc(Oc2ccc([N+](=O)[O-])cc2C(=O)Nc2cc(-c3ccccc3OC)[nH]n2)cc1 609201781 YAXHPIBTZUXFSV-UHFFFAOYSA-N 460.446 5.047 5 20 JKBD O=C(c1cc2ccccc2c2cccnc12)N1CCN(c2ncc(C(F)(F)F)cc2Cl)CC1 642518027 LDDOQAKBJCWHLI-UHFFFAOYSA-N 470.882 5.418 5 20 JKBD Cc1cc(O[C@@H](C)c2ccccc2)ccc1NC(=O)[C@H]1CC(=O)N(c2ccc(F)c([N+](=O)[O-])c2)C1 728010798 JQJMJZRPKMALHL-HKUYNNGSSA-N 477.492 5.174 5 20 JKBD CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccc2c(c1)CCN2C(=O)OC(C)(C)C 729040721 YMSBZDHUYDZYEK-UHFFFAOYSA-N 454.527 5.335 5 20 JKBD O=C(C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)OCc1nc(-c2ccoc2)no1 729865344 MXNKKBRQHZIEQG-BOPFTXTBSA-N 488.481 5.522 5 20 JKBD C[C@@H](OC(=O)c1sccc1SC(F)F)C(=O)Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1 730659479 BKAMHYQAQYQCEF-SECBINFHSA-N 485.515 5.279 5 20 JKBD C[C@@H](OC(=O)c1cnn(-c2ncc(C(F)(F)F)cc2Cl)c1C(F)F)c1cccc([N+](=O)[O-])c1 730962103 JYZHIFSELHSFAJ-SECBINFHSA-N 490.772 5.703 5 20 JKBD O=C(COc1ccc(C2SCCCS2)cc1)N(CC1CC1)c1ccc(Cl)c([N+](=O)[O-])c1 745344767 OQDKHLAGEAGKOP-UHFFFAOYSA-N 479.023 5.939 5 20 JKBD CC(C)(C)C[C@H](NC(=O)COC(=O)c1csc(-c2cccc([N+](=O)[O-])c2)n1)c1ccc(F)cc1 747954571 AXGJIQPSPWCOFF-IBGZPJMESA-N 485.537 5.308 5 20 JKBD O=C(Nc1ccccc1SC[C@H]1CC1(Cl)Cl)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-] 917750680 IHXUAYSCELSESD-LLVKDONJSA-N 495.306 6.074 5 20 JKBD Cc1sc(NC(=O)c2cc(OCC(F)(F)F)ccc2[N+](=O)[O-])nc1-c1cccc([N+](=O)[O-])c1 917790212 BOWUVAWEHRFPLB-UHFFFAOYSA-N 482.396 5.128 5 20 JKBD COc1ccccc1-n1c(N2CCCCC2)nn(CN(Cc2ccc([N+](=O)[O-])cc2)C(C)C)c1=S 919950945 ZFLFTTMFDSEAGV-UHFFFAOYSA-N 496.637 5.178 5 20 JKBD O=C(Cc1ccc(Cl)cc1[N+](=O)[O-])Nc1ccc(C2(NC(=O)CCCn3cccc3)CCC2)cc1 1786116080 SXIHCAVIHHNSKC-UHFFFAOYSA-N 494.979 5.207 5 20 JKBD O=C(Cc1cccc([N+](=O)[O-])c1)NC1(c2ccc(NC(=O)[C@@H]3CCCCC3(F)F)cc2)CCC1 1786461745 IUXATUFCFWBLNH-NRFANRHFSA-N 471.504 5.097 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)c3cc4cc([N+](=O)[O-])ccc4s3)CCC2)cc1)c1ccnc(F)c1 1786518777 UTSMCPJPUFXNDL-UHFFFAOYSA-N 490.516 5.405 5 20 JKBD Cc1cc(C(=O)NC2(c3ccc(NC(=O)C45CCC(CC4)CC5)cc3)CCC2)ncc1[N+](=O)[O-] 1791981886 RTYCNWJBKSWTMT-UHFFFAOYSA-N 462.550 5.016 5 20 JKBD Cc1ccc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)c(Cl)c1 1801208951 XVCYLDIJDSSEAK-BJWYYQGGSA-N 483.977 5.337 5 20 JKBD CC1=CC[C@H](C(=O)NC[C@H]2CCN(C(=O)c3cc(Cl)cc([N+](=O)[O-])c3C)[C@H]2c2cccnc2)CC1 1809481875 AMWRHBXPJAAIGE-NRYAXDJKSA-N 496.995 5.018 5 20 JKBD C[C@@H](C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cc(F)cc([N+](=O)[O-])c2)n[nH]1)c1ccc(Cl)cc1 1821163360 LUZULEJXSFWUBC-SPLOXXLWSA-N 499.930 5.220 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cc3ccccc3o2)[nH]n1 1821284045 PZICFOKPIPVZSU-LJQANCHMSA-N 491.479 5.131 5 20 JKBD CC1(C(=O)N2CCCC[C@H]2c2cc(NC(=O)c3cc4cc([N+](=O)[O-])ccc4s3)n[nH]2)CCCC1 1821612271 SXNIAUAOBGDMIM-SFHVURJKSA-N 481.578 5.419 5 20 JKBD CC[C@H](C(=O)N1CCCC[C@H]1C1CCN(C(=O)Cc2cc([N+](=O)[O-])ccc2F)CC1)c1ccccc1 1826309444 BYWJSMGWUGDFHD-AHWVRZQESA-N 495.595 5.090 5 20 JKBD Cc1ccc(SCC(=O)N2CCCC[C@H]2C2CCN(C(=O)c3cccc(F)c3[N+](=O)[O-])CC2)cc1 1828344943 RQRSVVGAEZELOI-QHCPKHFHSA-N 499.608 5.068 5 20 JKBD CC1=CC[C@H](C(=O)N2CCCC[C@H]2C2CCN(C(=O)c3cc(Cl)cc([N+](=O)[O-])c3C)CC2)CC1 1828350911 DAAXACIBSZUNRG-REWPJTCUSA-N 488.028 5.536 5 20 JKBD C[C@@H](C(=O)N1CCCC[C@H]1C1CCN(C(=O)CCc2cccc([N+](=O)[O-])c2)CC1)c1cccs1 1832137704 BZNPQJPDHJCSSY-XXBNENTESA-N 483.634 5.012 5 20 JKBD Cc1cc(CCCC(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)[C@@H](c2ccccc2)C(C)C)c([N+](=O)[O-])cc1F 1847614258 RAZABYDPEXUMTA-NLJOTIRTSA-N 495.595 5.007 5 20 JKBD C[C@H](NC(=O)CCNc1ccc(C(F)(F)F)cc1[N+](=O)[O-])c1nc2ccccc2n1C(F)F 9855584 XGAQBWYJBAQWJV-NSHDSACASA-N 471.386 5.038 5 20 JKBD Cc1ccccc1-c1cc(C(=O)OCc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)c2cnn(C(C)C)c2n1 14362275 FNNAHRFNBHJHKV-UHFFFAOYSA-N 498.499 5.303 5 20 JKBD Cc1cccc(Oc2ccc(NC(=O)c3ccc(Sc4nncn4C)c([N+](=O)[O-])c3)cc2)c1 14791978 SOKSBYAEKFTRGB-UHFFFAOYSA-N 461.503 5.228 5 20 JKBD Cc1ccc(-c2nnc(-c3ccc(C(=O)OCC(=O)Nc4cc([N+](=O)[O-])ccc4Cl)cc3)o2)cc1 16287776 OGFVTQOJRCFCRJ-UHFFFAOYSA-N 492.875 5.069 5 20 JKBD O=c1c2ccc(C(F)(F)F)cc2nc2n1CC/C2=C\c1ccc(-c2ccc([N+](=O)[O-])cc2)o1 16386214 LLPCHMZSSGHVNB-SDNWHVSQSA-N 453.376 5.528 5 20 JKBD CCCCn1c(S[C@@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)nnc1-c1ccc(OC)cc1 17656204 IIUNFDKIWFFSBV-HNNXBMFYSA-N 480.550 5.565 5 20 JKBD C[C@H](OC(=O)c1ccccc1SCc1ccco1)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl 18410455 BZTZFJOLMBONOY-ZDUSSCGKSA-N 460.895 5.318 5 20 JKBD Cc1ccc([N+](=O)[O-])cc1NC(=O)c1cnn(-c2cccc(C(F)(F)F)c2)c1C(F)(F)F 24933185 RDMUSVZPPIJMLD-UHFFFAOYSA-N 458.318 5.379 5 20 JKBD Cc1nc(-c2ccc(C(F)(F)F)cc2)sc1C(=O)OCc1nnc(-c2ccc([N+](=O)[O-])cc2)o1 25663891 LGQAKYWIOOGJCZ-UHFFFAOYSA-N 490.419 5.453 5 20 JKBD Cc1cc([N+](=O)[O-])ccc1NC(=O)CCSc1nnc(Cc2ccccc2)n1-c1ccccc1 26425894 XSBSAQHZTJGIAE-UHFFFAOYSA-N 473.558 5.196 5 20 JKBD C[C@H](Nc1ccc(C(=O)Nc2ccccc2Oc2ccccc2)cc1[N+](=O)[O-])c1ccccn1 72016477 XHCHPVJKBNKOGX-SFHVURJKSA-N 454.486 6.208 5 20 JKBD C[C@H](Sc1ncc(-c2ccccc2)n1CC(F)(F)F)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl 109622521 QRQKVIUIGFKJJC-LBPRGKRZSA-N 484.887 5.793 5 20 JKBD CCOc1cc(C(=O)Nc2ccc(Oc3cccc(Br)c3)nc2)c([N+](=O)[O-])cc1OC 109988494 ZVXMKGKZRTZNRJ-UHFFFAOYSA-N 488.294 5.204 5 20 JKBD Cc1[nH]c2ccccc2c1C1CCN(C(=O)c2ccc(N[C@H](C)c3ccccn3)c([N+](=O)[O-])c2)CC1 409891212 FAJFRTBWGMUQLR-GOSISDBHSA-N 483.572 5.972 5 20 JKBD O=C(CN1C(=O)COc2ccc([N+](=O)[O-])cc21)Nc1ccccc1-c1ccc(-c2ccccc2)cc1 410043765 SKAAWCKTTQMKGY-UHFFFAOYSA-N 479.492 5.293 5 20 JKBD C[C@H](Nc1ccc(C(=O)N2CCC(c3cccc4ccccc34)CC2)cc1[N+](=O)[O-])c1ccccn1 476143638 IWLSBSMEPXWAQY-FQEVSTJZSA-N 480.568 6.336 5 20 JKBD O=C(C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)N1CCO[C@H](c2ccccc2)C1 485498769 NTPBTLCQJPFKHL-VGBYGFDOSA-N 485.565 5.735 5 20 JKBD C[C@H](Nc1ccc(C(=O)Nc2n[nH]c(-c3cccc(C(F)(F)F)c3)n2)cc1[N+](=O)[O-])c1ccccn1 490607782 LMFUGASJDZHLIV-ZDUSSCGKSA-N 497.437 5.219 5 20 JKBD COc1cc(C(=O)Nc2cccc(C(=O)Nc3ccccc3)c2C)c([N+](=O)[O-])cc1OC(F)F 498473722 XRDJIMXQSHCLBX-UHFFFAOYSA-N 471.416 5.018 5 20 JKBD C[C@@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccc(F)c(NC(=O)Cc2ccccc2)c1 502810320 ORYXNSZMLBTLTG-OAHLLOKOSA-N 453.495 5.034 5 20 JKBD C[C@@H]1Cc2cc([N+](=O)[O-])ccc2N1C(=O)c1ccc(Oc2cccc(Br)c2)nc1 504328337 GGCYFIWCMJNOKL-CYBMUJFWSA-N 454.280 5.136 5 20 JKBD C[C@H](Nc1ccc(C(=O)Nc2nc(CN3CCCCCC3)cs2)cc1[N+](=O)[O-])c1ccccn1 507267338 XTIIOMWLMBXKSM-KRWDZBQOSA-N 480.594 5.248 5 20 JKBD COc1cc(C(=O)N[C@H](c2ccc(Cl)cc2)C(C)C)c([N+](=O)[O-])cc1OCc1cscn1 512293452 LIBUSSOECHPRKY-NRFANRHFSA-N 475.954 5.419 5 20 JKBD Cc1ccc(CN(C(=O)CSc2ccc([N+](=O)[O-])cc2)c2ccc3c(c2)OCCO3)s1 512410271 HUDRJXHRJZCIBU-UHFFFAOYSA-N 456.545 5.061 5 20 JKBD C[C@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)N(Cc1cccnc1)c1ccc(Br)cc1 515628066 ZCCXWAAFNKDDRB-HNNXBMFYSA-N 472.364 5.466 5 20 JKBD O=C(c1cc([N+](=O)[O-])ccc1Sc1ccc(Cl)cc1)N1CCCN(CC(F)(F)F)CC1 519060316 UMWZPAXWHOAOHY-UHFFFAOYSA-N 473.904 5.110 5 20 JKBD C[C@H]1CCCN(c2ccc(C(=O)Nc3cccc(NC(=O)c4cccs4)c3)cc2[N+](=O)[O-])C1 591682048 PPXYTXIMRWEKIA-INIZCTEOSA-N 464.547 5.397 5 20 JKBD O=C(C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)NCc1nc2ccccc2s1 603446001 PTTYOFWDLBPWTK-GHRIWEEISA-N 486.578 6.061 5 20 JKBD COc1cc(NC(=O)c2cc3cc([N+](=O)[O-])ccc3s2)c(C(=O)N2[C@@H](C)CCC[C@H]2C)cc1OC 603596704 LYNPORMHDHMSFB-GASCZTMLSA-N 497.573 5.482 5 20 JKBD CN(CCCCCc1cc(-c2cccc(F)c2)n[nH]1)C(=O)C1CCN(c2ccccc2[N+](=O)[O-])CC1 604194191 AJNXTFRNIFKLSN-UHFFFAOYSA-N 493.583 5.212 5 20 JKBD C[C@@H]1CCCN(c2ccc(C(=O)N3C[C@@H](C(F)(F)F)C[C@@H](C(F)(F)F)C3)cc2[N+](=O)[O-])C1 604257590 IFFGIOGXUBNOMD-YUELXQCFSA-N 467.410 5.034 5 20 JKBD C[N+](C)=c1ccn(/C(C(=S)Nc2ccccc2-c2ccccc2)=C(/O)c2ccc([N+](=O)[O-])cc2)cc1 725762149 FGYJQMXRABBFCL-UHFFFAOYSA-O 497.600 5.418 5 20 JKBD Cc1nn(-c2ccccc2)cc1C(=O)Oc1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2Cl)cc1 726497094 BGVDOBVKCLZWBM-UHFFFAOYSA-N 476.876 5.214 5 20 JKBD C[C@H](NC(=O)CC1(CC(=O)N[C@@H](C)c2cccc([N+](=O)[O-])c2)CCCCC1)c1cccc([N+](=O)[O-])c1 729823990 CMXNKNHFMRTLDG-OALUTQOASA-N 496.564 5.288 5 20 JKBD C[C@H](OC(=O)c1ccc(F)c(NC(=O)OC(C)(C)C)c1)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 730632284 QWTRRLGJZPCSDZ-LBPRGKRZSA-N 472.429 5.049 5 20 JKBD CC[C@H](C)n1c(S[C@@H](C)C(=O)Nc2cc([N+](=O)[O-])ccc2Cl)nnc1-c1ccccc1 749752021 OKXXTOSSPBOTJZ-KBPBESRZSA-N 459.959 5.597 5 20 JKBD O=C(Cc1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1)Nc1ccc(N2CCCC2)cc1 750734446 ZUBWSYHVJMWYBE-UHFFFAOYSA-N 467.529 5.229 5 20 JKBD Cc1cc([N+](=O)[O-])ccc1NC(=O)COC(=O)Cc1c(C)nc2ccccc2c1-c1ccccc1 800368732 BCYUFAXTPHAPGE-UHFFFAOYSA-N 469.497 5.151 5 20 JKBD COc1ccccc1N(Cc1ncc(-c2ccccc2)o1)S(=O)(=O)c1cc([N+](=O)[O-])ccc1Cl 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O=C(/C=C/c1ccccc1[N+](=O)[O-])Nc1ccc(C2(NC(=O)CCC(F)(F)F)CCC2)cc1 1792315646 KUUYMIKQUUPIBY-IZZDOVSWSA-N 461.440 5.085 5 20 JKBD CC(C)(C)CC(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cc3cc([N+](=O)[O-])ccc3s2)n[nH]1 1821610271 XLAXLVJTZJQZEU-KRWDZBQOSA-N 469.567 5.275 5 20 JKBD Cc1c(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)/C=C/c3ccccc3[N+](=O)[O-])n[nH]2)oc2ccccc12 1823504666 SBVRKXHNIGKRME-DGXIYAMASA-N 499.527 5.392 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)N1CCC([C@@H]2CCCCN2C(=O)[C@H]2CCCCC2(F)F)CC1 1824647776 GLLBGGNFUQWAKU-NQIIRXRSSA-N 495.542 5.101 5 20 JKBD Cc1ccoc1C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cc(Cl)cc([N+](=O)[O-])c2C)CC1 1827740851 FAKVARNMVZMEMB-FQEVSTJZSA-N 473.957 5.005 5 20 JKBD Cc1ccc2[nH]c(C(=O)N3CCC([C@@H]4CCCCN4C(=O)c4ccc([N+](=O)[O-])cc4F)CC3)cc2c1 1830496183 JMQYTHFHWKWCKK-VWLOTQADSA-N 492.551 5.071 5 20 JKBD CC1(C)CCC(CC(=O)N2CCC([C@@H]3CCCCN3C(=O)c3cc(F)cc([N+](=O)[O-])c3)CC2)CC1 1830618223 OMNBMWACFPJCGA-DEOSSOPVSA-N 487.616 5.574 5 20 JKBD Cc1cc(Cl)cc(C(=O)N2CCCC[C@H]2C2CCN(C(=O)c3cccc(F)c3[N+](=O)[O-])CC2)c1 1832610484 OTWIEAYXWUNXJR-QFIPXVFZSA-N 487.959 5.243 5 20 JKBD O=C(c1cccnc1-c1ccccc1)N1CC2(CCCN2C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)C1 1845738875 KNPSJPHCKCXVCV-UHFFFAOYSA-N 498.564 5.002 5 20 JKBD O=C(CSc1nnc(Cc2ccccc2)n1-c1ccc(Cl)cc1)Nc1cc([N+](=O)[O-])ccc1F 9570972 DUFNFEVGFBNKGB-UHFFFAOYSA-N 497.939 5.290 5 20 JKBD CC(C)CCSc1ccc(C(=O)N2CCC(C(=O)Nc3ccccc3)CC2)cc1[N+](=O)[O-] 10444612 NUCBZGWKJPSOQY-UHFFFAOYSA-N 455.580 5.224 5 20 JKBD CC(=O)N(c1nc(COC(=O)c2ccc([N+](=O)[O-])cc2)cs1)c1c(C)cc(C)cc1Cl 10646932 CFXRCDJBHGLCMM-UHFFFAOYSA-N 459.911 5.363 5 20 JKBD CC(=O)N[C@@H](CC(=O)Nc1cc([N+](=O)[O-])ccc1Nc1cccc(C(F)(F)F)c1)c1cccs1 21441515 SHVBQBJXHQWGRG-IBGZPJMESA-N 492.479 5.625 5 20 JKBD Cc1ccc([N+](=O)[O-])cc1NC(=O)c1ccc(-n2nc(SCc3ccccc3)sc2=S)cc1 24068356 ZCDWUVKDZQLTLR-UHFFFAOYSA-N 494.623 6.425 5 20 JKBD O=C(Nc1ccc(Cl)c([N+](=O)[O-])c1)[C@@H](Sc1nncn1-c1ccccc1F)c1ccccc1 24723258 GFCTVERPPWHSNC-FQEVSTJZSA-N 483.912 5.440 5 20 JKBD C[C@@H](N[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1)c1ccc(C(F)(F)F)cc1 28383915 BEJCDNDFBHYOGO-SZNDQCEHSA-N 477.870 6.298 5 20 JKBD O=C(Nc1ccccc1C(=O)Nc1ccc(OC(F)F)c(Cl)c1)c1ccc([N+](=O)[O-])cc1Cl 29635969 YFFGDVHWXFHMQT-UHFFFAOYSA-N 496.253 6.008 5 20 JKBD Cc1cc(CSc2ccccc2C(=O)Nc2nc(-c3ccc(C)c([N+](=O)[O-])c3)cs2)on1 105354280 LICCDYSFMXIZSE-UHFFFAOYSA-N 466.544 5.868 5 20 JKBD NC(=O)c1ccc(SCC(=O)Nc2ccccc2-c2ccc(-c3ccccc3)cc2)c([N+](=O)[O-])c1 410045874 XDPPYLCDUYLLAE-UHFFFAOYSA-N 483.549 5.759 5 20 JKBD CCC(=O)Nc1ccc(C)c(NC(=O)c2ccc(NCc3ccccc3Cl)c([N+](=O)[O-])c2)c1 481964692 DRNRKIMKYBYLBW-UHFFFAOYSA-N 466.925 5.770 5 20 JKBD C[C@@H](Nc1ccc(C(=O)NC(C)(C)Cc2ccccc2Cl)cc1[N+](=O)[O-])c1ccccn1 485873189 XZBORPJSZAEDHN-MRXNPFEDSA-N 452.942 5.567 5 20 JKBD CSCC[C@H](NC(=O)c1ccc([N+](=O)[O-])o1)C(=O)Nc1ccc(Oc2cccc(Cl)c2)cc1 489673917 DUWTYYQDRRLJQS-SFHVURJKSA-N 489.937 5.124 5 20 JKBD O=C(Nc1ccc(Cl)c(S(=O)(=O)Nc2ccccc2Cl)c1)c1csc([N+](=O)[O-])c1 508729272 ZROTTZQZNNYKDB-UHFFFAOYSA-N 472.331 5.016 5 20 JKBD O=C(Nc1cccc(CNCc2ccc(Oc3ccccc3Cl)c([N+](=O)[O-])c2)c1)[C@H]1CCCO1 509621991 VHLJJBMUGFFQID-XMMPIXPASA-N 481.936 5.448 5 20 JKBD COc1ccc(-c2nnc(SCC(=O)c3ccc([N+](=O)[O-])cc3)n2C2CCCCC2)cc1OC 515304591 TXICKANVSLDZCC-UHFFFAOYSA-N 482.562 5.351 5 20 JKBD Cc1cc(OC(C)C)ccc1NC(=O)c1ccc(NS(=O)(=O)c2ccc(C)c([N+](=O)[O-])c2)cc1 515931266 YRRJOMWIAQIKTC-UHFFFAOYSA-N 483.546 5.052 5 20 JKBD C[C@H]1CCCN(CCCCNC(=O)C/C(=C/c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)C1 517094680 FIRSLELMXUJSSH-OZNYCYRCSA-N 492.645 5.764 5 20 JKBD C[C@H](Nc1cc(Cl)ccc1OC[C@H]1CCCO1)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 518012789 CKDLOSRAUALADN-SWLSCSKDSA-N 487.862 5.264 5 20 JKBD Cn1ccnc1-c1cccc(NC(=O)Cc2cn(-c3ccccc3)nc2-c2ccc([N+](=O)[O-])cc2)c1 518305769 PECXYFKRAYVIFL-UHFFFAOYSA-N 478.512 5.029 5 20 JKBD Cc1[nH]c2ccc(CN[C@@H](C(=O)Nc3ccc([N+](=O)[O-])cc3Cl)c3ccccc3)cc2c1C 520467673 AHDZXUBUAQLZNV-XMMPIXPASA-N 462.937 5.816 5 20 JKBD O=C(CSc1ncc(-c2ccc(Cl)cc2)o1)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 589975305 FJHGLXRLZCFRIY-UHFFFAOYSA-N 457.817 5.653 5 20 JKBD Cc1sc2ncnc(Sc3ccccc3C(=O)N[C@@H](C)c3cccc([N+](=O)[O-])c3)c2c1C 603965979 UAZMSHIUIGCCOG-AWEZNQCLSA-N 464.572 5.859 5 20 JKBD Cc1c(NC(=O)c2ccccc2)cccc1NC(=O)c1cc([N+](=O)[O-])ccc1NCc1ccccc1 604002304 WVLNAKZBIHEPFR-UHFFFAOYSA-N 480.524 6.020 5 20 JKBD Cc1cc(Oc2ncccn2)ccc1NC(=O)c1ccc(N2C[C@@H](C)C[C@H](C)C2)c([N+](=O)[O-])c1 604452390 UWQLLBKWLDEWKI-IRXDYDNUSA-N 461.522 5.220 5 20 JKBD COCCOc1c(Cl)cccc1NC(=O)c1ccc(Sc2nc(C)cs2)c([N+](=O)[O-])c1 604465009 PSYIPVAWNBBUAL-UHFFFAOYSA-N 479.967 5.442 5 20 JKBD O=C(C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)NCCc1ccc2c(c1)OCO2 604484974 ZAYYWMAKVNJKCO-UYRXBGFRSA-N 487.537 5.223 5 20 JKBD Cc1ccc(C(=O)N[C@H](CC(=O)N(Cc2ccccc2[N+](=O)[O-])CC(F)(F)F)c2ccccc2)cc1 609228254 LPFRGTQKNMKYPR-JOCHJYFZSA-N 499.489 5.356 5 20 JKBD Cc1ccc(NC(=O)c2ccc(NCc3ccc(C(=O)N4CCCC4)cc3)c([N+](=O)[O-])c2)cc1 727430948 HFUQNSLKLLMSNT-UHFFFAOYSA-N 458.518 5.004 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])c(Cl)c1)c1cnn(-c2cccc(C(F)(F)F)c2)c1C(F)(F)F 727710467 UHSNAXKCPFABCG-UHFFFAOYSA-N 478.736 5.724 5 20 JKBD CN(Cc1cc([N+](=O)[O-])ccc1Cl)C(=O)CC[C@H](NC(=O)OC(C)(C)C)c1ccccc1 729306714 AJNMFDFLBFTXKU-FQEVSTJZSA-N 461.946 5.253 5 20 JKBD CC1=C(C(=O)Nc2ccccc2C)[C@@H](c2ccc([N+](=O)[O-])cc2)NC(=O)N1CCc1cccs1 731855876 DZWRRLPDOVUTBL-HSZRJFAPSA-N 476.558 5.186 5 20 JKBD COc1cc(C(=O)Nc2cc(CC(C)C)nn2C)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 747402984 OAKFIXNHUJPCSZ-UHFFFAOYSA-N 458.902 5.233 5 20 JKBD COc1ccc(NC(=O)c2ccccc2NC(=O)c2csc(-c3cccc([N+](=O)[O-])c3)n2)cc1 747635784 ZOGLUIIUVIFRAU-UHFFFAOYSA-N 474.498 5.232 5 20 JKBD C[C@@H](OC(=O)CSCc1ccc(Br)cc1F)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 747937269 IMAAHMXVRJAWHO-LLVKDONJSA-N 496.314 5.084 5 20 JKBD CC(=O)N(c1nc(COC(=O)c2csc(-c3cccc([N+](=O)[O-])c3)n2)cs1)c1ccccc1F 747963068 WZSPEPQTVSPVDQ-UHFFFAOYSA-N 498.517 5.356 5 20 JKBD O=C(Nc1ccccc1C(=O)N[C@H]1CCCOc2ccccc21)c1ccc([N+](=O)[O-])cc1Cl 749861536 BJDFMUZHPJYYMW-FQEVSTJZSA-N 465.893 5.144 5 20 JKBD C[C@@H](OC(=O)c1ccc(-c2nc3ccccc3s2)o1)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl 774001698 SOQISOCWRMTAEM-LLVKDONJSA-N 471.878 5.302 5 20 JKBD CCC(CC)c1cc[n+](/C(C(=S)Nc2cccc(C(C)C)c2)=C(/O)c2cccc([N+](=O)[O-])c2)cc1 917615339 LLDFSFBYBLGTSY-UHFFFAOYSA-O 490.649 7.233 5 20 JKBD COc1cc(COC(=O)Cc2csc(-c3ccc(Cl)s3)n2)c([N+](=O)[O-])cc1OC(F)F 920676784 QETQFCZHIQSQQJ-UHFFFAOYSA-N 490.893 5.329 5 20 JKBD Cc1cccc(-c2nc(CC(=O)N(Cc3nnc(-c4cccc([N+](=O)[O-])c4)o3)C(C)C)cs2)c1 921240751 RDBDBKIUTNQNEB-UHFFFAOYSA-N 477.546 5.056 5 20 JKBD COc1cscc1C(=O)Nc1ccc(C2(NC(=O)Cc3ccc(Cl)cc3[N+](=O)[O-])CCC2)cc1 1788825493 OMYVVPGQLNCOME-UHFFFAOYSA-N 499.976 5.309 5 20 JKBD O=C(NC1(c2ccc(NC(=O)c3cccc(F)c3[N+](=O)[O-])cc2)CCC1)c1ccc2scnc2c1 1790701020 JDDBEODNEBJKQZ-UHFFFAOYSA-N 490.516 5.405 5 20 JKBD Cc1ccc(C)c(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)CSc3ccccc3[N+](=O)[O-])n[nH]2)c1 1822314997 KEOLCUXNEUYFCX-HXUWFJFHSA-N 493.589 5.033 5 20 JKBD CCCCC[C@H](C)C(=O)N1CCC([C@H]2CCCCN2C(=O)Cc2cc([N+](=O)[O-])ccc2F)CC1 1824950090 XALBWJZINLCRTQ-YADARESESA-N 475.605 5.113 5 20 JKBD O=C(Cc1cccc([N+](=O)[O-])c1)N1CCC([C@@H]2CCCCN2C(=O)[C@@H]2CCC[C@H]3CCCC[C@H]32)CC1 1828455357 AAEQRBVXVGAIRN-WELLZUMNSA-N 495.664 5.364 5 20 JKBD Cc1cc(C(=O)N2CCC([C@@H]3CCCCN3C(=O)[C@@H]3CCC[C@H]4CCCC[C@H]43)CC2)ncc1[N+](=O)[O-] 1828459448 CTQGNOOVDRMJOB-QYOMTGNWSA-N 496.652 5.138 5 20 JKBD CCC[C@@H](C(=O)N1CCC([C@@H]2CCCCN2C(=O)/C=C/c2ccccc2[N+](=O)[O-])CC1)n1cccc1 1832906608 CZYUIKPFKVSZQO-NYUHFOLESA-N 492.620 5.071 5 20 JKBD CC(C)N(Cc1ccccc1)C(=O)COC(=O)c1ccccc1C(=O)c1ccc(Cl)c([N+](=O)[O-])c1 3499812 APNKSKCQWLKCIL-UHFFFAOYSA-N 494.931 5.073 5 20 JKBD O=[N+]([O-])c1cc2c(c(CSc3nnc(-c4ccc(Cl)cc4)n3Cc3ccco3)c1)OCOC2 3534870 BTAVYQXRLGEDDR-UHFFFAOYSA-N 484.921 5.307 5 20 JKBD CC(=O)N(c1ccccc1)c1nc(COC(=O)c2ccc(N3CCC[C@@H](C)C3)c([N+](=O)[O-])c2)cs1 10210220 PPNJGNUKOREDOD-QGZVFWFLSA-N 494.573 5.329 5 20 JKBD Cc1nc(CSc2ccccc2C(=O)OCC(=O)Nc2ccc([N+](=O)[O-])cc2Cl)cs1 11595942 OPAVCXWVKDQCHO-UHFFFAOYSA-N 477.951 5.101 5 20 JKBD C[C@H](OC(=O)c1cc([N+](=O)[O-])ccc1Cl)C(=O)Nc1ccc(Cl)cc1C(F)(F)F 15650863 FCAMXCUIQVEQQH-QMMMGPOBSA-N 451.184 5.104 5 20 JKBD C[C@@H](Sc1ncc(-c2ccc(F)cc2)[nH]1)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 17749969 RXHKCYDSKBUUHC-SNVBAGLBSA-N 454.405 5.262 5 20 JKBD CC(=O)Oc1ccc(-c2ccc(C(=O)O[C@H](C)c3nnc(-c4ccc([N+](=O)[O-])cc4)o3)cc2)cc1 17838551 OYURIGDBJKVGPY-OAHLLOKOSA-N 473.441 5.155 5 20 JKBD CCn1c(S[C@@H](C)C(=O)NCc2ccccc2Cl)nc2cc3ccccc3cc2c1=O 18467485 HBQZYKJAMPYJPP-HNNXBMFYSA-N 451.979 5.020 5 20 JKBD O=C(CSc1nc2cc(Cl)ccc2c(=O)n1C1CCCCC1)Nc1ccccc1[N+](=O)[O-] 21925841 HURCNLXRTLGYCZ-UHFFFAOYSA-N 472.954 5.194 5 20 JKBD O=C1CSc2ccc(NC(=O)c3ccc(Oc4ccc(Cl)cc4[N+](=O)[O-])cc3)cc2N1 24296851 RHKBLYWCJCCITE-UHFFFAOYSA-N 455.879 5.337 5 20 JKBD C[C@@H](Nc1ccc(C(=O)Nc2cccc(C(=O)c3ccccc3)c2)cc1[N+](=O)[O-])c1ccccn1 60351752 LMDYQSJJMXKWKR-GOSISDBHSA-N 466.497 5.646 5 20 JKBD COc1ccc(C(=O)N(C)C)cc1NC(=O)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])c(OC)c1 68735064 GWXBKYSTCOBABM-UHFFFAOYSA-N 499.907 5.012 5 20 JKBD CC1CCN(c2ccc([N+](=O)[O-])cc2C(=O)Nc2cccc(OCC(=O)Nc3ccccc3)c2)CC1 108383446 VFNKTTXPDXGKMQ-UHFFFAOYSA-N 488.544 5.101 5 20 JKBD COc1cc(C(=O)Nc2ccc(Oc3ccncc3)cc2)c([N+](=O)[O-])cc1OCc1cscn1 109596307 HOHPZWWITYRUPB-UHFFFAOYSA-N 478.486 5.079 5 20 JKBD COCCN(C(=O)c1cc(SC)c(OC)cc1[N+](=O)[O-])[C@H](C)c1cccc(C(F)(F)F)c1 482416326 SRDBMMXIASDUQH-CYBMUJFWSA-N 472.485 5.194 5 20 JKBD Cc1cc(N(C)C)ccc1NC(=O)C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1 482462260 GHHYLSBOECRORK-CYVLTUHYSA-N 472.570 6.148 5 20 JKBD COc1ccc([C@@H](NC(=O)c2cc(SC)c(OC)cc2[N+](=O)[O-])c2ccc(C)cc2)cc1 483441694 SIMLXPRXEPNDPT-QHCPKHFHSA-N 452.532 5.162 5 20 JKBD O=C(C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)Nc1ccnn1C[C@@H]1CCOC1 486244877 MPHZZYPNOUZIOK-DYGKOUCMSA-N 489.557 5.007 5 20 JKBD COCCOc1cc([N+](=O)[O-])c(C(=O)Nc2ccc(Oc3cccc(Cl)c3)cc2)cc1OC 489713558 KANJVWSJVRYQKG-UHFFFAOYSA-N 472.881 5.327 5 20 JKBD O=C(N[C@@H](Cc1cccc(F)c1)c1cccc(F)c1)C1CCN(c2ccccc2[N+](=O)[O-])CC1 489957461 QABSSRXFZQXHJL-QHCPKHFHSA-N 465.500 5.190 5 20 JKBD C[C@H](NC(=O)c1cc([N+](=O)[O-])ccc1Sc1ccc(Cl)cc1)c1ccc2c(c1)CC(=O)N2 501025887 SYFDDCXYDUCUNM-ZDUSSCGKSA-N 467.934 5.385 5 20 JKBD CCOC(=O)c1sc(-c2cccc([N+](=O)[O-])c2)cc1NC(=O)c1sc(-c2ccccn2)nc1C 506882471 WOOVTBRVJMOOLC-UHFFFAOYSA-N 494.554 5.579 5 20 JKBD CCc1cc(=Nc2ccc(F)c(NC(=O)c3ccoc3C)c2)nc(-c2ccc([N+](=O)[O-])cc2)[nH]1 507111145 NMXLDIJSINWLLO-UHFFFAOYSA-N 461.453 5.073 5 20 JKBD C[C@@H](Nc1cccc(NC(=O)c2cccc(C(F)(F)F)c2)c1)C(=O)Nc1cccc([N+](=O)[O-])c1 507544168 CHJKTAHETJCXKI-CQSZACIVSA-N 472.423 5.305 5 20 JKBD CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)Nc1cccc(COc2ccc3c(c2)OCO3)c1 509548182 FNXDQHWUVARKCS-UHFFFAOYSA-N 463.490 5.345 5 20 JKBD C[C@@H](c1ccco1)N(C(=O)C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)C1CC1 509840485 RDRMGZCNDFVWFJ-STZPCZCHSA-N 473.554 6.480 5 20 JKBD COc1cc(C(=O)N[C@H](CC(F)(F)F)c2ccccc2)c([N+](=O)[O-])cc1OCc1cscn1 512622623 NFNFWCULRVFPTK-MRXNPFEDSA-N 481.452 5.062 5 20 JKBD COc1cc([C@@H](C)NC(=O)Cn2c3ccccc3c(=O)c3ccccc32)ccc1OC1CCCC1 515161815 HVYXGPHLVLEVIX-LJQANCHMSA-N 470.569 5.362 5 20 JKBD Cc1cc(NC(=O)c2ccc(Oc3ccc(C(F)(F)F)cn3)cc2)n(-c2ccc([N+](=O)[O-])cc2)n1 517348413 KUQHIISDPCVRHZ-UHFFFAOYSA-N 483.406 5.547 5 20 JKBD COc1cc2c(cc1OC)CCN([C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1)CC2 518600281 QDJZQDIZUUZXDZ-RUZDIDTESA-N 495.963 5.046 5 20 JKBD COc1cc(C(=O)Nc2nc3c(s2)C[C@H](c2ccccc2)CC3)c([N+](=O)[O-])cc1OC(F)F 519075144 PRCUUHPQWARYCE-CYBMUJFWSA-N 475.473 5.186 5 20 JKBD COc1cc(C(=O)Nc2ccc(-c3nc4ccccc4s3)cn2)c([N+](=O)[O-])cc1OC(F)F 521764026 BWZGWZIWTRDDGM-UHFFFAOYSA-N 472.429 5.129 5 20 JKBD O=C(C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)N1CC=C(c2ccc(O)cc2)CC1 592629494 QFZPGITXBOXKSH-XLNRJJMWSA-N 497.576 6.157 5 20 JKBD O=C(Cc1ccccc1[N+](=O)[O-])N(C[C@@H]1CCCO1)c1nc(-c2cccc(C(F)(F)F)c2)cs1 592950789 UZWRSXGWOFSCIH-SFHVURJKSA-N 491.491 5.492 5 20 JKBD O=C(Nc1ccc(NC(=O)c2ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])cc2)cc1)NC1CC1 601969964 HZVXCORPJBEUOE-UHFFFAOYSA-N 466.881 5.577 5 20 JKBD Cc1cc(Br)cc(Cl)c1NC(=O)C1CCN(c2ccccc2[N+](=O)[O-])CC1 603743572 PTZUBYDKQLHTTH-UHFFFAOYSA-N 452.736 5.174 5 20 JKBD CCOC(=O)C[C@@H](c1ccccc1)C1CCN(C(=O)[C@H](C)Sc2ccc([N+](=O)[O-])cc2)CC1 603928132 LXXKNOVJGJDOAQ-MBSDFSHPSA-N 470.591 5.051 5 20 JKBD O=C(c1cc([N+](=O)[O-])ccc1Sc1ccccc1)N1CCC(C(=O)N2CCc3ccccc32)CC1 604447525 YGVDLOCLXSIKSB-UHFFFAOYSA-N 487.581 5.188 5 20 JKBD Cc1ccc(Sc2ccc(C(=O)N3CCC(CN4C[C@@H](C)O[C@H](C)C4)CC3)cc2[N+](=O)[O-])cc1 608855201 ZPHWPGMRIIWZEJ-WOJBJXKFSA-N 483.634 5.016 5 20 JKBD Cc1nc(-c2ccc([C@H](C)N[C@@H](C)C(=O)Nc3ccc([N+](=O)[O-])cc3C(F)(F)F)cc2)cs1 619556409 GZAASBPLRCNJAP-STQMWFEESA-N 478.496 5.723 5 20 JKBD Fc1ccc(-c2nnc(SCc3nc4ccccc4c4ccccc34)n2CCN2CCOCC2)cc1 621385991 HSEQBLBAVUEAPV-UHFFFAOYSA-N 499.615 5.410 5 20 JKBD CC(=O)c1cc(Br)ccc1OC(=O)c1ccc(N[C@@H](C)c2ccccn2)c([N+](=O)[O-])c1 727965508 PKARJMYPFAIAJL-ZDUSSCGKSA-N 484.306 5.347 5 20 JKBD COc1cc(C2SCCS2)ccc1OC(=O)c1cc(SC)c(OC)cc1[N+](=O)[O-] 728460076 KVOQWCSPRNDBMN-UHFFFAOYSA-N 453.563 5.032 5 20 JKBD CSCC[C@@H](NC(=O)c1ccc(Cl)cc1Cl)C(=O)O[C@H](C)c1cccc([N+](=O)[O-])c1 729357369 JNTYTULFWDXENZ-KZULUSFZSA-N 471.362 5.058 5 20 JKBD COc1ccccc1-c1nc(COC(=O)c2csc(-c3cccc([N+](=O)[O-])c3)n2)cs1 747962693 SRLGHTYEXIUVLK-UHFFFAOYSA-N 453.501 5.207 5 20 JKBD CCCOc1ccccc1Oc1ncccc1CNC(=O)c1cc([N+](=O)[O-])c(C)c([N+](=O)[O-])c1C 748625265 XWQPRBJAUBJMFM-UHFFFAOYSA-N 480.477 5.026 5 20 JKBD CC(C)(C)OC(=O)N1CCC[C@@H]1[C@H]1CCCCN1C(=O)c1csc(-c2cccc([N+](=O)[O-])c2)n1 751413893 UVYHYLDVUBMICD-WOJBJXKFSA-N 486.594 5.113 5 20 JKBD C[C@@H](OC(=O)c1c(Cl)ccc(Cl)c1Cl)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 755643782 ABOIPZVQRUFELF-SSDOTTSWSA-N 485.629 5.758 5 20 JKBD C[C@H](Sc1ccccc1Cl)C(=O)O[C@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 919507665 VKPYOMHESHSLDT-MNOVXSKESA-N 476.860 5.318 5 20 JKBD C[C@@H](Nc1ccc(C(=O)OCc2ncc(-c3cccc(Cl)c3)o2)cc1[N+](=O)[O-])c1ccccn1 920548141 QAAOYHQVJXPNDM-OAHLLOKOSA-N 478.892 5.828 5 20 JKBD C[C@H](Nc1ccc(C(=O)OCC(=O)c2ccc(Cl)c(Cl)c2)cc1[N+](=O)[O-])c1ccccn1 920548199 QZBYSOXIKKVGAO-ZDUSSCGKSA-N 474.300 5.509 5 20 JKBD O=[N+]([O-])c1ccc(Cl)cc1Oc1nc(CN2CCOCC2)nc2scc(-c3ccccc3)c12 921060721 UYBFQVNHQYCCCX-UHFFFAOYSA-N 482.949 5.544 5 20 JKBD O=C(Oc1cc(Cl)ccc1[N+](=O)[O-])C1CCN(c2ncc(C(F)(F)F)cc2Cl)CC1 921139062 GTQKNXXDFGBGEO-UHFFFAOYSA-N 464.227 5.137 5 20 JKBD CC(C)c1cc(C(=O)NC2(c3ccc(NC(=O)CCc4cccc([N+](=O)[O-])c4)cc3)CCC2)on1 1786602767 RENWTRZBIMDRDB-UHFFFAOYSA-N 476.533 5.087 5 20 JKBD O=C(NC1(c2ccc(NC(=O)[C@@H]3C[C@@H]3c3ccc(Cl)cc3)cc2)CCC1)c1ccc([N+](=O)[O-])[nH]1 1789154103 LAXBGDUKXHRYOV-WOJBJXKFSA-N 478.936 5.128 5 20 JKBD CCOc1ccc(Cl)cc1C(=O)Nc1ccc(C2(NC(=O)c3ccc([N+](=O)[O-])[nH]3)CCC2)cc1 1790693021 NGNFIJSEQUUGMN-UHFFFAOYSA-N 482.924 5.037 5 20 JKBD Cc1nscc1C(=O)NC1(c2ccc(NC(=O)c3cc(Cl)cc([N+](=O)[O-])c3C)cc2)CCC1 1790773666 FJELTBNAYJKBTE-UHFFFAOYSA-N 484.965 5.383 5 20 JKBD CN(C)c1ccc([N+](=O)[O-])cc1C(=O)NC1(c2ccc(NC(=O)c3cccc4ccoc34)cc2)CCC1 1790956471 JBESCCVNERJKPE-UHFFFAOYSA-N 498.539 5.469 5 20 JKBD C/C(=C\c1cccnc1)C(=O)NC1(c2ccc(NC(=O)/C=C/c3ccccc3[N+](=O)[O-])cc2)CCC1 1792319572 VIKMDGRUMJGSJD-QECFJDBTSA-N 482.540 5.241 5 20 JKBD Cc1cc(O)c([N+](=O)[O-])cc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc2c(Cl)cccc2s1 1797650390 YIFXFQUVGFAOBA-QDMKHBRRSA-N 499.976 5.043 5 20 JKBD Cc1cc(CCCC(=O)N2CCCC3(CCN(C(=O)CCC(C)C)CC3)C2)c([N+](=O)[O-])cc1F 1805821518 VKPQWFFWMZQDBJ-UHFFFAOYSA-N 475.605 5.032 5 20 JKBD CC1(C)CCC(CC(=O)NC[C@H]2CCN(C(=O)c3cccc(F)c3[N+](=O)[O-])[C@@H]2c2cccnc2)CC1 1808901691 IEOWCPUOEYWEAM-HYBUGGRVSA-N 496.583 5.055 5 20 JKBD CC[C@@H](C)[C@@H](C(=O)N1CCCC2(CCN(C(=O)c3cc(F)cc([N+](=O)[O-])c3)CC2)C1)c1ccccc1 1809163525 RTMZIXUTDPUPOS-CJFMBICVSA-N 495.595 5.409 5 20 JKBD CNc1ccc(C(=O)N2CCCC3(CCN(C(=O)c4cc5cc([N+](=O)[O-])ccc5s4)CC3)C2)cc1 1809725616 NHZWLEOLYNFSKH-UHFFFAOYSA-N 492.601 5.010 5 20 JKBD CCC[C@H]1CC[C@H](C(=O)N2CC[C@@H](CNC(=O)c3cc(F)cc([N+](=O)[O-])c3)[C@@H]2c2cccnc2)CC1 1811306486 DZYXUDPYDBDKGK-DDLLOKISSA-N 496.583 5.055 5 20 JKBD CC1(C(=O)Nc2cc([C@H]3CCCCN3C(=O)C3(c4cccc([N+](=O)[O-])c4)CCC3)[nH]n2)CCCC1 1814532079 QBFQRQNXXTUXLP-OAQYLSRUSA-N 479.581 5.012 5 20 JKBD COc1cc(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)c3ccc(C(C)C)cc3)n[nH]2)ccc1[N+](=O)[O-] 1820594350 QJOHUMZIHWZVHN-OAQYLSRUSA-N 491.548 5.070 5 20 JKBD Cc1cc(O)c([N+](=O)[O-])cc1C(=O)N1CCCC[C@H]1c1cc(NC(=O)CC2CCC(C)(C)CC2)n[nH]1 1820978271 HMWCKWBLDWYDHB-FQEVSTJZSA-N 497.596 5.244 5 20 JKBD O=C(c1cccc(F)c1)N1CCCC[C@H]1C1CCN(C(=O)C2(c3cccc([N+](=O)[O-])c3)CCC2)CC1 1829963064 QHHYQYSMBLDWBX-VWLOTQADSA-N 493.579 5.089 5 20 JKBD Cc1ccc(C(=O)N2CCC([C@H]3CCCCN3C(=O)c3ccc([N+](=O)[O-])cc3F)CC2)c(Cl)c1 1830497258 BYNCRMFUVYDRSS-HSZRJFAPSA-N 487.959 5.243 5 20 JKBD O=C(c1cc(F)ccc1Cl)N1CCC([C@H]2CCCCN2C(=O)c2ccc([N+](=O)[O-])cc2F)CC1 1830498764 JFQMQIIPCKLAIF-JOCHJYFZSA-N 491.922 5.074 5 20 JKBD CC1(C)CC(C(=O)N2CCC([C@@H]3CCCCN3C(=O)c3cc4cc([N+](=O)[O-])ccc4s3)CC2)C1 1831062406 SYNDCTWEFDXTTE-NRFANRHFSA-N 483.634 5.479 5 20 JKBD C[C@@H](Sc1nnc(COc2ccccc2Cl)n1C1CC1)C(=O)Nc1ccc(F)c([N+](=O)[O-])c1 9414153 QFVDGMZNQOCTSM-GFCCVEGCSA-N 491.932 5.012 5 20 JKBD O=C(O[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Br)c1ccccc1)c1ccccc1F 10730600 MTLKCBQMFOGXHW-IBGZPJMESA-N 473.254 5.033 5 20 JKBD O=C(NC1CCN(Cc2ccccc2)CC1)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1 15564531 ZNLWBCGVBOTDJS-UHFFFAOYSA-N 465.937 5.435 5 20 JKBD COc1ccc([C@@H](NC(=O)c2ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])cc2)c2nccn2C)cc1 16473886 PXMZNQAUJXHHIW-HSZRJFAPSA-N 492.919 5.302 5 20 JKBD C[C@@H](OC(=O)c1cc(-c2ccco2)nc2ccccc12)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 17529489 TXRUPMIUFPOIHT-CQSZACIVSA-N 456.414 5.371 5 20 JKBD C[C@@H](OC(=O)c1ccccc1SCc1cccs1)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 17939130 JQIHXTFSQVNFOQ-CQSZACIVSA-N 467.528 5.917 5 20 JKBD O=C(CCc1ncc(-c2ccc(Cl)cc2Cl)o1)OCc1nnc(-c2ccc([N+](=O)[O-])cc2)o1 21802074 NGKWRVCVCVNZQU-UHFFFAOYSA-N 489.271 5.283 5 20 JKBD Cc1cc(CN(C)C(=O)c2c3c(nc4ccccc24)/C(=C/c2cccc([N+](=O)[O-])c2)CCC3)no1 25138044 SGSDFZCXGKRDDV-XMHGGMMESA-N 468.513 5.589 5 20 JKBD O=C(Cc1csc(-c2ccccc2Cl)n1)N(Cc1ccccc1[N+](=O)[O-])CC(F)(F)F 106187959 VBSXJTRIGLJJQO-UHFFFAOYSA-N 469.872 5.505 5 20 JKBD CCCCn1c(SCc2nc(-c3ccc([N+](=O)[O-])cc3)no2)nnc1-c1ccc(OC)cc1 107675048 CMVXIOZHJDHCRO-UHFFFAOYSA-N 466.523 5.004 5 20 JKBD O=C(CCNc1ccc(C(F)(F)F)cc1[N+](=O)[O-])Nc1cccc(OCc2cscn2)c1 504993386 BBNITGMSKVDCCT-UHFFFAOYSA-N 466.441 5.090 5 20 JKBD C[C@@H](Nc1ccc(C(=O)N2CCc3sccc3[C@@H]2c2cccs2)cc1[N+](=O)[O-])c1ccccn1 506054870 DLTRKQMNJXCSTK-VOIUYBSRSA-N 490.610 6.074 5 20 JKBD CCN(C(=O)N[C@H](C)c1cccc([N+](=O)[O-])c1)[C@@H]1CCSc2ccc(Br)cc21 507330872 RSOKWGHMRNHBES-FZKQIMNGSA-N 464.385 5.687 5 20 JKBD CCOc1cc(CN[C@H]2CCc3cc(C)ccc32)ccc1OCc1cc([N+](=O)[O-])cc2c1OCOC2 507940671 KUSIVBLLKQQKOO-VWLOTQADSA-N 490.556 5.525 5 20 JKBD O=C(Nc1ccc(CNCc2ccc(Oc3ccc(F)cc3)c([N+](=O)[O-])c2)cc1)c1ccco1 507942263 QYFDVIOXQURJPS-UHFFFAOYSA-N 461.449 5.661 5 20 JKBD O=C(Nc1cccc(NC(=O)c2csc([N+](=O)[O-])c2)c1)Nc1cccc(C(F)(F)F)c1 510288171 NRFJELGBTGSFPR-UHFFFAOYSA-N 450.398 5.571 5 20 JKBD Cc1ccc(NC(=O)C2CCN(c3ccc(C(F)(F)F)cc3[N+](=O)[O-])CC2)c(Br)c1 515314449 MKMDSYPMACJAOE-UHFFFAOYSA-N 486.288 5.540 5 20 JKBD COc1cc(C(=O)Nc2ccc(Cl)c(NC(C)=O)c2)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 518715431 MJFOMFNCUUDRFT-UHFFFAOYSA-N 490.299 5.913 5 20 JKBD Cc1cc(COc2ccc(C(=O)N(Cc3ccc([N+](=O)[O-])cc3)C(C)C)cc2Br)no1 520026774 GFUYLLZSOHWENG-UHFFFAOYSA-N 488.338 5.284 5 20 JKBD CCOC(=O)c1sc(N(C(=O)[C@@H](C)Sc2ccc([N+](=O)[O-])cc2)c2ccccc2)nc1C 603739508 RZUQGMVGAZZMNW-OAHLLOKOSA-N 471.560 5.382 5 20 JKBD C[C@H](c1nc2ccccc2s1)N(C)C(=O)NCCNc1ccc(C(F)(F)F)cc1[N+](=O)[O-] 603748683 OWNJISAMRSDRRG-GFCCVEGCSA-N 467.473 5.038 5 20 JKBD O=C(NC[C@H]1CCCOC1)c1c2c(nc3ccccc13)/C(=C\c1ccc([N+](=O)[O-])cc1)CCC2 604013756 VRFGXWDYKHGTTO-GCFJHJGGSA-N 457.530 5.176 5 20 JKBD COCCN(C(=O)[C@@H](C)Oc1ccccc1C(F)(F)F)c1nc(-c2ccc([N+](=O)[O-])cc2)cs1 608895700 GUCCEVUGVAMLAZ-CQSZACIVSA-N 495.479 5.184 5 20 JKBD CSc1ccc(C(=O)c2ccccc2C(=O)N2CCO[C@@H](c3ccc(F)c(F)c3)C2)cc1[N+](=O)[O-] 608965299 UGCFXMMXXPBUKT-JOCHJYFZSA-N 498.507 5.040 5 20 JKBD COc1ccccc1[C@H](NC(=O)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-])c1ccccc1 609374192 ITOXOPTVAVSDGQ-OAQYLSRUSA-N 460.408 5.064 5 20 JKBD Cc1ccc(-c2nnc3n2CCCCC3)cc1NC(=O)Cn1c2ccccc2c(=O)c2ccccc21 641846195 XKKSRKFXRYESKG-UHFFFAOYSA-N 477.568 5.087 5 20 JKBD CN(C)C1CCN(c2ccc(NC(=O)c3ccc(NCc4ccccc4)c([N+](=O)[O-])c3)cc2F)CC1 728280067 LUOIOFCWFKZKDD-UHFFFAOYSA-N 491.567 5.129 5 20 JKBD O=C(Cc1ccccc1Br)Oc1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2Cl)cc1 729167178 HURWEHYODDNXQV-UHFFFAOYSA-N 489.709 5.411 5 20 JKBD Cc1c(NC(=O)[C@@H](C)OC(=O)CCc2nc3cc(C(F)(F)F)ccc3s2)cccc1[N+](=O)[O-] 730607732 BAFPAQCEMPLRHC-GFCCVEGCSA-N 481.452 5.035 5 20 JKBD Cc1ccc(-c2noc(CCCOC(=O)c3csc(-c4ccc([N+](=O)[O-])cc4)n3)n2)cc1F 747957711 QOGGLMKMDJAWPJ-UHFFFAOYSA-N 468.466 5.005 5 20 JKBD Cc1cc(-c2ccccc2)ccc1NC(=O)c1ccc([N+](=O)[O-])cc1I 751080072 TWDFTUUCFBZAQT-UHFFFAOYSA-N 458.255 5.427 5 20 JKBD C[C@H](OC(=O)c1ccccc1-c1ncc(-c2ccccc2F)o1)C(=O)Nc1ccccc1[N+](=O)[O-] 899997882 LSPPGSZSVZKNST-HNNXBMFYSA-N 475.432 5.240 5 20 JKBD O=C(Nc1cc([N+](=O)[O-])c(F)cc1F)c1ccc2c(c1)C(=O)N(c1cc(Cl)ccc1Cl)C2=O 915144239 PDXYUGGPIDZNDC-UHFFFAOYSA-N 492.221 5.233 5 20 JKBD CC1=C(C(=O)Nc2ccccc2)[C@@H](c2cc([N+](=O)[O-])c(F)cc2F)NC(=S)N1c1ccccc1 916724176 XLKRNHWAERGINL-JOCHJYFZSA-N 480.496 5.222 5 20 JKBD C[C@H](CC(=O)Oc1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2Cl)cc1)c1ccc(F)cc1 918144374 CDZUGDHIFIRBJW-CQSZACIVSA-N 456.857 5.739 5 20 JKBD CSCC[C@@H](NC(=O)c1ccc(Cl)c([N+](=O)[O-])c1)C(=O)O[C@H](C)c1cccc(Cl)c1 918765732 XOHUZQBJKODVOD-SJKOYZFVSA-N 471.362 5.058 5 20 JKBD CC(C)c1ccc(-c2nc(CC(=O)OCc3nc(-c4ccc([N+](=O)[O-])cc4)no3)cs2)cc1 918818232 JHKVDMDLZWNBBA-UHFFFAOYSA-N 464.503 5.178 5 20 JKBD CC(=O)Nc1cc(C(=O)O[C@H](C(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)c2ccccc2)ccc1C 919177379 JZGJIAYBVDWRKK-QFIPXVFZSA-N 481.892 5.052 5 20 JKBD Cc1ccc(C(=O)Nc2cccc(C(F)(F)F)c2)cc1NC(=O)c1cc([N+](=O)[O-])ccc1Cl 920845821 ZWRHZQUOUJHSOE-UHFFFAOYSA-N 477.826 6.080 5 20 JKBD C[C@@H](OC(=O)c1cccnc1Oc1ccc(Cl)cc1Cl)C(=O)Nc1ccccc1[N+](=O)[O-] 920911059 AGMUZGQGCULACL-GFCCVEGCSA-N 476.272 5.273 5 20 JKBD Cc1ccc(SCC(=O)NC2(c3ccc(NC(=O)c4cc(C)c([N+](=O)[O-])cn4)cc3)CCC2)cc1 1788766289 DIAVAPCMSDVVJR-UHFFFAOYSA-N 490.585 5.147 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)c3cc(F)cc([N+](=O)[O-])c3)CCC2)cc1)c1ccc2cnccc2c1 1789014283 BQBYLILUJRHGCE-UHFFFAOYSA-N 484.487 5.344 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)[C@H]3CCCCC3(F)F)CCC2)cc1)c1cc(F)cc([N+](=O)[O-])c1 1790695950 XHAZOBSZMKPOCO-HXUWFJFHSA-N 475.467 5.307 5 20 JKBD CC(C)[C@@H](C(=O)Nc1cc([C@H]2CCCCN2C(=O)/C=C/c2ccc([N+](=O)[O-])o2)[nH]n1)c1ccccc1 1814928141 BRZJAUZESZCRSH-YOVMVTRZSA-N 491.548 5.056 5 20 JKBD O=C(/C=C/c1ccccc1[N+](=O)[O-])N1CCC([C@H]2CCCCN2C(=O)[C@H]2CCCCC2(F)F)CC1 1824651104 KHYXEHRCBOUXHF-CXYUPCIPSA-N 489.563 5.053 5 20 JKBD Cc1c(C(=O)N2CCC([C@H]3CCCCN3C(=O)CCc3cccc([N+](=O)[O-])c3)CC2)ccc(F)c1F 1824843760 SRKINWRVFKMKAX-XMMPIXPASA-N 499.558 5.048 5 20 JKBD C/C=C(/C)C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)CC1 1831349800 BZYRNWFBKAPFOR-SAMDCNTISA-N 455.580 5.009 5 20 JKBD Cc1ccc([N+](=O)[O-])cc1NC(=O)CSc1nnc(-c2ccc(F)cc2)n1-c1ccccc1 15410457 FCGXBAHPEICXNT-UHFFFAOYSA-N 463.494 5.021 5 20 JKBD C[C@@H](OC(=O)c1cc(C(F)(F)F)cc(C(F)(F)F)c1)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 17717495 LBGHVLNUGALXJN-SECBINFHSA-N 475.301 5.600 5 20 JKBD COc1ccc([C@@H](CNC(=O)COc2ccc(Cl)cc2[N+](=O)[O-])c2c[nH]c3ccccc23)cc1 19047039 ZEMMDYKLWILSTO-HXUWFJFHSA-N 479.920 5.065 5 20 JKBD COc1ccccc1-c1nnc(SCC(=O)Nc2c(C)cccc2[N+](=O)[O-])n1-c1ccc(C)cc1 21120604 HQRWYBQIIXYVFY-UHFFFAOYSA-N 489.557 5.199 5 20 JKBD C[C@H](Sc1ncnc2sc3c(c12)CCC3)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 21359212 MUKNAWDVUUWSDC-VIFPVBQESA-N 468.482 5.226 5 20 JKBD O=C(COC(=O)c1cc(Cl)ccc1[N+](=O)[O-])Nc1c(Cl)c(Cl)cc(Cl)c1Cl 23515114 AZYLHUOZECBLHU-UHFFFAOYSA-N 472.495 5.657 5 20 JKBD CCN(C(C)=O)c1nc(COC(=O)c2ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])cc2)cs1 23569686 ZNQFIZHXYAVQEJ-UHFFFAOYSA-N 475.910 5.227 5 20 JKBD COc1cc(C(=O)Nc2ccccc2N2CCOC2=O)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 110040815 ZUVRRINDLBOJHL-UHFFFAOYSA-N 483.864 5.258 5 20 JKBD C[C@H]1C[C@H](C)CN(c2ccc(C(=O)Nc3ccc(C(=O)Nc4nccs4)cc3)cc2[N+](=O)[O-])C1 302929938 GBEXSAHQABREHD-HOTGVXAUSA-N 479.562 5.038 5 20 JKBD O=[N+]([O-])c1ccc(-c2ccc(CNC[C@@H](c3ccco3)N3CCCC3)o2)c(Br)c1 409484810 KZDGMCRDNSMLBI-IBGZPJMESA-N 460.328 5.137 5 20 JKBD CSc1ccsc1C(=O)N1CCN(Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)CC1 409829596 PVFRKMJRXPDJSU-UHFFFAOYSA-N 459.618 5.065 5 20 JKBD COCCn1cc(NC(=O)c2c3c(nc4ccccc24)/C(=C/c2cccc([N+](=O)[O-])c2)CCC3)cn1 486665413 PKJXTOBRCLPBGI-XMHGGMMESA-N 483.528 5.115 5 20 JKBD O=C(c1cc([N+](=O)[O-])ccc1NCc1ccccc1)N1CCC(c2nc3ccccc3[nH]2)CC1 490769166 MWEFTFRNUREXJI-UHFFFAOYSA-N 455.518 5.103 5 20 JKBD Cc1nn(Cc2ccc(C(=O)Nc3ccccc3-c3nc4ccccc4[nH]3)cc2)c(C)c1[N+](=O)[O-] 499078525 UIXDCDUALDWPKA-UHFFFAOYSA-N 466.501 5.252 5 20 JKBD C[C@H]1C[C@H](C)CN(c2ccc(C(=O)Nc3cccc(NC(=O)c4ccoc4)c3)cc2[N+](=O)[O-])C1 499607176 XQECWOFWRIGRLH-IRXDYDNUSA-N 462.506 5.175 5 20 JKBD CCOc1ccc(C(=O)N(C)[C@@H]2CCSc3ccc(Br)cc32)cc1[N+](=O)[O-] 504641353 DUDPEXHHGFROIW-OAHLLOKOSA-N 451.342 5.065 5 20 JKBD Cc1ccc(-c2nc(NC(=O)c3ccc([N+](=O)[O-])cc3I)sc2C)cc1 508871325 PSKKWHOIMWNBOX-UHFFFAOYSA-N 479.299 5.192 5 20 JKBD COc1cc(CNCc2ccc([N+](=O)[O-])cc2)ccc1OCc1ccc(Br)cc1 513626874 FZCAENCIHGRVDL-UHFFFAOYSA-N 457.324 5.235 5 20 JKBD COc1ccc([C@H](NCc2ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])cc2)c2nccn2C)cc1 518770536 OXLGDRLIUGNUEZ-DEOSSOPVSA-N 478.936 5.662 5 20 JKBD Cc1cc(SC2CCCCC2)ccc1NC(=O)N1CCN(c2ccc([N+](=O)[O-])nc2)CC1 522131800 XGHHZCVRNDYKFE-UHFFFAOYSA-N 455.584 5.077 5 20 JKBD O=C(NCCCc1nc(-c2ccncc2)cs1)c1cc([N+](=O)[O-])ccc1Oc1ccccc1 524320317 FTYGRNZNTWLUNS-UHFFFAOYSA-N 460.515 5.268 5 20 JKBD O=C(CN1CCCCCC1)Nc1cccc(NCc2ccc(C(F)(F)F)cc2[N+](=O)[O-])c1 600854804 YMYDOVZLFKCUCT-UHFFFAOYSA-N 450.461 5.040 5 20 JKBD COc1cccc(N2CC[C@H](CNCc3cn(-c4ccccc4)nc3-c3ccc([N+](=O)[O-])cc3)C2)c1 608837867 SFKNBMJRBZJRLE-OAQYLSRUSA-N 483.572 5.072 5 20 JKBD COCCOc1cc([N+](=O)[O-])c(C(=O)N2CCCC[C@H]2c2ccccc2C(F)(F)F)cc1OC 608945396 LBKOZSSNRIFMKS-SFHVURJKSA-N 482.455 5.015 5 20 JKBD O=C(OCc1nnc(-c2c(Cl)cccc2Cl)o1)c1cc([N+](=O)[O-])ccc1Br 726642143 UPFYHCZHXYBJAP-UHFFFAOYSA-N 473.066 5.071 5 20 JKBD COc1ccc(OC)c(-c2nn(-c3ccccc3)cc2C(=O)Nc2ccc([N+](=O)[O-])c(Cl)c2)c1 727711883 NZYNRWQRFHNFLR-UHFFFAOYSA-N 478.892 5.370 5 20 JKBD C[C@H](OC(=O)c1csc(-c2cccc([N+](=O)[O-])c2)n1)C(=O)N[C@H](C)c1ccc2c(c1)CCCC2 747961696 IUPDPSSLMBKRBN-CVEARBPZSA-N 479.558 5.020 5 20 JKBD COc1ccc(COCc2cccc(NC(=O)c3cc([N+](=O)[O-])c(C)c([N+](=O)[O-])c3C)c2)cc1 748634223 WXQLBJIROCWTLB-UHFFFAOYSA-N 465.462 5.098 5 20 JKBD O=C1C[C@@H](C(=O)Nc2cc(Cl)c([N+](=O)[O-])cc2OCc2ccccc2)c2ccc(F)cc2N1 824659288 CHPQMEBWQFXZBT-MRXNPFEDSA-N 469.856 5.031 5 20 JKBD CC(C)(C)OC(=O)Nc1ccc(CC(=O)Oc2ccc(NC(=O)c3cccc([N+](=O)[O-])c3)cc2)cc1 907255324 XMWIETLVIUSQOJ-UHFFFAOYSA-N 491.500 5.342 5 20 JKBD O=[N+]([O-])c1ccc(/C(O)=C(/C(=S)N[C@H]2C[C@H]3CC[C@H]2C3)[n+]2ccc(Cc3ccccc3)cc2)cc1 912842794 FKKYUPWYRWKYLQ-RSEQLOHWSA-O 486.617 5.463 5 20 JKBD O=C(Cc1ccc(Br)cc1)Nc1cccc(C(=O)Nc2cc([N+](=O)[O-])c(F)cc2F)c1 915284111 JXOPNNPBNQHJCC-UHFFFAOYSA-N 490.260 5.069 5 20 JKBD CCCOc1c(Br)cc(/C=C\c2ccnc(-c3cccc([N+](=O)[O-])c3)[n+]2[O-])cc1OC 915988203 RZHSQFOMILJPGJ-FPLPWBNLSA-N 486.322 5.021 5 20 JKBD CC(C)n1ncc2c(C(=O)OCC(=O)Nc3cc(Cl)ccc3[N+](=O)[O-])cc(-c3ccccc3)nc21 916533039 CLNDLUIEMNDUJZ-UHFFFAOYSA-N 493.907 5.036 5 20 JKBD O=C(/C=C/c1ccc([N+](=O)[O-])o1)Nc1ccc(C2(NC(=O)c3cc4ccccc4o3)CCC2)cc1 1786207361 DRDQHURFSJZIFA-ZRDIBKRKSA-N 471.469 5.395 5 20 JKBD Cc1cc(O)c([N+](=O)[O-])cc1C(=O)NC1(c2ccc(NC(=O)c3ccnc(C(F)F)c3)cc2)CCC1 1787018568 YXXYLQRDMMVIRY-UHFFFAOYSA-N 496.470 5.003 5 20 JKBD COc1ccc(Cl)cc1C(=O)NC1(c2ccc(NC(=O)c3ccc(O)c([N+](=O)[O-])c3)cc2)CCC1 1790618813 KHEOTUBAOSYOQR-UHFFFAOYSA-N 495.919 5.024 5 20 JKBD Cc1ncc(/C=C/C(=O)Nc2ccc(C3(NC(=O)CCc4cccc([N+](=O)[O-])c4)CCC3)cc2)s1 1791956969 VBGCARCILSRZGK-ACCUITESSA-N 490.585 5.140 5 20 JKBD Cc1c(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)[C@H](c2ccccc2)C(C)C)cc(Cl)cc1[N+](=O)[O-] 1793208850 WUTXEXFHAYCOOZ-XARGGIHNSA-N 483.996 5.248 5 20 JKBD C/C(=C\c1cccs1)C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2ccc([N+](=O)[O-])cc2F)CC1 1823718295 CMKBHVTUBJYLSB-GGJDQLKOSA-N 485.581 5.132 5 20 JKBD CC[C@H](C)c1ccccc1NC(=O)[C@@H](C)OC(=O)Cn1c2ccccc2c(=O)c2ccccc21 10722838 NOTAMPOOXPBJGA-RBUKOAKNSA-N 456.542 5.239 5 20 JKBD C[C@H](OC(=O)c1cc(-c2ccco2)nc2ccccc12)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 11398479 NLRINNYIVUAZEP-ZDUSSCGKSA-N 499.401 5.606 5 20 JKBD CCOC(=O)c1c(NC(=O)c2ccc([N+](=O)[O-])c(C)c2)sc(C(=O)Nc2ccc(C)cc2C)c1C 14862878 ARQWXDVZODKYLO-UHFFFAOYSA-N 495.557 5.571 5 20 JKBD COc1cc(/C=C2\CCn3c2nc2cc(Cl)ccc2c3=O)ccc1OCc1ccc([N+](=O)[O-])cc1 16385931 LUGWQJHDROVESX-LDADJPATSA-N 489.915 5.490 5 20 JKBD CCOc1ccc([C@@H](CNC(=O)c2ccccc2[N+](=O)[O-])c2c[nH]c3ccccc23)cc1OC 24113567 XZGRDHHFFOKHEX-HXUWFJFHSA-N 459.502 5.045 5 20 JKBD O=C(NC[C@H]1CCCO1)Nc1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2Sc2ccccc2)cc1 26834648 SFTOLPDFUDVRAV-HXUWFJFHSA-N 492.557 5.299 5 20 JKBD COc1cc(C(=O)Nc2cccc(NC(=O)C(C)C)c2)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 31919087 MSNWSCXQRJXDDB-UHFFFAOYSA-N 483.908 5.896 5 20 JKBD CC1CCN(c2ccc(C(=O)Nc3cc(Cl)ccc3OC[C@H]3CCCO3)cc2[N+](=O)[O-])CC1 72023642 REINWSUOHQQMCO-LJQANCHMSA-N 473.957 5.295 5 20 JKBD CN(Cc1csc2ccccc12)C(=O)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 302988569 WYKAFRPOBMPKFC-UHFFFAOYSA-N 477.508 5.703 5 20 JKBD O=C(Nc1c2c(nn1-c1ccccc1)CCC2)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 478061980 MQYCHHXMJTVASE-UHFFFAOYSA-N 499.493 5.143 5 20 JKBD O=C(C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)N1CCC[C@@H]1c1ccncc1 485475590 NVKWLNQUFAJTRQ-VUHHOQONSA-N 470.554 5.894 5 20 JKBD Cc1nc(CSc2ccc(C(=O)Nc3cc(-c4cccc([N+](=O)[O-])c4)[nH]n3)cc2)cs1 499060809 ZTXTXWQHDKVLTB-UHFFFAOYSA-N 451.533 5.294 5 20 JKBD CC[C@@H](C)Sc1ccc(NC(=O)CSc2ccc(C(N)=O)cc2[N+](=O)[O-])c(C(F)(F)F)c1 499576205 XBEHBFCHVONFQO-LLVKDONJSA-N 487.525 5.334 5 20 JKBD O=C(CNC(=O)NCc1ccc([N+](=O)[O-])cc1)Nc1ccccc1-c1ccc(-c2ccccc2)cc1 500933341 JHOROWOZNOYLMT-UHFFFAOYSA-N 480.524 5.367 5 20 JKBD O=C1COc2cc(NC(=O)c3ccc(NCc4ccccc4Cl)c([N+](=O)[O-])c3)c(Cl)cc2N1 505695413 OWLPNMCIPYCUGB-UHFFFAOYSA-N 487.299 5.097 5 20 JKBD C[C@H](Nc1ccc(C(=O)N(C2CC2)[C@H](C)c2ccc(Cl)cc2)cc1[N+](=O)[O-])c1ccccn1 509245892 HORVXHNMNGNJLD-DLBZAZTESA-N 464.953 6.182 5 20 JKBD C[C@H](NC(=O)Nc1ccc(C(=O)N(C)C2CCCCC2)c(Cl)c1)c1cccc([N+](=O)[O-])c1 511070945 YEELTXGBSSYBFI-HNNXBMFYSA-N 458.946 5.536 5 20 JKBD COc1cc(C(=O)Nc2cc(C(=O)Nc3cccc(C(F)(F)F)c3)ccc2C)ccc1[N+](=O)[O-] 513765743 IZTOJMVKFSOIAP-UHFFFAOYSA-N 473.407 5.435 5 20 JKBD COCCCOc1ccccc1NC(=O)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1 514229305 BYZQVKYYKZWTQK-UHFFFAOYSA-N 456.882 5.708 5 20 JKBD C[C@@H](Nc1ccc(C(=O)Nc2cc(C(C)(C)C)nn2-c2ccccn2)cc1[N+](=O)[O-])c1ccccn1 518126786 IYEYYHRWSNEIAD-QGZVFWFLSA-N 485.548 5.293 5 20 JKBD COc1cc(/C=C(/CC(=O)O)c2nc3ccccc3s2)c([N+](=O)[O-])cc1OCC(F)(F)F 519054336 NVLFSGQNOOQZTN-SDQBBNPISA-N 468.409 5.170 5 20 JKBD Cc1ccc(C(C)C)c(Oc2ccc(CNC3CCN(C(=O)c4ccco4)CC3)cc2[N+](=O)[O-])c1 520952263 KLMLJVFHLUWGBB-UHFFFAOYSA-N 477.561 5.806 5 20 JKBD O=C(Nc1ccc(NC(=O)c2ccn(-c3cccc([N+](=O)[O-])c3)n2)c(C(F)(F)F)c1)c1ccccc1 603742816 AOWKZWAQTDMOBL-UHFFFAOYSA-N 495.417 5.304 5 20 JKBD CCOc1cc(C(=O)Nc2sc3c(c2C(=O)OC(C)C)CC[C@H](C)C3)c([N+](=O)[O-])cc1OC 603761513 KRGSMQGDZBAXMS-ZDUSSCGKSA-N 476.551 5.006 5 20 JKBD Cc1ccc([N+](=O)[O-])cc1Oc1nc(CN2CCOCC2)nc2scc(-c3ccccc3)c12 603863348 IJTQPSSZIJUFPI-UHFFFAOYSA-N 462.531 5.199 5 20 JKBD Cc1csc(Sc2ccc(NC(=O)c3ccc(Sc4nncn4C)c([N+](=O)[O-])c3)cc2)n1 604113877 JKTMRXYWWUGKBC-UHFFFAOYSA-N 484.588 5.043 5 20 JKBD O=C(c1ccc(C(=O)N(Cc2ccccc2)C2CC2)c([N+](=O)[O-])c1)N(Cc1ccccc1)C1CC1 609043804 UHVBFBGBKCSYNU-UHFFFAOYSA-N 469.541 5.204 5 20 JKBD O=C(c1ccc(NCc2ccccc2)c([N+](=O)[O-])c1)N1CCC(c2nc(-c3ccccc3)no2)CC1 609143539 OVXAXXVWLLIUOL-UHFFFAOYSA-N 483.528 5.277 5 20 JKBD COc1ccccc1CCN(C)C(=O)C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1 609182340 PVMNWHNLXRIRQB-HEHNFIMWSA-N 487.581 5.845 5 20 JKBD O=C(c1cc2ccccc2c2cccnc12)N1CCC[C@@H](c2nnc3ccc(C(F)(F)F)cn23)C1 613609911 KITCIOUWHTZVRK-QGZVFWFLSA-N 475.474 5.469 5 20 JKBD C[C@H](OC(=O)[C@@H](C)SCc1nc(O)c2c(-c3ccccc3)csc2n1)c1cccc([N+](=O)[O-])c1 729758372 ITZHXRVSGJYDGH-LSDHHAIUSA-N 495.582 5.898 5 20 JKBD CC(C)Cc1ccc([C@@H](NC(=O)CNC(=O)c2c(Cl)cccc2[N+](=O)[O-])c2cccs2)cc1 731051015 UDONVVVBHZNDGL-HSZRJFAPSA-N 485.993 5.144 5 20 JKBD O=C(OCC(=O)N(c1ccccc1)C1CCCCC1)c1csc(-c2ccc([N+](=O)[O-])cc2)n1 747956250 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O=C(NCc1nc(Cc2ccccc2)no1)c1cc([N+](=O)[O-])ccc1Sc1ccc(Cl)cc1 921040063 KVBVXTKDKLZQKE-UHFFFAOYSA-N 480.933 5.303 5 20 JKBD Cc1nc(C)c(C(=O)NC2(c3ccc(NC(=O)CCc4cccc([N+](=O)[O-])c4)cc3)CCC2)s1 1786601605 BDUVKQBXFJJMLH-UHFFFAOYSA-N 478.574 5.049 5 20 JKBD O=C(/C=C/c1ccccc1[N+](=O)[O-])Nc1ccc(C2(NC(=O)c3ccc4c(c3)COC4)CCC2)cc1 1792317872 WBQBJBAVFPDZEN-MDWZMJQESA-N 483.524 5.086 5 20 JKBD O=C(/C=C/c1ccc([N+](=O)[O-])o1)N1CCCC2(CCN(C(=O)c3c(Cl)cccc3Cl)CC2)C1 1805682701 BOHPDIOKIGTIIW-FNORWQNLSA-N 492.359 5.053 5 20 JKBD CC(C)[C@H]1CC[C@H](C(=O)Nc2cc([C@@H]3CCCCN3C(=O)Cc3cccc([N+](=O)[O-])c3)[nH]n2)CC1 1822100695 QUJFMNXXOOMPPH-JTAQYXEDSA-N 481.597 5.015 5 20 JKBD CC1(C)CCC(CC(=O)N2CCCC[C@H]2C2CCN(C(=O)/C=C/c3ccc([N+](=O)[O-])o3)CC2)CC1 1830422001 RBGDFLHRSCXGQR-DRGXBFSJSA-N 485.625 5.427 5 20 JKBD Cc1oc(C(C)(C)C)cc1C(=O)N1CCC([C@H]2CCCCN2C(=O)c2ccc([N+](=O)[O-])cc2F)CC1 1830493984 SIISLDUOCFXWCI-HSZRJFAPSA-N 499.583 5.480 5 20 JKBD O=C(/C=C/c1cccs1)N1CCC([C@@H]2CCCCN2C(=O)CSc2ccccc2[N+](=O)[O-])CC1 1831776717 WUABFCSPNCWSJJ-ZJVMWOEPSA-N 499.658 5.082 5 20 JKBD CC(=O)N(c1ccc(Cl)c(Cl)c1)c1nc(COC(=O)COc2ccc([N+](=O)[O-])cc2)cs1 9606300 OMTGSZLJDQUZRS-UHFFFAOYSA-N 496.328 5.165 5 20 JKBD COC(=O)c1sc2nc(/C(Cl)=C/c3ccc(-c4ccccc4[N+](=O)[O-])s3)[nH]c(=O)c2c1C 11298066 OWVVIGSLCTWNTJ-LCYFTJDESA-N 487.946 5.453 5 20 JKBD O=C(Nc1ccc(OC(=O)c2ccc(F)cc2Br)cc1)c1cc([N+](=O)[O-])ccc1Cl 15600310 PRADLEVIPQFCHI-UHFFFAOYSA-N 493.672 5.621 5 20 JKBD CCCn1c(S[C@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)nnc1-c1cccc(C)c1 17706580 CXZRDITTYBBZMX-OAHLLOKOSA-N 450.524 5.475 5 20 JKBD COc1ccccc1Nc1nnc(S[C@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2C(F)(F)F)s1 21353525 CANDUEMAUMDSEY-SNVBAGLBSA-N 499.496 5.337 5 20 JKBD O=C(O[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Br)c1ccccc1)c1ccc(F)c(F)c1 22430248 CFQWPSRMNDICMQ-IBGZPJMESA-N 491.244 5.172 5 20 JKBD Cc1ccc(Nc2nnc(S[C@H](C)c3nnc(-c4ccc([N+](=O)[O-])cc4)o3)s2)cc1Cl 24506651 FTPDOYZMEPIJPI-LLVKDONJSA-N 474.955 6.055 5 20 JKBD O=C(Oc1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2Cl)cc1)c1cccc(OC[C@H]2CCCO2)c1 26365499 FFPRJKWXGKNPPD-OAQYLSRUSA-N 496.903 5.278 5 20 JKBD CC(=O)Nc1cc(NC(=O)c2ccc(NCc3ccccc3Cl)c([N+](=O)[O-])c2)ccc1F 105642243 PTYNVNSAPHYENS-UHFFFAOYSA-N 456.861 5.210 5 20 JKBD O=[N+]([O-])c1ccc(-c2noc(CSc3nnc(-c4c[nH]c5ccccc45)n3C3CC3)n2)cc1 107674161 AAIIUUWDCDZHEY-UHFFFAOYSA-N 459.491 5.012 5 20 JKBD C[C@@H](Nc1ccc(C(=O)N2CCC(c3cc4ccccc4[nH]3)CC2)cc1[N+](=O)[O-])c1ccccn1 109348354 OJPSBSCLMGBWIN-GOSISDBHSA-N 469.545 5.664 5 20 JKBD C[C@H](Nc1ccc(C(=O)Nc2ccc3c(c2)nc2n3CCCCC2)cc1[N+](=O)[O-])c1ccccn1 195602604 QWUHWCXBQQZYQD-KRWDZBQOSA-N 470.533 5.491 5 20 JKBD O=C(C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)NC1CCN(c2ccccn2)CC1 478774505 RDBVMJMPTXEGNO-LVZFUZTISA-N 499.596 5.315 5 20 JKBD COc1ccc([C@@H](NC(=O)c2cc(SC)ccc2[N+](=O)[O-])c2ccccc2)cc1Br 485476021 XZRHCWFIVFETPV-NRFANRHFSA-N 487.375 5.607 5 20 JKBD CCOc1cc(NC(=O)CSCc2ccc(Br)cc2)c([N+](=O)[O-])cc1OCC 501219793 WQNXYGGBIUBFSH-UHFFFAOYSA-N 469.357 5.027 5 20 JKBD CC[C@@H](C)NC(=O)c1ccc(NC(=O)Cc2cn(-c3ccccc3)nc2-c2ccc([N+](=O)[O-])cc2)cc1 507857866 BFCQFTZHZORQCV-LJQANCHMSA-N 497.555 5.157 5 20 JKBD COc1ccc(CNCc2cccc(Br)c2)cc1OCc1ccc([N+](=O)[O-])cc1 507945477 LYBGUWGJAAWOLN-UHFFFAOYSA-N 457.324 5.235 5 20 JKBD COc1cccc([C@H](C)N[C@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Br)c2ccccc2)c1 511014593 MSERGHPFFUEAOQ-NYHFZMIOSA-N 484.350 5.397 5 20 JKBD CC(=O)Nc1cccc(-n2c(SCc3cc([N+](=O)[O-])ccc3OC(C)C)nnc2C2CC2)c1 511059141 XZOATFUOKDIBQL-UHFFFAOYSA-N 467.551 5.091 5 20 JKBD Cn1cccc1[C@H]1CCCCCN1C(=O)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 512563701 GQVJBFWRMCMIGL-OAQYLSRUSA-N 478.515 5.312 5 20 JKBD C[C@@H]1CCCCN1C(=O)c1ccc(NC(=O)c2ccc(NC3CC3)c([N+](=O)[O-])c2)cc1Cl 603986519 DTBDDEOCSAFGGL-CQSZACIVSA-N 456.930 5.089 5 20 JKBD O=C(c1c2c(nc3ccccc13)/C(=C\c1ccc([N+](=O)[O-])cc1)CCC2)N1CC[C@H](N2CCCC2)C1 608906287 WFXCOPNZJGPXEW-YIUMPIMRSA-N 482.584 5.330 5 20 JKBD CCOc1ccc([C@@H]2CCCN2C(=O)CSc2nc3cc4ccccc4cc3c(=O)n2CC)cc1 613973474 ZIJQOCWDVCFZPB-VWLOTQADSA-N 487.625 5.424 5 20 JKBD C[C@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)OCc1nnc(-c2c(Cl)cccc2Cl)o1 726639553 ZOLQFTMTLRSKPM-VIFPVBQESA-N 472.668 5.116 5 20 JKBD Cc1nnc(SCc2c(C(=O)Nc3ccc([N+](=O)[O-])c(Cl)c3)oc3ccccc23)s1 727711495 IEUXQAHJVMMTNB-UHFFFAOYSA-N 460.924 5.699 5 20 JKBD O=C(Nc1ccc(CC[C@H](O)c2ccccc2)cc1)C1CCN(c2ccccc2[N+](=O)[O-])CC1 727762820 HSIQLTRKNQNFRX-SANMLTNESA-N 459.546 5.116 5 20 JKBD CCOc1cc(C(=O)Nc2sc(C)c(-c3ccccc3)c2C(=O)OC(C)C)c([N+](=O)[O-])cc1OC 913193538 POIYPWMZRBZJJS-UHFFFAOYSA-N 498.557 5.857 5 20 JKBD Cc1ccccc1-n1ncc(C(=O)O[C@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)c1C(F)(F)F 914984374 IKTZXTHIYSMRIF-CYBMUJFWSA-N 487.394 5.076 5 20 JKBD COc1ccc2c(ccn2CC(=O)O[C@@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2ccccc2)c1 915592209 DQRPHPZDTCPJKN-XMMPIXPASA-N 493.903 5.135 5 20 JKBD Cc1ccc(N2C(=O)/C(=C\c3cn(C)nc3-c3ccc([N+](=O)[O-])cc3)c3ccccc3C2=O)cc1 920397770 PMNSNHGEFSQGIG-IWIPYMOSSA-N 464.481 5.031 5 20 JKBD O=C(Cc1cccc([N+](=O)[O-])c1)NC1(c2ccc(NC(=O)C34CC(C(F)(F)F)(C3)C4)cc2)CCC1 1786459530 OYMFYHORXAWMIQ-UHFFFAOYSA-N 487.478 5.004 5 20 JKBD Cc1nc2ccncc2cc1C(=O)NC1(c2ccc(NC(=O)c3cccc(F)c3[N+](=O)[O-])cc2)CCC1 1790701421 REENBNFDSRAANH-UHFFFAOYSA-N 499.502 5.047 5 20 JKBD O=C(NC1(c2ccc(NC(=O)[C@H]3C[C@@H]3c3ccccc3)cc2)CCC1)c1cc([N+](=O)[O-])cc2c1OCC2 1791533982 PKMWOGIQWPIFAB-RPWUZVMVSA-N 497.551 5.081 5 20 JKBD Cc1c(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)Cc2ccc(C(C)C)cc2)cc(Cl)cc1[N+](=O)[O-] 1801858390 SFNGNVOPJUNMKM-KOUNCHBCSA-N 483.996 5.175 5 20 JKBD Cc1ccc([C@@H](C)C(=O)N2CCC3(CCCN(C(=O)Cc4ccc(Cl)cc4[N+](=O)[O-])C3)CC2)cc1 1805485409 USTUZLQFVGCJEJ-HXUWFJFHSA-N 498.023 5.134 5 20 JKBD CC(C)[C@@H](C(=O)N1CC2(CCCN2C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)C1)c1ccccc1 1845738195 JULVIZUWBJDFGB-HSZRJFAPSA-N 477.586 5.066 5 20 JKBD C[C@H](Sc1nnc(COc2ccccc2Cl)n1C1CC1)C(=O)Nc1ccc(F)c([N+](=O)[O-])c1 9414146 QFVDGMZNQOCTSM-LBPRGKRZSA-N 491.932 5.012 5 20 JKBD C[C@H](OC(=O)Cn1c2ccccc2c(=O)c2ccccc21)C(=O)Nc1ccc(Oc2ccccc2)cc1 14730493 ROTPLTPHSJINMV-FQEVSTJZSA-N 492.531 5.517 5 20 JKBD C[C@@H](OC(=O)c1nc(Cl)c(Cl)c(Cl)c1Cl)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 17661886 BVDXUPFARFZEDU-ZCFIWIBFSA-N 478.075 5.571 5 20 JKBD Cc1occc1-c1nnc(SCC(=O)Nc2ccc([N+](=O)[O-])cc2Cl)n1-c1ccccc1 21138645 WYASPAFMYWOQCY-UHFFFAOYSA-N 469.910 5.128 5 20 JKBD C[C@@H](Sc1ncnc2sc3c(c12)CCC3)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 21359207 MUKNAWDVUUWSDC-SECBINFHSA-N 468.482 5.226 5 20 JKBD C[C@@H](Sc1nc2cc3ccccc3cc2c(=O)n1C)C(=O)Nc1cc(Cl)ccc1Cl 24969946 SXVQMRSLNLIVHM-GFCCVEGCSA-N 458.370 5.513 5 20 JKBD C[C@@H](Sc1nnc2c(Cl)cc(C(F)(F)F)cn12)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl 36796061 ZWQCIKDDQHUSMQ-SSDOTTSWSA-N 480.255 5.082 5 20 JKBD Cc1c(C(=O)N2CC[C@H](C)Sc3ccc(C(F)(F)F)cc32)cc([N+](=O)[O-])cc1[N+](=O)[O-] 71972947 JALAREYGFGXQFK-JTQLQIEISA-N 455.414 5.361 5 20 JKBD C[C@H]1CN(C(=O)c2ccccc2NC(=O)c2ccc([N+](=O)[O-])cc2Cl)C[C@@H](c2ccccc2)O1 109046430 BYOYAVBTKNTFHZ-HJPURHCSSA-N 479.920 5.103 5 20 JKBD Cc1cc(C)n([C@@H](C)C(=O)Nc2ccc(NC(=O)CCCNc3ccc([N+](=O)[O-])cc3)cc2Cl)n1 109344911 YKCGPMBHDJRMGF-KRWDZBQOSA-N 498.971 5.092 5 20 JKBD O=C(Cn1c2ccccc2c(=O)c2ccccc21)NCCCOc1ccc(Cl)cc1Cl 109375635 AYGMARJGASPBDF-UHFFFAOYSA-N 455.341 5.047 5 20 JKBD C[C@@H]1CCC[C@@H](C)N1C(=O)c1cc(Cl)ccc1NC(=O)C1CCN(c2ccccc2[N+](=O)[O-])CC1 302990262 XHFJRLWZHZUIOI-QZTJIDSGSA-N 499.011 5.506 5 20 JKBD O=C(CSc1ccc(C(F)(F)F)cc1[N+](=O)[O-])Nc1ccccc1NC(=O)C[C@@H]1C=CCC1 303312814 PJKHEGOHDAFZRW-CQSZACIVSA-N 479.480 5.639 5 20 JKBD COc1cc(C(=O)N(Cc2ccco2)c2ccc(Cl)cc2)c([N+](=O)[O-])cc1OCc1cscn1 482625215 UQFQOELLONWCIJ-UHFFFAOYSA-N 499.932 5.732 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)N2CCC(c3nc4cc(Cl)ccc4o3)CC2)cc1SC 484592182 NKYDPBRUQVSEFF-UHFFFAOYSA-N 461.927 5.140 5 20 JKBD Cc1csc(Sc2ccc(C(=O)NC[C@@H]3CCCN(Cc4cccs4)C3)cc2[N+](=O)[O-])n1 492759047 WAEDMTJBXLCDKP-INIZCTEOSA-N 488.660 5.214 5 20 JKBD Cc1csc(Sc2ccc(C(=O)NCC(=O)Nc3cccc4ccccc34)cc2[N+](=O)[O-])n1 506571157 JWTOZQHVRHBWMO-UHFFFAOYSA-N 478.555 5.033 5 20 JKBD COCCn1ccc(NC(=O)c2c3c(nc4ccccc24)/C(=C\c2ccc([N+](=O)[O-])cc2)CCC3)n1 507148886 JKUITRCOEAFQTH-ZPHPHTNESA-N 483.528 5.115 5 20 JKBD O=C(c1c2c(nc3ccccc13)/C(=C/c1ccc([N+](=O)[O-])cc1)CCC2)N1CCCn2nccc21 509204676 VYVFFLIZWSIQAK-HTXNQAPBSA-N 465.513 5.267 5 20 JKBD O=[N+]([O-])c1cc(Cl)ccc1Oc1ccc(CNCc2ccc(N3CCCCC3)nc2)cc1 509609899 SVIOECWHUXSOBY-UHFFFAOYSA-N 452.942 5.716 5 20 JKBD O=C(Cc1ccc(NC(=O)c2cc3ccccc3o2)cc1)Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1 512354480 DHLLLVOWZUJHHJ-UHFFFAOYSA-N 498.520 5.898 5 20 JKBD O=C(c1ccn(-c2cccc([N+](=O)[O-])c2)n1)C(c1nc2ccccc2s1)c1nc2ccccc2s1 513696345 WXVULHWBSHIGKI-UHFFFAOYSA-N 497.561 6.015 5 20 JKBD CCCC(=O)Nc1cccc(CNC(=O)c2ccccc2C(=O)c2ccc(SC)c([N+](=O)[O-])c2)c1 516104994 WQGQWAGNCVJCLQ-UHFFFAOYSA-N 491.569 5.216 5 20 JKBD Cc1ccc(C(C)C)c(Oc2ccc(CNC3CCN(C(=O)c4ccoc4)CC3)cc2[N+](=O)[O-])c1 518269517 GPCQRSOWTXLUCC-UHFFFAOYSA-N 477.561 5.806 5 20 JKBD CC[C@@H](NC(=O)C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)c1nc(C)cs1 519122774 XAQUOWHNDKMQFA-LYPXWFNGSA-N 478.599 6.168 5 20 JKBD CN(C)CCn1ccc(NC(=O)c2c3c(nc4ccccc24)/C(=C/c2cccc([N+](=O)[O-])c2)CCC3)n1 523062437 HECCPBNRTYIJGT-LVZFUZTISA-N 496.571 5.030 5 20 JKBD COc1cc(C(=O)Nc2cccc3c2CN(CCC(C)C)C3)c([N+](=O)[O-])cc1OCc1cscn1 524378878 JMVCCIGTXXVIFJ-UHFFFAOYSA-N 496.589 5.253 5 20 JKBD CCCc1ccc([C@@H](NC(=O)c2cc(OC)c(OC(F)F)cc2[N+](=O)[O-])c2cccs2)cc1 585690176 UFBAITOVIPHSIL-OAQYLSRUSA-N 476.501 5.738 5 20 JKBD O=C(Cn1c2ccccc2c(=O)c2ccccc21)N1CCCC[C@H]1c1ccc(C(F)(F)F)cc1 588376724 QXTBGTGPLSPMPL-QFIPXVFZSA-N 464.487 5.927 5 20 JKBD O=C(C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)NCc1ccc(Cl)s1 603527931 GZHUIPXKIOXJJB-RVDMUPIBSA-N 469.975 6.167 5 20 JKBD O=C(Nc1nnc(SCc2ccc(F)cc2)s1)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-] 603727374 OHWBVQGMCGRWIB-UHFFFAOYSA-N 488.444 5.071 5 20 JKBD COc1cc(C(=O)Nc2nc(-c3ccc4c(c3)Cc3ccccc3-4)cs2)c([N+](=O)[O-])cc1OC 603966027 ZHCODFGEZQHWLT-UHFFFAOYSA-N 473.510 5.559 5 20 JKBD CCC(C)(C)NC(=O)c1ccc(NC(=O)c2ccc(N3CCC[C@H](C)C3)c([N+](=O)[O-])c2)cc1Cl 603987651 WDUQCCYQZUNEII-INIZCTEOSA-N 487.000 5.655 5 20 JKBD COc1ccc(NC(=O)CNc2ccccc2Oc2ncc(Cl)cc2Cl)c([N+](=O)[O-])c1 604010212 SNAWQEQMLULOAC-UHFFFAOYSA-N 463.277 5.148 5 20 JKBD CC[C@@H](NC(=O)c1ccccc1C(=O)c1ccc(SC)c([N+](=O)[O-])c1)c1nc(C)cs1 609191816 IRQXMHHIBMKBGS-QGZVFWFLSA-N 455.561 5.194 5 20 JKBD C[C@@H]1CSc2ccc(Br)cc2[C@H]1NC(=O)C1CCN(c2ccccc2[N+](=O)[O-])CC1 609192181 AVWKHUQSLABMFN-SZNDQCEHSA-N 490.423 5.173 5 20 JKBD COc1ccc(Oc2ccc([N+](=O)[O-])cc2C(=O)Nc2ccc(C)c(C(=O)NC(C)C)c2)cc1 609409543 VKVJCIZQIXEHKG-UHFFFAOYSA-N 463.490 5.095 5 20 JKBD O=C(NC1CCN(C(=O)c2ccccc2)CC1)c1cc([N+](=O)[O-])ccc1Sc1ccc(Cl)cc1 612978625 HMPVIZQGKUAURB-UHFFFAOYSA-N 495.988 5.434 5 20 JKBD Cc1c(NC(=O)[C@@H](C)OC(=O)c2cc(-c3ccco3)nc3onc(C(C)C)c23)cccc1[N+](=O)[O-] 727920545 XNUZVIQQLRKNHQ-CQSZACIVSA-N 478.461 5.007 5 20 JKBD CCN(CC)C(=O)c1ccc(C(=O)Oc2ccc(NC(=O)c3cc([N+](=O)[O-])ccc3Cl)cc2)cc1 729167458 KYQNNUHZYSTBNX-UHFFFAOYSA-N 495.919 5.202 5 20 JKBD COc1cc(C(=O)Nc2ccc(NC(=O)OC(C)(C)C)cc2C(F)(F)F)ccc1[N+](=O)[O-] 729654532 BOVVJGBBLIIJRU-UHFFFAOYSA-N 455.389 5.222 5 20 JKBD CC(C)(C)OC(=O)Nc1ccc(NC(=O)c2cc3cc([N+](=O)[O-])ccc3o2)c(C(F)(F)F)c1 729655067 KTYGCLUCBHMOKC-UHFFFAOYSA-N 465.384 5.959 5 20 JKBD Cc1ccc(-c2nnc([C@H](C)OC(=O)c3ccc(N4CCC(C)CC4)c([N+](=O)[O-])c3)o2)cc1 745929876 JSKSBVVVYXJGBV-KRWDZBQOSA-N 450.495 5.108 5 20 JKBD CCc1nc(C)c(C(=O)O[C@@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2ccccc2)s1 747950530 KPMMDRFKDAWBJP-GOSISDBHSA-N 459.911 5.112 5 20 JKBD C[C@@H](OC(=O)c1csc(-c2ccc([N+](=O)[O-])cc2)n1)C(=O)Nc1ccc(Cl)c(Cl)c1 747958383 IWNMFVMIXAMTQJ-SNVBAGLBSA-N 466.302 5.209 5 20 JKBD O=C(NCCNc1ccc(C(F)(F)F)cc1[N+](=O)[O-])Nc1cccc(C2SCCS2)c1 915331918 TVHMUSPYIWIZNQ-UHFFFAOYSA-N 472.514 5.326 5 20 JKBD CCOc1ccc(N2C(=S)N[C@H](c3ccc([N+](=O)[O-])cc3)C(C(=O)Nc3ccccc3)=C2C)cc1 916170140 IMQIJENTUIKFMM-XMMPIXPASA-N 488.569 5.342 5 20 JKBD Cc1cnn(-c2ccc(C(=O)O[C@@H](C(=O)Nc3ccc([N+](=O)[O-])cc3Cl)c3ccccc3)cc2)c1 917288024 MUJNRVUGTDROAV-HSZRJFAPSA-N 490.903 5.279 5 20 JKBD O=C(CSc1ccc(C(F)(F)F)cc1[N+](=O)[O-])Nc1cccc(-c2cn3c(n2)CCCC3)c1 917498555 BAAKDLMJAFBSAL-UHFFFAOYSA-N 476.480 5.544 5 20 JKBD C[C@@H](NC(=O)c1ccccc1SCC(=O)NC1CCCCCCC1)c1cccc([N+](=O)[O-])c1 917701965 SDQKQIXQWWLAPT-GOSISDBHSA-N 469.607 5.407 5 20 JKBD COc1ccc([N+](=O)[O-])c(C(=O)OCc2csc(N(C(C)=O)c3ccc(Cl)c(Cl)c3)n2)c1 920704798 JZVKHCGELMHXNX-UHFFFAOYSA-N 496.328 5.408 5 20 JKBD O=C(Cc1cc(F)ccc1[N+](=O)[O-])NC1(c2ccc(NC(=O)[C@@H]3CCCCC3(F)F)cc2)CCC1 1786467036 KTVXGNBHDJIHRI-FQEVSTJZSA-N 489.494 5.236 5 20 JKBD O=C(CCc1cccc([N+](=O)[O-])c1)Nc1ccc(C2(NC(=O)c3nccc4occc34)CCC2)cc1 1786600488 WDLIGWAHWFAHSW-UHFFFAOYSA-N 484.512 5.117 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)c3nc4cc([N+](=O)[O-])ccc4[nH]3)CCC2)cc1)c1ccc2cc[nH]c2c1 1788913393 AANFCAZNVOTJOV-UHFFFAOYSA-N 494.511 5.014 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)C3CC4(CCC4)C3)CCC2)cc1)c1cc(F)cc([N+](=O)[O-])c1 1790700303 YYJHLHRTFIWYKI-UHFFFAOYSA-N 451.498 5.062 5 20 JKBD Cc1c(C(=O)Nc2ccc(C3(NC(=O)C[C@@H]4CCCCO4)CCC3)cc2)cc(Cl)cc1[N+](=O)[O-] 1790773615 DHFIFLVKTKHWOA-FQEVSTJZSA-N 485.968 5.264 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)[C@H]3CCCCO3)CCC2)cc1)c1cc2cc([N+](=O)[O-])ccc2s1 1791008292 CBHHXFQOVJIJOA-HXUWFJFHSA-N 479.558 5.126 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)C3(c4cccc([N+](=O)[O-])c4)CCC3)CCC2)cc1)[C@H]1[C@H]2SC=C[C@H]21 1791093623 XURVYZWKVSSURG-ZRBLBEILSA-N 489.597 5.026 5 20 JKBD O=C(/C=C/c1ccccc1[N+](=O)[O-])Nc1ccc(C2(NC(=O)c3cnccc3Cl)CCC2)cc1 1792317833 RFNWCLVNJIWKAU-IZZDOVSWSA-N 476.920 5.104 5 20 JKBD O=C(/C=C/C1CCCCC1)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc2cc([N+](=O)[O-])ccc2s1 1801207262 RKJSVGLHQWRSCH-NWKATUPTSA-N 467.591 5.198 5 20 JKBD CC(C)[C@@H](C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2ccc([N+](=O)[O-])o2)n[nH]1)c1ccc(Cl)cc1 1814311349 GFUUSNOAHPAHEY-PGRDOPGGSA-N 499.955 5.310 5 20 JKBD CC1(C)CCC(CC(=O)N2CCC([C@H]3CCCCN3C(=O)/C=C/c3ccc([N+](=O)[O-])o3)CC2)CC1 1824276364 SMVGCIQCEHSPOS-AVAOGFIGSA-N 485.625 5.427 5 20 JKBD C[C@H](C(=O)N1CCC([C@H]2CCCCN2C(=O)CCc2cccc([N+](=O)[O-])c2)CC1)c1cccs1 1824842968 LNXZIGGAQJWQMI-WMZHIEFXSA-N 483.634 5.012 5 20 JKBD O=C(Cc1cc([N+](=O)[O-])ccc1F)N1CCC([C@@H]2CCCCN2C(=O)c2cc3ccoc3s2)CC1 1827407283 MEZKNMFFSALMDS-NRFANRHFSA-N 499.564 5.018 5 20 JKBD CSc1ccc([N+](=O)[O-])c(C(=O)Nc2cccc(C(=O)N3CCc4sccc4C3)c2C)c1 26049045 FXKLLLBUOUJXBN-UHFFFAOYSA-N 467.572 5.137 5 20 JKBD O=C(Cc1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1)Nc1cccc(OC[C@H]2CCCO2)c1 31265821 VMWCOQQGPTWXBV-AREMUKBSSA-N 498.539 5.187 5 20 JKBD CCN(C(=O)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])c(OC)c1)c1nc2ccccc2s1 39515876 PYCBYEWTLFLFID-UHFFFAOYSA-N 483.933 6.326 5 20 JKBD C[C@@H](Nc1ccc(C(=O)Nc2ccc(Nc3ccccc3)nc2)cc1[N+](=O)[O-])c1ccccn1 60336486 BTNGGNCSURHQAL-QGZVFWFLSA-N 454.490 5.554 5 20 JKBD Cc1ccccc1CN(Cc1cccnc1)C(=O)CSc1ccc(C(F)(F)F)cc1[N+](=O)[O-] 68749806 KCALKVWBELIDNF-UHFFFAOYSA-N 475.492 5.638 5 20 JKBD Cc1nn(Cc2ccc(C(=O)N[C@H](C)c3cccc(NC(=O)c4ccccc4)c3)cc2)c(C)c1[N+](=O)[O-] 69605923 OBBPGEDLUIMPCP-GOSISDBHSA-N 497.555 5.200 5 20 JKBD Cc1ccc([N+](=O)[O-])cc1NC(=O)CSc1nnc(Nc2ccc(SC(F)F)cc2)s1 104589582 XJSRMPNKIJROEQ-UHFFFAOYSA-N 483.547 5.544 5 20 JKBD Cc1ccc(-c2csc(N(C(=O)Cn3cc([N+](=O)[O-])ccc3=O)c3cc(C)ccc3C)n2)cc1 109706208 YQEUTADAPHDVGF-UHFFFAOYSA-N 474.542 5.170 5 20 JKBD COc1cc(CN[C@H](C)c2nc(-c3ccccc3)cs2)ccc1OCc1ccc([N+](=O)[O-])cc1 501352044 QWQUWXWBXZWRBH-GOSISDBHSA-N 475.570 6.157 5 20 JKBD CCOc1cc(C(=O)Nc2ncc(Cc3ccc(Cl)cc3C)s2)c([N+](=O)[O-])cc1OC 502559463 NHRGCDMZKHEUQU-UHFFFAOYSA-N 461.927 5.264 5 20 JKBD CC(C)N(Cc1ccc(-c2ccc(F)cc2)s1)C(=O)CSc1ccc(C(N)=O)cc1[N+](=O)[O-] 510161898 YSFBIOMXTGQZBL-UHFFFAOYSA-N 487.578 5.091 5 20 JKBD C[C@H]1CCCCN1CCCNC(=O)C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1 518747919 QCSSLUATHFDFNR-MXTRNAPSSA-N 478.618 5.516 5 20 JKBD CC[C@@H](NCc1ccc(Sc2ccc(C)cc2)c([N+](=O)[O-])c1)c1nnc2n1CCCCC2 520963566 RKSFAVOZFPVCNJ-HXUWFJFHSA-N 451.596 5.613 5 20 JKBD O=C(Nc1nc(C2CC2)c(Cc2cccc(C(F)(F)F)c2)s1)c1cc2c(cc1[N+](=O)[O-])OCO2 522376895 KJKVGKZKESBXHV-UHFFFAOYSA-N 491.447 5.519 5 20 JKBD C[C@@H]1CCCN(c2ccc(C(=O)N3CCC(c4nc5cc(Cl)ccc5o4)CC3)cc2[N+](=O)[O-])C1 603921794 NUPQZGXTUHZURO-MRXNPFEDSA-N 482.968 5.646 5 20 JKBD COc1cc(C(=O)Nc2nc(C)c(Cc3cccc(Cl)c3)s2)c([N+](=O)[O-])cc1OC(F)F 603973650 XJUBVCGZRNRNDD-UHFFFAOYSA-N 483.880 5.466 5 20 JKBD Cc1csc(Sc2ccc(NC(=O)C3CCN(c4ccccc4[N+](=O)[O-])CC3)cc2)n1 604114001 VQNMLNXELSULRP-UHFFFAOYSA-N 454.577 5.366 5 20 JKBD COc1ccc([C@H](NC(=O)c2ccc(N[C@@H](C)c3ccccn3)c([N+](=O)[O-])c2)c2ccccc2)cc1 604296272 MTLPAQPHLAFMJM-UZTOHYMASA-N 482.540 5.691 5 20 JKBD CN(C[C@H]1CCCO[C@H]1c1ccccc1)C(=O)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1 604519246 WKNMMEZXXMCVGM-NLFFAJNJSA-N 480.948 6.280 5 20 JKBD NC(=O)c1ccc(NC(=O)c2c3c(nc4ccccc24)/C(=C/c2cccc([N+](=O)[O-])c2)CCC3)cc1F 608850400 IRAAXKGFYGQYCV-GHRIWEEISA-N 496.498 5.510 5 20 JKBD CC(C)N1CCCN(C(=O)C/C(=C\c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)CC1 609035899 FSWRLYULWPRSSR-CAPFRKAQSA-N 464.591 5.078 5 20 JKBD CCOc1cc([N+](=O)[O-])c(C(=O)Nc2ccc(Sc3ccc(OC)cc3)cc2)cc1OC 609103439 AEOXMKZNQDFXRV-UHFFFAOYSA-N 454.504 5.414 5 20 JKBD COc1ccccc1[C@@H](NC(=O)c1ccc(N[C@H](C)c2ccccn2)c([N+](=O)[O-])c1)c1ccccc1 609373910 AGZQFZTYFWXCDP-WINIVTDRSA-N 482.540 5.691 5 20 JKBD CCOC(=O)c1sc(-c2ccc3c(c2)OCO3)cc1NC(=O)c1cc(SC)ccc1[N+](=O)[O-] 612735763 BMNBGZUZGORHMZ-UHFFFAOYSA-N 486.527 5.203 5 20 JKBD CC(C)(C)OC(=O)NC[C@H]1CCN(C(=O)c2ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])cc2)C1 725734420 RIWGBNSVWCTMJJ-OAHLLOKOSA-N 475.929 5.027 5 20 JKBD COc1cc(C(=O)NCc2ccc([C@@H](C)O)cc2)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 726195558 UMQVJXDHZYCWCQ-CQSZACIVSA-N 456.882 5.032 5 20 JKBD O=C(Nc1ccccc1C(=O)NCc1cccc(OCC(F)F)c1)c1ccc([N+](=O)[O-])cc1Cl 726548039 JOPNZAIXLYSYGE-UHFFFAOYSA-N 489.862 5.074 5 20 JKBD CCc1cc[n+](/C(C(=S)Nc2ccc(OC(C)C)cc2)=C(/O)c2cccc([N+](=O)[O-])c2)cc1 726573771 GGQMRVSNDREYFK-UHFFFAOYSA-O 464.567 5.555 5 20 JKBD COc1ccc(NC(=S)/C(=C(/O)c2ccc(C)c([N+](=O)[O-])c2)[n+]2cccc(C)c2)cc1Cl 726962546 PNZGDEWYBCXYGW-UHFFFAOYSA-O 470.958 5.484 5 20 JKBD Cc1ccc(NC(=O)c2cccc(OC(=O)Cn3c4ccccc4c(=O)c4ccccc43)c2)cc1 727328382 VDHHFMSUWTZRAJ-UHFFFAOYSA-N 462.505 5.321 5 20 JKBD Cc1nc(CSc2ccc(C(=O)N(CC3CC3)c3ccc(Cl)c([N+](=O)[O-])c3)cc2)cs1 728166223 WQDMYOJQUHEOGI-UHFFFAOYSA-N 474.007 6.362 5 20 JKBD O=C(COC(=O)[C@@H]1C[C@H]1c1ccc(Cl)cc1Cl)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 730610391 BWEQLFSPNKVHNU-QWHCGFSZSA-N 477.222 5.206 5 20 JKBD COc1ccccc1C(C)(C)CNC(=O)c1ccccc1NC(=O)c1ccc([N+](=O)[O-])cc1Cl 745154920 ANZBRJFTYMLHSJ-UHFFFAOYSA-N 481.936 5.217 5 20 JKBD Cc1ccc(NC(=O)[C@@H](OC(=O)/C=C/c2nc3ccccc3s2)c2ccccc2)c([N+](=O)[O-])c1 849190034 VEYJZRGFWOFZSH-XXFRDUSWSA-N 473.510 5.449 5 20 JKBD CC(C)Oc1cc(Br)ccc1C(=O)O[C@H](C)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 920668598 XYEFWYGYUIERSI-GFCCVEGCSA-N 476.283 5.113 5 20 JKBD O=C(Cc1cccc([N+](=O)[O-])c1)NC1(c2ccc(NC(=O)c3ccc4ccoc4c3)cc2)CCC1 1790890256 MAMXFGWFNDLHKN-UHFFFAOYSA-N 469.497 5.331 5 20 JKBD C[C@H](C(=O)NC1(c2ccc(NC(=O)c3cc4cc([N+](=O)[O-])ccc4s3)cc2)CCC1)C1(O)CCC1 1791008576 KPAPHULHUTUJQZ-MRXNPFEDSA-N 493.585 5.108 5 20 JKBD CC(=O)C[C@H](C)C(=O)Nc1ccc(C2(NC(=O)c3cc4cc([N+](=O)[O-])ccc4s3)CCC2)cc1 1791542316 UWXRFCSTADCVKA-HNNXBMFYSA-N 479.558 5.172 5 20 JKBD O=C(CCc1cccc([N+](=O)[O-])c1)Nc1cc([C@H]2CCCCN2C(=O)c2ccc3ccoc3c2)[nH]n1 1815538849 ZUCNAUYXZFCVTP-JOCHJYFZSA-N 487.516 5.003 5 20 JKBD CCn1c(S[C@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2)nc2scc(-c3cccs3)c2c1=O 9750675 DCQFNRVSEGFYHM-GFCCVEGCSA-N 486.600 5.234 5 20 JKBD C[C@@H]1c2ccsc2CCN1C(=O)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 16780940 QDAIEPOHIDJRJC-CYBMUJFWSA-N 453.486 5.037 5 20 JKBD O=C(C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)Nc1ccccc1-n1cncn1 25005789 AWLVHRBFNJYXTR-AQTBWJFISA-N 482.525 5.355 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)NCc2ccccc2-c2ccc(Cn3ccnc3)cc2)cc1SC 504782607 RVQPHEYMRMIBIA-UHFFFAOYSA-N 488.569 5.167 5 20 JKBD O=C(c1cccc(Cl)c1)N1CCCN(C(=O)c2cc([N+](=O)[O-])ccc2Oc2ccccc2)CC1 507996122 BFWPJYNFNNUXEN-UHFFFAOYSA-N 479.920 5.029 5 20 JKBD Cc1nc(-c2cccc(NC(=O)N3CCN(c4ccc(C(F)(F)F)cc4[N+](=O)[O-])CC3)c2)oc1C 510721728 UPGGZXDYJOIDKK-UHFFFAOYSA-N 489.454 5.240 5 20 JKBD O=C(Cn1c2ccccc2c(=O)c2ccccc21)Nc1ccccc1Oc1ccc(Cl)cc1 517906271 WKZXNHYFDLWLNU-UHFFFAOYSA-N 454.913 6.239 5 20 JKBD Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)c1ccc(NC(=O)c2cccc(Br)c2)cc1 518085407 QUZSQSRGNJFTIO-UHFFFAOYSA-N 468.307 5.479 5 20 JKBD CC(=O)N(c1nc(Cn2cc(-c3ccc([N+](=O)[O-])cc3)cn2)cs1)c1c(C)cc(C)cc1C 521438362 HDUNNOMKYBCIHP-UHFFFAOYSA-N 461.547 5.573 5 20 JKBD CC(C)N(Cc1cc(Br)ccc1F)C(=O)C1CCN(c2ccccc2[N+](=O)[O-])CC1 603526526 NMFJJADVKIWMST-UHFFFAOYSA-N 478.362 5.150 5 20 JKBD O=C(COc1ccc([N+](=O)[O-])cc1)Nc1ccc(NC(=O)c2ccccc2F)cc1C(F)(F)F 603742983 NYQHXFDJIPETOB-UHFFFAOYSA-N 477.370 5.023 5 20 JKBD O=C(Nc1ccccc1Oc1ncc(Cl)cc1Cl)c1ccc(-n2ccnc2)c([N+](=O)[O-])c1 603744324 HMXCLIUHXFIBQW-UHFFFAOYSA-N 470.272 5.527 5 20 JKBD CC[C@@H](C)NC(=O)c1ccc(NC(=O)c2ccc(Sc3nc(C)cs3)c([N+](=O)[O-])c2)c(C)c1 604457544 RELWPDRWOZHAEC-CQSZACIVSA-N 484.603 5.600 5 20 JKBD O=C(Nc1nc(C2CC2)c(Cc2ccccc2Cl)s1)c1cc2c(cc1[N+](=O)[O-])OCCO2 608850395 PUVKPUIQWHMZMR-UHFFFAOYSA-N 471.922 5.196 5 20 JKBD COc1ccc(Oc2ccc([N+](=O)[O-])cc2C(=O)N2CCC(CN(C)Cc3ccccc3)CC2)cc1 608964816 ZCEHMJCZNMPASS-UHFFFAOYSA-N 489.572 5.380 5 20 JKBD COc1cc(C(=O)N2C[C@@H](c3ccccc3)OC[C@@H]2C)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 608966331 IXMKDHFJUQAVDD-FYSMJZIKSA-N 482.920 5.651 5 20 JKBD Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)[C@H](C)SCc1nc(O)c2c(-c3ccccc3)csc2n1 610860164 GUOCHXILORLXHA-HNNXBMFYSA-N 494.598 5.849 5 20 JKBD O=C(Nc1cc2c(cc1[N+](=O)[O-])OCCCO2)c1ccc(Oc2ccc(C(F)(F)F)cn2)cc1 619215556 HMMOTAKTYZLCQV-UHFFFAOYSA-N 475.379 5.215 5 20 JKBD COCCN(C(=O)Cn1c2ccccc2c(=O)c2ccccc21)[C@@H](C)c1cccc(C(F)(F)F)c1 642070351 XGJHFIVYTXSRII-SFHVURJKSA-N 482.502 5.410 5 20 JKBD C[C@@H](NCc1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1)c1ccc(N2CCOC2=O)cc1 726607423 URIILSLDEHPSFR-LJQANCHMSA-N 483.528 5.255 5 20 JKBD O=C(Nc1ccccc1C(=O)NCCCc1nc2c(s1)CCCC2)c1ccc([N+](=O)[O-])cc1Cl 727111527 OLMWIFVMAXOPSH-UHFFFAOYSA-N 498.992 5.198 5 20 JKBD Cc1sc(NS(=O)(=O)C2=Cc3ccc(OC(F)F)cc3CC2)nc1-c1cccc([N+](=O)[O-])c1 727248085 CFSBSWVYIUKLSD-UHFFFAOYSA-N 493.513 5.357 5 20 JKBD O=C(Nc1nc(-c2ccccc2OC(F)F)cs1)c1cc([N+](=O)[O-])ccc1N1CCCCC1 727714696 CBAQNAZFUWFUNN-UHFFFAOYSA-N 474.489 5.562 5 20 JKBD O=C(Nc1ccc(OS(=O)(=O)Cc2ccccc2Cl)cc1)c1cc([N+](=O)[O-])ccc1Cl 728058931 RREUAUCWOPUUKA-UHFFFAOYSA-N 481.313 5.063 5 20 JKBD COc1cc(C(=O)Nc2ccc3c(c2)CCCN3C(=O)OC(C)(C)C)c([N+](=O)[O-])cc1OC(F)F 729410446 RCIUJFPVTQGDMR-UHFFFAOYSA-N 493.463 5.145 5 20 JKBD O=C(OCc1nnc(-c2ccc([N+](=O)[O-])cc2)o1)c1ccccc1C(=O)c1ccc(Cl)c(Cl)c1 729727206 ODVZOQABDCWMOZ-UHFFFAOYSA-N 498.278 5.540 5 20 JKBD C[C@@H](OC(=O)C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)C(=O)N1CCCCC1 804860878 REWOHKUXRGTBRB-VXNZKSKFSA-N 479.558 5.079 5 20 JKBD CC1=C(C(=O)Nc2ccc(C)cc2C)[C@H](c2ccc([N+](=O)[O-])cc2)NC(=S)N1c1ccccc1 916160678 YNYMSYAPIHNGFL-DEOSSOPVSA-N 472.570 5.560 5 20 JKBD O=C(Nc1ccccc1C(=O)NCc1ccc(OC2CCCC2)nc1)c1ccc([N+](=O)[O-])cc1Cl 918614017 YCQJPWFIPRFHTF-UHFFFAOYSA-N 494.935 5.147 5 20 JKBD O=C(OCC(=O)N1CCC[C@H]1c1ccc(Cl)c(Cl)c1)c1cc(Cl)ccc1[N+](=O)[O-] 918863397 MPIRJFJHUHNYHG-INIZCTEOSA-N 457.697 5.076 5 20 JKBD COc1cc(/C=C\C(=O)O[C@H](C)c2ccc([N+](=O)[O-])cc2)ccc1OCc1c(C)noc1C 920155039 GZCYFYCXCHRWGB-NCALTVRCSA-N 452.463 5.105 5 20 JKBD COc1cc(C(=O)OCc2c(Cl)ccc3cccnc23)c([N+](=O)[O-])cc1OCc1cscn1 920651895 HAAIVAZUQVPXNW-UHFFFAOYSA-N 485.905 5.198 5 20 JKBD O=C(Cc1cc(F)ccc1[N+](=O)[O-])NC1(c2ccc(NC(=O)[C@@H](F)c3ccccc3)cc2)CCC1 1786617019 XSTPXPRTZJTMCS-DEOSSOPVSA-N 479.483 5.121 5 20 JKBD Cc1nscc1C(=O)Nc1ccc(C2(NC(=O)c3cc(Cl)cc([N+](=O)[O-])c3C)CCC2)cc1 1787193341 AWMVXVCEAXVJRV-UHFFFAOYSA-N 484.965 5.383 5 20 JKBD Cc1cc(C(=O)Nc2ccc(C3(NC(=O)c4cc5cccc(C)c5[nH]4)CCC3)cc2)ncc1[N+](=O)[O-] 1788766808 IJQYMLREEBLNAD-UHFFFAOYSA-N 483.528 5.149 5 20 JKBD COc1ccc2[nH]cc(C(=O)Nc3ccc(C4(NC(=O)Cc5cccc([N+](=O)[O-])c5)CCC4)cc3)c2c1 1789274372 APHXVPANWRHNGH-UHFFFAOYSA-N 498.539 5.075 5 20 JKBD O=C(NC1(c2ccc(NC(=O)c3cc4cc(F)ccc4s3)cc2)CCC1)c1ccc([N+](=O)[O-])[nH]1 1789291825 VMNJWPIPICVULI-UHFFFAOYSA-N 478.505 5.338 5 20 JKBD O=C(C[C@H]1C[C@@H]2CC[C@H]1C2)Nc1ccc(C2(NC(=O)Cc3cc([N+](=O)[O-])ccc3F)CCC2)cc1 1791321232 UAEKZGITPKWADA-CEXWTWQISA-N 479.552 5.237 5 20 JKBD O=C(Nc1cc([C@@H]2CCCCN2C(=O)/C=C/c2ccc([N+](=O)[O-])o2)[nH]n1)[C@@H]1CCC[C@@H]2CCCC[C@@H]21 1818926833 BVUMPXASHNVPRR-UXKDAGANSA-N 495.580 5.223 5 20 JKBD O=C(c1ccccc1F)N1CCC([C@H]2CCCCN2C(=O)C2(c3cccc([N+](=O)[O-])c3)CCC2)CC1 1830292917 LVELNTWYSWXRII-RUZDIDTESA-N 493.579 5.089 5 20 JKBD O=C(c1cc2ccoc2s1)N1CCC([C@@H]2CCCCN2C(=O)c2cc(F)cc([N+](=O)[O-])c2)CC1 1830614015 MMCUYTXHSQGFNU-FQEVSTJZSA-N 485.537 5.089 5 20 JKBD O=C(c1ccsc1)N1CCC([C@H]2CCCCN2C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)CC1 1831060368 VCKNMYDBKMQJKC-HXUWFJFHSA-N 483.615 5.418 5 20 JKBD O=C(c1cccc(F)c1[N+](=O)[O-])N1CCC([C@@H]2CCCCN2C(=O)C2(c3ccccc3)CCC2)CC1 1831781881 KALRSWFVLZBZSG-DEOSSOPVSA-N 493.579 5.089 5 20 JKBD C[C@H](CC(=O)N1CCC([C@H]2CCCCN2C(=O)/C=C/c2ccccc2[N+](=O)[O-])CC1)c1ccccc1 1832903481 DWFROWPOCNTNBH-BRDULOMRSA-N 489.616 5.422 5 20 JKBD O=C(COC(=O)C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)Nc1ccccc1 18493971 IXOZEWOHMPIODK-JXAWBTAJSA-N 473.510 5.317 5 20 JKBD CCOc1ccc(NC(=O)CSc2nc3cc4ccccc4cc3c(=O)n2CC)cc1OCC 22178460 KMXYKLWFUWSGKU-UHFFFAOYSA-N 477.586 5.098 5 20 JKBD CCCCSc1nnc(S[C@@H](C(=O)Nc2ccc(C)cc2[N+](=O)[O-])c2ccccc2)s1 22489797 LJZDQCPLEARDNL-GOSISDBHSA-N 474.633 6.119 5 20 JKBD O=C(Oc1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2Cl)cc1)c1cc(-c2cccs2)on1 26376332 JXSSXEJNHVWDBY-UHFFFAOYSA-N 469.862 5.436 5 20 JKBD CCn1c(S[C@@H](C)C(=O)Nc2c(C)cc(C)cc2Cl)nc2cc3ccccc3cc2c1=O 26581056 FXZZGYBXHCSPLW-INIZCTEOSA-N 466.006 5.959 5 20 JKBD Cc1ccc(S(=O)(=O)Nc2ccc(C(=O)Nc3ccccc3OC3CCCC3)cc2)cc1[N+](=O)[O-] 486404267 YFGOAFBXYOODNU-UHFFFAOYSA-N 495.557 5.278 5 20 JKBD CN(CCc1ccncc1)C(=O)c1ccc(Sc2nc3ccccc3s2)c([N+](=O)[O-])c1 499948991 XDKVJVNSDZAPSE-UHFFFAOYSA-N 450.545 5.065 5 20 JKBD O=C(Nc1ccc(F)cc1Br)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 500068997 FHEBPJVQAQPOSG-UHFFFAOYSA-N 490.251 5.370 5 20 JKBD CC(C)Sc1ccc([C@H](C)NC(=O)c2ccc([N+](=O)[O-])cc2I)cc1 504743471 WSDCUTWHHIJLHT-LBPRGKRZSA-N 470.332 5.191 5 20 JKBD Cc1nc(-c2ccc(F)cc2)sc1[C@@H](C)Nc1ccc([N+](=O)[O-])cc1S(=O)(=O)N1CCCC1 511415268 OOYMNRXMFBGCEZ-CQSZACIVSA-N 490.582 5.123 5 20 JKBD Cc1cc(CNC(=O)c2c3c(nc4ccccc24)/C(=C/c2cccc([N+](=O)[O-])c2)CCC3)no1 518681518 RANPIBPZJOWZDV-QGOAFFKASA-N 454.486 5.246 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Cl)[C@@H](NCc1ccccc1Br)c1ccccc1 520154710 RLBOQYGRWAMVAU-FQEVSTJZSA-N 474.742 5.480 5 20 JKBD COc1c(Br)cc(Cl)cc1NC(=O)c1csc(-c2ccc([N+](=O)[O-])cc2)n1 523305490 YCZFPBPRLUFQAA-UHFFFAOYSA-N 468.716 5.395 5 20 JKBD CC1CCC(OC2CCN(C(=O)c3ccc(N[C@@H](C)c4ccccn4)c([N+](=O)[O-])c3)CC2)CC1 609374414 WJCQSXFWUDCKDP-SCCNAQOGSA-N 466.582 5.363 5 20 JKBD CC(=O)Nc1ccc(-c2csc(NC(=O)c3ccc(N4CCC[C@H](C)C4)c([N+](=O)[O-])c3)n2)c(F)c1 619213865 HEFICVKRTICHLK-AWEZNQCLSA-N 497.552 5.304 5 20 JKBD COCCOc1cc([N+](=O)[O-])c(C(=O)Nc2nc(-c3ccc(C(C)(C)C)cc3)cs2)cc1OC 619564071 NTWNZHROYHKGQK-UHFFFAOYSA-N 485.562 5.302 5 20 JKBD C[C@@H](NC(=S)/C(=C(/O)c1ccc([N+](=O)[O-])cc1)[n+]1ccc2c(c1)CCCC2)c1cccs1 726581922 ZOLRTWGHSXJSCN-MRXNPFEDSA-O 466.608 5.385 5 20 JKBD O=C(CCC(=O)N1CCN(Cc2cscn2)CC1)c1ccc2ccc3cccc4ccc1c2c34 727767545 BQPUTTLJVIPCFC-UHFFFAOYSA-N 467.594 5.348 5 20 JKBD O=C(c1nn(-c2ccccc2F)c2c1CCC2)N(CC1CC1)c1ccc(Cl)c([N+](=O)[O-])c1 728165619 LXBKUNWZZVEBFI-UHFFFAOYSA-N 454.889 5.119 5 20 JKBD Cc1c([N+](=O)[O-])cc(C(=O)Nc2nc3cc(C(F)(F)F)ccc3n2Cc2ccco2)cc1[N+](=O)[O-] 790910568 ILNFHNVJTAAIBU-UHFFFAOYSA-N 489.366 5.074 5 20 JKBD C[C@@H](OC(=O)C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)C(=O)N1CCCCC1 804860876 REWOHKUXRGTBRB-JFPYRBRCSA-N 479.558 5.079 5 20 JKBD C[C@@H](Nc1ccc(-c2nc([C@H]3CCCN3C(=O)OC(C)(C)C)no2)cc1[N+](=O)[O-])c1ccccn1 904702386 XWDWRYJWNODIKN-DNVCBOLYSA-N 480.525 5.285 5 20 JKBD Cc1ccc(-n2nc(C)c(CC(=O)N(C)Cc3cc([N+](=O)[O-])ccc3Cl)c2C)cc1Cl 917068913 CJEVAZISVYFUKL-UHFFFAOYSA-N 461.349 5.214 5 20 JKBD CC(C)N(Cc1nnc(-c2cccc([N+](=O)[O-])c2)o1)C(=O)c1ccc(-c2ccccc2F)o1 917205990 RCDGYAIJCNIKKN-UHFFFAOYSA-N 450.426 5.095 5 20 JKBD O=C(Nc1cc(Cl)ccc1N1CCCCC1)c1cc([N+](=O)[O-])ccc1I 918248219 HEGHAOVWHBAVLM-UHFFFAOYSA-N 485.709 5.095 5 20 JKBD Cc1cc(C)n(-c2ccc(NC(=O)c3ccc(N[C@@H](C)c4ccccn4)c([N+](=O)[O-])c3)cc2)n1 919703841 HFEUKBMXFABZFI-SFHVURJKSA-N 456.506 5.218 5 20 JKBD C[C@@H](OC(=O)c1cc(-c2ccccc2)nc2cc(F)ccc12)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 920586647 RYZMPNJWOBBTLR-OAHLLOKOSA-N 484.443 5.917 5 20 JKBD Cc1cc(Br)c(NC(=O)COc2cc(Cl)ccc2[N+](=O)[O-])c(Br)c1 920992946 VITBGDLPJSCWIC-UHFFFAOYSA-N 478.524 5.099 5 20 JKBD O=C(NC1(c2ccc(NC(=O)c3cc4ccc(Cl)cc4[nH]3)cc2)CCC1)c1ccc([N+](=O)[O-])[nH]1 1785793066 WLFQTTWXOIKTJX-UHFFFAOYSA-N 477.908 5.119 5 20 JKBD O=C(CCc1cccc([N+](=O)[O-])c1)Nc1ccc(C2(NC(=O)c3ccc4c(c3)C(=O)CC4)CCC2)cc1 1786602691 NIRNGZIAKZXAGW-UHFFFAOYSA-N 497.551 5.104 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)c3cc(F)cc([N+](=O)[O-])c3)CCC2)cc1)c1ccc2cc[nH]c2c1 1788913540 DPALTIWXNLFUMU-UHFFFAOYSA-N 472.476 5.277 5 20 JKBD O=C(CC(F)(F)F)NC1(c2ccc(NC(=O)C3(c4cccc([N+](=O)[O-])c4)CCC3)cc2)CCC1 1790476047 XDGUAWVAGTVKLA-UHFFFAOYSA-N 475.467 5.103 5 20 JKBD CC1=CC[C@@H](C(=O)NC2(c3ccc(NC(=O)c4cc(F)cc([N+](=O)[O-])c4)cc3)CCC2)CC1 1790696451 HAFCSUFCUYMFOW-QGZVFWFLSA-N 451.498 5.228 5 20 JKBD CC(C)(C)CCCCCC(=O)NC[C@@H]1CCN(C(=O)c2ccc([N+](=O)[O-])cc2F)[C@H]1c1cccnc1 1812808744 IDNHUZPLZYSOLT-CPJSRVTESA-N 498.599 5.445 5 20 JKBD Cc1cc(Cl)ccc1C(=O)N1CCCC[C@@H]1C1CCN(C(=O)/C=C/c2ccc([N+](=O)[O-])o2)CC1 1823907972 LDURTUVTKFPDBE-MECCDNJOSA-N 485.968 5.096 5 20 JKBD COc1ccccc1C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cc(Cl)cc([N+](=O)[O-])c2C)CC1 1830735718 KWURFFAXPZAXIY-QFIPXVFZSA-N 499.995 5.112 5 20 JKBD C[C@]1(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)Cc3ccc(Cl)cc3[N+](=O)[O-])CC2)CC=CCC1 1832402002 KNUPYMWWFFVYBH-GJZUVCINSA-N 488.028 5.157 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)N1CCCC12CN(C(=O)c1cc3c(Cl)cccc3s1)C2 1845493163 HYWRHHXJZJRPMG-UHFFFAOYSA-N 487.940 5.041 5 20 JKBD COc1cccc(NC(=O)[C@@H](OC(=O)Cn2c3ccccc3c(=O)c3ccccc32)c2ccccc2)c1 11276482 DHWHGCSTSIRRCM-LJAQVGFWSA-N 492.531 5.087 5 20 JKBD CC(=O)c1ccc(NC(=O)C/C(=C/c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)cc1 16023558 YGAMRAYKCYZVFW-RGEXLXHISA-N 457.511 5.977 5 20 JKBD Cc1c(-c2ccccc2)sc(NC(=O)COc2ccc([N+](=O)[O-])cc2)c1C(=O)N1CCCCC1 18188065 HXQBHGDMQDXBCZ-UHFFFAOYSA-N 479.558 5.275 5 20 JKBD CC(=O)N1C=Cc2ccccc2[C@H]1CC(=O)O[C@@H](C(=O)Nc1ccc(C)cc1[N+](=O)[O-])c1ccccc1 18745586 RKLUUYKAVXEQDL-SHQCIBLASA-N 499.523 5.090 5 20 JKBD O=[N+]([O-])c1cccc(CN(Cc2ccccc2)S(=O)(=O)c2ccccc2C(F)(F)F)c1 22350918 XPPQJAZNTCVULW-UHFFFAOYSA-N 450.438 5.005 5 20 JKBD Cc1ccc(-n2cnnc2S[C@@H](C)C(=O)Nc2nc(-c3cccc([N+](=O)[O-])c3)cs2)c(C)c1 24845272 AYUNDHWYNBOTLG-HNNXBMFYSA-N 480.575 5.035 5 20 JKBD O=C(CSc1nccn1-c1ccc(Cl)cc1)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 26679672 CEQGBCOQCCHFOV-UHFFFAOYSA-N 456.833 5.184 5 20 JKBD O=[N+]([O-])c1cccc(-c2noc(CSc3nnc(Cc4cccs4)n3-c3ccccc3)n2)c1 31846849 OEGNWCLVKYWZPI-UHFFFAOYSA-N 476.543 5.170 5 20 JKBD CSc1ccc([N+](=O)[O-])c(C(=O)Nc2nc(-c3cccc(Br)c3)cs2)c1 247843184 OQVVUHMSLKJYJO-UHFFFAOYSA-N 450.339 5.455 5 20 JKBD CN(C(=O)c1ccc(NC(=O)c2csc(-c3ccc([N+](=O)[O-])cc3)n2)cc1)C1CCCCC1 303075473 ZBZXVCNAGCAXHD-UHFFFAOYSA-N 464.547 5.375 5 20 JKBD COc1cc(NC(=O)c2ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])cc2)ccc1NC(C)=O 484303135 DIIGRXNAOMFYEZ-UHFFFAOYSA-N 455.854 5.260 5 20 JKBD COc1ccc(C[C@H](NC(=O)c2cc(SC)c(OC)cc2[N+](=O)[O-])c2ccccc2)cc1OC 484355944 YZAXCFJMIBZISQ-IBGZPJMESA-N 482.558 5.056 5 20 JKBD COc1cccc([C@H](C)N2CCN(C(=O)c3ccc(Sc4nc(C)cs4)c([N+](=O)[O-])c3)CC2)c1 505472964 FLGOZEBBJBIJSR-KRWDZBQOSA-N 498.630 5.039 5 20 JKBD Cc1cccc(C)c1Oc1ccccc1NC(=O)CCCn1c(=O)oc2cc([N+](=O)[O-])ccc21 509771312 FGQVDQYGSUQMQW-UHFFFAOYSA-N 461.474 5.331 5 20 JKBD CC[C@H](NC(=O)c1cc(OC)c(OCc2cscn2)cc1[N+](=O)[O-])c1cccc(Cl)c1 512402423 AAXTYYFISQHQNU-KRWDZBQOSA-N 461.927 5.173 5 20 JKBD CN(C[C@H]1CCCOC1)C(=O)C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1 517409406 YBIBQCIHAKJRIF-UIMCMNAESA-N 451.548 5.020 5 20 JKBD Cc1ccc(NC(=O)c2cccc(C(F)(F)F)c2)cc1NC(=O)c1cccc(C)c1[N+](=O)[O-] 520482668 DNRKUSSXRAUDBT-UHFFFAOYSA-N 457.408 5.735 5 20 JKBD C[C@H](Nc1ccc(C(=O)Nc2ccc(NC(=O)c3cccs3)cc2)cc1[N+](=O)[O-])c1ccccn1 522826410 DCBQSRPRARTFRE-INIZCTEOSA-N 487.541 5.729 5 20 JKBD COc1ccc(CC[C@H]2CCCCN2C(=O)c2csc(-c3ccc([N+](=O)[O-])cc3)n2)cc1OC 523559623 DVQFAGYTXXJQGK-LJQANCHMSA-N 481.574 5.363 5 20 JKBD COc1cccc([C@H](CNc2ccc([N+](=O)[O-])c(C(=O)O)c2)c2c[nH]c3ccccc23)c1OC 579139720 BXSPJPWYGBHJFH-FQEVSTJZSA-N 461.474 5.036 5 20 JKBD C[C@@H](Sc1nnc(-c2ccccc2)c2ccccc12)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 594669211 GASGISUQCKEJRS-CQSZACIVSA-N 498.486 6.343 5 20 JKBD COc1ccc(CSCC(=O)NC[C@H](c2ccccc2)c2c[nH]c3ccccc23)cc1[N+](=O)[O-] 603563559 UGWQDTDZVIADBR-OAQYLSRUSA-N 475.570 5.266 5 20 JKBD O=C(Nc1ccc(-c2nccs2)cc1)N1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 603649246 AVLCAHNVLLRRBQ-UHFFFAOYSA-N 477.468 5.091 5 20 JKBD C[C@H](Nc1ccc(C(=O)N2CCOCC2)cc1[N+](=O)[O-])c1ccc(Oc2ccccc2)c(F)c1 603871464 ACXHSUNVKIITFG-KRWDZBQOSA-N 465.481 5.172 5 20 JKBD Cc1ccc(-n2c(SCc3nc(-c4ccc([N+](=O)[O-])cc4)no3)nnc2-c2ccccn2)c(C)c1 603918427 VRFDNIJLPMAIFW-UHFFFAOYSA-N 485.529 5.197 5 20 JKBD CCCOc1cc(NC(=O)c2c(C)cc(=O)n(-c3ccccc3)c2C)c([N+](=O)[O-])cc1OCCC 603952052 UHQRLBQPHMSXPO-UHFFFAOYSA-N 479.533 5.192 5 20 JKBD O=C(Nc1ccc2c(c1)CCC(=O)N2Cc1ccc(Cl)cc1)c1c[nH]c2ccc([N+](=O)[O-])cc12 604550602 JEXJSTKYMWBDLA-UHFFFAOYSA-N 474.904 5.461 5 20 JKBD CCCCOc1ccc([C@H](C)Nc2cnn(-c3ccc([N+](=O)[O-])cc3)c(=O)c2Cl)cc1OC 608830909 HJDXASFTWTWJAI-HNNXBMFYSA-N 472.929 5.155 5 20 JKBD O=C(C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)N1CCCc2sccc2C1 609332262 OEXUGLABMNOTIJ-RGEXLXHISA-N 475.595 6.172 5 20 JKBD O=C(COc1ccccc1[N+](=O)[O-])Nc1cccc(NC(=O)Nc2cccc3c2CCCC3)c1 609428513 SVMUYBYWUMHPPF-UHFFFAOYSA-N 460.490 5.135 5 20 JKBD CCn1c(SCc2cccc(C(=O)NCc3ccco3)c2)nc2cc3ccccc3cc2c1=O 614509626 PFMVPVQANOGQPU-UHFFFAOYSA-N 469.566 5.385 5 20 JKBD Cc1cc(Br)ccc1NC(=O)CN(C)C(=O)c1cc2ccccc2c2cccnc12 642518045 NAYWQFKQXLFJLB-UHFFFAOYSA-N 462.347 5.170 5 20 JKBD COc1ccc(COc2cc(-c3ccc(N4CCOCC4)cc3)c(Cl)cc2[N+](=O)[O-])cc1 725325812 WVSYFKYHCCLUDK-UHFFFAOYSA-N 454.910 5.339 5 20 JKBD Cc1ccccc1-c1nc(C(=O)O[C@H](C)C(=O)Nc2nc(-c3cccc([N+](=O)[O-])c3)cs2)cs1 727562356 UDYLZZBGGJSYMQ-CQSZACIVSA-N 494.554 5.334 5 20 JKBD C/C(=C\C(=O)O[C@@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F)c1ccccc1Cl 727574283 HPCGVZSSNGPZOM-ZKQHCESOSA-N 456.804 5.241 5 20 JKBD CC(C)N(Cc1nnc(-c2cccc([N+](=O)[O-])c2)o1)C(=O)COc1ccc(Cl)c2ccccc12 747573813 KMOBANQROFDYTF-UHFFFAOYSA-N 480.908 5.267 5 20 JKBD Cc1ccc(NC(=O)[C@H](OC(=O)c2csc(-c3ccc([N+](=O)[O-])cc3)n2)c2ccccc2)cc1 747955339 HSOZXJGAAOMKSC-JOCHJYFZSA-N 473.510 5.564 5 20 JKBD O=C(NC[C@H](c1ccccc1)c1c[nH]c2ccccc12)c1cc([N+](=O)[O-])ccc1Br 750604075 WBDDBYWGFOXUAJ-LJQANCHMSA-N 464.319 5.401 5 20 JKBD COc1ccc([N+](=O)[O-])cc1OC(=O)c1nc(-c2cccs2)n(-c2cccc(C(F)(F)F)c2)n1 818033905 QROVTEKQIZJQKT-UHFFFAOYSA-N 490.419 5.151 5 20 JKBD Cc1ccc(S(=O)(=O)Nc2ccc(NC(=S)Nc3cccc(Cl)c3)cc2)cc1[N+](=O)[O-] 916119996 JVXVUXJLSJRUHT-UHFFFAOYSA-N 476.967 5.166 5 20 JKBD CN(Cc1cn(-c2ccccc2)nc1-c1ccc(Cl)cc1)C(=S)Nc1ccc([N+](=O)[O-])cc1 916547386 XZCGFIBOMBCXPI-UHFFFAOYSA-N 477.977 5.930 5 20 JKBD COc1ccc(C(=O)Nc2cc(C(F)(F)F)ccc2NC(=O)OC(C)(C)C)cc1[N+](=O)[O-] 918611554 CBAMBQDUIXNEST-UHFFFAOYSA-N 455.389 5.222 5 20 JKBD CC(C)N(Cc1nnc(-c2cccc([N+](=O)[O-])c2)o1)C(=O)C[C@@H](C)c1ccc(C(F)(F)F)cc1 920017186 JTNXAHZBKCHOMI-OAHLLOKOSA-N 476.455 5.594 5 20 JKBD Cc1ccccc1C1(C(=O)Oc2ccc(NC(=O)c3cc([N+](=O)[O-])ccc3Cl)cc2)CCOCC1 920023289 ZMIJHLKPAXACPT-UHFFFAOYSA-N 494.931 5.463 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)c3c(Cl)cccc3Cl)CCC2)cc1)c1ccc([N+](=O)[O-])o1 1785749647 HDVIXELEBNOCTC-UHFFFAOYSA-N 474.300 5.556 5 20 JKBD O=C(/C=C/c1ccc([N+](=O)[O-])o1)Nc1ccc(C2(NC(=O)C3CCC(F)(F)CC3)CCC2)cc1 1786205588 JIENRPKXUIXJGY-SOFGYWHQSA-N 473.476 5.161 5 20 JKBD O=C(/C=C/c1ccc([N+](=O)[O-])o1)Nc1ccc(C2(NC(=O)C3(F)CCCCC3)CCC2)cc1 1786207529 VNNKSEVTUBACHY-PKNBQFBNSA-N 455.486 5.008 5 20 JKBD COc1cc(C(=O)NC2(c3ccc(NC(=O)/C=C/c4cccs4)cc3)CCC2)ccc1[N+](=O)[O-] 1788165658 SWUZWWAWIIHCQQ-ZRDIBKRKSA-N 477.542 5.126 5 20 JKBD CC(C)(C)c1ccc(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)/C=C/c3ccc([N+](=O)[O-])o3)n[nH]2)s1 1814968248 UUZFBTWNLLBQHJ-VDZSZVPASA-N 497.577 5.289 5 20 JKBD O=C(CSc1ccccc1[N+](=O)[O-])Nc1cc([C@H]2CCCCN2C(=O)c2ccccc2Cl)[nH]n1 1822313563 UAUWNKPYGKPHDW-GOSISDBHSA-N 499.980 5.070 5 20 JKBD Cc1cccc(Cl)c1C(=O)N1CCC([C@@H]2CCCCN2C(=O)Cc2cccc([N+](=O)[O-])c2)CC1 1823679469 HJKILOOXBBLVKJ-QHCPKHFHSA-N 483.996 5.033 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cc3ccccc3o2)CC1 1828190883 OZNXKTSEHLPVNA-JOCHJYFZSA-N 493.535 5.336 5 20 JKBD CCCn1c(SCC(=O)Nc2ccc(Cl)cc2[N+](=O)[O-])nnc1-c1ccc(Cl)cc1 9139781 IJFSKVUEXWFDGV-UHFFFAOYSA-N 466.350 5.301 5 20 JKBD CCOc1ccc(NC(=O)CSc2nnc(-c3ccccc3)c(-c3ccccc3)n2)c([N+](=O)[O-])c1 9441365 IXXMNRXQHHCZHM-UHFFFAOYSA-N 487.541 5.243 5 20 JKBD CC(C)Cn1c(S[C@@H](C)C(=O)Nc2nc(-c3cccc([N+](=O)[O-])c3)cs2)nnc1-c1ccco1 9566588 KTEKKNQDDBBITK-AWEZNQCLSA-N 498.590 5.345 5 20 JKBD Cc1csc(SCc2ccccc2C(=O)OCC(=O)Nc2cc(Cl)ccc2[N+](=O)[O-])n1 9622430 SMDYHPBYOJSYHE-UHFFFAOYSA-N 477.951 5.101 5 20 JKBD CCOc1ccc(C(=O)O[C@@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2ccccc2)cc1OC 9920971 RXABTUYOEMFMRH-JOCHJYFZSA-N 484.892 5.192 5 20 JKBD C[C@H](OC(=O)CCc1ncc(-c2ccc(Cl)cc2)o1)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 12260294 NKTABLDXFBPSFJ-ZDUSSCGKSA-N 468.853 5.190 5 20 JKBD COc1ccc(NC(=O)[C@H](OC(=O)[C@@H](C)Sc2ccc([N+](=O)[O-])cc2)c2ccccc2)cc1 16118553 YRERYBFBAZHXEI-OPAMFIHVSA-N 466.515 5.007 5 20 JKBD C[C@@H](OC(=O)c1c(-n2cccc2)sc2c1CCSC2)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl 16412617 KXKBDDIQKMFZJE-GFCCVEGCSA-N 491.978 5.074 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Cl)[C@@H](N[C@H]1CCSc2ccccc21)c1ccccc1 19669690 ZUWWHHIPMZXVGG-UGKGYDQZSA-N 453.951 5.755 5 20 JKBD C[C@H](c1nnc(Sc2ccc(C(F)(F)F)cc2[N+](=O)[O-])n1-c1ccc(F)cc1)N(C)C 29001423 UBDABANSVDHQQS-LLVKDONJSA-N 455.437 5.107 5 20 JKBD O=C(C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1)N1CCC(c2ccccc2)CC1 32366391 CGHUTUMSPWNWCF-UHFFFAOYSA-N 461.484 5.236 5 20 JKBD COc1ccc(-c2nc(C(=O)Nc3nc(-c4cccc([N+](=O)[O-])c4)c(C)s3)cs2)cc1 195704031 AOFWMTOMPITEPF-UHFFFAOYSA-N 452.517 5.411 5 20 JKBD COc1ccc(NC(=O)c2ccc(N3C[C@@H](C)C[C@@H](C)C3)c([N+](=O)[O-])c2)c(C(F)(F)F)c1 488512753 IMCNDBGXKACJCG-OKILXGFUSA-N 451.445 5.357 5 20 JKBD Cc1cc(C)n(-c2ccccc2NC(=O)c2ccc(N[C@H](C)c3ccccn3)c([N+](=O)[O-])c2)n1 506203956 NWFAXLKDLRPHAU-GOSISDBHSA-N 456.506 5.218 5 20 JKBD C[C@H](Nc1ccc(C(=O)Nc2ccc(C(=O)NC3CCCCC3)cc2)cc1[N+](=O)[O-])c1ccccn1 509579211 LLVHSFACBPSWOU-SFHVURJKSA-N 487.560 5.478 5 20 JKBD COc1cc(C(=O)N[C@H](c2ccccc2)C2CCCC2)c([N+](=O)[O-])cc1OCc1cscn1 512216278 ZJZGTBGOGMCNES-HSZRJFAPSA-N 467.547 5.300 5 20 JKBD O=C(Nc1ccccc1)c1ccc(Cl)c(NC(=O)c2cc3cc([N+](=O)[O-])ccc3s2)c1 512327255 CTGDUTKPDCARDZ-UHFFFAOYSA-N 451.891 5.968 5 20 JKBD CCN(C(=O)c1cc(OC)c(OCc2cscn2)cc1[N+](=O)[O-])C12CC3CC(CC(C3)C1)C2 512389653 PNRHEAXYUNJHQT-UHFFFAOYSA-N 471.579 5.070 5 20 JKBD CCOc1cc(C(=O)Nc2ccc(NC(=O)Nc3ccc(Cl)cc3)cc2)c([N+](=O)[O-])cc1OC 512942027 BKURHUAAOUDSMM-UHFFFAOYSA-N 484.896 5.552 5 20 JKBD C[C@H](NC(=O)[C@@H](C)SCc1nc(O)c2c(-c3ccccc3)csc2n1)c1cccc([N+](=O)[O-])c1 515681840 YKOKOXVTCIFTJJ-LSDHHAIUSA-N 494.598 5.471 5 20 JKBD O=C(Cn1c2ccccc2c(=O)c2ccccc21)Nc1ccc(Oc2ccc(Cl)cc2)nc1 516698860 CEMBRCCTVOXCDQ-UHFFFAOYSA-N 455.901 5.634 5 20 JKBD CCN(Cc1ccc(OCc2cccs2)c(OC)c1)C(=O)c1cc2cccc([N+](=O)[O-])c2[nH]1 518430534 ZPKKDJRFVVWAAK-UHFFFAOYSA-N 465.531 5.388 5 20 JKBD CC(=O)Nc1cc(NC(=O)c2ccccc2Sc2ccc(C(F)(F)F)cc2[N+](=O)[O-])ccc1F 602037387 NMGPRCKRCOJKJV-UHFFFAOYSA-N 493.438 6.115 5 20 JKBD O=[N+]([O-])c1cccc(-c2noc(CSc3nc(O)c4c(-c5ccc(F)cc5)csc4n3)n2)c1 603565133 ITVCSZWYJIQAGS-UHFFFAOYSA-N 481.490 5.454 5 20 JKBD COc1ccc(NC(=O)Nc2ccc([N+](=O)[O-])cc2)cc1NC(=O)c1ccc(Cl)cc1F 604073525 ZAFXZAIKWKSBCO-UHFFFAOYSA-N 458.833 5.292 5 20 JKBD CC(C)Oc1ccc(NC(=O)c2csc(-c3ccc([N+](=O)[O-])cc3)n2)c(C(F)(F)F)c1 609188908 PFQKAPHFTNNXEP-UHFFFAOYSA-N 451.426 5.777 5 20 JKBD CCn1c(CNC(=O)c2ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])c(OC)c2)nc2ccccc21 744314447 ZBCWZZXVAFWOBM-UHFFFAOYSA-N 480.908 5.349 5 20 JKBD CC(=O)N(c1ccccc1)c1nc(COC(=O)c2csc(-c3cccc([N+](=O)[O-])c3)n2)cs1 747962500 SWGNOTVIVHJTDU-UHFFFAOYSA-N 480.527 5.216 5 20 JKBD COc1cc(C(=O)O[C@@H](C)c2ccc3c(c2)CC(=O)N3)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 748517801 QYWRZJKTBLKQEG-ZDUSSCGKSA-N 482.876 5.462 5 20 JKBD CC(C)(CNC(=O)c1ccccc1NC(=O)c1ccc([N+](=O)[O-])cc1Cl)c1ccccc1F 749870345 ZPCSNOWOJQVEJC-UHFFFAOYSA-N 469.900 5.347 5 20 JKBD CC(=O)N1CCc2cc(C(=O)[C@@H](C)Sc3nc4ccccc4c4nc5ccccc5n34)ccc21 752758004 NCZGZDGHBVHEJY-MRXNPFEDSA-N 466.566 5.308 5 20 JKBD Cc1onc(-c2ccccc2Cl)c1C(=O)O[C@@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl 763030954 SJFSSUVDFKBLJR-NSHDSACASA-N 464.261 5.049 5 20 JKBD COc1ccc(Oc2ccc([N+](=O)[O-])cc2C(=O)O[C@@H](C)C(=O)Nc2ccc(C)cc2F)cc1 915249267 HTYIEILGUUMGKD-HNNXBMFYSA-N 468.437 5.027 5 20 JKBD COc1ccc(Oc2ccc([N+](=O)[O-])cc2C(=O)O[C@@H](C)C(=O)Nc2c(C)cccc2C)cc1 915442103 MLOUJLMHUHPVRI-KRWDZBQOSA-N 464.474 5.197 5 20 JKBD CCCCN1C(=O)N[C@@H](c2ccc([N+](=O)[O-])cc2)C(C(=O)Nc2ccccc2C(F)(F)F)=C1C 916165688 IXDPZVWUILPVMY-FQEVSTJZSA-N 476.455 5.393 5 20 JKBD O=C1CCc2cc(NC(=O)c3cc([N+](=O)[O-])ccc3N3CCC(Cc4ccccc4)CC3)ccc2N1 918598601 ZOUYNIDHNQUMIO-UHFFFAOYSA-N 484.556 5.191 5 20 JKBD O=C1OC(c2ccc(Cl)c([N+](=O)[O-])c2)=N/C1=C\c1csc(COc2ccc(Cl)cc2)n1 918725466 DXNNUAPWGZFJRG-PXNMLYILSA-N 476.297 5.282 5 20 JKBD O=C(OCC(=O)N1c2ccccc2Sc2ccc(Cl)cc21)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1 919220152 IIUAQRDHYCMFNL-UHFFFAOYSA-N 485.861 5.143 5 20 JKBD C[C@H](OC(=O)c1ccc(N[C@H](C)c2ccccn2)c([N+](=O)[O-])c1)C(=O)c1ccc(Br)cc1 920549273 XAAAJZDCUYFQGK-CABCVRRESA-N 498.333 5.354 5 20 JKBD Cc1ccc([N+](=O)[O-])cc1NC(=O)COC(=O)[C@H](C)SCc1ncc(-c2ccc(Cl)cc2)o1 920669918 BLBFIQZMXFBXGT-AWEZNQCLSA-N 489.937 5.015 5 20 JKBD CCSc1ncccc1C(=O)NC1(c2ccc(NC(=O)Cc3cccc([N+](=O)[O-])c3)cc2)CCC1 1785791794 JBKOTDQXNSEPNX-UHFFFAOYSA-N 490.585 5.092 5 20 JKBD O=C(NC1(c2ccc(NC(=O)c3ccco3)cc2)CCC1)c1ccc(Br)c([N+](=O)[O-])c1 1787271251 IHSHRUREVKWQLD-UHFFFAOYSA-N 484.306 5.012 5 20 JKBD O=C(Cc1ccc([N+](=O)[O-])cc1F)NC1(c2ccc(NC(=O)c3ccc4cnccc4c3)cc2)CCC1 1789015226 IODRCMYTXIOPTO-UHFFFAOYSA-N 498.514 5.273 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)[C@]3(F)CCCC=C3F)CCC2)cc1)c1ccc([N+](=O)[O-])cc1F 1790625060 UYIUCNFXQXIVOG-DEOSSOPVSA-N 473.451 5.227 5 20 JKBD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc([N+](=O)[O-])o1)C1CCC(c2ccc(Cl)cc2)CC1 1792395018 ZHIVKSVVBRBMGZ-SQUOGFPLSA-N 485.968 5.067 5 20 JKBD CC(C)(C)c1ccc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)cn1 1801206474 ILIXFFPHRCITOH-REPLKXPHSA-N 492.601 5.068 5 20 JKBD O=C(Nc1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2Sc2ccccc2)cc1)c1ccco1 10871109 RBWYZODUNRTLLO-UHFFFAOYSA-N 459.483 5.844 5 20 JKBD C[C@H](Sc1nnc(Cc2cccs2)n1CCc1ccccc1)C(=O)Nc1ccccc1[N+](=O)[O-] 12744182 GGBGGZFKOFPSDH-KRWDZBQOSA-N 493.614 5.201 5 20 JKBD C[C@@H](OC(=O)COc1ccc(C2SCCCS2)cc1)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl 17267960 XURGKXHKLQOJNJ-CYBMUJFWSA-N 496.994 5.066 5 20 JKBD Cc1cccc([N+](=O)[O-])c1NC(=O)COC(=O)c1oc2ccccc2c1COc1ccccc1 21154123 IYGMVNFQGPYQTI-UHFFFAOYSA-N 460.442 5.024 5 20 JKBD Cc1cccc(Nc2nnc(S[C@@H](C)C(=O)Nc3ccc([N+](=O)[O-])cc3C(F)(F)F)s2)c1 21355912 VPSPZGNELMAYIE-NSHDSACASA-N 483.497 5.636 5 20 JKBD CCCC[C@H](Sc1nc2cc3ccccc3cc2c(=O)n1CC)C(=O)Nc1cc(C)on1 21487707 SKQRMOSIOXJCII-FQEVSTJZSA-N 450.564 5.156 5 20 JKBD Cc1cc(C)cc(-c2nnc(S[C@H](C)C(=O)Nc3nc(-c4cccc([N+](=O)[O-])c4)cs3)o2)c1 22236887 YXWPCYXSCXGYBY-CQSZACIVSA-N 481.559 5.504 5 20 JKBD Cn1c(SCC(=O)Nc2c(Cl)cc(Cl)cc2Cl)nc2cc3ccccc3cc2c1=O 22252900 DPJBSFQMHLHZJI-UHFFFAOYSA-N 478.788 5.778 5 20 JKBD Cc1cc(C)cc(-n2c(SCc3nnc(-c4ccc([N+](=O)[O-])cc4)o3)nc3ccccc3c2=O)c1 29826272 HPNARKRYKITBPJ-UHFFFAOYSA-N 485.525 5.253 5 20 JKBD Cc1nn(Cc2ccc(C(=O)NC3C[C@@H](C(F)(F)F)C[C@H](C(F)(F)F)C3)cc2)c(C)c1[N+](=O)[O-] 33195894 UVZDQVVFIZRUAJ-HOTGVXAUSA-N 492.420 5.096 5 20 JKBD Cc1cccc([N+](=O)[O-])c1NC(=O)CSc1nnc(-c2cccs2)n1Cc1ccccc1 36795939 HJZRIRVGFMMVBF-UHFFFAOYSA-N 465.560 5.002 5 20 JKBD Cc1sc(NC(=O)c2ccc(N3CCCC3)c([N+](=O)[O-])c2)nc1-c1ccc(OC(F)F)cc1 69908800 JGTNRLOYWOXSNK-UHFFFAOYSA-N 474.489 5.481 5 20 JKBD CCOc1cc(/C=C\C(=O)O[C@@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)cc(Cl)c1OC 96888125 ROWYSOBVSFJTND-PRFOUVDFSA-N 473.869 5.023 5 20 JKBD CN(C)c1ccc(C(=O)c2ccccc2C(=O)N2CCC(c3cc4ccccc4[nH]3)CC2)cc1[N+](=O)[O-] 116070919 AFSAUPRDIHHWFL-UHFFFAOYSA-N 496.567 5.393 5 20 JKBD CCN(CC)C(=O)c1ccc(NC(=O)c2csc(-c3ccc([N+](=O)[O-])cc3)n2)cc1Cl 303045536 QRVASWSZXRWWPG-UHFFFAOYSA-N 458.927 5.106 5 20 JKBD C[C@@H](Nc1ccc(C(=O)Nc2cc(F)ccc2OC[C@H]2CCCO2)cc1[N+](=O)[O-])c1ccccn1 502287233 ZOKWVQDALJXIGW-VQIMIIECSA-N 480.496 5.112 5 20 JKBD COc1cc(C(=O)Nc2sc3c(c2C(=O)c2ccc(Cl)cc2)CCC3)c([N+](=O)[O-])cc1OC 503083180 KKFNTUJREFBVOA-UHFFFAOYSA-N 486.933 5.299 5 20 JKBD C[C@H]1Cc2cc([N+](=O)[O-])ccc2N1C(=O)Cc1ccc(NC(=O)c2cc3ccccc3o2)cc1 504376569 NENYQIORGUVBMD-INIZCTEOSA-N 455.470 5.114 5 20 JKBD COc1ccc(Br)cc1[C@H]1CCCN1C(=O)[C@@H](C)Oc1ccc(Cl)cc1[N+](=O)[O-] 504877107 RTPAOJLKTAWFBA-MLGOLLRUSA-N 483.746 5.150 5 20 JKBD CCOc1cc2c(cc1OCC)CN(C(=O)c1ccc(N[C@@H](C)c3ccccn3)c([N+](=O)[O-])c1)CC2 506029492 CBHWLWINGFZXTO-SFHVURJKSA-N 490.560 5.159 5 20 JKBD Cc1sc(CNC(=O)c2cc(OCC(F)(F)F)ccc2[N+](=O)[O-])nc1-c1ccc(Cl)cc1 507907839 HWSXCFVTTZNYKC-UHFFFAOYSA-N 485.871 5.551 5 20 JKBD COc1cc(CN[C@H](c2ccc(F)cc2)[C@H]2CCCO2)ccc1OCc1ccc([N+](=O)[O-])cc1 507910629 ABMGSKQTDPVOPG-AOYPEHQESA-N 466.509 5.331 5 20 JKBD COc1cc([C@H](C)NC(=O)N(Cc2ccc([N+](=O)[O-])cc2)C(C)C)ccc1OC1CCCC1 509279600 QCIOUWQNSSHMRJ-SFHVURJKSA-N 455.555 5.606 5 20 JKBD COc1ccc2[nH]cc(C3=CCN(C(=O)c4ccc(N5CCC(C)CC5)c([N+](=O)[O-])c4)CC3)c2c1 510136368 RIXFHUHFSBPWJT-UHFFFAOYSA-N 474.561 5.251 5 20 JKBD CS(=O)(=O)c1ccc2c(c1)CCCN2C(=O)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1 511164279 FSPDDVFIDASNFV-UHFFFAOYSA-N 486.933 5.037 5 20 JKBD C[C@@H]1c2ccsc2CCN1C(=O)C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1 590655423 SMCDTYSDNYUYOF-VVZNPABPSA-N 475.595 6.343 5 20 JKBD O=C(Cc1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1)N1CCC[C@H]1c1ccsc1 603897124 CPEUREHSSDAWNE-QHCPKHFHSA-N 458.543 5.415 5 20 JKBD CSc1ccc(C(=O)N(C)CCCCCc2cc(-c3cccc(F)c3)n[nH]2)cc1[N+](=O)[O-] 604194190 AIDVJHJZYDDLOF-UHFFFAOYSA-N 456.543 5.331 5 20 JKBD CC(=O)N(C)c1ccc(NC(=O)C/C(=C\c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)cc1 604478824 AKIAOORFMUJDFH-XDJHFCHBSA-N 486.553 5.757 5 20 JKBD CO[C@@H](C)c1cccc(NC(=O)C/C(=C/c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)c1 608874508 DIZAQNMBGIQAPR-PNWWAVQQSA-N 473.554 6.481 5 20 JKBD Cc1ccc(NC(=O)c2ccc(NCc3ccc(NC(=O)c4ccncc4)cc3)c([N+](=O)[O-])c2)cc1 608974009 SDUALKJITDMJOX-UHFFFAOYSA-N 481.512 5.415 5 20 JKBD Cc1nn(CCC(=O)Nc2ccc(OCc3cccc(C(F)(F)F)c3)cc2)c(C)c1[N+](=O)[O-] 609066584 QVVDRYZFIGEVSP-UHFFFAOYSA-N 462.428 5.035 5 20 JKBD CCOc1cc(CNc2ccc(OC)cc2)ccc1OCc1cc([N+](=O)[O-])cc2c1OCOC2 728299080 ANTBHVVFNKJTPD-UHFFFAOYSA-N 466.490 5.060 5 20 JKBD NC(=O)c1c(NC(=O)Cn2c3ccccc3c(=O)c3ccccc32)sc2c1-c1ccccc1CCC2 729245664 YBVWQCOKVWJIDS-UHFFFAOYSA-N 493.588 5.110 5 20 JKBD COc1ccc(C(=O)Nc2ccc(NC(=O)OC(C)(C)C)cc2C(F)(F)F)cc1[N+](=O)[O-] 729657271 LUNQFMWAXDOTHG-UHFFFAOYSA-N 455.389 5.222 5 20 JKBD COc1ccc2cc(/C=C\C(=O)O[C@@H](C)C(=O)Nc3ccc([N+](=O)[O-])cc3C(F)(F)F)ccc2c1 746258662 KKTUAVCNFGHQOQ-IUZNHRGFSA-N 488.418 5.359 5 20 JKBD O=C(Cn1c2ccccc2c(=O)c2ccccc21)OCc1cc(Br)ccc1OC(F)F 746568087 WLSYZWWAGVRHOS-UHFFFAOYSA-N 488.284 5.262 5 20 JKBD C[C@H](OC(=O)Cc1csc(-c2ccc(Cl)cc2Cl)n1)C(=O)Nc1cccc([N+](=O)[O-])c1 747255338 YIARDQSNIRSJDE-NSHDSACASA-N 480.329 5.138 5 20 JKBD O=C(OCCOC(c1ccccc1)c1ccccc1)c1csc(-c2cccc([N+](=O)[O-])c2)n1 747962103 KXIFUFZHCPPYCR-UHFFFAOYSA-N 460.511 5.681 5 20 JKBD Cn1c(SCc2nnc(-c3ccc(Br)s3)o2)nc2cc3ccccc3cc2c1=O 749941346 HREUKIZBFALMSU-UHFFFAOYSA-N 485.388 5.253 5 20 JKBD C[C@@H](OC(=O)CCNc1ccc(C(F)(F)F)cc1[N+](=O)[O-])c1nnc(-c2cccc(Cl)c2)o1 750503696 NLMJMSPFCDASGD-LLVKDONJSA-N 484.818 5.423 5 20 JKBD O=C(CCc1nnc(-c2ccccc2)o1)Nc1cc(Cl)c([N+](=O)[O-])cc1OCc1ccccc1 750583643 SDWXCRGRYCDYBK-UHFFFAOYSA-N 478.892 5.449 5 20 JKBD CC(C)(C)OC(=O)Nc1cccc(-c2noc(CCOc3ccc(Cl)cc3[N+](=O)[O-])n2)c1 904634256 SKORAXBSLQRARP-UHFFFAOYSA-N 460.874 5.267 5 20 JKBD Cc1csc(Sc2ccc(-c3nc(-c4ccc(Br)cn4)no3)cc2[N+](=O)[O-])n1 904848797 JEBJQLKCEWZVCG-UHFFFAOYSA-N 476.337 5.385 5 20 JKBD COc1cc([C@@H](C[N+](=O)[O-])c2c[nH]c3ccccc23)ccc1OS(=O)(=O)c1ccc(Cl)cc1 916098038 CILLIIIUMULDDQ-HXUWFJFHSA-N 486.933 5.006 5 20 JKBD CCCN1C(=S)N[C@@H](c2csc([N+](=O)[O-])c2)C(C(=O)Nc2ccccc2C(F)(F)F)=C1C 917375752 URDSNLDMZUWYPW-KRWDZBQOSA-N 484.525 5.229 5 20 JKBD Cc1ccc(-c2nc(COC(=O)c3ccc(N[C@H](C)c4ccccn4)c([N+](=O)[O-])c3)cs2)o1 920543656 HFSZCFCFQYQSGG-OAHLLOKOSA-N 464.503 5.545 5 20 JKBD COc1ccc2c(c1)CCC[C@H]2CC(=O)O[C@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 920665187 WMHRWQYRMHQRGS-HIFRSBDPSA-N 480.439 5.003 5 20 JKBD CC(C)[C@@H](OC(=O)[C@@H](C)Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)Nc1ccccc1C(F)(F)F 920778142 KDJNYPAESFLTBH-KZULUSFZSA-N 488.846 5.241 5 20 JKBD Cn1c(CC(=O)Nc2ccc(C3(NC(=O)/C=C/c4ccc([N+](=O)[O-])o4)CCC3)cc2)cc2ccccc21 1786030122 PNWXDEGDLCWTOA-ACCUITESSA-N 498.539 5.070 5 20 JKBD Cc1c(C(=O)NC2(c3ccc(NC(=O)CCc4cccnc4)cc3)CCC2)cc(Cl)cc1[N+](=O)[O-] 1788278526 FVTKREDRCOMAMJ-UHFFFAOYSA-N 492.963 5.332 5 20 JKBD O=C(/C=C/c1ccccc1[N+](=O)[O-])Nc1ccc(C2(NC(=O)c3ccc4ncoc4c3)CCC2)cc1 1792317713 IXBXPJOEPBHDNR-NTUHNPAUSA-N 482.496 5.197 5 20 JKBD CC(C)[C@@H](C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cc3cc([N+](=O)[O-])ccc3s1)C2)c1ccccc1 1793207346 MJEXOEYFOVDOSZ-FBROZUCGSA-N 491.613 5.501 5 20 JKBD CCCOc1ccc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cc4cc([N+](=O)[O-])ccc4s2)C3)cc1 1799764312 IGCAOVALULRCHH-ACDBMABISA-N 493.585 5.164 5 20 JKBD Cc1c(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)CCc2ccccc2Cl)C3)cc(Cl)cc1[N+](=O)[O-] 1800709786 CBPUCMGHMQWFNF-REPLKXPHSA-N 490.387 5.095 5 20 JKBD Cc1oc(C(C)(C)C)cc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(Cl)cc([N+](=O)[O-])c1C 1800709817 FLYXBJTYWHJNMZ-BCDXTJNWSA-N 487.984 5.321 5 20 JKBD Cc1ccc(CC(=O)N2CCCC[C@H]2c2cc(NC(=O)C[C@@H](C)c3ccccc3)n[nH]2)cc1[N+](=O)[O-] 1822045156 NSJBGRHVWDNECX-XXBNENTESA-N 489.576 5.055 5 20 JKBD CC[C@@H](C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cc(F)cc([N+](=O)[O-])c2)CC1)c1ccccc1 1826316579 KEQKIXWRBPLPQS-RPBOFIJWSA-N 481.568 5.161 5 20 JKBD Cc1cccc(Cl)c1C(=O)N1CCCC[C@H]1C1CCN(C(=O)Cc2cccc([N+](=O)[O-])c2)CC1 1830594238 RVRPQQHFBIZNST-QHCPKHFHSA-N 483.996 5.033 5 20 JKBD Cc1c(C(=O)N2CCCC[C@H]2C2CCN(C(=O)c3ccoc3Cl)CC2)cc(Cl)cc1[N+](=O)[O-] 1830734283 BGCDQRLZLZXRQV-IBGZPJMESA-N 494.375 5.350 5 20 JKBD O=C(/C=C/C1CCCCC1)N1CCC([C@@H]2CCCCN2C(=O)Cc2ccc([N+](=O)[O-])cc2F)CC1 1831295131 WHOJGUQGSIUUKN-OPATVPMHSA-N 485.600 5.033 5 20 JKBD CCCCC[C@H](C)C(=O)N1CCC([C@@H]2CCCCN2C(=O)CSc2ccccc2[N+](=O)[O-])CC1 1831777907 XTPWPXYHZKWFNJ-UNMCSNQZSA-N 489.682 5.523 5 20 JKBD Cc1noc(C)c1CSc1ccccc1C(=O)O[C@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl 8712524 ZROTWZOZRISJIT-CQSZACIVSA-N 489.937 5.329 5 20 JKBD C[C@@H](OC(=O)c1ccccc1CSc1nc2ccccc2o1)C(=O)Nc1ccccc1[N+](=O)[O-] 9556012 LVLRUDXBGSGVLU-OAHLLOKOSA-N 477.498 5.212 5 20 JKBD CCN(CC)Cc1ccc(CNC(=O)c2ccccc2NC(=O)c2ccc([N+](=O)[O-])cc2Cl)cc1 15372880 QABBTOCVXQABBE-UHFFFAOYSA-N 494.979 5.272 5 20 JKBD Cc1nc(-c2ccc(NC(=O)c3ccc(OS(=O)(=O)c4cccc([N+](=O)[O-])c4)cc3)cc2)cs1 15613727 BVSXVEOCFWVFPD-UHFFFAOYSA-N 495.538 5.047 5 20 JKBD Cc1c(NC(=O)CSc2nnc(-c3ccc(F)cc3)n2-c2ccc(F)cc2)cccc1[N+](=O)[O-] 15790652 WGYZZQRVDJYDHJ-UHFFFAOYSA-N 481.484 5.160 5 20 JKBD O=C(Nc1ccccc1C(=O)NC1CC1)c1ccc(NCc2ccccc2Cl)c([N+](=O)[O-])c1 16015223 PIDBDHDYNNXBSU-UHFFFAOYSA-N 464.909 5.005 5 20 JKBD CC(=O)Nc1ccc(NC(=O)C/C(=C/c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)cc1 16019600 YJWGWUMDQLHLHT-JXAWBTAJSA-N 472.526 5.732 5 20 JKBD Cc1sc(NC(=O)C(C)(C)C)c(C(=O)O[C@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)c1C 17956762 DMJGLKGWYJEIER-GFCCVEGCSA-N 472.523 5.226 5 20 JKBD C[C@H](OC(=O)Cn1c2ccccc2c(=O)c2ccccc21)C(=O)N[C@@H](C)c1cccc2ccccc12 28775151 SFKVUEKOKZNWPO-PMACEKPBSA-N 478.548 5.117 5 20 JKBD CN(C(=O)c1ccc(Cl)cc1)c1ccc(NC(=O)c2ccc(NC3CC3)c([N+](=O)[O-])c2)cc1 302980326 HPGHSJBMRZENJX-UHFFFAOYSA-N 464.909 5.351 5 20 JKBD O=C(N[C@H](COc1ccccc1F)c1ccccc1)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-] 488525610 DGXIQWFGTASIEG-LJQANCHMSA-N 478.398 5.225 5 20 JKBD O=C(Nc1ncc(S(=O)(=O)c2ccc([N+](=O)[O-])cc2)s1)c1ccc(-c2ccc(F)cc2)s1 495904352 WIQDXSXOSYUCBI-UHFFFAOYSA-N 489.531 5.004 5 20 JKBD C[C@H](Nc1ccc(C(=O)Nc2ccccc2Sc2nccn2C)cc1[N+](=O)[O-])c1ccccn1 509127813 ZSJQNINQHIZKSU-INIZCTEOSA-N 474.546 5.300 5 20 JKBD CCCOc1ccc(NC(=O)c2cc(OC)c(OCc3cscn3)cc2[N+](=O)[O-])cc1Cl 509925477 KRXFABXWEGPHAN-UHFFFAOYSA-N 477.926 5.333 5 20 JKBD CCN(Cc1ccccc1)C(=O)c1cc(NC(=O)c2ccc(OC)c([N+](=O)[O-])c2)ccc1Cl 515677443 AGRKVWMBJPTLEY-UHFFFAOYSA-N 467.909 5.171 5 20 JKBD C[C@@H]1CCN(C(=O)c2ccn(-c3cccc([N+](=O)[O-])c3)n2)c2cc(C(F)(F)F)ccc2S1 515703093 GIYVEXFMQGJUKW-CYBMUJFWSA-N 462.453 5.330 5 20 JKBD COc1cc(C(=O)N[C@H](CC(C)C)c2cccc(C(F)(F)F)c2)c([N+](=O)[O-])cc1OC(F)F 524207450 FAYGXMHAAJDSOU-OAHLLOKOSA-N 476.398 5.741 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Cl)[C@H](NCCc1ccc(Cl)s1)c1ccccc1 551311248 PYQXFFACQLTBBM-LJQANCHMSA-N 450.347 5.475 5 20 JKBD O=C(C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)Nc1cccc(C(=O)O)c1 554502143 ROSXATOHKZDDBX-ATVHPVEESA-N 459.483 5.472 5 20 JKBD CCOc1ccc([C@@H](C)N[C@@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2ccccc2)cc1OC 603598540 JFQHFYOPRFZLFW-VOIUYBSRSA-N 483.952 5.686 5 20 JKBD CC(C)(C)C(=O)N1CCOc2ccc(NC(=O)CSc3ccc(C(F)(F)F)cc3[N+](=O)[O-])cc21 604020145 GVUVPWBQPGVTGV-UHFFFAOYSA-N 497.495 5.116 5 20 JKBD C[C@@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)NCc1ccccc1COCc1ccccc1 604442901 USXZJMRYTRVCHU-QGZVFWFLSA-N 454.910 5.049 5 20 JKBD O=C(Cc1csc(-c2ccc(C(F)(F)F)cc2)n1)Nc1cc(-c2cccc([N+](=O)[O-])c2)[nH]n1 608789272 BXEDDYCBBPYAPK-UHFFFAOYSA-N 473.436 5.308 5 20 JKBD COc1ccc(CC(=O)Nc2ccccc2NC(=O)c2ccc(C(C)(C)C)cc2)cc1[N+](=O)[O-] 609011149 CZNYSWUZCBDNJE-UHFFFAOYSA-N 461.518 5.334 5 20 JKBD O=[N+]([O-])c1ccc(Sc2nnc(-c3ccccc3)n2Cc2ccc3c(c2)OCO3)c2ccncc12 619673713 NKOAVCUKMIPQGE-UHFFFAOYSA-N 483.509 5.330 5 20 JKBD CC(=O)N(c1cccc(C(F)(F)F)c1)c1nc(COC(=O)c2ccc([N+](=O)[O-])cc2C)cs1 725986139 AMYUWZJRRICAGD-UHFFFAOYSA-N 479.436 5.420 5 20 JKBD O=C(c1ccc(NCc2ccccc2)c([N+](=O)[O-])c1)N1CCC(c2cc3ccccc3[nH]2)CC1 744045412 HKBJUQNIPUKWND-UHFFFAOYSA-N 454.530 5.708 5 20 JKBD Cc1ccccc1-c1ccc(CN(C(=O)C(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)C(C)C)s1 748485686 BBWVQCUETHRYJA-UHFFFAOYSA-N 471.966 5.661 5 20 JKBD Cc1c(C(=O)Nc2ccc(Cl)c(C(=O)NC3CCCCC3)c2)cc([N+](=O)[O-])c(C)c1[N+](=O)[O-] 748625564 FYIGLVLCKOFQKQ-UHFFFAOYSA-N 474.901 5.088 5 20 JKBD C[C@@H](OC(=O)CCc1ccc(-c2ccccc2F)o1)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 762411047 SCIXATTUVPKGCZ-CQSZACIVSA-N 451.410 5.281 5 20 JKBD CN(Cc1ccc(Br)o1)C(=O)c1ccccc1NC(=O)c1ccc([N+](=O)[O-])cc1Cl 915198549 MZYVUUFFWPCCRL-UHFFFAOYSA-N 492.713 5.128 5 20 JKBD O=C(Oc1cccc(Oc2ccccn2)c1)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 916861184 DZHTXSHGIILRLD-UHFFFAOYSA-N 487.434 5.623 5 20 JKBD COc1ccc(OC(=O)c2sc(NC(=O)c3ccc(F)cc3Cl)cc2C)c([N+](=O)[O-])c1 917428251 DVWVCEHLAIJILW-UHFFFAOYSA-N 464.858 5.237 5 20 JKBD CC(C)Cn1cc(C(=O)O[C@@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2C(F)(F)F)c2ccccc21 919484236 AIVTUFAKOKPZKI-AWEZNQCLSA-N 477.439 5.408 5 20 JKBD C[C@H](OC(=O)c1cc(-c2ccccc2)nc2cc(F)ccc12)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 920586645 RYZMPNJWOBBTLR-HNNXBMFYSA-N 484.443 5.917 5 20 JKBD C[C@H](OC(=O)c1csc(-c2ccc(Cl)cc2Cl)n1)C(=O)Nc1ccccc1[N+](=O)[O-] 921223013 KCUYLYWOBVWPAX-JTQLQIEISA-N 466.302 5.209 5 20 JKBD Cc1ccccc1NCC(=O)Nc1ccc(C2(NC(=O)Cc3ccc(C)c([N+](=O)[O-])c3)CCC2)cc1 1788109896 BBMJXHUPWFBJMP-UHFFFAOYSA-N 486.572 5.000 5 20 JKBD O=C(Cc1cccc([N+](=O)[O-])c1)NC1(c2ccc(NC(=O)c3ccoc3C(F)(F)F)cc2)CCC1 1788722052 WRLWHLVHLFPZRJ-UHFFFAOYSA-N 487.434 5.197 5 20 JKBD COc1ccc(Cl)c(C(=O)NC2(c3ccc(NC(=O)c4ccc(O)c([N+](=O)[O-])c4)cc3)CCC2)c1 1790622926 LORUDBLWCGCCAO-UHFFFAOYSA-N 495.919 5.024 5 20 JKBD O=C(CSc1ccccc1[N+](=O)[O-])Nc1ccc(C2(NC(=O)C3CC4(CCC4)C3)CCC2)cc1 1791522908 FJZQBOMYHLDSIS-UHFFFAOYSA-N 479.602 5.401 5 20 JKBD CC(C)[C@H](C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc(F)c1[N+](=O)[O-])c1ccc(Cl)cc1 1800526651 JAYUEZOCHJDLOW-WEMPKCCASA-N 487.959 5.079 5 20 JKBD Cc1ccc2[nH]c(C(=O)N3CCCC[C@@H]3C3CCN(C(=O)c4cccc(F)c4[N+](=O)[O-])CC3)cc2c1 1828123583 WSRSHHMUBLSWLS-XMMPIXPASA-N 492.551 5.071 5 20 JKBD O=C(c1cc(F)ccc1Cl)N1CCC([C@H]2CCCCN2C(=O)c2cccc(F)c2[N+](=O)[O-])CC1 1830621905 SQMRCDAIRPPHCQ-OAQYLSRUSA-N 491.922 5.074 5 20 JKBD CCCCC[C@@H](C)C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cc([N+](=O)[O-])ccc2N(C)C)CC1 1830766884 SLLYICQKHWRAGS-HYBUGGRVSA-N 486.657 5.111 5 20 JKBD Cc1nscc1C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)CC1 1831060366 VCKIMHSNCLGYKV-HXUWFJFHSA-N 498.630 5.122 5 20 JKBD CC(C)(C)Oc1ccc(C(=O)N2CC3(CCCN3C(=O)c3cc4cc([N+](=O)[O-])ccc4s3)C2)cc1 1845739611 SUICUYBGQNNFEY-UHFFFAOYSA-N 493.585 5.118 5 20 JKBD COCCN(C(=O)c1cc(Cl)cc(Cl)c1)c1nc(-c2ccc([N+](=O)[O-])cc2)cs1 14790560 AONKJZGXDVRGCQ-UHFFFAOYSA-N 452.319 5.318 5 20 JKBD C[C@@H](OC(=O)CCCc1ccc(Br)s1)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 16584148 VUEOAODLQQPSCO-LLVKDONJSA-N 466.313 5.096 5 20 JKBD C[C@H](Sc1nc(-c2ccccc2)c(-c2ccccc2)o1)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 17660684 OBPAXWUAXSXMQS-INIZCTEOSA-N 470.510 6.820 5 20 JKBD O=C(CCCn1c(=O)oc2cc([N+](=O)[O-])ccc21)Nc1nc(-c2ccc3ccccc3c2)cs1 18081493 QBYFGDCWRPFPJR-UHFFFAOYSA-N 474.498 5.198 5 20 JKBD C[C@@H](OC(=O)COc1ccc(Cl)c2ccccc12)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 19486788 UMOFPLKHTIHBRW-CYBMUJFWSA-N 453.838 5.135 5 20 JKBD Cc1ccccc1OCc1nnc(S[C@@H](C)C(=O)Nc2ccccc2[N+](=O)[O-])n1-c1ccccc1 22667977 QVOWRYOYGIPKRI-SFHVURJKSA-N 489.557 5.182 5 20 JKBD CCc1ccccc1NC(=O)[C@H](C)OC(=O)Cc1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1 27258867 BMNJDIADGCIVQJ-IBGZPJMESA-N 498.539 5.123 5 20 JKBD Cc1ccc(C(=O)Nc2cccc([N+](=O)[O-])c2C)cc1NC(=O)c1ccc(Br)cc1 31817204 DDWLCSZUNWPVAV-UHFFFAOYSA-N 468.307 5.479 5 20 JKBD COc1ccc([C@@H](NC(=O)c2ccc([N+](=O)[O-])cc2F)c2ccccc2)cc1Br 303221666 VKIXKXKBLYSURF-FQEVSTJZSA-N 459.271 5.024 5 20 JKBD CC(=O)Nc1cccc(CNC(=O)c2ccccc2Sc2ccc(C(F)(F)F)cc2[N+](=O)[O-])c1 482600405 DFEIDZKEEQPMFM-UHFFFAOYSA-N 489.475 5.653 5 20 JKBD Cc1cc(Br)cc(Cl)c1NC(=O)c1csc(-c2ccc([N+](=O)[O-])cc2)n1 496243547 HHRHTEFNVQROSU-UHFFFAOYSA-N 452.717 5.695 5 20 JKBD C[C@@H]1Cc2cc([N+](=O)[O-])ccc2N1C(=O)C[C@@H](NC(=O)c1ccccc1Cl)c1ccccc1 504265361 CNOZNANBFLMBOH-OPAMFIHVSA-N 463.921 5.087 5 20 JKBD Cc1sc(NC(=O)C2CCN(c3ccccc3[N+](=O)[O-])CC2)nc1-c1c(F)cc(F)cc1F 504712259 NWHMYDLDXFYFEK-UHFFFAOYSA-N 476.480 5.299 5 20 JKBD C[C@@H](Nc1ccc(C(=O)N2CCCC[C@@H]2c2nc(-c3ccccc3)no2)cc1[N+](=O)[O-])c1ccccn1 505342007 FHUQGWNCLGQHRX-WZONZLPQSA-N 498.543 5.580 5 20 JKBD C[C@@H](Nc1ccc(C(=O)Nc2nc(-c3ccccc3Cl)cs2)cc1[N+](=O)[O-])c1ccccn1 506236154 QCCQMXJBVVSHSG-CQSZACIVSA-N 479.949 6.192 5 20 JKBD Cc1ccc(Sc2ccc(C(=O)N3CCC(NC(=O)Nc4ccccc4)CC3)cc2[N+](=O)[O-])cc1 508326765 PLDLMTSUZRZHLH-UHFFFAOYSA-N 490.585 5.481 5 20 JKBD C[C@@H](Nc1ccc(C(=O)N(C)CCCOc2cccc(Cl)c2)cc1[N+](=O)[O-])c1ccccn1 509170847 QZNBETHOIWSCRA-QGZVFWFLSA-N 468.941 5.357 5 20 JKBD O=C(C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)NC1CCN(c2ccccc2)CC1 509373868 RFKLTKQQCVLDQU-UZYVYHOESA-N 498.608 5.920 5 20 JKBD COc1ccccc1Oc1ccc(NC(=O)Cn2c3ccccc3c(=O)c3ccccc32)cc1F 510260847 YARBZWGCLOVIPE-UHFFFAOYSA-N 468.484 5.733 5 20 JKBD COc1cc(C(=O)N(Cc2ccccn2)c2ccc(F)cc2)c([N+](=O)[O-])cc1OCc1cscn1 512311401 ALLLAQNFSRDJEY-UHFFFAOYSA-N 494.504 5.020 5 20 JKBD O=C(C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)N1CCOc2ccccc21 512323869 NUIHNISHHFHETG-SDXDJHTJSA-N 457.511 5.561 5 20 JKBD CCC(=O)Nc1ccc(Cl)c(NC(=O)c2ccc(N[C@@H](C)c3ccccn3)c([N+](=O)[O-])c2)c1 512576578 HHJBVIJRFQHAAE-AWEZNQCLSA-N 467.913 5.417 5 20 JKBD CN(Cc1cn(-c2ccccc2)nc1-c1cccs1)C(=O)CSc1ccc([N+](=O)[O-])cc1 512617510 DYBYULWDYTZVPM-UHFFFAOYSA-N 464.572 5.260 5 20 JKBD C[C@H](Nc1ccc(C(=O)N[C@@H](c2ccc(F)cc2)c2cccs2)cc1[N+](=O)[O-])c1ccccn1 516162045 APGPYYSHDSAKAC-FYSMJZIKSA-N 476.533 5.883 5 20 JKBD O=C(Nc1cc(Cl)ccc1Cl)[C@@H]1CCCCN1C(=O)c1cc2cc([N+](=O)[O-])ccc2o1 523059824 WYECEHZOGPVOHP-KRWDZBQOSA-N 462.289 5.281 5 20 JKBD O=C(c1ccccc1Sc1ccc(C(F)(F)F)cc1[N+](=O)[O-])N1CCN(c2ccccn2)CC1 598837411 DLJCQLUPQFDUNM-UHFFFAOYSA-N 488.491 5.122 5 20 JKBD O=C(C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)NCc1ccc2c(c1)OCCO2 600864507 KLNXXNUYBGTSNQ-CPNJWEJPSA-N 487.537 5.223 5 20 JKBD CC(C)(C)c1ccc(C(=O)Nc2ccc(NC(=O)[C@H]3CCCO3)cc2C(F)(F)F)cc1[N+](=O)[O-] 603761580 IPASORDHBDJDQT-LJQANCHMSA-N 479.455 5.281 5 20 JKBD Cc1ccc(C(=O)Nc2nc(-c3cccc([N+](=O)[O-])c3)c(C)s2)cc1NC(=O)c1ccccc1F 603997527 MVJMIWALZJKUSQ-UHFFFAOYSA-N 490.516 5.979 5 20 JKBD C[C@@H](Nc1ccc(C(=O)Nc2cccnc2OCc2ccccc2)cc1[N+](=O)[O-])c1ccccn1 604337285 ILVLRKJGBZOSAG-GOSISDBHSA-N 469.501 5.389 5 20 JKBD Cc1ccc(CN(Cc2ccco2)C(=O)c2ccc(Cn3nc(C)c([N+](=O)[O-])c3C)cc2)s1 604457105 XDVZZUSQVQCHRL-UHFFFAOYSA-N 464.547 5.262 5 20 JKBD Cc1csc(Sc2ccc(NC(=O)c3cc4c(cc3[N+](=O)[O-])OCCO4)cc2Cl)n1 608874419 OCPXACIIBSXFTE-UHFFFAOYSA-N 463.924 5.188 5 20 JKBD C[C@H](Sc1nnc(NCCc2ccccc2)s1)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 611196489 KKMDRNBXAHWIDK-ZDUSSCGKSA-N 454.537 5.004 5 20 JKBD O=C(CCC(=O)c1ccc2ccc3cccc4ccc1c2c34)Nc1ccc(N2CCCS2(=O)=O)cc1 727753780 RXQCFHRGTZKPDQ-UHFFFAOYSA-N 496.588 5.726 5 20 JKBD CCc1ccccc1N(C(C)=O)c1nc(COC(=O)c2c(Cl)cccc2[N+](=O)[O-])cs1 730643345 ABCJLTHBKPZVTR-UHFFFAOYSA-N 459.911 5.309 5 20 JKBD C[C@@H]1CCCCN1C(=O)COC(=O)C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1 748579789 XUQBTFYRCYDPRV-GMYFBSLISA-N 479.558 5.079 5 20 JKBD CCOC(=O)c1c(-c2ccc(C)s2)csc1NC(=O)c1cc(OC)c(OC)cc1[N+](=O)[O-] 812265614 PZMQINQPXUICTB-UHFFFAOYSA-N 476.532 5.139 5 20 JKBD Cn1cnnc1Sc1ccc(-c2nc(-c3ccc(COc4ccccc4)cc3)no2)cc1[N+](=O)[O-] 904443155 OUHWFHBINPOACW-UHFFFAOYSA-N 486.513 5.171 5 20 JKBD COc1cc2[nH]c(/C(Cl)=C\c3ccc(-c4cccc([N+](=O)[O-])c4)s3)nc(=O)c2cc1OC 912859428 SECDENICIUCTEX-CXUHLZMHSA-N 469.906 5.314 5 20 JKBD Cc1ccnc2sc(C(=O)O[C@H](C)C(=O)Nc3ccc([N+](=O)[O-])cc3C(F)(F)F)c(C)c12 914918743 MVVAJRRPUVUENT-LLVKDONJSA-N 467.425 5.024 5 20 JKBD Cc1c(NC(=O)[C@H](C)OC(=O)c2cc(C3CC3)nc3onc(CC(C)(C)C)c23)cccc1[N+](=O)[O-] 915581801 LZGLNTPWEXIWHS-AWEZNQCLSA-N 480.521 5.089 5 20 JKBD O=C(Cc1csc(NC(=O)c2cccs2)n1)Oc1ccc(-c2ccccc2)cc1[N+](=O)[O-] 920330637 LFEKNROPMHIMMM-UHFFFAOYSA-N 465.512 5.180 5 20 JKBD COc1cc(C(=O)OCc2cc3ccccc3nc2Cl)c([N+](=O)[O-])cc1OCc1cscn1 920654318 VKBVRLLVONQWKD-UHFFFAOYSA-N 485.905 5.198 5 20 JKBD O=C(COC(=O)c1csc(-c2ccc(Cl)cc2Cl)n1)Nc1ccc([N+](=O)[O-])cc1Cl 921222981 KAHHKBJXLGGZAD-UHFFFAOYSA-N 486.720 5.474 5 20 JKBD O=C(OCc1nc2ccccc2c2ccccc12)C1CCN(C(=O)/C=C\c2ccccc2)CC1 921293619 FJZIOVWAOOZAHA-PFONDFGASA-N 450.538 5.383 5 20 JKBD O=C(/C=C/c1cc(F)c(F)c(F)c1)NC1(c2ccc(NC(=O)c3ccc([N+](=O)[O-])o3)cc2)CCC1 1785751946 QOEFNMUBXJLIJX-KRXBUXKQSA-N 485.418 5.066 5 20 JKBD O=C(/C=C/c1ccc([N+](=O)[O-])o1)NC1(c2ccc(NC(=O)Cc3ccc(Cl)s3)cc2)CCC1 1786732615 LRYKSIGOJPXHCL-UXBLZVDNSA-N 485.949 5.293 5 20 JKBD O=C(CCc1c[nH]c2ccccc12)Nc1ccc(C2(NC(=O)c3ccc([N+](=O)[O-])o3)CCC2)cc1 1788242431 BYHXYEOLVYYCAY-UHFFFAOYSA-N 472.501 5.050 5 20 JKBD CC(C)=CCCC(=O)Nc1ccc(C2(NC(=O)CSc3ccccc3[N+](=O)[O-])CCC2)cc1 1790453834 YIRYSJBPBMHZGI-UHFFFAOYSA-N 467.591 5.567 5 20 JKBD Cc1ncc(/C=C/C(=O)NC2(c3ccc(NC(=O)/C=C/c4ccccc4[N+](=O)[O-])cc3)CCC2)s1 1792319204 KMIWNVYUBQMWOC-FELDBCONSA-N 488.569 5.220 5 20 JKBD O=C(Cc1cccc([N+](=O)[O-])c1)Nc1cc([C@H]2CCCCN2C(=O)c2cccc3ccccc23)[nH]n1 1814375147 LXDPYMNXPZTYFC-XMMPIXPASA-N 483.528 5.020 5 20 JKBD Cc1c(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)[C@@H](F)c3ccccc3)n[nH]2)cc(Cl)cc1[N+](=O)[O-] 1815557392 VSZMZEDQJPGMHU-KNQAVFIVSA-N 499.930 5.296 5 20 JKBD CC(C)c1ccc(CC(=O)N2CCC([C@H]3CCCCN3C(=O)/C=C/c3ccc([N+](=O)[O-])o3)CC2)cc1 1824278252 CECDGOGGQALSGP-MYHFBWBUSA-N 493.604 5.187 5 20 JKBD CC(=O)N(c1nc(COC(=O)c2cc([N+](=O)[O-])ccc2Cl)cs1)c1cccc(C)c1C 10665528 QYJQBZQWKPWXHQ-UHFFFAOYSA-N 459.911 5.363 5 20 JKBD C[C@@H](OC(=O)CCc1ccc(-c2ccccc2F)o1)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 16320457 HCTBSILJSDEAMA-CYBMUJFWSA-N 494.397 5.516 5 20 JKBD Cc1nn(Cc2ccc(C(=O)Nc3c(-c4ccccc4)nc4ccccn34)cc2)c(C)c1[N+](=O)[O-] 17367174 WWYBZUSCBLHJEF-UHFFFAOYSA-N 466.501 5.023 5 20 JKBD Cc1c(NC(=O)CSc2nnc(-c3ccc(Cl)cc3)n2Cc2ccco2)cccc1[N+](=O)[O-] 21623004 OXRYLVLNYCJMTI-UHFFFAOYSA-N 483.937 5.187 5 20 JKBD O=C(OCc1ncc(-c2ccc(F)cc2)o1)c1ccccc1C(=O)c1ccc(Cl)c([N+](=O)[O-])c1 26421522 DARFEPSOFUEDMP-UHFFFAOYSA-N 480.835 5.630 5 20 JKBD CCOc1ccc(C(=O)NC[C@@H](c2cccc(OC)c2OC)c2c[nH]c3ccccc23)cc1[N+](=O)[O-] 45864038 CNAIPXUXBFXUPS-NRFANRHFSA-N 489.528 5.054 5 20 JKBD CCOC(=O)c1cc(C(=O)Nc2ccccc2Oc2ncc(Cl)cc2Cl)cc([N+](=O)[O-])c1 69624316 QWFZRJRRRVIDGW-UHFFFAOYSA-N 476.272 5.518 5 20 JKBD COc1cc(C(=O)NC[C@@H](C)c2c(Cl)cccc2Cl)c([N+](=O)[O-])cc1OCc1cscn1 72077695 NVTQCFZHTKEUOH-GFCCVEGCSA-N 496.372 5.479 5 20 JKBD O=C(CCC(=O)c1ccc(-c2ccccc2)cc1)OCc1nc(-c2ccc([N+](=O)[O-])cc2)no1 108797214 ULTMZHUISVJGIG-UHFFFAOYSA-N 457.442 5.018 5 20 JKBD Cc1csc(Sc2ccc(C(=O)Nc3ccc(-c4csnn4)cc3)cc2[N+](=O)[O-])n1 108937921 HRLKPSQFSGIKLQ-UHFFFAOYSA-N 455.546 5.282 5 20 JKBD Cc1sc(NC(=O)c2cc(-c3ccco3)nc3c2cnn3C(C)C)nc1-c1cccc([N+](=O)[O-])c1 195704132 YAHDOTNHWUFWMO-UHFFFAOYSA-N 488.529 5.865 5 20 JKBD O=C(Nc1ccccc1N1CCC(O)CC1)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1 195707614 WBNSLGKUQWBRBA-UHFFFAOYSA-N 467.909 5.254 5 20 JKBD O=C(C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)N1CC[C@@H](c2ccccc2)C1 476172688 UZQDXPMESMCZAH-NCJDQSJGSA-N 469.566 6.151 5 20 JKBD C[C@H](Nc1ccc(C(=O)NCCc2ccc(Cl)cc2Cl)cc1[N+](=O)[O-])c1ccccn1 506113491 SDXVWQDZMUSZTN-AWEZNQCLSA-N 459.333 5.442 5 20 JKBD C[C@@H](Nc1ccc(C(=O)NCCc2ccc(OC(F)(F)F)cc2)cc1[N+](=O)[O-])c1ccccn1 507356036 XMWWWDHFQJLKFM-OAHLLOKOSA-N 474.439 5.034 5 20 JKBD COc1cc(C)ccc1Oc1ccc(NC(=O)NCc2ccc(OC)c([N+](=O)[O-])c2)cc1F 510687121 YFDGMTBYVWIHQA-UHFFFAOYSA-N 455.442 5.174 5 20 JKBD C[C@H](Nc1ccc(C(=O)NC[C@@H](c2ccccc2Cl)N2CCCC2)cc1[N+](=O)[O-])c1ccccn1 516170028 XNDPLZQWBYIYRH-BVZFJXPGSA-N 493.995 5.383 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Cl)[C@@H](NC[C@@H]1CCOc2ccccc21)c1ccccc1 521774361 LUHCISREQLSIAS-SBUREZEXSA-N 451.910 5.084 5 20 JKBD Cc1nc(NC(=O)c2ccc(-n3ccnc3)c([N+](=O)[O-])c2)sc1-c1nc2ccccc2n1C(F)F 524615143 HNXPRDVPDHKQCO-UHFFFAOYSA-N 495.471 5.210 5 20 JKBD CCN1C/C(=C/c2ccc(-c3ccc([N+](=O)[O-])cc3)s2)c2nc3ccccc3c(C(=O)O)c2C1 591632336 FWDXPEJGAXXDRJ-LGMDPLHJSA-N 471.538 5.946 5 20 JKBD CNC(=O)c1ccc(NC(=O)C/C(=C\c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)cc1 600888155 YYYOLWOPFLDJIY-NBVRZTHBSA-N 472.526 5.134 5 20 JKBD COc1cc(NC(=O)c2ccc(Sc3ccc(C)cc3)c([N+](=O)[O-])c2)ccc1NC(C)=O 603775059 KIWIWSAKRWYGRX-UHFFFAOYSA-N 451.504 5.274 5 20 JKBD O=C(Nc1cccnc1Oc1ccccc1)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 604243128 KLLRSFCICRQFSY-UHFFFAOYSA-N 486.450 5.656 5 20 JKBD COc1cc2nc(C)sc2cc1NC(=O)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 608850625 WAZRMQVWYURUPD-UHFFFAOYSA-N 494.495 5.395 5 20 JKBD O=C(Nc1cc([N+](=O)[O-])ccc1OC(F)F)N(CCc1ccccn1)Cc1ccc(F)cc1 608891912 SGLDEQUXDTZCFZ-UHFFFAOYSA-N 460.412 5.007 5 20 JKBD Cc1csc(Sc2ccc(C(=O)Nc3cc4c(cc3Cl)OCCO4)cc2[N+](=O)[O-])n1 619216488 ATIJZRAFAIVXTM-UHFFFAOYSA-N 463.924 5.188 5 20 JKBD CC(C)Oc1ccc(NC(=S)/C(=C(/O)c2cccc([N+](=O)[O-])c2)[n+]2ccc3c(c2)CCCC3)cc1 726573747 FKFBIWCSFOPNNR-UHFFFAOYSA-O 490.605 5.872 5 20 JKBD CCCc1cc[n+](/C(C(=S)N[C@H](C)c2cccs2)=C(/O)c2ccc(C)c([N+](=O)[O-])c2)cc1 726579492 MAVZZGXNBSUOIN-QGZVFWFLSA-O 468.624 5.767 5 20 JKBD C[C@H](OC(=O)c1occc1CN1c2ccccc2C[C@H]1C)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 728688307 OKABTLUGNBNWDW-CVEARBPZSA-N 474.473 5.107 5 20 JKBD COc1ccccc1CN(Cc1cccs1)C(=O)c1cc([N+](=O)[O-])c(C)c([N+](=O)[O-])c1C 748608764 UYLJDNAQDXFDNT-UHFFFAOYSA-N 455.492 5.033 5 20 JKBD COc1cc([C@H](C)NC(=O)c2cc([N+](=O)[O-])ccc2Br)ccc1OCc1ccccc1 751092571 GQSAEALJKOZGEO-HNNXBMFYSA-N 485.334 5.436 5 20 JKBD Cc1cc([C@@H](C)NC(=O)c2ccccc2NC(=O)c2ccc([N+](=O)[O-])cc2Cl)c(C)s1 914762304 OKYYUAKGZANKAY-CYBMUJFWSA-N 457.939 5.670 5 20 JKBD CCc1ccccc1N(C(C)=O)c1nc(COC(=O)[C@@H](C)Sc2ccc([N+](=O)[O-])cc2)cs1 916522893 SSKVEDZIPHUUBW-OAHLLOKOSA-N 485.587 5.522 5 20 JKBD CC(C)c1cccc(C(C)C)c1NC(=S)/C(=C(/O)c1cccc([N+](=O)[O-])c1)[n+]1cccc(CO)c1 917611289 YTBCMKZWEMIKAA-UHFFFAOYSA-O 492.621 5.945 5 20 JKBD Cc1nn(C(C)(C)C)c2nc(C3CC3)cc(C(=O)O[C@H](C)C(=O)Nc3ccc([N+](=O)[O-])cc3Cl)c12 919195930 OCSYQXAJRRBNCO-CYBMUJFWSA-N 499.955 5.118 5 20 JKBD Cc1nc(NC(=O)c2ccc(N[C@@H](C)c3ccccn3)c([N+](=O)[O-])c2)sc1-c1ccccc1 919745356 NBQMTRBZMBAQEB-HNNXBMFYSA-N 459.531 5.847 5 20 JKBD Cc1ccccc1N1C(=O)/C(=C/c2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)c2ccccc2C1=O 920397006 GFVVAIDQVNGPCV-HZHRSRAPSA-N 464.481 5.031 5 20 JKBD Cc1cccc2[nH]c(C(=O)NC3(c4ccc(NC(=O)c5ccc([N+](=O)[O-])o5)cc4)CCC3)cc12 1785750865 YYJOWHWYULFMAY-UHFFFAOYSA-N 458.474 5.039 5 20 JKBD CCOc1cccc(C(=O)NC2(c3ccc(NC(=O)/C=C/c4ccc([N+](=O)[O-])o4)cc3)CCC2)c1 1786207677 BTWSCWTXLWYPBS-ACCUITESSA-N 475.501 5.048 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)c3cc4cc([N+](=O)[O-])ccc4s3)CCC2)cc1)c1ccc(F)cn1 1787538321 KMMFUSHCRAKEBN-UHFFFAOYSA-N 490.516 5.405 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)c3cccc(F)c3[N+](=O)[O-])CCC2)cc1)c1ccc2occc2c1 1789049688 VDOGGYKXPKEJHH-UHFFFAOYSA-N 473.460 5.542 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)[C@H]3C[C@H]3c3ccccc3)CCC2)cc1)c1nc2cc([N+](=O)[O-])ccc2[nH]1 1790827807 SGLLGVNSKZVTFM-VXKWHMMOSA-N 495.539 5.023 5 20 JKBD Cc1ccc(CC(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2sc4ccccc4c2Cl)C3)cc1[N+](=O)[O-] 1800138749 GBQOQVVRKBPGAQ-BCDXTJNWSA-N 498.004 5.266 5 20 JKBD Cc1ccc(/C=C/C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)s1 1801208462 GKPRRUUEVGEHKJ-IQTOUSACSA-N 481.599 5.145 5 20 JKBD Cc1cc(CCCC(=O)N2CCCC3(CCN(C(=O)[C@@H]4CCC[C@H]4C)CC3)C2)c([N+](=O)[O-])cc1F 1805821527 WFXYEZDNZVCLNY-DENIHFKCSA-N 487.616 5.032 5 20 JKBD C[C@H](C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cccc(F)c2[N+](=O)[O-])n[nH]1)c1ccc(Cl)cc1 1821167095 CUTBVOJGJKLCMZ-XOBRGWDASA-N 499.930 5.220 5 20 JKBD CC(C)[C@@H](C(=O)N1CCC([C@H]2CCCCN2C(=O)Cc2cccc([N+](=O)[O-])c2)CC1)c1ccccc1 1823677286 SUJGFXBBAHFPLN-IXCJQBJRSA-N 491.632 5.197 5 20 JKBD CC[C@H](C)CC(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)CC1 1824348463 CRDLHSFSZDCSEH-LAUBAEHRSA-N 471.623 5.479 5 20 JKBD CCc1ccc(C(=O)N2CCCC[C@H]2C2CCN(C(=O)c3cc(Cl)cc([N+](=O)[O-])c3C)CC2)cn1 1825750919 SLVKDTUDAWVFSX-QHCPKHFHSA-N 499.011 5.061 5 20 JKBD CC[C@H](C(=O)N1CCCC[C@@H]1C1CCN(C(=O)/C=C/c2ccc([N+](=O)[O-])o2)CC1)c1ccccc1 1826309556 BDTSFBDKVCHQAD-KVKMCETFSA-N 479.577 5.015 5 20 JKBD O=C(CSc1ccccc1)N1CCC([C@@H]2CCCCN2C(=O)/C=C/c2ccccc2[N+](=O)[O-])CC1 1832903001 JPBNTJUZEZOUBL-XXFRDUSWSA-N 493.629 5.020 5 20 JKBD C[C@H](c1nc(-c2cccc(C(F)(F)F)c2)no1)N1CCN(c2ccc([N+](=O)[O-])c3cnccc23)CC1 10428141 YYNHEXGABMOWMR-OAHLLOKOSA-N 498.465 5.095 5 20 JKBD Cc1ccc(-c2cc(C(=O)OCc3nnc(-c4ccc([N+](=O)[O-])cc4)o3)c3cnn(C(C)C)c3n2)cc1 11678418 HLPCERQUMDMZHP-UHFFFAOYSA-N 498.499 5.303 5 20 JKBD c1ccc(-n2c(SCc3nc4ccccc4c4ccccc34)nnc2N2CCOCC2)cc1 17279269 DLUDFFZYJBXZLY-UHFFFAOYSA-N 453.571 5.098 5 20 JKBD NC(=S)/C(=C\c1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2[nH]1 17476282 WJIZTCQMUXVTLU-XSFVSMFZSA-N 466.526 5.151 5 20 JKBD COCCn1c(S[C@@H](C)C(=O)Nc2cc([N+](=O)[O-])ccc2Cl)nc2cc(Cl)ccc21 24048514 VYOJDVXBCXIVGH-NSHDSACASA-N 469.350 5.017 5 20 JKBD Cc1ccc(NC(=O)c2ccccc2SCC(=O)NC23CC4CC(CC(C4)C2)C3)cc1[N+](=O)[O-] 32517007 KYHHDGLEGBVMJB-UHFFFAOYSA-N 479.602 5.333 5 20 JKBD O=C(Nc1nc2cc(C(F)(F)F)ccc2n1Cc1ccco1)c1ccn(-c2cccc([N+](=O)[O-])c2)n1 106201756 XMWBOHNNMVXEAM-UHFFFAOYSA-N 496.405 5.043 5 20 JKBD O=C(c1cc2ccccc2c2cccnc12)N1CCN(Cc2ccc(Br)s2)CC1 107776790 MUNUDJCHIMXKKW-UHFFFAOYSA-N 466.404 5.170 5 20 JKBD C[C@H](Nc1ccc(C(=O)Nc2ccc(OCC(F)(F)F)cc2)cc1[N+](=O)[O-])c1ccccn1 108785675 BCXDINDDEDHKGL-AWEZNQCLSA-N 460.412 5.356 5 20 JKBD COc1cc(C(=O)N[C@@H](c2nc(C3CC3)no2)C(C)C)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 110699920 XPYZXGHLIXVHSU-HXUWFJFHSA-N 486.912 5.437 5 20 JKBD COc1ccc(C(=O)N[C@@H](c2ccccc2)c2ccc3nc(C(F)(F)F)[nH]c3c2)cc1[N+](=O)[O-] 248142916 TYHXOVLYYCLXDF-FQEVSTJZSA-N 470.407 5.018 5 20 JKBD C[C@@H](Sc1nnc(C[C@@H](C)c2ccccc2)o1)C(=O)Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1 255939847 VJCRELCAJYUOHL-HUUCEWRRSA-N 495.586 5.567 5 20 JKBD C[C@@H](Nc1ccc(C(=O)Nc2cccc(C(=O)Nc3cccc(F)c3)c2)cc1[N+](=O)[O-])c1ccccn1 410088553 QOZQMYOSDHGKRG-QGZVFWFLSA-N 499.502 5.807 5 20 JKBD COc1cc([C@@H](C)NC(=O)Cn2c3ccccc3c(=O)c3ccccc32)ccc1OCc1ccncc1 502695953 HNCKUYKCJIKZNX-HXUWFJFHSA-N 493.563 5.015 5 20 JKBD CCCC(=O)Nc1cccc(NC(=O)c2ccc(NCc3ccccc3Cl)c([N+](=O)[O-])c2)c1C 517904770 WEEUIVFKDXRGGV-UHFFFAOYSA-N 480.952 6.160 5 20 JKBD COc1ccc(COc2cccc(F)c2)cc1N[C@H](C)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 519888717 ICSFNOWBFOPKAK-OAHLLOKOSA-N 464.453 5.545 5 20 JKBD CCOc1cc(NC(=O)c2ccc(N3CCc4ccccc4C3)cc2)c([N+](=O)[O-])cc1OCC 520080805 ZBDBAIDBBOWZGZ-UHFFFAOYSA-N 461.518 5.207 5 20 JKBD Cc1ccc(C(=O)Nc2cccc(C(F)(F)F)c2)cc1NCc1nc(-c2ccc([N+](=O)[O-])cc2)no1 520469100 FORYPTTXGGSHGV-UHFFFAOYSA-N 497.433 5.836 5 20 JKBD C[C@H](Nc1ccc2c(c1)CCC(=O)N2Cc1ccc(Cl)cc1)C(=O)Nc1ccccc1[N+](=O)[O-] 521667217 NRMSUMKPKHPTAD-INIZCTEOSA-N 478.936 5.167 5 20 JKBD CC(=O)N1CCCc2cc(NC(=O)c3ccc(NCc4ccccc4Cl)c([N+](=O)[O-])c3)ccc21 523334425 SOSBNYPKSMIBJT-UHFFFAOYSA-N 478.936 5.412 5 20 JKBD CCOc1ccc(NC(=O)CCNc2ccc(C(F)(F)F)cc2[N+](=O)[O-])c(C(F)(F)F)c1 524641108 QQQUAKLWNZNAPF-UHFFFAOYSA-N 465.350 5.472 5 20 JKBD CSc1ccc(C(=O)c2ccccc2C(=O)N2CCC[C@H](N3[C@@H](C)CC[C@@H]3C)C2)cc1[N+](=O)[O-] 550895713 SFEQLYVJZCXTTJ-BJLQDIEVSA-N 481.618 5.025 5 20 JKBD O=C(NCc1ccc(Oc2ccc(Oc3ccccc3)cc2)nc1)c1cc2c(cc1[N+](=O)[O-])OCCO2 603988096 ZNTIJDBHFYFDOW-UHFFFAOYSA-N 499.479 5.276 5 20 JKBD C[C@H]1CCCN(c2ccc(C(=O)Nc3ccc(C(=O)N4CCCC[C@H]4C)cc3)cc2[N+](=O)[O-])C1 603993313 QVVXMQXLQKILQH-RBUKOAKNSA-N 464.566 5.098 5 20 JKBD CCOc1cc(C(=O)Nc2ccc(Oc3ccc(F)cc3)c3ccncc23)c([N+](=O)[O-])cc1OC 609033053 KVGRKUWTHMGTJH-UHFFFAOYSA-N 477.448 5.734 5 20 JKBD Cc1cc[n+](/C(C(=S)N[C@@H](C)c2ccc(Cl)cc2Cl)=C(/O)c2ccc([N+](=O)[O-])cc2)cc1 726569991 FYGMWUSIKIIOJE-HNNXBMFYSA-O 489.404 6.060 5 20 JKBD COc1cc(CN(C)C(=O)c2ccccc2NC(=O)c2ccc([N+](=O)[O-])cc2Cl)ccc1SC 746880572 BYSSAOFUSKTIAN-UHFFFAOYSA-N 499.976 5.503 5 20 JKBD COC(=O)c1c(-c2ccccc2Cl)csc1NC(=O)c1cc([N+](=O)[O-])ccc1Br 751061021 AETOWYQEWAQCLS-UHFFFAOYSA-N 495.738 5.778 5 20 JKBD CC(C)n1ncc2c(C(=O)OCC(=O)Nc3ccc(Cl)c([N+](=O)[O-])c3)cc(-c3cccs3)nc21 809259436 ROIUXNOOSFOLNH-UHFFFAOYSA-N 499.936 5.098 5 20 JKBD C[C@@H](Sc1nnc(-c2ccccc2Br)o1)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl 848971048 VDPLMJCBSFIXLC-SECBINFHSA-N 483.731 5.180 5 20 JKBD Cc1nn(Cc2ccccc2)c(Cl)c1COC(=O)Cn1c2ccccc2c(=O)c2ccccc21 919056027 SGKDNCAPCSCIEH-UHFFFAOYSA-N 471.944 5.105 5 20 JKBD O=C(c1cc(-c2ccncc2)nc2ccc(Br)cc12)N1CCc2cc([N+](=O)[O-])ccc21 919990451 KLLHCJZHYQOVGH-UHFFFAOYSA-N 475.302 5.170 5 20 JKBD O=C(Oc1ccc(-c2ccccc2)cc1[N+](=O)[O-])C1CCN(c2ccc(C(F)(F)F)cn2)CC1 920329400 JIYJVMWNGLMGHO-UHFFFAOYSA-N 471.435 5.498 5 20 JKBD O=C(CSc1nnc(C2CC2)n1Cc1ccccc1)Oc1ccc(-c2ccccc2)cc1[N+](=O)[O-] 920331265 WQPDOTJHKMLCPK-UHFFFAOYSA-N 486.553 5.477 5 20 JKBD C[C@H](SCc1ncc(-c2ccc(Cl)cc2)o1)C(=O)OCc1cc(F)ccc1[N+](=O)[O-] 920670327 FIAOCKMEPVWCNS-LBPRGKRZSA-N 450.875 5.407 5 20 JKBD C[C@H](OC(=O)c1cnc(-c2ccccc2F)s1)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 920698522 JWAPDGLRGQKNQK-JTQLQIEISA-N 483.399 5.060 5 20 JKBD O=C(/C=C/c1ccc([N+](=O)[O-])o1)NC1(c2ccc(NC(=O)c3cccc4ncccc34)cc2)CCC1 1788903934 GWNCMHWWIJSXCQ-ACCUITESSA-N 482.496 5.197 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)c3cccc4ccccc34)CCC2)cc1)c1ccc([N+](=O)[O-])[nH]1 1790186573 YCZJHLIGIBRGGE-UHFFFAOYSA-N 454.486 5.138 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)[C@@H]3C[C@@H]3C3CC3)CCC2)cc1)c1cccc([N+](=O)[O-])c1Br 1790636801 SDMLASFZWODYHT-RTBURBONSA-N 498.377 5.151 5 20 JKBD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2ccc(F)s2)[nH]n1)c1cc2cc([N+](=O)[O-])ccc2s1 1821610578 DSZWPRFFGMKQBU-HNNXBMFYSA-N 499.549 5.353 5 20 JKBD Cc1cc(C(=O)N2CCC([C@H]3CCCCN3C(=O)c3cc4sccc4s3)CC2)ncc1[N+](=O)[O-] 1828551363 VCPDUDHAUZWPKD-GOSISDBHSA-N 498.630 5.122 5 20 JKBD O=C(c1ccsc1)N1CCC([C@@H]2CCCCN2C(=O)C2(c3cccc([N+](=O)[O-])c3)CCC2)CC1 1830291641 QWCUALOEXIGFKM-QHCPKHFHSA-N 481.618 5.012 5 20 JKBD CC[C@H]1CC[C@H](C(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3ccc([N+](=O)[O-])cc3F)CC2)CC1 1831695540 BLONEBZSCAEOLP-DRMXPCRNSA-N 473.589 5.184 5 20 JKBD O=C(COC(=O)c1sc2cc(Cl)ccc2c1Cl)Nc1cc2c(cc1[N+](=O)[O-])OCCCO2 11436562 PEZGGBONJJYNTD-UHFFFAOYSA-N 497.312 5.073 5 20 JKBD CCOc1cc(C(=O)NC[C@H](c2ccccc2Cl)c2c[nH]c3ccccc23)c([N+](=O)[O-])cc1OC 15758541 BXZLGADYTBQWNA-LJQANCHMSA-N 493.947 5.699 5 20 JKBD Cc1occc1-c1nnc(S[C@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2C)n1-c1ccccc1 24014052 WVAOZMRLIYAMKA-MRXNPFEDSA-N 463.519 5.172 5 20 JKBD Cc1cccc(OCCCNC(=O)c2ccccc2NC(=O)c2ccc([N+](=O)[O-])cc2Cl)c1 25995649 CHYJQASSUXYXMB-UHFFFAOYSA-N 467.909 5.008 5 20 JKBD Cc1nn(-c2cccc(Cl)c2)c2sc(C(=O)OCc3nnc(-c4ccc([N+](=O)[O-])cc4)o3)cc12 28624489 OQGSKPRJYAPMEN-UHFFFAOYSA-N 495.904 5.364 5 20 JKBD COc1ccc([C@@H](C)N(C)C(=O)C2CCN(c3ccc(C(F)(F)F)cc3[N+](=O)[O-])CC2)cc1 105773829 WSMWFHIRIOTJKJ-OAHLLOKOSA-N 465.472 5.058 5 20 JKBD Cc1cc(C(=O)N2CCC[C@H](C)C2)ccc1NC(=O)CSc1ccc(C(F)(F)F)cc1[N+](=O)[O-] 195704067 JPRYVBNEXWGDDL-AWEZNQCLSA-N 495.523 5.525 5 20 JKBD Cc1nc(-c2ccccc2)sc1[C@H](C)NC(=O)Cn1c2ccccc2c(=O)c2ccccc21 303027753 SRYTYBBGUVISGU-KRWDZBQOSA-N 453.567 5.464 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)N(C/C=C\c2ccccc2)c2ccc3c(c2)OCCO3)cc1SC 481989212 FRGAXUGYWFMBBB-TWGQIWQCSA-N 492.553 5.457 5 20 JKBD O=C(c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1)N1CCC(OC2CCCCC2)CC1 495670414 RGNGQVYCBLXLQX-UHFFFAOYSA-N 458.942 5.994 5 20 JKBD Cc1cccc(CN(Cc2ccco2)C(=O)c2ccc(Cn3nc(C)c([N+](=O)[O-])c3C)cc2)c1 498898389 OFRQIQPTVCHGMI-UHFFFAOYSA-N 458.518 5.200 5 20 JKBD O=C(NC1CCN(CC(F)(F)F)CC1)c1cc([N+](=O)[O-])ccc1Sc1ccc(Cl)cc1 501170186 AJQRJQZXDLCBKQ-UHFFFAOYSA-N 473.904 5.156 5 20 JKBD COc1ccc([C@H]2CCCN2C(=O)c2ccc(N[C@@H](C)c3ccccn3)c([N+](=O)[O-])c2)c(OC)c1 506069042 DIYIVHPVCQCAFZ-GAJHUEQPSA-N 476.533 5.157 5 20 JKBD C[C@@H](Nc1ccc(C(=O)Nc2ccc(N(C)C)cc2C(F)(F)F)cc1[N+](=O)[O-])c1ccccn1 509183470 JTHREPMETLNYHL-CQSZACIVSA-N 473.455 5.500 5 20 JKBD COc1ccc(NC(C)=O)c(NC(=O)c2ccc(Sc3nc4ccccc4s3)c([N+](=O)[O-])c2)c1 509835913 BXKOXEAPILTXST-UHFFFAOYSA-N 494.554 5.575 5 20 JKBD O=C(c1c2c(nc3ccccc13)/C(=C\c1ccc([N+](=O)[O-])cc1)CCC2)N1CCC(n2cncn2)CC1 509970273 OSDSQOYAASTENC-SILNSSARSA-N 494.555 5.089 5 20 JKBD COc1ccccc1Oc1ccc(NC(=O)CSCc2ccc(OC)c([N+](=O)[O-])c2)cc1F 511577699 QUEBCMFFBMPBQU-UHFFFAOYSA-N 472.494 5.415 5 20 JKBD CC[C@H](NCc1ccc(OC)c(OCc2ccc([N+](=O)[O-])cc2)c1)c1ccc2c(c1)OCCO2 517537171 HNVHIPBECMLJFB-QFIPXVFZSA-N 464.518 5.195 5 20 JKBD CC(C)Oc1ccc(NC(=O)c2cc(OCC(F)(F)F)ccc2[N+](=O)[O-])c(C(F)(F)F)c1 517924080 ZJNZWGXFRWDLRZ-UHFFFAOYSA-N 466.334 5.594 5 20 JKBD Cc1cc(C)n([C@@H](C)C(=O)Nc2ccc(NC(=O)c3cc4ccccc4c4cccnc34)cc2Cl)n1 521540814 HLQJDAILZROFJJ-SFHVURJKSA-N 497.986 6.307 5 20 JKBD NC(=O)CC[C@H]1CCCN(C(=O)c2c3c(nc4ccccc24)/C(=C/c2cccc([N+](=O)[O-])c2)CCC3)C1 524039819 UNRCSJSNPKIGJW-SRMPHAGFSA-N 498.583 5.138 5 20 JKBD CCCOc1cc(NC(=O)N2CCO[C@H](c3ccc(F)c(F)c3)C2)c([N+](=O)[O-])cc1OCCC 524307979 ZQSAOXALMUGKLF-QFIPXVFZSA-N 479.480 5.056 5 20 JKBD O=[N+]([O-])c1cc(C(F)(F)F)ccc1CNc1cccc(NS(=O)(=O)Cc2ccccc2)c1 600861519 XRTQQJROQVZHAL-UHFFFAOYSA-N 465.453 5.168 5 20 JKBD CCn1c(Sc2ccc(S(=O)(=O)Nc3ccc(C)cc3C)cc2[N+](=O)[O-])nnc1-c1ccco1 603843429 XJGARERBPRKFHM-UHFFFAOYSA-N 499.574 5.035 5 20 JKBD COc1cc([C@@H](C)NC(=O)c2cc(SC)ccc2[N+](=O)[O-])ccc1OCc1ccccc1 603986695 OTPBIMMLNBLQGP-MRXNPFEDSA-N 452.532 5.395 5 20 JKBD Cc1onc(-c2ccccc2Cl)c1C(=O)Nc1nc(-c2cccc([N+](=O)[O-])c2)c(C)s1 603997350 WFDNSIFTFWGOJH-UHFFFAOYSA-N 454.895 5.896 5 20 JKBD Cc1cc([N+](=O)[O-])ccc1NC(=O)CNc1ccc(Cl)cc1C(=O)N1[C@@H](C)CCC[C@@H]1C 604009982 JEJOJAIFPLCROV-HOTGVXAUSA-N 458.946 5.010 5 20 JKBD COc1cc(CNCCc2c[nH]c3cc(Cl)ccc23)c([N+](=O)[O-])cc1OCC(F)(F)F 604532627 FFHIHVRNOVFUBP-UHFFFAOYSA-N 457.836 5.012 5 20 JKBD Cc1cc(O[C@@H](C)c2ccccc2)ccc1NC(=O)c1ccc(Sc2nncn2C)c([N+](=O)[O-])c1 609066506 HPZSYKOXPLVHJU-KRWDZBQOSA-N 489.557 5.575 5 20 JKBD C[C@H](OC(=O)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1)c1cnc2ccccc2c1 726335365 JPZXPVGHMRLGHR-HNNXBMFYSA-N 473.451 5.683 5 20 JKBD Cc1nc(NC(=O)c2ccc(Nc3ccccc3)c([N+](=O)[O-])c2)sc1-c1nnc(S)n1C1CC1 729322755 CAGVTRGZNNIUEJ-UHFFFAOYSA-N 493.574 5.238 5 20 JKBD CC1=C(C(=O)Nc2ccccc2C(F)(F)F)[C@@H](c2ccc(C)c([N+](=O)[O-])c2)NC(=S)N1C1CC1 731672027 VYHAYMYYRIADLR-HXUWFJFHSA-N 490.507 5.228 5 20 JKBD CC(=O)N(c1ccc(C(F)(F)F)cc1)c1nc(COc2cc(C=O)ccc2[N+](=O)[O-])cs1 748151188 QQGCKRQMQWEHQP-UHFFFAOYSA-N 465.409 5.146 5 20 JKBD O=[N+]([O-])c1ccc2c(c1)n(CN1CCC[C@@H]1c1ncon1)c(=S)n2-c1cccc(C(F)(F)F)c1 750020242 XTSGBACRHSVSGV-QGZVFWFLSA-N 490.467 5.266 5 20 JKBD O=C(CC12C[C@H]3C[C@@H](CC(O)(C3)C1)C2)O[C@H](C(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1)c1ccccc1 750508451 YAJMJAWGOKOMCV-WXQJIMTASA-N 498.963 5.193 5 20 JKBD O=C(COC(=O)Cc1csc(-c2ccc(C(F)(F)F)cc2)n1)Nc1ccc([N+](=O)[O-])cc1Cl 825348983 HRMKCIBPFHKOTJ-UHFFFAOYSA-N 499.854 5.115 5 20 JKBD O=[N+]([O-])c1ccc2[nH]cc(Cc3nc(-c4cccc(Cn5cnc6ccccc65)c4)no3)c2c1 904492710 OXZSSFWAPDMWRY-UHFFFAOYSA-N 450.458 5.115 5 20 JKBD Cc1ccc(C(=O)O[C@@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)cc1NC(=O)c1ccccc1 915019448 LCBCOLBWVACEMX-INIZCTEOSA-N 472.457 5.124 5 20 JKBD Cc1c([N+](=O)[O-])cc(C(=O)Nc2ccccc2Oc2ncc(Cl)cc2Cl)cc1[N+](=O)[O-] 915871536 XEWMRSYHVJVXIF-UHFFFAOYSA-N 463.233 5.558 5 20 JKBD Cc1sc(NC(=O)Cc2ccc(NC(=O)OC(C)(C)C)cc2)nc1-c1cccc([N+](=O)[O-])c1 917790895 MIKTXBOUPLNFRK-UHFFFAOYSA-N 468.535 5.555 5 20 JKBD C[C@@H](OC(=O)C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)c1nc(C2CC2)no1 919013577 ZVSDPHDDOJSDED-MTOJCTJASA-N 476.514 5.700 5 20 JKBD Cc1ccc(/C(O)=C(/C(=S)Nc2ccc(Cl)c(Cl)c2)[n+]2cc(O)ccc2C)cc1[N+](=O)[O-] 920483712 KBLLINQDPHRYIZ-UHFFFAOYSA-O 491.376 5.835 5 20 JKBD O=C(Cc1ccccc1C(F)(F)F)NC1(c2ccc(NC(=O)c3ccc([N+](=O)[O-])o3)cc2)CCC1 1785748616 UXKSOFSJUQOPTK-UHFFFAOYSA-N 487.434 5.197 5 20 JKBD O=C(NC1(c2ccc(NC(=O)[C@@H]3CCCCO3)cc2)CCC1)c1cc2cc([N+](=O)[O-])ccc2s1 1785890521 XSTMTHOSANNOQF-FQEVSTJZSA-N 479.558 5.126 5 20 JKBD COc1ccc(C(=O)NC2(c3ccc(NC(=O)CSc4ccccc4[N+](=O)[O-])cc3)CCC2)s1 1791521552 VRWJYIUDXICTDG-UHFFFAOYSA-N 497.598 5.205 5 20 JKBD O=C(Cc1ccc2ccccc2c1)N1CCC2(CCCN(C(=O)CCc3cccc([N+](=O)[O-])c3)C2)CC1 1806491840 SHJOQXMQAXFYFQ-UHFFFAOYSA-N 499.611 5.155 5 20 JKBD CC[C@H](C)CC(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cc(Cl)cc([N+](=O)[O-])c2C)n[nH]1 1821289426 HCRWAPZCGPKPMY-SCLBCKFNSA-N 461.950 5.022 5 20 JKBD O=C(Cc1cccc([N+](=O)[O-])c1)N1CCC([C@H]2CCCCN2C(=O)CCc2ccccc2Cl)CC1 1826571951 QSLWAMBTUCMBIW-RUZDIDTESA-N 498.023 5.043 5 20 JKBD Cc1cccc(Cl)c1C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cc(F)cc([N+](=O)[O-])c2)CC1 1830617995 HZCRHMQCMLOESL-QFIPXVFZSA-N 487.959 5.243 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)N1CCC([C@H]2CCCCN2C(=O)[C@@H]2CCc3ccccc32)CC1 1831980469 LHAIJQVUQYMEMU-RCZVLFRGSA-N 493.579 5.006 5 20 JKBD COCCN(C(=O)c1ccc(C(F)(F)F)cc1)c1nc(-c2ccc([N+](=O)[O-])cc2)cs1 14790537 MDZKQYUCRMLLDR-UHFFFAOYSA-N 451.426 5.030 5 20 JKBD Cc1nc(-c2ccc(CN[C@@H](C(=O)Nc3ccc([N+](=O)[O-])cc3Cl)c3ccccc3)s2)cs1 15506904 KWCVMJOGNSLIRM-JOCHJYFZSA-N 499.017 6.211 5 20 JKBD Cc1csc(Sc2ccc(C(=O)Nc3cnc4c(cnn4C(C)C)c3)cc2[N+](=O)[O-])n1 17526370 YWNQPNPNSDNMME-UHFFFAOYSA-N 454.537 5.089 5 20 JKBD Cc1ccccc1-n1c(S[C@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)nnc1-c1cccnc1 17542115 OYKSZKRBYOJLSX-MRXNPFEDSA-N 485.529 5.449 5 20 JKBD C[C@H](Sc1nnc(-c2ccc(F)cc2)n1Cc1ccccc1)C(=O)Nc1ccccc1[N+](=O)[O-] 21743536 XJVWJSRAGPBJQV-INIZCTEOSA-N 477.521 5.160 5 20 JKBD CCOc1cc(C(=O)N(Cc2ccccc2)[C@H](C)c2cccc(NC(C)=O)c2)c([N+](=O)[O-])cc1OC 23193483 RNYLDEZGIBOJGX-GOSISDBHSA-N 491.544 5.364 5 20 JKBD CCOc1ccc(NC(=O)c2ccccc2C(=O)c2ccc(SC)c([N+](=O)[O-])c2)cc1OC 25923953 WXFBMIMJMPHDRJ-UHFFFAOYSA-N 466.515 5.207 5 20 JKBD CSc1ccc(C(=O)Nc2ccc(NC(=O)c3ccccc3F)cc2C(F)(F)F)cc1[N+](=O)[O-] 195612421 ZJOBPFIWSRVJRY-UHFFFAOYSA-N 493.438 5.979 5 20 JKBD O=C(c1cc([N+](=O)[O-])ccc1Oc1ccccc1)N1CCC[C@H](c2nc(-c3ccc(F)cc3)no2)C1 303156094 UGGSZPNGLFXTTF-SFHVURJKSA-N 488.475 5.596 5 20 JKBD O=C(C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)N[C@H]1COc2ccccc2C1 480069831 NCQQENOTBRCJNS-QRRJMBGHSA-N 471.538 5.255 5 20 JKBD CCOC(=O)C1CCC(NC(=O)c2ccccc2Sc2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 503066588 OLQHRATZTBZAOQ-UHFFFAOYSA-N 496.507 5.617 5 20 JKBD CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccccc1C(=O)N1C[C@@H](C)C[C@@H](C)C1 509248999 VNWSSQMLXGREHI-KDURUIRLSA-N 452.555 5.155 5 20 JKBD CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)NC1CCN(Cc2cccc(C(F)(F)F)c2)CC1 509784650 ZXEKJOFMKPBGLB-UHFFFAOYSA-N 478.515 5.198 5 20 JKBD O=C(Nc1cccc(COc2cccc(F)c2)c1)c1ccc([N+](=O)[O-])cc1I 511266191 LLZMCAACULWTAX-UHFFFAOYSA-N 492.244 5.170 5 20 JKBD COCCN(C(=O)[C@H]1CCC[C@H](C(F)(F)F)C1)c1nc(-c2ccc([N+](=O)[O-])cc2)cs1 515159543 KYMZAEQAQVUJNF-GJZGRUSLSA-N 457.474 5.066 5 20 JKBD CCCC(=O)Nc1cccc(NC(=O)c2ccc(N3C[C@@H](C)C[C@H](C)C3)c([N+](=O)[O-])c2)c1C 517906117 QZGUNOVRWZJMDU-IRXDYDNUSA-N 452.555 5.376 5 20 JKBD Cc1ccc(S(=O)(=O)Nc2ccc(NC(=O)Nc3ccccc3Cl)cc2)cc1[N+](=O)[O-] 518430120 HNFFHPVCMLJCNS-UHFFFAOYSA-N 460.899 5.001 5 20 JKBD CN(C[C@@H]1CCCOC1)C(=O)c1c2c(nc3ccccc13)/C(=C\c1ccc([N+](=O)[O-])cc1)CCC2 521683992 LVTNCSWZIPNTSD-CVVHJZTLSA-N 471.557 5.519 5 20 JKBD O=[N+]([O-])c1ccc(-c2ccc(CNC[C@@H]3CCCO[C@H]3c3ccccc3)o2)c(Br)c1 521830316 RXKKMFZMBYJMPW-SBUREZEXSA-N 471.351 5.875 5 20 JKBD O=C(CSc1ccc(C(F)(F)F)cc1[N+](=O)[O-])Nc1ccccc1-c1nc2ccccc2[nH]1 603470435 CUXXTDGKOFBCLU-UHFFFAOYSA-N 472.448 5.888 5 20 JKBD Cc1sc(NC(=O)c2cnc3ccccc3c2C(F)(F)F)nc1-c1cccc([N+](=O)[O-])c1 603997409 ZQGJOGGRCKUVED-UHFFFAOYSA-N 458.421 5.846 5 20 JKBD CCCO[C@@H]1CCCN(C(=O)c2ccc(Sc3nc4ccccc4s3)c([N+](=O)[O-])c2)CC1 609376222 XDLCQPWASACJRV-QGZVFWFLSA-N 471.604 5.777 5 20 JKBD O=C(C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)NC[C@H]1CCOc2ccccc21 609409196 SHBBOVIZVPIAQT-GCFJHJGGSA-N 485.565 5.818 5 20 JKBD C[C@H](OC(=O)c1ccc(N2C[C@H](C)C[C@@H](C)C2)c([N+](=O)[O-])c1)C(=O)Nc1ccccc1C(F)(F)F 728943841 UZZFZVYEMOSWRY-OAGGEKHMSA-N 493.482 5.280 5 20 JKBD CC[C@@H](C)Sc1ccc(NC(=O)c2cc([N+](=O)[O-])c(C)c([N+](=O)[O-])c2C)c(C(F)(F)F)c1 748659012 YATGUSQKVPRLJO-SNVBAGLBSA-N 471.457 6.282 5 20 JKBD CC(C)Cn1cc([C@H]2N(C(=O)c3ccc(Nc4ccccc4)c([N+](=O)[O-])c3)CC23CCOCC3)cn1 849528816 BTDJMWPZRMXSGU-RUZDIDTESA-N 489.576 5.185 5 20 JKBD C[C@H]1C[C@@H](C)CN(c2ccc(-c3nc([C@@H]4CCC(=O)N(CC5CCCC5)C4)no3)cc2[N+](=O)[O-])C1 856582794 VWBYWMMDBZCNFB-LVCYWYKZSA-N 481.597 5.023 5 20 JKBD Cc1cc([N+](=O)[O-])nn1Cc1cccc(-c2nc(-c3ccc(Cn4cnc5ccccc54)cc3)no2)c1 904476327 PUJBFFYSAPDVGY-UHFFFAOYSA-N 491.511 5.263 5 20 JKBD C[C@H]1CCCCN1C(=O)c1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2N2CCCC2)cc1Cl 918645316 FWFHIEICYHSXGD-INIZCTEOSA-N 470.957 5.115 5 20 JKBD C[C@H](Cc1ccccc1F)NC(=O)c1ccccc1NC(=O)c1ccc([N+](=O)[O-])cc1Cl 919853439 OELVIGQKDNVGCL-CQSZACIVSA-N 455.873 5.001 5 20 JKBD Cc1ccc(CC(=O)NC2(c3ccc(NC(=O)C4(c5cccc([N+](=O)[O-])c5)CCC4)cc3)CCC2)o1 1790476603 LZKWQAAATPKANA-UHFFFAOYSA-N 487.556 5.295 5 20 JKBD O=C(Cc1cc(F)ccc1[N+](=O)[O-])NC1(c2ccc(NC(=O)c3cccc4ccncc34)cc2)CCC1 1790862029 DQVLQACGBRAYDW-UHFFFAOYSA-N 498.514 5.273 5 20 JKBD CC(C)[C@H](C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cc(F)cc([N+](=O)[O-])c1)C2)c1ccc(Cl)cc1 1793223698 GOSRMHZEGYLXMZ-KGSLCBSSSA-N 487.959 5.079 5 20 JKBD Cc1cccc(Cl)c1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cc(Cl)cc([N+](=O)[O-])c1C)C2 1800492010 ZLUKHPSFLGQZAA-BJWYYQGGSA-N 476.360 5.084 5 20 JKBD Cc1ccc(NC(=O)[C@@H](Sc2nc(-c3ccccc3F)n[nH]2)c2ccccc2)c([N+](=O)[O-])c1 9801175 JOUBYHLIFZLPTH-FQEVSTJZSA-N 463.494 5.300 5 20 JKBD Cc1ccc(NC(=O)[C@H](Sc2nnc(-c3cccs3)n2C)c2ccccc2)c([N+](=O)[O-])c1 10709409 NSSUNCQZSDBMQD-LJQANCHMSA-N 465.560 5.232 5 20 JKBD CSc1ccc([N+](=O)[O-])c(C(=O)Nc2ccc(C)c(S(=O)(=O)Nc3ccc(Cl)cc3)c2)c1 16226768 QQGYVYFTLFSQFY-UHFFFAOYSA-N 491.978 5.332 5 20 JKBD C[C@@H](OC(=O)c1ccc(-c2nc3ccccc3s2)s1)C(=O)Nc1ccccc1[N+](=O)[O-] 21736968 DGDLNTICLGSPCA-GFCCVEGCSA-N 453.501 5.117 5 20 JKBD CCn1c(SCC(=O)Nc2c(Cl)cccc2C(F)(F)F)nc2cc3ccccc3cc2c1=O 22177975 FPGCLSLVYSQQPC-UHFFFAOYSA-N 491.922 5.973 5 20 JKBD CC(=O)c1ccc(Oc2ccc(N(C)S(=O)(=O)c3ccc(Cl)cc3)cc2)c([N+](=O)[O-])c1 28725906 XZLAOGAIMGPVLE-UHFFFAOYSA-N 460.895 5.068 5 20 JKBD CCn1c(S[C@@H](C(=O)Nc2ccc(C)cc2[N+](=O)[O-])c2ccccc2)nc2ccccc2c1=O 36787816 SZDRESHNYMHIJY-JOCHJYFZSA-N 474.542 5.105 5 20 JKBD Cc1cc(=O)c(C(=O)N(c2ccc3[nH]ccc3c2)[C@@H](C)CC(C)C)nn1-c1ccccc1[N+](=O)[O-] 72066701 GCPDXMRZFMQODA-KRWDZBQOSA-N 473.533 5.012 5 20 JKBD O=C(Nc1nc(-c2ccccc2OC(F)F)cs1)c1ccc(N2CCCC2)c([N+](=O)[O-])c1 110601216 BNPGIJRFGMGKNG-UHFFFAOYSA-N 460.462 5.172 5 20 JKBD Cc1ccc(NC(=O)C(C)C)cc1NC(=O)c1ccc(NCc2ccccc2Cl)c([N+](=O)[O-])c1 479194471 MIORBCPEDLIMJN-UHFFFAOYSA-N 480.952 6.016 5 20 JKBD O=C(NCCOC1CCCC1)c1ccccc1Sc1ccc(C(F)(F)F)cc1[N+](=O)[O-] 489079906 XVNLTILQNXAYRM-UHFFFAOYSA-N 454.470 5.454 5 20 JKBD CCOc1cc([N+](=O)[O-])c(C(=O)N(Cc2ccco2)C23CC4CC(CC(C4)C2)C3)cc1OC 498918430 LKVZFUZYBUSERB-UHFFFAOYSA-N 454.523 5.206 5 20 JKBD Cc1ccc(N(C(=O)c2ccc(-n3cncn3)c([N+](=O)[O-])c2)c2nc3ccccc3s2)c(C)c1 508569210 MNDOSGLRLLERBG-UHFFFAOYSA-N 470.514 5.381 5 20 JKBD C[C@@H](Nc1ccc(C(=O)Nc2cc(Cl)ccc2OC[C@@H]2CCCO2)cc1[N+](=O)[O-])c1ccccn1 509814309 SZFVEZXRXMJPJC-APWZRJJASA-N 496.951 5.626 5 20 JKBD COc1cc(C(=O)NC[C@H](c2ccccc2)c2c[nH]c3ccccc23)c([N+](=O)[O-])cc1OC(F)F 514740286 GZITZDBSAGSVNP-GOSISDBHSA-N 481.455 5.248 5 20 JKBD O=C(Nc1cc2c(cc1[N+](=O)[O-])OCCCO2)c1oc2ccccc2c1CSc1cccs1 520022408 GKRMPVXFBYCALJ-UHFFFAOYSA-N 482.539 6.108 5 20 JKBD Cc1csc(Sc2ccc(C(=O)Nc3ccc(OCc4noc(C)n4)cc3)cc2[N+](=O)[O-])n1 520831322 DJCCDPDSRXPCER-UHFFFAOYSA-N 483.531 5.034 5 20 JKBD Cc1ccccc1NC(=O)[C@@H]1CCc2ccccc2N1C(=O)c1ccc(NC2CC2)c([N+](=O)[O-])c1 524164143 NRAWQDVZMBHWDD-DEOSSOPVSA-N 470.529 5.078 5 20 JKBD O=C(Nc1ccc(O)c2ccccc12)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 588751903 SDNIVMWSVKALRD-UHFFFAOYSA-N 459.424 5.328 5 20 JKBD CCCNC(=O)C1CCN(C(=O)c2ccccc2Sc2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 602244216 BTUGMFGHAQQIJE-UHFFFAOYSA-N 495.523 5.143 5 20 JKBD C[C@H](NC(=O)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1)c1ccc2nc(O)[nH]c2c1 604243906 NAKADAXJQQLLRQ-LBPRGKRZSA-N 452.854 5.113 5 20 JKBD CCn1c(SCC(=O)NCc2ccc(F)cc2C(F)(F)F)nc2cc3ccccc3cc2c1=O 613973287 UEGIDKFGQGLCMS-UHFFFAOYSA-N 489.494 5.136 5 20 JKBD CC(C)[C@@H](CC(=O)O[C@@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F)c1ccccc1 728640648 XHJJYVLWJKSPBL-WMLDXEAASA-N 452.429 5.314 5 20 JKBD COC(=O)c1cc2ccccc2cc1NC(=O)c1ccc(N[C@H](C)c2ccccn2)c([N+](=O)[O-])c1 729252359 WSQKLZOBFQUYAD-MRXNPFEDSA-N 470.485 5.355 5 20 JKBD Cc1ccc(C2=CCN(C(=O)c3ccccc3NC(=O)c3ccc([N+](=O)[O-])cc3Cl)CC2)cc1 843536095 CJKGOZDGPCEEOZ-UHFFFAOYSA-N 475.932 5.738 5 20 JKBD O=C(NCc1ccc2c(c1)OCO2)[C@H](Sc1nc2ccc([N+](=O)[O-])cc2s1)c1ccccc1 896112874 PHDVHXYGCLXCTA-OAQYLSRUSA-N 479.539 5.083 5 20 JKBD COc1ccc(NC(=O)c2nnc(/C(Cl)=C\c3ccc(-c4ccccc4[N+](=O)[O-])s3)s2)cc1 912965313 LLIGWKZEWUFHNX-SFQUDFHCSA-N 498.973 6.173 5 20 JKBD CC(C)c1ccc([C@H](NC(=O)C(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)c2cccs2)cc1 915743591 STNOJBKLRBCYDU-FQEVSTJZSA-N 457.939 5.277 5 20 JKBD Cc1ccccc1-c1nnc(SCC(=O)Nc2cc(Cl)ccc2[N+](=O)[O-])n1Cc1ccco1 916663810 RCLUVJBSKCZATC-UHFFFAOYSA-N 483.937 5.187 5 20 JKBD C[C@H](N[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Br)c1ccccc1)c1cccc([N+](=O)[O-])c1 917938098 FWTNLFZKNWIAQD-LHSJRXKWSA-N 499.321 5.296 5 20 JKBD O=C(Nc1ccc(Cl)cc1)c1ccccc1NC(=O)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-] 918559174 SRMNIJRBHPRFSF-UHFFFAOYSA-N 493.825 5.694 5 20 JKBD O=C(NCc1ccccc1F)c1cc(NC(=O)c2cc([N+](=O)[O-])ccc2N2CCCC2)ccc1Cl 918593312 LPLAUVDBMNWJOQ-UHFFFAOYSA-N 496.926 5.170 5 20 JKBD CC(=O)N(c1ccc(C(F)(F)F)cc1)c1nc(COC(=O)c2cc(Cl)ccc2[N+](=O)[O-])cs1 920498428 VALKUFZEMDPYDY-UHFFFAOYSA-N 499.854 5.765 5 20 JKBD COc1cc(C(=O)NC2(c3ccc(NC(=O)[C@H](C)c4cccs4)cc3)CCC2)ccc1[N+](=O)[O-] 1791813467 AFFZMWCFZPTNIQ-MRXNPFEDSA-N 479.558 5.216 5 20 JKBD Cc1c(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2ccc(C(F)(F)F)cc2)C3)cc(Cl)cc1[N+](=O)[O-] 1800711625 ORBTXIKCYSTHFL-BCDXTJNWSA-N 495.885 5.141 5 20 JKBD CC(C)[C@@H](C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1ccc([N+](=O)[O-])cc1F)C2)c1ccc(Cl)cc1 1801552281 UFILYPRSHURGHH-ISJRUSPKSA-N 487.959 5.079 5 20 JKBD O=C(NC[C@H]1CCN(C(=O)CCC2CCC2)[C@H]1c1cccnc1)c1cc2cc([N+](=O)[O-])ccc2s1 1812304928 XIZGORJOABCZFK-CLOONOSVSA-N 492.601 5.104 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2ccccc2Cl)n[nH]1 1820428699 ZQNXNPILXDZSKO-IBGZPJMESA-N 485.903 5.039 5 20 JKBD CCC1(C(=O)N2CCCC[C@H]2c2cc(NC(=O)C3(c4cccc([N+](=O)[O-])c4)CCC3)n[nH]2)CCC1 1820841720 YDTRJVQTOLXJDK-NRFANRHFSA-N 479.581 5.012 5 20 JKBD Cc1oc(C(C)(C)C)cc1C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cc(F)cc([N+](=O)[O-])c2)n[nH]1 1821164083 JZYBPWPJTJSJFD-HXUWFJFHSA-N 497.527 5.276 5 20 JKBD O=C(/C=C/c1ccccc1[N+](=O)[O-])Nc1cc([C@H]2CCCCN2C(=O)c2ccc3ccoc3c2)[nH]n1 1823502632 FBVQIEBBYBDDNX-NELJVSICSA-N 485.500 5.083 5 20 JKBD Cc1cc(CCCC(=O)N2CCCC[C@@H]2C2CCN(C(=O)[C@]3(C)C[C@@H]3C)CC2)c([N+](=O)[O-])cc1F 1824369875 AVSVQAVWXJZFFQ-AVHWCYKHSA-N 487.616 5.031 5 20 JKBD O=C(c1cc2ccoc2s1)N1CCC([C@H]2CCCCN2C(=O)c2cccc(F)c2[N+](=O)[O-])CC1 1830619104 JCQRKHHXCLVBDI-LJQANCHMSA-N 485.537 5.089 5 20 JKBD C[C@@H](OC(=O)c1cccc(NC(=O)OC(C)(C)C)c1)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 18026452 WDQPGHYXLPAIJE-GFCCVEGCSA-N 497.426 5.145 5 20 JKBD Cc1cc(Cl)ccc1NC(=O)COc1ccc2c(-c3ccc([N+](=O)[O-])cc3)cc(=O)oc2c1 28799494 RFOWHMQDQYIIDM-UHFFFAOYSA-N 464.861 5.348 5 20 JKBD O=C(Nc1cc(F)ccc1OC[C@@H]1CCCO1)c1ccc(Nc2ccccc2)c([N+](=O)[O-])c1 502402889 CVMDGJBDMYCBHH-IBGZPJMESA-N 451.454 5.288 5 20 JKBD C[C@@H](Nc1ccc(C(=O)N(C)CCc2cccc3ccccc23)cc1[N+](=O)[O-])c1ccccn1 505104064 KHJQZMFZSAAEAC-LJQANCHMSA-N 454.530 5.631 5 20 JKBD Cc1ncc([N+](=O)[O-])cc1C(=O)Nc1sc(-c2ccccc2)c(C)c1C(=O)N1CCCCC1 506949075 YYAOPCFMAOURNH-UHFFFAOYSA-N 464.547 5.214 5 20 JKBD Cc1noc([C@@H](C)NC(=O)c2c3c(nc4ccccc24)/C(=C\c2ccc([N+](=O)[O-])cc2)CCC3)n1 509115923 UKXUADUMPNUEPV-SULWINFOSA-N 469.501 5.202 5 20 JKBD O=C(Cn1cccn1)Nc1cccc(CNCc2ccc(Oc3ccccc3Cl)c([N+](=O)[O-])c2)c1 509598766 GPVBAFKJKKHKSU-UHFFFAOYSA-N 491.935 5.166 5 20 JKBD CCN(C(=O)c1cc(OC)c(OCc2cscn2)cc1[N+](=O)[O-])[C@H](C)c1cc2ccccc2o1 511486834 ITAJOLGMYOTNKG-OAHLLOKOSA-N 481.530 5.608 5 20 JKBD CN(C(=O)c1ccc(NC(=O)c2cc(OCC(F)(F)F)ccc2[N+](=O)[O-])cc1)C1CCCCC1 515874681 FCQXXYVCLSHZPN-UHFFFAOYSA-N 479.455 5.193 5 20 JKBD O=C(Cn1cc([N+](=O)[O-])cn1)N(Cc1ccccc1)c1nc(-c2ccc(Cl)cc2Cl)cs1 516071832 RWUIZCVJZXCCGC-UHFFFAOYSA-N 488.356 5.455 5 20 JKBD C[C@H]1CCCCN1CCCCNC(=O)C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1 516397506 KELNGFZJRDTICL-WDWWVRLLSA-N 492.645 5.906 5 20 JKBD Cc1ccc(C)c(Sc2ccc(NC(=O)CNC(=O)c3c(Cl)cccc3[N+](=O)[O-])cc2)c1 518655733 XGWSKXXCTBKALP-UHFFFAOYSA-N 469.950 5.385 5 20 JKBD O=C(C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)Nc1ccc(NC(=O)C2CC2)nc1 518743058 KLVDENBQPIGWPZ-QGOAFFKASA-N 499.552 5.517 5 20 JKBD Cc1ccc(NC(=O)c2cccc(C(F)(F)F)c2)cc1NC(=O)c1cc([N+](=O)[O-])cnc1C 519953204 PUTRCTLUCZXQGS-UHFFFAOYSA-N 458.396 5.130 5 20 JKBD CS(=O)(=O)c1cc(C(=O)Nc2ccc(Sc3ccccc3Cl)cc2)cc([N+](=O)[O-])c1 520477742 JNUZFUCYMCGUSM-UHFFFAOYSA-N 462.936 5.055 5 20 JKBD CCOCc1cccc(NC(=O)C/C(=C/c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)c1 522566110 AOMNNHMHOQWGKX-ZHZULCJRSA-N 473.554 6.310 5 20 JKBD CC(C)(C)c1ccc(C(=O)N2CCC[C@@H](c3nc(-c4ccc(F)cc4)no3)C2)cc1[N+](=O)[O-] 522584092 JYXKBKONZRZLCE-QGZVFWFLSA-N 452.486 5.101 5 20 JKBD CCOc1cc(NC(=O)c2cc(-c3ccco3)nn2-c2ccccc2)c([N+](=O)[O-])cc1OCC 589648913 XORVGSRUPPCGKA-UHFFFAOYSA-N 462.462 5.090 5 20 JKBD Cc1ccc(NS(=O)(=O)c2ccc(NCc3nc4ccccc4s3)c([N+](=O)[O-])c2)c(C)c1 603472498 ODRHUAAQVNIEKZ-UHFFFAOYSA-N 468.560 5.234 5 20 JKBD Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)c1cccc(NC(=O)c2ccc(Br)cc2)c1 603778283 ZFONQDXPPFFWCZ-UHFFFAOYSA-N 468.307 5.479 5 20 JKBD O=C(Cc1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1)N1CCC[C@H]1c1ccccc1 603839656 UJWAPZBJMKXYPC-VWLOTQADSA-N 452.514 5.354 5 20 JKBD COc1cc([C@H]2Nc3ccc(Cl)cc3C(=O)N2C)ccc1OCc1ccc([N+](=O)[O-])cc1 603940646 MKZXRWKKAMKLEE-QFIPXVFZSA-N 453.882 5.032 5 20 JKBD CCN(Cc1ccncc1)C(=O)C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1 608960707 WIMXSMLQACQSDM-HMMYKYKNSA-N 458.543 5.579 5 20 JKBD COc1ccc(C[C@@H](N[C@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)c2ccccc2)cc1OC 608980683 FUHKKUDKTRQANV-VGOFRKELSA-N 474.517 5.297 5 20 JKBD COc1ccc(CC(=O)N(c2ccc(C(C)C)cc2)c2nc3ccccc3s2)cc1[N+](=O)[O-] 609009083 BHGCGRHNLDTMAM-UHFFFAOYSA-N 461.543 6.244 5 20 JKBD Cc1cc([C@H](C)NC(=O)c2ccc(C(=O)N[C@H](C)c3cc(C)sc3C)c([N+](=O)[O-])c2)c(C)s1 609043953 JUMMIELIPHVERG-LSDHHAIUSA-N 485.631 5.933 5 20 JKBD Cc1cc(OCc2cccc(F)c2)ccc1NC(=O)c1ccc(Sc2nncn2C)c([N+](=O)[O-])c1 609064565 FGZRYMMITVFCJH-UHFFFAOYSA-N 493.520 5.153 5 20 JKBD CC(C)(NC(=O)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1)C(=O)Nc1ccccc1 609377078 YMPXTUSBYGFJPZ-UHFFFAOYSA-N 453.882 5.188 5 20 JKBD COCCN(C(=O)CCSc1ccccc1F)c1nc(-c2ccc([N+](=O)[O-])cc2)cs1 610421722 OTRBYAJDLFLPOG-UHFFFAOYSA-N 461.540 5.019 5 20 JKBD CC(C)(C)c1ccc(N2CCC(NC(=O)c3cc([N+](=O)[O-])ccc3Br)CC2)cc1 725906743 AIZVPXNVUQFPMV-UHFFFAOYSA-N 460.372 5.054 5 20 JKBD Cc1ccc(Sc2ccc(C(=O)N3CCC(NC(=O)Oc4ccccc4)CC3)cc2[N+](=O)[O-])cc1 727336456 PDOBBDYGOUGDHS-UHFFFAOYSA-N 491.569 5.448 5 20 JKBD CC(C)(C)OC(=O)Nc1ccc(NC(=O)c2ccc(N3CCCC3)c([N+](=O)[O-])c2)c(C(F)(F)F)c1 729657226 KWUVKGZDFOBUJP-UHFFFAOYSA-N 494.470 5.813 5 20 JKBD C[C@@H](OC(=O)Cn1ccc2cc([N+](=O)[O-])ccc21)C(=O)N1c2ccccc2Sc2ccccc21 744615443 QZPUOQOIJHBUTM-MRXNPFEDSA-N 473.510 5.311 5 20 JKBD CC(C)N(C)CC1CCN(C(=O)c2cc([N+](=O)[O-])ccc2N2CCC(Cc3ccccc3)CC2)CC1 746842933 BFYFXLDIRSUQMG-UHFFFAOYSA-N 492.664 5.246 5 20 JKBD COc1cc(C(=O)O[C@H](C)c2cnc3ccccc3c2)c([N+](=O)[O-])cc1OCc1cscn1 747354694 MQLKNJUFZRYVLB-CQSZACIVSA-N 465.487 5.105 5 20 JKBD COc1ccc(-c2cc(C(=O)N3CCc4cc([N+](=O)[O-])ccc43)c3ccccc3n2)cc1OC 758718391 QQHDJYNILCWYRG-UHFFFAOYSA-N 455.470 5.030 5 20 JKBD CC(C)(C)c1noc(COC(=O)C/C(=C\c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)n1 912646223 LDAWTWHRDGQWKV-FOWTUZBSSA-N 478.530 5.559 5 20 JKBD Cc1ccc(-c2nc(CC(=O)Oc3ccc4c(-c5ccc([N+](=O)[O-])cc5)cc(=O)oc4c3)cs2)o1 914714202 XEXUBPYVZVLULP-UHFFFAOYSA-N 488.477 5.541 5 20 JKBD C[C@H](OC(=O)CCOc1ccccc1-c1ccccc1)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl 914998997 DNBWJDJESJNKEU-INIZCTEOSA-N 468.893 5.255 5 20 JKBD O=C(Nc1cc([N+](=O)[O-])c(F)cc1F)c1ccccc1SCc1ccc(Br)cc1 915838095 ZSKCCRWONWAFNI-UHFFFAOYSA-N 479.302 6.180 5 20 JKBD Cc1ccc(-n2c(S[C@@H](C)C(=O)Nc3ccc(F)c([N+](=O)[O-])c3)nnc2-c2ccccn2)c(C)c1 917255657 CEHMURNWNCISFT-INIZCTEOSA-N 492.536 5.113 5 20 JKBD O=C(Nc1ccccc1C(=O)Nc1ccc(CCN2CCCC2)cc1)c1ccc([N+](=O)[O-])cc1Cl 919871804 PCKDWLLTAUMCGK-UHFFFAOYSA-N 492.963 5.391 5 20 JKBD Cc1ccc(C(=O)NC2(c3ccc(NC(=O)/C=C/c4ccc([N+](=O)[O-])o4)cc3)CCC2)s1 1786206251 DIOOKAWLKQDLHI-DHZHZOJOSA-N 451.504 5.019 5 20 JKBD O=C(NC1(c2ccc(NC(=O)c3ccc([N+](=O)[O-])[nH]3)cc2)CCC1)c1cnc2ccc(Cl)cc2c1 1790186731 KJDNGCSNCNJRFT-UHFFFAOYSA-N 489.919 5.186 5 20 JKBD O=C(C[C@H]1C[C@@H]2CC[C@H]1C2)Nc1ccc(C2(NC(=O)Cc3cc(F)ccc3[N+](=O)[O-])CCC2)cc1 1791324030 NJHGDBCPRQUDMO-CEXWTWQISA-N 479.552 5.237 5 20 JKBD CC[C@H]1CC[C@H](C(=O)N2CCC3(CCCN(C(=O)Cc4ccc(Cl)cc4[N+](=O)[O-])C3)CC2)CC1 1805485014 NMPXGEYNEJRYQD-MXVIHJGJSA-N 490.044 5.238 5 20 JKBD CC[C@H]1CC[C@H](C(=O)N2CCCC[C@@H]2c2cc(NC(=O)CCc3cccc([N+](=O)[O-])c3)n[nH]2)CC1 1815538481 KZZUWLLWELWNBD-KKLQWCBXSA-N 481.597 5.159 5 20 JKBD O=C(CCc1ccccc1Cl)Nc1cc([C@@H]2CCCCN2C(=O)c2cccc(F)c2[N+](=O)[O-])[nH]n1 1817004614 PVKIGFDCFOBYBH-FQEVSTJZSA-N 499.930 5.049 5 20 JKBD Cc1cc(Cl)c(Cl)cc1C(=O)N1CCC([C@H]2CCCCN2C(=O)c2ccc([N+](=O)[O-])o2)CC1 1823615317 PDHVGHPFJZXAAW-LJQANCHMSA-N 494.375 5.350 5 20 JKBD O=C(c1cccc2c1CCCC2)N1CCC([C@@H]2CCCCN2C(=O)/C=C/c2ccc([N+](=O)[O-])o2)CC1 1824278269 CVWJMYFAIMCNPS-BVYAJCBJSA-N 491.588 5.013 5 20 JKBD O=C(N[C@@H]1CCc2nc(NC(=O)C3CC4(CCC4)C3)sc2C1)c1cc2cc([N+](=O)[O-])ccc2s1 1827373466 RGDNAGYUBMOJPU-OAHLLOKOSA-N 496.614 5.072 5 20 JKBD Cc1cscc1C(=O)N1CCCC[C@H]1C1CCN(C(=O)Cc2ccc(Cl)cc2[N+](=O)[O-])CC1 1827801676 OLSIWTXGIXBNDF-NRFANRHFSA-N 490.025 5.094 5 20 JKBD O=C(/C=C/C1CCCCC1)N1CCC([C@H]2CCCCN2C(=O)c2cccc(F)c2[N+](=O)[O-])CC1 1830620774 GEHTWFMNQVSVMX-MDRMPYQZSA-N 471.573 5.104 5 20 JKBD O=C(c1cccc2ncccc12)N1CCC([C@H]2CCCCN2C(=O)/C=C/c2ccccc2[N+](=O)[O-])CC1 1832906621 DIRYFCRDGHHUHM-JBXKERDYSA-N 498.583 5.090 5 20 JKBD Cc1nn(-c2ccccc2)c(C)c1NC(=O)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 10540646 GVGQUGPLJWZOST-UHFFFAOYSA-N 487.482 5.271 5 20 JKBD Cc1nc2cc(C(=O)OCC(=O)Nc3ccc([N+](=O)[O-])cc3C(F)(F)F)ccc2n1-c1ccccc1 10992720 CVTIZSFLUCGJMJ-UHFFFAOYSA-N 498.417 5.056 5 20 JKBD C[C@H](OC(=O)c1ccccc1C(=O)c1ccc(Cl)c([N+](=O)[O-])c1)C(=O)N[C@H](C)c1ccc(F)cc1 11029313 TYUXNSFTQKKCRH-CABCVRRESA-N 498.894 5.041 5 20 JKBD Cc1ccccc1OCc1nnc(SCCC(=O)Nc2ccccc2[N+](=O)[O-])n1-c1ccccc1 26372123 APWXUKPXZCRRBX-UHFFFAOYSA-N 489.557 5.184 5 20 JKBD CN(Cc1cn(-c2ccccc2)nc1-c1ccccc1)C(=O)c1cc2cccc([N+](=O)[O-])c2[nH]1 71946049 SFERMFHSZSNWQZ-UHFFFAOYSA-N 451.486 5.201 5 20 JKBD O=C(CSc1ccc(C(F)(F)F)cc1[N+](=O)[O-])N(Cc1ccccn1)c1ccc(F)cc1 108335591 NYLKTXSCKGDFHF-UHFFFAOYSA-N 465.428 5.473 5 20 JKBD CCN1CCc2ccc(NC(=O)c3ccccc3NC(=O)c3ccc([N+](=O)[O-])cc3Cl)cc21 110810773 LMIZIGGKRJEPDC-UHFFFAOYSA-N 464.909 5.135 5 20 JKBD CN(C(=O)CSc1ccc(C(F)(F)F)cc1[N+](=O)[O-])[C@H](c1ccccc1)C(F)(F)F 303191301 MESBWNYLUALQQH-MRXNPFEDSA-N 452.376 5.468 5 20 JKBD CC(=O)c1cccc(NC(=O)[C@H](Sc2nc3cc4ccccc4cc3c(=O)n2C)C(C)C)c1 498081869 HGNDKYFOVOCEKM-HSZRJFAPSA-N 459.571 5.045 5 20 JKBD O=C(Nc1cccc(NC(=O)c2ccn(-c3ccc([N+](=O)[O-])cc3)n2)c1)c1cccc(C(F)(F)F)c1 504781546 GDMFZYHINOFTGG-UHFFFAOYSA-N 495.417 5.304 5 20 JKBD CSc1ccc(C(=O)c2ccccc2C(=O)N(C)CCc2ccc(F)cc2)cc1[N+](=O)[O-] 508327754 TYBMWHWARVMANU-UHFFFAOYSA-N 452.507 5.002 5 20 JKBD Cc1noc([C@@H]2CCCN(C(=O)c3ccc(Sc4nc5ccccc5s4)c([N+](=O)[O-])c3)C2)n1 509154813 OBOWVIAEMABXEC-OAHLLOKOSA-N 481.559 5.067 5 20 JKBD Cc1ccc(Sc2ccc(C(=O)N3CCC(C(=O)N[C@@H](C)C(C)C)CC3)cc2[N+](=O)[O-])cc1 512298833 LZJDXNYVDZPEHP-SFHVURJKSA-N 469.607 5.067 5 20 JKBD CCOc1cc(CNCc2ccc([N+](=O)[O-])cc2)ccc1OCC(=O)N1C[C@@]2(C)C[C@H]1CC(C)(C)C2 513642748 KDDZKJPBTBOOGX-LXFBAYGMSA-N 495.620 5.089 5 20 JKBD C[C@H](SCC(=O)Nc1cc2c(cc1[N+](=O)[O-])OCCCO2)c1ccc(OC(F)(F)F)cc1 518915355 PCTWXNCZYIVUJN-LBPRGKRZSA-N 472.441 5.088 5 20 JKBD Cc1ccc(-c2csc(NC(=O)CCc3nnc(-c4cc5ccccc5o4)o3)n2)cc1[N+](=O)[O-] 522393017 NFENTIQXLSKYEA-UHFFFAOYSA-N 475.486 5.394 5 20 JKBD CC(C)Oc1ccc(CNC(=O)c2cc(OCC(F)(F)F)ccc2[N+](=O)[O-])c(C(F)(F)F)c1 523268955 ZEBRNKXTQNNNDN-UHFFFAOYSA-N 480.361 5.272 5 20 JKBD CC(=O)Nc1cccc(NC(=O)c2ccc(NCc3ccccc3Cl)c([N+](=O)[O-])c2)c1C 603458605 YIGXCWDEPDJYSK-UHFFFAOYSA-N 452.898 5.379 5 20 JKBD O=C(Nc1ccc(Cl)cc1Cl)[C@H]1CCCCN1C(=O)c1ccc(NC2CC2)c([N+](=O)[O-])c1 603620298 QNIWYQVMVOXCSJ-LJQANCHMSA-N 477.348 5.109 5 20 JKBD CCOc1cc(NC(=O)N[C@@H]2C[C@@H](C(F)(F)F)C[C@@H](C(F)(F)F)C2)c([N+](=O)[O-])cc1OCC 603651020 ZVUWOJQGTVAPPI-GDNZZTSVSA-N 487.397 5.423 5 20 JKBD COc1ccc(NC(=O)c2ccc(NC(=O)c3cc(OCC(F)(F)F)ccc3[N+](=O)[O-])cc2)cc1 603726581 BURUMRGMUYOKKO-UHFFFAOYSA-N 489.406 5.049 5 20 JKBD O=C(CCNc1ccccc1[N+](=O)[O-])Nc1ccc(NC(=O)c2ccc(F)cc2)cc1C(F)(F)F 603742884 JPELKVGOEQYSSN-UHFFFAOYSA-N 490.413 5.446 5 20 JKBD C[C@H](Nc1ccc([N+](=O)[O-])c(C(=O)N2CCCC2)c1)c1ccc(NC(=O)c2ccc(F)cc2)cc1 603942603 PGPXZRXXWQJAHQ-KRWDZBQOSA-N 476.508 5.395 5 20 JKBD O=C(NCc1ccco1)c1cccc(CNC(=O)c2cc([N+](=O)[O-])ccc2Sc2ccccc2)c1 603967212 ZZQDAVCJLWXPMY-UHFFFAOYSA-N 487.537 5.199 5 20 JKBD O=C(CC1CCN(C(=O)c2ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])cc2)CC1)NC1CCCC1 604396600 BHFUNSVTPJWYEA-UHFFFAOYSA-N 485.968 5.342 5 20 JKBD O=C(c1csc(-c2ccc([N+](=O)[O-])cc2)n1)N1CCC[C@@H](c2nc(-c3ccc(Cl)cc3)no2)C1 608817603 OTPDRYLESGAMAH-MRXNPFEDSA-N 495.948 5.442 5 20 JKBD Cc1ccc(NC(=O)c2ccc(Nc3cccc(NC(=O)[C@H](C)n4cccn4)c3)c([N+](=O)[O-])c2)cc1 608972879 KNNULVQWBQOSIS-SFHVURJKSA-N 484.516 5.295 5 20 JKBD Cc1ccc(C(=O)N[C@@H](CC(=O)N(Cc2ccccc2[N+](=O)[O-])CC(F)(F)F)c2ccccc2)cc1 609228255 LPFRGTQKNMKYPR-QFIPXVFZSA-N 499.489 5.356 5 20 JKBD CCc1cc[n+](/C(C(=S)Nc2ccc(Cl)nc2)=C(/O)c2ccc(C)c([N+](=O)[O-])c2)cc1 727159282 FWVDAVJVYXCCES-UHFFFAOYSA-O 455.947 5.125 5 20 JKBD O=C(c1cnc2c(cnn2Cc2ccccc2)c1)N(CC1CC1)c1ccc(Cl)c([N+](=O)[O-])c1 728165411 JKJNYYDYTLJMJD-UHFFFAOYSA-N 461.909 5.098 5 20 JKBD CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccc2c(c1)CCCN2C(=O)OC(C)(C)C 729576422 VTOXQQVTRULVFV-UHFFFAOYSA-N 468.554 5.725 5 20 JKBD Cc1c(-c2ccccc2)sc(NC(=O)COc2ccc([N+](=O)[O-])c(F)c2)c1C(=O)N1CCCCC1 745753139 FFHUIJUYBSZPFW-UHFFFAOYSA-N 497.548 5.414 5 20 JKBD CCCN(Cc1ccc(F)cc1)C(=O)c1ccccc1NC(=O)c1ccc([N+](=O)[O-])cc1Cl 745844510 VHHTYDDWUVTOAC-UHFFFAOYSA-N 469.900 5.692 5 20 JKBD CC(=O)N(c1ccc(C)c(C)c1)c1nc(COC(=O)c2c[nH]c3cc([N+](=O)[O-])ccc23)cs1 756765353 HLRWCJBPROWYAJ-UHFFFAOYSA-N 464.503 5.191 5 20 JKBD Cc1ccc(-c2cnc(CCC(=O)Oc3ccc4c(-c5ccc([N+](=O)[O-])cc5)cc(=O)oc4c3)o2)cc1 821892505 IAEKKTMGZILHQF-UHFFFAOYSA-N 496.475 5.870 5 20 JKBD COc1ccc(NC(=O)[C@H](C)OC(=O)c2csc(-c3ccc(C(C)C)cc3)n2)c([N+](=O)[O-])c1 900259008 WOSPPNGUCWMKPK-AWEZNQCLSA-N 469.519 5.034 5 20 JKBD CC(=O)N(c1ccc(Cl)cc1)c1nc(/C=C\c2ccnc(-c3cccc([N+](=O)[O-])c3)[n+]2[O-])cs1 917560164 IFIOCHHGJUFOAL-YFHOEESVSA-N 493.932 5.255 5 20 JKBD CC(C)c1cccc(NC(=S)/C(=C(/O)c2ccc([N+](=O)[O-])cc2)[n+]2ccc(C(C)(C)C)cc2)c1 917614817 JQJATAIGVJAJEL-UHFFFAOYSA-O 476.622 6.627 5 20 JKBD Cc1ccc(NC(=O)Nc2ccccc2)cc1NS(=O)(=O)c1ccc(Cl)c([N+](=O)[O-])c1 917738955 FOURHQRNPBNCFX-UHFFFAOYSA-N 460.899 5.001 5 20 JKBD C[C@H](N[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1)c1cccc([N+](=O)[O-])c1 917939535 VOPDOZCLVPDBJM-QKKBWIMNSA-N 454.870 5.187 5 20 JKBD CSCC[C@@H](NC(=O)c1ccc(Cl)c([N+](=O)[O-])c1)C(=O)O[C@@H](C)c1cccc(Cl)c1 918765733 XOHUZQBJKODVOD-YVEFUNNKSA-N 471.362 5.058 5 20 JKBD O=C(CCc1cccc([N+](=O)[O-])c1)Nc1ccc(C2(NC(=O)c3cccc4ccncc34)CCC2)cc1 1786602116 DDJNVPMGGZLGBH-UHFFFAOYSA-N 494.551 5.524 5 20 JKBD O=C(NC1(c2ccc(NC(=O)[C@H]3C[C@@H]3c3ccc(Cl)cc3)cc2)CCC1)c1ccc([N+](=O)[O-])[nH]1 1789154101 LAXBGDUKXHRYOV-UXHICEINSA-N 478.936 5.128 5 20 JKBD CCCCCc1ncc(C(=O)NC2(c3ccc(NC(=O)c4ccc([N+](=O)[O-])[nH]4)cc3)CCC2)s1 1790186033 DLUPGFDJZBEZAR-UHFFFAOYSA-N 481.578 5.174 5 20 JKBD Cc1cnc(Cl)c(C(=O)NC2(c3ccc(NC(=O)c4cccc(F)c4[N+](=O)[O-])cc3)CCC2)c1 1790698058 LGIMUEXFNZQLKV-UHFFFAOYSA-N 482.899 5.152 5 20 JKBD O=C(NC1(c2ccc(NC(=O)C3(F)CC3)cc2)CCC1)c1cc2cc([N+](=O)[O-])ccc2s1 1791155170 WTTHXLBILTZAFL-UHFFFAOYSA-N 453.495 5.059 5 20 JKBD O=C(/C=C/c1ccc([N+](=O)[O-])o1)NC1(c2ccc(NC(=O)CCc3ccc(F)cc3)cc2)CCC1 1791459824 ULQDTXVJIJWACM-SDNWHVSQSA-N 477.492 5.107 5 20 JKBD CCc1ncsc1C(=O)NC1(c2ccc(NC(=O)/C=C/c3ccccc3[N+](=O)[O-])cc2)CCC1 1792317620 ZGBDYBAPACIFBO-MDWZMJQESA-N 476.558 5.075 5 20 JKBD C/C(=C\c1ccc(C)o1)C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2c(F)ccc([N+](=O)[O-])c2C)n[nH]1 1821286824 IDGBMXZHSCZHMX-OSJHKOOESA-N 495.511 5.076 5 20 JKBD Cc1c(C(=O)N2CCCC[C@H]2c2cc(NC(=O)C3CC(C)(C)C3)n[nH]2)cc(Cl)cc1[N+](=O)[O-] 1822475336 KGKJDFFXYBGSTQ-SFHVURJKSA-N 473.961 5.022 5 20 JKBD Cc1cc(Cl)ccc1C(=O)N1CCCC[C@@H]1C1CCN(C(=O)Cc2cccc([N+](=O)[O-])c2)CC1 1823908337 UEMBRUSACQPSPS-XMMPIXPASA-N 483.996 5.033 5 20 JKBD O=C(CCc1cccc([N+](=O)[O-])c1)N1CCC([C@@H]2CCCCN2C(=O)c2ccc3ccoc3c2)CC1 1830906199 SVGAOPPQHHHXQK-VWLOTQADSA-N 489.572 5.207 5 20 JKBD O=C([C@H]1CC=CCC1)N1CCC([C@H]2CCCCN2C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)CC1 1831061088 MFCRTKVQUJRRLQ-SIKLNZKXSA-N 481.618 5.399 5 20 JKBD Cc1cc([N+](=O)[O-])ccc1NC(=O)CSc1nnc(-c2ccccc2)n1-c1ccc(F)cc1F 10317001 QKPNXULUEHNTJK-UHFFFAOYSA-N 481.484 5.160 5 20 JKBD O=[N+]([O-])c1cccc(OC[C@H](O)CSc2nnc(-c3ccccc3Cl)n2Cc2ccccc2)c1 15237042 IOJQVEMNYRYWLE-IBGZPJMESA-N 496.976 5.087 5 20 JKBD COc1ccccc1-c1nnc(SCc2cc([N+](=O)[O-])cc3c2OCOC3)n1-c1ccc(C)cc1 21673791 WSHIIESHVOBJIT-UHFFFAOYSA-N 490.541 5.318 5 20 JKBD O=C(CCSc1nnc(-c2ccc(F)cc2)n1Cc1ccccc1)Nc1ccccc1[N+](=O)[O-] 26369504 XYVJWASKKZADBZ-UHFFFAOYSA-N 477.521 5.162 5 20 JKBD O=C(C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1)N1CCCC[C@@H]1Cc1ccccc1 60340506 VAQGUUWKQOHHEL-OAQYLSRUSA-N 475.511 5.454 5 20 JKBD CSCC[C@@H](NC(=O)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1)c1nnc2ccccn12 105220862 RHKZIIJOUHUOOO-GOSISDBHSA-N 497.964 5.307 5 20 JKBD O=C(C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1)N1CCC[C@H]1CCc1ccccc1 108283825 PWXALIAELSVCPP-NRFANRHFSA-N 475.511 5.454 5 20 JKBD COc1ccc2[nH]cc(C3CCN(Cc4cc(OC)c(OC(F)F)cc4[N+](=O)[O-])CC3)c2c1 108969784 SIHTXDMDPMAOOU-UHFFFAOYSA-N 461.465 5.074 5 20 JKBD Cc1ccccc1OCc1nnc(SCC(=O)c2cccc([N+](=O)[O-])c2)n1-c1ccccc1 216808706 UQNYZQHRJGJFTH-UHFFFAOYSA-N 460.515 5.038 5 20 JKBD CCOc1ccc(C(=O)N(C)Cc2cn(-c3ccccc3)nc2-c2cccs2)cc1[N+](=O)[O-] 248147966 WIJTYSRJBHPZBL-UHFFFAOYSA-N 462.531 5.180 5 20 JKBD Cc1nc(Cc2ccc(F)cc2)sc1C(=O)N(Cc1ccccc1[N+](=O)[O-])CC(F)(F)F 486070044 NSUXDFYZULPUHL-UHFFFAOYSA-N 467.444 5.294 5 20 JKBD Cc1c(-c2ccccc2)sc(NC(=O)c2ccc([N+](=O)[O-])s2)c1C(=O)N1CCCCC1 492593123 VAHRDCIKFDASDP-UHFFFAOYSA-N 455.561 5.572 5 20 JKBD O=C(Nc1nc(-c2ccc(OCc3ccccc3)cc2)cs1)c1cc2c(cc1[N+](=O)[O-])OCCO2 505094673 QJRQNFUJQTUTCA-UHFFFAOYSA-N 489.509 5.321 5 20 JKBD Cc1cc(CN2CCSCC2)ccc1NC(=O)CSc1ccc(C(F)(F)F)cc1[N+](=O)[O-] 512295881 RUTKWZMVJGMGTN-UHFFFAOYSA-N 485.553 5.202 5 20 JKBD CC(C)CNC(=O)c1ccc(NC(=O)c2ccc(N3CCC[C@H](C)C3)c([N+](=O)[O-])c2)cc1Cl 515665482 NOWKUFVCTSNMCW-INIZCTEOSA-N 472.973 5.123 5 20 JKBD CC1CCN(c2ccc(C(=O)N3CCC(C(=O)c4ccc(Cl)cc4)CC3)cc2[N+](=O)[O-])CC1 515984166 FHQXYEAQCMGFKY-UHFFFAOYSA-N 469.969 5.220 5 20 JKBD CCc1nc(CN(C)C(=O)c2ccc(Sc3nc4ccccc4s3)c([N+](=O)[O-])c2)cs1 518651556 ANQYAVIGPFWVAL-UHFFFAOYSA-N 470.601 5.647 5 20 JKBD CC(C)(C)CN(CC(F)(F)F)C(=O)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 520504306 PUMHRWOSDQBJMM-UHFFFAOYSA-N 469.426 5.267 5 20 JKBD Cc1ncsc1CNC(=O)C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1 521513009 YEPKLCQZWXEPLQ-YBEGLDIGSA-N 450.545 5.217 5 20 JKBD CCOc1cc([N+](=O)[O-])c(C(=O)Nc2cc(C)nn2-c2cc(C(F)(F)F)ccc2Cl)cc1OC 592945211 GCOOMCDSFIWDFC-UHFFFAOYSA-N 498.845 5.421 5 20 JKBD COc1ccc(-n2c(SCc3ccc(OC)c([N+](=O)[O-])c3)nnc2-c2ccccc2OC)cc1 603722688 VMDARYYDFVQNKI-UHFFFAOYSA-N 478.530 5.161 5 20 JKBD Cc1ccc([N+](=O)[O-])cc1NC(=O)c1cccc(NC(=O)c2cccc(Br)c2)c1 603750394 NKTQZQUHNJGDJS-UHFFFAOYSA-N 454.280 5.170 5 20 JKBD C[C@@H]1CCN(C(=O)c2cnn(-c3ccc([N+](=O)[O-])cc3)c2)c2cc(C(F)(F)F)ccc2S1 603961591 HHQOSMUXNYRIBJ-CYBMUJFWSA-N 462.453 5.330 5 20 JKBD O=C(Nc1nnc(-c2ccsc2)s1)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 604118807 JUWYQRVHKRZJJR-UHFFFAOYSA-N 483.497 5.049 5 20 JKBD Cc1nc(C2(NCc3cn(-c4ccccc4)nc3-c3ccc([N+](=O)[O-])cc3)CCCCC2)no1 608837249 ONMKPZNZNWHRKX-UHFFFAOYSA-N 458.522 5.088 5 20 JKBD Cc1cc(C(=O)NC2CCN(C(=O)c3ccc(Oc4ccc(Cl)cc4[N+](=O)[O-])cc3)CC2)c(C)o1 608949045 HDEJSWGPFLATKT-UHFFFAOYSA-N 497.935 5.285 5 20 JKBD O=C(c1ccc(Sc2nc3ccccc3s2)c([N+](=O)[O-])c1)N1CCCO[C@@H](c2ccccc2)C1 609230945 STZLOSGOLURBCV-OAQYLSRUSA-N 491.594 5.960 5 20 JKBD CC(C)(C)n1nccc1NC(=O)C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1 609326973 KQEJPSAZXUXMNJ-SAPNQHFASA-N 461.547 5.725 5 20 JKBD COc1cc(C(=O)NC(C)(C)C(=O)Nc2ccccc2)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 609376887 VMPAGCMBBQVTAF-UHFFFAOYSA-N 483.908 5.196 5 20 JKBD Cc1nc(-c2cccc(NC(=O)N3CCN(c4ccc([N+](=O)[O-])cc4C(F)(F)F)CC3)c2)oc1C 727591577 WXFKCTISHXIHOZ-UHFFFAOYSA-N 489.454 5.240 5 20 JKBD CC(C)N(Cc1nnc(-c2cccc([N+](=O)[O-])c2)o1)C(=O)[C@H](C)Cc1ccc(Cl)cc1Cl 730451233 SUIXVAOCIVERRP-CQSZACIVSA-N 477.348 5.567 5 20 JKBD O=C(Nc1cc([N+](=O)[O-])ccc1F)[C@@H]1C[C@H]2CCCC[C@H]2N1C(=O)c1ccc2ccccc2c1 751065051 QXKFENXZOQZFEA-QFWMQHCXSA-N 461.493 5.299 5 20 JKBD CSCC[C@@H](NC(=O)c1ccc(Cl)c([N+](=O)[O-])c1)C(=O)O[C@@H](C)c1ccccc1Cl 847431688 VYEOZJICQJCEAM-YVEFUNNKSA-N 471.362 5.058 5 20 JKBD CSc1ccccc1NC(=O)[C@H](C)OC(=O)c1cc([N+](=O)[O-])ccc1Sc1nc(C)cs1 849132843 ZEZAGPYRDDGRRN-ZDUSSCGKSA-N 489.600 5.417 5 20 JKBD COc1cc(COC(=O)c2ccc(Cn3nc(C)c([N+](=O)[O-])c3C)cc2)cc(Cl)c1OC(F)F 892150961 KHZAWBWXAJJMIS-UHFFFAOYSA-N 495.866 5.077 5 20 JKBD COc1ccc(CSCc2nc(-c3cccc(NC(=O)OC(C)(C)C)c3)no2)cc1[N+](=O)[O-] 904632085 ODYBGGYBXFGXIO-UHFFFAOYSA-N 472.523 5.434 5 20 JKBD CC(C)N(Cc1nnc(-c2cccc([N+](=O)[O-])c2)o1)C(=O)c1sc2cccc(Cl)c2c1Cl 912988868 OIJISMREUCSJPZ-UHFFFAOYSA-N 491.356 6.217 5 20 JKBD CC(C)OC(=O)C[C@@H](NC(=O)Nc1cccc(C2SCCS2)c1)c1ccccc1[N+](=O)[O-] 915331843 PBNSESHLKZCQSE-GOSISDBHSA-N 475.592 5.278 5 20 JKBD COc1ccc(Oc2ccc([N+](=O)[O-])cc2C(=O)O[C@H](C)c2nnc(-c3ccccc3)o2)cc1 915443163 ZDCSORXBFAJYDW-OAHLLOKOSA-N 461.430 5.364 5 20 JKBD CC(C)Oc1nnc(S[C@H](C(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)c2ccccc2)s1 918750794 UPHJBCSJSQFKOS-INIZCTEOSA-N 464.956 5.359 5 20 JKBD CCOC(=O)N(C)c1ccc(NC(=O)c2ccccc2NC(=O)c2ccc([N+](=O)[O-])cc2Cl)cc1 919862684 PBVGTXFVUZBHBW-UHFFFAOYSA-N 496.907 5.346 5 20 JKBD O=C(O[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1)c1ccc(CN2CCCC2)cc1 927535737 BTPXCHJXEHKRTP-DEOSSOPVSA-N 493.947 5.381 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)c3ccc(OCC4CC4)cc3F)CCC2)cc1)c1ccc([N+](=O)[O-])o1 1785751264 VZZVJOQETICMKA-UHFFFAOYSA-N 493.491 5.177 5 20 JKBD CC(C)(C)CCCCCC(=O)NC1(c2ccc(NC(=O)c3nc[nH]c3[N+](=O)[O-])cc2)CCC1 1788613514 QOCZNIRQCMKCPO-UHFFFAOYSA-N 455.559 5.062 5 20 JKBD CN(C)c1ccc([N+](=O)[O-])cc1C(=O)Nc1ccc(C2(NC(=O)C[C@@H]3C[C@@H]4CC[C@H]3C4)CCC2)cc1 1790793293 SZNJMXINDYZEON-AABGKKOBSA-N 490.604 5.235 5 20 JKBD Cc1c(Br)cc(C(=O)Nc2ccc(C3(NC(=O)C(C)(F)F)CCC3)cc2)cc1[N+](=O)[O-] 1790816613 OZIMHSKPJXALFU-UHFFFAOYSA-N 496.308 5.069 5 20 JKBD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2cccc(F)c2[N+](=O)[O-])[nH]n1)[C@@H]1CCC[C@@H]2CCCC[C@H]21 1818931176 JSMCLWKYQSXSSV-FBAVSBLXSA-N 497.571 5.369 5 20 JKBD O=C(Cc1ccc2ccccc2c1)N1CCC([C@H]2CCCCN2C(=O)Cc2cccc([N+](=O)[O-])c2)CC1 1823678753 WGIRMGQQMBVNCP-MUUNZHRXSA-N 499.611 5.153 5 20 JKBD Cc1cc2[nH]c(C(=O)N3CCCC[C@H]3C3CCN(C(=O)c4cc(F)cc([N+](=O)[O-])c4)CC3)cc2s1 1830889510 BYLQDTNRSHJHBU-QFIPXVFZSA-N 498.580 5.132 5 20 JKBD Cc1cccc(Nc2nnc(SCC(=O)Nc3ccc([N+](=O)[O-])cc3C(F)(F)F)s2)c1C 10211284 CTWWIASHMMBPFM-UHFFFAOYSA-N 483.497 5.556 5 20 JKBD NC(=O)c1ccc(CSc2nnc(-c3ccccc3Cl)n2C2CCCC2)c([N+](=O)[O-])c1 16555523 BOAGAELPEFBGTB-UHFFFAOYSA-N 457.943 5.013 5 20 JKBD CSCC[C@H](NC(=O)c1cccc([N+](=O)[O-])c1)C(=O)N1CCC(c2cccc3ccccc23)CC1 476157697 MBJWMYKWNKZIQE-VWLOTQADSA-N 491.613 5.006 5 20 JKBD COc1cc([C@H]2Nc3ccccc3C(=O)N2Cc2cccnc2)ccc1OCc1ccc([N+](=O)[O-])cc1 489291664 ROFVNCVALQWWCA-MHZLTWQESA-N 496.523 5.344 5 20 JKBD CCC[C@H](C)NC(=O)[C@H]1CCCN(C(=O)c2ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])cc2)C1 497472544 CBPAJMMDTCEAJH-WMZOPIPTSA-N 473.957 5.198 5 20 JKBD COc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)N(Cc1ccc(-c2ccccc2C)s1)C(C)C 499157936 BBFHUSYQRUQMGD-UHFFFAOYSA-N 467.547 5.016 5 20 JKBD CSc1ccc([N+](=O)[O-])c(C(=O)Nc2ccc(CNC(=O)c3ccc(C(F)(F)F)cc3)cc2)c1 502541780 LFZGAAUOYLQHOD-UHFFFAOYSA-N 489.475 5.518 5 20 JKBD O=C(Nc1cccc(Br)c1)C1CCN(C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)CC1 505281244 ZFFNBWJKIMEQDI-UHFFFAOYSA-N 488.363 5.063 5 20 JKBD Cc1c(NC(=O)[C@H](C)Nc2cccc(NC(=O)c3cccc(C(F)(F)F)c3)c2)cccc1[N+](=O)[O-] 507506460 FFEGRYLCVCIXFM-HNNXBMFYSA-N 486.450 5.613 5 20 JKBD COc1cc(CN[C@@H](c2ccccc2)c2nccs2)ccc1OCc1ccc([N+](=O)[O-])cc1 507916297 ZUNYEVARNSQDCU-DEOSSOPVSA-N 461.543 5.518 5 20 JKBD Cc1ccccc1OCCCC(=O)Nc1ccc(CNc2cc3c(cc2[N+](=O)[O-])CCC(=O)N3)cc1 510098157 GLLSIGXRIDIUSQ-UHFFFAOYSA-N 488.544 5.198 5 20 JKBD Cc1csc(Sc2ccc(C(=O)Nc3ccc(C(=O)NC4CCCC4)cc3C)cc2[N+](=O)[O-])n1 518904075 LEDYRDQMWGHKSX-UHFFFAOYSA-N 496.614 5.744 5 20 JKBD COc1cc(CNCc2cc(F)cc(Br)c2)ccc1OCc1ccc([N+](=O)[O-])cc1 520205205 CCJCJMSEAGBOSC-UHFFFAOYSA-N 475.314 5.374 5 20 JKBD Cc1cc(OCc2cccc(Cl)c2)ccc1NC(=O)CCCn1c(=O)oc2cc([N+](=O)[O-])ccc21 524391941 LLGYESAAFMKDKN-UHFFFAOYSA-N 495.919 5.462 5 20 JKBD COc1cccc(Cn2c(NC(=O)Cn3c4ccccc4c(=O)c4ccccc43)nc3ccccc32)c1 590245455 XHRBCUAPHWZHJI-UHFFFAOYSA-N 488.547 5.200 5 20 JKBD Cc1ccc(NC(=O)Nc2ccccc2)cc1NC(=O)c1ccc(Cn2nc(C)c([N+](=O)[O-])c2C)cc1 603660026 SEZODADFEFUIDS-UHFFFAOYSA-N 498.543 5.661 5 20 JKBD CN(c1ccccc1)c1ccc(CNCc2cccc(NC(=O)c3ccncc3)c2)cc1[N+](=O)[O-] 603955161 TXMNKDQTRFZREH-UHFFFAOYSA-N 467.529 5.300 5 20 JKBD O=C(Nc1ccc(S(=O)(=O)Nc2ccc(Cl)cc2)cc1)c1cc2cc([N+](=O)[O-])ccc2o1 604033476 JVLBMYRWFISRFB-UHFFFAOYSA-N 471.878 5.048 5 20 JKBD CC[C@H](C)NC(=O)c1ccc(NC(=O)c2ccc(Sc3nc(C)cs3)c([N+](=O)[O-])c2)c(C)c1 604457543 RELWPDRWOZHAEC-AWEZNQCLSA-N 484.603 5.600 5 20 JKBD CCN(CCC(F)(F)F)C(=O)C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1 604524158 XQDNACXGOMTDMA-DTQAZKPQSA-N 463.481 5.936 5 20 JKBD CCC[C@H](NC(=O)c1cc(OC)c(OC(F)F)cc1[N+](=O)[O-])c1cccc(C(F)(F)F)c1 608851429 UAESHUXLZONAAW-AWEZNQCLSA-N 462.371 5.495 5 20 JKBD C[C@@H](N[C@H](C)c1ccc(F)c(Br)c1)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 609387850 KNJBVLCUAIVHQW-NXEZZACHSA-N 478.240 5.193 5 20 JKBD COC(=O)Nc1cc(NC(=O)c2ccc(Sc3nc(C)cs3)c([N+](=O)[O-])c2)ccc1F 727335314 NISABWIVBLZDAC-UHFFFAOYSA-N 462.484 5.081 5 20 JKBD CC(C)N(Cc1nnc(-c2cccc([N+](=O)[O-])c2)o1)C(=O)c1csc(-c2cccc(Cl)c2)n1 744001500 QBHRMLXDUCMMSV-UHFFFAOYSA-N 483.937 5.473 5 20 JKBD Cc1cc([N+](=O)[O-])ccc1NC(=O)COC(=O)c1csc(-c2ccc(Cl)c(Cl)c2)n1 744604798 KTRBPOYIXUKPHC-UHFFFAOYSA-N 466.302 5.129 5 20 JKBD Cc1oc2c(C)c(OC(=O)CCn3cc([N+](=O)[O-])nc3C)ccc2c(=O)c1Oc1ccccc1Cl 747124469 SRWPZRYCGZWJNQ-UHFFFAOYSA-N 497.891 5.264 5 20 JKBD C[C@H](OC(=O)c1csc(-c2ccc([N+](=O)[O-])cc2)n1)C(=O)Nc1ccc(Cl)cc1C(F)(F)F 747957943 GYZGBTSXSXAXJY-JTQLQIEISA-N 499.854 5.575 5 20 JKBD O=C(OCc1csc(COc2ccc(Cl)cc2)n1)c1csc(-c2cccc([N+](=O)[O-])c2)n1 747963723 ZGSJMOJDJQKYPV-UHFFFAOYSA-N 487.946 5.764 5 20 JKBD O=C(Nc1cc([N+](=O)[O-])c(F)cc1F)c1nn(-c2cc(C(F)(F)F)ccc2Cl)c2c1CCC2 748167412 XZVKNYZOYIEBHY-UHFFFAOYSA-N 486.784 5.472 5 20 JKBD Cc1csc(SCc2ccc(C(=O)OCC3CCN(c4ncccc4[N+](=O)[O-])CC3)cc2)n1 749357190 DAXKITKTNRSCCJ-UHFFFAOYSA-N 484.603 5.120 5 20 JKBD CC(=O)Nc1cccc([C@H](C)N(Cc2ccccc2)C(=O)c2ccc(-n3ccnc3)c([N+](=O)[O-])c2)c1 841837597 DMLUXNVGGXXAPD-IBGZPJMESA-N 483.528 5.143 5 20 JKBD O=C(C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)OCc1ccc(Cl)nc1 901414416 ARVJPFSFGXDRRL-GZTJUZNOSA-N 465.918 5.927 5 20 JKBD CN(Cc1ccccc1[N+](=O)[O-])C(=O)NC[C@H](c1ccc(N(C)C)cc1)c1c[nH]c2ccccc12 915891749 OTAICPGUFXRANF-HSZRJFAPSA-N 471.561 5.116 5 20 JKBD COc1ccc(NC(=O)/C=C\c2ccc([N+](=O)[O-])cc2)cc1NC(=O)c1ccc(Cl)cc1F 917787550 NBGSZBZCXYBHNR-WCIBSUBMSA-N 469.856 5.300 5 20 JKBD COc1cc(C(=O)OCc2csc(-c3ccsc3)n2)c([N+](=O)[O-])cc1OCc1cscn1 920652743 MXQIPWMGPZLFNC-UHFFFAOYSA-N 489.556 5.181 5 20 JKBD Cc1nc(C)c(C(=O)Nc2ccc(C3(NC(=O)CCc4cccc([N+](=O)[O-])c4)CCC3)cc2)s1 1787333585 OQLKGRDSOYJZMP-UHFFFAOYSA-N 478.574 5.049 5 20 JKBD Cc1c(C(=O)Nc2ccc(C3(NC(=O)c4coc(Cl)n4)CCC3)cc2)cc(Cl)cc1[N+](=O)[O-] 1790774393 NCEQQOWUJBQYLK-UHFFFAOYSA-N 489.315 5.260 5 20 JKBD Cc1c(C(=O)Nc2ccc(C3(NC(=O)[C@H](C)n4ccnc4C)CCC3)cc2)cc(Cl)cc1[N+](=O)[O-] 1790774934 XHRHJHZFXLPCMV-INIZCTEOSA-N 495.967 5.070 5 20 JKBD O=C(Cc1ccc([N+](=O)[O-])cc1F)Nc1ccc(C2(NC(=O)c3ccnc(C(F)F)c3)CCC2)cc1 1791184394 QYBUPXHQRXRRCW-UHFFFAOYSA-N 498.461 5.057 5 20 JKBD Cc1c(Cl)cccc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cc3cc([N+](=O)[O-])ccc3s1)C2 1792745452 NMRQBVKSEHWUTE-BJWYYQGGSA-N 483.977 5.337 5 20 JKBD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc(F)c1[N+](=O)[O-])c1ccc(-c2ccc(Cl)cc2)o1 1800528839 WUEMRQBMKLXJJN-BCDXTJNWSA-N 497.910 5.213 5 20 JKBD CCCCCc1cccc(CC(=O)N2CCCC[C@@H]2c2cc(NC(=O)c3ccc([N+](=O)[O-])o3)n[nH]2)c1 1814311847 SBHCFPOZWDXPFK-OAQYLSRUSA-N 493.564 5.192 5 20 JKBD COc1cc(C(=O)Nc2cc([C@H]3CCCCN3C(=O)CC3CCC(C)(C)CC3)[nH]n2)ccc1[N+](=O)[O-] 1823285321 WMGSCKUXCJULET-HXUWFJFHSA-N 497.596 5.239 5 20 JKBD COc1ccc(C)cc1NC(=O)[C@@H](OC(=O)c1ccc([N+](=O)[O-])cc1Cl)c1ccccc1 11028651 IHQZFKUTTOVCLG-NRFANRHFSA-N 454.866 5.102 5 20 JKBD COc1ccc([N+](=O)[O-])cc1NC(=O)[C@H](C)OC(=O)c1sc2cc(Cl)ccc2c1Cl 11397068 SWJVRZJDWCXSOJ-VIFPVBQESA-N 469.302 5.309 5 20 JKBD C[C@H](OC(=O)c1cc(-c2ccco2)nc2ccccc12)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl 11398358 MJGICOXTPFQIKJ-ZDUSSCGKSA-N 465.849 5.240 5 20 JKBD O=C(c1cccc([N+](=O)[O-])c1)N(C[C@@H]1CCCO1)c1nc(-c2ccc(Cl)cc2Cl)cs1 14819617 ILTCARZHZGWBHG-INIZCTEOSA-N 478.357 5.851 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Br)[C@@H](NCCc1cccc(F)c1)c1ccccc1 15508981 PWJFIQISRGVLNR-NRFANRHFSA-N 472.314 5.009 5 20 JKBD CC(C)(C)c1ccc(-c2nnc(SCc3ccc(C(N)=O)cc3[N+](=O)[O-])n2Cc2ccco2)cc1 16815267 YEJKFCZJLGWHJO-UHFFFAOYSA-N 491.573 5.183 5 20 JKBD C[C@@H](Sc1nnc(-c2ccco2)n1-c1ccccc1)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 17664929 KIAFDICXRBYLHF-CQSZACIVSA-N 460.475 5.339 5 20 JKBD C[C@H](OC(=O)c1csc(-c2cccs2)n1)C(=O)Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1 19260152 MQKNZZGBTCXHGW-NSHDSACASA-N 486.556 5.087 5 20 JKBD O=C(CSc1nnc(-c2ccccc2)c2ccccc12)Nc1ccc(Cl)cc1[N+](=O)[O-] 21749482 OUDRDTVOHFHBAO-UHFFFAOYSA-N 450.907 5.589 5 20 JKBD CCc1ccccc1NC(=O)[C@@H](C)OC(=O)c1ccc(Sc2nc(C)cs2)c([N+](=O)[O-])c1 23968918 GRKKSBJKHQUDIP-CQSZACIVSA-N 471.560 5.257 5 20 JKBD Cc1ccc(-c2nnc(-c3ccc(C(=O)O[C@H](C)c4nnc(-c5ccc([N+](=O)[O-])cc5)o4)cc3)o2)cc1 24505599 ZHHWKFWSWOZWOQ-MRXNPFEDSA-N 497.467 5.588 5 20 JKBD CN(CCCCCc1cc(-c2ccc(F)cc2)n[nH]1)C(=O)Cn1c2ccccc2c(=O)c2ccccc21 68728960 GGUSEHIYGQOZKS-UHFFFAOYSA-N 496.586 5.555 5 20 JKBD C[C@H](c1cccc(C(F)(F)F)c1)N(C)C(=O)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-] 481194674 AFFNKFHOFNKHMK-LLVKDONJSA-N 450.335 5.388 5 20 JKBD O=C1CCc2cc(NC(=O)c3cc([N+](=O)[O-])ccc3Sc3ccc(Cl)cc3)ccc2N1 482497986 BISYSQIPUNFFTR-UHFFFAOYSA-N 453.907 5.536 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)N[C@H](COc2ccccc2F)c2ccccc2)cc1SC 482751740 KQAGNZHDNXPBBS-GOSISDBHSA-N 456.495 5.015 5 20 JKBD O=C(C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)Nc1cccc(Cn2cncn2)c1 487510287 OYUCEFOTAZEOJB-UDWIEESQSA-N 496.552 5.414 5 20 JKBD COc1cc(C(=O)N[C@@H](c2ccc(F)cc2)c2ccccc2Cl)c([N+](=O)[O-])cc1OC(F)F 502350952 DFELMVLRSBICOC-FQEVSTJZSA-N 480.826 5.517 5 20 JKBD Cc1cc(C)n(-c2ccccc2NC(=O)c2ccc(N[C@@H](C)c3ccccn3)c([N+](=O)[O-])c2)n1 506203957 NWFAXLKDLRPHAU-SFHVURJKSA-N 456.506 5.218 5 20 JKBD C[C@H]1CN(Cc2ccccc2NC(=O)c2ccc(N[C@@H](C)c3ccccn3)c([N+](=O)[O-])c2)C[C@@H](C)O1 508946658 AZSHQBBZQVUSDD-ZCNNSNEGSA-N 489.576 5.024 5 20 JKBD COc1cc(C(=O)Nc2ccccc2OC2CCCC2)c([N+](=O)[O-])cc1OCc1cscn1 512199919 VXNAXXJSBRKHDM-UHFFFAOYSA-N 469.519 5.213 5 20 JKBD COc1cc([C@H](C)N[C@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2ccccc2)cc(OC)c1OC 515516947 LHHPXQMOSDISJT-WNSKOXEYSA-N 499.951 5.305 5 20 JKBD COc1ccc([C@@H](CNC(=O)N[C@@H](C)c2cccc([N+](=O)[O-])c2)c2c[nH]c3ccccc23)cc1 515840016 DNAYMKWFKDPTHC-GAJHUEQPSA-N 458.518 5.277 5 20 JKBD CC(C)OCc1cccc(NC(=O)C2CCN(c3ccc(C(F)(F)F)cc3[N+](=O)[O-])CC2)c1 518780245 MMLZEGGAERYNML-UHFFFAOYSA-N 465.472 5.394 5 20 JKBD Cc1nc(-c2cccc(NC(=O)c3ccc(NCc4ccccc4Cl)c([N+](=O)[O-])c3)c2)no1 520366004 LPRIBLCHIKZFIH-UHFFFAOYSA-N 463.881 5.471 5 20 JKBD CCc1c(-c2cccc([N+](=O)[O-])c2)nc2sc3c(c2c1-c1ccc(C)cc1)CCN(C(C)=O)C3 541587072 PJAZBXGFMJGLML-UHFFFAOYSA-N 471.582 6.314 5 20 JKBD O=C1c2ccccc2N[C@@H](c2csc(-c3cccc([N+](=O)[O-])c3)n2)N1c1ccc2c(c1)OCO2 602762695 YYQHUENCTPIKLE-JOCHJYFZSA-N 472.482 5.218 5 20 JKBD Cc1ccccc1CN(C(=O)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1)C1CC1 603508668 MVCWNCJKJXKLLH-UHFFFAOYSA-N 461.484 5.330 5 20 JKBD Cc1c([C@@H](C)NC(=O)CSc2ccc(C(F)(F)F)cc2[N+](=O)[O-])cnn1-c1ccc(F)cc1 603548965 VXSZAWJTUMSBKF-GFCCVEGCSA-N 482.459 5.216 5 20 JKBD COc1cc([C@H](C)NC(=O)CSc2ccc([N+](=O)[O-])cc2)ccc1OCc1ccccc1 603986587 AAVBHGSGHXCCSR-KRWDZBQOSA-N 452.532 5.152 5 20 JKBD CC(C)(C)OC(=O)Nc1ccc(C(F)(F)F)cc1NC(=O)c1cc(Cl)ccc1[N+](=O)[O-] 727790637 NOHPWVXOILVLQS-UHFFFAOYSA-N 459.808 5.866 5 20 JKBD C[C@H](NC(=O)[C@@H](C)OC(=O)c1csc(-c2cccc([N+](=O)[O-])c2)n1)c1ccc2ccccc2c1 747963742 ZPOGVCKZOVWFGR-JKSUJKDBSA-N 475.526 5.294 5 20 JKBD Cc1ccc(NC(=O)CSc2ccccc2C(=O)N(C)Cc2cc([N+](=O)[O-])ccc2Cl)cc1 772462104 USWPOVBFZVZDIP-UHFFFAOYSA-N 483.977 5.560 5 20 JKBD O=[N+]([O-])c1cc(-c2nc(Cn3cnc4ccccc43)no2)ccc1NCc1ccccc1Cl 904738784 ZUUFYPSTTUTGDU-UHFFFAOYSA-N 460.881 5.308 5 20 JKBD CCOC(=O)N(C)c1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2Sc2ccccc2)cc1 919863035 XOSSFXCJEJBGCE-UHFFFAOYSA-N 451.504 5.591 5 20 JKBD C[C@@H](Nc1ccc(C(=O)OCC(=O)Nc2cccc(Cl)c2Cl)cc1[N+](=O)[O-])c1ccccn1 920543635 GQSASSDCUQBXRQ-CYBMUJFWSA-N 489.315 5.265 5 20 JKBD C[C@H](OC(=O)[C@H](C)Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)Nc1ccccc1-c1ccccc1 920777328 CHORTCDJJKOIRE-HOTGVXAUSA-N 468.893 5.253 5 20 JKBD Cc1cc(C(=O)Nc2ccc(C3(NC(=O)c4cc5c(C)cccc5[nH]4)CCC3)cc2)ncc1[N+](=O)[O-] 1788766821 IVRYJKWZHICVAW-UHFFFAOYSA-N 483.528 5.149 5 20 JKBD Cc1ccc2cc(C(=O)Nc3ccc(C4(NC(=O)c5ccc([N+](=O)[O-])o5)CCC4)cc3)ccc2n1 1789030591 POEQLHUJSVRSMX-UHFFFAOYSA-N 470.485 5.106 5 20 JKBD Cc1ccc(C(=O)Nc2ccc(C3(NC(=O)c4cc(Cl)cc([N+](=O)[O-])c4C)CCC3)cc2)c(O)n1 1790119811 ZLWIFIYVHIRBCA-UHFFFAOYSA-N 494.935 5.027 5 20 JKBD O=C(CCOc1ccc(F)cc1)NC1(c2ccc(NC(=O)c3cc(F)cc([N+](=O)[O-])c3)cc2)CCC1 1790695944 WTYFMGADGNPJEE-UHFFFAOYSA-N 495.482 5.090 5 20 JKBD COc1cc(C(=O)Nc2ccc(C3(NC(=O)[C@@]4(C)CC=CCC4)CCC3)cc2)cc([N+](=O)[O-])c1OC 1790812694 IJILDDXZKCWEOI-SANMLTNESA-N 493.560 5.106 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cccc3ccoc23)n[nH]1 1821537577 VXCIAFSSVUHCHV-FQEVSTJZSA-N 491.479 5.131 5 20 JKBD O=C(c1cc2cccc(F)c2s1)N1CCC([C@@H]2CCCCN2C(=O)c2ccc([N+](=O)[O-])o2)CC1 1823614212 HVZPGPIAUQMQBJ-SFHVURJKSA-N 485.537 5.089 5 20 JKBD O=C(c1cccs1)N1CCC([C@H]2CCCCN2C(=O)C2(c3cccc([N+](=O)[O-])c3)CCC2)CC1 1830291864 UTQQWUOOQLBTOU-JOCHJYFZSA-N 481.618 5.012 5 20 JKBD Cc1occc1-c1nnc(SCC(=O)Nc2cc([N+](=O)[O-])ccc2Cl)n1Cc1ccccc1 21460369 HACCBRFUXZVNSA-UHFFFAOYSA-N 483.937 5.187 5 20 JKBD CCOc1ccccc1-c1nnc(S[C@@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2C(F)(F)F)o1 21545781 XZONTNGQKZLOLR-NSHDSACASA-N 482.440 5.182 5 20 JKBD Cc1occc1-c1nnc(S[C@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)n1Cc1ccccc1 21684831 ROTZXAQFYZEIKU-OAHLLOKOSA-N 497.964 5.576 5 20 JKBD Cc1ccc(/C=C/c2nc(S[C@@H](C)C(=O)Nc3nc(-c4cccc([N+](=O)[O-])c4)cs3)n[nH]2)o1 23223181 JHRDLIRTEUVMAE-XEHSLEBBSA-N 482.547 5.028 5 20 JKBD O=C(O[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1)c1cc(Cl)ccc1[N+](=O)[O-] 23515102 SZPCAOGJGQSPQI-LJQANCHMSA-N 490.255 5.347 5 20 JKBD COc1ccc(NC(=O)c2ccc(NC3CC3)c([N+](=O)[O-])c2)cc1NC(=O)c1ccc(Cl)cc1F 68734425 RITQFSZYHWJWHR-UHFFFAOYSA-N 498.898 5.475 5 20 JKBD CC(=O)Oc1ccc(-c2ccc(C(=O)O[C@H](C)C(=O)Nc3ccc([N+](=O)[O-])cc3Cl)cc2)cc1 104539301 UMCISRQTJAQBPZ-CQSZACIVSA-N 482.876 5.025 5 20 JKBD CCOc1cc(C(=O)N[C@@H](C)c2ccc(OCc3ccc(F)cc3)cc2)c([N+](=O)[O-])cc1OC 485475290 XPXYOZACJQELFQ-INIZCTEOSA-N 468.481 5.211 5 20 JKBD Cc1cc(=O)c(C(=O)Nc2ccc(F)cc2-c2ccc(Cl)cc2)nn1-c1ccccc1[N+](=O)[O-] 485754160 PNZSONCTKAYEQK-UHFFFAOYSA-N 478.867 5.161 5 20 JKBD CCOc1cc(NC(=O)c2cnn(-c3cccc(Cl)c3)c2CC)c([N+](=O)[O-])cc1OCC 498784756 DAOIQVLWNYXOBX-UHFFFAOYSA-N 458.902 5.046 5 20 JKBD CN(C(=O)CSc1ccc([N+](=O)[O-])cc1)[C@H]1CCSc2ccc(Br)cc21 504559310 QKVVXCTYRHROOS-INIZCTEOSA-N 453.383 5.145 5 20 JKBD Cc1ccc(S(=O)(=O)Nc2ccc(NC(=O)c3ccccc3SC(C)C)cc2)cc1[N+](=O)[O-] 506111813 HTFAKXSWMBFPCF-UHFFFAOYSA-N 485.587 5.457 5 20 JKBD CCOc1cc([N+](=O)[O-])c(C(=O)N[C@@H](c2ccc(C(C)C)cc2)c2cccs2)cc1OC 512480728 PYEGNHFBILAROY-QHCPKHFHSA-N 454.548 5.706 5 20 JKBD C[C@H]1CCCN(Cc2ccc(NC(=O)c3ccc(N[C@H](C)c4ccccn4)c([N+](=O)[O-])c3)cc2)C1 516172874 DSKJIGYXKSWQHQ-VQTJNVASSA-N 473.577 5.647 5 20 JKBD COc1ccc(-c2nc(C)c(C(=O)N(Cc3ccccc3[N+](=O)[O-])CC(F)(F)F)s2)cc1 516526862 IDEGOLHOOFOUSV-UHFFFAOYSA-N 465.453 5.240 5 20 JKBD COc1cc(Br)c(NC(=O)c2ccc(N3C[C@@H](C)C[C@@H](C)C3)c([N+](=O)[O-])c2)cc1OC 520425668 UVSYEQGJOCZHPZ-OKILXGFUSA-N 492.370 5.109 5 20 JKBD O=C(C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)N1CCN(Cc2ccco2)CC1 592585731 AKVSVAMFTJGWGQ-SILNSSARSA-N 488.569 5.073 5 20 JKBD Cc1ccccc1-c1nnc(S[C@@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2C)n1Cc1ccco1 598612501 VXVSBGUSAOLEJY-KRWDZBQOSA-N 477.546 5.231 5 20 JKBD O=C(Nc1ccccc1C(F)(F)F)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 602354276 CGJSDHGCDYUZCM-UHFFFAOYSA-N 461.362 5.488 5 20 JKBD CNC(=O)c1cccc(NC(=O)c2ccc(Sc3nc4ccccc4s3)c([N+](=O)[O-])c2)c1C 603624386 FOROJNGKRYULGZ-UHFFFAOYSA-N 478.555 5.276 5 20 JKBD CSc1ccc([C@@H](CNC(=O)c2cccc(C)c2[N+](=O)[O-])N2CCc3sccc3C2)cc1 603759836 UMOWGUJUVBRMQE-OAQYLSRUSA-N 467.616 5.216 5 20 JKBD COc1cccc(/C=C(/CC(=O)N[C@@H](C)c2cccc([N+](=O)[O-])c2)c2nc3ccccc3s2)c1 603966489 AMJSHDNUJMWXIM-IZQLPPHKSA-N 473.554 6.021 5 20 JKBD CCOC1CCN(C(=O)C/C(=C/c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)CC1 604255749 KQKBMNIFRHSHFY-SDXDJHTJSA-N 451.548 5.163 5 20 JKBD Cc1ccccc1-c1ccc(CN(C(=O)CNC(=O)c2c(Cl)cccc2[N+](=O)[O-])C(C)C)s1 609392207 QYWLOADUPVJAPA-UHFFFAOYSA-N 485.993 5.452 5 20 JKBD CCC(CC)c1cc[n+](/C(C(=S)NCC(F)(F)F)=C(/O)c2cccc([N+](=O)[O-])c2)cc1 725760053 JJDOPBHPBLMFIZ-UHFFFAOYSA-O 454.494 5.149 5 20 JKBD C[C@H](NC(=S)/C(=C(/O)c1cccc([N+](=O)[O-])c1)[n+]1ccc(C(C)(C)C)cc1)c1cccs1 726578911 GRWZMLXPMGRAQR-INIZCTEOSA-O 468.624 5.803 5 20 JKBD COc1ccc(C(C)(C)CNC(=O)c2ccccc2NC(=O)c2ccc([N+](=O)[O-])cc2Cl)cc1 746014868 LOULBBSZSRPVBA-UHFFFAOYSA-N 481.936 5.217 5 20 JKBD Cc1cc(-c2cc(C(=O)O[C@H](C)C(=O)Nc3ccc(F)c([N+](=O)[O-])c3)c3c(C)noc3n2)c(C)s1 813303792 YNNSWCGDEUCKQV-GFCCVEGCSA-N 498.492 5.108 5 20 JKBD CC(C)Cn1cc([C@H]2N(Cc3ccc(Oc4ccc(F)cc4)c([N+](=O)[O-])c3)CC23CCOCC3)cn1 849478019 FMCMURGLANRQOJ-AREMUKBSSA-N 494.567 5.732 5 20 JKBD COc1cc(-c2nc(-c3cccc(NC(=O)OC(C)(C)C)c3)no2)c([N+](=O)[O-])cc1OC(F)F 904635434 XEXMHUMGXBDIHS-UHFFFAOYSA-N 478.408 5.269 5 20 JKBD O=C(Oc1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2Cl)cc1)c1cc(-c2cccc(F)c2)no1 915132174 BXJBMAWFDPGGOA-UHFFFAOYSA-N 481.823 5.514 5 20 JKBD CCNC(=O)c1ccccc1NC(=O)C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1 915175594 QCMDICWXXYTYTC-OBGWFSINSA-N 486.553 5.524 5 20 JKBD Cc1csc(Sc2ccc([N+](=O)[O-])cc2C(=O)OCc2nnc(-c3cc(C)oc3C)o2)n1 916508029 BHXJXLLEYNHGKE-UHFFFAOYSA-N 472.504 5.128 5 20 JKBD C[C@H](NC(=O)c1cc([N+](=O)[O-])ccc1N1CCCCC1)c1cccc(NC(=O)c2ccccc2)c1 918613463 RGBZQHLDRYIYHU-IBGZPJMESA-N 472.545 5.328 5 20 JKBD CC(C)(C)c1ccc(N2CCC(NC(=O)c3cc(OCC(F)(F)F)ccc3[N+](=O)[O-])CC2)cc1 919706706 YOKNQSLTQIAQPB-UHFFFAOYSA-N 479.499 5.232 5 20 JKBD O=C(OCc1nnc(-c2ccc(Cl)cc2Cl)o1)c1cc2cc([N+](=O)[O-])ccc2s1 920512408 JHASDBBLXLRGBA-UHFFFAOYSA-N 450.259 5.523 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)[C@@]3(F)CCCC=C3F)CCC2)cc1)c1cc(F)cc([N+](=O)[O-])c1 1790700266 WJSURRDYTUZQAU-XMMPIXPASA-N 473.451 5.227 5 20 JKBD C[C@@H](Cc1ccco1)C(=O)Nc1ccc(C2(NC(=O)CCc3cccc([N+](=O)[O-])c3)CCC2)cc1 1791909989 VNCOLLCURZVPML-IBGZPJMESA-N 475.545 5.133 5 20 JKBD O=C(CCc1ccoc1)Nc1ccc(C2(NC(=O)CSc3ccccc3[N+](=O)[O-])CCC2)cc1 1791956198 WNYQJPXVSAVSLL-UHFFFAOYSA-N 479.558 5.047 5 20 JKBD COc1ccc(Cl)c(C(=O)Nc2ccc(C3(NC(=O)c4ccc(O)c([N+](=O)[O-])c4)CCC3)cc2)c1 1792083416 AUFJADDELHCVKX-UHFFFAOYSA-N 495.919 5.024 5 20 JKBD Cc1occ(C(F)(F)F)c1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cc(Cl)cc([N+](=O)[O-])c1C)C2 1797102176 JHKDGUOYFAAVMJ-QDMKHBRRSA-N 499.873 5.042 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cc(Cl)c(F)c(Cl)c1)C2 1800699639 AAEMBWYQMNHCEX-BTTYYORXSA-N 498.313 5.054 5 20 JKBD O=C(Nc1cc([C@@H]2CCCCN2C(=O)/C=C/c2ccoc2)[nH]n1)c1cc2cc([N+](=O)[O-])ccc2s1 1821612046 PWSROUUPUQFYEE-QTWIXLPOSA-N 491.529 5.145 5 20 JKBD Cc1ccc(C(=O)N2CCC([C@H]3CCCCN3C(=O)Cc3ccc(Cl)cc3[N+](=O)[O-])CC2)cc1 1824162310 TUCIAQCXGDUBPJ-HSZRJFAPSA-N 483.996 5.033 5 20 JKBD Cc1cc(CCCC(=O)N2CCC([C@H]3CCCCN3C(=O)c3ccoc3C)CC2)c([N+](=O)[O-])cc1F 1825905180 GHHAXENLPDAKGT-XMMPIXPASA-N 499.583 5.200 5 20 JKBD Cc1ccc(CC(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3cccc4ccoc34)CC2)cc1[N+](=O)[O-] 1830364584 UHXRCPWYYGKHST-XMMPIXPASA-N 489.572 5.125 5 20 JKBD CCn1c(S[C@@H](C)C(=O)Nc2nc(-c3cccc([N+](=O)[O-])c3)cs2)nnc1-c1ccccc1 9484728 DMBFQJQZCYHISL-AWEZNQCLSA-N 480.575 5.116 5 20 JKBD Cc1cccc([N+](=O)[O-])c1NC(=O)COC(=O)c1ccccc1CSc1nc2ccccc2o1 9555928 APZBRIZWLPLLCF-UHFFFAOYSA-N 477.498 5.132 5 20 JKBD CCN(CC(=O)Nc1ccccc1OC)C(=O)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1 11402564 DRHRFANCNKBUET-UHFFFAOYSA-N 483.908 5.150 5 20 JKBD NC(=O)c1ccc(NC(=O)c2c3c(nc4ccccc24)/C(=C/c2ccc([N+](=O)[O-])cc2)CCC3)cc1 14215407 QFRKWWXFTWFRPX-KNTRCKAVSA-N 478.508 5.371 5 20 JKBD O=C(CSc1nnc(-c2ccccc2)c2ccccc12)Nc1ccc([N+](=O)[O-])cc1Cl 21670146 RMXGZXMJVBASST-UHFFFAOYSA-N 450.907 5.589 5 20 JKBD O=C(CSc1nc(C(F)(F)F)nc2ccccc12)Nc1ccc([N+](=O)[O-])cc1Br 22237906 JOTCJPPJYXOLCR-UHFFFAOYSA-N 487.257 5.050 5 20 JKBD C[C@@H](OC(=O)c1cc([N+](=O)[O-])ccc1Cl)C(=O)N1c2ccccc2Sc2ccccc21 22495196 YRHHFTXGCRFFFV-CYBMUJFWSA-N 454.891 5.623 5 20 JKBD Cc1cccc([N+](=O)[O-])c1C(=O)OCC(=O)Nc1c(Cl)c(Cl)cc(Cl)c1Cl 26114794 LZBYRSBUSWRCRZ-UHFFFAOYSA-N 452.077 5.312 5 20 JKBD COc1ccc(NC(=O)CCSc2nnc(-c3ccco3)n2C2CCCCC2)c([N+](=O)[O-])c1 26352653 MPIJTUOVZGDSNJ-UHFFFAOYSA-N 471.539 5.081 5 20 JKBD O=C(CSc1nc2scc(-c3ccc(F)cc3)c2c(=O)[nH]1)Nc1ccc(Cl)cc1[N+](=O)[O-] 26701699 KKPONCAHYJECRE-UHFFFAOYSA-N 490.925 5.083 5 20 JKBD C[C@H](NC(=O)C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)c1ccc2c(c1)OCO2 27692044 SYCYDGYXCXMCGQ-JJBLJPBOSA-N 487.537 5.741 5 20 JKBD O=C(Nc1ccc(F)c(-c2nnc3n2CCCCC3)c1)c1cc2cc([N+](=O)[O-])ccc2s1 29905624 WFXWFZVBJFLALE-UHFFFAOYSA-N 451.483 5.186 5 20 JKBD O=C(Nc1ccccc1Oc1ncc(Cl)cc1Cl)c1cnn(-c2ccc([N+](=O)[O-])cc2)c1 195612583 GEIQCUCVPBHQHL-UHFFFAOYSA-N 470.272 5.527 5 20 JKBD C[C@H](NC(=O)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-])C(c1ccccc1)c1ccccc1 481098164 CRSUZRQAPOXUGT-INIZCTEOSA-N 458.436 5.486 5 20 JKBD O=C(NCc1ccccc1F)c1cc(NC(=O)c2c[nH]c3cc([N+](=O)[O-])ccc23)ccc1Cl 484276638 DINZTYLOHQZFSP-UHFFFAOYSA-N 466.856 5.051 5 20 JKBD C[C@@H](Nc1ccc(C(=O)Nc2ccc(CCN3CCSCC3)cc2)cc1[N+](=O)[O-])c1ccccn1 489461155 XWZKDMUDHJIXND-LJQANCHMSA-N 491.617 5.007 5 20 JKBD COc1cc(C(=O)Nc2ccc(Oc3ncc(Cl)cc3Cl)cc2)c([N+](=O)[O-])cc1OC 500347416 NBOZWBFDNXBFFI-UHFFFAOYSA-N 464.261 5.358 5 20 JKBD Cc1ccccc1-c1cc(C(=O)Nc2cc3c(cc2[N+](=O)[O-])OCCCO3)c2cnn(C(C)C)c2n1 514489316 ZLSHXEOVSGAJIY-UHFFFAOYSA-N 487.516 5.309 5 20 JKBD O=C(CNC(=O)c1cc([N+](=O)[O-])ccc1Oc1ccccc1)Nc1cc(Cl)ccc1Cl 514560611 VWFKMDQOYUJRRQ-UHFFFAOYSA-N 460.273 5.062 5 20 JKBD CC(C)N(C(=O)c1ccc(N2CCC[C@H](C)C2)c([N+](=O)[O-])c1)c1ccc(Br)cn1 515626005 OBZRWOVOKKHJDZ-HNNXBMFYSA-N 461.360 5.044 5 20 JKBD O=C(N[C@H](c1ccccc1)c1ccc(Cl)c(Cl)c1)c1ccc(-n2cncn2)c([N+](=O)[O-])c1 515742140 DVKUYZSEMJYUGS-OAQYLSRUSA-N 468.300 5.002 5 20 JKBD Cc1sc(NC(=O)c2cnn(-c3ccc([N+](=O)[O-])cc3)c2)nc1-c1ccc(OC(F)F)cc1 603839096 QHZQKXUJVUYTFO-UHFFFAOYSA-N 471.445 5.066 5 20 JKBD COc1cccc(C[C@H]2CCCN2C(=O)c2ccc(N[C@@H](C)c3ccccn3)c([N+](=O)[O-])c2)c1 604310431 MFUAFGTZXIRMDG-GHTZIAJQSA-N 460.534 5.019 5 20 JKBD COc1cc(C(=O)O[C@@H]2CCc3ccc(Cl)cc32)c([N+](=O)[O-])cc1OCc1cscn1 727959734 DQRREPZAIFLHRE-GOSISDBHSA-N 460.895 5.137 5 20 JKBD O=C(Nc1cc(C(=O)N(CC2CC2)c2ccc(Cl)c([N+](=O)[O-])c2)ccc1Cl)c1cccs1 728167360 UWJZYSSBTNTVRY-UHFFFAOYSA-N 490.368 6.272 5 20 JKBD COc1cc(C(=O)N[C@@H](C)c2ccc3c(c2)CC(=O)N3C)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 728252849 KUIMZNDYONQBRN-AWEZNQCLSA-N 495.919 5.059 5 20 JKBD CN(C)c1ccc(C(=O)c2ccccc2C(=O)Nc2ccc(OCc3cccnc3)cc2)cc1[N+](=O)[O-] 728552359 WMCFFNRPUOJDJS-UHFFFAOYSA-N 496.523 5.118 5 20 JKBD O=C(Cc1csc(-c2ccccn2)n1)Nc1cc(Cl)c([N+](=O)[O-])cc1OCc1ccccc1 743853410 GDOWAMITTDXABA-UHFFFAOYSA-N 480.933 5.527 5 20 JKBD Cc1c(C(=O)Nc2ncc(Cc3ccc(Br)cc3)s2)cc([N+](=O)[O-])c(C)c1[N+](=O)[O-] 748618219 OJWPRTDPWLQQPN-UHFFFAOYSA-N 491.323 5.182 5 20 JKBD O=C(Nc1cc([N+](=O)[O-])c(F)cc1F)[C@@H]1C[C@@H]2CCCC[C@@H]2N1C(=O)c1ccc2ccccc2c1 751073773 UECDSKIPOGLARC-OWSXEPHWSA-N 479.483 5.438 5 20 JKBD O=C(O[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1)[C@@H]1Cc2ccccc2S1 841978852 UBZVIOMHHAIRCG-LEWJYISDSA-N 468.918 5.188 5 20 JKBD O=[N+]([O-])c1cccc(Br)c1CNc1cccc(-c2cn(Cc3ccccc3)nn2)c1 864008725 DXIQIDNYKDSJFL-UHFFFAOYSA-N 464.323 5.276 5 20 JKBD O=C(c1cc([N+](=O)[O-])ccc1N1CCCCC1)N1CCC[C@H](c2nc3ccccc3s2)C1 883977736 USVKKGPGKISUQX-KRWDZBQOSA-N 450.564 5.215 5 20 JKBD Cc1c(C(=O)O[C@@H](C(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)c2ccccc2)oc2c1C(=O)CCC2 915453445 SMBQNZRNFWAVLE-JOCHJYFZSA-N 482.876 5.205 5 20 JKBD COc1cccc(-c2nc(COC(=O)c3ccc(N[C@@H](C)c4ccccn4)c([N+](=O)[O-])c3)cs2)c1 920544049 CAPZHRBTKHWVSS-INIZCTEOSA-N 490.541 5.652 5 20 JKBD O=C(Cc1ccc(Cl)cc1[N+](=O)[O-])NC1(c2ccc(NC(=O)C3=CCCC3)cc2)CCC1 1787619009 LYWAQEZKHIBCHM-UHFFFAOYSA-N 453.926 5.035 5 20 JKBD COc1cc(C(=O)NC2(c3ccc(NC(=O)[C@@H]4C[C@@H]4c4ccccc4)cc3)CCC2)ccc1[N+](=O)[O-] 1791531605 HVWJIZLKWZKAAT-DHIUTWEWSA-N 485.540 5.155 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)c3ccc([N+](=O)[O-])o3)CCC2)cc1)c1cc(F)cc(Cl)c1 1792120462 REBCJIOMOINDOM-UHFFFAOYSA-N 457.845 5.042 5 20 JKBD Cc1ccc(CC(=O)N2CCC3(CCCN(C(=O)[C@H](c4ccccc4)C(C)C)C3)CC2)cc1[N+](=O)[O-] 1805622800 BFJBXZICVKJECP-MHZLTWQESA-N 491.632 5.117 5 20 JKBD CC[C@@H](C(=O)N1CCCC[C@@H]1c1cc(NC(=O)CCc2cccc([N+](=O)[O-])c2)n[nH]1)c1ccccc1 1815537169 DPVXLNBCCJNDNV-ISKFKSNPSA-N 489.576 5.137 5 20 JKBD O=C(c1c(F)cc(Cl)cc1Cl)N1CCC([C@@H]2CCCCN2C(=O)c2ccc([N+](=O)[O-])o2)CC1 1823615055 LZWIJHAGODEGNW-KRWDZBQOSA-N 498.338 5.181 5 20 JKBD CC1=CC[C@H](C(=O)N2CCC([C@H]3CCCCN3C(=O)Cc3ccc(Cl)cc3[N+](=O)[O-])CC2)CC1 1824160291 BPCINOACDDHRFB-NZQKXSOJSA-N 488.028 5.157 5 20 JKBD CCCCC[C@H](C)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cc([N+](=O)[O-])ccc2N(C)C)CC1 1831465377 HYPAYUYUQKFBPT-GBXCKJPGSA-N 486.657 5.111 5 20 JKBD Cc1ccc(C(=O)N2CCCC[C@H]2C2CCN(C(=O)c3cc(F)cc([N+](=O)[O-])c3)CC2)c(Cl)c1 1832607417 JPNDWHIIJKUGNL-QHCPKHFHSA-N 487.959 5.243 5 20 JKBD Cc1ccccc1-n1c(C)nnc1S[C@@H](C)C(=O)Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1 10245744 UDIRNYPWOIXPEC-AWEZNQCLSA-N 480.575 5.035 5 20 JKBD C[C@@H](OC(=O)c1ccccc1C(=O)c1ccc(Cl)c([N+](=O)[O-])c1)C(=O)N[C@H](C)c1ccc(F)cc1 11029311 TYUXNSFTQKKCRH-HUUCEWRRSA-N 498.894 5.041 5 20 JKBD COc1cc(NC(=O)c2cc([N+](=O)[O-])ccc2Sc2ccccc2)ccc1N1CCCC1=O 11263701 SSPKKTAOUXJPLB-UHFFFAOYSA-N 463.515 5.134 5 20 JKBD Cc1ccc(-c2nc(C)sc2CC(=O)N[C@@H](CC(=O)OC(C)C)c2ccccc2[N+](=O)[O-])cc1 14377447 MBKXZALTUILSPH-FQEVSTJZSA-N 481.574 5.077 5 20 JKBD C[C@H](OC(=O)c1ccc(N2CCCC2)c([N+](=O)[O-])c1)C(=O)Nc1ccc(Cl)cc1C(F)(F)F 15683308 UMLXDKHHSIGOHQ-LBPRGKRZSA-N 485.846 5.051 5 20 JKBD COc1cc(C(=O)N2CCN(c3ccccc3)CC2)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 17358167 YZKJEIMEPWFPAW-UHFFFAOYSA-N 467.909 5.012 5 20 JKBD CN(C(=O)COC(=O)C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)c1ccccc1 18493958 VHLYBZOUSPUFEX-CYVLTUHYSA-N 487.537 5.341 5 20 JKBD Cc1ccc(NC(=O)[C@@H](OC(=O)c2ccc(Cl)cc2[N+](=O)[O-])c2ccccc2)c([N+](=O)[O-])c1 20751075 SRIOVQAXAXQHTP-FQEVSTJZSA-N 469.837 5.002 5 20 JKBD C[C@H](Sc1nn(-c2ccc(Cl)cc2)c(=S)s1)C(=O)Nc1ccccc1[N+](=O)[O-] 21741650 XQJKZZGJDWWEPO-JTQLQIEISA-N 452.970 5.344 5 20 JKBD COc1ccccc1OCCNC(=O)C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1 31359349 FMVSFZYUUXPADB-MNDPQUGUSA-N 489.553 5.339 5 20 JKBD O=C(CSC1=N/C(=C/c2ccccc2)C(=O)N1c1ccc(F)cc1)c1cccc([N+](=O)[O-])c1 216808404 ZYDPBQOXPVOKOV-FYJGNVAPSA-N 461.474 5.094 5 20 JKBD Cc1ccccc1-c1nnc(S[C@H](C)C(=O)Nc2nc(-c3cccc([N+](=O)[O-])c3)cs2)o1 255926748 BWPSJAXDIWHJCK-CYBMUJFWSA-N 467.532 5.196 5 20 JKBD COc1ccc(Br)cc1[C@@H]1CCCN1C(=O)c1csc(-c2ccc([N+](=O)[O-])cc2)n1 303126360 OHQVRWHKBUQRHB-SFHVURJKSA-N 488.363 5.467 5 20 JKBD O=C(Nc1ccccc1N1CCCCCC1)c1ccc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)cc1 476155076 MPEQGMOZXWWFGU-UHFFFAOYSA-N 494.573 5.028 5 20 JKBD COc1cc(C(=O)Nc2ccc3c(c2)CCCC(=O)N3)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 483920825 VAQKWVDBXDUJKJ-UHFFFAOYSA-N 481.892 5.576 5 20 JKBD O=C(Nc1ccc(OCc2ccccc2F)cc1)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-] 493684525 HDQLUNMFCZLIGI-UHFFFAOYSA-N 464.371 5.506 5 20 JKBD O=C(C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1)N(Cc1ccccc1)c1ccccn1 514911626 XQDBLYPMRQHQJD-UHFFFAOYSA-N 484.478 5.458 5 20 JKBD COc1cc(CN(C)C(=O)c2ccc(N[C@H](C)c3ccccn3)c([N+](=O)[O-])c2)ccc1OC(F)F 517539094 BPEPICIMTMSGKI-OAHLLOKOSA-N 486.475 5.045 5 20 JKBD C[C@H](Nc1ccc(C(=O)NCc2ccc(-c3nc4ccccc4[nH]3)cc2)cc1[N+](=O)[O-])c1ccccn1 521310533 KSCDRJLZVQQVAI-SFHVURJKSA-N 492.539 5.636 5 20 JKBD C[C@H](Nc1ccc(S(=O)(=O)Nc2ccccc2)cc1[N+](=O)[O-])c1nc2ccccc2n1C(F)F 590820808 QUZKCFKIKQCMBS-AWEZNQCLSA-N 487.488 5.314 5 20 JKBD CCCN(Cc1ccccc1Br)C(=O)C1CCN(c2ccccc2[N+](=O)[O-])CC1 603519864 FBZWDIWCGZGUDV-UHFFFAOYSA-N 460.372 5.013 5 20 JKBD CN(Cc1ccccc1[N+](=O)[O-])C(=O)Nc1ncc(Cc2ccc(Br)cc2)s1 603649022 KKRWVUABDJWBRP-UHFFFAOYSA-N 461.341 5.069 5 20 JKBD CC(C)N(C(=O)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1)c1ccc(Br)cn1 603998906 JSQZWZPCVNCDQM-UHFFFAOYSA-N 490.741 6.253 5 20 JKBD C[C@@H]1CCN(C(=O)C2CCN(c3ccc(C(F)(F)F)cc3[N+](=O)[O-])CC2)[C@H]2CCCC[C@@H]21 604102556 JGMOPYMWZAWOEI-LZQZEXGQSA-N 453.505 5.257 5 20 JKBD C[C@@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)Nc1cc(Cl)ccc1OCC(F)(F)F 604446706 PCSXYYKMAKPFEY-SECBINFHSA-N 453.200 5.249 5 20 JKBD O=C(COC(=O)Cc1csc(-c2cccc(C(F)(F)F)c2)n1)Nc1cc(Cl)ccc1[N+](=O)[O-] 725969873 QNQHSMAYOQVFQS-UHFFFAOYSA-N 499.854 5.115 5 20 JKBD Cc1cc(SC(C)(C)C)ccc1NC(=O)[C@@H]1CCCN1C(=O)c1ccc([N+](=O)[O-])c(C)c1 726509809 SBGLZHNAEUOIGW-NRFANRHFSA-N 455.580 5.346 5 20 JKBD COc1ccc(NC(=S)/C(=C(/O)c2ccc([N+](=O)[O-])cc2)[n+]2ccc3c(c2)CCCC3)cc1F 726575431 IUYHSWDBNRRLLV-UHFFFAOYSA-O 480.541 5.232 5 20 JKBD CC(=O)CCc1ccc(OCc2cccc(C(=O)N(C)Cc3cc([N+](=O)[O-])ccc3Cl)c2)cc1 727368023 LNNWJAXZCBTHLR-UHFFFAOYSA-N 480.948 5.621 5 20 JKBD NC(=O)COc1ccc(NC(=O)CCC(=O)c2ccc3ccc4cccc5ccc2c3c45)cc1 727754366 QMPXELOPMIJCQT-UHFFFAOYSA-N 450.494 5.050 5 20 JKBD COc1cccc(Cn2c(NC(=O)c3cc([N+](=O)[O-])ccc3Br)nc3ccccc32)c1 728003382 VSBJJTAFZVHMHI-UHFFFAOYSA-N 481.306 5.016 5 20 JKBD COc1ccccc1-c1nc(COC(=O)c2csc(-c3ccc([N+](=O)[O-])cc3)n2)cs1 747958309 XWHUPQURAJIUBQ-UHFFFAOYSA-N 453.501 5.207 5 20 JKBD CCc1ccc(NC(=O)[C@H](C)OC(=O)c2ccccc2NC(=O)c2ccc([N+](=O)[O-])cc2Cl)cc1 847365867 GFBFXYYRRATWIM-HNNXBMFYSA-N 495.919 5.247 5 20 JKBD CCOc1ccc(NC(=O)COC(=O)c2c(-c3c(Cl)cccc3Cl)noc2C)c([N+](=O)[O-])c1 913350526 SEFFGLMNNUXKFU-UHFFFAOYSA-N 494.287 5.059 5 20 JKBD O=C(Cc1csc(-c2ccc(C(F)(F)F)cc2)n1)OCc1nc(-c2cccc([N+](=O)[O-])c2)no1 914802040 RUOHLZZZLZVHOC-UHFFFAOYSA-N 490.419 5.073 5 20 JKBD CCn1c(S[C@@H](C(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)c2ccccc2)nnc1-c1ccccn1 916663629 DDBAUHCKQPMLEA-HXUWFJFHSA-N 494.964 5.394 5 20 JKBD C[C@H](NC(=O)c1cc([N+](=O)[O-])ccc1N1CCCCC1)c1cccc(OCc2ccccn2)c1 917756895 TTYCNBDFBBZBOR-IBGZPJMESA-N 460.534 5.050 5 20 JKBD CC(C)(C)OC(=O)NC(C)(C)c1noc(CSc2nc3ccccc3c3nc4ccccc4n23)n1 920068310 SKRAXZLWOKYTHU-UHFFFAOYSA-N 490.589 5.471 5 20 JKBD CCc1cc[n+](/C(C(=S)Nc2ccc3c(c2)OC(F)(F)O3)=C(/O)c2cccc([N+](=O)[O-])c2)cc1 920397338 TUYWQWJCNGBRAR-UHFFFAOYSA-O 486.476 5.090 5 20 JKBD Cc1ccc(C(=O)Nc2cccc(C(F)(F)F)c2)cc1NC(=O)c1cccc([N+](=O)[O-])c1C 920844429 CFMGTSZFWDKQEI-UHFFFAOYSA-N 457.408 5.735 5 20 JKBD O=C(CCc1cccc([N+](=O)[O-])c1)Nc1ccc(C2(NC(=O)c3cc4sccc4[nH]3)CCC2)cc1 1786602737 PFMBMKWKDBUNPP-UHFFFAOYSA-N 488.569 5.518 5 20 JKBD O=C(NC1(c2ccc(NC(=O)C3(c4cccc([N+](=O)[O-])c4)CCC3)cc2)CCC1)[C@@H]1[C@H]2C=CS[C@@H]21 1790476645 PVRRBTMOVFBVMK-ZLNRFVROSA-N 489.597 5.026 5 20 JKBD C[C@@H](Cc1ccccn1)C(=O)Nc1ccc(C2(NC(=O)/C=C/c3ccccc3[N+](=O)[O-])CCC2)cc1 1791767396 SEAJDQNYMAFDDG-XIJQHFHMSA-N 484.556 5.016 5 20 JKBD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1sc2ccccc2c1Cl)c1cc(F)cc([N+](=O)[O-])c1 1797463359 UNJJHWMVHFZWOZ-MUJYYYPQSA-N 487.940 5.168 5 20 JKBD O=C(/C=C/c1cc2ccccc2o1)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)C1(c3cccc([N+](=O)[O-])c3)CCC1)C2 1797702448 GNIQJANCYPXRTO-MVACIEJFSA-N 499.567 5.114 5 20 JKBD Cc1c(C(=O)NC[C@@H]2CCN(C(=O)C3(C)CCCCC3)[C@@H]2c2cccnc2)cc(Cl)cc1[N+](=O)[O-] 1811796761 KZEMJENGAXYGBV-WMZHIEFXSA-N 499.011 5.242 5 20 JKBD Cc1c(C(=O)Nc2cc([C@H]3CCCCN3C(=O)c3cccc(F)c3)[nH]n2)cc(Cl)cc1[N+](=O)[O-] 1821294882 VBBVODYWQRYXEB-LJQANCHMSA-N 485.903 5.039 5 20 JKBD Cc1ccc(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3cc(Cl)cc([N+](=O)[O-])c3C)CC2)c(C)n1 1829533453 RGEPTSPYDGJDKL-HSZRJFAPSA-N 499.011 5.116 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)N1CCCC[C@@H]1C1CCN(C(=O)[C@H]2C[C@H]2c2ccccc2)CC1 1830728414 CAUKUVHXNKSWKA-WRALFONMSA-N 493.579 5.079 5 20 JKBD O=C(C1=CCCS1)N1CCC([C@H]2CCCCN2C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)CC1 1831059659 JMCOJIXCJWOFLK-LJQANCHMSA-N 485.631 5.064 5 20 JKBD C[C@H](Sc1nnc(-c2ccccc2Cl)n1C1CCCC1)C(=O)Nc1ccc(F)c([N+](=O)[O-])c1 8988873 SRNPLUZDXDSMQI-ZDUSSCGKSA-N 489.960 5.880 5 20 JKBD CSc1ccc(C(=O)c2ccccc2C(=O)OCc2nc(-c3ccccc3C)no2)cc1[N+](=O)[O-] 10154530 BVIIUIBTORVBFP-UHFFFAOYSA-N 489.509 5.263 5 20 JKBD CC(=O)Nc1ccc(-c2csc(NC(=O)c3cc([N+](=O)[O-])ccc3N3CCCCC3)n2)c(F)c1 10967162 WBUBHBACAPSOJB-UHFFFAOYSA-N 483.525 5.058 5 20 JKBD C[C@H](c1cccc(NC(=O)c2ccccc2)c1)N(C)C(=O)COc1ccc([N+](=O)[O-])cc1Cl 22556099 WNVAVGZOWBHNFX-MRXNPFEDSA-N 467.909 5.099 5 20 JKBD CCOc1ccccc1NC(=O)[C@@H](OC(=O)c1ccc(Cl)c([N+](=O)[O-])c1)c1ccccc1 23551929 KBSLUCVJIYFXNJ-NRFANRHFSA-N 454.866 5.184 5 20 JKBD O=C(Nc1ccccc1C(=O)NC[C@@H](c1ccco1)N1CCCCC1)c1ccc([N+](=O)[O-])cc1Cl 29870036 QCZUHJVVNGYGRB-QFIPXVFZSA-N 496.951 5.051 5 20 JKBD Cc1ccccc1NC(=O)c1cc2ccccc2cc1OC[C@@H](O)COc1cccc([N+](=O)[O-])c1 30533300 DETTUYDFVQMSIN-QFIPXVFZSA-N 472.497 5.127 5 20 JKBD O=[N+]([O-])c1ccc(Sc2nnc(Cc3cccs3)n2CCc2ccccc2)c2ccncc12 105323257 CYQAQVLXHODTHR-UHFFFAOYSA-N 473.583 5.781 5 20 JKBD C[C@@H](Nc1ccc(C(=O)Nc2ccc3nc(C4CC4)sc3c2)cc1[N+](=O)[O-])c1ccccn1 195734144 YLKNAAVUDQTCNE-CQSZACIVSA-N 459.531 5.902 5 20 JKBD Cc1ccc(C(=O)Nc2ccccc2)cc1NC(=O)C1CCN(c2ccccc2[N+](=O)[O-])CC1 483266682 GLJSCMUWXHJKDS-UHFFFAOYSA-N 458.518 5.011 5 20 JKBD Cc1nc(SCc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)n([C@H](C)[C@@H]2C[C@H]3CC[C@H]2C3)c1C 485044190 HRTHWVDJHMCQIG-JMVFIXPQSA-N 453.568 5.748 5 20 JKBD O=C(Nc1ccc(Br)cc1Br)c1csc(-c2ccc([N+](=O)[O-])cc2)n1 496487246 BLULONQAUGPBNV-UHFFFAOYSA-N 483.141 5.496 5 20 JKBD COc1cc(C(=O)Nc2ncc(Cc3ccc(Cl)cc3C)s2)c([N+](=O)[O-])cc1OC(F)F 502500484 JUQRYCIFDZRAEF-UHFFFAOYSA-N 483.880 5.466 5 20 JKBD Cc1ccc(-c2csc(NC(=O)c3cccc(S(=O)(=O)Cc4ccccc4)c3)n2)cc1[N+](=O)[O-] 503145937 XFWBCQLLVWIZQT-UHFFFAOYSA-N 493.566 5.253 5 20 JKBD CC(=O)Nc1ccc(Br)cc1NC(=O)CSc1ccc(C(F)(F)F)cc1[N+](=O)[O-] 506238954 SLYRMDHZZNIMFC-UHFFFAOYSA-N 492.273 5.065 5 20 JKBD O=c1ccccn1Cc1ccc(CNCc2ccc(Oc3ccc(F)cc3)c([N+](=O)[O-])c2)cc1 507919183 DBZPWOJCVHIASF-UHFFFAOYSA-N 459.477 5.026 5 20 JKBD O=C1CCCN1Cc1ccc(CNCc2ccc(Oc3ccccc3Cl)c([N+](=O)[O-])c2)cc1 509602827 TWPBZUUIHNKSAH-UHFFFAOYSA-N 465.937 5.453 5 20 JKBD COc1ccc([C@@H](NCc2ccc(Oc3ccccc3Cl)c([N+](=O)[O-])c2)c2nccn2C)cc1 509615635 FEUFSRGXNDMQCR-XMMPIXPASA-N 478.936 5.662 5 20 JKBD O=C(Cc1csc(-c2ccc(Cl)s2)n1)Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1 512951491 RHFVMOLFZCQBBK-UHFFFAOYSA-N 462.965 5.738 5 20 JKBD O=C(Nc1ncc(Cc2ccc(F)c(F)c2)s1)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-] 514030178 BSICKIMPHISHIH-UHFFFAOYSA-N 473.379 5.114 5 20 JKBD COc1cc(C(=O)N[C@@H](C)c2ccc(Oc3ccccc3)c(F)c2)c([N+](=O)[O-])cc1OC(F)F 515997127 SNFJKWWIWDVKNL-ZDUSSCGKSA-N 476.407 5.627 5 20 JKBD CC(=O)N1CCc2c(sc3nc(-c4cc([N+](=O)[O-])c[nH]4)c(Cl)c(-c4ccc(C)cc4)c23)C1 541586499 ZPBMOMOGBAIASO-UHFFFAOYSA-N 466.950 5.733 5 20 JKBD COc1cc(C(=O)Nc2cc(Cl)ccc2Oc2ccc(Cl)cc2)c([N+](=O)[O-])cc1OC 603463662 UTNSCERPOLAHCE-UHFFFAOYSA-N 463.273 5.963 5 20 JKBD C[C@H]1CCC[C@H](C)N1C(=O)c1cc(Cl)ccc1NC(=O)c1cc2cc([N+](=O)[O-])ccc2o1 603738365 YXNWVWWPJFBHFH-KBPBESRZSA-N 455.898 5.650 5 20 JKBD C[C@@H](Sc1nnc(-c2ccccc2)n1[C@H](C)c1ccccc1)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 603917263 LBJHUBLQGJVRTH-QZTJIDSGSA-N 498.568 6.366 5 20 JKBD C[C@@H](C1CC1)N(C(=O)CCCn1c(=O)oc2cc([N+](=O)[O-])ccc21)c1cccc(C(F)(F)F)c1 603965071 XMPXPRHTWIYUKC-AWEZNQCLSA-N 477.439 5.133 5 20 JKBD COCCOc1cc(C)ccc1NC(=O)c1ccc(Sc2nc(C)cs2)c([N+](=O)[O-])c1 603986870 PUXCEHSTCODLLQ-UHFFFAOYSA-N 459.549 5.097 5 20 JKBD CCN(Cc1cnn(C)c1)C(=O)c1c2c(nc3ccccc13)/C(=C\c1cccc([N+](=O)[O-])c1)CCC2 604482039 ZEIALYMPHZWFKE-STZFKDTASA-N 481.556 5.416 5 20 JKBD O=C(Nc1ccc(-c2noc(C(F)(F)F)n2)cc1)c1ccc(NCc2ccccc2)c([N+](=O)[O-])c1 608882266 DROMGSFKDIHCQE-UHFFFAOYSA-N 483.406 5.528 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)Nc2ccc(OCc3cccc(C)c3)cc2C)cc1SC 609228179 HWQVKLSJHVRBEL-UHFFFAOYSA-N 452.532 5.773 5 20 JKBD Cc1ccc(/C(O)=C(/C(=S)NCC(F)(F)F)[n+]2ccc(Cc3ccccc3)cc2)cc1[N+](=O)[O-] 725760497 PONLAZGTOHSAOQ-UHFFFAOYSA-O 488.511 5.145 5 20 JKBD CC(C)(C)c1csc(CCNC(=O)c2ccccc2NC(=O)c2ccc([N+](=O)[O-])cc2Cl)n1 729439328 GSCLBNUSMQYLOK-UHFFFAOYSA-N 486.981 5.227 5 20 JKBD O=C(O[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1)c1csc(-c2ccoc2)n1 731090302 CCLSYEXUYPTNIM-LJQANCHMSA-N 483.889 5.502 5 20 JKBD C[C@@H](OC(=O)c1ccc(-c2nc3ccccc3s2)o1)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl 773982701 LMLJPLKUWQWQGN-LLVKDONJSA-N 471.878 5.302 5 20 JKBD Cc1cc(C)c(NC(=O)[C@@H](C)Oc2ccc3c(-c4ccc([N+](=O)[O-])cc4)cc(=O)oc3c2)c(Cl)c1 851958762 JNCMYUZLUKWFOU-MRXNPFEDSA-N 492.915 6.044 5 20 JKBD O=C1CC[C@@H](c2noc(-c3ccccc3Sc3ccccc3[N+](=O)[O-])n2)CN1CC1CCCC1 856573376 SZBBTNZKNWUNBE-GOSISDBHSA-N 478.574 5.692 5 20 JKBD CC(C)N(Cc1nnc(-c2cccc([N+](=O)[O-])c2)o1)C(=O)c1cc(-c2ccco2)nc2ccccc12 864244616 GDOBFVKKYGFBDW-UHFFFAOYSA-N 483.484 5.504 5 20 JKBD CCCOc1cc(NC(=O)c2c(-c3ccc(F)cc3)noc2C)c([N+](=O)[O-])cc1OCCC 914718692 XGMGUTIGWJKAPA-UHFFFAOYSA-N 457.458 5.527 5 20 JKBD COc1cccc(SCC(=O)Oc2ccc(NC(=O)c3cc([N+](=O)[O-])ccc3Cl)cc2)c1 916035749 GOBVREJBMVWXTM-UHFFFAOYSA-N 472.906 5.207 5 20 JKBD COc1ccc(NC(=O)[C@H](OC(=O)c2cc([N+](=O)[O-])cc([N+](=O)[O-])c2C)c2ccccc2)cc1Cl 919226127 ZRLWKAMMZYUQCS-OAQYLSRUSA-N 499.863 5.010 5 20 JKBD CC(=O)N(c1ccc(C(F)(F)F)cc1)c1nc(COC(=O)c2ccccc2[N+](=O)[O-])cs1 920496383 PGIKJPBZRGCNJT-UHFFFAOYSA-N 465.409 5.112 5 20 JKBD O=C(CCc1cccnc1)Nc1ccc(C2(NC(=O)C3(c4cccc([N+](=O)[O-])c4)CCC3)CCC2)cc1 1788278378 HRQYWBWIEACJRS-UHFFFAOYSA-N 498.583 5.178 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)[C@@H]3C[C@@H]3C3CC3)CCC2)cc1)c1cc(Br)ccc1[N+](=O)[O-] 1790663929 MNWHALXYSRURJT-RTBURBONSA-N 498.377 5.151 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)c3cccc4ccncc34)CCC2)cc1)c1cc(F)cc([N+](=O)[O-])c1 1790699506 UABYLCSSWLLONO-UHFFFAOYSA-N 484.487 5.344 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)Nc1ccc(C2(NC(=O)CCc3ccoc3)CCC2)cc1 1790772224 DIDBDABPLMSNRE-UHFFFAOYSA-N 465.481 5.016 5 20 JKBD O=C(NC1(c2ccc(NC(=O)c3cccc4ccncc34)cc2)CCC1)c1ccc([N+](=O)[O-])cc1F 1790859461 IMPSPQLVUXSHMW-UHFFFAOYSA-N 484.487 5.344 5 20 JKBD O=C(NC1(c2ccc(NC(=O)[C@H]3CCc4cccc(Cl)c43)cc2)CCC1)c1ccc([N+](=O)[O-])o1 1791138684 NIKYIDAUJTUZSD-SFHVURJKSA-N 479.920 5.319 5 20 JKBD O=C(C[C@H]1C[C@@H]2CC[C@H]1C2)Nc1ccc(C2(NC(=O)c3nc4cc([N+](=O)[O-])ccc4[nH]3)CCC2)cc1 1791325272 GIZNQEIDSSGLDP-FGTMMUONSA-N 487.560 5.045 5 20 JKBD Cc1c(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cccc3ccccc23)cc(Cl)cc1[N+](=O)[O-] 1797300963 TYIRZTQBAWKTSF-ACDBMABISA-N 477.948 5.275 5 20 JKBD O=C(/C=C/c1ccccc1[N+](=O)[O-])N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc2c1oc1ccccc12 1801203963 FSUFRNBFPOQJGV-BNYZZTEFSA-N 495.535 5.459 5 20 JKBD Cc1c(C(=O)N2CCCC[C@H]2C2CCN(C(=O)/C=C/c3ccoc3)CC2)cc(Cl)cc1[N+](=O)[O-] 1830734443 LBTBHOBSBQBDHT-BDNZGDGKSA-N 485.968 5.096 5 20 JKBD CCc1ccc(C(=O)N2CCC([C@@H]3CCCCN3C(=O)CSc3ccccc3[N+](=O)[O-])CC2)cc1 1831777339 PQFPBJJSOLBJSM-QHCPKHFHSA-N 495.645 5.183 5 20 JKBD C[C@H](OC(=O)c1sc2ccccc2c1Cl)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 11331803 UUJWLMUQSUJOMB-VIFPVBQESA-N 472.828 5.666 5 20 JKBD O=C(Nc1ccc(Cl)c([N+](=O)[O-])c1)[C@H](Sc1nnc(C2CC2)n1C1CC1)c1ccccc1 17279578 LWDKBAJADYQGHA-LJQANCHMSA-N 469.954 5.524 5 20 JKBD C[C@@H](N[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Br)c1ccccc1)c1ccccc1 21818281 UUJNCBDMTOURNE-VFNWGFHPSA-N 454.324 5.388 5 20 JKBD COc1cc(C(=O)OCc2csc(-c3ccc(C(F)(F)F)cc3)n2)c([N+](=O)[O-])cc1OC 25434796 RGCBLMQXMKRBQG-UHFFFAOYSA-N 468.409 5.111 5 20 JKBD O=C(c1cccc([N+](=O)[O-])c1)N(C[C@@H]1CCCO1)c1nc(-c2cccc(C(F)(F)F)c2)cs1 26131584 NVRPTYONLQDWNT-SFHVURJKSA-N 477.464 5.563 5 20 JKBD Cc1c(NC(=O)[C@@H](C)OC(=O)c2ccccc2SCc2cccs2)cccc1[N+](=O)[O-] 26599445 LACSDUBFMRZADO-OAHLLOKOSA-N 456.545 5.441 5 20 JKBD O=C(Nc1ccccc1Oc1ncc(Cl)cc1Cl)C1CCN(c2ccccc2[N+](=O)[O-])CC1 69624327 DMYHQTQJQUDBLL-UHFFFAOYSA-N 487.343 5.944 5 20 JKBD C[C@H](Nc1ccc(C(=O)N[C@H]2CCc3c(Br)cccc32)cc1[N+](=O)[O-])c1ccccn1 303190624 MNUVQSMITAQXDT-XOBRGWDASA-N 481.350 5.343 5 20 JKBD C[C@H](Nc1ccc(C(=O)Nc2ccc(CCN3CCCCC3)cc2)cc1[N+](=O)[O-])c1ccccn1 410091540 SMKCZBSXJVHJJW-FQEVSTJZSA-N 473.577 5.444 5 20 JKBD C[C@@H](Nc1ccc(C(=O)Nc2ccc3nc(C(C)(C)C)[nH]c3c2)cc1[N+](=O)[O-])c1ccccn1 476181670 YBLWGLZUKPYNLP-OAHLLOKOSA-N 458.522 5.589 5 20 JKBD CN(C)c1ccc(C(=O)c2ccccc2C(=O)N(C)c2cccc(OC(F)(F)F)c2)cc1[N+](=O)[O-] 485534256 SLJUMPOQSZRAQR-UHFFFAOYSA-N 487.434 5.067 5 20 JKBD O=C(Nc1ccccc1CN1CCSCC1)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1 489375105 AKYASHXOLNCZGC-UHFFFAOYSA-N 483.977 5.842 5 20 JKBD C[C@H](NC(=O)c1csc(-c2ccc([N+](=O)[O-])cc2)n1)c1cccc(OCc2ccccn2)c1 498745035 PYQIZQWPTGDBQJ-INIZCTEOSA-N 460.515 5.183 5 20 JKBD O=C(Nc1ccc(CCC(=O)N2CCCC2)cc1)c1cc([N+](=O)[O-])ccc1Sc1ccccc1 510178235 YFPWQYVLYUMIOH-UHFFFAOYSA-N 475.570 5.553 5 20 JKBD C[C@H](CN1CCCCC1)NC(=O)C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1 512946371 AVMMSDAYYJIGQR-KETZHDHUSA-N 464.591 5.126 5 20 JKBD CCOc1cc(NC(=O)N2CCC[C@H]2c2nc3ccccc3n2CC)c([N+](=O)[O-])cc1OCC 513953197 KZQMQYWXSBBWEB-IBGZPJMESA-N 467.526 5.131 5 20 JKBD CCOC(=O)c1sc(N(Cc2ccccc2)C(=O)[C@@H](C)Sc2ccc([N+](=O)[O-])cc2)nc1C 514383256 HPFAOUBXNTWRKK-MRXNPFEDSA-N 485.587 5.250 5 20 JKBD COc1ccc(OCc2nnc(SCc3csc([N+](=O)[O-])c3)n2-c2ccccc2F)cc1 515592435 HFXKUWUXZYIWBL-UHFFFAOYSA-N 472.523 5.256 5 20 JKBD O=C(C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1)N1CCC[C@@H]1Cc1ccc(F)cc1 515993359 QDKXJFVYYCAQBU-HXUWFJFHSA-N 479.474 5.203 5 20 JKBD O=C(c1cc([N+](=O)[O-])ccc1Sc1ccc(Cl)cc1)N1CCCN(c2nccs2)CC1 518867034 LPLZPTCEEFAWAY-UHFFFAOYSA-N 474.995 5.208 5 20 JKBD Cc1c(NC(=O)c2ccc(Nc3ccccc3)c([N+](=O)[O-])c2)cccc1-c1nnc2n1CCCCC2 524325525 GLADPMXIBXDXHL-UHFFFAOYSA-N 482.544 5.884 5 20 JKBD CO[C@@H](C)c1cccc(NC(=O)c2ccc(C(=O)Nc3cccc([C@@H](C)OC)c3)cc2[N+](=O)[O-])c1 524357908 VXECLCJVVADZEM-SJORKVTESA-N 477.517 5.514 5 20 JKBD COc1ccc(CNCc2cn(Cc3ccccc3)nc2-c2cc3ccccc3o2)cc1[N+](=O)[O-] 551236641 VWCFLBGQMQOKNL-UHFFFAOYSA-N 468.513 5.551 5 20 JKBD O=C(NCCCn1ccnc1)c1c2c(nc3ccccc13)/C(=C\c1ccc([N+](=O)[O-])cc1)CCC2 590781129 KNHVZCQUNHVLGQ-JZJYNLBNSA-N 467.529 5.037 5 20 JKBD CS(=O)(=O)c1ccc(Oc2ccc(-c3nc4ccccc4s3)cc2Cl)c([N+](=O)[O-])c1 603474073 UUUHFRUXJSKIPJ-UHFFFAOYSA-N 460.920 5.721 5 20 JKBD O=C(CSc1ccc(C(F)(F)F)cc1[N+](=O)[O-])Nc1cccc(-c2cn3cccnc3n2)c1 603980626 LBFVIZDSAILJLP-UHFFFAOYSA-N 473.436 5.054 5 20 JKBD O=C(c1ccc(NCc2ccccc2)c([N+](=O)[O-])c1)N1C[C@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1 604262522 NAUJQDXUAVEGDV-HZPDHXFCSA-N 475.389 5.410 5 20 JKBD O=C(c1csc(-c2ccc([N+](=O)[O-])cc2)n1)N1CCc2[nH]c3c(Br)cccc3c2C1 604519475 RTIFHNJRSMZJSO-UHFFFAOYSA-N 483.347 5.161 5 20 JKBD CC(C)n1ncc2c(C(=O)Nc3ccnn3-c3ccc([N+](=O)[O-])cc3)cc(-c3cccs3)nc21 609151400 LEYURGGSASPDLK-UHFFFAOYSA-N 473.518 5.087 5 20 JKBD CSc1ccc([N+](=O)[O-])c(C(=O)Nc2sc3c(c2-c2nc4ccccc4[nH]2)CCCC3)c1 612517464 JECCJHQQCGYJII-UHFFFAOYSA-N 464.572 6.053 5 20 JKBD Cc1cc[n+](/C(C(=S)N[C@H](C)c2ccc(Cl)cc2Cl)=C(/O)c2cccc([N+](=O)[O-])c2)cc1 726571698 XCBSGQLMTVOWGO-OAHLLOKOSA-O 489.404 6.060 5 20 JKBD C[C@H](NC(=S)/C(=C(/O)c1cccc([N+](=O)[O-])c1)[n+]1cccc(O)c1)c1ccc(Cl)cc1Cl 726571742 XOJRYNNFIBWJPL-ZDUSSCGKSA-O 491.376 5.457 5 20 JKBD O=C(Nc1ccccc1OCc1ncc(-c2cccc(Cl)c2)o1)c1cc(F)ccc1[N+](=O)[O-] 726763968 MDRHRQOCXVSQSV-UHFFFAOYSA-N 467.840 5.874 5 20 JKBD O=C(Nc1ccc2c(c1)CCC(=O)N2Cc1ccc(Cl)cc1)c1cc(F)c(F)cc1[N+](=O)[O-] 727710628 UIPWAPDFQQFJBM-UHFFFAOYSA-N 471.847 5.258 5 20 JKBD O=C(Nc1ccc(OCc2cccc(F)c2)c(F)c1)c1cc([N+](=O)[O-])ccc1Br 728493595 XILVRJQUKZASFZ-UHFFFAOYSA-N 463.234 5.467 5 20 JKBD C[C@@H](OC(=O)C1CCN(c2ncc(C(F)(F)F)cc2Cl)CC1)c1cccc([N+](=O)[O-])c1 729436363 YIEQIAGOKCWXEQ-GFCCVEGCSA-N 457.836 5.183 5 20 JKBD Cc1ccc(C)c(NC(=O)[C@H](C)OC(=O)C2CCN(c3ccc(C(F)(F)F)cc3[N+](=O)[O-])CC2)c1 729628162 SSPWFVZEDSAXMD-INIZCTEOSA-N 493.482 5.017 5 20 JKBD C[C@H](OC(=O)Cn1c2ccccc2c(=O)c2ccccc21)c1nnc(-c2cccc(Cl)c2)o1 841978934 VIZOOFVIIHXDDT-HNNXBMFYSA-N 459.889 5.163 5 20 JKBD COc1cc(CNc2ccc(N=S(C)(C)=O)cc2)c([N+](=O)[O-])cc1OCc1ccccc1 864013504 UVLZHGBSJYCJOH-UHFFFAOYSA-N 455.536 5.154 5 20 JKBD O=C(Nc1ccc(OC(=O)c2cc(OCC(F)(F)F)ccc2[N+](=O)[O-])cc1)c1ccccc1 916959388 VCZPUSMQLOOJRY-UHFFFAOYSA-N 460.364 5.007 5 20 JKBD Cc1onc(-c2ccccc2)c1-c1nnc(COC(=O)c2cc([N+](=O)[O-])ccc2Oc2ccccc2)o1 917257391 NASHCCYFUIEQBA-UHFFFAOYSA-N 498.451 5.758 5 20 JKBD O=C1/C(=C\c2ccc(-c3ccc([N+](=O)[O-])cc3)o2)NC(=S)N1c1ccc(OC(F)(F)F)cc1 917611816 FCSJREGADWOCLB-GZTJUZNOSA-N 475.404 5.016 5 20 JKBD Cc1ccc(-c2nnc(-c3ccc(C(=O)OCc4nc(-c5ccc([N+](=O)[O-])cc5)no4)cc3)o2)cc1 918917537 UKODNNXDTSGXLC-UHFFFAOYSA-N 483.440 5.027 5 20 JKBD C[C@H](OC(=O)CCCCc1ccc(Br)cc1)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 919357113 GJKKLBVEKZVVQO-AWEZNQCLSA-N 474.311 5.425 5 20 JKBD C[C@@H](OC(=O)c1csc(-c2ccccc2F)n1)C(=O)Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1 920728825 ACSLGSZBGKTQTE-GFCCVEGCSA-N 498.517 5.165 5 20 JKBD COc1cc(C(=O)Nc2cc(NC(C)=O)c(F)cc2F)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 921155972 CVQQIZJXCNCRFZ-UHFFFAOYSA-N 491.834 5.538 5 20 JKBD COc1cccc(Cl)c1C(=O)Nc1ccc(C2(NC(=O)/C=C/c3ccc([N+](=O)[O-])o3)CCC2)cc1 1792144795 AYRBDUMAJSWBEL-ZRDIBKRKSA-N 495.919 5.311 5 20 JKBD COc1cc(C(=O)Nc2ccc(C3(NC(=O)CCC4CCCC4)CCC3)cc2)ccc1[N+](=O)[O-] 1792164205 ZIYQYSGZGVOTMF-UHFFFAOYSA-N 465.550 5.322 5 20 JKBD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc2cc([N+](=O)[O-])ccc2s1)[C@@H]1C[C@H]1c1ccc(F)cc1 1801206212 VSCBEDNTYZLTMU-HIHICTBBSA-N 493.560 5.004 5 20 JKBD O=C(c1cc2[nH]ccc2s1)N1CCC([C@@H]2CCCCN2C(=O)/C=C/c2ccccc2[N+](=O)[O-])CC1 1832906891 HNMRVMZJTGCZIX-SHBDEGQCSA-N 492.601 5.084 5 20 JKBD O=C(NC[C@H](c1ccccc1)c1c[nH]c2ccccc12)C1CCN(c2ccccc2[N+](=O)[O-])CC1 10691333 AOODIPRDNURJHI-HSZRJFAPSA-N 468.557 5.241 5 20 JKBD CCc1ccc(N(C(C)=O)c2nc(COC(=O)c3ccc(Cl)c([N+](=O)[O-])c3)cs2)cc1 11025208 NGPYDSAIPXIFCZ-UHFFFAOYSA-N 459.911 5.309 5 20 JKBD Cc1cc(C(=O)Nc2ccc(NS(=O)(=O)c3c(Cl)cccc3Cl)cc2)ccc1[N+](=O)[O-] 15788217 BCMAMOZCYMKZBR-UHFFFAOYSA-N 480.329 5.263 5 20 JKBD COc1ccc(NC(=O)[C@@H](C)Sc2nnc(-c3cccs3)n2-c2ccccc2)c([N+](=O)[O-])c1 16711665 RCEWGNGZQZIJSF-CQSZACIVSA-N 481.559 5.032 5 20 JKBD COc1ccc(NC(=O)[C@H](C)Sc2nnc(-c3cccs3)n2Cc2ccccc2)c([N+](=O)[O-])c1 16716140 GPRMWHKMAOJUSB-HNNXBMFYSA-N 495.586 5.091 5 20 JKBD CN(CC(=O)Nc1c(Cl)cccc1Cl)C(=O)c1ccc(Nc2ccccc2)c([N+](=O)[O-])c1 18040079 CABXJJNOLIXCGB-UHFFFAOYSA-N 473.316 5.356 5 20 JKBD CCn1c(S[C@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)nc2cc3ccccc3cc2c1=O 22178025 FUQBXCCHMWGNJG-CYBMUJFWSA-N 482.949 5.251 5 20 JKBD CSc1ccc(C(=O)c2ccccc2C(=O)Nc2ccc(C(=O)N3CCCC3)cc2)cc1[N+](=O)[O-] 26868674 QYMDTSWPGYOGED-UHFFFAOYSA-N 489.553 5.036 5 20 JKBD CCn1c(S[C@@H](C)C(=O)Nc2ncc(Cl)cc2Cl)nc2cc3ccccc3cc2c1=O 31747246 HCCOPMOQZAVUDY-LBPRGKRZSA-N 473.385 5.391 5 20 JKBD C[C@H](Sc1nnc(-c2cccnc2)n1Cc1ccccc1)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl 36795730 HCDBRQJDVDCTEP-HNNXBMFYSA-N 494.964 5.069 5 20 JKBD COc1cc(C(=O)N2CCC[C@@H](c3ccccc3)CC2)c([N+](=O)[O-])cc1OCc1cscn1 72092619 FLDMBYXGYGNWKS-GOSISDBHSA-N 467.547 5.049 5 20 JKBD CCOc1cc(C(=O)N[C@H](c2ccc3c(c2)CCCC3)c2cccs2)c([N+](=O)[O-])cc1OC 105271978 DKPKVTNWRVLMHA-XMMPIXPASA-N 466.559 5.462 5 20 JKBD C[C@H](OC(=O)c1ccc2nc(Cl)ccc2c1)C(=O)Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1 107661322 WVAGKQGUJVKUAZ-LBPRGKRZSA-N 482.905 5.104 5 20 JKBD CCOc1c(Br)cc(Cl)cc1NC(=O)c1cc(SC)c(OC)cc1[N+](=O)[O-] 482051299 FSCPNGUOUCPRGW-UHFFFAOYSA-N 475.748 5.392 5 20 JKBD O=C(Nc1nc2ccccc2n1CCCn1ccnc1)c1cc([N+](=O)[O-])ccc1Sc1ccccc1 485426462 DGYZCOUEXIHIDI-UHFFFAOYSA-N 498.568 5.635 5 20 JKBD COc1cc(C(=O)N2CCC(OCCC(C)C)CC2)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 500501241 UDOZMRGKJUNCON-UHFFFAOYSA-N 476.957 5.716 5 20 JKBD COc1ccc(NC(=O)Cc2cn(-c3ccccc3)nc2-c2ccc([N+](=O)[O-])cc2)c(C(F)(F)F)c1 500775251 QNXHDSKAKHMNMJ-UHFFFAOYSA-N 496.445 5.656 5 20 JKBD COc1ccc(Oc2ccc([N+](=O)[O-])cc2C(=O)Nc2ccccc2OC[C@@H]2CCCCO2)cc1 511384332 PBHQLPGRVBLOLL-NRFANRHFSA-N 478.501 5.596 5 20 JKBD CN(C(=O)c1ccc(Cl)cc1)c1ccc(NC(=O)c2ccc(N3CCCC3)c([N+](=O)[O-])c2)cc1 511602993 DURVRGBTZZPFIV-UHFFFAOYSA-N 478.936 5.377 5 20 JKBD CCc1cc(Sc2nnc(-c3ccc(OC(F)F)cc3)o2)nc(-c2ccc([N+](=O)[O-])cc2)n1 512553259 ASQQMGYHMCKCOG-UHFFFAOYSA-N 471.445 5.417 5 20 JKBD CCOc1cc(NC(=O)N2CC=C(c3c(C)[nH]c4ccccc34)CC2)c([N+](=O)[O-])cc1OCC 517957345 HFHYSGJZOYJMCK-UHFFFAOYSA-N 464.522 5.503 5 20 JKBD CC(C)c1ccc(OC2CCN(C(=O)c3ccc(N[C@H](C)c4ccccn4)c([N+](=O)[O-])c3)CC2)cc1 518434099 RCZSNRIIHLLCKS-HXUWFJFHSA-N 488.588 5.970 5 20 JKBD CC(C)(C)c1csc(CCNC(=O)Cc2cn(-c3ccccc3)nc2-c2ccc([N+](=O)[O-])cc2)n1 520526695 IOGCFFJHFOIMNH-UHFFFAOYSA-N 489.601 5.103 5 20 JKBD COc1cc([C@@H](C)NCc2ccc(-c3cccc([N+](=O)[O-])c3)o2)ccc1OCc1ccncc1 520955802 UHUXCOBYRFENNV-GOSISDBHSA-N 459.502 5.688 5 20 JKBD O=C(Cc1ccc([N+](=O)[O-])cc1)NCCc1cn(-c2ccccc2)nc1-c1ccc(Cl)cc1 521504766 NLWPSSIUKYHAKX-UHFFFAOYSA-N 460.921 5.002 5 20 JKBD O=C(Nc1cc(Cl)ccc1Cl)[C@@H]1CCCCN1C(=O)c1ccc([N+](=O)[O-])cc1Cl 523443646 GKKDEPNAMGEZHI-KRWDZBQOSA-N 456.713 5.188 5 20 JKBD COc1cc(C(=O)Nc2cc(-c3ccncc3)ccc2C)c([N+](=O)[O-])cc1OCc1cscn1 523870344 COWIIILPMSBJCG-UHFFFAOYSA-N 476.514 5.262 5 20 JKBD Cc1cc(OCc2cccc(F)c2)ccc1NC(=O)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-] 524386612 KPKLQNJANDWTTL-UHFFFAOYSA-N 478.398 5.815 5 20 JKBD COc1cc(C(=O)N(Cc2ccco2)C2CCN(C)CC2)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 602846051 PLGKSYHOPJLNSJ-UHFFFAOYSA-N 499.951 5.379 5 20 JKBD Cc1ccc(Sc2ccc(/C=C3/CN(C)Cc4c3nc3ccccc3c4C(=O)O)cc2[N+](=O)[O-])cc1 603781497 KSJOGPAKJHTQPX-UYRXBGFRSA-N 497.576 6.287 5 20 JKBD CCOc1cccc(CN[C@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Br)c2ccccc2)c1 604045531 PXQIDTKTJVAPLA-QFIPXVFZSA-N 484.350 5.226 5 20 JKBD C[C@@H]1CCCN(c2ccc(C(=O)N3CCC(C(=O)c4ccc(Cl)cc4)CC3)cc2[N+](=O)[O-])C1 604195970 XMADNXHAMYYOJF-QGZVFWFLSA-N 469.969 5.220 5 20 JKBD C[C@H]1C[C@@H](C)CN(c2ccc(C(=O)N(C)C[C@@H]3CCCO[C@@H]3c3ccccc3)cc2[N+](=O)[O-])C1 604519060 HJGXFQNCADGILO-XBLPNDSKSA-N 465.594 5.317 5 20 JKBD C[C@H](NCc1ccc(Oc2ccccc2Cl)c([N+](=O)[O-])c1)c1nc2ccccc2n1C(F)F 609006522 KEUUUBWHQOJGPH-AWEZNQCLSA-N 472.879 6.636 5 20 JKBD COc1cc(C(=O)N[C@H](C)c2sc(-c3ccc(F)cc3)nc2C)c([N+](=O)[O-])cc1OC(F)F 609186665 YQUDGUHTYHUELX-SNVBAGLBSA-N 481.452 5.267 5 20 JKBD COc1cc(C(=O)OCc2csc(N(C(C)=O)c3ccc(Cl)c(Cl)c3)n2)ccc1[N+](=O)[O-] 725944721 AUEUNIFMASSGQS-UHFFFAOYSA-N 496.328 5.408 5 20 JKBD O=C(COC(=O)c1cc([N+](=O)[O-])ccc1Cl)Nc1cc(C(F)(F)F)ccc1N1CCCCC1 747818168 HCMBLRLIVLRVDM-UHFFFAOYSA-N 485.846 5.053 5 20 JKBD COc1cc([C@H]2NC(=O)c3sc4ccccc4c3N2)c([N+](=O)[O-])cc1OCc1ccccc1 877855260 QICSJFHVOJASEE-HSZRJFAPSA-N 461.499 5.251 5 20 JKBD CC(C)(C)OC(=O)NCc1ccc(-c2noc(-c3csc(-c4ccc([N+](=O)[O-])cc4)n3)n2)cc1 904718568 ZFPADLUXPJFBMO-UHFFFAOYSA-N 479.518 5.460 5 20 JKBD Cc1ccc(C(=O)N2C[C@@H](C)C[C@@H](C)C2)cc1NC(=O)c1cc([N+](=O)[O-])ccc1N1CCCCC1 917742047 OSSKRGHIAWWKNT-KDURUIRLSA-N 478.593 5.264 5 20 JKBD COc1cc(C(=O)Nc2ccc(CN3CCOC3=O)cc2)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 917790010 WAIOXTKZJSAKBM-UHFFFAOYSA-N 497.891 5.254 5 20 JKBD CN(C(=O)c1ccccc1NC(=O)c1ccc([N+](=O)[O-])cc1Cl)c1ccc(C(C)(C)C)cc1 918685924 ZFJDVVLZIFHCAZ-UHFFFAOYSA-N 465.937 6.075 5 20 JKBD Cc1nccn1-c1ncccc1NC(=O)c1ccc(NCc2ccccc2Cl)c([N+](=O)[O-])c1 919983676 OGNAIOGEBBQLKM-UHFFFAOYSA-N 462.897 5.002 5 20 JKBD O=C(NC1(c2ccc(NC(=O)[C@H]3C[C@@H]3C3CC3)cc2)CCC1)c1cccc(Br)c1[N+](=O)[O-] 1786054456 CLKHLYOGCZQGBK-MOPGFXCFSA-N 498.377 5.151 5 20 JKBD Cc1ccc(OCCC(=O)NC2(c3ccc(NC(=O)/C=C/c4ccc([N+](=O)[O-])o4)cc3)CCC2)cc1 1786205587 JGNIGDLIJVLEQS-ACCUITESSA-N 489.528 5.113 5 20 JKBD Cc1ccc(C(=O)NC2(c3ccc(NC(=O)/C=C/c4ccc([N+](=O)[O-])o4)cc3)CCC2)cc1F 1786207916 SVDVWTPNSNHFAJ-PKNBQFBNSA-N 463.465 5.096 5 20 JKBD Cc1ccc(CC(=O)NC2(c3ccc(NC(=O)c4scnc4C4CC4)cc3)CCC2)cc1[N+](=O)[O-] 1787186221 ARBZAVIRLQWRTF-UHFFFAOYSA-N 490.585 5.228 5 20 JKBD COc1ccc2cc(C(=O)Nc3ccc(C4(NC(=O)Cc5cccc([N+](=O)[O-])c5)CCC4)cc3)[nH]c2c1 1788972836 COKGEKVNLLBQQI-UHFFFAOYSA-N 498.539 5.075 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)c3ccc([N+](=O)[O-])c4c3OCO4)CCC2)cc1)c1ccc2occc2c1 1789050280 MNUSFLPOPDKZDJ-UHFFFAOYSA-N 499.479 5.131 5 20 JKBD Cc1ccc(C(=O)Nc2ccc(C3(NC(=O)c4c(F)ccc([N+](=O)[O-])c4C)CCC3)cc2)c(C)n1 1789966965 PCEJYJQFGHTBKB-UHFFFAOYSA-N 476.508 5.116 5 20 JKBD COc1cscc1C(=O)NC1(c2ccc(NC(=O)CSc3ccccc3[N+](=O)[O-])cc2)CCC1 1791522473 WZNGKRBRHPQQNA-UHFFFAOYSA-N 497.598 5.205 5 20 JKBD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(-c2ccc(Cl)cc2)o1)c1cccc(F)c1[N+](=O)[O-] 1796965226 UVRSJKYKPNYATD-BCDXTJNWSA-N 497.910 5.213 5 20 JKBD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H]1CCC[C@H]2CCCC[C@H]21)c1cc2cc([N+](=O)[O-])ccc2s1 1797878839 WJDSUXQHJMHKHH-MYVDZQPHSA-N 495.645 5.668 5 20 JKBD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc2cc([N+](=O)[O-])ccc2s1)c1ccc(Cl)cc1 1801206761 HUHXUYHGWJSWCJ-BCDXTJNWSA-N 469.950 5.029 5 20 JKBD CC(C)(C)CCCCCC(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2ccc([N+](=O)[O-])o2)[nH]n1 1822113517 DHOPJFSHJZDKFI-KRWDZBQOSA-N 459.547 5.213 5 20 JKBD CC(C)=CCCC(=O)N1CCC([C@@H]2CCCCN2C(=O)c2c(F)ccc([N+](=O)[O-])c2C)CC1 1830732553 CGABOPDDQPCLSD-QFIPXVFZSA-N 459.562 5.022 5 20 JKBD CCC(C)(C)C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cccc(Br)c2[N+](=O)[O-])CC1 1831389348 QDIJKRZWDYQDLN-IBGZPJMESA-N 494.430 5.027 5 20 JKBD CCn1c(S[C@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2)nc2scc(-c3cccs3)c2c1=O 9751443 AOSVRDBZZUXFML-GFCCVEGCSA-N 486.600 5.234 5 20 JKBD CC1=C(C(=O)Nc2ccccc2)[C@H](c2ccc(Cl)c([N+](=O)[O-])c2)NC(=O)N1Cc1cccs1 16495205 AYORILMGIDCYRD-NRFANRHFSA-N 482.949 5.489 5 20 JKBD CCOc1ccc([C@H](CNC(=S)Nc2ccc([N+](=O)[O-])cc2)c2c[nH]c3ccccc23)cc1OC 18169219 LYVASQNNHJQBNS-NRFANRHFSA-N 490.585 5.602 5 20 JKBD CCCOc1ccc(C(F)(F)F)cc1NC(=O)c1ccc(Cn2nc(C)c([N+](=O)[O-])c2C)cc1 19684228 VUVHAZJQMNTHTA-UHFFFAOYSA-N 476.455 5.516 5 20 JKBD Cc1ccc(-n2c(SCc3nnc(-c4ccc([N+](=O)[O-])cc4)o3)nc3ccccc3c2=O)cc1F 25834383 DXSSLFIAIQWYBS-UHFFFAOYSA-N 489.488 5.084 5 20 JKBD Cc1cc(NC(=O)C/C(=C/c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)ccc1-n1cnnn1 29525045 NZFYQEDFWBZODU-AQTBWJFISA-N 497.540 5.058 5 20 JKBD Cc1ccc(-n2c(SCc3nc(-c4cccc([N+](=O)[O-])c4)no3)nnc2-c2ccncc2)cc1C 31839595 KOPSMNWGDZKSJB-UHFFFAOYSA-N 485.529 5.197 5 20 JKBD O=C(C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1)N1CCCC[C@H]1Cc1ccccc1 60340505 VAQGUUWKQOHHEL-NRFANRHFSA-N 475.511 5.454 5 20 JKBD C[C@H]1CN(c2ccc(NC(=O)CSc3ccc(C(F)(F)F)cc3[N+](=O)[O-])cc2F)C[C@@H](C)O1 107963850 XSCSBMLBVXXUOC-BETUJISGSA-N 487.475 5.097 5 20 JKBD CC(C)(C)OC(=O)Nc1ccc(C(F)(F)F)cc1NC(=O)c1n[nH]c2ccc([N+](=O)[O-])cc12 108636847 WUPHQKQLCPGNGS-UHFFFAOYSA-N 465.388 5.089 5 20 JKBD CCOC(=O)N(C)c1ccc(NC(=O)C2CCN(c3ccc(C(F)(F)F)cc3[N+](=O)[O-])CC2)cc1 108806891 QUTGDLDWWAVTOF-UHFFFAOYSA-N 494.470 5.061 5 20 JKBD C[C@H]1CCCN(c2ccc(C(=O)Nc3nc(-c4ccc5c(c4)CCC(=O)N5)cs3)cc2[N+](=O)[O-])C1 490939851 XEDGQAXJFWXTDO-HNNXBMFYSA-N 491.573 5.092 5 20 JKBD O=C(C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)NCC[C@@H]1C(=O)Nc2ccccc21 491196370 QVYPFGFBUUHDIY-TXOBRMIJSA-N 498.564 5.377 5 20 JKBD O=C(N[C@@H](Cc1ccc(O)cc1)c1nc2ccccc2[nH]1)c1csc(-c2ccc([N+](=O)[O-])cc2)n1 496611430 LFCBJCBGABBXKT-NRFANRHFSA-N 485.525 5.014 5 20 JKBD COc1cc(CCNC(=O)[C@H](Sc2cc(F)ccc2F)c2ccccc2)c([N+](=O)[O-])cc1OC 499675523 LRALJVLOTUNMEW-HSZRJFAPSA-N 488.512 5.083 5 20 JKBD CCOC(=O)c1c(NC(=O)c2cc(OCC)c(OC)cc2[N+](=O)[O-])sc(-c2ccccc2)c1C 502900274 YYJYZSWKXYUNOS-UHFFFAOYSA-N 484.530 5.468 5 20 JKBD C[C@H](Nc1ccc(C(=O)Nc2nc3ccc(Cl)cc3s2)cc1[N+](=O)[O-])c1ccccn1 506236546 RQMNXDRQFKICEN-LBPRGKRZSA-N 453.911 5.678 5 20 JKBD CC(C)N(C)C(=O)c1ccc(Cl)c(NC(=O)CCNc2ccc(C(F)(F)F)cc2[N+](=O)[O-])c1 509305214 NITQXTAIIWBSST-UHFFFAOYSA-N 486.878 5.188 5 20 JKBD O=C(Cc1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1)Nc1ccc(-c2cc[nH]n2)cc1 516357435 HLEQPAOGEIHIMP-UHFFFAOYSA-N 464.485 5.019 5 20 JKBD C[C@H](C[C@@H]1CCCO1)NC(=O)C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1 522552088 QWUVHOKBHNADGR-VQWLIAMWSA-N 451.548 5.209 5 20 JKBD CN1C/C(=C\c2ccc(-c3ccc([N+](=O)[O-])cc3Cl)o2)c2nc3ccccc3c(C(=O)O)c2C1 603781501 NZXRGCGAJCDVES-GXDHUFHOSA-N 475.888 5.741 5 20 JKBD O=C(c1c2c(nc3ccccc13)/C(=C\c1ccc([N+](=O)[O-])cc1)CCC2)N1CCCSCC1 604383260 NOSVBNZZTFBAFN-ZPHPHTNESA-N 459.571 5.599 5 20 JKBD Cc1ccc(C(C)C)c(Oc2ccc(CNC3CCN(C(=O)C(C)(C)C)CC3)cc2[N+](=O)[O-])c1 608781940 JLJNOEITNCNKFE-UHFFFAOYSA-N 467.610 5.946 5 20 JKBD O=[N+]([O-])c1ccc(-c2nn(-c3ccccc3)cc2CNC2CCN(c3ccccc3)CC2)cc1 608836118 NUOAZOGEJLDZLW-UHFFFAOYSA-N 453.546 5.206 5 20 JKBD O=C(C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)Nc1ccc(-n2ccnn2)cc1 608874597 PWZCWNNPVXMINS-SDXDJHTJSA-N 482.525 5.355 5 20 JKBD O=C(C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)N1CCC[C@@H](n2ccnc2)C1 609131695 VGVBXVPPILTXEK-LUDQZLGDSA-N 473.558 5.195 5 20 JKBD COc1ccc([C@@H](CNC(=O)c2c[nH]c3cc([N+](=O)[O-])ccc23)c2c[nH]c3ccccc23)cc1 609581186 FEWJYJPBRAOOOW-OAQYLSRUSA-N 454.486 5.128 5 20 JKBD O=C(OCc1cc([N+](=O)[O-])cc2c1OCOC2)[C@H](Oc1ccc(F)cc1Cl)c1ccccc1 730611918 UOKSPYIQABNCKP-JOCHJYFZSA-N 473.840 5.117 5 20 JKBD Cc1cc(C)n([C@H](C)C(=O)Nc2ccc(NC(=O)c3cc(Cl)ccc3[N+](=O)[O-])cc2Cl)n1 743838515 NXSZNJDPBRUZPB-CYBMUJFWSA-N 476.320 5.167 5 20 JKBD Cc1cc(C(=O)[C@H](C)OC(=O)c2csc(-c3cccc([N+](=O)[O-])c3)n2)c(C)n1Cc1ccco1 747964454 ZFOPTRIPWVMGKA-INIZCTEOSA-N 479.514 5.206 5 20 JKBD CC(C)(C)c1cc[n+](/C(C(=S)NCc2cccs2)=C(/O)c2ccc([N+](=O)[O-])cc2)cc1 839412242 RAWPKEPMFKIQST-UHFFFAOYSA-O 454.597 5.242 5 20 JKBD COC(=O)c1sc2cccc(F)c2c1COC(=O)Cn1c2ccccc2c(=O)c2ccccc21 864035693 OGIWWZNVGDQKJI-UHFFFAOYSA-N 475.497 5.039 5 20 JKBD CC(C)N(Cc1nnc(-c2cccc([N+](=O)[O-])c2)o1)C(=O)c1cc(-c2cccs2)nc2ccccc12 864244869 RWQBTKJJTNCXRH-UHFFFAOYSA-N 499.552 5.972 5 20 JKBD Cn1cc(-c2nc(-c3cccc(Cn4cnc5ccccc54)c3)no2)c(-c2ccc([N+](=O)[O-])cc2)n1 904489012 BLJCXFCHTJWTLP-UHFFFAOYSA-N 477.484 5.110 5 20 JKBD C[C@@H](Oc1ccc(Cl)cc1[N+](=O)[O-])c1nc(-c2cccc(NC(=O)OC(C)(C)C)c2)no1 904632575 VILFFWBSYSINSH-GFCCVEGCSA-N 460.874 5.785 5 20 JKBD C[C@H](OCc1ccccc1)C(=O)O[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1 915248174 IYLCDRBYIGGEIW-KSFYIVLOSA-N 468.893 5.077 5 20 JKBD Cc1sc(NC(=O)c2cccc(NC(=O)OC(C)(C)C)c2)nc1-c1cccc([N+](=O)[O-])c1 917792144 WRFRTQDFBBLHRJ-UHFFFAOYSA-N 454.508 5.626 5 20 JKBD CC1=C(C(=O)N(C)C)[C@H](c2ccc(Cl)c([N+](=O)[O-])c2)NC(=S)N1c1ccc(C(F)(F)F)cc1 918105083 OAOYZROWQWOKMG-SFHVURJKSA-N 498.914 5.065 5 20 JKBD CC(=O)N(c1nc(COC(=O)c2cc3cccc([N+](=O)[O-])c3[nH]2)cs1)c1c(C)cc(C)cc1C 919523487 ZRNHWXZGSULPHO-UHFFFAOYSA-N 478.530 5.499 5 20 JKBD COc1cc(C(=O)OCc2ccc(C(F)(F)F)cc2)c([N+](=O)[O-])cc1OCc1cscn1 920117333 QKBZDIPPVXPTFP-UHFFFAOYSA-N 468.409 5.015 5 20 JKBD Cc1ccccc1N1C(=O)/C(=C/c2cc([N+](=O)[O-])ccc2OC(F)F)c2ccccc2C1=O 920836691 JKHLQIOCYBTATF-CPNJWEJPSA-N 450.397 5.232 5 20 JKBD CC(=O)N(c1ccc(C(F)(F)F)cc1)c1nc(COc2cc(Cl)ccc2[N+](=O)[O-])cs1 920992189 NZXVNLSZPCHYEM-UHFFFAOYSA-N 471.844 5.987 5 20 JKBD O=C(NC1(c2ccc(NC(=O)c3ccnc4ccccc34)cc2)CCC1)c1cccc(F)c1[N+](=O)[O-] 1788891155 NFEDQOSOPNQNHJ-UHFFFAOYSA-N 484.487 5.344 5 20 JKBD O=C(/C=C/c1ccc([N+](=O)[O-])o1)NC1(c2ccc(NC(=O)c3ccc4c(c3)CCCC4=O)cc2)CCC1 1789038593 IKBOZMPMNQTLFO-JLHYYAGUSA-N 499.523 5.168 5 20 JKBD Cc1cccc2cc(C(=O)NC3(c4ccc(NC(=O)c5cc(O)cc([N+](=O)[O-])c5)cc4)CCC3)[nH]c12 1790755962 JQURGVDOVMSWRM-UHFFFAOYSA-N 484.512 5.152 5 20 JKBD O=C(C[C@@H]1C[C@@H]2CC[C@H]1C2)Nc1ccc(C2(NC(=O)Cc3cc(F)ccc3[N+](=O)[O-])CCC2)cc1 1791324031 NJHGDBCPRQUDMO-QYZOEREBSA-N 479.552 5.237 5 20 JKBD CC[C@@H](C)[C@@H](C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)Cc1ccc(Cl)cc1[N+](=O)[O-])c1ccccc1 1793078088 GJEQFJBBLNYXIF-GGUOXWIMSA-N 498.023 5.259 5 20 JKBD O=C(/C=C/c1ccccc1[N+](=O)[O-])Nc1cc([C@H]2CCCCN2C(=O)c2cc(F)cc(Cl)c2)[nH]n1 1823503879 XVNZFSGIJRJLCR-MHNQQFQPSA-N 497.914 5.130 5 20 JKBD CC1(C(=O)N2CCC([C@H]3CCCCN3C(=O)CCc3cccc([N+](=O)[O-])c3)CC2)CCCCC1 1824841769 BIZQQNHKRVFMTB-XMMPIXPASA-N 469.626 5.118 5 20 JKBD CC[C@@H](C(=O)N1CCC([C@H]2CCCCN2C(=O)c2ccc([N+](=O)[O-])cc2F)CC1)c1ccccc1 1830495821 WXJDKDXWNDTZED-RCZVLFRGSA-N 481.568 5.161 5 20 JKBD O=C(/C=C/C1CCCCC1)N1CCC([C@@H]2CCCCN2C(=O)c2ccc([N+](=O)[O-])cc2F)CC1 1830499123 OXKFXLARMYRNNQ-LUFJGRFYSA-N 471.573 5.104 5 20 JKBD Cc1cc(Cl)ccc1C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cc(F)cc([N+](=O)[O-])c2)CC1 1830612957 NMCBMIOFHHISJA-QHCPKHFHSA-N 487.959 5.243 5 20 JKBD Cc1cc(Cl)cc(C(=O)N2CCC([C@@H]3CCCCN3C(=O)c3cccc(F)c3[N+](=O)[O-])CC2)c1 1830623548 VUWVNUXWVRIZLH-QFIPXVFZSA-N 487.959 5.243 5 20 JKBD CC[C@H]1CC[C@H](C(=O)N2CCCC[C@@H]2C2CCN(C(=O)Cc3ccc([N+](=O)[O-])cc3F)CC2)CC1 1831695628 YFBDBNGNVQGOGZ-DZRGJMJISA-N 487.616 5.113 5 20 JKBD O=C(Cc1ccc(Cl)cc1)N1CCC([C@H]2CCCCN2C(=O)/C=C/c2ccccc2[N+](=O)[O-])CC1 1832903242 WNYSUNNCRVPBDV-XOJVXBCLSA-N 496.007 5.124 5 20 JKBD C[C@@H](OC(=O)c1cc([N+](=O)[O-])ccc1Cl)C(=O)Nc1ccc(Cl)c(C(F)(F)F)c1 10666538 QMKSFPQQOWDONJ-MRVPVSSYSA-N 451.184 5.104 5 20 JKBD O=C(Nc1ccccc1C(=O)N[C@@H]1CCSc2c(F)cccc21)c1ccc([N+](=O)[O-])cc1Cl 28043594 DTUHKUAQKMILMI-HXUWFJFHSA-N 485.924 5.607 5 20 JKBD O=C(CCC(=O)c1ccccc1)O[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1 28611035 JOQDCKOHYZXSCZ-QHCPKHFHSA-N 466.877 5.134 5 20 JKBD C[C@H](Nc1ccc(C(=O)Nc2ccccc2OC[C@H]2CCCCO2)cc1[N+](=O)[O-])c1ccccn1 108910905 QOERSVPRKXZRAV-AZUAARDMSA-N 476.533 5.363 5 20 JKBD O=[N+]([O-])c1cc(CN[C@@H](CN2CCOCC2)c2ccccc2)ccc1Oc1ccccc1Cl 216504020 XSEMDMNQDSAJBN-QFIPXVFZSA-N 467.953 5.204 5 20 JKBD C[C@H](Nc1ccc(C(=O)NCc2ccccc2OC2CCCC2)cc1[N+](=O)[O-])c1ccccn1 303050373 XXSHQLHGMNZSAT-SFHVURJKSA-N 460.534 5.414 5 20 JKBD CC(=O)Nc1ccc(C)c(NC(=O)c2ccccc2Sc2ccc(C(F)(F)F)cc2[N+](=O)[O-])c1 486072430 WJBHGYCOSUVNSN-UHFFFAOYSA-N 489.475 6.284 5 20 JKBD O=C(CSc1ccc(C(F)(F)F)cc1[N+](=O)[O-])Nc1ccc(=O)n(Cc2ccccc2Cl)c1 501464351 ZSPKWKHGDGAIGI-UHFFFAOYSA-N 497.882 5.208 5 20 JKBD COc1ccc(CNCc2ccc(Br)s2)cc1OCc1ccc([N+](=O)[O-])cc1 507933712 SUUORMBVHRZGCB-UHFFFAOYSA-N 463.353 5.296 5 20 JKBD COc1ccc(-c2nc(C)c(C(=O)Nc3nc(-c4cccc([N+](=O)[O-])c4)cs3)s2)cc1OC 511858178 GFTRZVBCLMIVKB-UHFFFAOYSA-N 482.543 5.420 5 20 JKBD Cn1c([C@@H]2CCCCN2C(=O)CSc2ccc(C(F)(F)F)cc2[N+](=O)[O-])nc2ccccc21 515583398 KQYJRPHZTPFIRW-KRWDZBQOSA-N 478.496 5.346 5 20 JKBD CC(C)Oc1ccc(NC(=O)c2csc(-c3cccc([N+](=O)[O-])c3)n2)c(C(F)(F)F)c1 520625479 JTCBDVLCIFRKEK-UHFFFAOYSA-N 451.426 5.777 5 20 JKBD COCCOc1ccc(C(F)(F)F)cc1NC(=O)c1ccc(N2CCC[C@@H](C)C2)c([N+](=O)[O-])c1 603444630 PEYFJEGJWPXZPU-OAHLLOKOSA-N 481.471 5.127 5 20 JKBD Cc1ccc(S(=O)(=O)Nc2ccc(NC(=O)[C@@H]3CCCC[C@H]3C(F)(F)F)cc2)cc1[N+](=O)[O-] 603780511 OJXICWMXXMVLRE-QZTJIDSGSA-N 485.484 5.011 5 20 JKBD CCCC(=O)Nc1cccc(NC(=O)C2CCN(c3ccc(C(F)(F)F)cc3[N+](=O)[O-])CC2)c1 603969996 ONYAOVAIDROKCM-UHFFFAOYSA-N 478.471 5.207 5 20 JKBD C[C@H](NCc1ccccc1CN1CCCC[C@@H]1C)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 604045294 MSCQUZCOMJTKPY-IRXDYDNUSA-N 478.515 5.105 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Cl)[C@H](N[C@@H]1CCc2c(Cl)cccc21)c1ccccc1 604403753 QBJZDAZTNBMOFJ-IFMALSPDSA-N 456.329 5.859 5 20 JKBD O=C(Nc1ncc(Cc2ccc(Br)cc2)s1)c1c[nH]c2ccc([N+](=O)[O-])cc12 604546406 LURSMVKVQHBNBJ-UHFFFAOYSA-N 457.309 5.138 5 20 JKBD O=[N+]([O-])c1ccc(-c2nn(-c3ccccc3)cc2CN[C@H](c2ccc(F)cc2)[C@H]2CCCO2)cc1 608837186 XLLUDWKYDKQACL-XNMGPUDCSA-N 472.520 5.597 5 20 JKBD Cc1csc(CCCCNC(=O)C/C(=C/c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)n1 608908789 DXCVVUURNUCARW-RGEXLXHISA-N 492.626 6.039 5 20 JKBD COc1ccc(C[C@H](NC(=O)c2cc(SC)ccc2[N+](=O)[O-])c2ccccc2)cc1OC 608948469 AEPFUUNXFCSWEO-FQEVSTJZSA-N 452.532 5.048 5 20 JKBD Cc1ccc(NC(=O)c2ccc(N3CCC[C@H](c4nc5ccccc5o4)C3)c([N+](=O)[O-])c2)cc1 608972787 GPNDSLZQAWYHES-IBGZPJMESA-N 456.502 5.681 5 20 JKBD O=C(Nc1ccc(OCc2ccncc2)cc1)c1cc([N+](=O)[O-])ccc1NCc1ccccc1 609216097 GTIVDIAFEFKNDQ-UHFFFAOYSA-N 454.486 5.433 5 20 JKBD CC(C)(C)c1csc(CCN[C@@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2ccccc2)n1 609222189 XBLHRSZEDUWPRH-OAQYLSRUSA-N 472.998 5.514 5 20 JKBD O=C(COC(=O)c1cc([N+](=O)[O-])ccc1Br)Nc1c(Cl)cc(Cl)cc1Cl 725983954 ANIHGQJRQNXXMA-UHFFFAOYSA-N 482.501 5.113 5 20 JKBD CC(=O)N(c1nc(COC(=O)/C=C\c2ccc([N+](=O)[O-])cc2)cs1)c1c(C)cc(C)cc1C 798128172 RAIUSJXUZGBWNP-YFHOEESVSA-N 465.531 5.418 5 20 JKBD Nc1ncc(-c2nc(-c3ccc(Oc4ncc(C(F)(F)F)cc4Cl)cc3)no2)cc1[N+](=O)[O-] 904671190 VHNALAZDYBIXAW-UHFFFAOYSA-N 478.774 5.149 5 20 JKBD CN(Cc1cccc(NC(=O)c2cc([N+](=O)[O-])ccc2Sc2ccccc2)c1)C(=O)C(F)(F)F 915161068 MSRWDEYVOPTEJV-UHFFFAOYSA-N 489.475 5.519 5 20 JKBD O=C(OCC(=O)N(Cc1ccccc1)c1nc(-c2ccc(F)cc2)cs1)c1csc([N+](=O)[O-])c1 919370550 NUQAFFITQBTEBI-UHFFFAOYSA-N 497.529 5.309 5 20 JKBD COc1ccc(C(=O)OCc2csc(N(C(C)=O)c3ccc(C(F)(F)F)cc3)n2)cc1[N+](=O)[O-] 920499277 MQHBBTXAIWSVRR-UHFFFAOYSA-N 495.435 5.120 5 20 JKBD C[C@@H](Nc1ccc(C(=O)O[C@H](c2ccccc2)c2ccncc2)cc1[N+](=O)[O-])c1ccccn1 920772482 NKHYLZSNLNTZFR-IQGLISFBSA-N 454.486 5.504 5 20 JKBD C[C@H](OC(=O)[C@@H](C)Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)Nc1ccccc1-c1ccccc1 920777334 CHORTCDJJKOIRE-JKSUJKDBSA-N 468.893 5.253 5 20 JKBD Cc1cc(C(=O)Nc2ccc(C3(NC(=O)CCc4cccc([N+](=O)[O-])c4)CCC3)cc2)c(C)o1 1787341261 QMZWGVUXQWUOCY-UHFFFAOYSA-N 461.518 5.185 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)[C@H]3C[C@H]3c3ccc(Cl)cc3)CCC2)cc1)c1ccc([N+](=O)[O-])[nH]1 1790185741 DVPSCAFMVBDRSI-PMACEKPBSA-N 478.936 5.128 5 20 JKBD CC(C)[C@H]1CC[C@H](C(=O)N2CCCC[C@H]2c2cc(NC(=O)Cc3cc([N+](=O)[O-])ccc3F)n[nH]2)CC1 1815646132 ZUHPZTKFEJNXNR-BSRJHKFKSA-N 499.587 5.154 5 20 JKBD CC[C@@H](NC(=O)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1)c1ccc(OC)cc1 18131682 ROWIJPDVQPDNFY-LJQANCHMSA-N 465.472 5.106 5 20 JKBD COc1cc(NC(=O)Cc2cn(-c3ccccc3)nc2-c2ccc([N+](=O)[O-])cc2)c(OC)cc1Cl 23787966 PAYNXNYQWUQAOL-UHFFFAOYSA-N 492.919 5.299 5 20 JKBD COc1cc(/C=C/c2ccnc(-c3cccc([N+](=O)[O-])c3)[n+]2[O-])ccc1OCc1ccccc1 58773049 ONVLFWYFSVJVGG-ZRDIBKRKSA-N 455.470 5.048 5 20 JKBD Cn1c(-c2ccc(Cl)cc2)nn(CN(Cc2ccccc2[N+](=O)[O-])CC(F)(F)F)c1=S 71966576 KWSLXYPWQZIKON-UHFFFAOYSA-N 471.892 5.202 5 20 JKBD CCOc1ccc([C@H](CNC(=O)c2cccc([N+](=O)[O-])c2C)c2c[nH]c3ccccc23)cc1OC 104969539 KVNKEXUSZXSVER-NRFANRHFSA-N 473.529 5.354 5 20 JKBD CCOC(=O)N(C)c1ccc(NC(=O)Cc2cn(-c3ccccc3)nc2-c2ccc([N+](=O)[O-])cc2)cc1 108805019 SVMANQOKPLQUEQ-UHFFFAOYSA-N 499.527 5.221 5 20 JKBD C[C@H](Nc1ccc(C(=O)N2CCC[C@H]2c2ccc(Cl)cc2)cc1[N+](=O)[O-])c1ccccn1 115710373 WOXZYCHFOVVTQP-AOMKIAJQSA-N 450.926 5.794 5 20 JKBD O=C(Nc1ccc(Cl)cc1Cl)[C@H]1CCCCN1C(=O)c1cc2cc([N+](=O)[O-])ccc2s1 195562365 YULQBSJZTPIEMX-QGZVFWFLSA-N 478.357 5.750 5 20 JKBD Cc1nn(Cc2ccc(C(=O)N(C)[C@@H](C)c3cccc(C(F)(F)F)c3)cc2)c(C)c1[N+](=O)[O-] 498493929 KYOAJQSCYFSFCZ-HNNXBMFYSA-N 460.456 5.308 5 20 JKBD C[C@@H](NCC1(c2c(F)cccc2F)CCCC1)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 501984146 NZDUKZBGCPGVSK-CYBMUJFWSA-N 471.426 5.320 5 20 JKBD COc1cc(C(=O)NCC2(c3cccc(C(F)(F)F)c3)CCCC2)c([N+](=O)[O-])cc1OC(F)F 502890329 MLECDBOMRBCIKX-UHFFFAOYSA-N 488.409 5.465 5 20 JKBD C[C@H](Nc1ccc(C(=O)N2CCN(c3cccc(C(F)(F)F)c3)CC2)cc1[N+](=O)[O-])c1ccccn1 506098962 HWUQTNPCTMWMRX-KRWDZBQOSA-N 499.493 5.144 5 20 JKBD CC(=O)Nc1ccc(Br)cc1NC(=O)c1ccc(NCc2ccccc2)c([N+](=O)[O-])c1 506210791 CLCFPHCGCMBLIR-UHFFFAOYSA-N 483.322 5.180 5 20 JKBD COc1ccccc1NC(=O)Nc1cc(NC(=O)N[C@@H](C)c2cccc([N+](=O)[O-])c2)ccc1OC 507730562 FMQRCPRXORYDHM-HNNXBMFYSA-N 479.493 5.139 5 20 JKBD C[C@@H](NC(=O)Nc1ccc(NC(=O)c2ccccc2)cc1C(F)(F)F)c1cccc([N+](=O)[O-])c1 509977946 AHSZVFZNFGPRLK-CQSZACIVSA-N 472.423 5.749 5 20 JKBD Cc1nn(C)c(C(=O)N2C[C@@H](c3ccccc3Cl)c3c([nH]c4ccccc34)[C@@H]2C)c1[N+](=O)[O-] 512291914 DUOKABIYALADEN-YOEHRIQHSA-N 463.925 5.120 5 20 JKBD COc1cc(C(=O)Nc2ccc(C(C)C)cc2C(C)C)c([N+](=O)[O-])cc1OCc1cscn1 512336251 BLINZVPAEYQCSD-UHFFFAOYSA-N 469.563 6.138 5 20 JKBD COc1ccc(Cl)cc1-c1cc(NC(=O)c2csc(-c3cccc([N+](=O)[O-])c3)n2)n[nH]1 512847006 SRMDHXDLBGWGEG-UHFFFAOYSA-N 455.883 5.023 5 20 JKBD O=[N+]([O-])c1c(Sc2nnc(-c3ccc(Cl)cc3)n2Cc2ccco2)nc2sccn12 514653195 CMERIECMPYVWTH-UHFFFAOYSA-N 458.912 5.008 5 20 JKBD COc1cc(C(=O)NC[C@@H](c2ccccc2)c2c[nH]c3ccccc23)c([N+](=O)[O-])cc1OC(F)F 514740287 GZITZDBSAGSVNP-SFHVURJKSA-N 481.455 5.248 5 20 JKBD C[C@H]1C[C@@H](C)CN(Cc2ccccc2CN[C@@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2C(F)(F)F)C1 515759503 MPYYVOFZFVIHPU-KSZLIROESA-N 492.542 5.208 5 20 JKBD COc1ccccc1N1CCC(NCc2ccc(-c3ccc([N+](=O)[O-])cc3Br)o2)CC1 518785895 AOLNZYKCFHJDHT-UHFFFAOYSA-N 486.366 5.385 5 20 JKBD CCCOc1cc(NC(=O)c2ccc(OC)cc2Br)c([N+](=O)[O-])cc1OCCC 522250455 WUFRHGLSLZDNJV-UHFFFAOYSA-N 467.316 5.196 5 20 JKBD COCCN(C(=O)c1cccc(OC2CCCC2)c1)c1nc(-c2ccc([N+](=O)[O-])cc2)cs1 553134446 FMXKFLPHESFOJP-UHFFFAOYSA-N 467.547 5.333 5 20 JKBD O=C(Nc1ccnn1Cc1cccc(Cl)c1Cl)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-] 603732990 JIKBKVNYCYYZMY-UHFFFAOYSA-N 489.237 5.340 5 20 JKBD COc1cc([C@@H]2Nc3cc(Cl)ccc3C(=O)N2C)ccc1OCc1ccc([N+](=O)[O-])cc1 603937894 BVAYOGHWAQILKV-JOCHJYFZSA-N 453.882 5.032 5 20 JKBD CCOc1cc(C(=O)Nc2nc(-c3cccc([N+](=O)[O-])c3)c(C)s2)cc(OCC)c1OCC 603997334 VWPQXEUSUUKLGO-UHFFFAOYSA-N 471.535 5.475 5 20 JKBD Cc1cccc(C(C)C)c1NC(=O)Cc1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1 604560034 MYAVIYMACFNOKE-UHFFFAOYSA-N 454.530 6.061 5 20 JKBD C[C@H]1CN(C(=O)c2c3c(nc4ccccc24)/C(=C\c2cccc([N+](=O)[O-])c2)CCC3)CCCO1 608946298 IBXJVNMUUVLDHF-BAOGPQIGSA-N 457.530 5.271 5 20 JKBD COc1ccccc1[C@@H]1CCCN1C(=O)C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1 609036418 FLKYLLUBBJYDOJ-QLWWLHSCSA-N 499.592 6.508 5 20 JKBD O=C(N[C@@H](c1ccccc1)C1CC1)c1ccc(C(=O)N[C@H](c2ccccc2)C2CC2)c([N+](=O)[O-])c1 609043633 FXGOZQVVSASPEU-IZZNHLLZSA-N 469.541 5.357 5 20 JKBD Cc1cc(C(=O)N2CCC[C@@H]2C(=O)Nc2cc(Cl)ccc2SC(C)C)ccc1[N+](=O)[O-] 609218263 CHOBICOHUIFTCM-LJQANCHMSA-N 461.971 5.300 5 20 JKBD CC(=O)N(c1nc(/C=C(\c2ccncc2)c2ccc([N+](=O)[O-])cc2)cs1)c1ccc(F)cc1F 610414018 HUIVSDUPUBBBNP-BKUYFWCQSA-N 478.480 5.998 5 20 JKBD Cc1ccc[n+](/C(C(=S)Nc2ccccc2-c2ccccc2)=C(/O)c2ccc([N+](=O)[O-])cc2)c1 725762539 AJYRBLDQNYSQND-UHFFFAOYSA-O 468.558 6.181 5 20 JKBD COc1ccccc1[C@H](C)CC(=O)Oc1ccc2c(-c3ccc([N+](=O)[O-])cc3)cc(=O)oc2c1 728457963 SWQYLEKUIYDFPN-MRXNPFEDSA-N 459.454 5.476 5 20 JKBD O=C(CSc1nnc(-c2cccs2)n1C1CC1)N(CC1CC1)c1ccc(Cl)c([N+](=O)[O-])c1 728469940 ZBLCJEHGSQRQKE-UHFFFAOYSA-N 490.010 5.438 5 20 JKBD CN(Cc1cc([N+](=O)[O-])ccc1Cl)C(=O)Cc1csc(-c2ccc(Cl)cc2Cl)n1 747151399 OAQJMSMOIJKOLL-UHFFFAOYSA-N 470.765 5.880 5 20 JKBD COc1cccc(-c2nc(COC(=O)c3csc(-c4cccc([N+](=O)[O-])c4)n3)cs2)c1 747960757 BKJWDYGPZLMKAB-UHFFFAOYSA-N 453.501 5.207 5 20 JKBD C/C(=C/C(=O)O[C@@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F)c1ccc(C(F)(F)F)cc1 748392850 PMOVGTNLGYJEEQ-MMRAYRKESA-N 490.356 5.606 5 20 JKBD CC(=O)Nc1ccc(OC(=O)C/C(=C\c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)cc1 909669996 JZVAAKRTQDRZHP-NBVRZTHBSA-N 473.510 5.699 5 20 JKBD CC(=O)c1ccc(C(=O)O[C@@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Br)c2ccccc2)cc1 915564690 HVZGSJIAZQVIJE-OAQYLSRUSA-N 497.301 5.097 5 20 JKBD CCCc1noc2nc(-c3ccco3)cc(C(=O)O[C@@H](C)C(=O)Nc3cc([N+](=O)[O-])ccc3Cl)c12 920680041 KNLYZSAWXDVWRL-LBPRGKRZSA-N 498.879 5.181 5 20 JKBD O=C(Nc1ccccc1SC[C@H]1CC1(Cl)Cl)c1ccn(-c2ccc([N+](=O)[O-])cc2)n1 921281484 SGODYQVVHVSLID-CYBMUJFWSA-N 463.346 5.319 5 20 JKBD C[C@@H]1CN(C(=O)C/C(=C/c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)Cc2ccccc21 922310752 UNGWFYMBXAWEPA-MKYLKIGJSA-N 469.566 6.281 5 20 JKBD C/C=C\c1ccc(OCC(=O)Oc2ccc(NC(=O)c3cc([N+](=O)[O-])ccc3Cl)cc2)c(OC)c1 923387314 JCNAHXOWHXIAQI-ARJAWSKDSA-N 496.903 5.527 5 20 JKBD CC1(C)CCC(CC(=O)NC2(c3ccc(NC(=O)c4ccc([N+](=O)[O-])o4)cc3)CCC2)CC1 1785751071 NZBIXNMMFIXVTG-UHFFFAOYSA-N 453.539 5.542 5 20 JKBD O=C(NC1(c2ccc(NC(=O)c3cccc4cccnc34)cc2)CCC1)c1cc(F)cc([N+](=O)[O-])c1 1788912989 BRSSSWQBSVZUCF-UHFFFAOYSA-N 484.487 5.344 5 20 JKBD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)[nH]n1)c1cccs1 1816345052 CTZHRHDIIWTIDO-INIZCTEOSA-N 481.559 5.214 5 20 JKBD O=C(Nc1cc([C@@H]2CCCCN2C(=O)/C=C/c2ccccc2[N+](=O)[O-])[nH]n1)c1cccc(F)c1Cl 1821122718 KPTKQOAAYJUNCP-SGWGQVFISA-N 497.914 5.130 5 20 JKBD CC(C)[C@H](C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cccc(F)c2[N+](=O)[O-])n[nH]1)c1ccccc1 1821167211 FRCLYXBNQVQWSQ-GGAORHGYSA-N 493.539 5.203 5 20 JKBD O=C(c1cc2sccc2s1)N1CCC([C@@H]2CCCCN2C(=O)Cc2cccc([N+](=O)[O-])c2)CC1 1823679736 QJFYOTNEQNIWMX-FQEVSTJZSA-N 497.642 5.347 5 20 JKBD Cc1cccc(C(=O)N2CCC([C@H]3CCCCN3C(=O)/C=C/c3ccc([N+](=O)[O-])o3)CC2)c1Cl 1824279557 XGYBRFLOXOFIEW-ZQAUEJBPSA-N 485.968 5.096 5 20 JKBD CC[C@H]1CC[C@H](C(=O)N2CCC([C@H]3CCCCN3C(=O)Cc3cc([N+](=O)[O-])ccc3F)CC2)CC1 1824950154 ZKSAUECCNNGEIF-DZRGJMJISA-N 487.616 5.113 5 20 JKBD O=C(c1ccc(C2CC2)cc1)N1CCC([C@H]2CCCCN2C(=O)c2ccc([N+](=O)[O-])cc2F)CC1 1830498727 GUPLWZNYFNYMIL-RUZDIDTESA-N 479.552 5.158 5 20 JKBD C[C@@H](OC(=O)CCc1ncc(-c2ccc(Cl)cc2Cl)o1)C(=O)Nc1ccc([N+](=O)[O-])cc1 12272310 ZPSGGADBXAOMMP-GFCCVEGCSA-N 478.288 5.060 5 20 JKBD CC(=O)Nc1ccc(-c2csc(NC(=O)Cn3c4ccccc4c(=O)c4ccccc43)n2)c(F)c1 14344562 QSYFLHCMDVRLCF-UHFFFAOYSA-N 486.528 5.014 5 20 JKBD O=C(C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)OCc1nc2ccccc2o1 18494277 NJZYOSOXJLXJAR-LGMDPLHJSA-N 471.494 6.020 5 20 JKBD Cc1c(-c2ccccc2)sc(NC(=O)c2ccc([N+](=O)[O-])cc2Cl)c1C(=O)N1CCCCC1 21900937 JABTVUNWGAIQLK-UHFFFAOYSA-N 483.977 6.164 5 20 JKBD O=C(CCCn1c(=O)oc2cc([N+](=O)[O-])ccc21)Nc1ccccc1-c1nc2ccccc2s1 26783472 ZXCPWCDEXOUVSC-UHFFFAOYSA-N 474.498 5.198 5 20 JKBD Cc1cccc([N+](=O)[O-])c1NC(=O)CSc1nn(-c2ccc(Cl)cc2)c(=S)s1 28790489 AOIGNYXUEBACQS-UHFFFAOYSA-N 452.970 5.264 5 20 JKBD COc1cc(C(=O)N2CCc3ccc([N+](=O)[O-])cc32)ccc1OCc1ccc(Br)s1 32147872 HTXCNRLCTLVWAC-UHFFFAOYSA-N 489.347 5.209 5 20 JKBD O=C(C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)NC[C@@H]1Cc2ccccc2O1 33117785 LSLOFVHTOZPCFP-FNGUVFISSA-N 471.538 5.255 5 20 JKBD COc1ccc(/C=C/c2ccnc(-c3cccc([N+](=O)[O-])c3)[n+]2[O-])cc1OCc1ccccc1 71891485 FTIAQGKSKJXJEO-ZRDIBKRKSA-N 455.470 5.048 5 20 JKBD CSc1ccc([N+](=O)[O-])c(C(=O)N[C@@H](C)c2ccc(NC(=O)c3ccc(F)cc3)cc2)c1 71988601 OWAWZMJZPCLMNO-AWEZNQCLSA-N 453.495 5.199 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)N(C)Cc2cn(-c3ccccc3)nc2-c2cccs2)cc1SC 303192648 MKHPBIDIKPUQNI-UHFFFAOYSA-N 494.598 5.512 5 20 JKBD C[C@@H](Nc1ccc(C(=O)Nc2nc(-c3ccccc3F)cs2)cc1[N+](=O)[O-])c1ccccn1 410081535 HBDOIROLHSTNCN-CQSZACIVSA-N 463.494 5.678 5 20 JKBD CN(C(=O)c1ccc(NC(=O)c2ccc(Cl)cc2[N+](=O)[O-])cc1Cl)C1CCCCC1 488644271 KQOKOXWKPABVJO-UHFFFAOYSA-N 450.322 5.559 5 20 JKBD C[C@H](Nc1ccc(C(=O)Nc2ccc(OCc3ccncc3)cc2)cc1[N+](=O)[O-])c1ccccn1 517844463 OJCKBLGHIZCNNL-SFHVURJKSA-N 469.501 5.389 5 20 JKBD COc1ccc(COc2cccc(F)c2)cc1NC(=O)Cn1c2ccccc2c(=O)c2ccccc21 519359541 FAFBJPKXWDBYAG-UHFFFAOYSA-N 482.511 5.520 5 20 JKBD O=C(Nc1cccc(CNCc2ccc(-c3ccc([N+](=O)[O-])cc3Br)o2)c1)C1CCCC1 520945856 VWRUBORIEWHMPC-UHFFFAOYSA-N 498.377 6.036 5 20 JKBD Cc1ccc(Cn2nccc2NC(=O)C/C(=C/c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)o1 524577027 AOAYQPKLIDVEOV-RGEXLXHISA-N 499.552 5.920 5 20 JKBD COC(=O)CC1CCN(C(=O)c2c3c(nc4ccccc24)/C(=C\c2cccc([N+](=O)[O-])c2)CCC3)CC1 553011983 CBUBTBWQUDEMPE-PGMHBOJBSA-N 499.567 5.435 5 20 JKBD CCSc1ccccc1C(=O)Nc1ccc(NS(=O)(=O)c2ccc(C)c([N+](=O)[O-])c2)cc1 591653346 JECIWZBBEQJEEO-UHFFFAOYSA-N 471.560 5.068 5 20 JKBD C[C@@H](N[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Br)c1ccccc1)c1c(F)cccc1F 604047856 NUVREFIEAMTYAN-LRTDBIEQSA-N 490.304 5.666 5 20 JKBD CC(C)(CNC(=O)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-])c1cccc(C(F)(F)F)c1 608901012 SXUFSXHYADFLEL-UHFFFAOYSA-N 464.362 5.262 5 20 JKBD O=C(c1ccc(Cl)s1)N1CCC(C(=O)N(CC2CC2)c2ccc(Cl)c([N+](=O)[O-])c2)CC1 728167220 TVRGQPGQFNKDEX-UHFFFAOYSA-N 482.389 5.259 5 20 JKBD COc1ccc2nc(C)c(C(=O)Oc3ccc(NC(=O)c4cc([N+](=O)[O-])ccc4Cl)cc3)cc2c1 809743378 YXYQFFRLKOJXAE-UHFFFAOYSA-N 491.887 5.585 5 20 JKBD CSCC[C@H](NC(=O)c1ccc(Cl)c([N+](=O)[O-])c1)C(=O)O[C@@H](C)c1ccccc1Cl 847431686 VYEOZJICQJCEAM-SJCJKPOMSA-N 471.362 5.058 5 20 JKBD CC1=C(C(=O)Nc2cc(Cl)ccc2C)[C@H](c2cc([N+](=O)[O-])c(F)cc2F)NC(=O)N1CC1CC1 916726072 QHOBUICNPBXEQW-NRFANRHFSA-N 490.894 5.224 5 20 JKBD O=C(c1cc(-c2nc3ccccc3s2)nc2ccccc12)N1CCc2cc([N+](=O)[O-])ccc21 918559037 RYMMVUWZDIDSAT-UHFFFAOYSA-N 452.495 5.623 5 20 JKBD COc1cc(/C=C\C(=O)Oc2cc(Cl)ccc2[N+](=O)[O-])ccc1OCc1c(C)noc1C 921136464 ILKQVIPOOYGHIV-UITAMQMPSA-N 458.854 5.059 5 20 JKBD O=C(NC1(c2ccc(NC(=O)[C@H]3C[C@@H]3c3ccc(F)c(F)c3)cc2)CCC1)c1ccc([N+](=O)[O-])o1 1786174880 NYMXZKRMEINZDG-MSOLQXFVSA-N 481.455 5.017 5 20 JKBD O=C(/C=C/c1ccc([N+](=O)[O-])o1)Nc1ccc(C2(NC(=O)CCc3ccsc3)CCC2)cc1 1786204374 AEUDVVQZZRWJPK-JXMROGBWSA-N 465.531 5.029 5 20 JKBD CCc1ccc(C(=O)Nc2ccc(C3(NC(=O)Cc4ccc(Cl)cc4[N+](=O)[O-])CCC3)cc2)cn1 1787254535 HKVJTGSMRFTMAK-UHFFFAOYSA-N 492.963 5.196 5 20 JKBD CN(C)c1ccc([N+](=O)[O-])cc1C(=O)NC1(c2ccc(NC(=O)C3(F)CCCCC3)cc2)CCC1 1789161862 OXCDMSAOPXPGCE-UHFFFAOYSA-N 482.556 5.081 5 20 JKBD Cc1ccc(NCCC(=O)Nc2ccc(C3(NC(=O)c4ccc([N+](=O)[O-])o4)CCC3)cc2)c(C)c1 1789565204 OTLNBHDNZHSQNO-UHFFFAOYSA-N 476.533 5.055 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)c3nc[nH]c3[N+](=O)[O-])CCC2)cc1)c1ccccc1Oc1ccccc1 1790229261 SCFDGIKBGQCCAY-UHFFFAOYSA-N 497.511 5.172 5 20 JKBD COc1cc(CC(=O)Nc2ccc(C3(NC(=O)[C@H]4C[C@H]4c4ccccc4)CCC3)cc2)ccc1[N+](=O)[O-] 1790479167 AELHQRULHKVMFD-ZEQRLZLVSA-N 499.567 5.084 5 20 JKBD CCCc1onc(C)c1C(=O)NC1(c2ccc(NC(=O)Cc3ccc(C)c([N+](=O)[O-])c3)cc2)CCC1 1790523955 CFHKNSIAIGRPQM-UHFFFAOYSA-N 490.560 5.143 5 20 JKBD COc1cc(C(=O)Nc2ccc(C3(NC(=O)c4sccc4C)CCC3)cc2)cc([N+](=O)[O-])c1OC 1790813219 UPIKZXLRFXLYKR-UHFFFAOYSA-N 495.557 5.043 5 20 JKBD COc1cc(C(=O)Nc2ccc(C3(NC(=O)C[C@@H]4C[C@@H]5CC[C@H]4C5)CCC3)cc2)ccc1[N+](=O)[O-] 1792165809 NEPZOMVZVBBVEI-HBFSDRIKSA-N 477.561 5.177 5 20 JKBD O=C(c1cc(O)cc([N+](=O)[O-])c1)N1CCC([C@@H]2CCCCN2C(=O)[C@@H]2CCC[C@H]3CCCC[C@H]32)CC1 1828460936 VDAWNHVTCHDFIG-BBXSYUKCSA-N 497.636 5.140 5 20 JKBD Cc1c(Cl)ccc(C(=O)N2CCCC[C@H]2C2CCN(C(=O)c3ccc([N+](=O)[O-])[nH]3)CC2)c1Cl 1832563499 BIQVVRKZIGIURW-IBGZPJMESA-N 493.391 5.085 5 20 JKBD COc1ccc(NC(=O)[C@H](C)OC(=O)c2ccccc2-c2ncc(-c3ccccc3)o2)c([N+](=O)[O-])c1 11506955 PACMEMMJQZWNCL-INIZCTEOSA-N 487.468 5.109 5 20 JKBD CCN(CC(=O)Nc1c(Cl)cccc1Cl)C(=O)c1ccc(Nc2ccccc2)c([N+](=O)[O-])c1 12484252 VMIYGIZUHCAGRF-UHFFFAOYSA-N 487.343 5.746 5 20 JKBD O=C(Cn1c2ccccc2c(=O)c2ccccc21)N(Cc1nnc(-c2ccc(Cl)cc2)o1)C1CC1 14729713 BWQRXZLPKMEERA-UHFFFAOYSA-N 484.943 5.049 5 20 JKBD C[C@H](OC(=O)c1ccc(-c2ccc(F)cc2)o1)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 21499801 HHUOAHBVINKFSF-NSHDSACASA-N 466.343 5.197 5 20 JKBD CSc1ccc(C(=O)c2ccccc2C(=O)OCC(=O)Nc2cccc(Cl)c2C)cc1[N+](=O)[O-] 22882801 JRVUBXJTBNQPEP-UHFFFAOYSA-N 498.944 5.305 5 20 JKBD Cc1sc2nc(S[C@@H](C)C(=O)Nc3cccc([N+](=O)[O-])c3C)n(C3CCCC3)c(=O)c2c1C 24018397 JXDDSLLBJZAOIK-HNNXBMFYSA-N 486.619 5.526 5 20 JKBD Cc1nc2ccccc2c2c(NC(=O)c3nc(N4CCCC4)ncc3Cl)c3ccccc3n12 107838361 AWYRFMAORVNGSW-UHFFFAOYSA-N 456.937 5.245 5 20 JKBD CC(C)Oc1ccc(F)cc1NC(=O)Cc1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1 303194291 XNORPSQJKXNEMM-UHFFFAOYSA-N 474.492 5.555 5 20 JKBD O=C(C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)Nc1nnc(C(F)F)s1 409457444 SHFFRUTUELNPMC-XFXZXTDPSA-N 473.486 5.563 5 20 JKBD CCOC(=O)c1c(NC(=O)c2cc(SC)c(OC)cc2[N+](=O)[O-])sc(-c2ccccc2)c1C 482319639 SSCXORGOTSJLFK-UHFFFAOYSA-N 486.571 5.791 5 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BJSMRPOKLMGWHG-LJQANCHMSA-N 478.545 5.598 5 20 JKBD NC(=O)Nc1cccc(NC(=O)c2ccc(Sc3nc4ccccc4s3)c([N+](=O)[O-])c2)c1 514692888 IBRKXUTXIUUFFJ-UHFFFAOYSA-N 465.516 5.099 5 20 JKBD Cc1nn(-c2ccccc2)c(C)c1NC(=O)Cc1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1 514858501 GVCIOGXWBWTWSF-UHFFFAOYSA-N 492.539 5.431 5 20 JKBD O=C(Nc1ccc(-c2nc3ccccc3o2)cc1)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-] 515286685 YLJHOJKXCBIHTF-UHFFFAOYSA-N 457.364 5.596 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Br)[C@H](NCCc1c(F)cccc1F)c1ccccc1 515717547 OADIXNSQKVIQAN-OAQYLSRUSA-N 490.304 5.148 5 20 JKBD C[C@H]1CCCN(c2ccc(C(=O)Nc3ccccc3NC(=O)c3ccccc3)cc2[N+](=O)[O-])C1 515905135 SZILVVUNHSDZMA-SFHVURJKSA-N 458.518 5.336 5 20 JKBD Cc1ncc2c(n1)CCN(C(=O)c1ccccc1Sc1ccc(C(F)(F)F)cc1[N+](=O)[O-])C2 516100002 SWWQIAKKOHCTGU-UHFFFAOYSA-N 474.464 5.062 5 20 JKBD COc1cc([C@@H](C)Nc2cnn(-c3ccc([N+](=O)[O-])cc3)c(=O)c2Cl)ccc1OCC(C)C 522625812 BXGCSFPKQXGGAW-OAHLLOKOSA-N 472.929 5.011 5 20 JKBD Cn1c(-c2ccc(NC(=O)C3CCN(c4ccccc4[N+](=O)[O-])CC3)cc2)nc2ccccc21 524292912 VAEZGFZRNINRKV-UHFFFAOYSA-N 455.518 5.004 5 20 JKBD CSc1ccc(NC(=O)c2ccc(C(=O)Nc3ccc(SC)cc3)c([N+](=O)[O-])c2)cc1 560004631 VODZXKCIOZORJD-UHFFFAOYSA-N 453.545 5.543 5 20 JKBD CCOC(=O)C1CCN(C(=O)c2c3c(nc4ccccc24)/C(=C\c2ccc([N+](=O)[O-])cc2)CCC3)CC1 590781030 CQNWBVPXWSHZQE-UZYVYHOESA-N 499.567 5.435 5 20 JKBD COC(=O)c1ccccc1C(=O)c1ccc(N2CCC(C(=O)c3ccc(C)cc3)CC2)c([N+](=O)[O-])c1 603932165 SCMFOLDRJIWQFL-UHFFFAOYSA-N 486.524 5.020 5 20 JKBD COc1cc(OCC(=O)N(Cc2ccsc2)c2ccc(Br)cc2)ccc1[N+](=O)[O-] 604457158 GBOOQDNJJCSLBD-UHFFFAOYSA-N 477.336 5.040 5 20 JKBD CCOCCOc1ccc(Cl)cc1NC(=O)c1cc([N+](=O)[O-])ccc1N1CCC(C)CC1 728181921 KHSHKSJSQGGDIB-UHFFFAOYSA-N 461.946 5.152 5 20 JKBD COc1ccc([C@H](NC(=O)c2cc(Cl)ccc2[N+](=O)[O-])c2ccccc2)cc1Br 728497563 BQOGWPBFMBOUIG-HXUWFJFHSA-N 475.726 5.539 5 20 JKBD Cc1c(NC(=O)[C@H](C)OC(=O)CCc2nc3cc(C(F)(F)F)ccc3s2)cccc1[N+](=O)[O-] 730607734 BAFPAQCEMPLRHC-LBPRGKRZSA-N 481.452 5.035 5 20 JKBD CCc1ccccc1O[C@@H](C(=O)OCc1nnc(-c2ccc([N+](=O)[O-])cc2)o1)c1ccccc1 730624277 FKTRFSCPMIWINN-HSZRJFAPSA-N 459.458 5.071 5 20 JKBD O=C(Nc1ccc(OCc2ccccn2)c(Cl)c1)c1cc([N+](=O)[O-])ccc1Br 751113277 HVEVAONJDIOFFP-UHFFFAOYSA-N 462.687 5.237 5 20 JKBD CCc1cccc(CC)c1NC(=O)[C@@H](C)OC(=O)c1ccc(N2CCC(C)CC2)c([N+](=O)[O-])c1 826130038 DAICSCXOLGHUQV-GOSISDBHSA-N 467.566 5.140 5 20 JKBD O=C(Nc1cc([N+](=O)[O-])c(F)cc1F)c1cccnc1Oc1ccc(Br)cc1 915284108 JQQNOKIMEMMQGQ-UHFFFAOYSA-N 450.195 5.075 5 20 JKBD C[C@@H](NC(=O)C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)c1cccc([N+](=O)[O-])c1 917700456 HULVEULKONPYBP-YZYPPFLQSA-N 488.525 5.921 5 20 JKBD COCCOc1cc([N+](=O)[O-])c(C(=O)Nc2cccc(-c3ccc(Cl)c(Cl)c3)c2)cc1OC 917816400 GFHYURMBQPIKGC-UHFFFAOYSA-N 491.327 5.855 5 20 JKBD CC1=C(C(=O)Nc2cccc(C)c2C)[C@H](c2ccc(Cl)c([N+](=O)[O-])c2)NC(=O)N1CC1CC1 918075471 SNBVGFVQWWLUMK-QFIPXVFZSA-N 468.941 5.254 5 20 JKBD CC(=O)N[C@H](CC(=O)Oc1ccc(-c2ccccc2)cc1[N+](=O)[O-])c1ccc(Br)cc1 920330739 MUTLMPSFBLBBHL-HXUWFJFHSA-N 483.318 5.197 5 20 JKBD CC(=O)N(c1ccc(C(F)(F)F)cc1)c1nc(COC(=O)/C=C/c2ccc([N+](=O)[O-])cc2)cs1 920497978 QOJIXQSFLVYVHD-NYYWCZLTSA-N 491.447 5.511 5 20 JKBD Cc1nn(Cc2ccc(C(=O)N3CCC[C@@H]3Cc3ccc(Br)cc3)cc2)c(C)c1[N+](=O)[O-] 920810688 ZZUFPYYEWNFFOR-JOCHJYFZSA-N 497.393 5.066 5 20 JKBD O=C(C[C@@H]1CCCCO1)Nc1ccc(C2(NC(=O)c3cc4cc([N+](=O)[O-])ccc4s3)CCC2)cc1 1786647857 GITOFBJAVCEKEA-NRFANRHFSA-N 493.585 5.516 5 20 JKBD O=C(/C=C\c1c[nH]c2ccccc12)Nc1ccc(C2(NC(=O)/C=C/c3ccc([N+](=O)[O-])o3)CCC2)cc1 1786777950 JUOBFJGVOYKJOL-NUARCNNVSA-N 496.523 5.530 5 20 JKBD CC(=O)Nc1cccc(C(=O)Nc2ccc(C3(NC(=O)/C=C/c4ccccc4[N+](=O)[O-])CCC3)cc2)c1 1792140214 OELXAXBAJLSUNA-XNTDXEJSSA-N 498.539 5.014 5 20 JKBD O=C(Cc1ccc(Cl)cc1[N+](=O)[O-])N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H]1CCC[C@H]2CCCC[C@@H]21 1797869605 MYTRCMBBQRYNOZ-QFHQZCAOSA-N 488.028 5.035 5 20 JKBD CC1(C)CCC(CC(=O)N2CCCC[C@@H]2c2cc(NC(=O)Cc3cccc([N+](=O)[O-])c3)n[nH]2)CC1 1814376174 UPVZDMGZTUHZBL-JOCHJYFZSA-N 481.597 5.159 5 20 JKBD CC(C)[C@H](C(=O)Nc1cc([C@H]2CCCCN2C(=O)/C=C/c2ccc([N+](=O)[O-])o2)[nH]n1)c1ccccc1 1814928138 BRZJAUZESZCRSH-RODRTBBPSA-N 491.548 5.056 5 20 JKBD Cc1ccc(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)CSc3ccccc3[N+](=O)[O-])[nH]n2)cc1C 1820539649 KXKMHHVXMKWDDV-FQEVSTJZSA-N 493.589 5.033 5 20 JKBD O=C(CCC1CCC1)N1CCCC[C@@H]1C1CCN(C(=O)C2(c3cccc([N+](=O)[O-])c3)CCC2)CC1 1824352476 DTXSPEJOYKJFLG-RUZDIDTESA-N 481.637 5.217 5 20 JKBD O=C(c1ccc([N+](=O)[O-])cc1F)N1CCC([C@H]2CCCCN2C(=O)c2cc3ccoc3s2)CC1 1827412931 AKLVEOUYTKRHAA-HXUWFJFHSA-N 485.537 5.089 5 20 JKBD O=C(/C=C/c1ccccc1[N+](=O)[O-])N1CCC([C@@H]2CCCCN2C(=O)c2cc3[nH]ccc3s2)CC1 1828336573 HACFSQFLCHISID-SHBDEGQCSA-N 492.601 5.084 5 20 JKBD CCOC(=O)Nc1ccc(C(=O)O[C@@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2ccccc2)cc1 10702084 IZJYPIIVDDGTKF-OAQYLSRUSA-N 497.891 5.353 5 20 JKBD CC(C)OCc1c(C(=O)OCC(=O)Nc2ccc(C(F)(F)F)cc2[N+](=O)[O-])oc2ccccc12 11242829 MXAJATFWLSJSNN-UHFFFAOYSA-N 480.395 5.080 5 20 JKBD Cc1ccc(Sc2ccc(C(=O)N(C)CC(=O)Nc3c(C)cc(C)cc3C)cc2[N+](=O)[O-])cc1 17961849 AKJMAMAMWPWHGL-UHFFFAOYSA-N 477.586 5.690 5 20 JKBD O=C(CCCc1cccs1)O[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1 22036425 RRCHQRRMHNXXTJ-OAQYLSRUSA-N 458.923 5.556 5 20 JKBD Cc1c(NC(=O)[C@@H](C)Sc2nnc(-c3ccc(F)cc3)n2-c2ccccc2)cccc1[N+](=O)[O-] 23510387 RRZTXBDGVAUGIJ-MRXNPFEDSA-N 477.521 5.409 5 20 JKBD CC(C)CCSc1ccc(C(=O)N2CCC(c3nc4ccccc4[nH]3)CC2)cc1[N+](=O)[O-] 25835287 UYOGLBWXCSMRSO-UHFFFAOYSA-N 452.580 5.629 5 20 JKBD CCn1c(S[C@@H](C)C(=O)Nc2ccc(C)cc2Cl)nc2cc3ccccc3cc2c1=O 26581054 YSZSBFKHTNKZQJ-HNNXBMFYSA-N 451.979 5.651 5 20 JKBD Cc1noc(CSc2ccccc2C(=O)Nc2nc(-c3ccc(C)c([N+](=O)[O-])c3)cs2)n1 69531500 DXUGLIAXUXAQQX-UHFFFAOYSA-N 467.532 5.263 5 20 JKBD Cc1ccc(-c2noc([C@H](C)N3CCN(C(=O)c4cc5ccccc5c5cccnc45)CC3)n2)cc1 108089122 LYPCWAWCIGQFCR-FQEVSTJZSA-N 477.568 5.265 5 20 JKBD C[C@H](Nc1ccc(C(=O)Nc2ccc(OCc3ccccc3)cc2)cc1[N+](=O)[O-])c1ccccn1 115700037 IHZZVFYKCNAGKB-IBGZPJMESA-N 468.513 5.994 5 20 JKBD Cc1ccc2c(c1C)OC[C@@H]2N[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Br)c1ccccc1 477036341 UHGOJOOXHVAVMD-FCHUYYIVSA-N 496.361 5.377 5 20 JKBD Cc1ccc(Sc2ccc(C(=O)Nc3ccccc3NC(=O)N3CCCC3)cc2[N+](=O)[O-])cc1 485122271 NXDYBTBIUQHBEJ-UHFFFAOYSA-N 476.558 5.934 5 20 JKBD C[C@@H]1Cc2cc([N+](=O)[O-])ccc2N1C(=O)Cc1ccc(NC(=O)c2cc3ccccc3o2)cc1 504376570 NENYQIORGUVBMD-MRXNPFEDSA-N 455.470 5.114 5 20 JKBD CCc1cc(Sc2nnc(-c3ccccc3Cl)n2C)nc(-c2ccc([N+](=O)[O-])cc2)n1 507132136 PDOJUECXBIVNOJ-UHFFFAOYSA-N 452.927 5.214 5 20 JKBD O=C(Nc1cc(-c2nnc3n2CCCCC3)ccc1Cl)C1CCN(c2ccccc2[N+](=O)[O-])CC1 514524517 YDFDKBQRXOHHMN-UHFFFAOYSA-N 494.983 5.088 5 20 JKBD COc1ccc(NC(=O)c2c[nH]c3ccc([N+](=O)[O-])cc23)cc1OCc1ccc2ccccc2n1 524127926 SUOMXZXBXRINPV-UHFFFAOYSA-N 468.469 5.464 5 20 JKBD CCC(=O)Nc1cccc(CNC(=O)c2ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])cc2)c1 603813111 QKNJQKBETHBSQG-UHFFFAOYSA-N 453.882 5.319 5 20 JKBD CC(C)(C)Oc1ccc(CN[C@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2ccccc2)cc1 604435247 LWYHBEAZHBUHRO-QHCPKHFHSA-N 467.953 5.895 5 20 JKBD O=C(c1cc2cc([N+](=O)[O-])ccc2s1)N1CCC[C@@H](c2nc(-c3ccc(Cl)cc3)no2)C1 608818044 VCTIVOZJICUKIM-CQSZACIVSA-N 468.922 5.533 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)N[C@@H](c2ccc(C(C)(C)C)cc2)C(F)(F)F)cc1SC 609126682 DIRCJUXEBPQLNL-SFHVURJKSA-N 456.486 5.656 5 20 JKBD COc1ccc(NC(=S)/C(=C(/O)c2cccc([N+](=O)[O-])c2)[n+]2ccc3c(c2)CCCC3)cc1Cl 726962824 VPKSJIDSTTWDLK-UHFFFAOYSA-O 496.996 5.746 5 20 JKBD C[C@]1(c2cccc(NC(=O)CCC(=O)c3ccc4ccc5cccc6ccc3c4c56)c2)NC(=O)NC1=O 727755634 FVFRBCBJJHUVRS-SSEXGKCCSA-N 489.531 5.240 5 20 JKBD C[C@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccc(NC(=O)OC(C)(C)C)cc1C(F)(F)F 729655563 ROJQHQNZZHKHBY-LBPRGKRZSA-N 485.484 6.080 5 20 JKBD CC(C)(C)OC(=O)Nc1ccc(NC(=O)CCNc2ccccc2[N+](=O)[O-])c(C(F)(F)F)c1 729656068 YHISUEULBFTYOB-UHFFFAOYSA-N 468.432 5.401 5 20 JKBD Cc1c([N+](=O)[O-])cc(C(=O)N(C)CCCCCc2cc(-c3cccc(F)c3)no2)cc1[N+](=O)[O-] 745823095 QENNKGSAASGZCY-UHFFFAOYSA-N 470.457 5.091 5 20 JKBD Cc1ccc(Sc2ccc(C(=O)N3CCC(CNC(=O)OC(C)(C)C)CC3)cc2[N+](=O)[O-])cc1 748766054 LEGXJHQHWHVCQS-UHFFFAOYSA-N 485.606 5.431 5 20 JKBD C[C@H](OC(=O)c1cc([N+](=O)[O-])ccc1N1CCCC1)C(=O)Nc1c(Cl)cc(Cl)cc1Cl 846285516 VBLORQVAYAEDBZ-NSHDSACASA-N 486.739 5.339 5 20 JKBD O=C(Nc1cc(Br)ccc1Br)c1cc([N+](=O)[O-])ccc1N1CCCCC1 914731586 DQFFJZZXHRJJHA-UHFFFAOYSA-N 483.160 5.362 5 20 JKBD Cc1ccc(-c2nnc(COC(=O)c3ccccc3NC(=O)c3ccc([N+](=O)[O-])cc3Cl)o2)cc1 914894988 YVTKEPDYNQBCGM-UHFFFAOYSA-N 492.875 5.216 5 20 JKBD O=c1nc(/C(Cl)=C\c2ccc(Oc3ccccc3Cl)c([N+](=O)[O-])c2)[nH]c2ccccc12 916139900 AOAMKKZWQXEOHG-LFIBNONCSA-N 454.269 6.014 5 20 JKBD Cc1ccc(C(=O)C2CCN(C(=O)c3cc([N+](=O)[O-])ccc3N3CCC(C)CC3)CC2)c(C)c1 917103018 ASDXWONCQYKEKD-UHFFFAOYSA-N 463.578 5.183 5 20 JKBD CCCC(=O)Nc1c(Cl)cc(Cl)cc1C(=O)OCC(=O)Nc1cc(Cl)ccc1[N+](=O)[O-] 919559044 XUAQPRHRHSVRHA-UHFFFAOYSA-N 488.711 5.089 5 20 JKBD O=C(NC1(c2ccc(NC(=O)[C@@H]3C[C@@H]3C3CC3)cc2)CCC1)c1ccc(Br)c([N+](=O)[O-])c1 1786057680 XDFOGSXORJICEP-RTBURBONSA-N 498.377 5.151 5 20 JKBD Cc1cc(O)c([N+](=O)[O-])cc1C(=O)Nc1ccc(C2(NC(=O)[C@]3(F)CCCC=C3F)CCC2)cc1 1790808133 TUOLBLZHNRJXHI-VWLOTQADSA-N 485.487 5.102 5 20 JKBD CCc1nc(C(=O)NC2(c3ccc(NC(=O)c4cc5cc([N+](=O)[O-])ccc5s4)cc3)CCC2)co1 1791010738 UAKPMQCXSWAJRM-UHFFFAOYSA-N 490.541 5.421 5 20 JKBD CC(C)(C)CCCCCC(=O)NC[C@H]1CCN(C(=O)c2cc(O)cc([N+](=O)[O-])c2)[C@@H]1c1cccnc1 1812808791 JATGNCRLLFBOCV-CJFMBICVSA-N 496.608 5.012 5 20 JKBD O=C(c1ccc(C2CC2)cc1)N1CCC([C@H]2CCCCN2C(=O)Cc2cc([N+](=O)[O-])ccc2F)CC1 1824948224 CILVZFWTRYLOIW-AREMUKBSSA-N 493.579 5.087 5 20 JKBD O=C(c1ccc([N+](=O)[O-])cc1F)N1CCCC[C@H]1C1CCN(C(=O)C2(c3ccccc3)CCC2)CC1 1830498476 WOTOXQKBQYLVHZ-VWLOTQADSA-N 493.579 5.089 5 20 JKBD CC1(C)CCC(CC(=O)N2CCC([C@@H]3CCCCN3C(=O)c3cccc(F)c3[N+](=O)[O-])CC2)CC1 1830621274 KZINSKMOMWUHMJ-QHCPKHFHSA-N 487.616 5.574 5 20 JKBD CC[C@H]1CC[C@H](C(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3ccc([N+](=O)[O-])c(OC)c3)CC2)CC1 1831696098 YDBSMOABSUZCLF-KJXAQDMKSA-N 485.625 5.053 5 20 JKBD CCCn1c(SCC(=O)Nc2ccc([N+](=O)[O-])cc2C(F)(F)F)nnc1-c1ccc(Cl)cc1 9139763 RXVTWSLQNBVXSS-UHFFFAOYSA-N 499.902 5.666 5 20 JKBD COc1ccc(C(=O)OCc2csc(N(C(C)=O)c3c(C)cc(C)cc3C)n2)cc1[N+](=O)[O-] 11341900 IDWUOBOCOJVUQJ-UHFFFAOYSA-N 469.519 5.027 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Cl)[C@@H](NCc1coc(-c2cccs2)n1)c1ccccc1 11723076 JMVDHTCJEYJURZ-FQEVSTJZSA-N 468.922 5.434 5 20 JKBD Cc1cccc(OCc2nnc(S[C@@H](C(=O)Nc3ccc(C)cc3[N+](=O)[O-])c3ccccc3)o2)c1 12673543 KKQANHDKSNEHKR-HSZRJFAPSA-N 490.541 5.646 5 20 JKBD Cc1cccc(C(=O)Nc2nnc(SCc3c(Cl)cccc3Cl)s2)c1[N+](=O)[O-] 14582140 DMCCVMRINBZFGV-UHFFFAOYSA-N 455.348 5.606 5 20 JKBD C[C@H](OC(=O)c1ccccc1SCc1ccco1)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 16155907 WDDMIVFJOOHMFO-AWEZNQCLSA-N 451.460 5.448 5 20 JKBD Cc1ccc([N+](=O)[O-])cc1NC(=O)CSc1nnc(SCc2ccc(C(C)C)cc2)s1 21377753 YBMBUDXDMJJORB-UHFFFAOYSA-N 474.633 5.901 5 20 JKBD COc1cccc(NCc2nnc(SCc3cc([N+](=O)[O-])ccc3OC)n2C2CCCCC2)c1 22719429 ZQJFVFFBULBWCT-UHFFFAOYSA-N 483.594 5.613 5 20 JKBD CCOCCCn1c(=O)c2ccccc2n2c(SCc3nc4ccccc4c4ccccc34)nnc12 26048415 XXDATTMGCYXLQW-UHFFFAOYSA-N 495.608 5.465 5 20 JKBD Cc1csc(CNC(=O)c2ccccc2Sc2ccc(C(F)(F)F)cc2[N+](=O)[O-])n1 29885887 ASCYNQPHRWIUFH-UHFFFAOYSA-N 453.467 5.460 5 20 JKBD Cc1c(C(=O)N2CC[C@@H](C)Sc3ccc(C(F)(F)F)cc32)cc([N+](=O)[O-])cc1[N+](=O)[O-] 71972948 JALAREYGFGXQFK-SNVBAGLBSA-N 455.414 5.361 5 20 JKBD O=C(Nc1ccccc1C(=O)NCc1cccc(Br)c1)c1ccc([N+](=O)[O-])cc1Cl 105924214 FRFLFHIPAFQNJD-UHFFFAOYSA-N 488.725 5.193 5 20 JKBD C[C@@H](Nc1ccc(C(=O)N[C@H]2CCc3c(Br)cccc32)cc1[N+](=O)[O-])c1ccccn1 303190619 MNUVQSMITAQXDT-VLIAUNLRSA-N 481.350 5.343 5 20 JKBD COc1cc(C(=O)N[C@H](c2ccccc2)c2cccnc2)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 485508492 FAOYNPDZQQMHDU-RUZDIDTESA-N 489.915 5.964 5 20 JKBD O=C(Nc1cccc(N[C@@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2ccccc2)c1)C1CC1 493552805 LRJGUUKUSKDXPE-JOCHJYFZSA-N 464.909 5.389 5 20 JKBD CN(CCCc1cc(-c2ccccc2)n(C)n1)C(=O)c1ccc(NCc2ccccc2)c([N+](=O)[O-])c1 499181492 WTWMLFDJTBLJSF-UHFFFAOYSA-N 483.572 5.312 5 20 JKBD CNC(=O)c1ccc(Cl)c(NC(=O)c2ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])cc2)c1 500262006 ORFFSSWGYQNKML-UHFFFAOYSA-N 460.273 5.306 5 20 JKBD Cn1c([C@@H](NC(=O)c2csc(-c3ccc([N+](=O)[O-])cc3)n2)c2ccccc2)nc2ccccc21 503147636 QMLLZCCNBBMOCO-QFIPXVFZSA-N 469.526 5.124 5 20 JKBD COc1ccc(Br)cc1[C@H]1CCCN1C(=O)Nc1ccc([N+](=O)[O-])cc1Cl 510584709 OYOFYOKRNIERSX-MRXNPFEDSA-N 454.708 5.388 5 20 JKBD COc1cc2c(cc1OC)CN(Cc1ccccc1NC(=O)c1cc(SC)ccc1[N+](=O)[O-])CC2 520021931 ISDVOZSNRFWBRJ-UHFFFAOYSA-N 493.585 5.145 5 20 JKBD COc1cc2c(cc1OC)[C@H](c1ccccc1)N(C(=O)[C@@H](C)Oc1ccc(Cl)cc1[N+](=O)[O-])CC2 520436405 UZFSTNWWSKNNDS-CPJLOUKISA-N 496.947 5.207 5 20 JKBD O=[N+]([O-])c1ccc(-c2nnc(COc3ccc(-c4nc5ccccc5s4)cc3Cl)o2)cc1 559260179 SWNANFNWHVVETF-UHFFFAOYSA-N 464.890 6.154 5 20 JKBD CN(C)Cc1cccc(CNC(=O)C/C(=C\c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)c1 603575735 UHXOVAPAWATJMO-PXLXIMEGSA-N 486.597 5.513 5 20 JKBD C[C@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)NC1C[C@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1 604442929 WOMYPHWPYXVWSU-IVZWLZJFSA-N 462.774 5.041 5 20 JKBD CC[C@H](C)Sc1ccc(NC(=O)[C@@H]2CCCN2C(=O)c2ccc([N+](=O)[O-])c(C)c2)c(C)c1 608806140 OBHOPPGUGOQCRS-JTSKRJEESA-N 455.580 5.346 5 20 JKBD COc1ccc(NC(=O)CSc2ccc(C(F)(F)F)cc2[N+](=O)[O-])c(Br)c1 608900083 IMHCFJQNENGJNN-UHFFFAOYSA-N 465.247 5.116 5 20 JKBD Cc1csc(Sc2ccc(C(=O)N3C[C@@H](c4ccccc4)OC[C@@H]3C)cc2[N+](=O)[O-])n1 608966180 GTRCWVVBCYBYIA-KXBFYZLASA-N 455.561 5.113 5 20 JKBD Cc1sc(NC(=O)c2ccc(CNC(=O)C3CCCC3)cc2)nc1-c1cccc([N+](=O)[O-])c1 609031308 DQAODBFYBSODHX-UHFFFAOYSA-N 464.547 5.085 5 20 JKBD O=C(Cc1csc(Cc2ccc(F)cc2)n1)N(CC1CC1)c1ccc(Cl)c([N+](=O)[O-])c1 728166931 QVNGJMUMEZEZLG-UHFFFAOYSA-N 459.930 5.420 5 20 JKBD Cc1ccc2nc(-c3cccnc3)cc(C(=O)O[C@@H](C)C(=O)Nc3cccc([N+](=O)[O-])c3C)c2c1 730441618 IYAQURNCHPSFEB-KRWDZBQOSA-N 470.485 5.006 5 20 JKBD CC(=O)Nc1cccc([C@H](C)N(Cc2ccccc2)C(=O)c2ccc(Br)c([N+](=O)[O-])c2)c1 841838363 ACQFKTZNFIGJJJ-INIZCTEOSA-N 496.361 5.719 5 20 JKBD C[C@H](Oc1ccc(Cl)cc1[N+](=O)[O-])c1nc(-c2cccc(NC(=O)OC(C)(C)C)c2)no1 904632576 VILFFWBSYSINSH-LBPRGKRZSA-N 460.874 5.785 5 20 JKBD CCOc1cc(C(=O)Nc2ccccc2SC[C@@H]2CC2(Cl)Cl)c([N+](=O)[O-])cc1OC 917751339 JSAVHANQUSIGIB-LBPRGKRZSA-N 471.362 5.540 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)c3cccc(F)c3[N+](=O)[O-])CCC2)cc1)c1ccc2cc[nH]c2c1 1788913881 NNTJLMOXTRDFRO-UHFFFAOYSA-N 472.476 5.277 5 20 JKBD O=C(NC1(c2ccc(NC(=O)c3cccc4ccoc34)cc2)CCC1)c1cc(O)cc([N+](=O)[O-])c1 1790956353 CHTRORJZSOGFNF-UHFFFAOYSA-N 471.469 5.108 5 20 JKBD Cc1c(C(=O)N2CCC3(CCCN(C(=O)CCCC(F)(F)F)C3)CC2)cc(Cl)cc1[N+](=O)[O-] 1806541617 CIUHQELQHVKHSX-UHFFFAOYSA-N 489.922 5.134 5 20 JKBD O=C(Cc1cc([N+](=O)[O-])ccc1F)N1CCCC2(CCN(C(=O)[C@@H]3CCC[C@@H]4CCCC[C@@H]43)CC2)C1 1806655542 GNXWCJZJOCCMQW-NKKJXINNSA-N 499.627 5.114 5 20 JKBD CC(C)(C)CCCCCC(=O)N1CC[C@H](CNC(=O)c2cc(F)cc([N+](=O)[O-])c2)[C@@H]1c1cccnc1 1811306934 JDEZEEOKYWTOED-NLFFAJNJSA-N 498.599 5.445 5 20 JKBD Cc1c(C(=O)Nc2cc([C@H]3CCCCN3C(=O)C(C)(C)C(C)(F)F)[nH]n2)cc(Cl)cc1[N+](=O)[O-] 1821289740 JKCQAERWFWYRLR-MRXNPFEDSA-N 497.930 5.267 5 20 JKBD O=C(N[C@H]1CCc2nc(NC(=O)C3CC4(CCC4)C3)sc2C1)c1cc2cc([N+](=O)[O-])ccc2s1 1827373465 RGDNAGYUBMOJPU-HNNXBMFYSA-N 496.614 5.072 5 20 JKBD O=C(c1cc(F)cc([N+](=O)[O-])c1)N1CCC([C@@H]2CCCCN2C(=O)c2c(F)cccc2Cl)CC1 1829899488 PBSRCYMZTJXAIP-NRFANRHFSA-N 491.922 5.074 5 20 JKBD CC1=CC[C@@H](C(=O)N2CCC([C@@H]3CCCCN3C(=O)c3c(F)ccc([N+](=O)[O-])c3C)CC2)CC1 1830733999 TXCDNRGKCZUSRG-OFNKIYASSA-N 471.573 5.022 5 20 JKBD Cc1c(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3sccc3F)CC2)cc(Cl)cc1[N+](=O)[O-] 1830734727 PVIXMCWKOWSSKC-LJQANCHMSA-N 493.988 5.304 5 20 JKBD C[C@H]1CC[C@H](C(=O)N2CCCC[C@H]2C2CCN(C(=O)Cc3ccc(Cl)cc3[N+](=O)[O-])CC2)CC1 1832368140 XSBYIKKAWJBKGL-LEDOBFOHSA-N 490.044 5.237 5 20 JKBD Cc1ccc(C(=O)CCC(=O)O[C@@H](C(=O)Nc2ccc(C)cc2[N+](=O)[O-])c2ccccc2)cc1 8929513 OEYGZSILNBGKMY-RUZDIDTESA-N 460.486 5.098 5 20 JKBD CCc1ccccc1N(C(C)=O)c1nc(COC(=O)c2ccc(Cl)cc2[N+](=O)[O-])cs1 10748643 URMNYDCGAKVNEL-UHFFFAOYSA-N 459.911 5.309 5 20 JKBD Cc1ccc(N2C(=O)/C(=C\c3ccc4c(c3)OCO4)N=C2S/C=C/c2ccc([N+](=O)[O-])o2)cc1 14112249 CASIEQPJIOCHID-OFAWCBBISA-N 475.482 5.373 5 20 JKBD C[C@@H](c1nc2ccccc2s1)N(C)C(=O)CSc1ccc(C(F)(F)F)cc1[N+](=O)[O-] 15094348 RHBKNTSCTBOBAR-NSHDSACASA-N 455.483 5.535 5 20 JKBD O=[N+]([O-])c1cccc(CN(Cc2ccco2)S(=O)(=O)c2cc(C(F)(F)F)ccc2Cl)c1 22350691 KGXMFCVJYCCFKI-UHFFFAOYSA-N 474.844 5.251 5 20 JKBD CC(C)NC(=O)Nc1ccccc1NC(=O)Cc1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1 72010715 NZZSMRQQAWCELJ-UHFFFAOYSA-N 498.543 5.159 5 20 JKBD Cn1cnnc1Sc1ccc(C(=O)N2CCC[C@@H]2c2cccc3ccccc23)cc1[N+](=O)[O-] 72024316 KYSGCSZVUIJFNA-HXUWFJFHSA-N 459.531 5.005 5 20 JKBD COc1ccc(CSCC(=O)N[C@H](c2ccc(Cl)cc2)c2cccs2)cc1[N+](=O)[O-] 107959324 ASYARSZELMSPGS-OAQYLSRUSA-N 462.980 5.457 5 20 JKBD COc1cc([C@@H](C)NC(=O)c2cc(SC)c(OC)cc2[N+](=O)[O-])ccc1OCc1ccccc1 483464483 LSOYUAMFFFNMKZ-MRXNPFEDSA-N 482.558 5.404 5 20 JKBD CS(=O)(=O)c1ccc(F)c(NC(=O)c2cc([N+](=O)[O-])ccc2Sc2ccc(Cl)cc2)c1 490912267 PCTDQJHGOVWIEB-UHFFFAOYSA-N 480.926 5.194 5 20 JKBD CC[C@@H](C)Sc1ccc(NC(=O)c2ccc([N+](=O)[O-])cc2I)c(C)c1 504648451 XZAUFXTZZUTNKX-GFCCVEGCSA-N 470.332 5.651 5 20 JKBD C[C@H](Nc1ccc(C(=O)Nc2cc(Cl)ccc2N2CCCCC2)cc1[N+](=O)[O-])c1ccccn1 506017025 MVHPZQHHAWOUAZ-KRWDZBQOSA-N 479.968 6.059 5 20 JKBD C[C@@H](Nc1ccc(C(=O)N2CCc3sccc3[C@H]2c2cccs2)cc1[N+](=O)[O-])c1ccccn1 506054868 DLTRKQMNJXCSTK-GYCJOSAFSA-N 490.610 6.074 5 20 JKBD O=C(Cn1cnc([N+](=O)[O-])n1)N(Cc1ccccc1)c1nc(-c2ccc(-c3ccccc3)cc2)cs1 506236475 QLGVRADCJGUZRR-UHFFFAOYSA-N 496.552 5.210 5 20 JKBD COc1ccc(N(C(=O)C2CCN(c3ccc(C(F)(F)F)cc3[N+](=O)[O-])CC2)C(C)C)cc1F 509825211 JLLJWJQBRLGMHZ-UHFFFAOYSA-N 483.462 5.419 5 20 JKBD Cc1cccc(-n2c(SCc3nnc(-c4ccc([N+](=O)[O-])cc4)o3)nnc2-c2ccccc2)c1 510432039 XBAIIMJBTGUFRT-UHFFFAOYSA-N 470.514 5.493 5 20 JKBD O=C(Nc1cccc(-c2cnco2)c1)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 511354626 FDUUWQVMEQKHDD-UHFFFAOYSA-N 460.412 5.124 5 20 JKBD CC[C@H](C)Oc1cccc(NC(=O)c2cc(OC)c(OCc3cscn3)cc2[N+](=O)[O-])c1 512123173 NLMCMBIEQCJGCR-AWEZNQCLSA-N 457.508 5.069 5 20 JKBD CCOc1cc(NC(=O)Cc2c(C)[nH]c3ccc(Br)cc23)c([N+](=O)[O-])cc1OCC 512234340 PCZMWBSNVHBGTF-UHFFFAOYSA-N 476.327 5.126 5 20 JKBD Cc1ccc(-n2c(S[C@H](C)c3nnc(-c4ccc([N+](=O)[O-])cc4)o3)nnc2-c2ccncc2)cc1 515339454 QTILOVRCBCHSTR-MRXNPFEDSA-N 485.529 5.449 5 20 JKBD C[C@@H]1CCCN(c2ccc(C(=O)Nc3cccc(OCC(=O)Nc4ccccc4)c3)cc2[N+](=O)[O-])C1 515614694 JBVBIWWLCDVVSP-LJQANCHMSA-N 488.544 5.101 5 20 JKBD COc1cccc(CCNC(=O)c2ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])cc2)c1OC 517412478 FCBAVACNKRYCPQ-UHFFFAOYSA-N 456.882 5.030 5 20 JKBD C[C@@H](c1ccncc1)N(C)C(=O)C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1 520103661 CHBSSTIQNUEMNM-SWEXZPIWSA-N 458.543 5.750 5 20 JKBD O=C(c1ccc(C(=O)N2CCC[C@@H]2c2ccccc2)c([N+](=O)[O-])c1)N1CCC[C@H]1c1ccccc1 524353867 OUVWKRJSVPVGHL-LOSJGSFVSA-N 469.541 5.549 5 20 JKBD O=C(Nc1ccc(C(=O)NC2CC2)cc1)c1ccc(NCc2ccccc2Cl)c([N+](=O)[O-])c1 589736525 OYFFIKJLMJVPCN-UHFFFAOYSA-N 464.909 5.005 5 20 JKBD C[C@H]1CCCN(c2ccc(C(=O)N3CCC[C@H]3c3nc4ccccc4s3)cc2[N+](=O)[O-])C1 598675164 UHJJZJBQSAARJL-JXFKEZNVSA-N 450.564 5.418 5 20 JKBD COc1cc(C(=O)NCc2cn3cc(Cl)ccc3n2)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 602341230 JZYDMRADQZXLFR-UHFFFAOYSA-N 487.299 5.280 5 20 JKBD COc1ccc(CSCC(=O)Nc2nc(-c3ccc(OC(F)F)cc3)cs2)cc1[N+](=O)[O-] 603572332 UTDWGOLBEVJQAS-UHFFFAOYSA-N 481.502 5.200 5 20 JKBD Cc1ccc(C(=O)C2CCN(C(=O)CCNc3ccc(C(F)(F)F)cc3[N+](=O)[O-])CC2)c(C)c1 603576805 SRBLKWGOECRYIV-UHFFFAOYSA-N 477.483 5.154 5 20 JKBD Cc1cc(NC(=O)c2cc(OCC(F)(F)F)ccc2[N+](=O)[O-])n(-c2cccc(Br)c2)n1 603738336 VYDYMHXHUFZEGI-UHFFFAOYSA-N 499.243 5.045 5 20 JKBD COC(=O)c1ccoc1CSc1ccccc1C(=O)Nc1cc([N+](=O)[O-])ccc1OC(F)F 603961139 IDKPTHZZCGJFAF-UHFFFAOYSA-N 478.429 5.120 5 20 JKBD CNC(=O)c1ccc(NC(=O)c2ccc(NCc3ccccc3Cl)c([N+](=O)[O-])c2)cc1Cl 604013438 HTIRXODNLNCAKG-UHFFFAOYSA-N 473.316 5.126 5 20 JKBD Cc1c(CS(=O)(=O)C(c2ccc(Cl)cc2)c2ccc(Cl)cc2)cccc1[N+](=O)[O-] 608784445 NXTMKAANSCGSDG-UHFFFAOYSA-N 450.343 5.914 5 20 JKBD COc1ccc(Oc2ccc([N+](=O)[O-])cc2C(=O)N2CCC[C@@H](c3nc4ccc(C)cc4[nH]3)C2)cc1 608986392 BIGHHYNKGBUEOC-GOSISDBHSA-N 486.528 5.600 5 20 JKBD O=C(Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1)c1cnn(-c2ncccc2Cl)c1C(F)(F)F 609324937 ABRSBIHEAFKJST-UHFFFAOYSA-N 494.842 5.224 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])c(Cl)c1)c1ccc(C(=O)Nc2ccc([N+](=O)[O-])c(Cl)c2)s1 727710041 FUFCPWMFQJPDHX-UHFFFAOYSA-N 481.273 5.376 5 20 JKBD Cc1ccc[n+](/C(C(=S)Nc2c(Cl)ccc(C)c2Cl)=C(/O)c2ccc([N+](=O)[O-])cc2)c1 728558233 ILMDUIIPGWSIKR-UHFFFAOYSA-O 475.377 6.129 5 20 JKBD O=C(O[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1)c1cc(F)c(F)c(F)c1 728652348 HPVCEBKEVHMASX-LJQANCHMSA-N 464.783 5.202 5 20 JKBD CSc1ccc([N+](=O)[O-])c(C(=O)NC[C@H](NC(=O)OC(C)(C)C)c2ccc(C(C)C)cc2)c1 728883376 IMDUDANVJZMUTO-FQEVSTJZSA-N 473.595 5.436 5 20 JKBD CC(C)(C)OC(=O)N1CCCc2cc(NC(=O)C3CCN(c4ccccc4[N+](=O)[O-])CC3)ccc21 729411567 BQPLXPAKLCJXIM-UHFFFAOYSA-N 480.565 5.138 5 20 JKBD Cc1nc(-c2cccc(Cl)c2)sc1C(=O)N(Cc1nnc(-c2cccc([N+](=O)[O-])c2)o1)C(C)C 744001383 DKSGPFHAHYORLX-UHFFFAOYSA-N 497.964 5.781 5 20 JKBD CC(C)Oc1ccc(-c2nc(C(=O)O[C@H](C)C(=O)Nc3cc([N+](=O)[O-])ccc3Cl)cs2)cc1 749318831 WFHAUTKUFWMJKW-CYBMUJFWSA-N 489.937 5.343 5 20 JKBD O=C(OCC(=O)N1c2ccccc2Sc2ccccc21)c1ccc(NC2CC2)c([N+](=O)[O-])c1 777491572 XDGQUYMESNOETL-UHFFFAOYSA-N 461.499 5.155 5 20 JKBD COc1ccc(C)cc1NC(=O)[C@H](OC(=O)c1ccc(N2CCCC2)c([N+](=O)[O-])c1)c1ccccc1 798273172 SIQJKGGNPOXPBD-RUZDIDTESA-N 489.528 5.049 5 20 JKBD O=C(/C=C\c1ccc(-c2ccc(F)cc2)s1)OCc1nnc(-c2ccc([N+](=O)[O-])cc2)o1 842092433 DVTNFLDDWFUPAX-BENRWUELSA-N 451.435 5.269 5 20 JKBD C[C@H](OC(=O)CSc1ccc([N+](=O)[O-])cc1)C(=O)N1c2ccccc2Sc2ccccc21 852583521 XDINQXQCDRMFNU-HNNXBMFYSA-N 466.540 5.448 5 20 JKBD COc1ccc(N2C(=S)N[C@@H](c3cccs3)C(C(=O)Nc3cccc([N+](=O)[O-])c3)=C2C)cc1 916168312 KYFFPHXYQPCQKZ-NRFANRHFSA-N 480.571 5.013 5 20 JKBD COc1ccccc1NC(=O)c1cc2ccccc2cc1OC(=O)c1ccc(OC)c([N+](=O)[O-])c1 916879323 QUTRRLJMDFDUIO-UHFFFAOYSA-N 472.453 5.237 5 20 JKBD Cc1c(COC(=O)C[C@H](NC(=O)c2ccccc2Cl)c2ccccc2)cccc1[N+](=O)[O-] 918798173 VXMZULKHRXQKSQ-NRFANRHFSA-N 452.894 5.161 5 20 JKBD C[C@@H](OC(=O)CCOc1ccc(Cl)cc1Cl)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 919490758 SWVMLGWYOUMWKQ-SNVBAGLBSA-N 495.237 5.260 5 20 JKBD C[C@H](Nc1ccc(C(=O)Nc2cccc(C3SCCS3)c2)cc1[N+](=O)[O-])c1ccccn1 919691504 CFAPYCBTEHXMAN-HNNXBMFYSA-N 466.588 5.894 5 20 JKBD CC(=O)N(c1ccc(F)cc1)c1nc(COC(=O)[C@H](C)Oc2ccc(Cl)cc2[N+](=O)[O-])cs1 920778117 JWDCDWHBOYLYFQ-LBPRGKRZSA-N 493.900 5.039 5 20 JKBD Cc1nn(C(F)F)c(C)c1CC(=O)Nc1cc(Cl)c([N+](=O)[O-])cc1OCc1ccccc1 920878723 NRPUXXCWODHFIQ-UHFFFAOYSA-N 464.856 5.217 5 20 JKBD Cc1cc(C(=O)N2CCCC[C@H]2C)ccc1NC(=O)c1cc([N+](=O)[O-])ccc1N1CCC(C)CC1 921153325 INOJFVWQHZJJOG-HXUWFJFHSA-N 478.593 5.406 5 20 JKBD COc1cc2c(cc1OC)CN(Cc1ccccc1NC(=O)c1cc([N+](=O)[O-])ccc1Cl)CC2 921284974 PRSFVICMLXAJDF-UHFFFAOYSA-N 481.936 5.076 5 20 JKBD Cc1ccc(C(=O)NC2(c3ccc(NC(=O)c4ccc([N+](=O)[O-])o4)cc3)CCC2)cc1Cl 1785748728 MSLUHCMLTUXWIB-UHFFFAOYSA-N 453.882 5.211 5 20 JKBD O=C(/C=C/c1ccc([N+](=O)[O-])o1)Nc1ccc(C2(NC(=O)CSC3CCCC3)CCC2)cc1 1786205678 NSPAUVWFKGJSFJ-ZRDIBKRKSA-N 469.563 5.011 5 20 JKBD CCn1ccc(C(=O)Nc2ccc(C3(NC(=O)c4cc5cc([N+](=O)[O-])ccc5s4)CCC3)cc2)n1 1787501570 QEEXTHLXZFRUBL-UHFFFAOYSA-N 489.557 5.087 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)c3ccc([N+](=O)[O-])[nH]3)CCC2)cc1)c1ccc2occ(Cl)c2c1 1790092165 USNPZZUMOFNWBP-UHFFFAOYSA-N 478.892 5.384 5 20 JKBD O=C(NC1(c2ccc(NC(=O)c3ccc([N+](=O)[O-])c4c3OCO4)cc2)CCC1)c1ccc(Cl)cc1 1790096001 ABHZTGVALXMLPE-UHFFFAOYSA-N 493.903 5.038 5 20 JKBD CC(C)[C@@H](C(=O)Nc1ccc(C2(NC(=O)c3nc[nH]c3[N+](=O)[O-])CCC2)cc1)c1ccc(Cl)cc1 1791191788 GVUBZEJEWSCFIY-HXUWFJFHSA-N 495.967 5.159 5 20 JKBD CC(C)c1ccc(C(=O)N2CCC3(CCCN(C(=O)Cc4ccc(Cl)cc4[N+](=O)[O-])C3)CC2)cc1 1805484766 DOZKTMLGMCRKJY-UHFFFAOYSA-N 498.023 5.459 5 20 JKBD CC(C)[C@H](C(=O)N1CCCC2(CCN(C(=O)CCc3cccc([N+](=O)[O-])c3)CC2)C1)c1ccccc1 1805617941 OSWSGMNMZHSXMJ-MHZLTWQESA-N 491.632 5.198 5 20 JKBD Cc1cc(C(=O)N2CCC([C@H]3CCCCN3C(=O)c3cc(C(C)(C)C)oc3C)CC2)ncc1[N+](=O)[O-] 1825950145 IWIGJKVTEXFNHD-JOCHJYFZSA-N 496.608 5.044 5 20 JKBD CC(C)CCC(=O)N1CCCC[C@H]1C1CCN(C(=O)C2(c3cccc([N+](=O)[O-])c3)CCC2)CC1 1831383150 YMFMFUWOBCGYLC-DEOSSOPVSA-N 469.626 5.072 5 20 JKBD CC(C)c1ccc(C(=O)N2CC3(CCCN3C(=O)c3cc4cc([N+](=O)[O-])ccc4s3)C2)cc1 1845739247 AWCRYRGTULJBHS-UHFFFAOYSA-N 463.559 5.064 5 20 JKBD CN(Cc1nc2ccccc2s1)C(=O)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 9891586 BJGMMWKUOQVWAC-UHFFFAOYSA-N 478.496 5.098 5 20 JKBD O=C(COC(=O)c1ccccc1OCc1ccc(F)cc1)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 10588109 GWDOBXCOJILPOW-UHFFFAOYSA-N 492.381 5.127 5 20 JKBD O=C(OCC(=O)N1N=C(c2ccc(Cl)cc2)C[C@@H]1c1ccco1)c1ccc([N+](=O)[O-])cc1Cl 11029103 YJLBFBYZSCJXQB-LJQANCHMSA-N 488.283 5.029 5 20 JKBD Cc1ccccc1NC(=O)c1cc2ccccc2cc1OS(=O)(=O)c1ccc([N+](=O)[O-])cc1 15331315 TZFHOKISULGFLM-UHFFFAOYSA-N 462.483 5.076 5 20 JKBD COc1ccc(NC(=O)[C@@H](C)Sc2ncnc3scc(-c4ccc(F)cc4)c23)c([N+](=O)[O-])c1 16864723 AYYYCGCYCHFWHM-GFCCVEGCSA-N 484.534 5.534 5 20 JKBD C[C@@H](Sc1nnc([C@@H](C)N(C)C)n1-c1ccc(Cl)cc1)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 17718184 JWNHPENHHMQIIO-ZIAGYGMSSA-N 499.984 5.355 5 20 JKBD Cc1cc(C)cc(-c2nnc(S[C@H](C)C(=O)Nc3ccc([N+](=O)[O-])cc3C(F)(F)F)o2)c1 22237315 ZDLUPXJLLIWXOZ-GFCCVEGCSA-N 466.441 5.400 5 20 JKBD COc1cc(C(=O)N[C@@H](C)c2nc3ccccc3[nH]2)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 57743929 MBMPTFRUABRXFL-ZDUSSCGKSA-N 466.881 5.416 5 20 JKBD COc1ccc(NC(=O)CNc2ccccc2NC23CC4CC(CC(C4)C2)C3)c([N+](=O)[O-])c1 72058754 AKBPIQZKVBRTDB-UHFFFAOYSA-N 450.539 5.035 5 20 JKBD O=C(NC[C@@H]1CCCO[C@H]1c1ccccc1)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 409547884 MKOKZYFHLRHELT-CVDCTZTESA-N 491.510 5.114 5 20 JKBD C[C@@H](NC(=O)c1ccccc1Sc1ccc(Br)cn1)c1cccc([N+](=O)[O-])c1 489327494 KRXZUXAORAOQHV-CYBMUJFWSA-N 458.337 5.395 5 20 JKBD Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)c1cccc(NC(=O)c2ccc(Br)o2)c1 490827720 OKCCZIXJRSVXJE-UHFFFAOYSA-N 458.268 5.072 5 20 JKBD Cc1nn(Cc2ccc(C(=O)N(Cc3cccc(F)c3)C3CCCC3)cc2)c(C)c1[N+](=O)[O-] 500567135 XDGORJWCARLQKT-UHFFFAOYSA-N 450.514 5.181 5 20 JKBD O=[N+]([O-])c1cc(Cl)ccc1Oc1ccc(CN[C@H](c2ccccc2)c2nccs2)cc1 507912527 HBYGEMPIEIDHMQ-JOCHJYFZSA-N 451.935 6.376 5 20 JKBD Cc1cc(NC(=O)c2ccccc2Cl)sc1C(=O)N(Cc1ccc([N+](=O)[O-])cc1)C(C)C 509693707 AOTWPWZTNBFWEX-UHFFFAOYSA-N 471.966 5.921 5 20 JKBD CSc1ccc(C(=O)c2ccccc2C(=O)N2CCC(Nc3ccc(F)cc3)CC2)cc1[N+](=O)[O-] 512160317 WZWPJUVWXYUJQB-UHFFFAOYSA-N 493.560 5.404 5 20 JKBD CCOc1ccc(C(=O)Nc2ccc(NC(=O)c3ccccc3)cc2C(F)(F)F)cc1[N+](=O)[O-] 514568265 AQTOFRITEYEAFC-UHFFFAOYSA-N 473.407 5.517 5 20 JKBD COc1ccc([N+](=O)[O-])cc1C(=O)Nc1ccc2nc(NC(=O)c3ccc(C)s3)sc2c1 522574110 RPOGUTKIZXMKQS-UHFFFAOYSA-N 468.516 5.088 5 20 JKBD Cc1sc(NC(=O)c2ccccc2-c2nc(C(C)(C)C)no2)nc1-c1cccc([N+](=O)[O-])c1 524317494 KFRZBWMGEMEHCY-UHFFFAOYSA-N 463.519 5.627 5 20 JKBD COc1cc(CCNC(=O)c2sc3cc(C(F)(F)F)ccc3c2Cl)c([N+](=O)[O-])cc1OC 603566013 DGVKKJUWXLWDMJ-UHFFFAOYSA-N 488.871 5.471 5 20 JKBD C[C@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccc(C(=O)N2CCCC[C@@H]2C)c(Cl)c1 603987177 LQMKWZFNHFBECW-GJZGRUSLSA-N 461.971 5.382 5 20 JKBD CCO[C@H]1CCCN(C(=O)C/C(=C/c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)C1 604427856 DKQMBPNCDOYACQ-BXWQOUMASA-N 451.548 5.163 5 20 JKBD O=C(Nc1scnc1-c1ccccc1)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 604537393 QUPKGEQAAHAREC-UHFFFAOYSA-N 476.480 5.592 5 20 JKBD Cc1nc([N+](=O)[O-])cn1CCC(=O)N(Cc1ccc(Oc2ccc(Br)cc2)cc1)C1CC1 609431630 RGIWWSNGGOALQZ-UHFFFAOYSA-N 499.365 5.236 5 20 JKBD O=[N+]([O-])c1ccc(/C(O)=C(/C(=S)Nc2ccc(Cl)nc2)[n+]2ccc3c(c2)CCCC3)cc1 727161702 MKEKOQHCBVCJSL-UHFFFAOYSA-O 467.958 5.133 5 20 JKBD O=C(CCNc1ccc(C(F)(F)F)cc1[N+](=O)[O-])Nc1ccc(OCc2cccnc2)cc1 728496173 CNRDENWNGQSQNI-UHFFFAOYSA-N 460.412 5.028 5 20 JKBD C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)N1CCC(c2nc(C(C)(C)C)cs2)CC1 750068534 UTJROIDOLDHUSR-ZDUSSCGKSA-N 450.992 5.209 5 20 JKBD COc1cc(COC(=O)c2ccc(-c3ccc(C(C)=O)cc3)o2)c([N+](=O)[O-])cc1OC(F)F 791190656 CDTVJLQBGOXBBA-UHFFFAOYSA-N 461.373 5.024 5 20 JKBD O=C(Nc1ccc(C(=O)Nc2cc([N+](=O)[O-])ccc2F)cc1)c1ccc(Br)cc1 917611649 NIGZTAQVFJISNH-UHFFFAOYSA-N 458.243 5.001 5 20 JKBD Cc1nn(Cc2ccc(C(=O)Nc3ccccc3C(=O)N(C)C3CCCCC3)cc2)c(C)c1[N+](=O)[O-] 917807947 WWCQFEDXHHHXEJ-UHFFFAOYSA-N 489.576 5.113 5 20 JKBD Cc1ccc(NC(=O)[C@@H](OC(=O)c2cc(-c3ccccc3)no2)c2ccccc2)c([N+](=O)[O-])c1 919188429 ZQWGMPUFXHNYRC-QHCPKHFHSA-N 457.442 5.095 5 20 JKBD Cc1ccc(CC(=O)NC2(c3ccc(NC(=O)[C@H]4CCC(F)(F)C4)cc3)CCC2)cc1[N+](=O)[O-] 1785805349 WNHZBIXTSSOAJU-SFHVURJKSA-N 471.504 5.015 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)c3ccc([N+](=O)[O-])c4c3OCO4)CCC2)cc1)c1cc2ccccc2o1 1789004385 CRZLFIGGKYNQIR-UHFFFAOYSA-N 499.479 5.131 5 20 JKBD Cc1c(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2ccc(OC(C)(C)C)cc2)C3)cc(Cl)cc1[N+](=O)[O-] 1800711799 BXVXZKRWLMHEQT-ACDBMABISA-N 499.995 5.300 5 20 JKBD CC(C)(C)CCCCCC(=O)N1CC[C@H](CNC(=O)c2cc(O)cc([N+](=O)[O-])c2)[C@@H]1c1cccnc1 1811689787 YMZFOCRENCITAQ-NLFFAJNJSA-N 496.608 5.012 5 20 JKBD CCCCCc1cccc(CC(=O)N2CCCC[C@H]2c2cc(NC(=O)c3ccc([N+](=O)[O-])o3)n[nH]2)c1 1814311844 SBHCFPOZWDXPFK-NRFANRHFSA-N 493.564 5.192 5 20 JKBD C/C(=C\c1cccs1)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2ccc([N+](=O)[O-])cc2F)CC1 1823718292 CMKBHVTUBJYLSB-CZTSOZTGSA-N 485.581 5.132 5 20 JKBD Cc1c(Cl)cccc1C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2ccc([N+](=O)[O-])cc2F)CC1 1823916552 UTNFMSHBUXYFEK-HSZRJFAPSA-N 487.959 5.243 5 20 JKBD Cc1ccc(CCC(=O)N2CCC([C@@H]3CCCCN3C(=O)c3ccc([N+](=O)[O-])cc3F)CC2)cc1F 1830492426 GBGVQEHLQNOPRB-VWLOTQADSA-N 499.558 5.048 5 20 JKBD C/C(=C\c1ccc(C)o1)C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2c(F)ccc([N+](=O)[O-])c2C)CC1 1830734104 XOCXGHFIKABCAL-JOPBRCQMSA-N 497.567 5.281 5 20 JKBD Cc1cccc(-c2nnc(SCc3nnc(-c4ccc([N+](=O)[O-])cc4)o3)n2Cc2ccco2)c1 22045699 APPACEYVZJUZHF-UHFFFAOYSA-N 474.502 5.145 5 20 JKBD CSc1ccc([N+](=O)[O-])c(C(=O)Nc2cc(C)nn2-c2cc(C(F)(F)F)ccc2Cl)c1 69531813 NQHWCUYARLQTCW-UHFFFAOYSA-N 470.860 5.735 5 20 JKBD COc1cc(C(=O)N2CCc3sccc3[C@@H]2c2cccs2)c([N+](=O)[O-])cc1OC(F)F 115379586 MWEGEASJAUUVTG-GOSISDBHSA-N 466.487 5.116 5 20 JKBD COc1cccc(CN(C(=O)CSc2ncccc2[N+](=O)[O-])C23CC4CC(CC(C4)C2)C3)c1 195660999 UCHFSEMPXCVOHZ-UHFFFAOYSA-N 467.591 5.088 5 20 JKBD COc1ccc(C)cc1-c1csc(NC(=O)c2csc(-c3cccc([N+](=O)[O-])c3)n2)n1 302988931 FLENJMUQWIGVSQ-UHFFFAOYSA-N 452.517 5.411 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)NC[C@@H]2CC3c4ccccc4C2c2ccccc23)cc1SC 481925418 YYLBPEYELLYHHT-XRHVDXNJSA-N 460.555 5.352 5 20 JKBD COc1ccc(N(C(=O)c2ccc(N[C@H](C)c3ccccn3)c([N+](=O)[O-])c2)[C@H](C)C2CC2)cc1 499600649 YTFYPYZCWZELJP-QZTJIDSGSA-N 460.534 5.617 5 20 JKBD CN(C)C(=O)c1ccc(Cl)c(NC(=O)c2ccc(NCc3ccccc3Cl)c([N+](=O)[O-])c2)c1 512329696 AQDIYFGMZAAGGH-UHFFFAOYSA-N 487.343 5.468 5 20 JKBD O=C(Nc1ccnn1Cc1c(Cl)cccc1Cl)C1CCN(c2ccccc2[N+](=O)[O-])CC1 516506371 JYGYDDUMNCGECH-UHFFFAOYSA-N 474.348 5.002 5 20 JKBD C[C@@H](SCC(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F)c1ccc(OC(F)(F)F)cc1 520472379 OCKCPFZSTFGQLO-SNVBAGLBSA-N 468.375 5.945 5 20 JKBD Cc1ccc(NC(=O)CN[C@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2ccccc2)c(Cl)c1 521767907 XGHFDGOEBWRIRN-QFIPXVFZSA-N 487.343 5.118 5 20 JKBD Cc1cc(C(=O)N2CCC[C@H]2C(=O)Nc2nc(-c3ccc(F)c(Cl)c3)cs2)ccc1[N+](=O)[O-] 522572539 BHMLDEZOAHHUTN-IBGZPJMESA-N 488.928 5.063 5 20 JKBD O=C(CCSc1nnc(-c2ccccc2Cl)n1Cc1ccccc1)Nc1ccc([N+](=O)[O-])cc1 592993769 LMIWAHWQEOBODP-UHFFFAOYSA-N 493.976 5.676 5 20 JKBD COc1cc(N[C@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2ccccc2)ccc1NC(C)=O 604045567 UXANNPJUKLHRHK-QFIPXVFZSA-N 468.897 5.007 5 20 JKBD COc1ccc(Oc2ccc([N+](=O)[O-])cc2C(=O)N(C)C[C@H]2CCCO[C@@H]2c2ccccc2)cc1 604519596 HBNRRPXZYMYFHV-FQRUVTKNSA-N 476.529 5.636 5 20 JKBD CCCCN(C(=O)c1ccc([N+](=O)[O-])n1C)c1nc(-c2ccc(Cl)cc2Cl)cs1 612566685 HBWKKGXWCSJQAM-UHFFFAOYSA-N 453.351 5.811 5 20 JKBD COc1ccc(Oc2ccc([N+](=O)[O-])cc2C(=O)N2CCC([C@@H](O)c3ccc(F)cc3)CC2)cc1 731054909 JMZUOYPULJYCMZ-VWLOTQADSA-N 480.492 5.121 5 20 JKBD O=C(COC(=O)c1c2c(nc3ccccc13)/C(=C\c1ccco1)CC2)c1ccc([N+](=O)[O-])cc1 765736897 BZYUNEWECZUCRI-VKAVYKQESA-N 454.438 5.263 5 20 JKBD COc1ccc([N+](=O)[O-])cc1NC(=O)[C@@H](C)OC(=O)c1sc(-c2ccco2)nc1-c1ccccc1 900279385 SQBIZELHWDAMCZ-CQSZACIVSA-N 493.497 5.171 5 20 JKBD COc1cc(-c2noc(-c3ccc(N[C@H](C)c4ccccn4)c([N+](=O)[O-])c3)n2)cc(Cl)c1OC 904403616 XOKQNFXZCYSMJT-CYBMUJFWSA-N 481.896 5.551 5 20 JKBD Cc1ccnc2sc(C(=O)N3CCCC[C@H]3CCOC(=O)c3cccc([N+](=O)[O-])c3)c(C)c12 918633614 PRNQWXOOMSVAQR-SFHVURJKSA-N 467.547 5.063 5 20 JKBD CCCC(=O)Nc1c(Cl)cc(Cl)cc1C(=O)OCc1nc(-c2ccc([N+](=O)[O-])cc2)no1 919558259 LDHVMJFFJJXOJH-UHFFFAOYSA-N 479.276 5.047 5 20 JKBD Cc1cc(C)c(NC(=O)COC(=O)c2ccc(N[C@H](C)c3ccccn3)c([N+](=O)[O-])c2)c(Cl)c1 920545687 HYJPWZWFDDIEGY-MRXNPFEDSA-N 482.924 5.229 5 20 JKBD COc1ccc(-c2cnc(COC(=O)c3ccccc3C(=O)c3ccc(Cl)c([N+](=O)[O-])c3)o2)cc1 920889166 KSCOFNVCOAAWBW-UHFFFAOYSA-N 492.871 5.500 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)c3ccc4occc4c3)CCC2)cc1)c1ccc(O)c([N+](=O)[O-])c1 1790619597 HADIFLYJYTYJFZ-UHFFFAOYSA-N 471.469 5.108 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)c3ccnc4ccccc34)CCC2)cc1)c1ccc([N+](=O)[O-])cc1F 1790622207 NKZPUSIVZVNFOF-UHFFFAOYSA-N 484.487 5.344 5 20 JKBD CC(=O)C[C@@H](C)C(=O)Nc1ccc(C2(NC(=O)c3cc4cc([N+](=O)[O-])ccc4s3)CCC2)cc1 1791542318 UWXRFCSTADCVKA-OAHLLOKOSA-N 479.558 5.172 5 20 JKBD O=C(Cc1cc(F)ccc1[N+](=O)[O-])Nc1ccc(C2(NC(=O)C[C@@H]3C[C@@H]4CC[C@H]3C4)CCC2)cc1 1792309258 IWXBPCVMMZXFKY-QYZOEREBSA-N 479.552 5.237 5 20 JKBD O=C(/C=C/c1ccccc1[N+](=O)[O-])NC1(c2ccc(NC(=O)[C@]3(F)CCCC=C3F)cc2)CCC1 1792378470 SYQYBFQGVOWXEX-BULTVDLSSA-N 481.499 5.488 5 20 JKBD C[C@@H](OC(=O)c1ccc(SC(F)F)cc1)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 10766013 CYRLUAIFJHQLLE-SECBINFHSA-N 464.368 5.112 5 20 JKBD CCOc1ccc(-c2nc(NC(=O)Cn3c4ccccc4c(=O)c4ccccc43)sc2C)cc1 14215551 ZHZCPKSMJCZFAU-UHFFFAOYSA-N 469.566 5.624 5 20 JKBD C[C@@H](OC(=O)c1csc(-c2ccc(Cl)cc2)n1)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 16457785 BAAXRHSFBHIRTI-SNVBAGLBSA-N 499.854 5.575 5 20 JKBD COc1ccc(NC(=O)[C@H](C)OC(=O)c2cc(-c3cccs3)nc3ccccc23)c([N+](=O)[O-])c1 16911746 HESYPUGHJPSIOI-AWEZNQCLSA-N 477.498 5.064 5 20 JKBD COc1ccc([N+](=O)[O-])cc1C(=O)OCc1csc(N(C(C)=O)c2ccc(Cl)c(Cl)c2)n1 19285086 HLACJJALYWFGOS-UHFFFAOYSA-N 496.328 5.408 5 20 JKBD Cc1ccccc1-n1ccnc1S[C@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 21594692 JMGQSSJGQCSROY-CYBMUJFWSA-N 450.442 5.227 5 20 JKBD CC(C)N(C(=O)COC(=O)c1ccccc1NC(=O)c1ccc([N+](=O)[O-])cc1Cl)c1ccccc1 21686933 KZKXEASNKQCUTQ-UHFFFAOYSA-N 495.919 5.099 5 20 JKBD C[C@@H](Sc1nnc(-c2ccncc2)n1-c1ccccc1)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl 28682597 QQVWVJHIBLKRCH-CQSZACIVSA-N 480.937 5.010 5 20 JKBD CCCn1c(SCc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)nc2ccc(C(F)(F)F)cc21 29813388 LBUPZPMZMPQICJ-UHFFFAOYSA-N 463.441 5.716 5 20 JKBD COc1ccc(CSc2nnc(S[C@@H](C)C(=O)Nc3ccc([N+](=O)[O-])cc3Cl)s2)cc1 36866207 SUYAVAYPKCTPBI-NSHDSACASA-N 497.023 5.520 5 20 JKBD CCOc1cc(C(=O)Nc2sc3c(c2C(=O)c2ccco2)CC[C@H](C)C3)c([N+](=O)[O-])cc1OC 105943204 QTLIMLCBWUEPHS-ZDUSSCGKSA-N 484.530 5.265 5 20 JKBD COCCOc1cc(NC(=O)c2ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])cc2)ccc1OC 106036612 PMQQMWNRHCUFOF-UHFFFAOYSA-N 472.881 5.327 5 20 JKBD COc1cc(C(=O)Nc2ccccc2CN2CCOCC2)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 108376491 SFBLKYLPWAYDPS-UHFFFAOYSA-N 497.935 5.134 5 20 JKBD CCCn1c(SCC(=O)Nc2ccc([N+](=O)[O-])cc2C(F)(F)F)nc2cc(Cl)ccc21 247988380 JIWHTXUKJHXVOP-UHFFFAOYSA-N 472.876 5.758 5 20 JKBD COc1ccc(Br)cc1NC(=O)c1ccc(N[C@H](C)c2ccccn2)c([N+](=O)[O-])c1 410082983 OESSZVVZGUZCHX-CYBMUJFWSA-N 471.311 5.186 5 20 JKBD Cc1c(CN2CCSCC2)cccc1NC(=O)c1cc([N+](=O)[O-])ccc1NCc1ccccc1 490151225 QCWCZFMRWRFGAE-UHFFFAOYSA-N 476.602 5.316 5 20 JKBD CC(=O)N(c1ccc(Cl)cc1)c1nc(/C=C\c2ccc3cccc([N+](=O)[O-])c3n2)cs1 510636252 AAMNAOCWVKTDNV-KTKRTIGZSA-N 450.907 6.108 5 20 JKBD COCCN(C(=O)c1ccc(COc2ccc(F)cc2)o1)c1nc(-c2ccc([N+](=O)[O-])cc2)cs1 514620419 GRUXDJWYXUKNEG-UHFFFAOYSA-N 497.504 5.323 5 20 JKBD C[C@H](Nc1ccc(NC(=O)CCCn2c(=O)oc3cc([N+](=O)[O-])ccc32)cc1)c1ccccc1 518866119 PFOXVBZRPZGAGR-KRWDZBQOSA-N 460.490 5.095 5 20 JKBD O=C(c1c2c(nc3ccccc13)/C(=C\c1ccc([N+](=O)[O-])cc1)CCC2)N1CCC(n2ccnc2)CC1 523181260 DRAPDJCCKAAGLB-UZYVYHOESA-N 493.567 5.694 5 20 JKBD O=C(Nc1cc([N+](=O)[O-])ccc1Nc1cccc(C(F)(F)F)c1)c1csc(-c2ncccn2)n1 603949907 XBHQXPIVSJIRKU-UHFFFAOYSA-N 486.435 5.523 5 20 JKBD Cc1nc(NC(=O)c2cc(OCC(F)(F)F)ccc2[N+](=O)[O-])sc1Cc1cccc(F)c1 603974043 BFZYFEKWCHLOKT-UHFFFAOYSA-N 469.416 5.283 5 20 JKBD CCCOc1cc(NC(=O)N2CCC(C(=O)c3ccc(C)cc3)CC2)c([N+](=O)[O-])cc1OCCC 604087513 WBWKMDRPIHTABR-UHFFFAOYSA-N 483.565 5.608 5 20 JKBD Cc1cc(-c2noc(CCC(=O)Nc3nc(-c4cccc([N+](=O)[O-])c4)c(C)s3)n2)ccc1F 604118183 MRWOFFYMZJDIDC-UHFFFAOYSA-N 467.482 5.096 5 20 JKBD COc1cc(C(=O)N2CC=C(c3c[nH]c4ccccc34)CC2)c([N+](=O)[O-])cc1OCc1cscn1 604351045 ZPODYUVHKQPMFK-UHFFFAOYSA-N 490.541 5.050 5 20 JKBD COc1cc(C(=O)N2CCC[C@H](c3cc4ccccc4[nH]3)C2)c([N+](=O)[O-])cc1OCc1cscn1 604354059 GNISZDWKZPSVBK-KRWDZBQOSA-N 492.557 5.140 5 20 JKBD CC(C)OCc1cccc(NC(=O)c2ccccc2C(=O)c2ccc(N(C)C)c([N+](=O)[O-])c2)c1 604439345 ZACLLMSKMPBRQS-UHFFFAOYSA-N 461.518 5.069 5 20 JKBD COc1ccc(-c2ccc(CN[C@@H](C)c3cccc(OCc4ccccn4)c3)o2)c([N+](=O)[O-])c1 608836187 VJMHPZFJEACHKR-SFHVURJKSA-N 459.502 5.688 5 20 JKBD COc1cc(C(=O)Nc2ccc(Oc3ccc(F)cc3)c3ccncc23)c([N+](=O)[O-])cc1OC 609033494 YKMWKZYFKHFZAC-UHFFFAOYSA-N 463.421 5.344 5 20 JKBD COc1cc(C(=O)NCC2CCC(c3ccccc3)CC2)c([N+](=O)[O-])cc1OCc1cscn1 609374234 XEFSSOJPSYIDLY-UHFFFAOYSA-N 481.574 5.343 5 20 JKBD Cc1ccccc1NC(=O)[C@H]1CCc2ccccc2N1C(=O)c1cc([N+](=O)[O-])ccc1Br 726918336 JOSVJESKIMWVDW-JOCHJYFZSA-N 494.345 5.266 5 20 JKBD CS(=O)(=O)Nc1ccc(NC(=O)CCC(=O)c2ccc3ccc4cccc5ccc2c3c45)cc1 729258941 VGURKHBRLZUWNF-UHFFFAOYSA-N 470.550 5.557 5 20 JKBD C[C@@H](OC(=O)c1cn(C(C)(C)C)nc1-c1ccccc1Cl)C(=O)Nc1ccccc1[N+](=O)[O-] 731084521 FMWDUWDNPWZXMT-CQSZACIVSA-N 470.913 5.051 5 20 JKBD O=C(Nc1cc(Cl)c([N+](=O)[O-])cc1OCc1ccccc1)[C@H]1CCCN(C(=O)c2ccccc2)C1 731163020 MCDIFWWYOJMTKH-FQEVSTJZSA-N 493.947 5.318 5 20 JKBD O=C(Nc1cc([N+](=O)[O-])c(F)cc1F)c1cc2cc(Br)cc(Br)c2o1 747377914 MELIDFZTOIRYPG-UHFFFAOYSA-N 476.027 5.397 5 20 JKBD Cc1cc(-c2noc([C@H](C)OC(=O)c3csc(-c4cccc([N+](=O)[O-])c4)n3)n2)ccc1F 747955749 LOLQKJDTYQJLKK-LBPRGKRZSA-N 454.439 5.134 5 20 JKBD COc1ccccc1Oc1ccc(NC(=O)c2cc([N+](=O)[O-])c(C)c([N+](=O)[O-])c2C)cc1F 748632905 DVSXXBVPSDQTKC-UHFFFAOYSA-N 455.398 5.312 5 20 JKBD O=C(Nc1ncc(Cc2cccc(Cl)c2)s1)c1cc([N+](=O)[O-])ccc1Br 751072698 NDUGOSUHIFBZQL-UHFFFAOYSA-N 452.717 5.310 5 20 JKBD O=C(Nc1ccc2c(c1)CCC(=O)N2Cc1ccc(Cl)cc1)c1cc(F)ccc1[N+](=O)[O-] 751113308 JFKVGIJWLRFZAX-UHFFFAOYSA-N 453.857 5.119 5 20 JKBD O=C(OCc1nc2ccccc2c2ccccc12)C1(S(=O)(=O)c2ccc(Cl)cc2)CC1 812758017 VWULLEHNJDRNBM-UHFFFAOYSA-N 451.931 5.091 5 20 JKBD Cc1csc(Sc2ccc(C(=O)N3CC[C@@H](Oc4ccc(C5CC5)cn4)C3)cc2[N+](=O)[O-])n1 858067833 JVHRFGDSIAXKEL-GOSISDBHSA-N 482.587 5.077 5 20 JKBD CC(C)[C@@H](OC(=O)Cn1c2ccccc2c(=O)c2ccccc21)C(=O)Nc1cc(Cl)ccc1Cl 915385347 UBBYFOCBYDDTPH-RUZDIDTESA-N 497.378 5.668 5 20 JKBD CC(=O)c1ccc(NC(=S)N2CCN(Cc3ccc(-c4ccccc4[N+](=O)[O-])s3)CC2)cc1 916022425 FABGJNPLJWJUOY-UHFFFAOYSA-N 480.615 5.041 5 20 JKBD CCOc1ccc(NC(=O)c2ccccc2NC(=O)c2ccc([N+](=O)[O-])cc2Cl)cc1F 918669110 AZSPMFSRGHLPPV-UHFFFAOYSA-N 457.845 5.291 5 20 JKBD Cc1cc(=O)oc2cc(OC(=O)c3ccc(N[C@@H](C)c4ccccn4)c([N+](=O)[O-])c3)c(Cl)cc12 920113512 GFXGRXHECRLYAW-AWEZNQCLSA-N 479.876 5.450 5 20 JKBD O=C(NC1(c2ccc(NC(=O)c3ccc([N+](=O)[O-])[nH]3)cc2)CCC1)c1csc(-c2ccccc2)n1 1790185716 CVVQYLXGSKMCHK-UHFFFAOYSA-N 487.541 5.108 5 20 JKBD Cc1cc(C(=O)Nc2ccc(C3(NC(=O)Cn4ccc5ccc([N+](=O)[O-])cc54)CCC3)cc2)ccc1O 1790656145 XUGZNQOBBWVHCF-UHFFFAOYSA-N 498.539 5.011 5 20 JKBD Cc1c(Cl)ccc(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)c3ccc([N+](=O)[O-])o3)n[nH]2)c1Cl 1814313774 YCQXCJKUVIUEGW-OAHLLOKOSA-N 492.319 5.146 5 20 JKBD CC(C)[C@H]1CC[C@H](C(=O)N2CCCC[C@@H]2c2cc(NC(=O)/C=C/c3ccc([N+](=O)[O-])o3)n[nH]2)CC1 1814970219 WVMQQOKEKJYZHB-XAVXOPJASA-N 483.569 5.079 5 20 JKBD Cc1c(Cl)cccc1C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cccc(F)c2[N+](=O)[O-])n[nH]1 1821167077 CDWUKCZPPITWON-LJQANCHMSA-N 485.903 5.039 5 20 JKBD CC(C)c1ccc(CC(=O)N2CCC([C@H]3CCCCN3C(=O)Cc3cccc([N+](=O)[O-])c3)CC2)cc1 1823681137 CFPOBRHVIQERCL-HHHXNRCGSA-N 491.632 5.123 5 20 JKBD C[C@H](C(=O)N1CCC([C@H]2CCCCN2C(=O)Cc2ccc(Cl)cc2[N+](=O)[O-])CC1)c1ccccc1 1824157708 BERVBUKLANHEAW-YADARESESA-N 498.023 5.214 5 20 JKBD O=C(c1ccc([N+](=O)[O-])o1)N1CCC([C@H]2CCCCN2C(=O)c2ccc(-c3ccccc3)cc2)CC1 1832697219 JTYDBIGUPNMIBM-XMMPIXPASA-N 487.556 5.402 5 20 JKBD O=C(c1cc2cc([N+](=O)[O-])ccc2s1)N1CC2(CCCN2C(=O)c2cc3ccc(Cl)cc3[nH]2)C1 1841001672 BJAHDNSDOHOXAV-UHFFFAOYSA-N 494.960 5.075 5 20 JKBD C[C@@H](OC(=O)c1cc(-c2ccco2)nc2ccccc12)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 11398482 NLRINNYIVUAZEP-CYBMUJFWSA-N 499.401 5.606 5 20 JKBD COc1cccc(Nc2nnc(SCc3cc(OC)c(OC(F)F)cc3[N+](=O)[O-])s2)c1 12476787 DPJXMYRBQDUJAS-UHFFFAOYSA-N 470.479 5.101 5 20 JKBD CSc1ccc(C(=O)Nc2sc(-c3ccccc3)c(C)c2C(=O)N2CCOCC2)cc1[N+](=O)[O-] 14389381 UXIURLBWUSXVSX-UHFFFAOYSA-N 497.598 5.078 5 20 JKBD Cc1ccc(Oc2ccccc2NC(=O)c2ccc(Sc3nncn3C)c([N+](=O)[O-])c2)cc1 14818491 HWQBUOWNOZABOA-UHFFFAOYSA-N 461.503 5.228 5 20 JKBD O=C(C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)Nc1ccc(F)c(F)c1F 15002686 STDBJESKHYBVTO-KAMYIIQDSA-N 469.444 6.191 5 20 JKBD O=C(NC1CC1)c1cccc(NC(=O)c2cc([N+](=O)[O-])ccc2Sc2ccc(Cl)cc2)c1 16172954 SIHGIQVPLYKMKE-UHFFFAOYSA-N 467.934 5.544 5 20 JKBD C[C@@H](Sc1nc2scc(-c3ccccc3)c2c(=O)n1C)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 17655319 IZZGPCYHFFVYJJ-CYBMUJFWSA-N 491.554 5.474 5 20 JKBD C[C@H](Sc1nnc(-c2ccc(F)cc2)n1C[C@@H]1CCCO1)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 17715332 VHDQQYXXDWJFPK-LIRRHRJNSA-N 496.524 5.075 5 20 JKBD CCN(CC)C(=O)c1ccc(NC(=O)Cc2cn(-c3ccccc3)nc2-c2ccc([N+](=O)[O-])cc2)cc1 19204237 YARVDEFJTVJSND-UHFFFAOYSA-N 497.555 5.111 5 20 JKBD CCOc1ccccc1-c1nnc(S[C@@H](C(=O)Nc2ccc(C)cc2[N+](=O)[O-])c2ccccc2)o1 21545520 JHHLAIIJSDWUGM-JOCHJYFZSA-N 490.541 5.824 5 20 JKBD COCc1cccc(N[C@@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Br)c2ccccc2)c1 28371287 PWLCBQOSNFYTNJ-OAQYLSRUSA-N 470.323 5.296 5 20 JKBD C[C@H](Nc1ccc(C(=O)Nc2nnc(SCc3ccccc3)s2)cc1[N+](=O)[O-])c1ccccn1 108754292 ZWXXKWMZGJMZIR-HNNXBMFYSA-N 492.586 5.559 5 20 JKBD Cc1ccc(-c2nc(CC(=O)Nc3nc(-c4cccc([N+](=O)[O-])c4)c(C)s3)cs2)cc1 195704005 ICIAZOIWGHUTJU-UHFFFAOYSA-N 450.545 5.640 5 20 JKBD Cc1occc1C(=O)Nc1cc(NC(=O)Cn2c3ccccc3c(=O)c3ccccc32)ccc1F 479913327 CFIQHPWBFNYKKL-UHFFFAOYSA-N 469.472 5.086 5 20 JKBD Cc1ccc(C(=O)C2CCN(C(=O)c3ccc(N4C[C@@H](C)C[C@@H](C)C4)c([N+](=O)[O-])c3)CC2)cc1 490742904 AHJTYENZSSOXQE-BGYRXZFFSA-N 463.578 5.121 5 20 JKBD O=C(Cc1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1)N1CCC(OC2CCCCC2)CC1 495640473 QIJBEVDCMVHQKW-UHFFFAOYSA-N 488.588 5.330 5 20 JKBD Cc1ccc(Sc2ccc(C(=O)N(C)[C@@H](C)c3ccc(-n4cncn4)cc3)cc2[N+](=O)[O-])cc1 499205123 YPONIUXCSPLFFA-SFHVURJKSA-N 473.558 5.468 5 20 JKBD Cc1sc(NC(=O)C2CCC(NC(=O)CC3CCCCC3)CC2)nc1-c1cccc([N+](=O)[O-])c1 508949646 PAZZWNDTJJSUAC-UHFFFAOYSA-N 484.622 5.611 5 20 JKBD COc1ccc([C@@H](CNC(=O)N(Cc2ccc([N+](=O)[O-])cc2)C(C)C)c2c[nH]c3ccccc23)cc1 509366300 NNPNVEQMHUSKPM-RUZDIDTESA-N 486.572 5.837 5 20 JKBD CCN(C(=O)Nc1cccc([N+](=O)[O-])c1C)[C@@H]1CCSc2ccc(Br)cc21 510066574 YVAPCEHVHYNWES-QGZVFWFLSA-N 450.358 5.757 5 20 JKBD CCN(Cc1ccccc1)C(=O)c1cc(NC(=O)c2cc(SC)ccc2[N+](=O)[O-])ccc1Cl 515452617 SAKHFRBJJGKPLC-UHFFFAOYSA-N 483.977 5.885 5 20 JKBD O=[N+]([O-])c1cccc(Cl)c1S(=O)(=O)N1CCC(c2nc3cc(Cl)ccc3s2)CC1 517911715 QXYPVWFAGDMWKN-UHFFFAOYSA-N 472.375 5.080 5 20 JKBD CO[C@H](CNC(=O)C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)c1ccccc1 518330639 DVKUWLVXWJHRTF-HVQRGMKJSA-N 473.554 5.639 5 20 JKBD Cc1ccc(NC(=O)c2cccc(C(F)(F)F)c2)cc1NC(=O)c1ccc([N+](=O)[O-])c(O)c1 518914544 LSEVGDZVSXEQBE-UHFFFAOYSA-N 459.380 5.132 5 20 JKBD C[C@H](c1ccncc1)N(C)C(=O)c1ccc(Sc2nc3ccccc3s2)c([N+](=O)[O-])c1 520098404 LMMUEBKKSIACER-CQSZACIVSA-N 450.545 5.584 5 20 JKBD CCOc1cccc([C@H](C)N[C@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2ccccc2)c1 520140176 FATDXKJMRDZIOT-HJPURHCSSA-N 453.926 5.678 5 20 JKBD C[C@H](NCc1ccc(-c2ccc([N+](=O)[O-])cc2)s1)c1cccc(NC(=O)c2ccccc2)c1 520949067 UHBPFQFXRNMRLN-SFHVURJKSA-N 457.555 6.426 5 20 JKBD CCOc1cc(NC(=O)c2cn(C(C)(C)C)nc2-c2ccccc2Cl)c([N+](=O)[O-])cc1OCC 521708776 MZRDGSRDCSRLPT-UHFFFAOYSA-N 486.956 5.916 5 20 JKBD CC(C)C(=O)Nc1cccc(NC(=O)C2CCN(c3ccc(C(F)(F)F)cc3[N+](=O)[O-])CC2)c1 603570277 DFZRUPTZOKEIHH-UHFFFAOYSA-N 478.471 5.063 5 20 JKBD C[C@H](c1ccccc1)n1c(SCC(=O)N(C)c2ccc([N+](=O)[O-])cc2)nnc1-c1ccccc1 603917236 HVNAZXLAIDRMPU-GOSISDBHSA-N 473.558 5.218 5 20 JKBD COc1ccc(C2(NC(=O)c3ccc(NCc4ccccc4Cl)c([N+](=O)[O-])c3)CCOCC2)cc1 604569215 QBGWCOQDKHUTNK-UHFFFAOYSA-N 495.963 5.305 5 20 JKBD O=[N+]([O-])c1ccc(-c2nn(-c3ccccc3)cc2CN[C@@H](c2ccc(F)cc2)[C@@H]2CCCO2)cc1 608837184 XLLUDWKYDKQACL-BDYUSTAISA-N 472.520 5.597 5 20 JKBD C[C@@H]1CSc2ccc(Br)cc2[C@H]1NC(=O)CSc1ccc([N+](=O)[O-])cc1 609192309 NISIGPXRSNIEOK-ZMZPIMSZSA-N 453.383 5.049 5 20 JKBD O=C(Cc1csc(-c2cccc(C(F)(F)F)c2)n1)OCc1nc(-c2ccc([N+](=O)[O-])cc2)no1 725968483 DCQCWBOFVSRBHN-UHFFFAOYSA-N 490.419 5.073 5 20 JKBD Cc1cccc2[nH]cc(CC(=O)Oc3ccc(NC(=O)c4cc([N+](=O)[O-])ccc4Cl)cc3)c12 728800524 DWZJTAKTUOABDA-UHFFFAOYSA-N 463.877 5.438 5 20 JKBD C[C@H](OC(=O)[C@H](C)Sc1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccccc1Cc1ccccc1 856620276 IBURIQIHPBXAOS-ROUUACIJSA-N 464.543 5.237 5 20 JKBD COc1cc(C(=O)Nc2ccccc2SC[C@@H]2CC2(Cl)Cl)c([N+](=O)[O-])cc1OC(F)F 917750134 FRZNNTCBPDEKKN-JTQLQIEISA-N 493.315 5.743 5 20 JKBD CSc1ccc(NC(=O)[C@@H](C)OC(=O)c2ccc(N[C@H](C)c3ccccn3)c([N+](=O)[O-])c2)cc1 920548101 PTINEHNPTMXXOM-HZPDHXFCSA-N 480.546 5.069 5 20 JKBD COC(=O)c1oc2ccccc2c1COC(=O)c1ccc(N[C@H](C)c2ccccn2)c([N+](=O)[O-])c1 920549354 XOIMHZZVKVNZIG-OAHLLOKOSA-N 475.457 5.053 5 20 JKBD Cc1ccc2nc(-c3ccc(NC(=O)Cn4c(C)nc([N+](=O)[O-])c4Br)cc3)sc2c1 920750913 MQCRRZQKKMQZNV-UHFFFAOYSA-N 486.351 5.086 5 20 JKBD O=C(CCCOc1ccc(Cl)cc1)NC1(c2ccc(NC(=O)c3ccc([N+](=O)[O-])o3)cc2)CCC1 1785748556 UCFAKKFXJUHYNX-UHFFFAOYSA-N 497.935 5.448 5 20 JKBD O=C(NC1(c2ccc(NC(=O)c3ccncc3F)cc2)CCC1)c1cc2cc([N+](=O)[O-])ccc2s1 1788858354 KUNJCEOYTGWXRO-UHFFFAOYSA-N 490.516 5.405 5 20 JKBD Cc1cc(O)c([N+](=O)[O-])cc1C(=O)Nc1ccc(C2(NC(=O)CSC3CCCC3)CCC2)cc1 1790806949 IQDQJPQUZIBRLO-UHFFFAOYSA-N 483.590 5.032 5 20 JKBD O=C(NC1(c2ccc(NC(=O)c3cc4cc([N+](=O)[O-])ccc4s3)cc2)CCC1)C1=COCCC1 1791010338 IDLDJBKTKCZCEM-UHFFFAOYSA-N 477.542 5.252 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)[C@@H]3[C@H]4C=CS[C@@H]43)CCC2)cc1)c1cc2cc([N+](=O)[O-])ccc2s1 1791010391 MXMWBMMBMMJOSL-QIJUGHKUSA-N 491.594 5.432 5 20 JKBD O=C(/C=C/c1ccccc1[N+](=O)[O-])Nc1ccc(C2(NC(=O)c3ccncc3Cl)CCC2)cc1 1792317465 SPKKQWLWOUKHRD-IZZDOVSWSA-N 476.920 5.104 5 20 JKBD CC(C)(C)CCCCCC(=O)N1CC[C@@H](CNC(=O)c2ccc([N+](=O)[O-])cc2F)[C@@H]1c1cccnc1 1810745932 JEOUGPCMKVXYPP-CPJSRVTESA-N 498.599 5.445 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2ccc3ccoc3c2)[nH]n1 1821285437 DQEASPVLFLEXSY-HXUWFJFHSA-N 491.479 5.131 5 20 JKBD CC[C@@H](C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cc([N+](=O)[O-])c(O)cc2C)CC1)c1ccccc1 1826314276 AJZLVIFZDGNWEY-VWNXMTODSA-N 493.604 5.036 5 20 JKBD O=C(c1ccc([N+](=O)[O-])o1)N1CCC([C@H]2CCCCN2C(=O)c2c(Cl)cccc2Cl)CC1 1829901169 WCYUVTCXNNKBEM-QGZVFWFLSA-N 480.348 5.042 5 20 JKBD O=C([C@H]1C[C@@H]1c1ccc(Cl)cc1)N1CC2(CCCN2C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)C1 1845739215 YADWYXBREMAXFU-UXHICEINSA-N 495.988 5.084 5 20 JKBD O=C(O[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1)c1ccc2ccccc2n1 10663597 PDZIJSUKENWALO-QFIPXVFZSA-N 461.861 5.333 5 20 JKBD CSc1ccc([N+](=O)[O-])c(C(=O)OCC(=O)Nc2ccccc2Oc2ccc(C)cc2)c1 11649525 BQWICWFPSKSEHT-UHFFFAOYSA-N 452.488 5.213 5 20 JKBD CCn1c(S[C@@H](C)C(=O)Nc2ccc(OC)cc2[N+](=O)[O-])nnc1-c1ccc(C(C)(C)C)cc1 16866130 XMKJRDQFBWWLTP-HNNXBMFYSA-N 483.594 5.299 5 20 JKBD CCn1c(S[C@@H](C)C(=O)Nc2ccc(F)cc2Cl)nc2cc3ccccc3cc2c1=O 22178132 ATUBPFNXGQMCAD-ZDUSSCGKSA-N 455.942 5.481 5 20 JKBD Cc1cc([N+](=O)[O-])ccc1NC(=O)CCSc1nnc(-c2ccccc2F)n1CC(C)C 26164703 UJMGMFCTZJTSRP-UHFFFAOYSA-N 457.531 5.078 5 20 JKBD O=C(Nc1ccc(N[C@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2ccccc2)cc1)c1ccco1 26986484 SNZLDUZKHKEXQF-QHCPKHFHSA-N 490.903 5.885 5 20 JKBD Cc1cc(-c2cc(C(=O)N3CCc4cc([N+](=O)[O-])ccc43)c3cnn(C(C)C)c3n2)c(C)s1 58530860 GRGOILZEKOOGJM-UHFFFAOYSA-N 461.547 5.469 5 20 JKBD CSc1ccc(C(=O)c2ccccc2C(=O)OCc2csc(-c3ccco3)n2)cc1[N+](=O)[O-] 105624992 FFBNKKWJSJIPHW-UHFFFAOYSA-N 480.523 5.621 5 20 JKBD O=C(Cc1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1)N(Cc1ccco1)CC(F)(F)F 115329335 XGEBJIMVVRZDKY-UHFFFAOYSA-N 484.434 5.174 5 20 JKBD O=C(Nc1ccccc1C(=O)NCc1ccccc1CN1CCCC1)c1ccc([N+](=O)[O-])cc1Cl 139684698 GRFKHAIFJVHJLG-UHFFFAOYSA-N 492.963 5.026 5 20 JKBD Cc1sc(NC(=O)c2cnn(Cc3ccccc3Cl)c2)nc1-c1cccc([N+](=O)[O-])c1 195704080 FFCKEDBMUMJBAS-UHFFFAOYSA-N 453.911 5.177 5 20 JKBD Cc1ccc(C(=O)Nc2ccccc2)cc1NC(=O)c1csc(-c2cccc([N+](=O)[O-])c2)n1 303067216 WEHQDJVTBNVRMM-UHFFFAOYSA-N 458.499 5.531 5 20 JKBD COc1cc([C@@H](C)NC(=O)c2ccc(Sc3nc(C)cs3)c([N+](=O)[O-])c2)cc(OC)c1OC 482464045 NGSFKKLMFWVULI-CYBMUJFWSA-N 489.575 5.028 5 20 JKBD O=C(NCC[C@@H]1C(=O)Nc2ccccc21)c1ccc(Sc2nc3ccccc3s2)c([N+](=O)[O-])c1 491107438 CKMPKJCSBMTTIA-INIZCTEOSA-N 490.566 5.212 5 20 JKBD C[C@@H](Nc1ccc(C(=O)Nc2cc(Cl)ccc2N2CCSCC2)cc1[N+](=O)[O-])c1ccccn1 499512641 YBKPVECVCHNQAM-MRXNPFEDSA-N 498.008 5.622 5 20 JKBD COC(=O)c1cc(-c2csc(NC(=O)c3cc([N+](=O)[O-])ccc3Sc3ccccc3)n2)c[nH]1 505304373 GXAGHKNZUUCFQF-UHFFFAOYSA-N 480.527 5.237 5 20 JKBD O=C(C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)NCc1ccnc(-n2cccn2)c1 505568570 LJZRPIWJNLLVNB-ZHZULCJRSA-N 496.552 5.032 5 20 JKBD CC(C)N(C)Cc1ccccc1CN[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1 511006258 YNLASLQLVJBGBP-VWLOTQADSA-N 480.996 5.558 5 20 JKBD COc1cc(C(=O)Nc2ccccc2COc2ccccc2)c([N+](=O)[O-])cc1OCc1cscn1 512633371 MUACMLITNRAKLF-UHFFFAOYSA-N 491.525 5.470 5 20 JKBD COC(=O)c1ccccc1C(=O)c1ccc(NC[C@@H]2CCCO[C@H]2c2ccccc2)c([N+](=O)[O-])c1 513201104 YBNZRCHHHBFCHP-FNZWTVRRSA-N 474.513 5.192 5 20 JKBD C[C@H](Sc1nnc(-c2ccncc2)n1-c1ccccc1)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 514702544 AGJPVFVVBKCMFI-HNNXBMFYSA-N 471.502 5.141 5 20 JKBD COc1ccc([N+](=O)[O-])c(C(=O)N[C@@H](c2ccccc2)c2ccc(Br)cc2F)c1 517902314 NSYDXWOVKACHPL-FQEVSTJZSA-N 459.271 5.024 5 20 JKBD C[C@H](SCC(=O)Nc1c(Br)cc([N+](=O)[O-])cc1Br)c1ccc(F)cc1 521614073 ZFVGKLWAWILFTD-VIFPVBQESA-N 492.164 5.692 5 20 JKBD C[C@H](NC(=O)C(=O)Nc1ccc(OCc2cccc(C(F)(F)F)c2)cc1)c1cccc([N+](=O)[O-])c1 524423059 USATYFZAKOTKKA-HNNXBMFYSA-N 487.434 5.009 5 20 JKBD COc1cc(C(=O)Nc2c(-c3ccccc3)nc3c(C)cccn23)c([N+](=O)[O-])cc1OC(F)F 585704325 CYDKVDDRRQGUID-UHFFFAOYSA-N 468.416 5.080 5 20 JKBD COc1ccc([N+](=O)[O-])cc1C(=O)N[C@H](c1ccccc1)c1ccc2nc(C(F)(F)F)[nH]c2c1 592948603 GROQUTUILISCRX-HXUWFJFHSA-N 470.407 5.018 5 20 JKBD CCCCCN(Cc1ccc(Cl)cc1)C(=O)c1ccc(Sc2nncn2C)c([N+](=O)[O-])c1 603821544 UMOYHXZORKQIAD-UHFFFAOYSA-N 473.986 5.361 5 20 JKBD O=C(c1csc(-c2ccc([N+](=O)[O-])cc2)n1)N1CCc2[nH]c3ccc(Br)cc3c2C1 604518791 LBLQDUHHOFNGBQ-UHFFFAOYSA-N 483.347 5.161 5 20 JKBD C[C@H]1CCCN(c2ccc(C(=O)N3CCC[C@@H](c4nc(-c5ccc(F)cc5)no4)C3)cc2[N+](=O)[O-])C1 608817228 GNBXDJPXNDXMMD-FXAWDEMLSA-N 493.539 5.040 5 20 JKBD Cc1cc(Sc2ncccn2)ccc1NC(=O)c1cc([N+](=O)[O-])ccc1Sc1ccccc1 608895472 LEQVNSXMINCAMQ-UHFFFAOYSA-N 474.567 6.248 5 20 JKBD COc1ccc(-c2nc(Sc3ccc(C(=O)Nc4ccc(C)cc4)cc3[N+](=O)[O-])n[nH]2)c(OC)c1 608974504 CVVBERXJODHJMQ-UHFFFAOYSA-N 491.529 5.109 5 20 JKBD O=C(Nc1ccc(OC(=O)c2csc(-c3c(F)cccc3F)n2)cc1)c1cccc([N+](=O)[O-])c1 726133672 KGARYILBRRSTCM-UHFFFAOYSA-N 481.436 5.468 5 20 JKBD C[C@H](Nc1ccc(C(=O)N2CCCC[C@H]2[C@H](C)NC(=O)OC(C)(C)C)cc1[N+](=O)[O-])c1ccccn1 727376860 DKRBVNXAQDUACI-SPEDKVCISA-N 497.596 5.071 5 20 JKBD CC(=O)c1cccc(O[C@@H](C)C(=O)Oc2ccc(NC(=O)c3cc([N+](=O)[O-])ccc3Cl)cc2)c1 745042460 DVGDAWSAFFTOPZ-HNNXBMFYSA-N 482.876 5.076 5 20 JKBD C[C@H](OC(=O)c1csc(-c2cccc([N+](=O)[O-])c2)n1)C(=O)Nc1ccc(C(C)(C)C)cc1 747961814 JEXSJBRBPHTXJN-AWEZNQCLSA-N 453.520 5.200 5 20 JKBD O=C(Nc1ccnn1Cc1cccc2ccccc12)c1cc([N+](=O)[O-])ccc1Br 751087919 YXMWHEFSBOLBLJ-UHFFFAOYSA-N 451.280 5.008 5 20 JKBD Cc1ccc(C(=O)Nc2cccc(C(F)(F)F)c2)cc1NC(=O)c1cc(F)ccc1[N+](=O)[O-] 751106535 DVDAQDCAVLBOOL-UHFFFAOYSA-N 461.371 5.566 5 20 JKBD O=C1CC[C@@H](c2noc(-c3ccc(Sc4ccc([N+](=O)[O-])cc4)cc3)n2)CN1CC1CCCC1 856574580 SOCUGOAUIUXUOB-LJQANCHMSA-N 478.574 5.692 5 20 JKBD O=C(Nc1cc(Cl)ccc1NCc1c(Br)cccc1[N+](=O)[O-])c1ccco1 863999576 VANRIIQWTXJVDK-UHFFFAOYSA-N 450.676 5.468 5 20 JKBD Cc1cccc(C(C)C)c1NC(=O)[C@@H](C)OC(=O)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-] 919195723 NFJNCMWJJCPAOV-CQSZACIVSA-N 468.428 5.152 5 20 JKBD Cc1cc(C)c(NC(=O)[C@@H](C)OC(=O)c2ccc(N[C@@H](C)c3ccccn3)c([N+](=O)[O-])c2)c(C)c1 920545594 UEMUEZHVSVFPGN-RBUKOAKNSA-N 476.533 5.272 5 20 JKBD C[C@H](SCc1nc(O)c2c(-c3ccccc3)csc2n1)C(=O)OCc1ccccc1[N+](=O)[O-] 921173631 HTNHUPAQCHVRGN-AWEZNQCLSA-N 481.555 5.337 5 20 JKBD O=C(CCc1cnc2ccccc2c1)Nc1ccc(C2(NC(=O)c3ccc([N+](=O)[O-])o3)CCC2)cc1 1786035728 QLZPFYZKAOUUCB-UHFFFAOYSA-N 484.512 5.117 5 20 JKBD O=C(NC1(c2ccc(NC(=O)c3cnccc3F)cc2)CCC1)c1cc2cc([N+](=O)[O-])ccc2s1 1788354851 NGDCCEMETYDZQZ-UHFFFAOYSA-N 490.516 5.405 5 20 JKBD CCOc1ccccc1C(=O)Nc1ccc(C2(NC(=O)/C=C/c3ccc([N+](=O)[O-])o3)CCC2)cc1 1790239582 RZFVVTQUWJEKNJ-WYMLVPIESA-N 475.501 5.048 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)c3ccc(O)c([N+](=O)[O-])c3)CCC2)cc1)c1ccc2ccoc2c1 1790892294 DKTCQAIVEVAGON-UHFFFAOYSA-N 471.469 5.108 5 20 JKBD CC(C)[C@@H](C(=O)N1CCCC2(CCN(C(=O)c3cccc(F)c3[N+](=O)[O-])CC2)C1)c1ccccc1 1805623523 PMEJHIMILBFZPK-HSZRJFAPSA-N 481.568 5.019 5 20 JKBD CC(C)(C)CCCCCC(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cc(O)cc([N+](=O)[O-])c2)[nH]n1 1822116135 OYVMIEQTJZYNEC-OAQYLSRUSA-N 485.585 5.326 5 20 JKBD CC1(C)CCC(CC(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3ccc(O)c([N+](=O)[O-])c3)CC2)CC1 1830423693 WGMIREWZGXTCEM-JOCHJYFZSA-N 485.625 5.140 5 20 JKBD Cc1cccc2[nH]c(C(=O)N3CCC([C@H]4CCCCN4C(=O)c4ccc([N+](=O)[O-])cc4F)CC3)cc12 1830497214 ZOMVNLZQHQWHTD-RUZDIDTESA-N 492.551 5.071 5 20 JKBD CCCOc1ccc(C(=O)N2CCC([C@@H]3CCCCN3C(=O)c3cccc(F)c3[N+](=O)[O-])CC2)cc1 1830621691 QUGQKHSAYCBWJX-DEOSSOPVSA-N 497.567 5.070 5 20 JKBD O=C(c1cc(F)cc(Cl)c1)N1CCC([C@H]2CCCCN2C(=O)c2cccc(F)c2[N+](=O)[O-])CC1 1830623643 XZJAEZLDBGNVMD-OAQYLSRUSA-N 491.922 5.074 5 20 JKBD Cc1ccc(NC(=O)[C@@H](OC(=O)c2ccc([N+](=O)[O-])cc2Cl)c2ccccc2)c([N+](=O)[O-])c1 11028645 XJJOFBVFUPQIOC-FQEVSTJZSA-N 469.837 5.002 5 20 JKBD O=C(C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1)N(Cc1ccc(F)cc1)C1CC1 14391935 AGBMSJBUQONOTN-UHFFFAOYSA-N 465.447 5.160 5 20 JKBD O=C(Nc1ccccc1I)c1cc([N+](=O)[O-])ccc1NCc1ccccc1 14429454 BJXWOHYUCAXCED-UHFFFAOYSA-N 473.270 5.064 5 20 JKBD CCOc1ccc(NC(=O)[C@@H](C)Oc2ccc3c(-c4ccc([N+](=O)[O-])cc4)cc(=O)oc3c2)cc1 15370806 LJELRZQHVUIBPL-MRXNPFEDSA-N 474.469 5.173 5 20 JKBD Cc1ccc(Sc2ccc(C(=O)N3CCCN(C(=O)c4cccc(F)c4)CC3)cc2[N+](=O)[O-])cc1 31268017 LYPFOYWRWHPSGN-UHFFFAOYSA-N 493.560 5.182 5 20 JKBD CC[C@@H](C(=O)N1CCC(NC(=O)c2cc3ccccc3c3cccnc23)CC1)c1ccccc1 72056894 PLYDDWPZKUICEU-HSZRJFAPSA-N 451.570 5.303 5 20 JKBD O=C(CSc1nnc(-c2cccs2)n1Cc1ccccc1)Nc1cc([N+](=O)[O-])ccc1Cl 97601244 DIIPTDALDYFIQC-UHFFFAOYSA-N 485.978 5.347 5 20 JKBD CC(C)N(Cc1nnc(-c2ccccc2Cl)o1)C(=O)c1cc2cc([N+](=O)[O-])ccc2s1 216297552 ULLDQXSQONAXLM-UHFFFAOYSA-N 456.911 5.564 5 20 JKBD O=C(Oc1ccc(Oc2ccccn2)cc1)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 247312370 IWDIFXSTRXGAPO-UHFFFAOYSA-N 487.434 5.623 5 20 JKBD C[C@@H](Nc1ccc(C(=O)NCCCc2nc(-c3ccncc3)cs2)cc1[N+](=O)[O-])c1ccccn1 303183743 IPMGGLGLNRJPGG-QGZVFWFLSA-N 488.573 5.044 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)Nc2ccc(N[C@@H](C)c3ccccc3)c(Cl)c2)cc1SC 303232047 YTLSBJMZJOCXRR-AWEZNQCLSA-N 471.966 6.404 5 20 JKBD Cc1csc(Sc2ccc(C(=O)N3CCCCC[C@@H]3c3ccncc3)cc2[N+](=O)[O-])n1 479276119 QYTWKIFRMPMBQC-GOSISDBHSA-N 454.577 5.663 5 20 JKBD COc1ccc(OC(F)F)c(NC(=O)c2ccc(NCc3ccccc3Cl)c([N+](=O)[O-])c2)c1 482216598 SPDRMXKWQIVTJZ-UHFFFAOYSA-N 477.851 5.723 5 20 JKBD COCCN(C(=O)c1ccc(-c2ccccc2F)o1)c1nc(-c2ccc([N+](=O)[O-])cc2)cs1 483265770 FXLMUEMNTXVNIU-UHFFFAOYSA-N 467.478 5.411 5 20 JKBD Cc1ccc(-c2nnco2)cc1NC(=O)C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1 483297033 ORMZSYIOIOXBAO-XDHOZWIPSA-N 497.536 6.132 5 20 JKBD COc1ccc([C@H](NC(=O)c2cc(SC)ccc2[N+](=O)[O-])c2ccccc2)cc1Br 485476025 XZRHCWFIVFETPV-OAQYLSRUSA-N 487.375 5.607 5 20 JKBD Cc1c(NC(=O)c2cnn(-c3ncc(C(F)(F)F)cc3Cl)c2C(F)(F)F)cccc1[N+](=O)[O-] 503072078 IEOKMRPLBXVEJC-UHFFFAOYSA-N 493.751 5.427 5 20 JKBD CC[C@H](C)n1c(S[C@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)nnc1-c1ccccc1 504288556 IMITZXDIGILYRC-UONOGXRCSA-N 459.959 5.597 5 20 JKBD O=C(Cc1csc(-c2cccc(C(F)(F)F)c2)n1)Nc1cc([N+](=O)[O-])ccc1OC(F)F 508940266 DKUFDDBFZZKSBR-UHFFFAOYSA-N 473.379 5.520 5 20 JKBD CC1CCN(Cc2ccc(NC(=O)c3ccc(N[C@H](C)c4ccccn4)c([N+](=O)[O-])c3)cc2)CC1 516596098 JFNZTZUWOFBJNV-HXUWFJFHSA-N 473.577 5.647 5 20 JKBD COc1cc(CNCc2coc(-c3cccs3)n2)ccc1OCc1ccc([N+](=O)[O-])cc1 518276541 AHLOBUWWEZMNRR-UHFFFAOYSA-N 451.504 5.189 5 20 JKBD COc1cc(NC(=O)c2ccccc2C(=O)c2ccc(SC)c([N+](=O)[O-])c2)c(OC)cc1Cl 598952727 DYYGJIJKNUGEEY-UHFFFAOYSA-N 486.933 5.471 5 20 JKBD COc1cc(C(=O)NCc2ccnc(N3CCCCC3)c2)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 603922292 HFWONUMHLZSBMB-UHFFFAOYSA-N 496.951 5.364 5 20 JKBD COc1cc(CN[C@H](c2ccc(Cl)cc2)c2nccn2C)ccc1OCc1ccc([N+](=O)[O-])cc1 604417857 DTCVSRLELOCLKR-RUZDIDTESA-N 492.963 5.449 5 20 JKBD CCCn1c(Sc2ccc(C(=O)Nc3ccc(C)cc3)cc2[N+](=O)[O-])nnc1-c1ccncc1 608972559 VRQRRHSKXLPYNA-UHFFFAOYSA-N 474.546 5.370 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Cl)[C@H](c1ccccc1)N1CCO[C@H](c2cccc(F)c2)C1 608975947 BAPDHHSIMXTSLL-GOTSBHOMSA-N 469.900 5.141 5 20 JKBD Cc1cc(O[C@H](C)c2ccccc2)ccc1NC(=O)c1cn(C)nc1-c1ccc([N+](=O)[O-])cc1 609067262 SXZDDCGHROVXEE-GOSISDBHSA-N 456.502 5.696 5 20 JKBD CCOc1ccc([C@H](NC(=O)C2CCN(c3ccccc3[N+](=O)[O-])CC2)C(C)C)cc1OCC 611994324 NRYQVIIHNZYIBP-RUZDIDTESA-N 469.582 5.122 5 20 JKBD Cc1ccc(Cc2sc(NC(=O)Cn3c4ccccc4c(=O)c4ccccc43)nc2C)cc1 614781263 LTNANUNNYFCGTN-UHFFFAOYSA-N 453.567 5.458 5 20 JKBD Cc1ccn2cc(-c3ccc(NC(=O)Cn4c5ccccc5c(=O)c5ccccc54)cc3)nc2c1 653754820 IQOKIJRVDBOCDV-UHFFFAOYSA-N 458.521 5.417 5 20 JKBD Cc1nc(-c2ccsc2)ccc1C(=O)O[C@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 726233350 KSOPRWLKUIMBGT-GFCCVEGCSA-N 479.436 5.230 5 20 JKBD CC(C)(C)OC(=O)N1CCc2cc(NC(=O)c3cc(OCC(F)(F)F)ccc3[N+](=O)[O-])ccc21 726509005 NLYGTUJUBRPPDX-UHFFFAOYSA-N 481.427 5.086 5 20 JKBD C[C@H](NC(=S)/C(=C(/O)c1ccc([N+](=O)[O-])cc1)[n+]1ccc(C(C)(C)C)cc1)c1cccs1 726578967 IAHUHPRQRSGOII-INIZCTEOSA-O 468.624 5.803 5 20 JKBD Cc1c(NC(=O)CCC(=O)c2ccc3ccc4cccc5ccc2c3c45)c(=O)n(-c2ccccc2)n1C 727750549 ALAJGUJDXOEWQF-UHFFFAOYSA-N 487.559 5.983 5 20 JKBD COC1CCN(c2ccc(NC(=O)[C@@H](C)Sc3ccc([N+](=O)[O-])cc3)cc2C(F)(F)F)CC1 728011408 NETJVKKSQVBEAK-CQSZACIVSA-N 483.512 5.348 5 20 JKBD Cc1cc(O[C@@H](C)c2ccccc2)ccc1NC(=O)c1cc([N+](=O)[O-])ccc1Br 728011624 OFKINJUEMUQSIJ-HNNXBMFYSA-N 455.308 6.058 5 20 JKBD C[C@H](C(=O)O[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1)c1ccccc1F 731395869 XJZWMLCURDVOGM-QKKBWIMNSA-N 456.857 5.414 5 20 JKBD CC(C)N(Cc1nnc(-c2cccc([N+](=O)[O-])c2)o1)C(=O)c1cnc(-c2ccccc2Cl)s1 747626256 OBBVRPXMJBRAJS-UHFFFAOYSA-N 483.937 5.473 5 20 JKBD C/C(=C/C(=O)OCC(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F)c1ccc(C(F)(F)F)cc1 748385761 JPDQJTSUMOKUBA-FLIBITNWSA-N 476.329 5.218 5 20 JKBD Cc1ccc(Cc2cnc(NC(=O)c3cc([N+](=O)[O-])ccc3Br)s2)cc1Cl 751071989 ISQPUDBTVQXBNM-UHFFFAOYSA-N 466.744 5.619 5 20 JKBD Cc1c(C(=O)O[C@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2ccccc2)cnn1-c1ccccc1 792734123 IJBBTRGTRFWNJD-QHCPKHFHSA-N 490.903 5.279 5 20 JKBD Cc1c(Br)cc([N+](=O)[O-])cc1-c1nc(C(C)(C)NC(=O)c2cccc(Cl)c2)no1 904599156 ZOTQYCXBCAQWRI-UHFFFAOYSA-N 479.718 5.034 5 20 JKBD CCCOc1ccc(S(=O)(=O)Oc2ccc(NC(=O)c3cc([N+](=O)[O-])ccc3Cl)cc2)cc1 914851618 KGJHRXWLIWTFSU-UHFFFAOYSA-N 490.921 5.057 5 20 JKBD CCC(CC)c1cc[n+](/C(C(=S)N[C@@H](C)c2ccccc2)=C(/O)c2ccc(C)c([N+](=O)[O-])c2)cc1 917611877 GXWYHUDSTCXLNK-FQEVSTJZSA-O 490.649 6.656 5 20 JKBD C[C@H](N[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1)c1cccc([N+](=O)[O-])c1 917939534 VOPDOZCLVPDBJM-LHSJRXKWSA-N 454.870 5.187 5 20 JKBD CSc1ccc([N+](=O)[O-])c(C(=O)OCc2csc(N(C(C)=O)c3ccc(C)cc3)n2)c1 918921594 RKLHAQAGVQGMKS-UHFFFAOYSA-N 457.533 5.123 5 20 JKBD COc1cccc([C@H](C)C(=O)Oc2ccc(NC(=O)c3cc([N+](=O)[O-])ccc3Cl)cc2)c1 919679027 MEUGARCZVJQDCD-AWEZNQCLSA-N 454.866 5.218 5 20 JKBD CCSc1cc(C(=O)O[C@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2ccccc2)ccn1 919733701 VQKLNRMFMZPLJY-FQEVSTJZSA-N 471.922 5.292 5 20 JKBD O=C(CCc1cccc([N+](=O)[O-])c1)Nc1ccc(C2(NC(=O)c3cnc(Cl)s3)CCC2)cc1 1786602800 SBZSIVLTKYOQDL-UHFFFAOYSA-N 484.965 5.085 5 20 JKBD O=C(CSc1ccccc1[N+](=O)[O-])Nc1ccc(C2(NC(=O)[C@H]3CCC(F)(F)C3)CCC2)cc1 1791521794 LEGMYJKXHSPTPR-INIZCTEOSA-N 489.544 5.256 5 20 JKBD O=C(/C=C/c1cccs1)N1CCCC2(CCN(C(=O)c3cc4cc([N+](=O)[O-])ccc4s3)CC2)C1 1810001881 ARMGCOGNLPWBBA-FNORWQNLSA-N 495.626 5.429 5 20 JKBD O=C(/C=C/c1ccccc1[N+](=O)[O-])Nc1cc([C@H]2CCCCN2C(=O)c2cc(F)ccc2Cl)[nH]n1 1823502603 CGVVUAVCUWAAAX-OGECGYFKSA-N 497.914 5.130 5 20 JKBD O=C(CCC1CCCC1)N1CCC([C@@H]2CCCCN2C(=O)Cn2ccc3ccc([N+](=O)[O-])cc32)CC1 1824371801 YDYGCKPCVXSDGW-VWLOTQADSA-N 494.636 5.140 5 20 JKBD COc1cc(C(=O)N2CCC([C@@H]3CCCCN3C(=O)c3c(C)cccc3Cl)CC2)ccc1[N+](=O)[O-] 1830599401 ZBPPQYAZSLMRKJ-NRFANRHFSA-N 499.995 5.112 5 20 JKBD Nc1c(N(c2ccccc2)c2c(N)c3ccccc3c3ccccc23)c2ccccc2c2ccccc12 2332241185 YGYFOIYRWUFBJZ-UHFFFAOYSA-N 475.595 8.934 5 20 JKBD C[C@H](Sc1nnc(-c2ccccc2F)n1C1CC1)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl 9636826 BDMFCOVJVPUWQB-NSHDSACASA-N 461.906 5.100 5 20 JKBD C[C@@H](OC(=O)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1)c1nnc(-c2cccs2)o1 17741264 WHNPUILGLZRPKT-GFCCVEGCSA-N 496.467 5.246 5 20 JKBD CCCOc1cc(NC(=O)c2ccc(Br)c([N+](=O)[O-])c2)c([N+](=O)[O-])cc1OCCC 17741939 JFOFRSQJQWJCIC-UHFFFAOYSA-N 482.287 5.095 5 20 JKBD COc1ccc(N2C(=O)CC[C@H](C(=O)Nc3cc([N+](=O)[O-])ccc3C)[C@@H]2c2ccccc2OC)cc1 19161034 JYQXVMGYHBIKCM-NVQXNPDNSA-N 489.528 5.043 5 20 JKBD O=C(CSc1ccc(F)c(Cl)c1)Nc1c(Br)cc([N+](=O)[O-])cc1Br 21410447 ZGUBATYXISDDPS-UHFFFAOYSA-N 498.555 5.643 5 20 JKBD C[C@H](OC(=O)CCC(=O)c1ccc2c(c1)CCCC2)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 25771186 ROTLGPYRVMXNSH-AWEZNQCLSA-N 492.450 5.026 5 20 JKBD CCN(CC)C(=O)Cc1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2Oc2ccc(OC)cc2)cc1 31116024 BQXRNKHZJUVTKN-UHFFFAOYSA-N 477.517 5.059 5 20 JKBD O=C(Nc1ccc(CN2C(=O)CCC2=O)cc1)c1cc([N+](=O)[O-])ccc1Sc1ccc(Cl)cc1 31143316 VTNUTSSTOYCXEY-UHFFFAOYSA-N 495.944 5.301 5 20 JKBD O=C(C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)Nc1nnc(C2CC2)s1 33681076 LNCJWRNFLFZEAN-RVDMUPIBSA-N 463.544 5.503 5 20 JKBD O=C(Nc1ccc(Cl)c([N+](=O)[O-])c1)[C@H](Sc1nccc(C(F)(F)F)n1)c1ccccc1 45800621 IEGREJHERBSXAK-MRXNPFEDSA-N 468.844 5.529 5 20 JKBD Cc1noc2nc(-c3ccccc3)cc(C(=O)O[C@H](C)c3nnc(-c4ccc([N+](=O)[O-])cc4)o3)c12 105435890 XYFCDVCTNOZXNI-CQSZACIVSA-N 471.429 5.074 5 20 JKBD COc1cc(C(=O)N2CCC(N3CCCCC3)CC2)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 116139723 DTZWBFHDJSGTKZ-UHFFFAOYSA-N 473.957 5.140 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)Nc2ccc(C(=O)N3CCCC[C@@H]3C)c(Cl)c2)cc1SC 483446358 ZJSKRHMDMGTOBJ-ZDUSSCGKSA-N 477.970 5.246 5 20 JKBD O=C(C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)NCc1ccnc(N2CCCC2)c1 483949670 ZOUHBOTXVYZKDX-RCCKNPSSSA-N 499.596 5.447 5 20 JKBD C[C@@H](Nc1ccc(C(=O)N[C@H](c2ccccc2)c2cccnc2)cc1[N+](=O)[O-])c1ccccn1 485499115 DBJXRTMZFANFSX-IQGLISFBSA-N 453.502 5.077 5 20 JKBD O=C(C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)NCCC(=O)NC1CCCCC1 491232447 MUMYSGFIIXXDNO-MNDPQUGUSA-N 492.601 5.090 5 20 JKBD COc1ccc(NC(=O)c2csc(-c3ccc([N+](=O)[O-])cc3)n2)cc1NC(=O)c1cccc(F)c1 496267343 QDDXFXLVEYMWGS-UHFFFAOYSA-N 492.488 5.371 5 20 JKBD COc1cc(C(=O)Nc2ccc(OCC3CCCCC3)cc2)c([N+](=O)[O-])cc1OCc1cscn1 498415772 ZEWGAFMDAXUXOU-UHFFFAOYSA-N 497.573 5.850 5 20 JKBD Cc1nn(Cc2ccc(C(=O)Nc3c(C(=O)c4ccco4)oc4ccccc34)cc2)c(C)c1[N+](=O)[O-] 499133075 WXASAJPGBGPMAP-UHFFFAOYSA-N 484.468 5.279 5 20 JKBD COCCN(C(=O)c1ccc(N(C)CC(C)C)cc1)c1nc(-c2ccc([N+](=O)[O-])cc2)cs1 499314503 IREFSWQEIZVAQH-UHFFFAOYSA-N 468.579 5.104 5 20 JKBD O=C(NCc1ccccc1OC(F)(F)F)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 500511119 CUFTWGYDRNSMPF-UHFFFAOYSA-N 491.388 5.045 5 20 JKBD CCCN(C(=O)c1ccc(Sc2nc(C)cs2)c([N+](=O)[O-])c1)[C@H](C)C(=O)Nc1ccccc1 502711645 JAGMZQHYHAYTSN-MRXNPFEDSA-N 484.603 5.390 5 20 JKBD O=C(c1csc(-c2ccc([N+](=O)[O-])cc2)n1)N1CCCc2cc(Br)cc(F)c21 502770453 OPWWWDJIDVRNEJ-UHFFFAOYSA-N 462.300 5.213 5 20 JKBD COc1cc(NC(=O)c2ccc(N[C@H](C)c3ccccn3)c([N+](=O)[O-])c2)c(OC)cc1Cl 505993367 WJGNLCMSLBXEIK-CYBMUJFWSA-N 456.886 5.086 5 20 JKBD CCOc1cc(CN[C@H]2CCc3cc(F)ccc32)ccc1OCc1cc([N+](=O)[O-])cc2c1OCOC2 507910638 ADGDOQGBLWHJCS-DEOSSOPVSA-N 494.519 5.355 5 20 JKBD O=C1CCc2cc(-c3csc(NC(=O)c4cccc5c(=O)c6cccc(F)c6[nH]c45)n3)ccc2N1 508007181 KLSBQBURFABSIQ-UHFFFAOYSA-N 484.512 5.081 5 20 JKBD COc1cc(CNCC2(c3ccc(F)cc3)CCOCC2)c([N+](=O)[O-])cc1OCc1ccccc1 509620624 RYCQMSDXDABJDJ-UHFFFAOYSA-N 480.536 5.160 5 20 JKBD CN(C(=O)c1ccc(NCc2ccccc2Cl)c([N+](=O)[O-])c1)c1ccc(Br)cn1 511166059 ACBLRNGUSFHNKU-UHFFFAOYSA-N 475.730 5.294 5 20 JKBD Cc1c(NC(=O)[C@@H](C)Sc2nnc(-c3ccccc3)n2-c2ccccc2)cccc1[N+](=O)[O-] 597217862 IYNMZVRFLCCIGV-QGZVFWFLSA-N 459.531 5.270 5 20 JKBD O=C(CCOc1ccccc1[N+](=O)[O-])Nc1sc2c(c1-c1nc3ccccc3[nH]1)CCCC2 603945976 XKVSBMPNCRKANU-UHFFFAOYSA-N 462.531 5.486 5 20 JKBD Cc1cccc([C@@H]2CCCN2C(=O)C2CCN(c3ccc(C(F)(F)F)cc3[N+](=O)[O-])CC2)c1 604024383 KQAQLHUILBAWGB-FQEVSTJZSA-N 461.484 5.502 5 20 JKBD COC(=O)c1ccccc1C(=O)c1ccc(N(C)C[C@H]2CCCO[C@H]2c2ccccc2)c([N+](=O)[O-])c1 604520423 MPVVQENKSGTKGL-ZBLYBZFDSA-N 488.540 5.217 5 20 JKBD COc1ccc(CN[C@H]2CCc3nc(-c4ccccc4)ncc3C2)cc1OCc1ccc([N+](=O)[O-])cc1 608782175 KVBJUEBDDYEOEJ-DEOSSOPVSA-N 496.567 5.287 5 20 JKBD CCN(CC)S(=O)(=O)c1ccc([C@@H](C)NCc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)cc1 608835532 RZRCIOQCFZWGMD-QGZVFWFLSA-N 473.620 5.205 5 20 JKBD O=C(NCCCc1nc(-c2ccncc2)cs1)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1 609028442 XQLDTLGJLNHNLB-UHFFFAOYSA-N 494.960 5.922 5 20 JKBD CC(C)c1c(C(=O)Nc2cc(-c3cccc([N+](=O)[O-])c3)[nH]n2)cnn1-c1ccc(Cl)cc1 609202665 VBQPPORHLVMCRM-UHFFFAOYSA-N 450.886 5.200 5 20 JKBD COc1cc(CSc2nnc(C[C@@H](C)c3ccccc3)o2)c([N+](=O)[O-])cc1OC(F)F 619253877 SGDIKZUDBZRANP-GFCCVEGCSA-N 451.451 5.226 5 20 JKBD C[C@H](SCc1ccc(Br)cc1)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 619608579 OHZXXNHOBQOAFZ-JTQLQIEISA-N 463.275 5.637 5 20 JKBD O=C(Oc1ccccc1)N1CCCN(C(=O)c2cc([N+](=O)[O-])ccc2Sc2ccccc2)CC1 725757251 LMJLIEGEVBGNKE-UHFFFAOYSA-N 477.542 5.093 5 20 JKBD COc1ccccc1[C@H](C)CC(=O)O[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1 728657707 CKHQXOPJYSUNMX-VOIUYBSRSA-N 482.920 5.674 5 20 JKBD C[C@@H](OC(=O)c1ccccc1NC(=O)c1ccc(Cl)cc1)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 746156467 INAXFLPRWHUAKS-CQSZACIVSA-N 492.875 5.469 5 20 JKBD COc1ccc(NCc2ccc(C(F)(F)F)cc2[N+](=O)[O-])cc1OCc1cn2ccccc2n1 864025576 LGMSRDLKXJGCMT-UHFFFAOYSA-N 472.423 5.461 5 20 JKBD CC(=O)Nc1cccc(OC(=O)C/C(=C\c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)c1 904792486 MWEPLCKAADTBTC-QGOAFFKASA-N 473.510 5.699 5 20 JKBD C[C@H](OC(=O)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1)c1nc(-c2cccs2)no1 914623119 WPNVZWYASWRTJT-LBPRGKRZSA-N 496.467 5.246 5 20 JKBD CC(C)c1cc(C(=O)Oc2ccc(NC(=O)c3cccc([N+](=O)[O-])c3)cc2)c2cnn(C(C)C)c2n1 920091882 RWOBFXVFYLANNG-UHFFFAOYSA-N 487.516 5.515 5 20 JKBD CCOC(=O)c1c(-c2ccccc2Cl)csc1NC(=O)c1cc(OC)ccc1[N+](=O)[O-] 920274825 ZPEKHNBMHNEAGZ-UHFFFAOYSA-N 460.895 5.414 5 20 JKBD C[C@H](Nc1ccc(C(=O)O[C@H](Cn2cncn2)c2ccc(Cl)cc2)cc1[N+](=O)[O-])c1ccccn1 920772881 CFDWVHGNLVIQGA-QMHKHESXSA-N 492.923 5.006 5 20 JKBD O=C(OCc1nc2ccccc2c2ccccc12)C1CCN(c2ccc(C(F)(F)F)cn2)CC1 921281345 OZMCVAVGXMGOJD-UHFFFAOYSA-N 465.475 5.762 5 20 JKBD Cc1nc(C(=O)NC2(c3ccc(NC(=O)Cc4ccc(Cl)cc4[N+](=O)[O-])cc3)CCC2)cs1 1786116608 WAZAUFFQWKBSRB-UHFFFAOYSA-N 484.965 5.004 5 20 JKBD O=C(/C=C/c1ccoc1)Nc1ccc(C2(NC(=O)/C=C/c3ccccc3[N+](=O)[O-])CCC2)cc1 1786750565 OSFDNZSXUIHFPR-PWHKKFIBSA-N 457.486 5.049 5 20 JKBD O=C(Cc1cccc([N+](=O)[O-])c1)NC1(c2ccc(NC(=O)[C@@]3(F)CCCC=C3F)cc2)CCC1 1792375014 LMHUOGOUXLFDAF-RUZDIDTESA-N 469.488 5.017 5 20 JKBD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)/C=C/c1ccc([N+](=O)[O-])o1)c1cc(Cl)c(Cl)c(Cl)c1 1793277283 BVYBNWUHRFQBHO-HPLAMEMLSA-N 498.750 5.113 5 20 JKBD Cc1cccc(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)CSc3ccccc3[N+](=O)[O-])CC2)c1F 1823904957 FEGJITUNHPTWTF-OAQYLSRUSA-N 499.608 5.068 5 20 JKBD Cc1c(C(=O)N2CCC([C@@H]3CCCCN3C(=O)CCc3cccc([N+](=O)[O-])c3)CC2)ccc(F)c1F 1824843754 SRKINWRVFKMKAX-DEOSSOPVSA-N 499.558 5.048 5 20 JKBD O=C(Cc1cc(F)ccc1[N+](=O)[O-])N1CCC([C@@H]2CCCCN2C(=O)c2cc3ccoc3s2)CC1 1827411173 AIKUKISUYUNXMH-FQEVSTJZSA-N 499.564 5.018 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)N1CCCC[C@H]1C1CCN(C(=O)/C=C/C2CCCC2)CC1 1830729731 VPGQQJCSMGQINL-SRLUVNLFSA-N 471.573 5.022 5 20 JKBD COc1cc(C(=O)N2CCC([C@H]3CCCCN3C(=O)[C@H]3CC[C@H](C(C)C)CC3)CC2)ccc1[N+](=O)[O-] 1831566708 QIXXMKXBDRDXKK-KIFXHHALSA-N 499.652 5.299 5 20 JKBD Cc1ccc(CC(=O)N2CCC([C@@H]3CCCCN3C(=O)C34CCC(CC3)CC4)CC2)cc1[N+](=O)[O-] 1832389817 IPACOVQUVAMUJP-CJQCTXEWSA-N 481.637 5.036 5 20 JKBD C[C@H](OC(=O)c1ccc([N+](=O)[O-])cc1Cl)C(=O)Nc1ccc(Cl)cc1C(F)(F)F 15710054 AVVAVZHCUPKZMQ-QMMMGPOBSA-N 451.184 5.104 5 20 JKBD O=C(NC[C@H](c1ccccc1Cl)c1c[nH]c2ccccc12)c1cc2c(cc1[N+](=O)[O-])OCCO2 15758520 OMTXDTVCPUYHCK-GOSISDBHSA-N 477.904 5.063 5 20 JKBD COc1ccc(-c2nnc(S[C@@H](C)c3nnc(-c4ccc([N+](=O)[O-])cc4)o3)n2CC(C)C)cc1 17536409 OAXRKJPKVMOUTD-HNNXBMFYSA-N 480.550 5.421 5 20 JKBD C[C@H](OC(=O)c1csc(-c2cccc(Cl)c2)n1)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 17981335 HMPICSBAMHQDDR-NSHDSACASA-N 456.867 5.340 5 20 JKBD CCN(Cc1ccc(OCc2cccs2)c(OC)c1)C(=O)c1ccc(SC)c([N+](=O)[O-])c1 18155096 NHLLFTMEFWUKJB-UHFFFAOYSA-N 472.588 5.628 5 20 JKBD COc1ccc(-c2nnc(SCC(=O)Nc3c(C)cccc3[N+](=O)[O-])n2C2CCCCC2)cc1 28789223 PSXQEUFBMAXZBQ-UHFFFAOYSA-N 481.578 5.406 5 20 JKBD Cc1cc2nnc(S[C@H](C)C(=O)Nc3nc(-c4cccc([N+](=O)[O-])c4)cs3)n2c2ccccc12 32535148 QQUJCPSIDRFQRI-CQSZACIVSA-N 490.570 5.342 5 20 JKBD COc1ccc([C@@H]2[C@H](C(=O)Nc3cc([N+](=O)[O-])ccc3C)CCC(=O)N2c2ccc(OC)cc2)cc1 36774295 OFDYNUWQVXOAMF-ZEQKJWHPSA-N 489.528 5.043 5 20 JKBD CC(C)Cc1ccc(C(=O)C2CCN(C(=O)C3CCN(c4ccccc4[N+](=O)[O-])CC3)CC2)cc1 46791527 WIHQVBGIPBQZKA-UHFFFAOYSA-N 477.605 5.131 5 20 JKBD O=C(Cn1c2ccccc2c(=O)c2ccccc21)Nc1cc(C(=O)N2CCCCC2)ccc1Cl 303125784 GWGHKKQPEKACJD-UHFFFAOYSA-N 473.960 5.073 5 20 JKBD CC[C@H](C)n1c(SCC(=O)Nc2cc([N+](=O)[O-])ccc2OC(F)F)nnc1-c1ccccc1 505043262 ACQXALHXZUAGND-ZDUSSCGKSA-N 477.493 5.157 5 20 JKBD C[C@H](Nc1ccc(C(=O)Nc2ccc3oc(C(C)(C)C)nc3c2)cc1[N+](=O)[O-])c1ccccn1 506172693 FNQHWQTXYOGOGY-HNNXBMFYSA-N 459.506 5.854 5 20 JKBD CCc1cc(Sc2nnc([C@@H](C)N(C)C)n2-c2ccc(F)cc2)nc(-c2ccc([N+](=O)[O-])cc2)n1 507133284 VMGJIIOZPHJTAW-OAHLLOKOSA-N 493.568 5.108 5 20 JKBD CC1CCN(C(=O)c2ccc(NC(=O)c3ccc(N[C@H](C)c4ccccn4)c([N+](=O)[O-])c3)cc2)CC1 509135531 GVSOZGABQLRHCF-LJQANCHMSA-N 487.560 5.287 5 20 JKBD C[C@@H](Nc1ccc(C(=O)NCC2(c3ccc(Cl)cc3)CCOCC2)cc1[N+](=O)[O-])c1ccccn1 510122486 XMTZNXDLFVZSOR-GOSISDBHSA-N 494.979 5.295 5 20 JKBD CSc1ccc(C(=O)c2ccccc2C(=O)N(C)Cc2ccc(Cl)s2)cc1[N+](=O)[O-] 511422567 TWWCTDPMYRROJR-UHFFFAOYSA-N 460.964 5.535 5 20 JKBD O=C(c1cc([N+](=O)[O-])ccc1Oc1ccccc1)N1CCC(N2CCc3ccccc3C2)CC1 518654089 YEOJINJIMQQCAT-UHFFFAOYSA-N 457.530 5.050 5 20 JKBD COc1ccc([C@H](Cc2ccccc2C)NC(=O)N(C)Cc2ccccc2[N+](=O)[O-])cc1OC 520877123 JWEGPFAMOIKZKL-QFIPXVFZSA-N 463.534 5.046 5 20 JKBD COCCOc1ncccc1NC(=O)C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1 524421740 IDNJDTKBPLERIZ-SDXDJHTJSA-N 490.541 5.194 5 20 JKBD COC(=O)c1ccc(OCc2csc(N(C(C)=O)c3c(C)cc(C)cc3C)n2)c([N+](=O)[O-])c1 589533450 OSEXTZPHNBIYMO-UHFFFAOYSA-N 469.519 5.027 5 20 JKBD COc1ccc([C@H](CNC(=O)c2ccc(N3CCCC3)c([N+](=O)[O-])c2)c2c[nH]c3ccccc23)cc1 603467101 LEHKLFVTGHFIEK-QHCPKHFHSA-N 484.556 5.247 5 20 JKBD COc1ccc([C@@H](NCc2ccc(Oc3ccc(F)cc3)c([N+](=O)[O-])c2)c2nccn2C)cc1 603633610 XMTBJWRWPZZVIR-XMMPIXPASA-N 462.481 5.148 5 20 JKBD Cc1ccc(CNC(=O)C2CCN(C(=O)c3cc([N+](=O)[O-])ccc3Oc3ccccc3)CC2)cc1F 603901600 MCKSSKFRIVSYBF-UHFFFAOYSA-N 491.519 5.003 5 20 JKBD Cc1nc2ccccc2c2c(NC(=O)CCCc3nc(O)c4ccccc4n3)c3ccccc3n12 641929292 DGEOMROJBWRYLG-UHFFFAOYSA-N 461.525 5.559 5 20 JKBD C[C@H]1CN(c2ccc(NC(=O)c3cc4cc([N+](=O)[O-])ccc4o3)cc2C(F)(F)F)C[C@H](C)O1 728011100 BZCPSYKKFIYFJA-STQMWFEESA-N 463.412 5.226 5 20 JKBD CCN(Cc1ccccc1C)C(=O)c1ccccc1NC(=O)c1ccc([N+](=O)[O-])cc1Cl 729838836 TZPNOHBUCGSACZ-UHFFFAOYSA-N 451.910 5.471 5 20 JKBD Cc1ccc(-c2nc(C)c([C@@H](C)NC(=O)c3cc([N+](=O)[O-])ccc3Br)s2)cc1 730761394 ILUKLFZYAVGERO-GFCCVEGCSA-N 460.353 5.589 5 20 JKBD O=C(Nc1cc(Cl)c([N+](=O)[O-])cc1OCc1ccccc1)c1ccc(Cn2cccn2)cc1 836498759 LPPAEENOAUDSEX-UHFFFAOYSA-N 462.893 5.324 5 20 JKBD COc1ccc([N+](=O)[O-])cc1NC(=O)c1ccccc1Sc1ccc(C(F)(F)F)cc1[N+](=O)[O-] 916665195 DUCVIAXXYBMMQR-UHFFFAOYSA-N 493.419 5.934 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Cl)[C@@H](c1ccccc1)N1CCC([C@H](O)c2ccccc2)CC1 917023869 MOPGYXRADQOHRW-JWQCQUIFSA-N 479.964 5.374 5 20 JKBD C[C@@H](OC(=O)c1ccc(NC(=O)Nc2ccccc2)cc1)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl 918047120 NYUXOOZJBQLCFK-CQSZACIVSA-N 482.880 5.076 5 20 JKBD CC(=O)N(c1nc(COC(=O)c2cc3cc([N+](=O)[O-])ccc3o2)cs1)c1c(C)cc(C)cc1C 919213157 IFURAPXKGSQHAZ-UHFFFAOYSA-N 479.514 5.764 5 20 JKBD Cc1c(Cl)cccc1C(=O)NC1(c2ccc(NC(=O)c3ccc([N+](=O)[O-])o3)cc2)CCC1 1785748874 SUWASWAUYKYMNK-UHFFFAOYSA-N 453.882 5.211 5 20 JKBD Cc1ccc2oc(C(=O)Nc3ccc(C4(NC(=O)Cc5ccc(C)c([N+](=O)[O-])c5)CCC4)cc3)cc2n1 1788322902 WIWASNGTTCVKFP-UHFFFAOYSA-N 498.539 5.343 5 20 JKBD Cc1ccoc1C(=O)Nc1ccc(C2(NC(=O)Cc3ccc(Cl)cc3[N+](=O)[O-])CCC2)cc1 1788689187 JQBFNFWSZSRELL-UHFFFAOYSA-N 467.909 5.140 5 20 JKBD O=C(/C=C/c1ccccc1[N+](=O)[O-])Nc1ccc(C2(NC(=O)c3cnc4ccoc4c3)CCC2)cc1 1792317859 VJTUQKNYUIFBJJ-IZZDOVSWSA-N 482.496 5.197 5 20 JKBD O=C([C@@H]1CCC[C@@H]2CCCC[C@@H]21)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)C1(c3cccc([N+](=O)[O-])c3)CCC1)C2 1797874206 JKIZXIZMJAJENE-YQMVKYCNSA-N 493.648 5.261 5 20 JKBD O=C(CCc1cccc([N+](=O)[O-])c1)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(Oc2ccccc2)cc1 1800344830 VOHUNKPCTQEQNE-BKFWDETESA-N 499.567 5.272 5 20 JKBD Cc1cccc2cc(C(=O)N[C@@H]3C[C@@H]4CC[C@H](C3)N4C(=O)c3cc4cc([N+](=O)[O-])ccc4s3)[nH]c12 1801207085 KOAHRQUKZPXQNA-REPLKXPHSA-N 488.569 5.165 5 20 JKBD CC[C@@H](C)[C@@H](C(=O)N1CCCC2(CCN(C(=O)Cc3cccc([N+](=O)[O-])c3)CC2)C1)c1ccccc1 1809153528 JRKVFPJMDQXPCA-AJTFRIOCSA-N 491.632 5.198 5 20 JKBD Cc1c(C(=O)NC[C@@H]2CCN(C(=O)CCC3CCCC3)[C@@H]2c2cccnc2)cc(Cl)cc1[N+](=O)[O-] 1811794274 MMCIBIWZFOJZOX-NBGIEHNGSA-N 499.011 5.242 5 20 JKBD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)[nH]n1)c1sccc1F 1815429802 QOOLHJZOCAKXAX-INIZCTEOSA-N 499.549 5.353 5 20 JKBD Cc1cc(CCCC(=O)N2CCC([C@H]3CCCCN3C(=O)c3occc3C)CC2)c([N+](=O)[O-])cc1F 1827736201 JOAOAJYREWDDNL-HSZRJFAPSA-N 499.583 5.200 5 20 JKBD Cc1ccc(CC(=O)N2CCC([C@@H]3CCCCN3C(=O)c3ccc4occc4c3)CC2)cc1[N+](=O)[O-] 1828259058 UQJBZYXLRMCTOX-DEOSSOPVSA-N 489.572 5.125 5 20 JKBD CC1=CC[C@H](C(=O)N2CCCC[C@H]2C2CCN(C(=O)CSc3ccccc3[N+](=O)[O-])CC2)CC1 1828352321 OMEKGGZGLWHMRT-VXKWHMMOSA-N 485.650 5.053 5 20 JKBD O=C(c1ccccc1F)N1CCC([C@@H]2CCCCN2C(=O)C2(c3cccc([N+](=O)[O-])c3)CCC2)CC1 1830292918 LVELNTWYSWXRII-VWLOTQADSA-N 493.579 5.089 5 20 JKBD O=C(Cc1ccsc1)N1CCC([C@H]2CCCCN2C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)CC1 1831061248 QGQSLLXHXRNNBO-OAQYLSRUSA-N 497.642 5.347 5 20 JKBD CC(C)CCC(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cccc([N+](=O)[O-])c2Br)CC1 1831382529 OKWRMFCRAUXPBB-IBGZPJMESA-N 494.430 5.027 5 20 JKBD O=C(CSc1ccc([N+](=O)[O-])cc1)Nc1ccc(NC(=O)c2ccco2)cc1C(F)(F)F 10640941 ZLKWUNMXSSNXJS-UHFFFAOYSA-N 465.409 5.190 5 20 JKBD O=C(c1cc([N+](=O)[O-])ccc1N1CCCCC1)N1CCC(c2nc3ccccc3s2)CC1 14390007 YWLQJTUGQSIYMT-UHFFFAOYSA-N 450.564 5.215 5 20 JKBD C[C@@H](c1ccccc1)n1c(SCc2cc([N+](=O)[O-])cc3c2OCOC3)nc2ccccc2c1=O 20891041 BILLGDFDMYCZIG-INIZCTEOSA-N 475.526 5.073 5 20 JKBD C[C@H](Nc1ccc(C(=O)N2CCC[C@@H](c3nc4ccccc4o3)C2)cc1[N+](=O)[O-])c1ccccn1 108781261 WTUWXZGXZIUXMQ-PKOBYXMFSA-N 471.517 5.324 5 20 JKBD Cc1ccc(CSCCNC(=O)c2ccc(N[C@H](C)c3ccccn3)c([N+](=O)[O-])c2)cc1 108790317 OAIKMKHCHMODFW-GOSISDBHSA-N 450.564 5.135 5 20 JKBD CC(=O)N(c1nc(/C=C\c2ccc3c([N+](=O)[O-])cccc3n2)cs1)c1ccc(F)cc1F 208896820 PBMIUKUSKZHTST-SREVYHEPSA-N 452.442 5.733 5 20 JKBD O=C(/C=C\c1ccc([N+](=O)[O-])cc1)Nc1ccc(NC(=O)c2ccc(F)cc2)cc1C(F)(F)F 213147301 JALREFQYSWYLFO-BASWHVEKSA-N 473.382 5.657 5 20 JKBD Cc1c(Br)cccc1NC(=O)c1ccc(N[C@@H](C)c2ccccn2)c([N+](=O)[O-])c1 303126562 HCVDFZQKLWLHHS-AWEZNQCLSA-N 455.312 5.486 5 20 JKBD O=C(C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)N[C@H]1COc2ccccc2C1 480069833 NCQQENOTBRCJNS-UMSHPIDHSA-N 471.538 5.255 5 20 JKBD CCN(C(=O)c1csc(-c2cccc([N+](=O)[O-])c2)n1)[C@@H]1CCN([C@H](C)c2ccccc2)C1 501942153 BKQCNXLNRGCLKC-DYESRHJHSA-N 450.564 5.016 5 20 JKBD CC[C@@H](C)n1c(S[C@@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)nnc1-c1ccccc1 504288555 IMITZXDIGILYRC-KGLIPLIRSA-N 459.959 5.597 5 20 JKBD O=[N+]([O-])c1cc(S(=O)(=O)N2CCCCCC2)ccc1SCc1coc(-c2cccs2)n1 506318191 YDUNZHUWIUKPTI-UHFFFAOYSA-N 479.605 5.168 5 20 JKBD Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)[C@H]1CCCN(C(=O)c2ccc(Cl)c(Cl)c2)C1 506587804 WJCLLWLHNTYGLS-HNNXBMFYSA-N 450.322 5.009 5 20 JKBD COc1ccc(Br)c(CNCc2ccc(OCc3ccc([N+](=O)[O-])cc3)c(OC)c2)c1 507911981 FMNCZACCQMLRKM-UHFFFAOYSA-N 487.350 5.243 5 20 JKBD CC[C@@H](C(=O)N1CCC(NCc2ccc(Oc3ccc(F)cc3)c([N+](=O)[O-])c2)CC1)c1ccccc1 507949165 KFFJSFRPWLGVGO-RUZDIDTESA-N 491.563 5.801 5 20 JKBD CCOc1cc(NC(=O)c2cc(C)nc3ccc(Br)cc23)c([N+](=O)[O-])cc1OCC 508809087 IHBSLBVUXWPYKV-UHFFFAOYSA-N 474.311 5.264 5 20 JKBD CC[C@H](c1ccc(F)cc1)N(Cc1cccc(F)c1)C(=O)c1ccc(S(C)(=O)=O)c([N+](=O)[O-])c1 512334631 WCJYTIGRWOMTRY-OAQYLSRUSA-N 488.512 5.070 5 20 JKBD O=C(Nc1cccc(NC(=O)c2cc([N+](=O)[O-])ccc2Oc2ccccc2)c1)c1ccncc1 514559699 DNNZXBCWLAEWRX-UHFFFAOYSA-N 454.442 5.287 5 20 JKBD C[C@@H](NC(=O)CSc1ccc([N+](=O)[O-])cc1)c1ccc(NC(=O)Nc2ccccc2)cc1 517359046 LNVAKHQXOKTVSM-MRXNPFEDSA-N 450.520 5.208 5 20 JKBD Cn1ccnc1COc1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2Sc2ccc(Cl)cc2)cc1 517382815 UGVFPSJRHUCLKY-UHFFFAOYSA-N 494.960 5.964 5 20 JKBD C[C@@H](Nc1ccc(NC(=O)c2ccc(-n3cncn3)c([N+](=O)[O-])c2)cc1Cl)c1ccccc1 575144309 TYTKDKUBYLNBIM-OAHLLOKOSA-N 462.897 5.254 5 20 JKBD C[C@H]1CN(Cc2csc(NC(=O)c3cc([N+](=O)[O-])ccc3Sc3ccccc3)n2)C[C@H](C)O1 590766914 AXYUKOCSVYCZDJ-HOTGVXAUSA-N 484.603 5.064 5 20 JKBD O=C(Nc1cc(F)ccc1Oc1ccccc1)c1ccc([N+](=O)[O-])cc1I 609023001 ZDELGKXWORDSPY-UHFFFAOYSA-N 478.217 5.383 5 20 JKBD Cn1cc(C(=O)N[C@@H]2CCCc3nc(-c4ccc(F)cc4)sc32)c(-c2ccc([N+](=O)[O-])cc2)n1 609187207 DPHHDAMQDFNQRC-LJQANCHMSA-N 477.521 5.065 5 20 JKBD Cn1cnc([N+](=O)[O-])c1Sc1nnc(-c2ccccc2Cl)n1-c1cccc(C(F)(F)F)c1 619674709 ALWPJEIGAASPFB-UHFFFAOYSA-N 480.859 5.399 5 20 JKBD O=C(NC[C@@H](c1ccc(Cl)cc1)N1CCc2sccc2C1)c1cc(F)c(F)cc1[N+](=O)[O-] 727708688 BNELVHHPDCDLKZ-FQEVSTJZSA-N 477.920 5.117 5 20 JKBD Cc1ccccc1NC(=O)Cc1nc(COC(=O)c2csc(-c3cccc([N+](=O)[O-])c3)n2)cs1 747960934 FDPLYAJAQNOTEY-UHFFFAOYSA-N 494.554 5.021 5 20 JKBD Cc1cccc(C(C)C)c1NC(=O)[C@H](C)OC(=O)c1cc([N+](=O)[O-])ccc1N1CCC(C)CC1 772450927 DLPHFVWEMGVGQI-IBGZPJMESA-N 467.566 5.447 5 20 JKBD Cc1ccc(Oc2ccc(OCC(=O)O[C@@H](C)c3nnc(-c4ccc([N+](=O)[O-])cc4)o3)cc2)cc1 844503378 GFISOUXQYRHPGS-KRWDZBQOSA-N 475.457 5.429 5 20 JKBD O=C(COC(=O)c1sc2cc(C(F)(F)F)ccc2c1Cl)Nc1ccccc1[N+](=O)[O-] 914964208 UYFZHVQCBGTGPB-UHFFFAOYSA-N 458.801 5.277 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Br)[C@@H](Nc1ccc2c(c1)OCCCO2)c1ccccc1 915871321 XWYQXQCLNHCTAM-QFIPXVFZSA-N 498.333 5.311 5 20 JKBD CC(C)Oc1ncc(C(=O)Oc2ccc(NC(=O)c3cc([N+](=O)[O-])ccc3Cl)cc2)cc1Cl 917562845 UPVHVTNKRWXPPY-UHFFFAOYSA-N 490.299 5.555 5 20 JKBD Cc1ccc(/C(O)=C(/C(=S)Nc2ccc3ccccc3c2)n2ccc(=[N+](C)C)cc2)cc1[N+](=O)[O-] 917609605 JQJYVOMYJQQSKY-UHFFFAOYSA-O 485.589 5.213 5 20 JKBD O=C(/C=C/c1ccc([N+](=O)[O-])o1)NC1(c2ccc(NC(=O)c3cccc4cccnc34)cc2)CCC1 1788909780 SMDUFGFDQKCNIZ-ACCUITESSA-N 482.496 5.197 5 20 JKBD CCSc1cccnc1C(=O)Nc1ccc(C2(NC(=O)c3ccc([N+](=O)[O-])cc3F)CCC2)cc1 1790210400 ZDCFHPPGBGLJOU-UHFFFAOYSA-N 494.548 5.302 5 20 JKBD Cc1ccc(CC(=O)Nc2ccc(C3(NC(=O)c4c(F)ccnc4Cl)CCC3)cc2)cc1[N+](=O)[O-] 1790523828 FCWDTOSDBXDKTF-UHFFFAOYSA-N 496.926 5.081 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)c3ccoc3C(F)(F)F)CCC2)cc1)c1ccc([N+](=O)[O-])cc1F 1790622277 QFBKZDQSWLAVPN-UHFFFAOYSA-N 491.397 5.407 5 20 JKBD CC[C@H](C)[C@H](C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1c(F)ccc([N+](=O)[O-])c1C)c1ccccc1 1800699129 IICJCOZJAGBHCB-YPEAGQFRSA-N 481.568 5.124 5 20 JKBD CC(C)c1ccc(CC(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cc4cc([N+](=O)[O-])ccc4s2)C3)cc1 1801858420 UYHOEJMIDDGYRA-KOUNCHBCSA-N 491.613 5.427 5 20 JKBD Cc1c(F)cccc1C(=O)N1CCCC2(CCN(C(=O)c3cc(Cl)cc([N+](=O)[O-])c3C)CC2)C1 1805112869 NZPDOHHDMGWYEL-UHFFFAOYSA-N 487.959 5.163 5 20 JKBD O=C(c1ccc(F)s1)N1CCCC2(CCN(C(=O)c3cc4cc([N+](=O)[O-])ccc4s3)CC2)C1 1807287384 WAQHAGQCJXYKQG-UHFFFAOYSA-N 487.578 5.169 5 20 JKBD CCC1(C(=O)N2CC[C@H](CNC(=O)c3cc4cc([N+](=O)[O-])ccc4s3)[C@@H]2c2cccnc2)CCC1 1812303981 SYNQOORFPZIQBB-JPYJTQIMSA-N 492.601 5.104 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)Nc1cc([C@@H]2CCCCN2C(=O)C[C@H](C)c2ccccc2)[nH]n1 1821285401 CWCAKDMHWJHCBJ-AOMKIAJQSA-N 493.539 5.265 5 20 JKBD Cc1c(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)/C=C/c3ccsc3)[nH]n2)cc(Cl)cc1[N+](=O)[O-] 1821290401 ACJSOAOWLOPEQO-UEKDZROGSA-N 499.980 5.361 5 20 JKBD Cc1ccc(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3cc4cc([N+](=O)[O-])ccc4s3)CC2)o1 1824684975 BUWVZWYITNOAJP-HXUWFJFHSA-N 481.574 5.258 5 20 JKBD CCC[C@H](C(=O)N1CCCC[C@@H]1C1CCN(C(=O)/C=C/c2ccccc2[N+](=O)[O-])CC1)n1cccc1 1827635147 XOAJCCATBIPENW-XOPPCCJWSA-N 492.620 5.071 5 20 JKBD O=C(/C=C/c1ccccc1[N+](=O)[O-])N1CCC([C@H]2CCCCN2C(=O)c2ccc3ncccc3c2)CC1 1828034587 JCUMANAHAPMXBP-HEAKDJBOSA-N 498.583 5.090 5 20 JKBD C[C@@H](CC(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cccc(F)c2[N+](=O)[O-])CC1)c1ccccc1 1831508731 DZIVXPKMXUKPST-CYFREDJKSA-N 481.568 5.161 5 20 JKBD CCCCCc1ncc(C(=O)N2CCCC23CN(C(=O)c2cc4cc([N+](=O)[O-])ccc4s2)C3)s1 1845792903 HPMLHFTVQDHZMZ-UHFFFAOYSA-N 498.630 5.130 5 20 JKBD C[C@@H](OC(=O)c1ccc(N2CCCC2)c([N+](=O)[O-])c1)C(=O)Nc1ccccc1-c1ccccc1 10733818 OHIKXHBCTJLUEU-GOSISDBHSA-N 459.502 5.046 5 20 JKBD CCCOc1ccc(-c2csc(NC(=O)c3cc(OC)c(OC(F)F)cc3[N+](=O)[O-])n2)cc1 10961076 SKHJFJZIWPKSCQ-UHFFFAOYSA-N 479.461 5.369 5 20 JKBD COc1ccc(NC(=O)[C@H](C)Sc2nnc(-c3ccccc3)c(-c3ccccc3)n2)c([N+](=O)[O-])c1 16058488 SJINORLNHRCDBH-INIZCTEOSA-N 487.541 5.242 5 20 JKBD CCCn1c(S[C@@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)nc2sc3c(c2c1=O)CCC3 17541499 AYPOWGTWXGTKSQ-LBPRGKRZSA-N 483.575 5.168 5 20 JKBD C[C@@H](OC(=O)c1csc(-c2cccc(Cl)c2)n1)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl 17980855 KRZMILCAKAFLOK-SNVBAGLBSA-N 466.302 5.209 5 20 JKBD COc1ccccc1NC(=O)C(=Cc1ccc(C(C)C)c([N+](=O)[O-])c1)C(=O)Nc1ccccc1OC 20885607 YQBGLLJPNPYNAS-UHFFFAOYSA-N 489.528 5.396 5 20 JKBD CC(=O)N(c1ccc(C)c(C)c1)c1nc(COC(=O)CSc2ccccc2[N+](=O)[O-])cs1 24846097 JVOITQHQZKHDLM-UHFFFAOYSA-N 471.560 5.188 5 20 JKBD CCOc1cc(C(=O)Nc2ncc(Cc3cccc(Cl)c3Cl)s2)c([N+](=O)[O-])cc1OC 26366764 AGOGQFFZOYEEHX-UHFFFAOYSA-N 482.345 5.609 5 20 JKBD Cc1c(NC(=O)[C@@H](C)OC(=O)CCc2ncc(-c3ccc(Cl)cc3Cl)o2)cccc1[N+](=O)[O-] 28773287 YJMVSRWPNHFYMI-CYBMUJFWSA-N 492.315 5.368 5 20 JKBD Cc1ccc(NC(=O)[C@@H](Sc2nc(-c3ccc(Cl)cc3)n[nH]2)c2ccccc2)c([N+](=O)[O-])c1 28806902 WSFRQTALTTVPJA-FQEVSTJZSA-N 479.949 5.814 5 20 JKBD O=C(C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)NCc1ccc(N2CCCC2)nc1 30296158 YCMYUJSCGNLIJI-QNGOZBTKSA-N 499.596 5.447 5 20 JKBD C[C@H](Nc1ccc(C(=O)NCc2ccccc2CN2CCCCC2)cc1[N+](=O)[O-])c1ccccn1 108787722 XUEKBPYNYSHKLE-FQEVSTJZSA-N 473.577 5.079 5 20 JKBD CC(=O)Nc1ccc(C(F)(F)F)cc1NC(=O)CSc1ccc(C(F)(F)F)cc1[N+](=O)[O-] 109163793 QIARPDFIXMQAJU-UHFFFAOYSA-N 481.374 5.322 5 20 JKBD O=C(Nc1ccccc1)Nc1ccc(NC(=O)c2csc(-c3cccc([N+](=O)[O-])c3)n2)cc1 303012153 JRLDDWUJEPMHOR-UHFFFAOYSA-N 459.487 5.615 5 20 JKBD COc1cc(C(=O)N(CCc2ccccc2)c2nc(-c3ccccc3)cs2)c([N+](=O)[O-])cc1OC 491230465 CNPYICBTJFGWDP-UHFFFAOYSA-N 489.553 5.625 5 20 JKBD CC[C@@H](C)n1c(S[C@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)nnc1-c1ccccc1 504312643 ABGWWEFZMNKSON-HUUCEWRRSA-N 450.524 5.728 5 20 JKBD C[C@@H](Nc1ccc(C(=O)Nc2ccc(C(=O)NCc3ccccc3)cc2)cc1[N+](=O)[O-])c1ccccn1 509092013 BVZFVJDTSSSPIY-LJQANCHMSA-N 495.539 5.345 5 20 JKBD Cc1csc(N(C)C(=O)c2c3c(nc4ccccc24)/C(=C/c2ccc([N+](=O)[O-])cc2)CCC3)n1 512019170 WCARBFXPTJEFSR-NBVRZTHBSA-N 470.554 6.061 5 20 JKBD COc1cc(C(=O)Nc2ccccc2Sc2ccccc2)c([N+](=O)[O-])cc1OCc1cscn1 512302121 WINFLHIISMOORT-UHFFFAOYSA-N 493.566 6.042 5 20 JKBD COCCN(C(=O)c1oc2c(C)ccc(C)c2c1C)c1nc(-c2ccc([N+](=O)[O-])cc2)cs1 512384758 VWMRWZDGFWILIQ-UHFFFAOYSA-N 465.531 5.683 5 20 JKBD CN(Cc1cnn(-c2ccccc2)c1)[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1 514745028 KWGIHKIHEBICIT-XMMPIXPASA-N 475.936 5.246 5 20 JKBD CN(Cc1ccccc1[N+](=O)[O-])C(=O)C(=O)Nc1ccc(Oc2ccc(Cl)cc2Cl)c(F)c1 517837074 GFIBRBBXGOEYGY-UHFFFAOYSA-N 492.290 5.430 5 20 JKBD Cc1cc(CNC(=O)c2c3c(nc4ccccc24)/C(=C/c2ccc([N+](=O)[O-])cc2)CCC3)no1 517906701 LWOXYSOMCKOHQS-NBVRZTHBSA-N 454.486 5.246 5 20 JKBD CCOc1ccc(CN(CCCn2ccnc2)C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)cc1 519139948 GSXKCVPCDULQTL-UHFFFAOYSA-N 464.547 5.137 5 20 JKBD Cc1ccc(C(=O)Nc2cccc(C(F)(F)F)c2)cc1NC(=O)COc1ccc([N+](=O)[O-])cc1 521297484 ZJXOXEREWXQPSQ-UHFFFAOYSA-N 473.407 5.192 5 20 JKBD O=C(Nc1ccc(CN2C(=O)Cc3ccc(Cl)cc32)cc1)c1cc2cc([N+](=O)[O-])ccc2o1 521647281 OFSHJJWGKDDWSP-UHFFFAOYSA-N 461.861 5.336 5 20 JKBD CCN(C(=O)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])c(OC)c1)c1ccccc1OC 603531544 UQKJBTCQULXTDC-UHFFFAOYSA-N 456.882 5.724 5 20 JKBD COC(=O)c1cc(CNC(=O)C/C(=C/c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)oc1C 603571669 OFYDCXYCZNVGPG-BOPFTXTBSA-N 491.525 5.140 5 20 JKBD C[C@H](NC(=O)c1ccc(N2CCCC2)c([N+](=O)[O-])c1)c1cccc(NC(=O)Cc2ccccc2F)c1 603765120 XSGRMDJADXROPP-SFHVURJKSA-N 490.535 5.006 5 20 JKBD Cc1ccc(NC(=O)c2ccc(Sc3nnc(C(C)C)n3Cc3ccco3)c([N+](=O)[O-])c2)cc1 608972447 KPWBBLUYQLUBIT-UHFFFAOYSA-N 477.546 5.663 5 20 JKBD O=[N+]([O-])c1ccc2nc(/C(Cl)=C/c3cc(Br)c(O)c(Br)c3)[nH]c2c1 747117561 VFVOZYYHVXBYQZ-WZUFQYTHSA-N 473.508 5.439 5 20 JKBD COc1cc2[nH]c(/C(Cl)=C/c3ccc(-c4ccc([N+](=O)[O-])cc4)s3)nc(=O)c2cc1OC 818215312 GBKYVNBCHITVPY-SXGWCWSVSA-N 469.906 5.314 5 20 JKBD O=[N+]([O-])c1cc(Br)cc(-c2nc(-c3cccc(OCc4cccnc4)c3)no2)c1 904506649 SHNZFMYCRDGTFB-UHFFFAOYSA-N 453.252 5.048 5 20 JKBD CC(C)(C)OC(=O)Nc1cccc(-c2noc(-c3ccc4[nH]c5ccccc5c(=O)c4c3)n2)c1 904632816 DVDXJSKBXJRABS-UHFFFAOYSA-N 454.486 5.745 5 20 JKBD Cc1nn(Cc2ccc(C(=O)Nc3cccc(CN(C)C(=O)OC(C)(C)C)c3)cc2)c(C)c1[N+](=O)[O-] 917111449 RAKTWLVBNBHAIP-UHFFFAOYSA-N 493.564 5.076 5 20 JKBD O=C(Cc1cc2ccccc2o1)Oc1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2Cl)cc1 919975997 BYNBSUDEKKHLIU-UHFFFAOYSA-N 450.834 5.395 5 20 JKBD C[C@@H](OC(=O)[C@H]1CCCN(C(=O)c2ccc(Cl)c(Cl)c2)C1)c1ccc([N+](=O)[O-])cc1 920157421 GOSIOYNOZVTWSG-CJNGLKHVSA-N 451.306 5.058 5 20 JKBD C[C@@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)N1CCC(C(O)(c2ccccc2)c2ccccc2)CC1 920276831 PJCFVKPHOWQNII-HXUWFJFHSA-N 476.598 5.250 5 20 JKBD O=C(Cc1ccc(C(F)(F)F)cc1)NC1(c2ccc(NC(=O)c3ccc([N+](=O)[O-])o3)cc2)CCC1 1785748615 UWVLGILELKBSLC-UHFFFAOYSA-N 487.434 5.197 5 20 JKBD COc1cc(Cl)cc(C(=O)NC2(c3ccc(NC(=O)/C=C/c4ccc([N+](=O)[O-])o4)cc3)CCC2)c1 1786207980 BVOUBJMSYWMERV-VQHVLOKHSA-N 495.919 5.311 5 20 JKBD O=C(Cc1cc(F)ccc1[N+](=O)[O-])NC1(c2ccc(NC(=O)c3cccc4ncccc34)cc2)CCC1 1788906332 JDLWZNZGVIHMCC-UHFFFAOYSA-N 498.514 5.273 5 20 JKBD COc1cc(CC(=O)Nc2ccc(C3(NC(=O)CCC=C(C)C)CCC3)cc2)ccc1[N+](=O)[O-] 1790479180 AXNKPRRXYQFUIR-UHFFFAOYSA-N 465.550 5.026 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)C3CC4(CCC4)C3)CCC2)cc1)c1ccc([N+](=O)[O-])cc1F 1790625155 VCEPHDAWAFVEFZ-UHFFFAOYSA-N 451.498 5.062 5 20 JKBD Cc1c(C(=O)Nc2ccc(C3(NC(=O)C[C@H]4CCCCO4)CCC3)cc2)cc(Cl)cc1[N+](=O)[O-] 1790773621 DHFIFLVKTKHWOA-HXUWFJFHSA-N 485.968 5.264 5 20 JKBD O=C(/C=C/c1ccc([N+](=O)[O-])o1)NC1(c2ccc(NC(=O)c3cc4ccsc4[nH]3)cc2)CCC1 1790876126 PIDCJFQDPYGMGL-SOFGYWHQSA-N 476.514 5.192 5 20 JKBD Cc1ccc(CC(=O)NC2(c3ccc(NC(=O)c4onc5ccccc45)cc3)CCC2)cc1[N+](=O)[O-] 1790906914 HNVPCRBEWOGOSX-UHFFFAOYSA-N 484.512 5.035 5 20 JKBD O=C(Nc1cc([C@@H]2CCCCN2C(=O)[C@@H]2CCC[C@@H]3CCCC[C@@H]32)[nH]n1)c1cccc(F)c1[N+](=O)[O-] 1821169434 HKFLNQNKKLZKEO-AYMMHLMVSA-N 497.571 5.369 5 20 JKBD O=C(c1ccc(F)s1)N1CCC([C@@H]2CCCCN2C(=O)C2(c3cccc([N+](=O)[O-])c3)CCC2)CC1 1830291219 IZBJZLJTQSOIHK-NRFANRHFSA-N 499.608 5.151 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)N1CCCC[C@H]1C1CCN(C(=O)[C@]2(C)CC=CCC2)CC1 1830729737 VTORSHKSMCGJFZ-BKMJKUGQSA-N 471.573 5.022 5 20 JKBD CCc1ncccc1C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cc(Cl)cc([N+](=O)[O-])c2C)CC1 1830734531 MMDZQMGZJARFLY-QHCPKHFHSA-N 499.011 5.061 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cccc3ccoc23)CC1 1830991188 XXLZYWPHYAWRMH-QHCPKHFHSA-N 493.535 5.336 5 20 JKBD O=C(O[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1)c1ccc(Cl)s1 9484373 APVUJIQORHWIPJ-QGZVFWFLSA-N 451.287 5.500 5 20 JKBD O=C(Cn1c2ccccc2c(=O)c2ccccc21)Nc1nc2ccc(SC(F)F)cc2s1 11247652 WCCXWQUDHCCITE-UHFFFAOYSA-N 467.522 5.718 5 20 JKBD Cc1ccc(NC(=O)[C@@H](Sc2nnc(-c3cccs3)o2)c2ccccc2)c([N+](=O)[O-])c1 11389788 SLAPJQDJEOQEKZ-SFHVURJKSA-N 452.517 5.487 5 20 JKBD Cc1nn(Cc2ccc(C(=O)Nc3ccc(Br)cc3Cl)cc2)c(C)c1[N+](=O)[O-] 20007696 HVTBMPMMLGEDIR-UHFFFAOYSA-N 463.719 5.125 5 20 JKBD COc1ccc(-c2n[nH]c(S[C@H](C(=O)Nc3ccc(C)cc3[N+](=O)[O-])c3ccccc3)n2)cc1 36803531 AOHYDRCFMOSMJO-NRFANRHFSA-N 475.530 5.169 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)Nc2ccc3[nH]c(-c4cc(F)ccc4F)nc3c2)cc1SC 303145327 DPMUAFPTSPCBIE-UHFFFAOYSA-N 470.457 5.399 5 20 JKBD CSc1ccc(C(=O)N2CCC(N(C)Cc3cccc(C(F)(F)F)c3)CC2)cc1[N+](=O)[O-] 490113308 RZGCZVCWBMDZRP-UHFFFAOYSA-N 467.513 5.072 5 20 JKBD O=C(Cn1c(=O)oc2cc([N+](=O)[O-])ccc21)N(c1cccc(Cl)c1)c1nc2ccccc2s1 495902011 JLVUAIMZQKNHDZ-UHFFFAOYSA-N 480.889 5.131 5 20 JKBD CC[C@@H](C)Sc1ccc(NC(=O)c2cc(OC)c(OC)cc2[N+](=O)[O-])c(C(F)(F)F)c1 499581893 OYCXSKZDFDBWRZ-LLVKDONJSA-N 458.458 5.774 5 20 JKBD CN(C)C(=O)COc1cccc(NC(=O)c2cc([N+](=O)[O-])ccc2Sc2ccc(Cl)cc2)c1 501920473 UYGVIBNVFNMTCT-UHFFFAOYSA-N 485.949 5.119 5 20 JKBD Cn1cc(C(=O)Nc2cc(C(F)(F)F)cc(C(F)(F)F)c2)c(-c2ccc([N+](=O)[O-])cc2)n1 506063237 DDQRZSYKPABQKK-UHFFFAOYSA-N 458.318 5.285 5 20 JKBD Cc1cccc(Oc2ncccc2NC(=O)c2ccc(N[C@H](C)c3ccccn3)c([N+](=O)[O-])c2)c1C 512566338 SSCHNRYWXPSHPA-LJQANCHMSA-N 483.528 6.219 5 20 JKBD Cc1sc(CNC(=O)[C@@H](C)Oc2ccc(Cl)cc2[N+](=O)[O-])nc1-c1ccc(Cl)cc1 520473467 GSHZQXZTUYCHQB-LLVKDONJSA-N 466.346 5.417 5 20 JKBD CN(C[C@@H]1CCCOC1)C(=O)c1c2c(nc3ccccc13)/C(=C/c1ccc([N+](=O)[O-])cc1)CCC2 521683999 LVTNCSWZIPNTSD-PVKQIQIRSA-N 471.557 5.519 5 20 JKBD Cc1ccc([C@H]2CCCN2C(=O)C2CCN(c3ccc(C(F)(F)F)cc3[N+](=O)[O-])CC2)cc1 603459856 VHKOUWVXUNVMPP-HXUWFJFHSA-N 461.484 5.502 5 20 JKBD COCCN(C(=O)c1ccc(-c2ccccc2)cc1)c1nc(-c2ccc([N+](=O)[O-])cc2)cs1 603461288 LGWAMUUFDASSFQ-UHFFFAOYSA-N 459.527 5.679 5 20 JKBD COc1cc(NC(=O)c2ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])c(OC)c2)ccc1NC(C)=O 603775257 ZKSNVOFQOYUCIV-UHFFFAOYSA-N 485.880 5.268 5 20 JKBD O=C(NCc1ccccc1[N+](=O)[O-])N[C@H](c1ccccc1)c1ccc(Br)cc1F 604076765 RQOSOXJIRRLXOA-HXUWFJFHSA-N 458.287 5.085 5 20 JKBD CC(C)CN(CCc1ccc(F)cc1)C(=O)c1ccc(N[C@H](C)c2ccccn2)c([N+](=O)[O-])c1 604301727 PAYOTXOFKVGWSE-LJQANCHMSA-N 464.541 5.643 5 20 JKBD O=C(c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1)N1CCC(Nc2ccc(F)cc2)CC1 609027072 IPBWXUPWOZJHTM-UHFFFAOYSA-N 469.900 5.896 5 20 JKBD O=C(O[C@H](C(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1)c1ccccc1)c1csc(-c2ccoc2)n1 731090837 JBRNBSDLLKRGAS-IBGZPJMESA-N 483.889 5.502 5 20 JKBD COC(=O)c1c(-c2ccccc2Cl)csc1NC(=O)c1cc(OC)c(OC)cc1[N+](=O)[O-] 747614038 AEIZFSVLQINUJD-UHFFFAOYSA-N 476.894 5.033 5 20 JKBD CC(C)(C)C[C@@H](NC(=O)COC(=O)c1csc(-c2ccc([N+](=O)[O-])cc2)n1)c1ccc(F)cc1 747955502 SMRXYACCFBIWHE-LJQANCHMSA-N 485.537 5.308 5 20 JKBD Cc1ccccc1-c1ccc(CN(Cn2nc(-c3cccc([N+](=O)[O-])c3)ccc2=O)C(C)C)s1 748302775 HIQZQOSKBYCDJG-UHFFFAOYSA-N 474.586 5.724 5 20 JKBD CC1CCN(c2ccc(C(=O)Nc3cc(NC(=O)OC(C)(C)C)ccc3F)cc2[N+](=O)[O-])CC1 918600668 QFVSKDVZJHTDRH-UHFFFAOYSA-N 472.517 5.570 5 20 JKBD COc1ccc([C@H](Cc2ccccc2C)NC(=O)c2cc([N+](=O)[O-])ccc2Cl)cc1OC 921284895 MRSDAQCVGBMOMM-NRFANRHFSA-N 454.910 5.288 5 20 JKBD O=C(NC1(c2ccc(NC(=O)c3ccc([N+](=O)[O-])o3)cc2)CCC1)c1cnc2cccc(Cl)c2c1 1785751117 PSGOWOFJUBNRSF-UHFFFAOYSA-N 490.903 5.451 5 20 JKBD O=C(CCc1cccc([N+](=O)[O-])c1)NC1(c2ccc(NC(=O)[C@@H]3CCc4ccoc4C3)cc2)CCC1 1786212892 JADPXCGTLSFQEC-OAQYLSRUSA-N 487.556 5.060 5 20 JKBD Cc1ncccc1CCC(=O)Nc1ccc(C2(NC(=O)c3c(F)ccc([N+](=O)[O-])c3C)CCC2)cc1 1786745392 KVJMYUFNPRUGTE-UHFFFAOYSA-N 490.535 5.126 5 20 JKBD Cc1c(C(=O)Nc2ccc(C3(NC(=O)c4ccc([N+](=O)[O-])o4)CCC3)cc2)oc2ccccc12 1788966149 NWTURHJONYDWRL-UHFFFAOYSA-N 459.458 5.304 5 20 JKBD CN(C)c1ccc(C(=O)Nc2ccc(C3(NC(=O)c4ccc([N+](=O)[O-])[nH]4)CCC3)cc2)c2ccccc12 1788991180 YEIKTVQIHOCGEN-UHFFFAOYSA-N 497.555 5.204 5 20 JKBD Cc1noc(C)c1C(=O)NC1(c2ccc(NC(=O)c3cc(Cl)cc([N+](=O)[O-])c3C)cc2)CCC1 1790774629 UEXLLINXBDGJHR-UHFFFAOYSA-N 482.924 5.223 5 20 JKBD COc1cc(CC(=O)NC2(c3ccc(NC(=O)c4ccc5ccoc5c4)cc3)CCC2)ccc1[N+](=O)[O-] 1790892806 WHPSSVKGVFDSOC-UHFFFAOYSA-N 499.523 5.340 5 20 JKBD CC[C@H]1CC[C@H](C(=O)N2CCC([C@@H]3CCCCN3C(=O)/C=C/c3ccc([N+](=O)[O-])o3)CC2)CC1 1824278279 DNIBDKDHLGTCGX-QHXBOCPTSA-N 471.598 5.037 5 20 JKBD O=C(c1cccc(F)c1Cl)N1CCC([C@@H]2CCCCN2C(=O)c2cc(F)cc([N+](=O)[O-])c2)CC1 1830618381 YYYIRGNPFGROIF-NRFANRHFSA-N 491.922 5.074 5 20 JKBD COc1cc(C(=O)N2CCC([C@@H]3CCCCN3C(=O)c3ccc(C4CC4)cc3)CC2)ccc1[N+](=O)[O-] 1830752615 PMVGFYXTBNWOFA-DEOSSOPVSA-N 491.588 5.028 5 20 JKBD O=C(/C=C/c1ccc([N+](=O)[O-])o1)N1CCC([C@H]2CCCCN2C(=O)c2ccccc2C2CC2)CC1 1832554672 PUPOZYMHKOZHHO-IYNHSRRRSA-N 477.561 5.012 5 20 JKBD Cc1c(Cl)ccc(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3ccc([N+](=O)[O-])o3)CC2)c1Cl 1832562675 KIZIVTLALWDVSR-GOSISDBHSA-N 494.375 5.350 5 20 JKBD COc1cc(C(=O)N2CCCC[C@H]2C2CCN(C(=O)c3ccc(C)c(Cl)c3)CC2)ccc1[N+](=O)[O-] 1832694580 LZOAMRJIMSOJFQ-QFIPXVFZSA-N 499.995 5.112 5 20 JKBD CCCCC[C@@H](C)C(=O)N1CCC([C@H]2CCCCN2C(=O)c2ccc([N+](=O)[O-])c(OC)c2)CC1 1832696636 DAMPMOLZWOBJGX-DENIHFKCSA-N 473.614 5.053 5 20 JKBD Cc1cccc([N+](=O)[O-])c1NC(=O)COC(=O)c1c2c(nc3ccccc13)/C(=C/c1ccco1)CCC2 8632607 IXUVKFWPUUKANQ-OBGWFSINSA-N 497.507 5.717 5 20 JKBD O=C(CSc1nnc(-c2ccccc2F)n1Cc1ccccc1)Nc1ccc([N+](=O)[O-])cc1Cl 9330636 INWJXXHPNHDSRC-UHFFFAOYSA-N 497.939 5.425 5 20 JKBD Cc1ccc(NC(=O)[C@H](Sc2nc(Cc3cccs3)n[nH]2)c2ccccc2)c([N+](=O)[O-])c1 11600615 GXXRBDPLLYWKKA-HXUWFJFHSA-N 465.560 5.146 5 20 JKBD Cc1nc(-c2cccc(Cl)c2)sc1C(=O)OCC(=O)Nc1cc([N+](=O)[O-])ccc1Cl 17955977 ICPCQCBGGYYOBQ-UHFFFAOYSA-N 466.302 5.129 5 20 JKBD COc1cc2c(cc1OC)[C@H](c1cccs1)N(C(=O)c1cc(SC)ccc1[N+](=O)[O-])CC2 24475942 GZXRUEQWLRIJAA-JOCHJYFZSA-N 470.572 5.183 5 20 JKBD CCn1cnnc1-c1cccc(NC(=O)c2ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])cc2)c1 25278749 AHBKBFXFXIWFAD-UHFFFAOYSA-N 463.881 5.571 5 20 JKBD Cn1c(S[C@@H](C(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)c2ccccc2)nc2ccsc2c1=O 26100928 IRYXREJLQXHTHU-QGZVFWFLSA-N 486.962 5.029 5 20 JKBD COc1ccc([N+](=O)[O-])cc1NC(=O)CCSc1nnc(-c2ccc(F)cc2)n1-c1ccccc1 26368878 JBWLVLXHEDTQIL-UHFFFAOYSA-N 493.520 5.111 5 20 JKBD C[C@@H](OC(=O)Cc1csc(-c2ccccc2Cl)n1)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl 26674593 DXUXUOXPWCJDGI-LLVKDONJSA-N 480.329 5.138 5 20 JKBD C[C@@H](c1nc2ccccc2s1)N1CCN(C(=O)c2ccc(C(C)(C)C)c([N+](=O)[O-])c2)CC1 29928470 UOZAKRHMIGTFOI-INIZCTEOSA-N 452.580 5.021 5 20 JKBD COC(=O)CCCN(C)C(=O)c1c2c(nc3ccccc13)/C(=C/c1ccc([N+](=O)[O-])cc1)CCC2 32278454 CQUSZFSLDFTDQL-HTXNQAPBSA-N 473.529 5.045 5 20 JKBD C[C@@H](Sc1nc(-c2ccco2)nc2ccccc12)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl 45677319 GCQPJQCCVFZGPV-GFCCVEGCSA-N 454.895 5.571 5 20 JKBD C[C@H](NC(=O)c1ccc(NS(=O)(=O)c2cc(Cl)ccc2Cl)cc1)c1cccc([N+](=O)[O-])c1 108456861 GQRPVGCRQKUBFT-ZDUSSCGKSA-N 494.356 5.193 5 20 JKBD CC(C)(C)OC(=O)NCC1CCN(C(=O)c2ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])cc2)CC1 109785334 DQXMVBYKWJBRQE-UHFFFAOYSA-N 489.956 5.417 5 20 JKBD O=C(c1csc(-c2cccc([N+](=O)[O-])c2)n1)N(C[C@@H]1CCCO1)c1ccc(Br)cc1 215729298 DRZPWQGVPWDDTA-SFHVURJKSA-N 488.363 5.307 5 20 JKBD CCN(Cc1ccc(Cl)s1)C(=O)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 248252919 NACMCYIRLRNDEV-UHFFFAOYSA-N 475.920 5.594 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)N(CCc2ccccc2)c2nc3ccccc3s2)cc1SC 482163880 NQKWUMJXOSRHSQ-UHFFFAOYSA-N 479.583 5.825 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)Nc2cc(C(=O)N3C[C@H](C)C[C@@H](C)C3)ccc2C)cc1SC 482785242 YWRIRCVMQQGYHR-HUUCEWRRSA-N 471.579 5.004 5 20 JKBD CCC(=O)Nc1ccc(Cl)c(NC(=O)c2ccc(N3C[C@@H](C)C[C@@H](C)C3)c([N+](=O)[O-])c2)c1 488564616 DVCBIDZBWYDLJM-GASCZTMLSA-N 458.946 5.331 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Cl)[C@H](NC[C@@H]1CCCN(Cc2cccs2)C1)c1ccccc1 493886916 YWGNFASUSDFYPL-MHECFPHRSA-N 499.036 5.491 5 20 JKBD CN(CCc1ccncc1)C(=O)c1c2c(nc3ccccc13)/C(=C/c1cccc([N+](=O)[O-])c1)CCC2 499947397 TVHXXZATXRADIS-RELWKKBWSA-N 478.552 5.730 5 20 JKBD CCN(Cc1ccc(-c2ccc(C(F)(F)F)cc2)o1)Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1 513417638 XFSRRHVTPGBLIF-UHFFFAOYSA-N 472.423 5.946 5 20 JKBD CN(C(=O)c1ccc(NC(=O)c2ccc(N3CCCC3)c([N+](=O)[O-])c2)cc1Cl)C1CCCCC1 515442636 XYPFIQUKHROQQS-UHFFFAOYSA-N 484.984 5.505 5 20 JKBD C[C@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)NCc1ccc(-c2nc3ccccc3s2)o1 520388933 NKZFFXSJGMVQGG-LBPRGKRZSA-N 457.895 5.202 5 20 JKBD COc1cc(C(=O)N[C@@H](c2ccc(F)cc2)C2CCC2)c([N+](=O)[O-])cc1OCc1cscn1 521533255 AFNXRJQSLZEKKK-JOCHJYFZSA-N 471.510 5.049 5 20 JKBD C[C@@H](c1ccccc1F)N(C)C(=O)c1ccc(C(=O)N(C)[C@H](C)c2ccccc2F)c([N+](=O)[O-])c1 524353036 HWCIVJJZMFEDJS-DLBZAZTESA-N 481.499 5.539 5 20 JKBD Cc1nc(-c2ccc([C@H](C)NC(=O)c3cc(OCC(F)(F)F)ccc3[N+](=O)[O-])cc2)cs1 603737642 UBDZLMOURNWNBU-LBPRGKRZSA-N 465.453 5.459 5 20 JKBD COc1cc(C(=O)Nc2ccccc2-n2ccnc2)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 603883242 LWVBDISLFARDAF-UHFFFAOYSA-N 464.865 5.487 5 20 JKBD CNC(=O)c1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2Sc2ccc(Cl)cc2)cc1Cl 604013506 LLYOJPFSFFHBCE-UHFFFAOYSA-N 476.341 5.665 5 20 JKBD COc1cc(C(=O)Nc2ccccc2SCC(F)(F)F)c([N+](=O)[O-])cc1OCc1cscn1 604384928 QWBFATXHOLCSEB-UHFFFAOYSA-N 499.492 5.546 5 20 JKBD CCOc1ccc(C(=O)Nc2cc(C(=O)Nc3cccc(C(F)(F)F)c3)ccc2C)cc1[N+](=O)[O-] 604449364 GTKUWQHOPYZRRS-UHFFFAOYSA-N 487.434 5.825 5 20 JKBD COc1cc(C(=O)Nc2ccc3nc(NC(=O)c4ccc(C)s4)sc3c2)ccc1[N+](=O)[O-] 608817755 BKYZKSLGENFPJU-UHFFFAOYSA-N 468.516 5.088 5 20 JKBD O=C(c1csc(-c2ccc([N+](=O)[O-])cc2)n1)N1CCO[C@H](c2ccc(Cl)c(Cl)c2)C1 608965580 ZNTKKFKTMOWFJE-SFHVURJKSA-N 464.330 5.239 5 20 JKBD CCC(CC)c1cc[n+](/C(C(=S)Nc2cnn(CC)c2)=C(/O)c2ccc([N+](=O)[O-])cc2)cc1 726179795 PNYCRLULDDDUBV-UHFFFAOYSA-O 466.587 5.326 5 20 JKBD Cc1cc[n+](/C(C(=S)NCCc2ccc(Cl)cc2Cl)=C(/O)c2ccc([N+](=O)[O-])cc2)cc1 726573390 ZJDLLGDOYXMSDX-UHFFFAOYSA-O 489.404 5.541 5 20 JKBD Cc1c(NC(=O)CC2(CC(=O)Nc3cccc([N+](=O)[O-])c3C)CCCCC2)cccc1[N+](=O)[O-] 729825034 IQPXBAXVRJJJFR-UHFFFAOYSA-N 468.510 5.428 5 20 JKBD O=C(CCc1nnc(-c2ccccc2)o1)Oc1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2Cl)cc1 750653905 QWKYHQVYCZBACM-UHFFFAOYSA-N 492.875 5.089 5 20 JKBD O=C(Nc1cc(-c2ccoc2)nn1-c1ccccc1)c1cc([N+](=O)[O-])ccc1Br 751116798 GPBRIYBBUFFSST-UHFFFAOYSA-N 453.252 5.055 5 20 JKBD COc1ccc(OC(=O)[C@@H](C)SCc2nc(O)c3c(-c4ccccc4)csc3n2)c([N+](=O)[O-])c1 818029200 PFHAYOIGGJTOID-CYBMUJFWSA-N 497.554 5.208 5 20 JKBD Cc1ccc(NC(=O)C2=S=C(/C(Cl)=C\c3ccc(-c4cccc([N+](=O)[O-])c4)o3)N=N2)cc1 844255481 DDYPEMXQVZTXJU-LDADJPATSA-N 466.906 5.840 5 20 JKBD COc1ccc(-c2noc(C3CCN(c4ccc(C(F)(F)F)cc4[N+](=O)[O-])CC3)n2)cc1OC 904285684 YGQXGNDOCIYBCE-UHFFFAOYSA-N 478.427 5.065 5 20 JKBD Cc1cc(Cc2cnc(NC(=O)c3cc(Cl)ccc3[N+](=O)[O-])s2)ccc1Br 916071560 GHBOXLWHNNHHQJ-UHFFFAOYSA-N 466.744 5.619 5 20 JKBD COc1cc(/C=C/C(=O)O[C@@H](C)c2ccccc2[N+](=O)[O-])ccc1OCc1c(C)noc1C 920268050 MGIXXKUPAPVPTG-TYZQSYOASA-N 452.463 5.105 5 20 JKBD O=C(Nc1ccccc1SC[C@@H]1CC1(Cl)Cl)c1ccn(-c2ccc([N+](=O)[O-])cc2)n1 921281486 SGODYQVVHVSLID-ZDUSSCGKSA-N 463.346 5.319 5 20 JKBD Cc1nn(-c2ccccc2)c(C)c1C(=O)Oc1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2Cl)cc1 923385937 CSNKXJZHGAXBIF-UHFFFAOYSA-N 490.903 5.522 5 20 JKBD Cc1cc(C(=O)Nc2ccc(C3(NC(=O)c4ccc(Br)c([N+](=O)[O-])c4)CCC3)cc2)c[nH]1 1788815058 GCJICIWZMDZSKK-UHFFFAOYSA-N 497.349 5.055 5 20 JKBD Cc1nc(F)ccc1C(=O)Nc1ccc(C2(NC(=O)Cc3ccc(Cl)cc3[N+](=O)[O-])CCC2)cc1 1789915734 PSYLQXABPCVDDQ-UHFFFAOYSA-N 496.926 5.081 5 20 JKBD Cc1ncsc1C(=O)NC1(c2ccc(NC(=O)C3(c4cccc([N+](=O)[O-])c4)CCC3)cc2)CCC1 1790476068 YGLCFJRBSJJMSY-UHFFFAOYSA-N 490.585 5.229 5 20 JKBD COc1ccc(C(=O)Nc2ccc(C3(NC(=O)c4cc(O)cc([N+](=O)[O-])c4)CCC3)cc2)cc1Cl 1792142971 VRDOKFCGBNAVAO-UHFFFAOYSA-N 495.919 5.024 5 20 JKBD CC[C@H]1CC[C@H](C(=O)Nc2cc([C@H]3CCCCN3C(=O)CCc3cccc([N+](=O)[O-])c3)[nH]n2)CC1 1822222969 CJLBUHJZDJHERP-KKLQWCBXSA-N 481.597 5.159 5 20 JKBD CC(C)[C@H]1CC[C@H](C(=O)N2CCCC[C@H]2C2CCN(C(=O)/C=C/c3ccc([N+](=O)[O-])o3)CC2)CC1 1831562293 MKEHRDHWZJSOSW-DRKSHDSUSA-N 485.625 5.283 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)N1CCC([C@@H]2CCCCN2C(=O)[C@@H]2CCc3ccccc32)CC1 1831980470 LHAIJQVUQYMEMU-RDGATRHJSA-N 493.579 5.006 5 20 JKBD Cc1ccc(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)/C=C/c3ccccc3[N+](=O)[O-])CC2)c(F)c1F 1832616880 UWYWEVLRVYEOIY-RSNBEDGSSA-N 497.542 5.128 5 20 JKBD O=C(CSc1ccc2ccccc2c1)Nc1c(Br)cc([N+](=O)[O-])cc1Br 10440041 FNZWEELRWANUPE-UHFFFAOYSA-N 496.180 6.004 5 20 JKBD CC[C@H](C)c1ccccc1NC(=O)[C@H](C)OC(=O)Cn1c2ccccc2c(=O)c2ccccc21 10722840 NOTAMPOOXPBJGA-OALUTQOASA-N 456.542 5.239 5 20 JKBD CCc1ccccc1N(C(C)=O)c1nc(COC(=O)/C=C/c2ccc([N+](=O)[O-])cc2)cs1 10757839 SLJIVTYMLCKHQL-JLHYYAGUSA-N 451.504 5.055 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Br)[C@H](N[C@@H]1CCSc2ccccc21)c1ccccc1 19669656 KRFYFFDLYRXCNM-DENIHFKCSA-N 498.402 5.864 5 20 JKBD CSc1cccc(NC(=O)COC(=O)c2ccc(Sc3nc(C)cs3)c([N+](=O)[O-])c2)c1 24221545 DUSFSMGNXHZXHW-UHFFFAOYSA-N 475.573 5.028 5 20 JKBD Cc1ccc([N+](=O)[O-])cc1NC(=O)c1cccnc1SCc1cccc(Br)c1 31744125 MDTAGEZOLPKHIP-UHFFFAOYSA-N 458.337 5.605 5 20 JKBD O=C(Cc1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1)N1CCCCC[C@H]1c1ccncc1 479276133 FVNKPGFDJICPBJ-SANMLTNESA-N 481.556 5.529 5 20 JKBD O=C(C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1)N1CCC(Nc2ccc(F)cc2)CC1 486496984 KNAVZTXABCAFDX-UHFFFAOYSA-N 494.489 5.072 5 20 JKBD Cc1cc(C(=O)NC(C)C)ccc1NC(=O)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1 489955637 JDLPGLROXCGLOP-UHFFFAOYSA-N 467.909 5.739 5 20 JKBD CCOC(=O)C1CCC(NC(=O)C/C(=C\c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)CC1 503104330 MFSGJYMVNRNFHZ-XDJHFCHBSA-N 493.585 5.373 5 20 JKBD Cc1sc(NC(=O)c2cnn(-c3ncccc3Cl)c2C(F)F)nc1-c1cccc([N+](=O)[O-])c1 503387468 VKBIVMKNGZNAKV-UHFFFAOYSA-N 490.879 5.451 5 20 JKBD CC1CCC(NS(=O)(=O)c2ccc(N[C@H](c3ccccc3)c3nccs3)c([N+](=O)[O-])c2)CC1 505559154 IDVGGROVEAZTST-CWZMJNCASA-N 486.619 5.110 5 20 JKBD Cc1ccc(NC(=O)c2ccc(N[C@@H](C)c3ccccn3)c([N+](=O)[O-])c2)cc1Br 506136118 KRCRZPCIIYVVRQ-AWEZNQCLSA-N 455.312 5.486 5 20 JKBD C[C@H](Nc1ccc(C(=O)N2CCC(=Cc3cccc(F)c3)CC2)cc1[N+](=O)[O-])c1ccccn1 507421405 DFGFGBOLIAPOKW-SFHVURJKSA-N 460.509 5.622 5 20 JKBD CCc1cc(O)nc(-c2cccc(NC(=O)c3ccc(N[C@H](C)c4ccccn4)c([N+](=O)[O-])c3)c2)n1 508931220 BUYJCEPPNJPHQB-MRXNPFEDSA-N 484.516 5.140 5 20 JKBD O=C(Nc1cccc(CNCc2ccc(Oc3ccc(F)cc3)c([N+](=O)[O-])c2)c1)C1CCCC1 513621345 FHYAKMXWNWQDJL-UHFFFAOYSA-N 463.509 5.945 5 20 JKBD C[C@@H]1CCCN(Cc2ccc(NC(=O)c3ccc(N[C@H](C)c4ccccn4)c([N+](=O)[O-])c3)cc2)C1 516172875 DSKJIGYXKSWQHQ-WOJBJXKFSA-N 473.577 5.647 5 20 JKBD C[C@H](Nc1cc(Cl)ccc1OC[C@@H]1CCCO1)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 518012790 CKDLOSRAUALADN-WFASDCNBSA-N 487.862 5.264 5 20 JKBD COCCOc1c(Cl)cccc1NC(=O)c1ccc(N[C@@H](C)c2ccccn2)c([N+](=O)[O-])c1 520011021 HEGKENRXXZBGJC-HNNXBMFYSA-N 470.913 5.094 5 20 JKBD COc1cc(C(=O)Nc2ccccc2-c2nc3ccccc3s2)c([N+](=O)[O-])cc1OC(F)F 585704862 WGRBIHIOQSDSPG-UHFFFAOYSA-N 471.441 5.734 5 20 JKBD COc1ccc([C@@H](NC(=O)c2cc(OCC(F)(F)F)ccc2[N+](=O)[O-])c2ccccc2)cc1 603732284 GUAUJIOTIAGISA-NRFANRHFSA-N 460.408 5.064 5 20 JKBD O=C(c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-])N1CCO[C@H](c2ccc(Cl)c(Cl)c2)C1 608965523 YXSSASRLLGOKIO-KRWDZBQOSA-N 479.238 5.056 5 20 JKBD CC(C)Oc1ccc([N+](=O)[O-])cc1CSc1nc(O)c2cnn(-c3cccc(Cl)c3)c2n1 609148841 JMBJOBCOOHCSSL-UHFFFAOYSA-N 471.926 5.162 5 20 JKBD CCOc1cccc2cc([C@@H](C)N[C@@H](C)C(=O)Nc3ccc([N+](=O)[O-])cc3C(F)(F)F)oc12 610250141 DYRISNBZZVWSAK-OLZOCXBDSA-N 465.428 5.436 5 20 JKBD CSc1ccc([N+](=O)[O-])c(C(=O)O[C@H](C)C(=O)N2c3ccccc3Sc3ccccc32)c1 857840333 NTHFVSSOTUWEHS-CQSZACIVSA-N 466.540 5.692 5 20 JKBD CC(C)(NC(=O)c1cccc(Cl)c1)c1noc(-c2ccnc(-c3ccccc3)c2[N+](=O)[O-])n1 904599954 WKELPRJZWVIBAZ-UHFFFAOYSA-N 463.881 5.025 5 20 JKBD CSc1ccc(C(=O)O[C@H](C(=O)Nc2ccccc2C(F)(F)F)C(C)C)cc1[N+](=O)[O-] 915367452 XPJUWJRLAVSDML-KRWDZBQOSA-N 456.442 5.156 5 20 JKBD CC(=O)N(c1ccc(C(F)(F)F)cc1)c1nc(COC(=O)Cc2ccccc2[N+](=O)[O-])cs1 920496238 XUZMXAXNJWWGBX-UHFFFAOYSA-N 479.436 5.041 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)c3ccc([N+](=O)[O-])o3)CCC2)cc1)c1cc2ccc(Cl)cc2[nH]1 1785790495 BNPURFCPHIZVSD-UHFFFAOYSA-N 478.892 5.384 5 20 JKBD CCCCC[C@@H](C)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc2cc([N+](=O)[O-])ccc2s1 1801206802 IOCVRVNLBOXESC-OQIJWPOYSA-N 457.596 5.278 5 20 JKBD COc1cc(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)CC3CCC(C)(C)CC3)n[nH]2)ccc1[N+](=O)[O-] 1820979559 PZPQQWOLBZGVHA-HXUWFJFHSA-N 497.596 5.239 5 20 JKBD CC(C)c1ccc(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)c3ccc([N+](=O)[O-])cc3F)n[nH]2)cc1 1821052882 OFMBCQMRMCXXTB-JOCHJYFZSA-N 479.512 5.200 5 20 JKBD O=C(c1cc2ccsc2[nH]1)N1CCC([C@H]2CCCCN2C(=O)CCc2cccc([N+](=O)[O-])c2)CC1 1824843108 OICYTUMGXZLLHB-HSZRJFAPSA-N 494.617 5.004 5 20 JKBD O=C(/C=C/c1ccccc1[N+](=O)[O-])N1CCCC[C@H]1C1CCN(C(=O)C23CCC(CC2)CC3)CC1 1832904212 PCEFRAVMJYJIKC-DTEJCLQWSA-N 479.621 5.198 5 20 JKBD Cc1csc(Sc2ccc(C(=O)NCc3ccc(C(=O)N4CCCCC4)cc3)cc2[N+](=O)[O-])n1 10460079 HOEPILBQIFZASI-UHFFFAOYSA-N 496.614 5.067 5 20 JKBD C[C@H](NC(=O)[C@@H](C)OC(=O)Cn1c2ccccc2c(=O)c2ccccc21)c1ccc(Cl)cc1Cl 10722921 RGMZHLQTSCSZMI-JKSUJKDBSA-N 497.378 5.271 5 20 JKBD C[C@H](OC(=O)/C=C/c1ccc(-c2ccc(F)cc2)s1)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 11374122 JRGMHMNASYYBKT-CMPYXILNSA-N 465.462 5.830 5 20 JKBD COCCOc1cc([N+](=O)[O-])c(C(=O)Nc2ccc(Cc3nc4ccccc4s3)cc2)cc1OC 28731305 AOCGNHZHCGEAOU-UHFFFAOYSA-N 493.541 5.081 5 20 JKBD O=C(Nc1ccccc1C(=O)NCCc1ccc(C(F)(F)F)cc1)c1ccc([N+](=O)[O-])cc1Cl 36702527 QCFSWMZHEOPYJX-UHFFFAOYSA-N 491.853 5.492 5 20 JKBD COc1cc(C(=O)Nc2cc(C)nn2C(C)(C)C)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 107648605 RRPYDUGRBXTPKB-UHFFFAOYSA-N 458.902 5.561 5 20 JKBD COc1ccccc1C[C@H]1CCCN1C(=O)c1ccc(Sc2nc(C)cs2)c([N+](=O)[O-])c1 302989712 MGQZUVXURUVSJX-GOSISDBHSA-N 469.588 5.367 5 20 JKBD C[C@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)N[C@H]1CCCc2nc(-c3ccc(F)cc3)sc21 303258190 OSYZCSJOFBWMEF-UGSOOPFHSA-N 457.552 5.532 5 20 JKBD COc1ccc(CNC(=O)c2cc([N+](=O)[O-])ccc2Sc2ccc(Cl)cc2)c(OC)c1OC 498381935 AEEPWZYIUWLJIR-UHFFFAOYSA-N 488.949 5.355 5 20 JKBD COc1cc([C@@H](C)NC(=O)Cn2ccc3cc([N+](=O)[O-])ccc32)ccc1OCc1ccccc1 498724430 IZTWVSDAXOWRFR-GOSISDBHSA-N 459.502 5.015 5 20 JKBD O=C(NC(c1ccc(F)cc1)c1ccc(F)cc1)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-] 511585441 BSAGJUGZLSLQCN-UHFFFAOYSA-N 466.362 5.334 5 20 JKBD COc1ccc(Br)cc1-c1nc(CS(=O)(=O)[C@@H](C)c2cccc([N+](=O)[O-])c2)cs1 518480842 FGGMNFGSRWINEE-LBPRGKRZSA-N 497.392 5.165 5 20 JKBD COc1ccc(C)cc1-c1csc(NC(=O)c2csc(-c3ccc([N+](=O)[O-])cc3)n2)n1 522636566 DYWAXIHYADBLGD-UHFFFAOYSA-N 452.517 5.411 5 20 JKBD Cc1cnn([C@H]2CCCc3ccccc32)c1NC(=O)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-] 524377699 NDZHCJOUOSNOHZ-IBGZPJMESA-N 474.439 5.219 5 20 JKBD Cn1ccnc1[C@@H](NCc1ccc(Oc2ccc(F)cc2)c([N+](=O)[O-])c1)c1ccc(F)cc1 603633411 DAZXUBUEUKMWDG-QHCPKHFHSA-N 450.445 5.278 5 20 JKBD O=C(c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-])N1CCC[C@H]1c1nc2ccccc2s1 603729622 JMHOXPOTFUKAEB-INIZCTEOSA-N 451.426 5.123 5 20 JKBD O=C(Nc1cc(OCC(F)(F)F)cc(OCC(F)(F)F)c1)c1c[nH]c2cc([N+](=O)[O-])ccc12 604077310 KXCQIQCLTCFKKU-UHFFFAOYSA-N 477.317 5.211 5 20 JKBD COC(=O)c1ccoc1COc1cccc2c1N(C(=O)[C@H](C)Sc1ccc([N+](=O)[O-])cc1)CCC2 608947301 NHEKDAOTXCYWBG-INIZCTEOSA-N 496.541 5.013 5 20 JKBD Cc1occc1C(=O)Nc1nc(CC(=O)Nc2c3ccccc3n3c(C)nc4ccccc4c23)cs1 643113564 GCELWOJWZOOZIX-UHFFFAOYSA-N 495.564 5.741 5 20 JKBD COC(=O)c1c(-c2ccccc2Cl)csc1NC(=O)c1cc(SC)c(OC)cc1[N+](=O)[O-] 728461387 ZYEXAPRCVGCONK-UHFFFAOYSA-N 492.962 5.746 5 20 JKBD O=C(Nc1ccccc1)c1cccc(COC(=O)c2csc(-c3cccc([N+](=O)[O-])c3)n2)c1 747956608 XFQKTRRIESPKLS-UHFFFAOYSA-N 459.483 5.328 5 20 JKBD O=C(Cc1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1)OCc1ncc(-c2ccccc2)o1 750484706 CRIITRANPHXDIQ-UHFFFAOYSA-N 480.480 5.388 5 20 JKBD O=C(OCc1ncc(-c2ccccc2)o1)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 825345402 KKTYHZDFRVKJON-UHFFFAOYSA-N 475.423 5.228 5 20 JKBD O=c1c2ccccc2n(Cc2nc(-c3cccc(OCc4cccnc4)c3)no2)c2ccccc12 904500790 MPBQAJBHRRGXIL-UHFFFAOYSA-N 460.493 5.227 5 20 JKBD O=C(c1ccc([N+](=O)[O-])s1)N1CCC[C@@H]1c1nc(-c2cccc(Oc3ccccc3)c2)no1 904586767 FNQOFIDUAFOHME-GOSISDBHSA-N 462.487 5.476 5 20 JKBD O=C(Nc1ccc(NC(=O)c2cc(Cl)ccc2[N+](=O)[O-])c(C(F)(F)F)c1)c1ccccc1 915869798 HEVYNQDCSFTTEY-UHFFFAOYSA-N 463.799 5.772 5 20 JKBD COc1ccc(NC(=O)c2ccc(Br)c([N+](=O)[O-])c2)cc1NC(=O)c1cccc(F)c1 916057407 BSWRMFZJFRPCPD-UHFFFAOYSA-N 488.269 5.010 5 20 JKBD O=C(Nc1ccc(CN2CCOC2=O)cc1)c1ccc(NCc2ccccc2Cl)c([N+](=O)[O-])c1 917786296 QYTMMALHNUOEQM-UHFFFAOYSA-N 480.908 5.065 5 20 JKBD CC(=O)Nc1cccc(NC(=O)[C@@H](OC(=O)c2cc([N+](=O)[O-])ccc2Oc2ccccc2)C(C)C)c1 919193573 WSSYHBUETSJADR-DEOSSOPVSA-N 491.500 5.166 5 20 JKBD CCc1c(C(=O)O[C@@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2ccccc2)[nH]c(C)c1C(C)=O 919518763 XEFBHIUNLWDXIQ-JOCHJYFZSA-N 483.908 5.187 5 20 JKBD C[C@@H](Nc1ccc(C(=O)Nc2nc(COc3ccccc3)cs2)cc1[N+](=O)[O-])c1ccccn1 919680662 DWKJHOAISHQZBV-MRXNPFEDSA-N 475.530 5.451 5 20 JKBD C[C@@H](OC(=O)c1ccccc1N(C)C(=O)c1ccc(Br)o1)c1ccc([N+](=O)[O-])cc1 920158944 QZTXQWQUMUUGAM-CYBMUJFWSA-N 473.279 5.145 5 20 JKBD C[C@H](OC(=O)c1cnn(-c2ccc(Cl)cc2Cl)c1)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 920651477 GHARVCZIEXXFHH-NSHDSACASA-N 474.260 5.055 5 20 JKBD Cc1c(NC(=O)[C@@H](C)OC(=O)c2csc(-c3ccc(Cl)cc3Cl)n2)cccc1[N+](=O)[O-] 921223353 JFXYCVUFEYGSIT-LLVKDONJSA-N 480.329 5.518 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)C3(c4cccc([N+](=O)[O-])c4)CCC3)CCC2)cc1)[C@H]1CCC(F)(F)C1 1785804430 JOGHJCJKAVQEAS-SFHVURJKSA-N 497.542 5.586 5 20 JKBD Cn1ccc2cccc(C(=O)NC3(c4ccc(NC(=O)/C=C/c5ccc([N+](=O)[O-])o5)cc4)CCC3)c21 1786207541 XLOZSJCLXKMZEQ-ZRDIBKRKSA-N 484.512 5.141 5 20 JKBD Cc1nc(C(=O)Nc2ccc(C3(NC(=O)c4cc5cc([N+](=O)[O-])ccc5s4)CCC3)cc2)co1 1787395196 CKXCBQPGACFYRJ-UHFFFAOYSA-N 476.514 5.167 5 20 JKBD COc1ccc(CC(=O)Nc2ccc(C3(NC(=O)c4cccc5ccoc45)CCC3)cc2)c([N+](=O)[O-])c1 1790572360 WPJUZOCXYZLQBK-UHFFFAOYSA-N 499.523 5.340 5 20 JKBD Cc1cccc2[nH]c(C(=O)NC3(c4ccc(NC(=O)c5cc(O)cc([N+](=O)[O-])c5)cc4)CCC3)cc12 1790756163 PLCVIPQSBLFQTB-UHFFFAOYSA-N 484.512 5.152 5 20 JKBD O=C(NC1(c2ccc(NC(=O)C34CCC(CC3)CC4)cc2)CCC1)c1nc2cc([N+](=O)[O-])ccc2[nH]1 1791980743 JFEHFFCDWIKRBG-UHFFFAOYSA-N 487.560 5.189 5 20 JKBD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc([N+](=O)[O-])cc1F)c1sc2ccccc2c1Cl 1800349747 JWSPMDSKSWZNQU-BTTYYORXSA-N 487.940 5.168 5 20 JKBD Cc1c(Cl)cccc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc2cc([N+](=O)[O-])ccc2s1 1801206591 WIVVVJIISLJUPF-BJWYYQGGSA-N 483.977 5.337 5 20 JKBD Cc1cc(CCCC(=O)N2CCC3(CCCN(C(=O)CC(C)(C)C)C3)CC2)c([N+](=O)[O-])cc1F 1809033571 IVLGJHDHLRNMOQ-UHFFFAOYSA-N 475.605 5.032 5 20 JKBD O=C(/C=C/c1ccc([N+](=O)[O-])o1)Nc1cc([C@@H]2CCCCN2C(=O)[C@@H]2CCC[C@H]3CCCC[C@H]32)[nH]n1 1814967792 MXVVFNVFNAJTOT-FGKHOMNMSA-N 495.580 5.223 5 20 JKBD C[C@@H](CC(=O)Nc1cc([C@H]2CCCCN2C(=O)CCc2cccc([N+](=O)[O-])c2)[nH]n1)c1ccccc1 1822040955 HKLVLBKOLCDJNT-YADARESESA-N 489.576 5.137 5 20 JKBD CCc1ccc(C(=O)N2CCC([C@H]3CCCCN3C(=O)CSc3ccccc3[N+](=O)[O-])CC2)cc1 1831777337 PQFPBJJSOLBJSM-HSZRJFAPSA-N 495.645 5.183 5 20 JKBD C[C@H]1CC[C@H](C(=O)N2CCCC[C@H]2C2CCN(C(=O)/C=C/c3ccccc3[N+](=O)[O-])CC2)CC1 1832373531 QWUGZVZXOUQEJS-AXYHNHOLSA-N 467.610 5.054 5 20 JKBD O=C(c1cc2cc([N+](=O)[O-])ccc2s1)N1CC2(CCCN2C(=O)[C@H]2CCc3cccc(Cl)c32)C1 1845867204 NOAJBGWZMFIVME-SFHVURJKSA-N 495.988 5.010 5 20 JKBD COc1cc(C(=O)N(C)CC(=O)Nc2ccc(C)cc2)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 15916885 IMHPYCXLKMRMQB-UHFFFAOYSA-N 483.908 5.068 5 20 JKBD COc1cc(C(=O)Nc2cccc(C(=O)N(C)C)c2)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 21138630 SJMNRVLERGOCNS-UHFFFAOYSA-N 469.881 5.003 5 20 JKBD O=C(Cc1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1)Nc1cccc(OC[C@@H]2CCCO2)c1 31265818 VMWCOQQGPTWXBV-SANMLTNESA-N 498.539 5.187 5 20 JKBD O=[N+]([O-])c1ccc(-c2noc(CSc3ncnc4scc(-c5ccc(F)cc5)c34)n2)cc1 46865042 HUVDRFXEEFLMLQ-UHFFFAOYSA-N 465.491 5.748 5 20 JKBD Cc1csc(Sc2ccc(C(=O)N3CCC(c4ccc(O)cc4)CC3)cc2[N+](=O)[O-])n1 247984677 YVUCIPLZVXJKMM-UHFFFAOYSA-N 455.561 5.236 5 20 JKBD O=C(Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1)c1cc(N2CCCC2=O)cc(C(F)(F)F)c1 476580399 CYKIGHFUMLUYFF-UHFFFAOYSA-N 476.436 5.116 5 20 JKBD Cc1cc(C(=O)N2CCCC2)ccc1NC(=O)c1ccc(SCCC(C)C)c([N+](=O)[O-])c1 498467288 WXCRNZMHUNPSRN-UHFFFAOYSA-N 455.580 5.530 5 20 JKBD CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)c1oc2ccccc2c1CSc1ncccn1 499453484 GXRYBRPMFFVOKD-UHFFFAOYSA-N 462.531 5.474 5 20 JKBD CCOc1cc([N+](=O)[O-])c(C(=O)N[C@H](c2ccc(C(C)C)cc2)c2cccs2)cc1OC 512480727 PYEGNHFBILAROY-HSZRJFAPSA-N 454.548 5.706 5 20 JKBD COc1cc(CN[C@@H](C)c2cccc([N+](=O)[O-])c2)cc(Br)c1OCc1ccccc1 513110761 SUGNSIDZAGNHAT-INIZCTEOSA-N 471.351 5.796 5 20 JKBD CCOc1ccc(NC(=O)c2ccc(NC(=O)[C@@H](C)Oc3ccc(Cl)cc3[N+](=O)[O-])cc2)cc1 518829274 KHPYVMKIXGMHBQ-OAHLLOKOSA-N 483.908 5.305 5 20 JKBD COc1ccccc1Oc1ccc(NC(=O)[C@H]2CCCN2C(=O)c2ccc([N+](=O)[O-])c(C)c2)cc1F 523258024 TVFVJSUUWIDRIC-OAQYLSRUSA-N 493.491 5.087 5 20 JKBD COc1cc(C(=O)N(Cc2ccccc2)Cc2ccccc2)c([N+](=O)[O-])cc1OCc1cscn1 560796350 LDHONEKPHWAMAI-UHFFFAOYSA-N 489.553 5.482 5 20 JKBD Cc1cc(-c2cc(C(=O)Nc3cc4c(cc3[N+](=O)[O-])OCCCO4)c3cnn(C(C)C)c3n2)c(C)o1 590646898 VNLORPIPMVKWFU-UHFFFAOYSA-N 491.504 5.211 5 20 JKBD COCCN(C(=O)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1)[C@@H](C)c1ccccc1 603529017 BKGSTOAYVNTKOY-KRWDZBQOSA-N 479.499 5.066 5 20 JKBD COc1ccc(CSCC(=O)Nc2nc(-c3ccco3)c(-c3ccco3)s2)cc1[N+](=O)[O-] 603564610 QSZQWANPLHPIMC-UHFFFAOYSA-N 471.516 5.452 5 20 JKBD Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)Cc1ccc(NC(=O)c2ccc(Br)cc2)cc1 603751564 KHGXYGTVQDYVFC-UHFFFAOYSA-N 482.334 5.408 5 20 JKBD CCN(CC)[C@@H](CNC(=O)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1)c1ccsc1 603880660 RKZFNLKRKHKVOD-NRFANRHFSA-N 498.571 5.091 5 20 JKBD O=C(Nc1cccc(-c2cn3cccnc3n2)c1)c1cc([N+](=O)[O-])ccc1NCc1ccccc1 603980577 FQWBKMKMMOHWAT-UHFFFAOYSA-N 464.485 5.169 5 20 JKBD CC(C)NC(=O)c1ccc(NC(=O)c2ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])cc2)cc1 603993401 TXURNYTWHBKAMY-UHFFFAOYSA-N 453.882 5.431 5 20 JKBD COc1cc2c(cc1OC)[C@H](c1cccs1)N(C(=O)N[C@H](C)c1cccc([N+](=O)[O-])c1)CC2 604126283 LMOBZLHSDNQFRV-IQMFZBJNSA-N 467.547 5.092 5 20 JKBD O=C(Nc1ccc(Oc2ccc(F)cc2)c2ccncc12)c1cc2c(cc1[N+](=O)[O-])OCCO2 609032678 AYIKCBIPIDUSEZ-UHFFFAOYSA-N 461.405 5.098 5 20 JKBD Cc1ccc[n+](/C(C(=S)NCc2cccc(C(F)(F)F)c2)=C(/O)c2ccc([N+](=O)[O-])cc2)c1 726571252 VRYHAICHNZNVMJ-UHFFFAOYSA-O 474.484 5.211 5 20 JKBD COc1ccc(NC(=S)Nc2ccc([N+](=O)[O-])cc2)cc1OCc1ccc2ccccc2n1 727980578 UEIFEJDCWSVTFZ-UHFFFAOYSA-N 460.515 5.540 5 20 JKBD C[C@H](OC(=O)c1ccc(-c2nc3ccccc3s2)o1)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 746138723 SDSJLFWESKSJNN-LBPRGKRZSA-N 462.443 5.433 5 20 JKBD O=C(O[C@@H](C(=O)Nc1ccccc1)c1ccccc1)c1csc(-c2cccc([N+](=O)[O-])c2)n1 747962453 PXHANRIANYNJPI-OAQYLSRUSA-N 459.483 5.255 5 20 JKBD CC(=O)N(c1ccc(C)c(C)c1)c1nc(COC(=O)c2c[nH]c3ccc([N+](=O)[O-])cc23)cs1 749315488 CSQOYIKFJSCIEZ-UHFFFAOYSA-N 464.503 5.191 5 20 JKBD CC(C)C[C@H](C)N(C(=O)CCCn1c(=O)oc2cc([N+](=O)[O-])ccc21)c1ccc2[nH]ccc2c1 750825245 AXUIXULMQCIXCA-KRWDZBQOSA-N 464.522 5.232 5 20 JKBD Cc1cc(SC(C)(C)C)ccc1NC(=O)c1ccc([N+](=O)[O-])cc1I 751251532 HXQCXPNUDGOYFZ-UHFFFAOYSA-N 470.332 5.651 5 20 JKBD CC(C)(C)OC(=O)N1CCC[C@@H]1[C@@H]1CCCCN1C(=O)c1csc(-c2cccc([N+](=O)[O-])c2)n1 751413891 UVYHYLDVUBMICD-VQTJNVASSA-N 486.594 5.113 5 20 JKBD COc1ccc(CCC(=O)Oc2ccc(NC(=O)c3cc([N+](=O)[O-])ccc3Cl)cc2)cc1F 790040778 VLQOZKNRQMCLRM-UHFFFAOYSA-N 472.856 5.186 5 20 JKBD Cc1ccc(-c2cc(C(=O)O[C@H](C)C(=O)Nc3ccccc3[N+](=O)[O-])c3cnn(C(C)C)c3n2)cc1 825897002 VSYWISKGXAZRSH-QGZVFWFLSA-N 487.516 5.080 5 20 JKBD CCN(CC)Cc1csc(NC(=O)c2ccccc2NC(=O)c2ccc([N+](=O)[O-])cc2Cl)n1 833696275 QIXREVGUKPKKQW-UHFFFAOYSA-N 487.969 5.051 5 20 JKBD Cc1ccnc(-c2noc(C/C(=C/c3ccc([N+](=O)[O-])cc3)c3nc4ccccc4s3)n2)c1 904939571 IYKPEIXRDSBABX-LGMDPLHJSA-N 455.499 5.741 5 20 JKBD O=C(Nc1ccc(F)c([N+](=O)[O-])c1)c1cccnc1SCc1cccc(Br)c1 915281655 RPJFNPJSIUSPMZ-UHFFFAOYSA-N 462.300 5.436 5 20 JKBD C[C@H](OC(=O)c1cc2cc(Br)ccc2o1)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 915424665 VLXYQUWDBIGLPK-JTQLQIEISA-N 458.224 5.072 5 20 JKBD CC(C)N(Cc1nnc(-c2cccc([N+](=O)[O-])c2)o1)C(=O)[C@H](C)Sc1cc(Cl)ccc1Cl 917590737 ATLJRNBEVYXDKI-ZDUSSCGKSA-N 495.388 5.869 5 20 JKBD O=C(COC(=O)c1cc([N+](=O)[O-])ccc1Oc1ccccc1)Nc1c(Cl)cccc1Cl 919193656 YKZULCDRHRBMLR-UHFFFAOYSA-N 461.257 5.489 5 20 JKBD Cc1cc(C(=O)O[C@H](C(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)c2ccccc2)nn1C(C)(C)C 919351174 NXXRMIJPGHTGEJ-FQEVSTJZSA-N 470.913 5.045 5 20 JKBD O=C(Nc1ccccc1C(=O)N[C@@H]1CCCOc2ccc(F)cc21)c1ccc([N+](=O)[O-])cc1Cl 919859961 LNEODCZVOKMOGC-OAQYLSRUSA-N 483.883 5.283 5 20 JKBD CSc1ccc(NC(=O)[C@@H](C)OC(=O)c2ccc(N[C@@H](C)c3ccccn3)c([N+](=O)[O-])c2)cc1 920548103 PTINEHNPTMXXOM-JKSUJKDBSA-N 480.546 5.069 5 20 JKBD C[C@H](SCc1ncc(-c2ccc(Cl)cc2)o1)C(=O)OCc1cc([N+](=O)[O-])cc2c1OCOC2 920673879 XAUMBZUCPXHLCI-ZDUSSCGKSA-N 490.921 5.135 5 20 JKBD Cc1cc(Oc2ccc3c(-c4ccc([N+](=O)[O-])cc4)cc(=O)oc3c2)nc(-c2cccnc2)n1 921188230 LBAREYPBDAVFMR-UHFFFAOYSA-N 452.426 5.321 5 20 JKBD O=C(NC1(c2ccc(NC(=O)[C@]3(F)CCCC=C3F)cc2)CCC1)c1cc([N+](=O)[O-])cc2c1OCC2 1792379902 NLAQIGCBQBNMOH-SANMLTNESA-N 497.498 5.023 5 20 JKBD CC(C)[C@@H](C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc2cc([N+](=O)[O-])ccc2s1)c1ccccc1 1801206321 XVXIOWHPPDMNAI-FBROZUCGSA-N 491.613 5.501 5 20 JKBD Cc1ccc(-c2ccccc2C(=O)N2CCC3(CCCN(C(=O)c4ccc([N+](=O)[O-])o4)C3)CC2)cc1 1804651604 YGLQRXWKHZJZLV-UHFFFAOYSA-N 487.556 5.322 5 20 JKBD CC[C@H](C(=O)Nc1cc([C@@H]2CCCCN2C(=O)CCc2cccc([N+](=O)[O-])c2)[nH]n1)c1ccccc1 1816735895 GFFIRXPCKHOPMP-UPVQGACJSA-N 489.576 5.137 5 20 JKBD O=C(c1ccccc1C1CC1)N1CCC([C@@H]2CCCCN2C(=O)/C=C/c2ccc([N+](=O)[O-])o2)CC1 1824279172 QFCNODFTTOQFBC-YKATVRGKSA-N 477.561 5.012 5 20 JKBD Cc1cc(Cl)ccc1C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cccc(F)c2[N+](=O)[O-])CC1 1830616819 PGMLZBORVDWUNN-JOCHJYFZSA-N 487.959 5.243 5 20 JKBD O=C(c1cccc(F)c1Cl)N1CCC([C@@H]2CCCCN2C(=O)c2cccc(F)c2[N+](=O)[O-])CC1 1830621711 RLNUJZCHQOBFKC-FQEVSTJZSA-N 491.922 5.074 5 20 JKBD O=[N+]([O-])c1ccc(NC(=S)N(CCO)Cc2cccc(OCc3ccccc3Cl)c2)cc1 11034697 OMBUJYNREGZFSW-UHFFFAOYSA-N 471.966 5.019 5 20 JKBD C[C@@H](Sc1nnc(Cc2cccs2)n1CCc1ccccc1)C(=O)Nc1cccc([N+](=O)[O-])c1 12743855 GVOHCZBBJXJOKM-QGZVFWFLSA-N 493.614 5.201 5 20 JKBD CCc1ccc(-c2nc(CC(=O)O[C@H](C)c3nnc(-c4ccc([N+](=O)[O-])cc4)o3)cs2)cc1 16673498 SJCUUORIUBPLCP-CQSZACIVSA-N 464.503 5.178 5 20 JKBD CC(C)c1ccc(-n2ccnc2SCC(=O)O[C@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)cc1 17831740 GBYPJDZGJNPVLN-MRXNPFEDSA-N 493.545 5.350 5 20 JKBD Cn1c(SCC(=O)N[C@@H](c2ccc(F)cc2)c2cccs2)nc2cc3ccccc3cc2c1=O 19417884 UEYCTOLDVYZYIV-DEOSSOPVSA-N 489.597 5.285 5 20 JKBD COc1ccccc1N1C(=O)/C(=C\c2ccc(Br)c([N+](=O)[O-])c2)c2ccccc2C1=O 22748281 XFRRTQZZMIWDJS-ATVHPVEESA-N 479.286 5.094 5 20 JKBD CCn1c(-c2ccc3c(c2)OCCO3)cnc1S[C@@H](C)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl 23291217 FLYAJHSHECTLAK-ZDUSSCGKSA-N 488.953 5.022 5 20 JKBD CCN(c1ccccc1)S(=O)(=O)c1ccc(N[C@H](c2ccccc2)c2ccccn2)c([N+](=O)[O-])c1 24153888 WNSMUHUBJOEJCY-AREMUKBSSA-N 488.569 5.407 5 20 JKBD O=C(OCC(=O)N1N=C(c2cc3ccccc3o2)C[C@H]1c1ccco1)c1ccc([N+](=O)[O-])cc1Cl 24460129 BHCMCANCNXEOFZ-IBGZPJMESA-N 493.859 5.122 5 20 JKBD CN(Cc1cnn(C)c1)C(=O)c1c2c(nc3ccccc13)/C(=C/c1ccc([N+](=O)[O-])cc1)CCC2 24479579 LRBJDPNWIVIKLS-XSFVSMFZSA-N 467.529 5.026 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Cl)[C@H](Nc1ccc2oc(C3CC3)nc2c1)c1ccccc1 27041639 XGYUGUKPAHLRHX-JOCHJYFZSA-N 462.893 6.059 5 20 JKBD Cc1cc(C)c(NC(=O)COc2ccc3c(-c4ccc([N+](=O)[O-])cc4)cc(=O)oc3c2)c(C)c1 28609974 LAWPQLRMBYWLKD-UHFFFAOYSA-N 458.470 5.311 5 20 JKBD Cc1cc(C)c(NC(=O)COC(=O)c2ccc(Sc3nc(C)cs3)c([N+](=O)[O-])c2)c(C)c1 28831690 PLBLMSAXTRWJAG-UHFFFAOYSA-N 471.560 5.232 5 20 JKBD O=C(NCc1ccccc1CN1CCCC1=O)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1 43770614 DDRBZSDHNKMLDP-UHFFFAOYSA-N 479.920 5.093 5 20 JKBD Cc1ccc(-c2n[nH]c(S[C@H](C(=O)Nc3ccc(C)cc3[N+](=O)[O-])c3ccccc3)n2)cc1 45252161 DQLLNRBPCNGVDT-NRFANRHFSA-N 459.531 5.469 5 20 JKBD CN(CCCCCc1cc(-c2cccc(F)c2)n[nH]1)C(=O)c1ccc(N2CCCC2)c([N+](=O)[O-])c1 59888941 KVZFKFHLHQRVFJ-UHFFFAOYSA-N 479.556 5.209 5 20 JKBD C[C@@H](Nc1ccc(C(=O)NC2(c3ccc(Br)cc3)CC2)cc1[N+](=O)[O-])c1ccccn1 109341385 FJEAWZKMYJKXSB-OAHLLOKOSA-N 481.350 5.345 5 20 JKBD O=C(Cn1ccc2cc([N+](=O)[O-])ccc21)N(Cc1ccc(Cl)c(Cl)c1)Cc1ccccn1 109727892 VZJOQWLWHROFTA-UHFFFAOYSA-N 469.328 5.480 5 20 JKBD CC(C)CCSc1ccc(C(=O)Nc2cc(C(C)C)nn2-c2ncccn2)cc1[N+](=O)[O-] 303409873 ULOFFRQQXRPUMB-UHFFFAOYSA-N 454.556 5.084 5 20 JKBD Cc1ccc(NC(=O)[C@H]2CCCN(C(=O)c3ccc(Oc4ccc(Cl)cc4[N+](=O)[O-])cc3)C2)nc1 503014222 LHDPJZSRQMIGSO-SFHVURJKSA-N 494.935 5.235 5 20 JKBD C[C@@H]1C[C@@H](C)CN(c2ccc(C(=O)Nc3ccccc3OCc3cscn3)cc2[N+](=O)[O-])C1 503493703 XGHYEFBIBRBCAM-IAGOWNOFSA-N 466.563 5.365 5 20 JKBD Cc1ccccc1[C@H]1CCN(C(=O)C2CCN(c3ccc(C(F)(F)F)cc3[N+](=O)[O-])CC2)C1 504931978 YIELUJXSSIKNLE-SFHVURJKSA-N 461.484 5.155 5 20 JKBD Cc1nc(C)c(-c2csc(NC(=O)c3ccc(N[C@@H](C)c4ccccn4)c([N+](=O)[O-])c3)n2)s1 507370491 WOYKODPYIAOFCT-LBPRGKRZSA-N 480.575 5.612 5 20 JKBD COc1ccccc1Oc1ccc(NC(=O)N(Cc2ccc([N+](=O)[O-])cc2)C(C)C)cc1F 509221873 CHFWBNOLDNYGAK-UHFFFAOYSA-N 453.470 5.977 5 20 JKBD O=C(Nc1cccnc1)c1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2Sc2ccccc2)cc1 512782540 DCUOYNJNRHBALN-UHFFFAOYSA-N 470.510 5.646 5 20 JKBD CN(c1ccccc1)c1ccc(CNCc2cccc(C(=O)NCc3ccco3)c2)cc1[N+](=O)[O-] 513067036 BKRQCXCCGSVGQA-UHFFFAOYSA-N 470.529 5.176 5 20 JKBD CC[C@H]1c2ccsc2CCN1C(=O)C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1 515078622 YHGCCUKMJWETCV-LXKWBGADSA-N 489.622 6.733 5 20 JKBD COc1ccc(F)cc1[C@@H](C)N[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1 515525473 RXEVYWZOIJPKHU-JLCFBVMHSA-N 457.889 5.427 5 20 JKBD C[C@@H]1CN(c2ccccc2NC(=O)c2ccc(NCc3ccccc3)c([N+](=O)[O-])c2)C[C@@H](C)O1 515926157 IVTVPDFAQUDZIB-RTBURBONSA-N 460.534 5.073 5 20 JKBD CCOc1ccc2nc(-c3ccc(NC(=O)C(=O)N[C@H](C)c4cccc([N+](=O)[O-])c4)cc3)sc2c1 517185309 ZWJKWHVMPXGJJU-OAHLLOKOSA-N 490.541 5.086 5 20 JKBD O=C(NC1(c2cccc(Br)c2)CCOCC1)c1cc2cc([N+](=O)[O-])ccc2s1 520105723 AETYVQATOAVZCC-UHFFFAOYSA-N 461.337 5.008 5 20 JKBD COc1cc(Br)c(NC(=O)c2ccc(N3C[C@@H](C)C[C@H](C)C3)c([N+](=O)[O-])c2)cc1OC 520425667 UVSYEQGJOCZHPZ-KBPBESRZSA-N 492.370 5.109 5 20 JKBD C[C@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)Nc1cc(Br)ccc1Br 520440677 OVXBXPGJHYUUKL-QMMMGPOBSA-N 478.524 5.179 5 20 JKBD O=[N+]([O-])c1ccc(-c2ccc(CN[C@@H]3CCSc4c(F)cccc43)o2)c(Br)c1 520951169 TUOAFJAZVLRCPA-GOSISDBHSA-N 463.328 6.083 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Cl)[C@@H](NCCc1ccc2ccccc2n1)c1ccccc1 521667208 MUNJOXWNAVEUFB-DEOSSOPVSA-N 460.921 5.309 5 20 JKBD COc1ccc(NS(=O)(=O)c2cc(C)c(C)cc2[N+](=O)[O-])cc1OCc1ccc2ccccc2n1 524381167 QHZUOVYNEMULKH-UHFFFAOYSA-N 493.541 5.148 5 20 JKBD O=C(Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1)c1ccccc1SCc1cccs1 590612890 ARZUGUYHRDJFFX-UHFFFAOYSA-N 453.570 6.324 5 20 JKBD O=C(Nc1cc([N+](=O)[O-])ccc1OC(F)F)[C@@H]1CCC(=O)N(Cc2ccccc2)[C@H]1c1ccccc1 603961486 XDGGCVXAFHVDSC-YKSBVNFPSA-N 495.482 5.315 5 20 JKBD CCOc1ccc([C@H](C)NCc2cn(-c3ccccc3)nc2-c2ccc([N+](=O)[O-])cc2)cc1OC 608836472 JIVTYQJYSRCEBO-IBGZPJMESA-N 472.545 5.706 5 20 JKBD O=[N+]([O-])c1ccc(-c2nn(-c3ccccc3)cc2CNCc2ccc(-n3ccnc3)c(F)c2)cc1 608836697 FRGYXUOKXRDKHQ-UHFFFAOYSA-N 468.492 5.062 5 20 JKBD CO[C@@H](C)c1cccc(N[C@@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Br)c2ccccc2)c1 608889100 IASZWNZSQPFKQC-OYHNWAKOSA-N 484.350 5.857 5 20 JKBD COc1ccc(NC(=O)c2ccc(N3C[C@H](C)C[C@@H](C)C3)c([N+](=O)[O-])c2)c(Br)c1 608901027 QXEPZWPTJJMBGH-ZIAGYGMSSA-N 462.344 5.101 5 20 JKBD Cc1csc(Sc2ccc(C(=O)N3CCC(CN(C)Cc4ccccc4)CC3)cc2[N+](=O)[O-])n1 608964219 OCXGVSFUJRAMAL-UHFFFAOYSA-N 496.658 5.495 5 20 JKBD COc1ccc(CSc2nnc(SCc3nnc(-c4ccc([N+](=O)[O-])cc4)o3)s2)cc1 619671040 GSZCBUDNEILLFU-UHFFFAOYSA-N 473.561 5.090 5 20 JKBD CCCc1cc[n+](/C(C(=S)Nc2ccc(OC)c(Cl)c2)=C(/O)c2cccc([N+](=O)[O-])c2)cc1 726963072 XYUAYDIQKBNMSK-UHFFFAOYSA-O 484.985 5.820 5 20 JKBD COc1ccc([N+](=O)[O-])c(C(=O)Nc2cc(C(F)(F)F)ccc2NC(=O)OC(C)(C)C)c1 727790638 NRMGYGFUPPZIQZ-UHFFFAOYSA-N 455.389 5.222 5 20 JKBD O=C(C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)Nc1ccc(Cl)nc1 729173589 JSZAYIVAGCFCAT-RVDMUPIBSA-N 450.907 5.822 5 20 JKBD Cc1ccc2nc(-c3cccnc3)cc(C(=O)Nc3cc([N+](=O)[O-])ccc3OC(F)F)c2c1 730476688 BPBZHOYWTWGVFN-UHFFFAOYSA-N 450.401 5.367 5 20 JKBD O=C(O[C@@H](C(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1)c1ccccc1)c1csc(-c2ccoc2)n1 731090839 JBRNBSDLLKRGAS-LJQANCHMSA-N 483.889 5.502 5 20 JKBD Cc1cc([N+](=O)[O-])ccc1NC(=O)COC(=O)c1nc(-c2ccccc2)oc1-c1ccccc1 731377778 XKXAMSTWOPJWGL-UHFFFAOYSA-N 457.442 5.021 5 20 JKBD COc1ccc(OC(=O)[C@H](C)SCc2nc(O)c3c(-c4ccccc4)csc3n2)c([N+](=O)[O-])c1 818029215 PFHAYOIGGJTOID-ZDUSSCGKSA-N 497.554 5.208 5 20 JKBD O=C(COC(=O)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1)c1cc2ccccc2o1 825345364 FPEOWLSGENDJMP-UHFFFAOYSA-N 476.407 5.002 5 20 JKBD Cc1cc(C(N)=O)ccc1NC(=O)c1ccc(Sc2nc3ccccc3s2)c([N+](=O)[O-])c1 915174314 KQVRJBMFLYBTNF-UHFFFAOYSA-N 464.528 5.015 5 20 JKBD COc1cc([C@H](C)NC(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)ccc1OCc1ccncc1 916668873 HHUNIXTUVNACBO-AWEZNQCLSA-N 456.886 5.114 5 20 JKBD O=C(CN(Cc1ccc(Cl)cc1)C(=O)/C=C/c1ccc([N+](=O)[O-])cc1)Nc1ccccc1F 918625531 ZVPRWLPIBZQRBN-NTEUORMPSA-N 467.884 5.068 5 20 JKBD C[C@H](OC(=O)c1cc([N+](=O)[O-])ccc1Oc1ccccc1)C(=O)N1CCC[C@@H]1c1cccs1 919191529 GCWBLIDQZKMBSW-OXJNMPFZSA-N 466.515 5.358 5 20 JKBD CCOc1cc(-c2ccccc2)sc1C(=O)OCC(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 919450968 GMJQKUQMYIOILR-UHFFFAOYSA-N 494.447 5.536 5 20 JKBD Cc1ccc(NC(=O)[C@@H](OC(=O)c2ccc(-c3cnco3)cc2)c2ccccc2)c([N+](=O)[O-])c1 919499313 WHWOYBZDZGVDIJ-QHCPKHFHSA-N 457.442 5.095 5 20 JKBD Cc1ccc(/C(O)=C(/C(=S)Nc2cc(Cl)cc(Cl)c2)[n+]2cc(O)ccc2C)cc1[N+](=O)[O-] 920484614 PHAMONYWOHUWOT-UHFFFAOYSA-O 491.376 5.835 5 20 JKBD Cc1ccc(-c2noc([C@H](C)OC(=O)c3ccc(N[C@H](C)c4ccccn4)c([N+](=O)[O-])c3)n2)cc1F 920549175 WFKRQRHKWBEVAZ-CVEARBPZSA-N 491.479 5.578 5 20 JKBD C[C@@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)Nc1ccccc1C(=O)N(C)C1CCCCC1 920815105 QMZOCUSPLHJBGG-OAHLLOKOSA-N 459.930 5.059 5 20 JKBD C[C@@H](c1cccc(NC(=O)c2ccccc2)c1)N(C)C(=O)COc1cc(Cl)ccc1[N+](=O)[O-] 920993048 HPBDKUZXMTZJKW-INIZCTEOSA-N 467.909 5.099 5 20 JKBD Cc1ncsc1C(=O)NC1(c2ccc(NC(=O)Cc3ccc(Cl)cc3[N+](=O)[O-])cc2)CCC1 1786116165 CPQZCIQUZRZILJ-UHFFFAOYSA-N 484.965 5.004 5 20 JKBD O=C(Cc1cccc2ncccc12)Nc1ccc(C2(NC(=O)c3ccc([N+](=O)[O-])cc3F)CCC2)cc1 1786345741 IROACVHJOSBTRX-UHFFFAOYSA-N 498.514 5.273 5 20 JKBD Cc1ccc(C(=O)Nc2ccc(C3(NC(=O)Cc4ccc(Cl)cc4[N+](=O)[O-])CCC3)cc2)c(C)n1 1789964545 KDXJFEHKVZXMOM-UHFFFAOYSA-N 492.963 5.250 5 20 JKBD O=C(/C=C/c1ccccc1[N+](=O)[O-])Nc1ccc(C2(NC(=O)COC3CCCCC3)CCC2)cc1 1792315447 PFWHPANEQRPZMA-LFIBNONCSA-N 477.561 5.091 5 20 JKBD Cc1oc(C(C)(C)C)cc1C(=O)N1CCCC[C@H]1c1cc(NC(=O)Cc2cccc([N+](=O)[O-])c2)n[nH]1 1814373700 AURURWFWKQLSPW-NRFANRHFSA-N 493.564 5.065 5 20 JKBD C/C(=C\c1cccs1)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)/C=C/c2ccccc2[N+](=O)[O-])[nH]n1 1814413443 FKDFNVLLERMRAC-CCNDIDFDSA-N 491.573 5.188 5 20 JKBD CC(C)[C@@H](C(=O)N1CCCC[C@H]1c1cc(NC(=O)/C=C/c2ccc([N+](=O)[O-])o2)n[nH]1)c1ccccc1 1814965527 MFQIHTUTYVCFAP-UZHFMHAUSA-N 491.548 5.056 5 20 JKBD O=C(CCc1cccc([N+](=O)[O-])c1)Nc1cc([C@@H]2CCCCN2C(=O)c2cc(F)ccc2Cl)[nH]n1 1815538835 ZFFSWYOOXREBOL-NRFANRHFSA-N 499.930 5.049 5 20 JKBD O=C(Nc1cc([C@@H]2CCCCN2C(=O)[C@@H]2CCC[C@@H]3CCCC[C@H]32)[nH]n1)c1cc(F)cc([N+](=O)[O-])c1 1821166453 WRIUUHHFVZZTMN-NCDVDMNXSA-N 497.571 5.369 5 20 JKBD O=C(c1ccc([N+](=O)[O-])o1)N1CCC([C@H]2CCCCN2C(=O)c2cc3cc(F)ccc3s2)CC1 1828602191 WCCPZEZLAKITKJ-GOSISDBHSA-N 485.537 5.089 5 20 JKBD O=C(/C=C/c1ccccc1[N+](=O)[O-])N1CCC([C@@H]2CCCCN2C(=O)c2cc(F)ccc2Cl)CC1 1830578475 VXDCINIHTYZQMO-HDFUYHJRSA-N 499.970 5.334 5 20 JKBD CCC[C@H]1CC[C@H](C(=O)N2CCC([C@H]3CCCCN3C(=O)c3cc(O)cc([N+](=O)[O-])c3)CC2)CC1 1830706342 FUMJIQWBECHCTA-DZRGJMJISA-N 485.625 5.140 5 20 JKBD C[C@H](Sc1ncc(-c2ccc(Cl)cc2)o1)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 11300321 XNFYMFCDVXTYMD-JTQLQIEISA-N 471.844 6.041 5 20 JKBD O=C(Nc1cccc(C(=O)NC2CC2)c1)c1ccc(NCc2ccccc2Cl)c([N+](=O)[O-])c1 14481784 SZCKSQOUIKJIQB-UHFFFAOYSA-N 464.909 5.005 5 20 JKBD COc1ccc(CCNC(=O)c2ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])c(OC)c2)cc1OC 15652299 PKDHLLSVNXWEPN-UHFFFAOYSA-N 486.908 5.039 5 20 JKBD O=C(Nc1ccccc1C(=O)NC1CC1)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1 16015230 APEPQSJKJLTSQV-UHFFFAOYSA-N 451.866 5.185 5 20 JKBD C[C@@H](Sc1nnc(-c2ccccc2)c(-c2ccccc2)n1)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 16048682 DYEJSTCMWFDEGP-MRXNPFEDSA-N 482.525 6.017 5 20 JKBD COc1ccc(NC(=O)[C@H](C)Sc2nnc(-c3ccccc3)c3ccccc23)c([N+](=O)[O-])c1 16829626 QVCKVENAOHJYHN-HNNXBMFYSA-N 460.515 5.333 5 20 JKBD Cc1cccc(C)c1NC(=O)[C@@H](C)OC(=O)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1 16906092 LWXPCEDTGMWSCF-MRXNPFEDSA-N 468.893 5.841 5 20 JKBD COc1ccc(Cl)cc1NC(=O)CN(C)C(=O)c1ccc(SCCC(C)C)c([N+](=O)[O-])c1 17975006 AFPNNXHKTUQADS-UHFFFAOYSA-N 479.986 5.106 5 20 JKBD COc1cc(CSc2nnc(COc3cc(C)ccc3C)o2)c([N+](=O)[O-])cc1OC(F)F 24980805 CNNZDYOEQQNOQO-UHFFFAOYSA-N 467.450 5.076 5 20 JKBD CCN(C(=O)CSc1nc2cc3ccccc3cc2c(=O)n1CC)c1nc2ccccc2s1 26115687 INANIJNXWLNVHT-UHFFFAOYSA-N 474.611 5.325 5 20 JKBD COc1ccc(Oc2ccc([N+](=O)[O-])cc2C(=O)NCc2ccc(NC(=O)c3ccco3)cc2)cc1 32926249 KQWUBGZYXBTUTD-UHFFFAOYSA-N 487.468 5.171 5 20 JKBD O=C(COc1ccc([N+](=O)[O-])cc1Cl)c1cc(Br)sc1Br 37976307 LXNFSLGDKJKQLQ-UHFFFAOYSA-N 455.511 5.096 5 20 JKBD CC(C)Oc1ccccc1CNC(=O)c1ccccc1NC(=O)c1ccc([N+](=O)[O-])cc1Cl 108677913 CRKLYCPKTUONQZ-UHFFFAOYSA-N 467.909 5.218 5 20 JKBD Cc1nn(Cc2ccc(C(=O)Nc3ccc(N[C@@H](C)c4ccccc4)cc3)cc2)c(C)c1[N+](=O)[O-] 108707793 JKZKLAKCXOLZEZ-SFHVURJKSA-N 469.545 5.882 5 20 JKBD O=C(CCNc1ccc(C(F)(F)F)cc1[N+](=O)[O-])N(Cc1cccnc1)c1ccc(F)cc1 195702011 IPBWXMMNDOROAJ-UHFFFAOYSA-N 462.403 5.183 5 20 JKBD Cc1cc(C(=O)N2CCC[C@H](C)C2)ccc1NC(=O)CCNc1ccc(C(F)(F)F)cc1[N+](=O)[O-] 195703814 YAACKOJPBQSMLA-HNNXBMFYSA-N 492.498 5.235 5 20 JKBD Cc1cc(NC(=O)c2ccc(N[C@@H](C)c3ccccn3)c([N+](=O)[O-])c2)n(-c2ccccc2C)n1 482126248 RSSYFEQVVUPJOK-SFHVURJKSA-N 456.506 5.218 5 20 JKBD C[C@@H](c1ccc(-n2cncn2)cc1)N(C)C(=O)c1ccc(NCc2ccccc2Cl)c([N+](=O)[O-])c1 499207654 YXMFTTUCFPABLH-KRWDZBQOSA-N 490.951 5.274 5 20 JKBD CCOCc1ccc(CNC(=O)C/C(=C\c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)cc1 503028916 DXSQRNSMDMVEOG-PXLXIMEGSA-N 487.581 5.988 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Cl)[C@@H](NC1CCN(c2ccccc2)CC1)c1ccccc1 513189610 ZJOXGPCEXOEAGX-DEOSSOPVSA-N 464.953 5.187 5 20 JKBD O=C(C[C@@H](NC(=O)c1ccccc1Cl)c1ccccc1)Nc1cc(-c2cccc([N+](=O)[O-])c2)[nH]n1 517880677 CUQXFDAERHLYLA-OAQYLSRUSA-N 489.919 5.138 5 20 JKBD Cc1ccc(Sc2ccc(CNCc3cccc(NC(=O)[C@H]4CCCO4)c3)cc2[N+](=O)[O-])cc1 518277275 CHZOHUWAMNRXQQ-XMMPIXPASA-N 477.586 5.462 5 20 JKBD C[C@@H]1CN(Cc2ccc(CNCc3ccc(-c4ccc([N+](=O)[O-])cc4)s3)cc2)C[C@@H](C)O1 518768042 AKXFXUPJMUKVDG-RTBURBONSA-N 451.592 5.222 5 20 JKBD CC(=O)Nc1cccc([C@@H](C)N(Cc2ccccc2)C(=O)Cn2ccc3cc([N+](=O)[O-])ccc32)c1 521541493 IXUYNPKLYFWLBE-LJQANCHMSA-N 470.529 5.298 5 20 JKBD C[C@H](C1CC1)n1nccc1NC(=O)C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1 602140947 RNRCEZARLPZLGB-BAACNHRGSA-N 473.558 5.941 5 20 JKBD O=C(C[C@@H](NC(=O)c1ccccc1Cl)c1ccccc1)Nc1cc([N+](=O)[O-])ccc1OC(F)F 603638315 ATXWJMZPKIHYSU-GOSISDBHSA-N 489.862 5.350 5 20 JKBD CCCOc1ccccc1Oc1ncccc1CNC(=O)c1ccc(N2CCCC2)c([N+](=O)[O-])c1 604098360 YAJCJAFPGKKRRZ-UHFFFAOYSA-N 476.533 5.101 5 20 JKBD C[C@H]1C[C@@H](C)CN(c2ccc(C(=O)N3C[C@@H](C(F)(F)F)C[C@H](C(F)(F)F)C3)cc2[N+](=O)[O-])C1 604257915 OJJCKNLHPVJZML-XRGAULLZSA-N 481.437 5.280 5 20 JKBD CCOc1cc([N+](=O)[O-])c(C(=O)Nc2ccc(OCc3cccc(Cl)c3)cc2C)cc1OC 609062160 BAKYRBWBGUBNDG-UHFFFAOYSA-N 470.909 5.795 5 20 JKBD CN(C(=O)CSc1ncnc2cc(-c3ccc(F)cc3)sc12)c1ccc([N+](=O)[O-])cc1 619749250 SXHWTZVDICWBEX-UHFFFAOYSA-N 454.508 5.161 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)O[C@H](C)C(=O)N[C@@H](C)c2ccc(Cl)cc2Cl)cc1SC 728651024 OYWQRFVNSLRPIR-WDEREUQCSA-N 487.361 5.055 5 20 JKBD O=C(O[C@H](C(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1)c1ccccc1)c1ccc(C(F)(F)F)cn1 844420033 GZFHLXQWRVXDKF-SFHVURJKSA-N 479.798 5.199 5 20 JKBD CC(C)(C)c1cc[n+](/C(C(=S)N[C@@H]2C[C@H]3CC[C@H]2C3)=C(/O)c2cccc([N+](=O)[O-])c2)cc1 912843472 KCOVCKDRPXZANS-XGHQBKJUSA-O 452.600 5.169 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Cl)[C@@H](c1ccccc1)N1CCC([C@@H](O)c2ccccc2)CC1 917023871 MOPGYXRADQOHRW-RPBOFIJWSA-N 479.964 5.374 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)NC1(c2ccc(NC(=O)/C=C/c3ccoc3)cc2)CCC1 1786749918 HIQDZLJRIQGTCB-XCVCLJGOSA-N 463.465 5.096 5 20 JKBD COc1ccc(CC(=O)NC2(c3ccc(NC(=O)[C@@]4(F)CCCC=C4F)cc3)CCC2)c([N+](=O)[O-])c1 1792379614 LPJLFXNSJVLUQU-AREMUKBSSA-N 499.514 5.026 5 20 JKBD CC(C)[C@H](C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cc(F)cc([N+](=O)[O-])c2)[nH]n1)c1ccccc1 1814931319 HNDPQUYUVMIITJ-UPVQGACJSA-N 493.539 5.203 5 20 JKBD C[C@@H](C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cc(F)cc([N+](=O)[O-])c2)n[nH]1)c1ccc(Cl)cc1 1821163361 LUZULEJXSFWUBC-SZNDQCEHSA-N 499.930 5.220 5 20 JKBD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2cccc3ccccc23)[nH]n1)c1cc(F)cc([N+](=O)[O-])c1 1821166524 XSLNHFTWEJMIGQ-QHCPKHFHSA-N 487.491 5.230 5 20 JKBD C/C(=C\c1ccc(C)o1)C(=O)N1CCC([C@H]2CCCCN2C(=O)Cc2ccc(C)c([N+](=O)[O-])c2)CC1 1830364587 DEBWSNFLIXSKBN-RALKEJGDSA-N 493.604 5.070 5 20 JKBD C[C@H](Sc1ccccc1)C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cccc(F)c2[N+](=O)[O-])CC1 1830617568 VUPPHUBXQJQFJJ-FDDCHVKYSA-N 499.608 5.148 5 20 JKBD Cc1cc2[nH]c(C(=O)N3CCC([C@H]4CCCCN4C(=O)c4cc(F)cc([N+](=O)[O-])c4)CC3)cc2s1 1830618063 JWFJGELLHUZZTB-JOCHJYFZSA-N 498.580 5.132 5 20 JKBD C[C@@H]1CCC[C@@H]1C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)CC1 1831061587 WUPYXDWCMGNBSG-VOQZNFBZSA-N 483.634 5.479 5 20 JKBD O=C(C1CC2(CCC2)C1)N1CCC([C@@H]2CCCCN2C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)CC1 1831062057 MZJJXUZPFCUTRQ-QFIPXVFZSA-N 495.645 5.623 5 20 JKBD CCC1(C(=O)N2CCC(OC3CCN(C(=O)c4cc5cc([N+](=O)[O-])ccc5s4)CC3)CC2)CCC1 1838294059 KKQPJQXKFZHEPM-UHFFFAOYSA-N 499.633 5.002 5 20 JKBD O=C1/C(=C/c2ccccc2)N=C(SCc2cc([N+](=O)[O-])cc3c2OCOC3)N1c1ccc(F)cc1 3416539 HDOSPDHISMVBAF-YVNNLAQVSA-N 491.500 5.278 5 20 JKBD Cc1csc(SCc2ccccc2C(=O)OCC(=O)Nc2ccc([N+](=O)[O-])cc2Cl)n1 9622362 SWPMJCFCDIDPEL-UHFFFAOYSA-N 477.951 5.101 5 20 JKBD CSc1ccccc1NC(=O)[C@@H](C)OC(=O)c1ccccc1C(=O)c1ccc(Cl)c([N+](=O)[O-])c1 11029268 XVZHVAIVKYMYMN-CQSZACIVSA-N 498.944 5.385 5 20 JKBD CSc1ccc([N+](=O)[O-])c(C(=O)OCC(=O)N2c3ccccc3Sc3ccccc32)c1 16196063 RDILNEHVCKFHNP-UHFFFAOYSA-N 452.513 5.303 5 20 JKBD COc1ccc2c(CC(=O)O[C@@H](C(=O)Nc3ccc([N+](=O)[O-])cc3Cl)c3ccccc3)coc2c1 20974140 CVTNECWCVLVAFE-XMMPIXPASA-N 494.887 5.469 5 20 JKBD CCCCC[C@H](C)n1c(SCC(=O)Nc2c(C)cccc2[N+](=O)[O-])nc2ccccc2c1=O 21995349 GGISBCQRINKLTK-KRWDZBQOSA-N 468.579 5.485 5 20 JKBD Cc1cc(C(=O)NCC(C)C)ccc1NC(=O)c1ccc(N[C@H](C)c2ccccn2)c([N+](=O)[O-])c1 60248240 YGFVDOJZYZRVNH-GOSISDBHSA-N 475.549 5.109 5 20 JKBD COc1ccc(N(Cc2cccs2)C(=O)C2CCN(c3ccccc3[N+](=O)[O-])CC2)cc1 104792080 XVKVBSLLBRGCQU-UHFFFAOYSA-N 451.548 5.115 5 20 JKBD COc1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2Oc2ccccc2)cc1OCc1ccncc1 107791132 KRMKXTUROTUVLH-UHFFFAOYSA-N 471.469 5.622 5 20 JKBD C[C@@H]1CN(Cc2ccccc2NC(=O)c2ccc(NCc3ccccc3)c([N+](=O)[O-])c2)C[C@@H](C)O1 117731956 UQIPSVJHOWQAMX-WOJBJXKFSA-N 474.561 5.068 5 20 JKBD O=C(Cc1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1)NC12CC3CC(CC(C3)C1)C2 477263949 KSKVLEGPMOEDKU-UHFFFAOYSA-N 456.546 5.075 5 20 JKBD O=C(c1cc([N+](=O)[O-])ccc1Sc1ccccc1)N1CCC[C@@H](c2nnc3n2CCCCC3)C1 486565851 NDQJSGJQWYAZNK-GOSISDBHSA-N 477.590 5.084 5 20 JKBD Cc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)N(Cc1ccc(-c2ccccc2C)s1)C(C)C 499170699 QULKUTWITZZXFM-UHFFFAOYSA-N 451.548 5.316 5 20 JKBD O=C(c1cc2cc([N+](=O)[O-])ccc2o1)N(Cc1ccc(Cl)c(Cl)c1)Cc1ccccn1 499624558 YKOBFIAZKDDUCH-UHFFFAOYSA-N 456.285 5.885 5 20 JKBD O=[N+]([O-])c1ccccc1-c1ccc(CNCc2ccccc2-c2ccc(Cn3ccnc3)cc2)o1 504162831 OGGNGUXEUGRRMB-UHFFFAOYSA-N 464.525 6.056 5 20 JKBD O=C(CCn1cc([N+](=O)[O-])cn1)NC[C@H](c1ccccc1)c1c(-c2ccccc2)[nH]c2ccccc12 508806839 SHCCBQOPEJYPAQ-XMMPIXPASA-N 479.540 5.278 5 20 JKBD Cc1ccc(C(C)C)c(Oc2ccc(CNCc3ccc(N4CCO[C@H](C)C4)nc3)cc2[N+](=O)[O-])c1 509599823 KBLNSBYXFKKSNS-OAQYLSRUSA-N 490.604 5.729 5 20 JKBD O=[N+]([O-])c1ccc(-c2ccc(CNCc3cccc(Cn4cccn4)c3)o2)c(Br)c1 518764356 LJHNETKTTRFTIS-UHFFFAOYSA-N 467.323 5.152 5 20 JKBD CC(C)[C@@H](NCc1ccc(-c2ccc([N+](=O)[O-])cc2Br)o1)c1nnc2ccccn12 518783664 QUZXMWYZYUXYKM-HXUWFJFHSA-N 470.327 5.147 5 20 JKBD C[C@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)NCc1cccc(NC(=O)Nc2ccccc2)c1 522508775 WKCZBTQEDNVVPF-INIZCTEOSA-N 450.520 5.036 5 20 JKBD CSc1ccc([N+](=O)[O-])c(C(=O)Nc2ccc3nc(NC(=O)c4ccc(C)s4)sc3c2)c1 522577512 POBVELGCDWRXLO-UHFFFAOYSA-N 484.584 5.801 5 20 JKBD COc1ccc(NC(=O)N(C)Cc2ccccc2[N+](=O)[O-])cc1OCc1ccc2ccccc2n1 524439442 XAJPDPPAHRNLAY-UHFFFAOYSA-N 472.501 5.395 5 20 JKBD CCCN1CCC(NC(=O)c2ccccc2Sc2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 591593272 BTESKGCAHIUJRY-UHFFFAOYSA-N 467.513 5.369 5 20 JKBD COc1ccc(OC2CCN(C(=O)c3ccc(Sc4nc(C)cs4)c([N+](=O)[O-])c3)CC2)cc1 603816692 UBJPOTXUJSXNJZ-UHFFFAOYSA-N 485.587 5.203 5 20 JKBD Cc1cc(C(=O)NC2CCCCC2)ccc1NC(=O)CSc1ccc(C(F)(F)F)cc1[N+](=O)[O-] 603969794 AGZCQFHVRQKYDV-UHFFFAOYSA-N 495.523 5.715 5 20 JKBD C[C@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)N[C@@H]1C[C@@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1 604442932 WOMYPHWPYXVWSU-UXCLJVHYSA-N 462.774 5.041 5 20 JKBD Cc1cccc(NC(=O)Nc2cccc(CNC(=O)[C@@H](C)Oc3ccc(Cl)cc3[N+](=O)[O-])c2)c1 604443675 IUUFPJSLARBVNG-MRXNPFEDSA-N 482.924 5.284 5 20 JKBD COc1cc(C(=O)Nc2ccc(OCc3cccc(Cl)c3)cc2C)c([N+](=O)[O-])cc1OC 609062208 FYDWEUQOQQQJOI-UHFFFAOYSA-N 456.882 5.405 5 20 JKBD CC(=O)N(CCC(=O)Nc1cc(Cl)c([N+](=O)[O-])cc1OCc1ccccc1)Cc1ccccc1 726136879 RJFGNUSHRNNTTJ-UHFFFAOYSA-N 481.936 5.205 5 20 JKBD CCCc1cc[n+](/C(C(=S)Nc2c(C)cc(C)cc2Cl)=C(/O)c2ccc(C)c([N+](=O)[O-])c2)cc1 747892081 SNLWVWPHXIHTTD-UHFFFAOYSA-O 497.040 6.737 5 20 JKBD COc1cccc(NC(=O)[C@H](OC(=O)c2csc(-c3ccc([N+](=O)[O-])cc3)n2)c2ccccc2)c1 747956509 UIKNRUVGTQRVAV-JOCHJYFZSA-N 489.509 5.264 5 20 JKBD CC(C)Oc1ccc([C@H](C)NC(=O)c2ccccc2NC(=O)c2ccc([N+](=O)[O-])cc2Cl)cc1 914487342 IBHVGQZTTKDJNW-INIZCTEOSA-N 481.936 5.779 5 20 JKBD C[C@@H](CC(=O)O[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Br)c1ccccc1)C1CC1 920721534 GSPLGKCOMJVRSI-RBZFPXEDSA-N 461.312 5.017 5 20 JKBD Cc1cc(C(=O)Nc2ccc(C3(NC(=O)Cc4ccc(Cl)cc4[N+](=O)[O-])CCC3)cc2)cnc1C 1787007387 MJVCTRQESNASCI-UHFFFAOYSA-N 492.963 5.250 5 20 JKBD COc1cc(C(=O)NC2(c3ccc(NC(=O)CCC4CCCC4)cc3)CCC2)ccc1[N+](=O)[O-] 1787619069 OQMMVNLOEIMEQR-UHFFFAOYSA-N 465.550 5.322 5 20 JKBD CC(C)=CCCC(=O)NC[C@H]1CCN(C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)[C@H]1c1cccnc1 1807997046 KNJSMODQTPGNTQ-CLOONOSVSA-N 492.601 5.271 5 20 JKBD CC1=CC[C@H](C(=O)N2CCCC[C@H]2c2cc(NC(=O)c3cc(Cl)cc([N+](=O)[O-])c3C)n[nH]2)CC1 1821294638 RTCVQLJDCCXSEL-JXFKEZNVSA-N 485.972 5.332 5 20 JKBD Cc1csc(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)Cc3ccc(Cl)cc3[N+](=O)[O-])CC2)c1 1824672954 UHNGFEMJYIYHMA-HXUWFJFHSA-N 490.025 5.094 5 20 JKBD C[C@]1(C(=O)N2CCC([C@H]3CCCCN3C(=O)CSc3ccccc3[N+](=O)[O-])CC2)CC=CCC1 1831777628 ULEYMCPOLYKZTR-RLWLMLJZSA-N 485.650 5.053 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Cl)[C@@H](NCc1ccccc1OC(F)F)c1ccccc1 11040098 HPYPKOOUEPACIE-FQEVSTJZSA-N 461.852 5.319 5 20 JKBD COc1cc(NC(=O)c2ccc(Sc3ccc(C)cc3)c([N+](=O)[O-])c2)cc(OC)c1OC 15567176 RKSIIYNFVGGZEJ-UHFFFAOYSA-N 454.504 5.333 5 20 JKBD O=C(COC(=O)c1ccccc1SCc1ccco1)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 18410330 GKYBGESWYDBANZ-UHFFFAOYSA-N 480.420 5.294 5 20 JKBD CC(=O)Nc1ccc(NC(=O)c2ccc(N3C[C@@H](C)C[C@H](C)C3)c([N+](=O)[O-])c2)c(C(F)(F)F)c1 21900818 QMPSTCPFFGAEJJ-KBPBESRZSA-N 478.471 5.307 5 20 JKBD COc1ccc(S(=O)(=O)Oc2cc3ccccc3cc2C(=O)Nc2ccccc2C)c([N+](=O)[O-])c1 23403167 HAJIXZMIZAEPTB-UHFFFAOYSA-N 492.509 5.085 5 20 JKBD O=C(C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)Nc1ccc2c(c1)OCCCO2 25031832 BIXHBJYGFKYJQZ-JXAWBTAJSA-N 487.537 5.935 5 20 JKBD O=C(Nc1ccccc1C(=O)Nc1ccc(OC(F)(F)F)cc1)c1ccc([N+](=O)[O-])cc1Cl 29548593 SVXSZOHJBPATRP-UHFFFAOYSA-N 479.798 5.651 5 20 JKBD Cc1nc(-c2ccc([C@H](C)NC(=O)C3CCN(c4ccccc4[N+](=O)[O-])CC3)cc2)cs1 30890373 MZXGZIJHAFPZPA-INIZCTEOSA-N 450.564 5.121 5 20 JKBD CNC(=O)c1ccc(CN(C)C(=O)c2cc([N+](=O)[O-])ccc2Sc2ccc(Cl)cc2)cc1 31532077 OBUVCCBBPVOHPX-UHFFFAOYSA-N 469.950 5.031 5 20 JKBD O=C(COc1ccc([N+](=O)[O-])cc1C(F)(F)F)N1N=C(c2cccs2)C[C@@H]1c1ccco1 72033589 SNFTYXQABXMHDN-OAHLLOKOSA-N 465.409 5.025 5 20 JKBD CSc1ccc(C(=O)c2ccccc2C(=O)N2CCCc3cc(F)c(F)cc32)cc1[N+](=O)[O-] 116880515 YCFTYDLWDVHCSV-UHFFFAOYSA-N 468.481 5.419 5 20 JKBD O=C(Nc1nnc(C(F)F)s1)c1c2c(nc3ccccc13)/C(=C/c1cccc([N+](=O)[O-])c1)CCC2 409460539 GYBSHUKPFIZULT-SDNWHVSQSA-N 493.495 6.061 5 20 JKBD COc1c(C)cnc(CN2CCC(N(C)C(=O)c3cc4ccccc4c4cccnc34)CC2)c1C 485426307 CNKLHTYGIMGIRV-UHFFFAOYSA-N 468.601 5.145 5 20 JKBD C[C@@H](Nc1ccc(C(=O)N2CC3(CCCC3)c3c(F)cccc32)cc1[N+](=O)[O-])c1ccccn1 501790624 DJKAPGYCVGMMBF-QGZVFWFLSA-N 460.509 5.774 5 20 JKBD C[C@@H](Nc1ccc(CC(=O)N2CCCc3ccccc32)cc1)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl 504420681 YITGIHVCFVWRMH-QGZVFWFLSA-N 492.963 5.209 5 20 JKBD Cc1cccn2c(NC(=O)c3ccc(N[C@H](C)c4ccccn4)c([N+](=O)[O-])c3)c(-c3ccccc3)nc12 506011154 YUEPROMGKSTVOM-LJQANCHMSA-N 492.539 6.038 5 20 JKBD CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)N[C@@H](c1ccccc1)c1nc2ccccc2n1C 509684921 BIXRXHSERSILBK-DEOSSOPVSA-N 457.534 5.191 5 20 JKBD CCOC(=O)[C@@H]1CCCCN1C(=O)C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1 509858775 WHNAOQZXAJTKAA-RHYRFBSLSA-N 479.558 5.079 5 20 JKBD O=C(CSc1ncnc2scc(-c3ccc(F)cc3)c12)N1CCc2ccc([N+](=O)[O-])cc21 514357609 WGBGZJCLAGVBGO-UHFFFAOYSA-N 466.519 5.087 5 20 JKBD O=[N+]([O-])c1ccc(-c2noc(CSc3nnc(-c4ccc(Cl)cc4)n3Cc3ccco3)n2)cc1 515134924 WTRKRWAUGIJUEH-UHFFFAOYSA-N 494.920 5.490 5 20 JKBD Cc1ccc(-c2csc(NC(=O)c3c(C)cc(=O)n(-c4ccccc4)c3C)n2)cc1[N+](=O)[O-] 515602512 FYRFBVAWLITAMG-UHFFFAOYSA-N 460.515 5.047 5 20 JKBD CC[C@H](NCc1ccc(-c2cccc([N+](=O)[O-])c2)o1)c1ccccc1OCC(=O)N1CCCC1 517534631 ZHQRAYAAKWPUEJ-QHCPKHFHSA-N 463.534 5.097 5 20 JKBD Cc1ccc(C(=O)N2CCC(NCc3ccc(N(C)c4ccccc4)c([N+](=O)[O-])c3)CC2)cc1 517551307 CXJWCIYFJQALRS-UHFFFAOYSA-N 458.562 5.066 5 20 JKBD CCN(CC)C(=O)c1ccc(CNCc2ccc(-c3ccc([N+](=O)[O-])cc3Br)o2)cc1 518271220 NPQZCTLZUIMQOU-UHFFFAOYSA-N 486.366 5.389 5 20 JKBD COc1cc(/C=C(\CC(=O)O)c2nc3cc(C(F)(F)F)ccc3s2)c([N+](=O)[O-])cc1OC 520764253 SEFFBFURSYNLMF-VZUCSPMQSA-N 468.409 5.256 5 20 JKBD COc1cc(C(=O)Nc2cc(Cl)ccc2Oc2cccc(C)c2)c([N+](=O)[O-])cc1OC(F)F 585701186 OWWZMPSXDOJTNX-UHFFFAOYSA-N 478.835 6.211 5 20 JKBD COc1ccc([C@@H]2CCCN2C(=O)c2ccc(NCc3ccccc3)c([N+](=O)[O-])c2)cc1OC 591887563 FMKUHCLMFHRSOP-QFIPXVFZSA-N 461.518 5.201 5 20 JKBD COc1cc(C(=O)Nc2ccc(NC(=O)NC3CC3)cc2)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 601974783 VCAGDMHXLHLZKH-UHFFFAOYSA-N 496.907 5.585 5 20 JKBD CCN(C(=O)Cc1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1)c1ccccc1OC 603531046 BYCQAKNHGMTGPO-UHFFFAOYSA-N 456.502 5.052 5 20 JKBD CN(C(=O)c1ccc(NC(=O)CSc2ccc([N+](=O)[O-])cc2)cc1Cl)C1CCCCC1 603982360 IFEWOXPOZXDOJX-UHFFFAOYSA-N 461.971 5.384 5 20 JKBD O=C(Nc1cc(OCC(F)(F)F)cc(OCC(F)(F)F)c1)c1cc2cccc([N+](=O)[O-])c2[nH]1 604077350 LUYJTRQGNACQHB-UHFFFAOYSA-N 477.317 5.211 5 20 JKBD COc1ccccc1-c1cc(NC(=O)Cc2cn(-c3ccccc3)nc2-c2ccc([N+](=O)[O-])cc2)n[nH]1 604498932 WCNFPFQKPLPIAK-UHFFFAOYSA-N 494.511 5.027 5 20 JKBD CSc1nnc(CCCNC(=O)c2cc([N+](=O)[O-])ccc2Sc2ccccc2)n1C1CCCC1 604518292 VSXALJBUEDSDHI-UHFFFAOYSA-N 497.646 5.537 5 20 JKBD C[C@H](NCc1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1)c1ccc(OC(F)F)cc1 608835617 FBPMUPSQCZCWII-KRWDZBQOSA-N 464.472 5.900 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)O[C@@H](C)C(=O)Nc2ccccc2Oc2ccccc2)cc1SC 728659150 ZQGHYYHGQLNMHX-HNNXBMFYSA-N 482.514 5.302 5 20 JKBD O=C(CCc1c[nH]c2ccccc12)Oc1ccc2c(-c3ccc([N+](=O)[O-])cc3)cc(=O)oc2c1 890292287 ZOTQTMNNYQRZNT-UHFFFAOYSA-N 454.438 5.388 5 20 JKBD CSc1ccc(C(=O)O[C@@H](C(=O)Nc2ccccc2C(F)(F)F)C(C)C)cc1[N+](=O)[O-] 915367453 XPJUWJRLAVSDML-QGZVFWFLSA-N 456.442 5.156 5 20 JKBD COc1cccc(SCC(=O)Oc2ccc3c(-c4ccc([N+](=O)[O-])cc4)cc(=O)oc3c2)c1 916035167 GAYBCFFARYPUPF-UHFFFAOYSA-N 463.467 5.075 5 20 JKBD C[C@H](Sc1nnc(-c2ccccc2)n1[C@H](C)c1ccccc1)C(=O)Nc1ccc(F)c([N+](=O)[O-])c1 917254090 GTSHPHXIXHVAON-SJORKVTESA-N 491.548 5.721 5 20 JKBD Cc1c(C(=O)O[C@@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2C(F)(F)F)oc2c(C)cccc12 920560156 KPGQIMJBWMQLJU-LBPRGKRZSA-N 450.369 5.161 5 20 JKBD COc1ccc(C(=O)Nc2ccc(C3(NC(=O)CCc4cccc([N+](=O)[O-])c4)CCC3)cc2)s1 1787057877 XROSFOOTKOYYEB-UHFFFAOYSA-N 479.558 5.045 5 20 JKBD C[C@@H](Sc1cccs1)C(=O)Nc1ccc(C2(NC(=O)c3ccc(O)c([N+](=O)[O-])c3)CCC2)cc1 1789416442 NMFWVCXKNBCFMZ-OAHLLOKOSA-N 497.598 5.290 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)c3cc(-c4ccccc4)on3)CCC2)cc1)c1ccc(O)c([N+](=O)[O-])c1 1790616838 KVGYGJDMSHPJJW-UHFFFAOYSA-N 498.495 5.017 5 20 JKBD Cc1c[nH]c(C)c1CCC(=O)NC1(c2ccc(NC(=O)c3cccc(F)c3[N+](=O)[O-])cc2)CCC1 1790700283 XZPFAUHXLLXYER-UHFFFAOYSA-N 478.524 5.059 5 20 JKBD O=C(NC1(c2ccc(NC(=O)c3cc4cc([N+](=O)[O-])ccc4s3)cc2)CCC1)C1=CCCS1 1791010937 JXOSFQNXJZQMAB-UHFFFAOYSA-N 479.583 5.578 5 20 JKBD COc1cc(C(=O)Nc2ccc(C3(NC(=O)c4cccc5ccn(C)c45)CCC3)cc2)ccc1[N+](=O)[O-] 1792164747 UIWDKUQLAUKQIJ-UHFFFAOYSA-N 498.539 5.157 5 20 JKBD O=C(/C=C/c1ccsc1)N1CCCC2(CCN(C(=O)c3cc4cc([N+](=O)[O-])ccc4s3)CC2)C1 1807203214 ATHRXDWVMXYHOA-GORDUTHDSA-N 495.626 5.429 5 20 JKBD O=C(Cc1cccc([N+](=O)[O-])c1)Nc1cc([C@@H]2CCCCN2C(=O)c2cc3sccc3s2)[nH]n1 1814375791 VVPMVFURIMZKEO-KRWDZBQOSA-N 495.586 5.143 5 20 JKBD CCCCC[C@@H](C)C(=O)N1CCC([C@H]2CCCCN2C(=O)Cc2cc([N+](=O)[O-])ccc2F)CC1 1824950088 XALBWJZINLCRTQ-NTKDMRAZSA-N 475.605 5.113 5 20 JKBD CC(C)=CCCC(=O)N1CCCC[C@H]1C1CCN(C(=O)C2(c3cccc([N+](=O)[O-])c3)CCC2)CC1 1830257553 STKAJDGYKPTEAL-VWLOTQADSA-N 481.637 5.383 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)N1CCC([C@H]2CCCCN2C(=O)[C@H](C)c2ccccc2)CC1 1832897995 PJFVOKQTQJYLEX-HOYKHHGWSA-N 481.568 5.079 5 20 JKBD C[C@@H](OC(=O)CCc1ncc(-c2ccc(Cl)cc2Cl)o1)C(=O)Nc1cccc([N+](=O)[O-])c1 12271901 BQHHQMJMKJGOHX-GFCCVEGCSA-N 478.288 5.060 5 20 JKBD Cc1cccc(OCc2nnc(S[C@@H](C)C(=O)Nc3ccc([N+](=O)[O-])cc3C(F)(F)F)o2)c1 12674337 GSTHKRPCLVTTEL-LBPRGKRZSA-N 482.440 5.003 5 20 JKBD COc1cc2c(cc1OC)[C@H](c1ccccc1)N(C(=O)c1ccc(SC)c([N+](=O)[O-])c1)CC2 16002150 QQDUEAAWDPKBIC-DEOSSOPVSA-N 464.543 5.122 5 20 JKBD CCOc1ccc([C@H](C)NC(=O)c2ccccc2NC(=O)c2ccc([N+](=O)[O-])cc2Cl)cc1 25609863 WXROUTXWAFTIBB-HNNXBMFYSA-N 467.909 5.390 5 20 JKBD CSc1ccc(C(=O)c2ccccc2C(=O)NCc2nc3ccccc3s2)cc1[N+](=O)[O-] 27151236 OYMPYNFOFXJZPF-UHFFFAOYSA-N 463.540 5.087 5 20 JKBD CC(C)N(C)c1ccc(NC(=O)c2ccc(N[C@H](C)c3ccccn3)c([N+](=O)[O-])c2)cc1F 108850417 LSRPWASOUDPSEK-MRXNPFEDSA-N 451.502 5.399 5 20 JKBD Cc1cc([C@H]2CCCN2C(=O)c2ccc(Sc3nc4ccccc4s3)c([N+](=O)[O-])c2)on1 481601732 YMJWQYWOMCYWOY-MRXNPFEDSA-N 466.544 5.629 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)Nc2nc(-c3ccc(Br)s3)cs2)cc1SC 482049421 BCUSDGCCPSJPHH-UHFFFAOYSA-N 486.394 5.525 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)Nc2cccc(NC(=O)c3ccccc3)c2C)cc1SC 483328895 XUNVDHZZPZBIJM-UHFFFAOYSA-N 451.504 5.138 5 20 JKBD O=C(NCc1nccs1)c1c2c(nc3ccccc13)/C(=C\c1ccc([N+](=O)[O-])cc1)CCC2 483642076 LTURLVYDORMUCF-VKAVYKQESA-N 456.527 5.406 5 20 JKBD CCn1cc(NC(=O)c2c3c(nc4ccccc24)/C(=C\c2ccc([N+](=O)[O-])cc2)CCC3)ccc1=O 486924899 IWWRLONOUAIKSY-MNDPQUGUSA-N 480.524 5.454 5 20 JKBD O=c1c2cc([N+](=O)[O-])ccc2nc2n1CC/C2=C\c1csc(-c2ccc(C(F)(F)F)cc2)n1 497687822 XKWVIHLSQXRRSP-UKTHLTGXSA-N 470.432 5.391 5 20 JKBD O=C(Cn1c2ccccc2c(=O)c2ccccc21)Nc1ccc(NC(=O)c2ccc(Cl)cc2)cc1 507651092 RMZXIVOSNTUDNF-UHFFFAOYSA-N 481.939 5.699 5 20 JKBD CCOc1cc([N+](=O)[O-])c(C(=O)Nc2cc(F)ccc2Oc2ccc(C)cc2OC)cc1OC 513052053 QGXZGHSLCHBLTG-UHFFFAOYSA-N 470.453 5.503 5 20 JKBD COc1cc(C(=O)Nc2nnc(-c3ccsc3)s2)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 515871674 SBKNIKOMECDZPO-UHFFFAOYSA-N 488.934 5.881 5 20 JKBD COc1ccc(-c2ccc(CNCc3cccc(NC(=O)c4ccc(F)cc4)c3)o2)c([N+](=O)[O-])c1 521814568 JVSFLTHWCFDHMG-UHFFFAOYSA-N 475.476 5.545 5 20 JKBD C[C@H](c1cccs1)N(Cc1ccccc1)C(=O)c1ccc(Sc2nncn2C)c([N+](=O)[O-])c1 603531152 HFFADWGQBNUHPL-MRXNPFEDSA-N 479.587 5.340 5 20 JKBD Cc1ccc(C(=O)Nc2ccccc2)cc1NC(=O)c1cc([N+](=O)[O-])ccc1Sc1ccccc1 603762474 NLYOEYDSUDJAPU-UHFFFAOYSA-N 483.549 6.559 5 20 JKBD O=C(CSc1ccc(C(F)(F)F)cc1[N+](=O)[O-])Nc1ccc(Sc2nncs2)cc1 604118754 IAHPFNQXIASRHQ-UHFFFAOYSA-N 472.495 5.347 5 20 JKBD COc1cc2c(cc1OC)[C@@H](c1cccs1)N(C(=O)N[C@@H](C)c1cccc([N+](=O)[O-])c1)CC2 604126285 LMOBZLHSDNQFRV-WNSKOXEYSA-N 467.547 5.092 5 20 JKBD CCOc1cc([N+](=O)[O-])c(C(=O)Nc2ccc(Sc3nc(C)cs3)c(Cl)c2)cc1OC 608875139 ZDYNBYJNJBMDKQ-UHFFFAOYSA-N 479.967 5.824 5 20 JKBD Cc1nn(Cc2ccc(C(=O)N3CCc4sccc4[C@H]3c3cccs3)cc2)c(C)c1[N+](=O)[O-] 609549844 NPYXOTFWRKTHOD-QHCPKHFHSA-N 478.599 5.367 5 20 JKBD CCOC(=O)/C(=C\c1ccc(-c2cccc([N+](=O)[O-])c2)s1)c1nc(O)c2c(C)c(C)sc2n1 728699937 JLEFDWQAXZRTCH-BOPFTXTBSA-N 481.555 5.754 5 20 JKBD C[C@@H](OC(=O)c1csc(-c2ccc([N+](=O)[O-])cc2)n1)C(=O)Nc1nc(-c2ccccc2)cs1 747956616 IEPUVTVDMWVFNQ-CYBMUJFWSA-N 480.527 5.026 5 20 JKBD C[C@@H](OC(=O)c1csc(-c2ccc([N+](=O)[O-])cc2)n1)C(=O)N[C@H](C)c1cccc2ccccc12 747956665 JDRTVFZKBALHBR-HZPDHXFCSA-N 475.526 5.294 5 20 JKBD Cc1ccc([C@H](NC(=O)COC(=O)c2csc(-c3ccc([N+](=O)[O-])cc3)n2)c2cccs2)cc1 747958827 WFXCCNMGFLJSLM-QFIPXVFZSA-N 493.566 5.151 5 20 JKBD C[C@@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)Nc1ccc(N2CCc3sccc3C2)cc1 748648172 AOZMOYUOHJVYQM-CQSZACIVSA-N 457.939 5.278 5 20 JKBD CC1=C(C(=O)Nc2ccc(F)cc2)[C@H](c2ccc([N+](=O)[O-])o2)NC(=S)N1c1ccc(C)c(C)c1 812835122 MVEBCPBKCKZZQO-QFIPXVFZSA-N 480.521 5.292 5 20 JKBD COc1ccc(Oc2ccc([N+](=O)[O-])cc2C(=O)Nc2cc([N+](=O)[O-])ccc2OC(F)F)cc1 915283354 NGVIYKYAGQGSBJ-UHFFFAOYSA-N 475.360 5.158 5 20 JKBD Cc1ccc(/C(O)=C(/C(=S)NC(C)(C)C)[n+]2ccc(Cc3ccccc3)cc2)cc1[N+](=O)[O-] 917613637 KYZJAZKUFUFRAB-UHFFFAOYSA-O 462.595 5.381 5 20 JKBD O=C(CCc1ncc(-c2ccc(Cl)cc2Cl)o1)OCCOc1ccccc1[N+](=O)[O-] 919054980 UROVITCBXYEHIG-UHFFFAOYSA-N 451.262 5.111 5 20 JKBD O=C(Nc1ccc(Oc2ccc(Cl)cc2)nc1)c1cc([N+](=O)[O-])ccc1I 919994855 PZBNTRWVLSYKTM-UHFFFAOYSA-N 495.660 5.292 5 20 JKBD Cc1cc(Cl)ccc1NC(=O)[C@@H](C)OC(=O)c1ccc(N[C@@H](C)c2ccccn2)c([N+](=O)[O-])c1 920548163 QEVMJDFUGPZTCU-JKSUJKDBSA-N 482.924 5.309 5 20 JKBD O=C(COC(=O)c1cccnc1Oc1ccc(Cl)cc1Cl)Nc1cc([N+](=O)[O-])ccc1F 920912541 NLKNOUXUARZEIO-UHFFFAOYSA-N 480.235 5.024 5 20 JKBD CC(C)(C)n1cc(C(=O)Nc2ccc(C3(NC(=O)/C=C/c4ccccc4[N+](=O)[O-])CCC3)cc2)cn1 1787072356 PVXIYRCXUCWJLT-NTEUORMPSA-N 487.560 5.007 5 20 JKBD COc1cc(C(=O)Nc2ccc(C3(NC(=O)c4ccc5ccoc5c4)CCC3)cc2)ccc1[N+](=O)[O-] 1792165844 OHWUMXNVQXSQDK-UHFFFAOYSA-N 485.496 5.411 5 20 JKBD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(F)ccc1Cl)c1cc2cc([N+](=O)[O-])ccc2s1 1800462913 DPTITAQOPSIBEF-MUJYYYPQSA-N 487.940 5.168 5 20 JKBD Cc1ccc(C(=O)N2CCCC3(CCN(C(=O)c4c(F)ccc([N+](=O)[O-])c4C)CC3)C2)cc1Cl 1805084457 HSLOPFHRUNAVQT-UHFFFAOYSA-N 487.959 5.163 5 20 JKBD Cc1ccc(-c2ccccc2C(=O)Nc2cc([C@@H]3CCCCN3C(=O)c3ccc([N+](=O)[O-])[nH]3)[nH]n2)cc1 1821225803 MQSNGIXYKGTNQY-QHCPKHFHSA-N 498.543 5.241 5 20 JKBD Cc1ccc(C)c(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)CSc3ccccc3[N+](=O)[O-])[nH]n2)c1 1823145158 BEOHUUYJDRDJBI-FQEVSTJZSA-N 493.589 5.033 5 20 JKBD Cc1ccc(C(=O)Nc2cc([C@H]3CCCCN3C(=O)c3cccc(F)c3[N+](=O)[O-])[nH]n2)c(Cl)c1 1823186990 UIHJIWFJDKQUCY-LJQANCHMSA-N 485.903 5.039 5 20 JKBD O=C(c1cc(F)cc([N+](=O)[O-])c1)N1CCC([C@@H]2CCCCN2C(=O)c2cc3ccoc3s2)CC1 1827413025 DLFVRYKBMMBODC-FQEVSTJZSA-N 485.537 5.089 5 20 JKBD O=C(C1CCC(c2ccc(Cl)cc2)CC1)N1CC2(CCCN2C(=O)c2cc(F)cc([N+](=O)[O-])c2)C1 1845402276 LNERCRBCRHTCBF-UHFFFAOYSA-N 499.970 5.178 5 20 JKBD Cc1oc(-c2ccccc2)nc1C(=O)O[C@@H](C(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1)c1ccccc1 9717701 XBXUGBDIZFFLCK-JOCHJYFZSA-N 491.887 5.748 5 20 JKBD COc1cc(C(=O)OCC(=O)Nc2ccc(F)cc2F)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 10912007 URPIKHWEUYAELP-UHFFFAOYSA-N 492.818 5.123 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Cl)[C@@H](Nc1cccc(C2SCCS2)c1)c1ccccc1 15500386 VWXPRFGVZBOPLZ-NRFANRHFSA-N 486.018 6.519 5 20 JKBD CC1=C(C(=O)N(C)C)[C@H](c2ccc(Cl)c([N+](=O)[O-])c2)NC(=S)N1c1cccc(C(F)(F)F)c1 16060087 IZEHKTXZLBHIAJ-SFHVURJKSA-N 498.914 5.065 5 20 JKBD C[C@H](OC(=O)c1csc(-c2cccc(Cl)c2)n1)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl 17980857 KRZMILCAKAFLOK-JTQLQIEISA-N 466.302 5.209 5 20 JKBD C[C@@H](OC(=O)c1ccc(Br)c([N+](=O)[O-])c1)C(=O)Nc1c(Cl)cc(Cl)cc1Cl 22622475 JUZBWFHTKXHDBZ-SSDOTTSWSA-N 496.528 5.502 5 20 JKBD CCN(CC)C(=O)Cc1ccc(N[C@@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2ccccc2)cc1 27038961 JKWSFRGTKBOFPQ-RUZDIDTESA-N 494.979 5.451 5 20 JKBD CC(C)CCSc1ccc(C(=O)Nc2ccc(NS(C)(=O)=O)c(Cl)c2)cc1[N+](=O)[O-] 32003556 CRJQRGMXEIEOOE-UHFFFAOYSA-N 471.988 5.010 5 20 JKBD CCn1c(S[C@@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2C(F)(F)F)nnc1-c1cccs1 36202487 ZLODNQHYRQRPQY-JTQLQIEISA-N 471.486 5.073 5 20 JKBD C[C@@H](Nc1ccc(C(=O)Nc2ccccc2Oc2ccccc2)cc1[N+](=O)[O-])c1ccccn1 72016478 XHCHPVJKBNKOGX-GOSISDBHSA-N 454.486 6.208 5 20 JKBD Cc1nn(Cc2ccc(C(=O)NC3(c4cccc(Br)c4)CCC3)cc2)c(C)c1[N+](=O)[O-] 108690001 ILHOEAIXNGKOTA-UHFFFAOYSA-N 483.366 5.028 5 20 JKBD C[C@@H](CCc1ccc(Br)cc1)NC(=O)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-] 108771823 MOCBFDRDLUGFPY-LBPRGKRZSA-N 475.261 5.050 5 20 JKBD Cc1nn(Cc2ccc(C(=O)Nc3ccc(Cl)c(C(F)(F)F)c3)cc2)c(C)c1[N+](=O)[O-] 491000238 ZPOXEEIACHUULS-UHFFFAOYSA-N 452.820 5.381 5 20 JKBD C[C@@H](Nc1ccc(C(=O)Nc2ccc(Oc3ccncc3)c(Cl)c2)cc1[N+](=O)[O-])c1ccccn1 504842203 JDOKTKVIHCSFQW-MRXNPFEDSA-N 489.919 6.256 5 20 JKBD Cc1ccc(Sc2ccc(C(=O)N3CCC(NC(=O)c4ccsc4)CC3)cc2[N+](=O)[O-])cc1 511574450 KFOUYEAFKLLNOD-UHFFFAOYSA-N 481.599 5.151 5 20 JKBD CCOc1cc(C(=O)Nc2cc(F)ccc2Oc2ccc(C)cc2OC)c([N+](=O)[O-])cc1OC 513049776 BBWMELDMNOGCDL-UHFFFAOYSA-N 470.453 5.503 5 20 JKBD Cc1csc(Sc2ccc(C(=O)Nc3ccc(NC4CCOCC4)cc3)cc2[N+](=O)[O-])n1 513061666 OMMHQIBPVFYELZ-UHFFFAOYSA-N 470.576 5.354 5 20 JKBD CC(C)NC(=O)Nc1ccc(CNCc2ccc(Oc3ccc(F)cc3)c([N+](=O)[O-])c2)cc1 513622614 VOGWJBIAVGUVSL-UHFFFAOYSA-N 452.486 5.346 5 20 JKBD COc1ccccc1C[C@@H](C)N(Cc1ccccc1)Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1 513962325 VPVPIITULKKLGU-LJQANCHMSA-N 458.518 5.287 5 20 JKBD O=C(Nc1cc([N+](=O)[O-])ccc1OC(F)F)c1oc2ccccc2c1CSc1ncccn1 519489672 BAFNOTRIHXDJOG-UHFFFAOYSA-N 472.429 5.277 5 20 JKBD O=C(c1ccc(C(=O)N2CCC[C@@H]2c2ccccc2)c([N+](=O)[O-])c1)N1CCC[C@@H]1c1ccccc1 524353866 OUVWKRJSVPVGHL-JWQCQUIFSA-N 469.541 5.549 5 20 JKBD O=C(NC[C@@H]1CCCN(C(=O)c2cc3ccccc3c3cccnc23)C1)Nc1cccc(F)c1 524482709 KPOZOLXBDOHHMM-SFHVURJKSA-N 456.521 5.201 5 20 JKBD CN(Cc1ccc(F)cc1)C(=O)C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1 599167091 XGBYICHLBQAISF-RGEXLXHISA-N 461.518 5.933 5 20 JKBD O=C(C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1)N1CCC[C@H]1c1ccc(Cl)cc1 603506692 GZMFEJDEBNUDOK-IBGZPJMESA-N 481.902 5.847 5 20 JKBD C[C@H]1C[C@@H](C)CN(c2ccc(C(=O)N3CCC[C@@H](c4nc5ccccc5o4)C3)cc2[N+](=O)[O-])C1 603609381 MIRGWPKAVRIWJY-WSTZPKSXSA-N 462.550 5.238 5 20 JKBD O=C(Nc1ccnn1Cc1cccc(Br)c1)c1cc2cc([N+](=O)[O-])ccc2s1 603757142 PMURONGCJNGRTN-UHFFFAOYSA-N 457.309 5.069 5 20 JKBD C[C@@H](NC(=O)c1ccc(N2CCCC2)c([N+](=O)[O-])c1)c1cccc(NC(=O)Cc2ccccc2F)c1 603765119 XSGRMDJADXROPP-GOSISDBHSA-N 490.535 5.006 5 20 JKBD O=C(Nc1cc([N+](=O)[O-])ccc1OC(F)F)N1CCc2[nH]c3ccc(Br)cc3c2C1 603829800 IATQYHFXTJUXEC-UHFFFAOYSA-N 481.253 5.030 5 20 JKBD C[C@H](N[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Br)c1ccccc1)c1c(F)cccc1F 604047858 NUVREFIEAMTYAN-ZSEKCTLFSA-N 490.304 5.666 5 20 JKBD Cc1ccccc1NC(=O)[C@@H]1CCc2ccccc2N1C(=O)C1CCN(c2ccccc2[N+](=O)[O-])CC1 608872014 JVKDXDZAGIEOAT-MHZLTWQESA-N 498.583 5.106 5 20 JKBD C[C@H](Nc1ccc(C(=O)Nc2ccc(-c3noc(C(F)(F)F)n3)cc2)cc1[N+](=O)[O-])c1ccccn1 608875536 RIOFWOHZVNSZLI-ZDUSSCGKSA-N 498.421 5.484 5 20 JKBD Cc1ccc(S(=O)(=O)Nc2ccc(NC(=O)c3oc4c(F)cccc4c3C)cc2)cc1[N+](=O)[O-] 609453786 BKTQWXPKCLQFPP-UHFFFAOYSA-N 483.477 5.150 5 20 JKBD C[C@@H](OC(=O)c1cc([N+](=O)[O-])ccc1Br)C(=O)Nc1ccccc1Oc1ccccc1 725985243 JDLGWQUIUGMOBX-CQSZACIVSA-N 485.290 5.334 5 20 JKBD Cc1ccc(Br)cc1NC(=O)CNCc1ccc(-c2ccccc2[N+](=O)[O-])s1 726606053 RPWFVEUNAMJTGZ-UHFFFAOYSA-N 460.353 5.123 5 20 JKBD CN(C(=O)CSc1ccccc1C(=O)Nc1ccc([N+](=O)[O-])c(Cl)c1)C1CCCCC1 727711159 DESQYBCIXPDTNX-UHFFFAOYSA-N 461.971 5.384 5 20 JKBD O=C(COC(=O)c1c(Cl)cccc1[N+](=O)[O-])Nc1cc(C(F)(F)F)ccc1N1CCCCC1 730646377 DIPKPLOGFATSEF-UHFFFAOYSA-N 485.846 5.053 5 20 JKBD COC1CCN(c2ccc(Nc3nc4ccc([N+](=O)[O-])cc4s3)cc2C(F)(F)F)CC1 731210488 YXTYPZJOWCXHJC-UHFFFAOYSA-N 452.458 5.582 5 20 JKBD O=C(Oc1ccc(C(=O)N2CCc3sccc3C2)cc1)c1csc(-c2ccc([N+](=O)[O-])cc2)n1 731334061 QIIARNXOZKFYKG-UHFFFAOYSA-N 491.550 5.198 5 20 JKBD C[C@@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)O[C@H](C)c1ccccc1NC(=O)c1ccccc1 748019692 CDXQJJQAQVGQMO-IAGOWNOFSA-N 450.516 5.632 5 20 JKBD CC(C)(C)n1ccnc1SCC(=O)Oc1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2Cl)cc1 749563848 SJXODHXCWWMFOH-UHFFFAOYSA-N 488.953 5.150 5 20 JKBD O=C(Nc1ccc(F)c(NC(=O)C2CCCCC2)c1)c1cc([N+](=O)[O-])ccc1Br 751089075 SFFORANHXWVBHR-UHFFFAOYSA-N 464.291 5.268 5 20 JKBD C[C@@H](OC(=O)c1occc1CSc1ccccc1)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl 792737891 ZKHXHYRSGKSEEL-CYBMUJFWSA-N 460.895 5.318 5 20 JKBD O=C(OCC(=O)N(Cc1ccccc1)c1nc(-c2ccc(Cl)cc2)cs1)c1ccc([N+](=O)[O-])o1 797157791 TWHSIVORAAZTAC-UHFFFAOYSA-N 497.916 5.355 5 20 JKBD CC(C)Cn1cc([C@@H]2N(C(=O)c3ccc(Nc4ccccc4)c([N+](=O)[O-])c3)CC23CCOCC3)cn1 849528817 BTDJMWPZRMXSGU-VWLOTQADSA-N 489.576 5.185 5 20 JKBD O=C(Nc1ccccc1C(=O)Nc1nnc(Cc2ccccc2)s1)c1ccc([N+](=O)[O-])cc1Cl 864025257 ARKDVEYJIFGCPQ-UHFFFAOYSA-N 493.932 5.195 5 20 JKBD Cc1cc([N+](=O)[O-])nn1Cc1cccc(-c2nc(-c3cccc(NC(=O)OC(C)(C)C)c3)no2)c1 904634338 LZLSZYASOORCNH-UHFFFAOYSA-N 476.493 5.212 5 20 JKBD CCC(CC)c1cc[n+](/C(C(=S)N[C@H]2C[C@H]3CC[C@H]2C3)=C(/O)c2ccc(C)c([N+](=O)[O-])c2)cc1 912844126 NDJNJEQXPRVBDY-HARLFGEKSA-O 480.654 6.084 5 20 JKBD Cc1cc(NC(=O)c2cccc(F)c2)sc1C(=O)O[C@H](C)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 915592838 VQFCUHXBZVGRFS-CYBMUJFWSA-N 496.476 5.324 5 20 JKBD CCCN(CC(=O)Nc1ccc(Cl)cc1Cl)[C@H](C)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl 916147191 BVKKGPYRVVBPOC-GFCCVEGCSA-N 487.771 5.233 5 20 JKBD CC(=O)N(c1ccc(C)cc1)c1nc(CSc2nc3ccc([N+](=O)[O-])cc3s2)cs1 917561577 UAYDVFWHIPSTJM-UHFFFAOYSA-N 456.574 5.946 5 20 JKBD COc1cc(C(=O)Nc2ccccc2SC[C@H]2CC2(Cl)Cl)c([N+](=O)[O-])cc1OC 917749894 PJBJXBUODWVOBA-LLVKDONJSA-N 457.335 5.150 5 20 JKBD C[C@H](OC(=O)[C@@H](C)Oc1cccc(C(C)(C)C)c1)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 919407280 JIPHHTBWINRVDS-UONOGXRCSA-N 482.455 5.249 5 20 JKBD Cc1cc(COc2ccc(C(=O)Nc3ccc(Cl)c([N+](=O)[O-])c3)cc2Br)on1 921276907 PYMJAXJHEMBRJY-UHFFFAOYSA-N 466.675 5.138 5 20 JKBD O=C(NC1(c2ccc(NC(=O)c3cccc4cc[nH]c34)cc2)CCC1)c1cccc(F)c1[N+](=O)[O-] 1789094084 UFKJLULGDJFYSY-UHFFFAOYSA-N 472.476 5.277 5 20 JKBD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)Cc1ccc(Cl)cc1[N+](=O)[O-])c1cc2sccc2s1 1793078753 CNISSKKKQPUBBP-MUJYYYPQSA-N 490.006 5.019 5 20 JKBD O=C(c1cc2ccoc2s1)N1CCC([C@@H]2CCCCN2C(=O)/C=C/c2ccccc2[N+](=O)[O-])CC1 1832907485 VAMZCILHSIDIPF-SHBDEGQCSA-N 493.585 5.349 5 20 JKBD O=C(O)c1ccc(C=Cc2c3ccccc3c(C=Cc3ccc(C(=O)O)cc3)c3ccccc23)cc1 2332239719 ATNHSEKOZXABDI-UHFFFAOYSA-N 470.524 7.730 5 20 JKBD C[C@@H](OC(=O)c1cc2c(s1)-c1ccccc1OC2)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl 9816420 OLXQLZWYOKTYFQ-LLVKDONJSA-N 458.879 5.053 5 20 JKBD O=C(Cn1c2ccccc2c(=O)c2ccccc21)Nc1ccc(-c2cn3ccsc3n2)cc1 14218280 FVRMQHNMXWVRSB-UHFFFAOYSA-N 450.523 5.170 5 20 JKBD Cc1ccccc1CN[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Br)c1ccccc1 18942377 CIOXTGJLLRGCFS-NRFANRHFSA-N 454.324 5.135 5 20 JKBD CC(C)CC(=O)Nc1ccc(NC(=O)Cc2cn(-c3ccccc3)nc2-c2ccc([N+](=O)[O-])cc2)cc1 25757206 AJJWBTVQOFICKT-UHFFFAOYSA-N 497.555 5.613 5 20 JKBD CC[C@H](C)[C@@H](NC(=O)c1ccc(N[C@@H](C)c2ccccn2)c([N+](=O)[O-])c1)c1nc2ccccc2[nH]1 410078167 QGLDFKXGBHXJAG-WOGXIUBCSA-N 472.549 5.556 5 20 JKBD O=C(NC1CCN(C2CC2)CC1)c1ccccc1Sc1ccc(C(F)(F)F)cc1[N+](=O)[O-] 485362242 VVRBJWVDZYFPLA-UHFFFAOYSA-N 465.497 5.121 5 20 JKBD CC[C@H](C)Sc1ccc(NC(=O)C(=O)N[C@@H](C)c2cccc([N+](=O)[O-])c2)c(C(F)(F)F)c1 501442868 UREXANNUXAHROT-STQMWFEESA-N 469.485 5.320 5 20 JKBD Cc1csc(Sc2ccc(C(=O)Nc3cccc(C(=O)Nc4ccccn4)c3)cc2[N+](=O)[O-])n1 505810798 DAPCXLYHSJLDNS-UHFFFAOYSA-N 491.554 5.411 5 20 JKBD O=C(Nc1ncc(Cc2ccc(C(F)(F)F)cc2)s1)c1cnn(-c2ccc([N+](=O)[O-])cc2)c1 514029502 RXTJGMGNDSUEDK-UHFFFAOYSA-N 473.436 5.099 5 20 JKBD CC(C)OC(=O)C[C@@H](NC(=O)Nc1ccc(OC(F)F)c(Cl)c1)c1ccccc1[N+](=O)[O-] 515223891 BOMJSGAZALNMLV-OAHLLOKOSA-N 471.844 5.054 5 20 JKBD CCCOc1cc(NC(=O)N2CCC[C@@H]2c2nc3ccc(C)cc3[nH]2)c([N+](=O)[O-])cc1OCCC 519935059 SHSSBUDHUBUPRG-HXUWFJFHSA-N 481.553 5.726 5 20 JKBD Cc1csc(CCNC(=O)C/C(=C/c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)n1 603558562 NHCBNGZTMZHYNA-ATVHPVEESA-N 464.572 5.259 5 20 JKBD NC(=O)c1cc(NC(=O)c2c3c(nc4ccccc24)/C(=C\c2cccc([N+](=O)[O-])c2)CCC3)ccc1F 603571698 WFSDLGUSTYOUJX-LGMDPLHJSA-N 496.498 5.510 5 20 JKBD O=[N+]([O-])c1ccc(-c2noc(CSc3nnc(-c4ccco4)n3C3CCCCC3)n2)cc1 603680276 WYMWQWDMZHEBCJ-UHFFFAOYSA-N 452.496 5.294 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Br)[C@@H](NCc1cc2ccccc2o1)c1ccccc1 604045600 ZDTTWENGQUTCCG-QFIPXVFZSA-N 480.318 5.573 5 20 JKBD COc1cc(C(=O)NC2(c3cccc(C)c3)CCCC2)c([N+](=O)[O-])cc1OCc1cscn1 608948415 KBISNJIUNWPTKD-UHFFFAOYSA-N 467.547 5.147 5 20 JKBD O=C(COC(=O)c1csc(-c2cccc(C(F)(F)F)c2)n1)Nc1ccc(Cl)cc1[N+](=O)[O-] 725995666 FPTNWABMPVUVSR-UHFFFAOYSA-N 485.827 5.186 5 20 JKBD Cc1nn(Cc2ccc(C(=O)Nc3ccc(NC(=O)OC(C)(C)C)cc3)cc2)c(C)c1[N+](=O)[O-] 729402029 NCTQYIWOIVAESF-UHFFFAOYSA-N 465.510 5.056 5 20 JKBD Cc1cccc(C(C)C)c1NC(=O)[C@H](C)OC(=O)c1ccc(Cn2nc(C)c([N+](=O)[O-])c2C)cc1 742409805 LGQFNHWMSVUNAK-IBGZPJMESA-N 478.549 5.072 5 20 JKBD C[C@H](OC(=O)c1csc(-c2ccc([N+](=O)[O-])cc2)n1)C(=O)Nc1ccccc1-c1ccccc1 747956273 QKGHSYPQLZENNE-INIZCTEOSA-N 473.510 5.569 5 20 JKBD C[C@@H](OC(=O)Cc1cc(Cl)ccc1Cl)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 748388965 CKUADJBNMDDCTE-SECBINFHSA-N 465.211 5.033 5 20 JKBD O=C(OCC(=O)N1c2ccccc2Sc2ccccc21)c1ccc(N2CCCC2)c([N+](=O)[O-])c1 798279059 CTOIRSDWYNNZQP-UHFFFAOYSA-N 475.526 5.181 5 20 JKBD CCOc1cc(-c2nc(-c3ccc(Oc4ccc(F)cc4)nc3)no2)c([N+](=O)[O-])cc1OC 904506383 LEKACKMLFPBPSV-UHFFFAOYSA-N 452.398 5.046 5 20 JKBD CC(C)C(=O)Nc1ccc(C(=O)Nc2cc(Cl)c([N+](=O)[O-])cc2OCc2ccccc2)cc1 914716078 VHIFUDXHJIMEIK-UHFFFAOYSA-N 467.909 5.674 5 20 JKBD Cc1ccc(S(=O)(=O)Nc2ccc(NC(=S)Nc3ccc(Cl)cc3)cc2)cc1[N+](=O)[O-] 916120179 XJSRCCKGPANWFI-UHFFFAOYSA-N 476.967 5.166 5 20 JKBD O=C(NC1CCC2(CC1)OCCO2)c1ccccc1Sc1ccc(C(F)(F)F)cc1[N+](=O)[O-] 916428989 SZTGBSCIDNSMNM-UHFFFAOYSA-N 482.480 5.180 5 20 JKBD O=C(Nc1ccc(N2CCOC2=O)cc1)c1cc([N+](=O)[O-])ccc1Sc1ccc(Cl)cc1 918388611 UUGBEORHOLOOPU-UHFFFAOYSA-N 469.906 5.608 5 20 JKBD CCOC(=O)N(C)c1ccc(NC(=O)c2ccccc2C(=O)c2ccc(SC)c([N+](=O)[O-])c2)cc1 919768783 ODPPHZADBSPNPL-UHFFFAOYSA-N 493.541 5.393 5 20 JKBD C[C@H](OC(=O)CSc1ccccc1[N+](=O)[O-])c1nc(-c2cccc(C(F)(F)F)c2)no1 923401214 RYCWAEGLWNGBFR-NSHDSACASA-N 453.398 5.060 5 20 JKBD O=C(CCc1c[nH]c2ccc(F)cc12)NC1(c2ccc(NC(=O)c3ccc([N+](=O)[O-])o3)cc2)CCC1 1785751516 HAFFSHCCJMSLCU-UHFFFAOYSA-N 490.491 5.189 5 20 JKBD C[C@@H](C(=O)NC1(c2ccc(NC(=O)Cc3ccc(Cl)cc3[N+](=O)[O-])cc2)CCC1)c1ccccn1 1786115647 BYTHQLWVLVIGKT-QGZVFWFLSA-N 492.963 5.124 5 20 JKBD O=C(/C=C/c1ccc([N+](=O)[O-])o1)Nc1ccc(C2(NC(=O)c3cc4ccsc4[nH]3)CCC2)cc1 1786207929 UPUBOUMYAJWVIE-SOFGYWHQSA-N 476.514 5.192 5 20 JKBD COc1cc(C(=O)Nc2ccc(C3(NC(=O)CCC4CCCC4)CCC3)cc2)cc([N+](=O)[O-])c1OC 1790813086 NLXGYCCGBOXRLZ-UHFFFAOYSA-N 495.576 5.330 5 20 JKBD O=C(/C=C/c1ccccc1[N+](=O)[O-])NC1(c2ccc(NC(=O)C(F)(F)c3ccco3)cc2)CCC1 1791080336 ABDHVDAZBGZTRM-MDWZMJQESA-N 481.455 5.127 5 20 JKBD Cc1cc(O)c([N+](=O)[O-])cc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cc3c(Cl)cccc3s1)C2 1800802795 FOOFLJUAPAPMTF-QDMKHBRRSA-N 499.976 5.043 5 20 JKBD C[C@H](C(=O)N1CCCC[C@H]1c1cc(NC(=O)Cc2ccc(Cl)cc2[N+](=O)[O-])n[nH]1)c1ccccc1 1814846355 OHWQKCKRQXVCBO-KKSFZXQISA-N 495.967 5.010 5 20 JKBD Cc1ccc(-c2ccccc2C(=O)Nc2cc([C@H]3CCCCN3C(=O)c3ccc([N+](=O)[O-])[nH]3)[nH]n2)cc1 1821225802 MQSNGIXYKGTNQY-HSZRJFAPSA-N 498.543 5.241 5 20 JKBD Cc1cc(C(=O)N2CCC([C@H]3CCCCN3C(=O)c3ccc(C(C)(C)C)s3)CC2)ncc1[N+](=O)[O-] 1827904326 WNHAFHPMVIGXOQ-HXUWFJFHSA-N 498.649 5.204 5 20 JKBD CCCCC[C@@H](C)C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2ccc([N+](=O)[O-])c(OC)c2)CC1 1831467789 AMRFMQHZEZFIJY-KNQAVFIVSA-N 473.614 5.053 5 20 JKBD C[C@@H](CC(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cc(F)cc([N+](=O)[O-])c2)CC1)c1ccccc1 1831509003 GIHJHBLLLVXLET-DFBJGRDBSA-N 481.568 5.161 5 20 JKBD COc1ccc(/C=C/C(=O)O[C@@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2ccccc2)cc1OC 10795882 ZYVOSXUBNNAUSJ-GPOLZQFCSA-N 496.903 5.202 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Br)[C@H](N[C@H]1CCSc2ccccc21)c1ccccc1 19669660 KRFYFFDLYRXCNM-SIKLNZKXSA-N 498.402 5.864 5 20 JKBD CCc1cccc(CC)c1NC(=O)[C@H](C)OC(=O)c1ccc(Sc2nc(C)cs2)c([N+](=O)[O-])c1 23968915 KCYXACADESNPNL-HNNXBMFYSA-N 499.614 5.820 5 20 JKBD Cc1ccc(-n2c(SCC(=O)Nc3ccccc3[N+](=O)[O-])nnc2-c2ccccc2F)cc1 28387350 HEFPTIOCGJUMKN-UHFFFAOYSA-N 463.494 5.021 5 20 JKBD COc1ccc(Oc2ccc([N+](=O)[O-])cc2C(=O)Nc2cc(Cl)c(OC)cc2OC)cc1 33152917 UIHKDUNVOIFULW-UHFFFAOYSA-N 458.854 5.319 5 20 JKBD O=C(CSc1nnc(-c2ccccc2Cl)n1-c1ccccc1F)Nc1ccccc1[N+](=O)[O-] 39482831 YXTXTGFAURADLD-UHFFFAOYSA-N 483.912 5.366 5 20 JKBD CSc1ccc([N+](=O)[O-])c(C(=O)N[C@H](C)c2ccc(NC(=O)c3ccc(F)cc3)cc2)c1 71988602 OWAWZMJZPCLMNO-CQSZACIVSA-N 453.495 5.199 5 20 JKBD C[C@H](OC(=O)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1)c1nc(-c2cccnc2)no1 105448581 QUAYKNXFNHUDDA-ZDUSSCGKSA-N 466.837 5.404 5 20 JKBD Cc1cc(NC(=O)c2nc(Cl)c(Cl)c(Cl)c2Cl)n(-c2ccc([N+](=O)[O-])cc2)n1 105584197 QUUIPYSSWTZSIY-UHFFFAOYSA-N 461.092 5.350 5 20 JKBD C[C@@H](Nc1ccc(C(=O)NCc2ccccc2CN2CCCCC2)cc1[N+](=O)[O-])c1ccccn1 108787725 XUEKBPYNYSHKLE-HXUWFJFHSA-N 473.577 5.079 5 20 JKBD Cc1cc(C(=O)N2CCCC[C@@H]2C)ccc1NC(=O)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-] 109249773 OJZYFCCKRQCFSF-HNNXBMFYSA-N 479.455 5.111 5 20 JKBD CSc1ccc(C(=O)c2ccccc2C(=O)Nc2cccc(-c3nc(C)c(C)o3)c2)cc1[N+](=O)[O-] 115719379 HUGIJJKZWFAPCG-UHFFFAOYSA-N 487.537 6.072 5 20 JKBD O=C(Nc1ccc(NC(=O)[C@@H]2CCCO2)cc1C(F)(F)F)c1cc2cc([N+](=O)[O-])ccc2s1 117255198 HERFHKHSRFCKCJ-INIZCTEOSA-N 479.436 5.198 5 20 JKBD O=C(C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)N1CC[C@@H](c2ccccc2F)C1 410290404 RLRVCLAGXROKNR-GCFJHJGGSA-N 487.556 6.290 5 20 JKBD O=C(Nc1ccccc1C(=O)N1CCC(OC2CCCC2)CC1)c1ccc([N+](=O)[O-])cc1Cl 503852802 FQJVXMTZETYOKO-UHFFFAOYSA-N 471.941 5.064 5 20 JKBD CCc1cc(Sc2nnc(COc3ccc(Cl)cc3)n2C)nc(-c2ccc([N+](=O)[O-])cc2)n1 507109068 AGNWUXPKEMMTLF-UHFFFAOYSA-N 482.953 5.126 5 20 JKBD COc1ccc([N+](=O)[O-])cc1NC(=O)N(C)[C@H]1CCSc2ccc(Br)cc21 509071928 RWJHFXQVEFCTMI-HNNXBMFYSA-N 452.330 5.067 5 20 JKBD C[C@@H](NC(=O)Nc1ccc(NC(=O)c2ccc(F)cc2)cc1C(F)(F)F)c1cccc([N+](=O)[O-])c1 509972234 NEMYIZHRPFKPOC-CYBMUJFWSA-N 490.413 5.888 5 20 JKBD Cc1ccc(Sc2ccc(C(=O)Nc3ccc(C)cc3OCC(=O)N(C)C)cc2[N+](=O)[O-])cc1 511313457 HJJSSSNVHRDYOU-UHFFFAOYSA-N 479.558 5.082 5 20 JKBD CCCN(C(=O)c1cc(OC)c(OCc2cscn2)cc1[N+](=O)[O-])[C@@H](C)c1cc2ccccc2o1 511428180 WEHNEGZAXXWQHO-INIZCTEOSA-N 495.557 5.999 5 20 JKBD C[C@H](SCc1ncc(-c2ccc(Cl)cc2)o1)C(=O)Nc1cc2c(cc1[N+](=O)[O-])OCCCO2 512976860 BNEPZLOTKMDGJE-ZDUSSCGKSA-N 489.937 5.325 5 20 JKBD CCC(=O)Nc1cccc(CNCc2ccc(-c3ccc([N+](=O)[O-])cc3Br)o2)c1 518265362 WGJJERRSHLWVKI-UHFFFAOYSA-N 458.312 5.256 5 20 JKBD COc1cc(C(=O)N2CCC(c3nc4cc(Cl)ccc4o3)CC2)c([N+](=O)[O-])cc1OC(F)F 603921722 JSNVKNIXLUEGTD-UHFFFAOYSA-N 481.839 5.019 5 20 JKBD CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)c1ccc(NS(=O)(=O)c2ccc(Cl)s2)cc1 604346311 CNBGOCWNLJVQBL-UHFFFAOYSA-N 493.994 5.161 5 20 JKBD C[C@@H]1C[C@@H](C)CN(c2ccc(C(=O)Nc3ccc4nc([C@H]5CCCO5)[nH]c4c3)cc2[N+](=O)[O-])C1 604480818 LXNQBPDYUDOBHT-CKNGIIGNSA-N 463.538 5.057 5 20 JKBD C[C@H](NCc1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1)c1ccccc1OC(F)F 608835624 FZTUNFQYPQCKLG-KRWDZBQOSA-N 464.472 5.900 5 20 JKBD Cc1ccc(NC(=O)c2ccc(N3C[C@H](C(F)(F)F)C[C@@H](C(F)(F)F)C3)c([N+](=O)[O-])c2)cc1 608974490 ATEHOIRDPAKWIS-HUUCEWRRSA-N 475.389 5.723 5 20 JKBD COc1ccccc1NC(=O)c1cc2ccccc2cc1OC(=O)c1ccc([N+](=O)[O-])c(OC)c1 726320684 WDZYEENENAPYMV-UHFFFAOYSA-N 472.453 5.237 5 20 JKBD CCCc1cc[n+](/C(C(=S)Nc2ccc(OC(C)C)cc2)=C(/O)c2ccc([N+](=O)[O-])cc2)cc1 726574220 OKFAVMMSIFNSEK-UHFFFAOYSA-O 478.594 5.945 5 20 JKBD O=C1/C(=C\c2ccc(-c3ccccc3[N+](=O)[O-])o2)NC(=S)N1c1ccccc1C(F)(F)F 747968341 CIUAJPFJHMWUFM-RVDMUPIBSA-N 459.405 5.136 5 20 JKBD C[C@H](NC(=O)c1ccccc1NC(=O)c1ccc([N+](=O)[O-])cc1Cl)c1ccc(OC(F)F)cc1 913016005 MFXVDOOHKOFDNN-ZDUSSCGKSA-N 489.862 5.593 5 20 JKBD COc1cc(C(=O)N(C)Cc2ccc(Cl)nc2)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 913481614 DOFUYKORXSDQFW-UHFFFAOYSA-N 462.289 5.370 5 20 JKBD O=C(Nc1ccc(F)cc1)NC1CCN(c2cc(Cl)c(C(F)(F)F)cc2[N+](=O)[O-])CC1 917082692 YRNXRECXEMZRAI-UHFFFAOYSA-N 460.815 5.197 5 20 JKBD COc1cc([C@H](C[N+](=O)[O-])c2c[nH]c3ccccc23)ccc1OS(=O)(=O)c1cc(C)sc1C 917219521 TXLSECVMKBXNDH-IBGZPJMESA-N 486.571 5.031 5 20 JKBD CN(CC(=O)OCc1nc2ccccc2c2ccccc12)C(=O)c1ccc(Br)s1 919534319 PRWYJWPAPPBQRW-UHFFFAOYSA-N 469.360 5.027 5 20 JKBD CC(=O)N(c1nc(COC(=O)c2ccc([N+](=O)[O-])cc2F)cs1)c1c(C)cc(C)cc1C 919569382 WPXSOBDRHKMZJD-UHFFFAOYSA-N 457.483 5.157 5 20 JKBD Cc1cccc(-c2nnc([C@@H](C)OC(=O)c3ccc(N[C@H](C)c4ccccn4)c([N+](=O)[O-])c3)o2)c1 920544903 NGTCWHKEJIQWOC-IAGOWNOFSA-N 473.489 5.439 5 20 JKBD C[C@H](Nc1ccc(C(=O)OCc2ncc(-c3cccc(Cl)c3)o2)cc1[N+](=O)[O-])c1ccccn1 920548139 QAAOYHQVJXPNDM-HNNXBMFYSA-N 478.892 5.828 5 20 JKBD CC(C)CC(=O)NC1(c2ccc(NC(=O)Cc3cc(Br)ccc3[N+](=O)[O-])cc2)CCC1 1786071457 KYGPLFQUHWQHJR-UHFFFAOYSA-N 488.382 5.080 5 20 JKBD O=C(CCc1cccc([N+](=O)[O-])c1)Nc1ccc(C2(NC(=O)c3onc4ccccc34)CCC2)cc1 1786602671 MJFZYHVJJKXCIY-UHFFFAOYSA-N 484.512 5.117 5 20 JKBD CN(C)c1ccc([N+](=O)[O-])c(C(=O)Nc2ccc(C3(NC(=O)C[C@H]4C[C@@H]5CC[C@H]4C5)CCC3)cc2)c1 1790056099 DSHIGWYFXUNECQ-HSALFYBXSA-N 490.604 5.235 5 20 JKBD COc1ccc(C(=O)Nc2ccc(C3(NC(=O)c4ccc(O)c([N+](=O)[O-])c4)CCC3)cc2)c(Cl)c1 1792141239 FTYJXRUEJQJZSJ-UHFFFAOYSA-N 495.919 5.024 5 20 JKBD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(Cl)s1)c1cc2cc([N+](=O)[O-])ccc2s1 1795042698 LVXZZZOOWMZRQB-BTTYYORXSA-N 475.979 5.090 5 20 JKBD CC[C@@H](C(=O)Nc1cc([C@@H]2CCCCN2C(=O)CCc2cccc([N+](=O)[O-])c2)[nH]n1)c1ccccc1 1816735897 GFFIRXPCKHOPMP-VWNXMTODSA-N 489.576 5.137 5 20 JKBD C[C@@H](CC(=O)Nc1cc([C@@H]2CCCCN2C(=O)/C=C/c2ccccc2[N+](=O)[O-])[nH]n1)c1ccccc1 1822045328 SZCUOLHPYATVFV-MTAXOXARSA-N 487.560 5.217 5 20 JKBD O=C(c1ccc(C2CC2)cc1)N1CCC([C@H]2CCCCN2C(=O)/C=C/c2ccc([N+](=O)[O-])o2)CC1 1824276316 QHHDIJMITYDHHA-IYNHSRRRSA-N 477.561 5.012 5 20 JKBD O=C(c1ccoc1Cl)N1CCC([C@@H]2CCCCN2C(=O)C2(c3cccc([N+](=O)[O-])c3)CCC2)CC1 1830292962 NRMQZAIRXYXDKQ-QFIPXVFZSA-N 499.995 5.196 5 20 JKBD O=C([C@@H]1CCC[C@@H]2CCCC[C@@H]21)N1CCC([C@@H]2CCCCN2C(=O)c2cc(O)cc([N+](=O)[O-])c2)CC1 1830705195 UVTZVJOEWYQEKW-XSGUUIGASA-N 497.636 5.140 5 20 JKBD CC/C=C(\C)C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)CC1 1831062779 ZROMCBQJMDOZQS-FRKKFGCYSA-N 469.607 5.399 5 20 JKBD CC[C@H]1CC[C@H](C(=O)N2CCC([C@@H]3CCCCN3C(=O)c3ccc([N+](=O)[O-])c(OC)c3)CC2)CC1 1832696582 CBESHTNUNHBGPU-RRPUWOKSSA-N 485.625 5.053 5 20 JKBD O=C([C@@H]1C[C@H]1c1ccccc1)N1CCC([C@@H]2CCCCN2C(=O)/C=C/c2ccccc2[N+](=O)[O-])CC1 1832904233 PUUVUANDPFPEBB-NQXHXMBISA-N 487.600 5.031 5 20 JKBD Cc1ccc(NC(=O)[C@H](OC(=O)Cn2c3ccccc3c(=O)c3ccccc32)c2ccccc2)cc1 11277024 PBODYQDXVIAFMG-GDLZYMKVSA-N 476.532 5.386 5 20 JKBD CCCCCCn1c(S[C@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)nc2ccccc2c1=O 17654312 FWJAHRURRVGRGI-MRXNPFEDSA-N 479.562 5.788 5 20 JKBD Cc1cccc(NC(=O)c2ccccc2NC(=O)c2ccc(Cn3nc(C)c([N+](=O)[O-])c3C)cc2)c1 20006646 IJDKVCFUZQPVBR-UHFFFAOYSA-N 483.528 5.269 5 20 JKBD C[C@H](Sc1nc2ccccc2c(=O)n1CCCc1ccccc1)C(=O)Nc1ccccc1[N+](=O)[O-] 25108712 VMEMWGVWTRGXAC-SFHVURJKSA-N 488.569 5.057 5 20 JKBD C[C@@H](Nc1ccc(C(=O)NCc2ccc(Oc3cccc(F)c3)nc2)cc1[N+](=O)[O-])c1ccccn1 68814939 TZUODFCVNDXHTF-QGZVFWFLSA-N 487.491 5.419 5 20 JKBD O=C(Nc1nc(Cc2ccccc2)c(-c2ccccc2)s1)c1ccc(-n2cncn2)c([N+](=O)[O-])c1 486866708 DKSMZCYEUMKGNV-UHFFFAOYSA-N 482.525 5.142 5 20 JKBD C[C@@H]1CCCN(c2ccc(C(=O)NCc3cn(-c4ccccc4)nc3-c3ccncc3)cc2[N+](=O)[O-])C1 489936189 QKOAOGIIYIXXHX-HXUWFJFHSA-N 496.571 5.009 5 20 JKBD O=C(NCc1ccccc1-c1ccc(Cn2ccnc2)cc1)c1ccc(NC2CC2)c([N+](=O)[O-])c1 504777383 WWUOMMKMJWBJSQ-UHFFFAOYSA-N 467.529 5.011 5 20 JKBD Cc1nnc(Sc2ccc(NC(=O)c3ccc(N4CCC[C@@H](C)C4)c([N+](=O)[O-])c3)c(C)c2)s1 505870751 BKBPBWAQEUZHNB-CQSZACIVSA-N 483.619 5.703 5 20 JKBD COc1cc(C(=O)Nc2ccc(-c3nccs3)cc2)c([N+](=O)[O-])cc1OCc1cscn1 509889286 YTXVNWREZPVFOP-UHFFFAOYSA-N 468.516 5.015 5 20 JKBD C[C@H](c1ccccc1)n1c(SCCC(=O)Nc2ccc([N+](=O)[O-])cc2)nnc1-c1ccccc1 515574410 RGKFAJAKBYXYBV-GOSISDBHSA-N 473.558 5.584 5 20 JKBD O=C(c1ccc(Sc2nc3ccccc3s2)c([N+](=O)[O-])c1)N1CCC[C@@H](OCC(F)(F)F)C1 518302009 YCKMNVPTQZDVQK-CQSZACIVSA-N 497.520 5.539 5 20 JKBD CCN(CC)CC1CCN(C(=O)c2ccc(NCc3ccccc3Cl)c([N+](=O)[O-])c2)CC1 520167564 BMLOVFKRXKDLFT-UHFFFAOYSA-N 458.990 5.054 5 20 JKBD C[C@H](NCc1ccc(-c2ccc([N+](=O)[O-])cc2)o1)c1ccc(NC(=O)c2ccc(F)cc2)cc1 549171907 TWXWMDLKZXOOPA-KRWDZBQOSA-N 459.477 6.097 5 20 JKBD CN(CCc1ccccn1)C(=O)C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1 594669226 IOUALZRWFBWBES-KNTRCKAVSA-N 458.543 5.231 5 20 JKBD CN(C)[C@H](CNC(=O)c1ccccc1Sc1ccc(C(F)(F)F)cc1[N+](=O)[O-])c1ccco1 599086102 YTUIPYUQPYCDIZ-QGZVFWFLSA-N 479.480 5.391 5 20 JKBD CCOc1cc(CNCc2cc3ccccc3o2)ccc1OCc1cc([N+](=O)[O-])cc2c1OCOC2 608782076 UBNQPHIDEUIAEF-UHFFFAOYSA-N 490.512 5.475 5 20 JKBD O=C(C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)Nc1ccc(Cl)nc1 729173383 JSZAYIVAGCFCAT-PTNGSMBKSA-N 450.907 5.822 5 20 JKBD O=C(Nc1ccc(Cl)c([N+](=O)[O-])c1)c1cnn(-c2ncc(C(F)(F)F)cc2Cl)c1C(F)F 730957832 GGTRESGCGIKERL-UHFFFAOYSA-N 496.179 5.691 5 20 JKBD COc1ccc(CNCc2c(C)nn(Cc3ccc(Cl)cc3Cl)c2Cl)cc1[N+](=O)[O-] 742717816 NNCNNFYHJZHVQI-UHFFFAOYSA-N 469.756 5.407 5 20 JKBD COc1ccc2cc(/C=C\C(=O)O[C@H](C)C(=O)Nc3ccc([N+](=O)[O-])cc3C(F)(F)F)ccc2c1 746258665 KKTUAVCNFGHQOQ-PXTDYPQFSA-N 488.418 5.359 5 20 JKBD O=C(Nc1ncc(Cc2cccc(Br)c2)s1)c1cc([N+](=O)[O-])ccc1Cl 751149929 RCSNQKINQMBWBQ-UHFFFAOYSA-N 452.717 5.310 5 20 JKBD C[C@H]1CCCN(c2ccc(C(=O)OCC(=O)Nc3ccc(Cl)cc3C(F)(F)F)cc2[N+](=O)[O-])C1 783513170 QAWIFQRLNMNZFG-ZDUSSCGKSA-N 499.873 5.299 5 20 JKBD CCC[C@H](C)NS(=O)(=O)c1cc(C(=O)Nc2cc([N+](=O)[O-])c(C)cc2C)c(Cl)cc1Cl 913416691 PDBNBSOQSQOTGV-ZDUSSCGKSA-N 488.393 5.238 5 20 JKBD CC(C)C(=O)Nc1ccc(C(=O)O[C@@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2ccccc2)cc1 914931625 MLOVSXUUQBUZCY-JOCHJYFZSA-N 495.919 5.380 5 20 JKBD Cc1ccc(C)c(NC(=O)[C@@H](OC(=O)CCOc2cc(C)ccc2[N+](=O)[O-])c2ccccc2)c1 915442279 HYBYFLMUFDJETQ-VWLOTQADSA-N 462.502 5.212 5 20 JKBD Cc1ccccc1CNc1ccc(C(=O)OCC(=O)Nc2ccc([N+](=O)[O-])cc2C(F)(F)F)cc1 915479059 ZXNSLFYWDFAZIG-UHFFFAOYSA-N 487.434 5.330 5 20 JKBD COc1c([N+](=O)[O-])cc(NCc2cccnc2Oc2cccc(F)c2)c([N+](=O)[O-])c1Br 917064317 OQPYSEIWXLCEDJ-UHFFFAOYSA-N 493.245 5.213 5 20 JKBD COCCOc1ccc(N[C@@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2ccccc2)cc1Cl 918748096 WGANFNWFTXMVSL-JOCHJYFZSA-N 490.343 5.719 5 20 JKBD Cc1cc(N2CCCC2)ccc1NC(=O)COC(=O)c1cc([N+](=O)[O-])ccc1Oc1ccccc1 919192660 MZRBGXCDIIVPPB-UHFFFAOYSA-N 475.501 5.091 5 20 JKBD Cc1ccc(NC(=O)[C@@H](OC(=O)c2cc3cc([N+](=O)[O-])ccc3o2)c2ccccc2)c([N+](=O)[O-])c1 919214417 RBQXDDGBJREFJU-QFIPXVFZSA-N 475.413 5.094 5 20 JKBD CS(=O)(=O)c1cc(C(=O)Oc2ccc(-c3nc4cc(Cl)ccc4s3)cc2)cc([N+](=O)[O-])c1 920322853 AIBUMBMAPDAAHT-UHFFFAOYSA-N 488.930 5.148 5 20 JKBD C[C@H](OC(=O)[C@H](C)Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)Nc1c(Cl)cc(Cl)cc1Cl 920778707 LRVATWLKJJIKKM-IUCAKERBSA-N 496.130 5.546 5 20 JKBD Cc1nc(C(=O)Nc2ccc(C3(NC(=O)C4(c5cccc([N+](=O)[O-])c5)CCC4)CCC3)cc2)cs1 1787528845 OYDLKLBOLYGQQF-UHFFFAOYSA-N 490.585 5.229 5 20 JKBD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2sc3ccccc3c2Cl)[nH]n1)c1ccc([N+](=O)[O-])o1 1814309116 GMQXJLKOKNOOSZ-AWEZNQCLSA-N 499.936 5.399 5 20 JKBD CC1(C)CCC(CC(=O)N2CCCC[C@@H]2c2cc(NC(=O)c3cccc(F)c3[N+](=O)[O-])n[nH]2)CC1 1821172042 HQWNZLLFDKDBEB-HXUWFJFHSA-N 485.560 5.369 5 20 JKBD C[C@H](C(=O)N1CCC([C@H]2CCCCN2C(=O)/C=C/c2ccc([N+](=O)[O-])o2)CC1)c1ccc(Cl)cc1 1824275529 CNKHYWGQYICINF-ZZHXAETESA-N 499.995 5.278 5 20 JKBD CCC(C)(C)C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cccc([N+](=O)[O-])c2Br)CC1 1830516476 DJVLNDFIDFSQKX-GOSISDBHSA-N 494.430 5.027 5 20 JKBD O=C(CCc1cccc([N+](=O)[O-])c1)N1CCC([C@H]2CCCCN2C(=O)c2ccc3ccoc3c2)CC1 1830906198 SVGAOPPQHHHXQK-RUZDIDTESA-N 489.572 5.207 5 20 JKBD CC[C@H]1CC[C@H](C(=O)N2CCC([C@@H]3CCCCN3C(=O)Cc3cc(F)ccc3[N+](=O)[O-])CC2)CC1 1832888095 DWSGGZUBJKKBQB-PTLVVNQVSA-N 487.616 5.113 5 20 JKBD CC(=O)N(c1nc(COC(=O)CSc2ccc([N+](=O)[O-])cc2)cs1)c1ccc(C)cc1C 9352156 SKTSCJVYJPDNLE-UHFFFAOYSA-N 471.560 5.188 5 20 JKBD O=C(O[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Br)c1ccccc1)C1CCCCC1 10626711 SNJYOCLGMDZLOI-IBGZPJMESA-N 461.312 5.161 5 20 JKBD CCCOc1ccc(C(F)(F)F)cc1NC(=O)c1cc(OC)c(OC(F)F)cc1[N+](=O)[O-] 10960422 IYZCPYDUALCLOS-UHFFFAOYSA-N 464.343 5.265 5 20 JKBD CC(C)c1ccccc1NC(=O)[C@H](C)Oc1ccc2c(-c3ccc([N+](=O)[O-])cc3)cc(=O)oc2c1 15370829 XSJTUNFQIQDUAH-KRWDZBQOSA-N 472.497 5.898 5 20 JKBD C[C@H](Sc1nnc(COc2ccc(Cl)cc2)o1)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 17654554 FAROPXGSCJUGLW-NSHDSACASA-N 459.871 5.114 5 20 JKBD COc1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2Sc2ccc(Cl)cc2)cc1NC(C)=O 26616153 NEMCHGRUQJSVSQ-UHFFFAOYSA-N 471.922 5.619 5 20 JKBD Cc1ccc(Sc2ccc(C(=O)Nc3cc(C(=O)N(C)C)ccc3Cl)cc2[N+](=O)[O-])cc1 33173610 WHOOZLOJPRIFEL-UHFFFAOYSA-N 469.950 5.662 5 20 JKBD O=C(Cn1c2ccccc2c(=O)c2ccccc21)Nc1ccccc1CN1CCc2ccccc21 59338188 TVGDGGTVUZZERF-UHFFFAOYSA-N 459.549 5.356 5 20 JKBD O=C(Nc1ccccc1Oc1ncc(Cl)cc1Cl)c1ccc(N2CCCC2)c([N+](=O)[O-])c1 195612728 RRXJWYYYJVIPMM-UHFFFAOYSA-N 473.316 5.941 5 20 JKBD O=C(NCc1ccccc1-c1ccc(Cn2ccnc2)cc1)c1ccc(N2CCCC2)c([N+](=O)[O-])c1 303148327 CFFSBKCITIPVHN-UHFFFAOYSA-N 481.556 5.037 5 20 JKBD CC[C@@H](C)c1ccc([C@@H](NC(=O)c2cc([N+](=O)[O-])cc(S(C)(=O)=O)c2)c2cccs2)cc1 410095402 QZNPOPGZYDJAIB-IVZQSRNASA-N 472.588 5.093 5 20 JKBD CCN(CC)S(=O)(=O)c1ccc(Oc2ccc(CNc3ccc(C)cc3)cc2OC)c([N+](=O)[O-])c1 477207420 QDQNLGJPJGRZHB-UHFFFAOYSA-N 499.589 5.347 5 20 JKBD COc1ccc([C@@H]2Nc3ccccc3C(=O)N2Cc2cccnc2)cc1OCc1ccc([N+](=O)[O-])cc1 489304399 HSNXMCROLVCAAG-HHHXNRCGSA-N 496.523 5.344 5 20 JKBD O=C(c1csc(-c2ccc([N+](=O)[O-])cc2)n1)N1CCC(c2nc3cc(Cl)ccc3s2)CC1 496376951 KFECVZMGAUNJIP-UHFFFAOYSA-N 484.990 6.001 5 20 JKBD C[C@@H](OC[C@@H](O)COc1ccc(NC(=O)c2cccc([N+](=O)[O-])c2)cc1)c1ccc(Cl)cc1 506337296 IXCQTWHDUJGKAO-OPAMFIHVSA-N 470.909 5.018 5 20 JKBD C[C@H](Nc1ccc(C(=O)NCCc2ccc(F)c(Br)c2)cc1[N+](=O)[O-])c1ccccn1 509148611 BMOUFOUGOJEWQW-AWEZNQCLSA-N 487.329 5.037 5 20 JKBD COc1ccccc1Oc1ccc(NC(=O)c2cc(OCC(F)(F)F)ccc2[N+](=O)[O-])cc1F 510246889 YKYGKZPJVVPBJR-UHFFFAOYSA-N 480.370 5.728 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Cl)[C@H](NCc1ccc(N2CCCCCC2)nc1)c1ccccc1 515761508 IIGCDFLGVNEVOU-RUZDIDTESA-N 493.995 5.493 5 20 JKBD Cc1ccc(CNC(=O)c2cccc(CNCc3ccc(-c4cccc([N+](=O)[O-])c4)o3)c2)cc1 520205333 LQGQTJCRVHXACR-UHFFFAOYSA-N 455.514 5.383 5 20 JKBD CCOc1ccc(N(C(=O)CCNC(=O)c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)cc1 602016903 JNYBXIXYWUIRKJ-UHFFFAOYSA-N 490.541 5.088 5 20 JKBD C[C@H]1C[C@@H](C)CN(c2ccc(C(=O)Nc3ccc(NC(=O)c4ccco4)c(Cl)c3)cc2[N+](=O)[O-])C1 604119252 HPVOTMDHHYHRQM-IYBDPMFKSA-N 496.951 5.828 5 20 JKBD O=C(C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)Nc1cccnc1N1CCCC1 604236594 ZJJOFNFPCJZZKB-KNTRCKAVSA-N 485.569 5.769 5 20 JKBD COc1ccc(CNC[C@@H]2CCN(c3ccc(F)c(F)c3)C2)cc1OCc1ccc([N+](=O)[O-])cc1 608782082 WFVBMGWDERPLPR-FQEVSTJZSA-N 483.515 5.077 5 20 JKBD CSc1nnc(CCCNc2ccc(C(=O)Nc3ccc(C)cc3)cc2[N+](=O)[O-])n1C1CCCC1 608972563 WAUUDZZOOYVJIW-UHFFFAOYSA-N 494.621 5.629 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)Nc2ccc(Oc3ccc(C(F)(F)F)cc3)nc2)cc1SC 609177822 QEWSLHCHUVQWPP-UHFFFAOYSA-N 479.436 5.784 5 20 JKBD C[C@H](CCC(=O)Nc1ccc([N+](=O)[O-])c(Cl)c1)CC(=O)Nc1ccc([N+](=O)[O-])c(Cl)c1 727710216 JKKLNBVIUZOHQL-LLVKDONJSA-N 469.281 5.193 5 20 JKBD Cc1cccc([N+](=O)[O-])c1NC(=O)COC(=O)c1cc2ccccc2cc1NC(=O)OC(C)(C)C 743246511 IREKFYWYRMGOHM-UHFFFAOYSA-N 479.489 5.199 5 20 JKBD Cc1onc(-c2ccccc2Cl)c1C(=O)O[C@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl 763030889 SJFSSUVDFKBLJR-LLVKDONJSA-N 464.261 5.049 5 20 JKBD O=C(Nc1cc([N+](=O)[O-])c(F)cc1F)c1cn(Cc2ccccc2)nc1-c1ccc(Cl)cc1 897521256 INFHOTGKHNYCNW-UHFFFAOYSA-N 468.847 5.691 5 20 JKBD O=C(Nc1ccccc1C(=O)Nc1cccc(OC[C@@H]2CCCO2)c1)c1ccc([N+](=O)[O-])cc1Cl 913153551 ZBDDKMRGWJCSTQ-IBGZPJMESA-N 495.919 5.311 5 20 JKBD O=C(OCC[C@H]1CCCCN1C(=O)c1ccc(C2SCCS2)cc1)c1cccc([N+](=O)[O-])c1 916690422 QDFZAAJXRWSDAR-HXUWFJFHSA-N 486.615 5.315 5 20 JKBD O=C(Nc1ccccc1SC[C@@H]1CC1(Cl)Cl)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-] 917750681 IHXUAYSCELSESD-NSHDSACASA-N 495.306 6.074 5 20 JKBD C[C@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)Nc1ccccc1C(=O)N(C)C1CCCCC1 920815104 QMZOCUSPLHJBGG-HNNXBMFYSA-N 459.930 5.059 5 20 JKBD O=C(/C=C/c1ccc([N+](=O)[O-])o1)Nc1ccc(C2(NC(=O)c3cc4cc(F)ccc4[nH]3)CCC2)cc1 1786207445 NMSCHUJYIVZBLH-JXMROGBWSA-N 488.475 5.269 5 20 JKBD Cc1ccc(S/C=C/C(=O)NC2(c3ccc(NC(=O)c4ccc([N+](=O)[O-])[nH]4)cc3)CCC2)cc1 1790186753 QYEYLIRGUCRHKT-DTQAZKPQSA-N 476.558 5.285 5 20 JKBD Cc1cc(O)c([N+](=O)[O-])cc1C(=O)Nc1ccc(C2(NC(=O)c3ccnc(C(F)F)c3)CCC2)cc1 1790806660 SQWOSJFJZYJWKS-UHFFFAOYSA-N 496.470 5.003 5 20 JKBD O=C(CCC(F)(F)F)N1CCC([C@H]2CCCCN2C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)CC1 1831061437 SPSNVXJENNNMEJ-GOSISDBHSA-N 497.539 5.385 5 20 JKBD O=C(CC1CCC1)N1CCC([C@H]2CCCCN2C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)CC1 1831061657 HUYOZVNVUAUYEZ-OAQYLSRUSA-N 469.607 5.233 5 20 JKBD C[C@H](Sc1nnc(-c2ccccc2Cl)n1C1CCCC1)C(=O)Nc1cccc([N+](=O)[O-])c1 8988480 DHGINEVYZMWQTL-AWEZNQCLSA-N 471.970 5.741 5 20 JKBD CC[C@@H](C)c1ccc([C@@H](NC(=O)c2ccc(S(C)(=O)=O)c([N+](=O)[O-])c2)c2cccs2)cc1 14316083 DYLABGJUFCWIRI-IVZQSRNASA-N 472.588 5.093 5 20 JKBD O=C(O[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1)c1csc(-c2ccccc2)n1 17984189 CVSWLJDEBGCFDC-OAQYLSRUSA-N 493.928 5.909 5 20 JKBD O=C(Cc1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1)OCc1coc(-c2cccs2)n1 18961764 IEHRKASZKFYOBQ-UHFFFAOYSA-N 486.509 5.450 5 20 JKBD Cc1nn(Cc2ccc(C(=O)Nc3ccc4c(c3)OC3(CCCCC3)O4)cc2)c(C)c1[N+](=O)[O-] 21047383 UBAALYNGJYCWSC-UHFFFAOYSA-N 462.506 5.140 5 20 JKBD Cc1c(NC(=O)[C@H](C)Sc2nnc(-c3cccs3)n2Cc2ccccc2)cccc1[N+](=O)[O-] 21642332 UAKODOARCGQDHB-INIZCTEOSA-N 479.587 5.391 5 20 JKBD CCN(CC)C(=O)c1cccc(NC(=O)c2ccc(Sc3nc(C)cs3)c([N+](=O)[O-])c2)c1 22471994 AOPDSSQKZMUMKF-UHFFFAOYSA-N 470.576 5.245 5 20 JKBD O=C(Nc1ccccc1-c1ccccc1)c1ccc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)cc1 26459254 HJXBNNWWPOCEKC-UHFFFAOYSA-N 473.510 5.315 5 20 JKBD Cc1ccc(CN[C@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Br)c2ccccc2)cc1F 28623238 HAQBNAOXSBWGMW-NRFANRHFSA-N 472.314 5.274 5 20 JKBD O=c1c2ccccc2nc(SCc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)n1C1CCCCC1 28626177 GDLBHIBLFWTXGZ-UHFFFAOYSA-N 463.519 5.152 5 20 JKBD Cc1cc(Br)ccc1NC(=O)c1ccc(N[C@H](C)c2ccccn2)c([N+](=O)[O-])c1 108756623 YQGULRXROXWZSY-CQSZACIVSA-N 455.312 5.486 5 20 JKBD O=C(Nc1ccc(C(=O)N2CCc3ccccc32)cc1)c1cc([N+](=O)[O-])ccc1N1CCCCC1 109653275 NGOVRNXPVFENCX-UHFFFAOYSA-N 470.529 5.040 5 20 JKBD O=C(Nc1ccccc1OCc1cscn1)c1ccc(NCc2ccccc2)c([N+](=O)[O-])c1 503913078 VCOHQXWCHPPHRM-UHFFFAOYSA-N 460.515 5.495 5 20 JKBD Cc1nc(-c2cccc(NC(=O)NCCNc3ccc(C(F)(F)F)cc3[N+](=O)[O-])c2)oc1C 510706317 YIALTFAPKGUPLX-UHFFFAOYSA-N 463.416 5.119 5 20 JKBD COCCOc1ccccc1NC(=O)c1ccc(NCc2ccccc2Cl)c([N+](=O)[O-])c1 512150873 WWMMTUZCDJPUIR-UHFFFAOYSA-N 455.898 5.138 5 20 JKBD Cc1csc(N(CC(F)(F)F)C(=O)c2ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])cc2)n1 512638098 DQXNUBBZRQNKTO-UHFFFAOYSA-N 471.844 6.015 5 20 JKBD Cc1nn(Cc2ccc(C(=O)N(Cc3cccnc3)c3ccc(Cl)cc3)cc2)c(C)c1[N+](=O)[O-] 515450178 ULZTXVNAMYRWLX-UHFFFAOYSA-N 475.936 5.352 5 20 JKBD C[C@H]1CCCN(c2ccc(C(=O)Nc3ccc(F)c(NC(=O)Cc4ccccc4)c3)cc2[N+](=O)[O-])C1 515813918 HCQTWCAULHXBBN-SFHVURJKSA-N 490.535 5.404 5 20 JKBD CN(C(=O)c1ccc(NS(=O)(=O)c2c(Cl)cccc2[N+](=O)[O-])cc1Cl)C1CCCCC1 518658868 YOPOPTVZNDZBKC-UHFFFAOYSA-N 486.377 5.107 5 20 JKBD CC(=O)Nc1cccc([C@@H](C)N(Cc2ccccc2)C(=O)[C@@H](C)Oc2ccc(Cl)cc2[N+](=O)[O-])c1 518878499 GXMGQTVAMUYTKD-QZTJIDSGSA-N 495.963 5.764 5 20 JKBD Cc1ccc(NC(=O)c2cccc(C(F)(F)F)c2)cc1NC(=O)c1ccc(Cl)cc1[N+](=O)[O-] 518889445 JZSHCCDEDNVHAB-UHFFFAOYSA-N 477.826 6.080 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Cl)[C@@H](NCc1cc(Cl)c2c(c1)OCCO2)c1ccccc1 520520190 SFEODDPOQOOOAL-NRFANRHFSA-N 488.327 5.142 5 20 JKBD Cc1ccc(NS(=O)(=O)c2ccc(NCc3cccc4cccnc34)c([N+](=O)[O-])c2)c(C)c1 521100545 DQWDTLPKRMJBGN-UHFFFAOYSA-N 462.531 5.173 5 20 JKBD CCOc1cccc([C@@H](C)N[C@@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Br)c2ccccc2)c1 521726207 LNVWLYPOKZDNDM-WAIKUNEKSA-N 498.377 5.787 5 20 JKBD Cn1ccnc1[C@@H](NCc1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1)c1cccc(F)c1 521821423 QXEWFJUPUDHVEQ-SANMLTNESA-N 482.519 5.199 5 20 JKBD CN(Cc1nccn1C)C(=O)c1c2c(nc3ccccc13)/C(=C\c1ccc([N+](=O)[O-])cc1)CCC2 600831567 IPZOBNZSBKTMNO-MNDPQUGUSA-N 467.529 5.026 5 20 JKBD CCCOc1cc(NC(=O)N2CCC[C@H](C(=O)Nc3ccccc3)C2)c([N+](=O)[O-])cc1OCCC 603652575 IDFKESWCKFHLFV-SFHVURJKSA-N 484.553 5.055 5 20 JKBD O=C(Nc1ccc(NC(=O)c2ccccc2F)cc1C(F)(F)F)c1cc2cc([N+](=O)[O-])ccc2o1 603744260 ZZSDYYJTCIHSKS-UHFFFAOYSA-N 487.365 6.004 5 20 JKBD COc1cc([C@H](C)Nc2ccc(C(=O)NC3CC3)cc2[N+](=O)[O-])ccc1OCc1ccccc1 603870674 VAFRMMJFYLSNMY-KRWDZBQOSA-N 461.518 5.248 5 20 JKBD CN(C(=O)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1)C1CCN(C(=O)c2ccccc2)CC1 608953135 VEUBEEYPVGSRLQ-UHFFFAOYSA-N 493.947 5.417 5 20 JKBD Cc1ccc(-n2ncc(C(=O)Nc3nc(-c4cccc([N+](=O)[O-])c4)cs3)c2C(F)(F)F)cc1 619672676 QPUGSRMJMANMLJ-UHFFFAOYSA-N 473.436 5.484 5 20 JKBD Cc1c(C(=O)Nc2ccc(Sc3nncs3)c(Cl)c2)cc([N+](=O)[O-])c(C)c1[N+](=O)[O-] 728186458 QWWAMELTVKFHHO-UHFFFAOYSA-N 465.900 5.028 5 20 JKBD C[C@H](OC(=O)C[C@@H](c1ccccc1)C(F)(F)F)C(=O)Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1 728655020 TXPVOLWFQJWZJN-GUYCJALGSA-N 493.463 5.325 5 20 JKBD O=C(COC(=O)[C@@H]1C[C@@H]1c1cccc2ccccc12)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 730876524 POOSKQQGMRSOTP-QZTJIDSGSA-N 458.392 5.052 5 20 JKBD CC(C)N(Cc1nnc(-c2cccc([N+](=O)[O-])c2)o1)C(=O)Cc1csc(-c2ccccc2Cl)n1 744001536 UZUOZDPGXJOIAU-UHFFFAOYSA-N 497.964 5.401 5 20 JKBD CCS(=O)(=O)c1ccc(N2CCC(Nc3cc(Cl)c(C(F)(F)F)cc3[N+](=O)[O-])CC2)cc1 746386946 DKQWGHFNQARJDN-UHFFFAOYSA-N 491.919 5.142 5 20 JKBD O=C(Nc1ccccc1Oc1ccccc1NC(=O)c1ccc([N+](=O)[O-])cc1)c1ccc([N+](=O)[O-])cc1 749554518 IPAUKJMYLGDPAR-UHFFFAOYSA-N 498.451 5.800 5 20 JKBD COc1cc(C2SCCS2)ccc1OC(=O)CCNc1ccc(C(F)(F)F)cc1[N+](=O)[O-] 750724155 DWWDVQKSYLLIGS-UHFFFAOYSA-N 488.509 5.508 5 20 JKBD COc1ccc(-c2n[nH]cc2C(=O)Oc2ccc(NC(=O)c3cc([N+](=O)[O-])ccc3Cl)cc2)cc1 838338501 GBDZFMXKZNSLIX-UHFFFAOYSA-N 492.875 5.118 5 20 JKBD CCNC(=O)N(C)c1cccc(NCc2ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])cc2)c1 864034812 APBATZFYFSXRDC-UHFFFAOYSA-N 454.914 5.818 5 20 JKBD Cc1csc(Sc2ccc(-c3nc(C4(NC(=O)OC(C)(C)C)CC4)no3)cc2[N+](=O)[O-])n1 904996710 KMAVUHVOZKDOGN-UHFFFAOYSA-N 475.552 5.075 5 20 JKBD O=C(Nc1ccc(OC[C@@H](O)CO[C@H]2CCCc3ccccc32)cc1)c1cc([N+](=O)[O-])ccc1Cl 914794874 CSBMNWOMRYCNQX-NLFFAJNJSA-N 496.947 5.334 5 20 JKBD CCc1ccc(N(C(C)=O)c2nc(COC(=O)c3cc4cccc([N+](=O)[O-])c4[nH]3)cs2)cc1 919522842 MJLQIWPRJWGXRX-UHFFFAOYSA-N 464.503 5.137 5 20 JKBD Cc1c(COC(=O)[C@@H]2CCC(=O)N(Cc3ccccc3)[C@@H]2c2ccccc2)cccc1[N+](=O)[O-] 919531772 DZDAPPJLTSCWMR-ZEQKJWHPSA-N 458.514 5.127 5 20 JKBD Cc1c(C(=O)O[C@@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2C(F)(F)F)sc2ccc(F)cc12 920552081 HJFGZZIFGJCTJC-JTQLQIEISA-N 470.400 5.460 5 20 JKBD CC(=O)N(c1ccc(F)cc1)c1nc(COC(=O)[C@@H](C)Oc2ccc(Cl)cc2[N+](=O)[O-])cs1 920777855 JWDCDWHBOYLYFQ-GFCCVEGCSA-N 493.900 5.039 5 20 JKBD Cc1cc(C(=O)NC2(c3ccc(NC(=O)C4(c5cccc([N+](=O)[O-])c5)CCC4)cc3)CCC2)c[nH]1 1790476109 ZEZZNPJMNGVAQC-UHFFFAOYSA-N 472.545 5.101 5 20 JKBD O=C(C[C@@H]1C[C@@H]2CC[C@H]1C2)NC1(c2ccc(NC(=O)c3ccc([N+](=O)[O-])cc3F)cc2)CCC1 1790626381 VWHKEURPGXBRSZ-SQNIBIBYSA-N 465.525 5.308 5 20 JKBD Cc1nscc1C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)CC1 1825661152 PWEKTJDOXIKCTO-FQEVSTJZSA-N 498.630 5.122 5 20 JKBD O=C(c1cc2cc([N+](=O)[O-])ccc2s1)N1CCC([C@H]2CCCCN2C(=O)C2=CCCC2)CC1 1826278832 OJQVGHFXVQPECT-OAQYLSRUSA-N 467.591 5.153 5 20 JKBD Cc1c(C(=O)N2CCC([C@@H]3CCCCN3C(=O)[C@H]3CCC[C@@H]3C)CC2)cc(Cl)cc1[N+](=O)[O-] 1828486402 OGPQRAMDSUKUSY-BUKVSMQUSA-N 476.017 5.226 5 20 JKBD O=C(c1ccc([N+](=O)[O-])o1)N1CCC([C@H]2CCCCN2C(=O)C2(c3ccc(Cl)cc3)CCC2)CC1 1831303527 WGMLHQMWURHQBD-OAQYLSRUSA-N 499.995 5.196 5 20 JKBD O=C(/C=C/c1ccsc1)N1CCC([C@H]2CCCCN2C(=O)CSc2ccccc2[N+](=O)[O-])CC1 1831775250 JFNNOJFPBLKANR-MHNQQFQPSA-N 499.658 5.082 5 20 JKBD O=C(Cc1cc([N+](=O)[O-])ccc1F)N1CCC([C@H]2CCCCN2C(=O)c2ccccc2C2CC2)CC1 1832554981 YLKITANVHHQNLD-AREMUKBSSA-N 493.579 5.087 5 20 JKBD O=C(CSc1ccc([N+](=O)[O-])cc1)OCc1csc(COc2ccc(Cl)cc2)n1 11460190 DVCBZZKNCOVACV-UHFFFAOYSA-N 450.925 5.119 5 20 JKBD C[C@H](Sc1nnc(N2CCCCC2)n1-c1ccccc1)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 17952604 JWRSVQAOXATUHS-INIZCTEOSA-N 477.550 5.069 5 20 JKBD Cc1ccc(-n2c(SCCC(=O)Nc3ccc([N+](=O)[O-])cc3C)nnc2-c2ccncc2)cc1C 26343494 IIHMQTRMENYSTP-UHFFFAOYSA-N 488.573 5.284 5 20 JKBD CCn1c(S[C@H](C(=O)Nc2ccc(C)cc2[N+](=O)[O-])c2ccccc2)nc2ccsc2c1=O 27819967 DWLHGOINPGDFHD-IBGZPJMESA-N 480.571 5.167 5 20 JKBD Cc1cc(C(=O)N2CCC[C@@H](C)C2)ccc1NC(=O)CSc1ccc(C(F)(F)F)cc1[N+](=O)[O-] 195704065 JPRYVBNEXWGDDL-CQSZACIVSA-N 495.523 5.525 5 20 JKBD CCN(CC(=O)Nc1ccccc1C(F)(F)F)C(=O)c1cc2ccccc2c2cccnc12 302924725 BXHPKSWNLLLBBC-UHFFFAOYSA-N 451.448 5.508 5 20 JKBD CSCC[C@@H](NC(=O)c1ccc([N+](=O)[O-])o1)C(=O)Nc1ccc(Oc2cccc(Cl)c2)cc1 489673916 DUWTYYQDRRLJQS-GOSISDBHSA-N 489.937 5.124 5 20 JKBD C[C@@H](SC(c1ccccc1)c1ccccc1)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 502548513 VPPAFOWDTITQAY-OAHLLOKOSA-N 460.477 6.463 5 20 JKBD Cc1ccc(C(C)C)c(Oc2ccc(CN[C@H](C)c3ccc4c(c3)NC(=O)CO4)cc2[N+](=O)[O-])c1 504130541 LGAVYUDJZRJJHH-GOSISDBHSA-N 475.545 6.001 5 20 JKBD Cc1ccc(-c2cc(C(=O)N3c4ccc([N+](=O)[O-])cc4C[C@H]3C)c3cnn(C(C)C)c3n2)s1 504326260 ZNXUZSBCPPCICL-CQSZACIVSA-N 461.547 5.549 5 20 JKBD C[C@H](Nc1ccc(C(=O)NC(C)(C)c2ccc(Br)cc2)cc1[N+](=O)[O-])c1ccccn1 507048188 OTMZAYWIFJNAOE-HNNXBMFYSA-N 483.366 5.591 5 20 JKBD O=[N+]([O-])c1cc(CNCc2nn(-c3ccccc3)c3c2CCC3)ccc1Oc1ccc(F)cc1 513636850 GIUGVCRKOWHZTO-UHFFFAOYSA-N 458.493 5.490 5 20 JKBD Cc1noc(C)c1CNC(=O)c1ccccc1Sc1ccc(C(F)(F)F)cc1[N+](=O)[O-] 517902123 QKUFKCBHCUZQIC-UHFFFAOYSA-N 451.426 5.300 5 20 JKBD O=C(C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)Nc1ccc2nccnc2c1 518283738 BUNPLMSEVHRROO-GHRIWEEISA-N 467.510 5.717 5 20 JKBD Cc1nc([N+](=O)[O-])cn1CC(=O)N(c1ccc(Cl)c(Cl)c1)c1nc2ccccc2s1 520101000 MZCBJUMSAALHQJ-UHFFFAOYSA-N 462.318 5.381 5 20 JKBD CC(=O)NC[C@@H]1CCCN(C(=O)c2c3c(nc4ccccc24)/C(=C\c2cccc([N+](=O)[O-])c2)CCC3)C1 521418284 KXRSOIFCWZSAJF-FLVGQNKLSA-N 498.583 5.008 5 20 JKBD O=C(Cn1c2ccccc2c(=O)c2ccccc21)NCc1cccc(NC(=O)Nc2ccccc2)c1 523243430 JWFBZFHFONCHDG-UHFFFAOYSA-N 476.536 5.115 5 20 JKBD COc1ccc(OC)c(-c2csc(NC(=O)c3ccc(N4CCC[C@H](C)C4)c([N+](=O)[O-])c3)n2)c1 603461170 BAVJSWKWJBIEBN-HNNXBMFYSA-N 482.562 5.224 5 20 JKBD CCCOc1cc(NC(=O)N2CCCCC[C@@H]2c2ccncc2)c([N+](=O)[O-])cc1OCCC 603660097 LKNQKDZWAMZWEK-HXUWFJFHSA-N 456.543 5.717 5 20 JKBD CCOc1cc(NC(=O)c2c(C)nc(-c3ccc(F)cc3)nc2SC)c([N+](=O)[O-])cc1OCC 603753719 SBSUUVFWASFICP-UHFFFAOYSA-N 486.525 5.271 5 20 JKBD Cc1ccc(NC(=O)C(C)C)cc1NC(=O)c1ccc(N2C[C@H](C)C[C@@H](C)C2)c([N+](=O)[O-])c1 603895815 ZFMKIISKTADPCT-IAGOWNOFSA-N 452.555 5.232 5 20 JKBD CCOc1ccc(C(=O)Nc2ccc(OC)c(NC(=O)c3ccc(Cl)cc3F)c2)cc1[N+](=O)[O-] 603997662 BMQKDQOBOUTPOB-UHFFFAOYSA-N 487.871 5.299 5 20 JKBD O=C(Nc1ccccc1OCc1ncc(-c2cccc(Cl)c2)o1)c1ccc(Cl)cc1[N+](=O)[O-] 608855457 LKSKMLRSFJWQMV-UHFFFAOYSA-N 484.295 6.388 5 20 JKBD O=C(c1ccccc1Sc1ccc(C(F)(F)F)cc1[N+](=O)[O-])N1CC[C@H](N2CCCC2)C1 608905604 GVVFDVTVXYFFLJ-INIZCTEOSA-N 465.497 5.075 5 20 JKBD CCC[C@H](NC(=O)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])c(OC)c1)c1ccccn1 609179371 LFDDEFLWNWDRHZ-SFHVURJKSA-N 455.898 5.715 5 20 JKBD COc1ccc(CSCC(=O)Nc2ccc(OC(C)C)cc2C(F)(F)F)cc1[N+](=O)[O-] 609189311 ZSJXDDQULRMVFP-UHFFFAOYSA-N 458.458 5.281 5 20 JKBD C[C@H](OC(=O)c1csc(-c2cccc(C(F)(F)F)c2)n1)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl 725995781 GBEGKMBWRGPGED-JTQLQIEISA-N 499.854 5.575 5 20 JKBD C[C@H](NC(=S)/C(=C(/O)c1ccc([N+](=O)[O-])cc1)[n+]1ccc2c(c1)CCCC2)c1cccs1 726581921 ZOLRTWGHSXJSCN-INIZCTEOSA-O 466.608 5.385 5 20 JKBD O=C(OCc1nnc(-c2c(Cl)cccc2Cl)o1)c1ccc(Br)c([N+](=O)[O-])c1 726631758 AYZSLMAMWHKIRY-UHFFFAOYSA-N 473.066 5.071 5 20 JKBD Cc1nc(CSc2ccc(C(=O)OC[C@H]3CCCN3C(=O)c3ccccc3[N+](=O)[O-])cc2)cs1 730708103 MVKPFIXFVYNFSO-LJQANCHMSA-N 497.598 5.114 5 20 JKBD COc1ccc(C(=O)c2ccccc2)c(OC(=O)c2csc(-c3ccc([N+](=O)[O-])cc3)n2)c1 748003546 BVKNLJUNLWKNQZ-UHFFFAOYSA-N 460.467 5.177 5 20 JKBD Cc1c(C(=O)O[C@@H](C)C(=O)Nc2c(Cl)cc(Cl)cc2Cl)cc([N+](=O)[O-])c(C)c1[N+](=O)[O-] 748949473 HKNOCWBWPAQTOX-VIFPVBQESA-N 490.683 5.264 5 20 JKBD CC(C)C[C@@H](C)N(C(=O)CCCn1c(=O)oc2cc([N+](=O)[O-])ccc21)c1ccc2[nH]ccc2c1 750825249 AXUIXULMQCIXCA-QGZVFWFLSA-N 464.522 5.232 5 20 JKBD C[C@H](SC1=N/C(=C\c2ccccc2)C(=O)N1c1ccc(F)cc1)C(=O)Nc1ccccc1[N+](=O)[O-] 849191742 RQQDVHCUBLCNMF-NOEYKIMYSA-N 490.516 5.238 5 20 JKBD O=[N+]([O-])c1cc(Br)cc(-c2nc(-c3ccc(OCc4cccnc4)cc3)no2)c1 904465814 IULNHMFUJYBKFR-UHFFFAOYSA-N 453.252 5.048 5 20 JKBD C[C@H](Nc1ccc(-c2nc(C[C@@H](C)N(C)C(=O)OC(C)(C)C)no2)cc1[N+](=O)[O-])c1ccccn1 904654833 IIETYGXVIDKVLU-CVEARBPZSA-N 482.541 5.011 5 20 JKBD O=C(CSc1nnc(-c2ccccc2F)n1Cc1ccco1)Nc1cc(Cl)ccc1[N+](=O)[O-] 916664019 RKQRDYCJVOWEMC-UHFFFAOYSA-N 487.900 5.018 5 20 JKBD Cc1ccc(/C(O)=C(/C(=S)Nc2cccc(C(C)C)c2)[n+]2ccc(C(C)(C)C)cc2)cc1[N+](=O)[O-] 917613870 STLORHDUZUVDEB-UHFFFAOYSA-O 490.649 6.935 5 20 JKBD O=C(Cn1ccc2ccc([N+](=O)[O-])cc21)Nc1ccc(C2(NC(=O)c3cccs3)CCC2)cc1 1786275452 IQKURFXTHUTHPP-UHFFFAOYSA-N 474.542 5.059 5 20 JKBD Cc1cc(C(=O)NC2(c3ccc(NC(=O)c4cc5cc([N+](=O)[O-])ccc5s4)cc3)CCC2)no1 1791009939 CNIJQAOUNCKJFM-UHFFFAOYSA-N 476.514 5.167 5 20 JKBD Cc1c(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)CCC3CCC3)n[nH]2)cc(Cl)cc1[N+](=O)[O-] 1815051237 BPLNOEVUYCJRBX-LJQANCHMSA-N 473.961 5.166 5 20 JKBD Cc1cccc2cc(C(=O)N3CCC([C@@H]4CCCCN4C(=O)c4cccc(F)c4[N+](=O)[O-])CC3)[nH]c12 1830620574 CUPKRAMYRFBJDT-QHCPKHFHSA-N 492.551 5.071 5 20 JKBD CC(C)(C)CC(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)CC1 1831061685 XJGSUBABCAIUON-FQEVSTJZSA-N 471.623 5.479 5 20 JKBD CCCCC[C@H](C)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2ccc([N+](=O)[O-])c(OC)c2)CC1 1831467790 AMRFMQHZEZFIJY-SIKLNZKXSA-N 473.614 5.053 5 20 JKBD C[C@H](OC(=O)c1cccc(Cl)c1Cl)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 11029728 QAMCWBOBLUNKSW-QMMMGPOBSA-N 451.184 5.104 5 20 JKBD COc1ccc(Br)cc1-c1nc(COC(=O)c2cccc([N+](=O)[O-])c2C)cs1 11398395 DPUXUGMPXWMOKF-UHFFFAOYSA-N 463.309 5.155 5 20 JKBD C[C@H](OC(=O)c1csc(-c2ccc(Cl)cc2)n1)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl 16457311 ULWARVFNWXYSEG-JTQLQIEISA-N 466.302 5.209 5 20 JKBD C[C@H](OC(=O)c1csc(-c2ccc(Cl)cc2)n1)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl 16457613 MKIUUBMMABANAL-JTQLQIEISA-N 466.302 5.209 5 20 JKBD COc1ccc(-c2nnc(S[C@H](C)C(=O)Nc3ccccc3[N+](=O)[O-])n2C2CCCCC2)cc1 21740451 CRUXBLJHVWMJKT-MRXNPFEDSA-N 481.578 5.486 5 20 JKBD C[C@H](Sc1nc2cc3ccccc3cc2c(=O)n1C)C(=O)N[C@@H](C)c1ccc(Cl)cc1 26580946 CHAVXYNLUVCFBA-GJZGRUSLSA-N 451.979 5.098 5 20 JKBD Cc1csc(Sc2ccc(C(=O)N[C@@H](c3ccccc3)c3ccccn3)cc2[N+](=O)[O-])n1 29711818 UVKQMHOOODCYBB-NRFANRHFSA-N 462.556 5.425 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Cl)[C@@H](NCC1(c2ccccc2)CCOCC1)c1ccccc1 30507547 JYYVEMVIXIRHPI-DEOSSOPVSA-N 479.964 5.266 5 20 JKBD Cc1cccc([N+](=O)[O-])c1NC(=O)CSc1nc(NC(=O)c2ccccc2)c2c(C)c(C)oc2n1 43751381 BBFLDLZMTWMVFI-UHFFFAOYSA-N 491.529 5.039 5 20 JKBD O=C(CCNc1ccc(C(F)(F)F)cc1[N+](=O)[O-])Nc1cccc(OCc2cccnc2)c1 107985141 JOXOQYSOAAOPTC-UHFFFAOYSA-N 460.412 5.028 5 20 JKBD Cc1ccc(N(C(=O)Cn2c(=O)oc3cc([N+](=O)[O-])ccc32)c2nc3ccccc3s2)c(C)c1 116546195 WURCADPUYWXGJE-UHFFFAOYSA-N 474.498 5.094 5 20 JKBD CC(C)N(C)C(=O)c1ccc(Cl)c(NC(=O)c2ccc(N3CCC[C@H](C)C3)c([N+](=O)[O-])c2)c1 116560749 PKKABLVPZMFONS-INIZCTEOSA-N 472.973 5.217 5 20 JKBD Cc1cc(Sc2ncccn2)ccc1NC(=O)c1ccc(N2CCC(C)CC2)c([N+](=O)[O-])c1 303181923 YLSPAWCXRDJPGO-UHFFFAOYSA-N 463.563 5.333 5 20 JKBD CCc1cccc2c(C3CCN(C(=O)c4ccc(N[C@@H](C)c5ccccn5)c([N+](=O)[O-])c4)CC3)c[nH]c12 410092308 YVSMPTKGPXDFJQ-IBGZPJMESA-N 497.599 6.226 5 20 JKBD O=C(Cc1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1)Nc1ccc2ncsc2c1 478806420 XLCDFUXRKXVVNH-UHFFFAOYSA-N 455.499 5.238 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)N2CCC[C@@H]2c2cc(Br)ccc2OC)cc1SC 483529621 OSVPXBHHTDRWQX-OAHLLOKOSA-N 481.368 5.074 5 20 JKBD O=C(C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)N[C@H]1CCCc2occc21 493325724 YZPZHUCPNSGKBJ-PZSQYBTKSA-N 459.527 5.922 5 20 JKBD CCC(=O)Nc1ccc(Cl)c(NC(=O)c2ccc(NCc3ccccc3Cl)c([N+](=O)[O-])c2)c1 500909644 YSJHBVABZABIQN-UHFFFAOYSA-N 487.343 6.115 5 20 JKBD COc1cc([C@H](C)NC(=O)c2cc3cc([N+](=O)[O-])ccc3s2)ccc1OCc1ccncc1 502681503 DSJQHTFSGLKMSP-HNNXBMFYSA-N 463.515 5.283 5 20 JKBD C[C@H](c1cccc(C(F)(F)F)c1)N(C(=O)c1ccc(Sc2nncn2C)c([N+](=O)[O-])c1)C1CC1 502887149 KWOJBVNPFXKWOS-CYBMUJFWSA-N 491.495 5.259 5 20 JKBD CC[C@H](C)n1ncc2c(C(=O)Nc3nc(-c4ccc(C)c([N+](=O)[O-])c4)cs3)cc(C)nc21 508792082 CMGCQGKSBXHYAL-AWEZNQCLSA-N 450.524 5.303 5 20 JKBD CC(C)OCc1ccc(N[C@@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Br)c2ccccc2)cc1 513210171 NRPYOHOGWMUAHR-HSZRJFAPSA-N 498.377 6.074 5 20 JKBD O=C(Nc1nc(-c2ccc(OC(F)F)cc2)cs1)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-] 514558852 JRJMPSFIMZWLAL-UHFFFAOYSA-N 489.378 5.513 5 20 JKBD Cc1ccc(NC(=O)[C@H](Sc2nnc(C[C@@H](C)c3ccccc3)o2)c2ccccc2)c([N+](=O)[O-])c1 515309928 ZPBMXKAMDFTTID-HOYKHHGWSA-N 488.569 6.105 5 20 JKBD COCCN(C(=O)CSc1cc(C)ccc1C)c1nc(-c2ccc([N+](=O)[O-])cc2)cs1 516069969 ATBRDWIKMGZFSN-UHFFFAOYSA-N 457.577 5.107 5 20 JKBD CCOc1cc(NC(=O)c2sc3cccc(Cl)c3c2Cl)c([N+](=O)[O-])cc1OCC 603484392 HUUMZMNINOAHHJ-UHFFFAOYSA-N 455.319 6.166 5 20 JKBD C[C@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccc(NC(=O)c2ccccc2)cc1C(F)(F)F 603742873 JAYKFRRQOVQCLW-AWEZNQCLSA-N 489.475 5.985 5 20 JKBD O=C(NCCc1cc(F)cc2c1OCOC2)c1cc([N+](=O)[O-])ccc1Sc1ccc(Cl)cc1 603881963 VMDOLACJWKALKV-UHFFFAOYSA-N 488.924 5.378 5 20 JKBD CC[C@H](C)c1ccc2nc(N(Cc3ccccc3)C(=O)Cn3cccc([N+](=O)[O-])c3=O)sc2c1 608801404 LJKHJVXGLPXYCB-KRWDZBQOSA-N 476.558 5.113 5 20 JKBD O=C(CSc1ccc(C(F)(F)F)cc1[N+](=O)[O-])Nc1ccc(-c2noc(C(F)(F)F)n2)cc1 608875012 JLKVDFBIKKFXTH-UHFFFAOYSA-N 492.357 5.413 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Cl)[C@@H](c1ccccc1)N1CCO[C@@H](c2ccc(F)c(F)c2)C1 608976186 UELWGGKBHHKBQO-DHIUTWEWSA-N 487.890 5.280 5 20 JKBD COc1ccc(CCNC(=O)c2ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])cc2)c(OC)c1OC 609022127 XIMPRQXGQHFTCS-UHFFFAOYSA-N 486.908 5.039 5 20 JKBD Cc1ccc(-c2csc(NC(=O)c3ccc(Cl)c(NC(=O)c4cccs4)c3)n2)cc1[N+](=O)[O-] 619729350 OOBUGOUMWJYVEL-UHFFFAOYSA-N 498.973 6.246 5 20 JKBD CC1=C(C(=O)Nc2ccc(C)cc2C)[C@@H](c2ccc([N+](=O)[O-])cc2)NC(=O)N1Cc1cccs1 732018262 KNJZGBXHBNHHKD-HSZRJFAPSA-N 476.558 5.452 5 20 JKBD O=C(OCc1cc(=O)c(O)co1)c1c2c(nc3ccccc13)/C(=C/c1ccc([N+](=O)[O-])cc1)CCC2 752151632 ZVVYKYYFBSCAST-SFQUDFHCSA-N 484.464 5.036 5 20 JKBD COc1ccc(-c2nnc(Sc3nc4ccccn4c3[N+](=O)[O-])n2C2CCCCC2)cc1OC 799718501 DBWLLZHJPFISFB-UHFFFAOYSA-N 480.550 5.175 5 20 JKBD COc1ccc(NCc2ccc(C(F)(F)F)cc2[N+](=O)[O-])cc1NC(=O)C1CCCCC1 864027777 FFIBQJNTHODLEX-UHFFFAOYSA-N 451.445 5.753 5 20 JKBD O=C(Nc1nc2ccc(SC(F)F)cc2s1)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-] 915804217 DDOGUYHBEMBYKE-UHFFFAOYSA-N 479.408 5.713 5 20 JKBD CN(C(=O)c1c2c(nc3ccccc13)/C(=C\c1ccc([N+](=O)[O-])cc1)CCC2)c1ccc(C(N)=O)cc1 917860250 FOTJQFCPVMBIFP-JZJYNLBNSA-N 492.535 5.395 5 20 JKBD CC(=O)N(c1ccc(Cl)cc1)c1nc(COC(=O)c2ccc(NC3CC3)c([N+](=O)[O-])c2)cs1 918824999 OKQFZHDGORXIEZ-UHFFFAOYSA-N 486.937 5.321 5 20 JKBD Cc1ccc(OCc2ccc(C(=O)OCC(=O)Nc3ccc([N+](=O)[O-])cc3C(F)(F)F)o2)c(C)c1 920586274 IRYLYEKZSWHBLF-UHFFFAOYSA-N 492.406 5.198 5 20 JKBD Cc1cc(CCCC(=O)NC2(c3ccc(NC(=O)c4cnoc4C)cc3)CCC2)c([N+](=O)[O-])cc1F 1787443657 UFYZKTCEBRUYGW-UHFFFAOYSA-N 494.523 5.109 5 20 JKBD Cc1cc(C(=O)NC2(c3ccc(NC(=O)c4cc5cccc(C)c5[nH]4)cc3)CCC2)ncc1[N+](=O)[O-] 1789253588 UDLCQVOENZHTJL-UHFFFAOYSA-N 483.528 5.149 5 20 JKBD O=C(Nc1cc([C@@H]2CCCCN2C(=O)Cc2cccc([N+](=O)[O-])c2)[nH]n1)[C@@H]1CCC[C@H]2CCCC[C@H]21 1818927383 UTSQDMYCKYTKDY-YJRNTSOCSA-N 493.608 5.159 5 20 JKBD CC/C=C(\C)C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)CC1 1831062781 ZROMCBQJMDOZQS-PKWFBFISSA-N 469.607 5.399 5 20 JKBD O=C([C@H](F)c1ccccc1)N1CCC([C@@H]2CCCCN2C(=O)CSc2ccccc2[N+](=O)[O-])CC1 1831774857 FAGWITZYOQAGQL-SQJMNOBHSA-N 499.608 5.017 5 20 JKBD Cc1cc(Cl)cc(C(=O)N2CCCC[C@H]2C2CCN(C(=O)Cc3cccc([N+](=O)[O-])c3)CC2)c1 1832608490 XACKQMFVVSJSBX-DEOSSOPVSA-N 483.996 5.033 5 20 JKBD CC(C)[C@H](C(=O)N1CC2(CCCN2C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)C1)c1ccc(F)cc1 1845739529 JLKAUDNJVPCBNP-QHCPKHFHSA-N 495.576 5.205 5 20 JKBD O=C(Cn1c2ccccc2c(=O)c2ccccc21)Nc1nnc(SCc2ccc(F)cc2)s1 11249011 HGLATCIXLZIXBJ-UHFFFAOYSA-N 476.558 5.076 5 20 JKBD COc1ccc(-c2nc(C)c(C(=O)O[C@@H](C)c3nnc(-c4ccc([N+](=O)[O-])cc4)o3)s2)cc1 19619725 QYGBCBWGWLXHEB-ZDUSSCGKSA-N 466.475 5.003 5 20 JKBD COc1ccccc1Nc1nnc(S[C@@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)s1 24107430 NZUQKQZLQWUNBB-NSHDSACASA-N 456.509 5.102 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Cl)[C@@H](Nc1ccc(N2CCCC2=O)c(Cl)c1)c1ccccc1 25211134 CMPPVVHNNGISDG-QHCPKHFHSA-N 499.354 5.820 5 20 JKBD CSc1ccc(C(=O)c2ccccc2C(=O)OCc2nc3ccccc3n2C(F)F)cc1[N+](=O)[O-] 39548971 LLESBTKUFIRNSL-UHFFFAOYSA-N 497.479 5.650 5 20 JKBD C[C@@H](Nc1ccc(C(=O)N(C)CCCc2cc(-c3ccccc3)n[nH]2)cc1[N+](=O)[O-])c1ccccn1 108830510 ZXYXLIHFRMKDIS-LJQANCHMSA-N 484.560 5.258 5 20 JKBD C[C@@H](Nc1ccc(C(=O)N(C2CC2)[C@H]2CCCc3ccccc32)cc1[N+](=O)[O-])c1ccccn1 110573779 ZTHLMJJKJGDXDF-CJAUYULYSA-N 456.546 5.845 5 20 JKBD COc1ccc(-c2nn(-c3ccccc3)cc2C(=O)Nc2cc([N+](=O)[O-])ccc2OC(F)F)cc1 302974173 SVWWAGADFIJRLR-UHFFFAOYSA-N 480.427 5.310 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)N[C@H](C)c2cccc(NC(=O)Cc3ccccc3F)c2)cc1SC 482868991 NPOBYVGIDNKJEX-OAHLLOKOSA-N 497.548 5.137 5 20 JKBD C[C@H](Nc1ccc(C(=O)N[C@H](c2ccc(Cl)cc2)C2CC2)cc1[N+](=O)[O-])c1ccccn1 505996342 NRHBSQBAUBOVCR-WNSKOXEYSA-N 450.926 5.697 5 20 JKBD COc1cc(C(=O)Nc2ccccc2-c2ccccc2)c([N+](=O)[O-])cc1OCc1cscn1 512395389 ULEQPVWZNAQYJH-UHFFFAOYSA-N 461.499 5.558 5 20 JKBD O=C(C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1)N1CCC(Cc2ccccc2)CC1 514854871 KAZJEIDUJXWWIW-UHFFFAOYSA-N 475.511 5.311 5 20 JKBD Cc1noc(CSc2ccc(C(=O)Nc3nc(-c4cccc([N+](=O)[O-])c4)c(C)s3)cc2)n1 515626471 IOXFEJAFMLVIEZ-UHFFFAOYSA-N 467.532 5.263 5 20 JKBD Cc1ccc(Sc2ccc(CNCc3ccc(CN4CCCC4=O)cc3)cc2[N+](=O)[O-])cc1 521817910 YGTZCVGLSWGJGZ-UHFFFAOYSA-N 461.587 5.467 5 20 JKBD NC(=O)CC[C@@H]1CCCN(C(=O)c2c3c(nc4ccccc24)/C(=C\c2cccc([N+](=O)[O-])c2)CCC3)C1 524039818 UNRCSJSNPKIGJW-JIVYGXRASA-N 498.583 5.138 5 20 JKBD O=C(Nc1ccc(NC(=O)c2ccc(NCc3ccccc3Cl)c([N+](=O)[O-])c2)cc1)NC1CC1 601969711 DWUCQELAFQWNPK-UHFFFAOYSA-N 479.924 5.397 5 20 JKBD COc1ccc(CSCC(=O)N(Cc2ccc(C(F)(F)F)cc2)C2CC2)cc1[N+](=O)[O-] 603567626 JFWMZWGOFNMBGZ-UHFFFAOYSA-N 454.470 5.047 5 20 JKBD COc1cc(C(=O)Nc2n[nH]c(-c3ccccc3OC)n2)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 603879247 JSJDCJSFLRLDMU-UHFFFAOYSA-N 495.879 5.095 5 20 JKBD Cc1ccc(Sc2ccc(C(=O)N3CCC(C(=O)c4cc(F)ccc4F)CC3)cc2[N+](=O)[O-])cc1 603905145 DKQGABXJNNBREJ-UHFFFAOYSA-N 496.535 6.068 5 20 JKBD O=C(Nc1ccccc1NC(=O)c1cccs1)c1csc(-c2cccc([N+](=O)[O-])c2)n1 608809174 WTHPDKQTZJNSMD-UHFFFAOYSA-N 450.501 5.284 5 20 JKBD O=[N+]([O-])c1ccc(-c2ccc(CNCc3ccc(Cn4cccn4)cc3)o2)c(Br)c1 608835879 UDUPJNWYYJYWMF-UHFFFAOYSA-N 467.323 5.152 5 20 JKBD CC(C)C[C@H](NC(=O)CCCn1c(=O)oc2cc([N+](=O)[O-])ccc21)c1cccc(C(F)(F)F)c1 608851485 WQUIYGGLCWNKAP-SFHVURJKSA-N 479.455 5.205 5 20 JKBD CSc1ccc(C(=O)c2ccccc2C(=O)N2CCCc3sccc3C2)cc1[N+](=O)[O-] 609332505 UECFRJOIHXHPJV-UHFFFAOYSA-N 452.557 5.198 5 20 JKBD CC(C)(C)c1ccc(Oc2ccc(CNCc3ccnc(-n4ccnc4)c3)cc2[N+](=O)[O-])cc1 725849350 ZSUUNAGTFLHTNJ-UHFFFAOYSA-N 457.534 5.555 5 20 JKBD Cc1ccc([C@H](C)NC(=O)c2ccc(C(=O)N[C@H](C)c3ccc(C)s3)c([N+](=O)[O-])c2)s1 727851837 OGENIDXTELEXSJ-LSDHHAIUSA-N 457.577 5.317 5 20 JKBD Cc1ccc(S(=O)(=O)Cc2ccc(C(=O)N(CC3CC3)c3ccc(Cl)c([N+](=O)[O-])c3)cc2)cc1 728165638 NBLBKZJTANOLPN-UHFFFAOYSA-N 498.988 5.587 5 20 JKBD CN(C(=O)c1ccc(Br)c([N+](=O)[O-])c1)[C@@H]1CCSc2ccc(Br)cc21 728844794 BUEJPHADABVAEI-CQSZACIVSA-N 486.185 5.429 5 20 JKBD O=C(O[C@H](C(=O)Nc1ccccc1)c1ccccc1)c1csc(-c2ccc([N+](=O)[O-])cc2)n1 747957834 CRVXWMTTZQBINL-NRFANRHFSA-N 459.483 5.255 5 20 JKBD O=C(OCC1CCN(c2ccc([N+](=O)[O-])cn2)CC1)c1csc(-c2ccc(Cl)cc2Cl)n1 750434271 JMMXDEOKVQVBOM-UHFFFAOYSA-N 493.372 5.494 5 20 JKBD C[C@@H](OC(=O)c1ccc2c(c1)Cc1ccccc1-2)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 915401599 YQKLMULAZRNXSP-CYBMUJFWSA-N 470.403 5.369 5 20 JKBD COc1ccccc1-c1cc(NC(=O)c2cc(Cl)ccc2[N+](=O)[O-])n(-c2ccc(C)cc2)n1 916065650 SFAZZVLBKSFTPE-UHFFFAOYSA-N 462.893 5.670 5 20 JKBD COc1ccc(F)cc1-c1csc(NC(=O)c2cc([N+](=O)[O-])ccc2N2CCCCC2)n1 917164575 MUBUBUYKHJSEAJ-UHFFFAOYSA-N 456.499 5.109 5 20 JKBD CC1=C(C(=O)Nc2ccccc2C(F)(F)F)[C@@H](c2csc([N+](=O)[O-])c2)NC(=O)N1CC1CC1 918076894 USOBPPRKVGGSAG-GOSISDBHSA-N 480.468 5.064 5 20 JKBD COc1ccc(COC(=O)CSc2ncnc3scc(-c4ccccc4)c23)cc1[N+](=O)[O-] 918797145 KJUUGLMKBBJPQL-UHFFFAOYSA-N 467.528 5.111 5 20 JKBD Cc1c(C(=O)O[C@H](C(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)c2ccccc2)cnn1C(C)(C)C 919189683 IOZZHEXKDFAQOY-FQEVSTJZSA-N 470.913 5.045 5 20 JKBD C[C@@H](OC(=O)c1cc2cc([N+](=O)[O-])ccc2[nH]1)C(=O)Nc1c(Cl)cc(Cl)cc1Cl 919514661 UCPCWMUWYVWEQJ-MRVPVSSYSA-N 456.669 5.220 5 20 JKBD CC(=O)N(c1nc(COC(=O)c2cc3cc([N+](=O)[O-])ccc3[nH]2)cs1)c1ccc(C)cc1C 919514777 RDAOOKKKRFUGNE-UHFFFAOYSA-N 464.503 5.191 5 20 JKBD C[C@H](SCc1ncc(-c2ccc(Cl)cc2)o1)C(=O)Nc1cc([N+](=O)[O-])c(F)cc1F 920026160 RXGQBYFNKRCFIR-JTQLQIEISA-N 453.854 5.442 5 20 JKBD C[C@@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)Nc1cccc(CN(C)C(=O)OC(C)(C)C)c1 920806696 ZUQDWRLSLZULKQ-CQSZACIVSA-N 463.918 5.021 5 20 JKBD Cc1c(NC(=O)[C@H](C)OC(=O)c2cccnc2Oc2ccc(Cl)cc2Cl)cccc1[N+](=O)[O-] 920912501 LVOHDFSOGKRKPF-ZDUSSCGKSA-N 490.299 5.581 5 20 JKBD Cc1ccc(O)c(C(=O)Nc2ccc(C3(NC(=O)Cn4ccc5ccc([N+](=O)[O-])cc54)CCC3)cc2)c1 1790246968 NQXFQCMWSGNGSL-UHFFFAOYSA-N 498.539 5.011 5 20 JKBD Cc1ncccc1C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)CC1 1825845465 XJCGYSQDEQNODH-QFIPXVFZSA-N 492.601 5.060 5 20 JKBD CC(C)CCC(=O)N1CCC([C@H]2CCCCN2C(=O)c2ccc(Br)c([N+](=O)[O-])c2)CC1 1830522514 LACRBQUAZUDMQG-HXUWFJFHSA-N 494.430 5.027 5 20 JKBD Cc1occc1C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cc(Cl)cc([N+](=O)[O-])c2C)CC1 1830734429 KCLWFGVNAJETCU-NRFANRHFSA-N 473.957 5.005 5 20 JKBD CC[C@H]1CC[C@H](C(=O)N2CCCC[C@@H]2C2CCN(C(=O)Cc3cc(F)ccc3[N+](=O)[O-])CC2)CC1 1831695769 QYTFVIINDWWQSZ-ZILOHOTNSA-N 487.616 5.113 5 20 JKBD CSc1ccc(C(=O)OCC(=O)Nc2c(Cl)c(Cl)cc(Cl)c2Cl)cc1[N+](=O)[O-] 9620601 PDQKYRPUQWUUSY-UHFFFAOYSA-N 484.144 5.726 5 20 JKBD Cc1oc(-c2ccccc2)nc1C(=O)O[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1 9717708 QKFFGZLCYQVPOA-QFIPXVFZSA-N 491.887 5.748 5 20 JKBD COc1ccccc1NC(=O)c1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2N2CCCCC2)cc1 15313317 GOVCCXRQTTWNCT-UHFFFAOYSA-N 474.517 5.098 5 20 JKBD COc1ccc(C)cc1NC(=O)[C@H](C)Oc1ccc2c(-c3ccc([N+](=O)[O-])cc3)cc(=O)oc2c1 15370845 DIOZNCBVILVWAU-INIZCTEOSA-N 474.469 5.091 5 20 JKBD O=C(C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)NCc1ccc2c(c1)OCO2 16023243 AZBRKTJOTIYHMQ-WQRHYEAKSA-N 473.510 5.180 5 20 JKBD Cc1ccccc1-n1c(S[C@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)nc2ccccc2c1=O 17532578 ZBWVIJKZGCCEJI-MRXNPFEDSA-N 485.525 5.506 5 20 JKBD Cc1cccc2c(O)nc(/C(Cl)=C/c3ccc(-c4ccc([N+](=O)[O-])cc4Br)o3)nc12 18076424 NSSSGHNJBKNZMX-YVLHZVERSA-N 486.709 6.311 5 20 JKBD C[C@H](Sc1nnc(-c2ccc(F)cc2)c2ccccc12)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl 20883464 TYYPAWGYDAYRAJ-ZDUSSCGKSA-N 482.924 6.117 5 20 JKBD C[C@H](Sc1nnc(NC2CCCCC2)s1)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 21357814 XTNFXOHIFIUTNM-JTQLQIEISA-N 475.518 5.329 5 20 JKBD COc1ccc(NC(=O)CSc2ncnc3scc(-c4ccc(F)cc4)c23)c([N+](=O)[O-])c1 21672019 LFNHFMHEKQCJEJ-UHFFFAOYSA-N 470.507 5.145 5 20 JKBD CC(=O)N1CCc2cc(NC(=O)c3ccc(Sc4nc5ccccc5s4)c([N+](=O)[O-])c3)ccc21 22642641 PFCIKBIUFBYWQY-UHFFFAOYSA-N 490.566 5.517 5 20 JKBD COc1ccc(C(=O)C2CCN(C(=O)c3cc([N+](=O)[O-])ccc3Sc3ccccc3)CC2)cc1 26132082 BMJVGAAYCQBDPW-UHFFFAOYSA-N 476.554 5.490 5 20 JKBD CCN(CC)C(=O)c1ccc(CNC(=O)c2ccc(NCc3ccccc3Cl)c([N+](=O)[O-])c2)cc1 27468228 MYQIFLISWYWNDX-UHFFFAOYSA-N 494.979 5.272 5 20 JKBD C[C@@H](Oc1ccccc1)C(=O)O[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Br)c1ccccc1 28302495 FTMVMMUGZPPFBO-QVKFZJNVSA-N 499.317 5.048 5 20 JKBD C[C@@H](Nc1ccc(C(=O)Nc2ccccc2I)cc1[N+](=O)[O-])c1ccccn1 409654833 WZQBIKKJWWRMBY-CYBMUJFWSA-N 488.285 5.020 5 20 JKBD O=C(CCc1nc2cc(C(F)(F)F)ccc2s1)N(Cc1ccccc1[N+](=O)[O-])CC(F)(F)F 409792365 QZSBRTIOAAYMBX-UHFFFAOYSA-N 491.413 5.747 5 20 JKBD C[C@H](Nc1ccc(C(=O)Nc2ccccc2NC(=O)C[C@@H]2C=CCC2)cc1[N+](=O)[O-])c1ccccn1 409988499 WHUKTGWJSPWSQT-RBUKOAKNSA-N 485.544 5.710 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)N[C@H](C)c2cccc(NC(=O)c3ccccc3)c2)cc1SC 482879393 QDWWQWLLVBZSON-OAHLLOKOSA-N 465.531 5.069 5 20 JKBD C[C@H](NC(=O)Cn1c2ccccc2c(=O)c2ccccc21)c1ccc(OCc2ccc(F)cc2)cc1 485625218 XRDLZLBBECIRMS-FQEVSTJZSA-N 480.539 5.750 5 20 JKBD COc1ccc(-c2ccc([C@@H]3Nc4ccccc4C(=O)N3Cc3cccnc3)o2)c([N+](=O)[O-])c1 489286779 KUGIAVXNNZXJQR-XMMPIXPASA-N 456.458 5.025 5 20 JKBD O=C(Nc1nc(-c2cccc(C(F)(F)F)c2)cs1)c1ccc(-n2ccnc2)c([N+](=O)[O-])c1 491443559 JMACBOYFHZHTMQ-UHFFFAOYSA-N 459.409 5.175 5 20 JKBD CC(C)c1cccc(C(C)C)c1NC(=O)c1ccc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)cc1 497489076 MINAXYAWGKHIJT-UHFFFAOYSA-N 481.574 5.895 5 20 JKBD CSc1ccc([N+](=O)[O-])c(C(=O)N(Cc2ccc(Cl)c(Cl)c2)Cc2ccccn2)c1 499606514 VYJKPAFLLDKAEH-UHFFFAOYSA-N 462.358 5.861 5 20 JKBD Cc1ncc([N+](=O)[O-])cc1C(=O)N(C[C@@H]1CCCO1)c1nc(-c2ccc(Cl)cc2Cl)cs1 506848077 VBMHPYNTMQDSKX-HNNXBMFYSA-N 493.372 5.554 5 20 JKBD COc1cc(C(=O)N[C@@H](c2ccccc2)c2ccc3nc(C(F)(F)F)[nH]c3c2)ccc1[N+](=O)[O-] 508801123 HDQBRKOHHAWIGQ-FQEVSTJZSA-N 470.407 5.018 5 20 JKBD CCN(Cc1ccccc1)C(=O)c1cc(NC(=O)c2cccc(C)c2[N+](=O)[O-])ccc1Cl 515687195 IZHAYBIFAXQRID-UHFFFAOYSA-N 451.910 5.471 5 20 JKBD C[C@H]1CCCN(c2ccc(C(=O)Nc3ccc(NC(=O)c4ccco4)c(Cl)c3)cc2[N+](=O)[O-])C1 515871838 UEDSFSAIBUKZDT-HNNXBMFYSA-N 482.924 5.582 5 20 JKBD Cc1cccc(Oc2ccc(Cl)cc2NC(=O)C(=O)N[C@H](C)c2cccc([N+](=O)[O-])c2)c1 518135786 NMOPOXFKASCCEC-OAHLLOKOSA-N 453.882 5.165 5 20 JKBD Cc1ccc(NS(=O)(=O)c2ccc(NCc3ncc(-c4ccccc4)[nH]3)c([N+](=O)[O-])c2)c(C)c1 519516862 RCWNTPYHAOWYJK-UHFFFAOYSA-N 477.546 5.015 5 20 JKBD C[C@@H](NC(=O)C(=O)Nc1ccc(Sc2ccccc2Cl)cc1)c1cccc([N+](=O)[O-])c1 519956615 QRFZYEQNYDIIPQ-CQSZACIVSA-N 455.923 5.215 5 20 JKBD O=C(Nc1ccn(CCc2ccncc2)n1)c1cc([N+](=O)[O-])ccc1Sc1ccc(Cl)cc1 522896803 SNNJLYIXSBGXMQ-UHFFFAOYSA-N 479.949 5.486 5 20 JKBD C[C@H](Nc1ccc(C(=O)N2CCc3c(Br)cccc3C2)cc1[N+](=O)[O-])c1ccccn1 523366459 BKBYACYHAPPCQS-HNNXBMFYSA-N 481.350 5.124 5 20 JKBD CCCOc1cc(NC(=O)C2CCN(c3nc4ccccc4s3)CC2)c([N+](=O)[O-])cc1OCCC 524167904 YMOLESXFVDAMKR-UHFFFAOYSA-N 498.605 5.637 5 20 JKBD COCCN(C(=O)[C@@H]1C[C@@H]1c1ccccc1C(F)(F)F)c1nc(-c2ccc([N+](=O)[O-])cc2)cs1 589197814 BOHWEWVPLQYZLK-QZTJIDSGSA-N 491.491 5.520 5 20 JKBD CC(=O)Nc1cccc([C@H](C)N(Cc2ccccc2)C(=O)c2ccn(-c3cccc([N+](=O)[O-])c3)n2)c1 603617178 SELNBQYBPMJFFW-IBGZPJMESA-N 483.528 5.143 5 20 JKBD Cc1ccc([N+](=O)[O-])cc1NC(=O)c1cccc(NC(=O)c2ccc(Br)cc2)c1 603780053 KCGVFTCMGFXFNE-UHFFFAOYSA-N 454.280 5.170 5 20 JKBD COc1cc(C(=O)Nc2nc(C)c(Cc3ccccc3Cl)s2)c([N+](=O)[O-])cc1OC(F)F 603974798 JWCXJBFNBIRXOB-UHFFFAOYSA-N 483.880 5.466 5 20 JKBD O=C(Nc1cccc(CN2CCOCC2)c1)c1cc([N+](=O)[O-])ccc1Sc1ccc(Cl)cc1 604480494 HESAPDLQDBZSAM-UHFFFAOYSA-N 483.977 5.484 5 20 JKBD C[C@@H](NCc1ccc(-c2ccc([N+](=O)[O-])cc2Br)o1)c1ccc(NC(=O)NC2CC2)cc1 608836025 HHKXQFOTJLJMMX-CQSZACIVSA-N 499.365 5.752 5 20 JKBD O=C(Nc1ccc(COc2ccc(Br)cc2)cc1)c1cc(F)c(F)cc1[N+](=O)[O-] 727707478 JDHOPSOCNAWKGI-UHFFFAOYSA-N 463.234 5.467 5 20 JKBD O=C(O[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1)c1cnn(-c2ccccc2F)c1 746901704 NASUTRQAOCTLJS-QFIPXVFZSA-N 494.866 5.110 5 20 JKBD C[C@@H](OC(=O)c1csc(-c2cccc([N+](=O)[O-])c2)n1)C(=O)N[C@H](C)c1cccc2ccccc12 747962828 UYPXMBJXCAFYHJ-HZPDHXFCSA-N 475.526 5.294 5 20 JKBD CCOc1cc([N+](=O)[O-])c(C(=O)O[C@H](C)c2ccccc2NC(=O)c2ccccc2)cc1OC 748016664 YERNPXSJKRLCFY-MRXNPFEDSA-N 464.474 5.172 5 20 JKBD COc1ccc(OC)c(-c2csc(NC(=O)CSc3nc4ccc([N+](=O)[O-])cc4s3)n2)c1 787994830 HELKCSGCWJMASG-UHFFFAOYSA-N 488.572 5.076 5 20 JKBD CC(C)(C)OC(=O)N1CCOC[C@H]1c1noc(-c2ccc(Sc3ccc([N+](=O)[O-])cc3)cc2)n1 904692348 NFCJYHQKTKRVQW-IBGZPJMESA-N 484.534 5.104 5 20 JKBD CN(C(=O)c1ccccc1NC(=O)c1ccc(Br)c([N+](=O)[O-])c1)C1CCCCC1 917803126 OYKVHZCFNNLCNG-UHFFFAOYSA-N 460.328 5.014 5 20 JKBD O=C(OCc1nc2ccccc2c2ccccc12)c1cnn(-c2ccc(Cl)nn2)c1C(F)(F)F 919452712 ZHBQWTFNDCTRAS-UHFFFAOYSA-N 483.837 5.393 5 20 JKBD C[C@@H](Nc1ccc(C(=O)O[C@H](C(=O)N2CCCCC2)c2ccccc2)cc1[N+](=O)[O-])c1ccccn1 920545425 RDNDZQPYXCKNGO-CLOONOSVSA-N 488.544 5.074 5 20 JKBD O=C(CSc1ccccc1[N+](=O)[O-])NC1(c2ccc(NC(=O)c3cccnc3Cl)cc2)CCC1 1785756081 AKNUAVIQNWDMJF-UHFFFAOYSA-N 496.976 5.183 5 20 JKBD O=C(NC1(c2ccc(NC(=O)C3CCC(C(F)(F)F)CC3)cc2)CCC1)c1ccc([N+](=O)[O-])[nH]1 1786591213 FIKNHSZYOKTEHV-UHFFFAOYSA-N 478.471 5.039 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)[C@H]3C[C@H]3c3ccccc3)CCC2)cc1)c1cc([N+](=O)[O-])cc2c1OCC2 1790045596 YCYNGHQUQWTDOF-ZEQRLZLVSA-N 497.551 5.081 5 20 JKBD C[C@H](C(=O)N1CCCC2(CCN(C(=O)c3cc(F)cc([N+](=O)[O-])c3)CC2)C1)c1ccc(Cl)cc1 1805198649 QRTNUTIXQRQAOW-KRWDZBQOSA-N 487.959 5.036 5 20 JKBD Cc1c(C(=O)N2CC[C@H](CNC(=O)[C@]3(C)CC=CCC3)[C@H]2c2cccnc2)cc(Cl)cc1[N+](=O)[O-] 1813585359 HOWFZNVZQUBFGJ-GVCORALISA-N 496.995 5.018 5 20 JKBD O=C(Nc1cc([C@@H]2CCCCN2C(=O)C2(c3cccc([N+](=O)[O-])c3)CCC2)[nH]n1)C1CCCCC1 1816710819 UZAZKEPBTJMPEH-QFIPXVFZSA-N 479.581 5.012 5 20 JKBD Cc1occc1C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cc(Cl)cc([N+](=O)[O-])c2C)CC1 1825909419 IINKESOLMCPQPI-NRFANRHFSA-N 473.957 5.005 5 20 JKBD CCC[C@H]1CC[C@H](C(=O)N2CCCC[C@H]2C2CCN(C(=O)c3cc(O)cc([N+](=O)[O-])c3)CC2)CC1 1831561117 BBOAWYCXYBUCGK-OWHZGTRUSA-N 485.625 5.140 5 20 JKBD Cc1c(C(=O)O[C@@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2C(F)(F)F)sc2cccc(F)c12 17150539 ZXNUAODSZHMEPY-JTQLQIEISA-N 470.400 5.460 5 20 JKBD COc1ccc(C(=O)Nc2sc(-c3ccccc3)c(C)c2C(=O)N2CCCCC2)cc1[N+](=O)[O-] 21900948 BFDFMHMVWWTXAX-UHFFFAOYSA-N 479.558 5.519 5 20 JKBD C[C@@H](Sc1nnc(-c2ccc(C(C)(C)C)cc2)o1)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 22250321 RWKNPNGCGYSUDY-GFCCVEGCSA-N 494.495 6.080 5 20 JKBD COc1cc(C(=O)N[C@@H](C)c2ccc(-c3csc(C)n3)cc2)c([N+](=O)[O-])cc1OC(F)F 30892660 SANLRDJDPBMZFJ-NSHDSACASA-N 463.462 5.128 5 20 JKBD CCn1c(S[C@H](C)C(=O)Nc2cccc3ncccc23)nc2cc3ccccc3cc2c1=O 31747413 XNSSVPQFOACLGV-MRXNPFEDSA-N 454.555 5.237 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)Nc2ccc(N3CCc4sccc4C3)cc2)cc1SC 97547962 XSQQLWDLYJUBCF-UHFFFAOYSA-N 455.561 5.202 5 20 JKBD O=C(Nc1ccccc1-c1nc2ccccc2s1)[C@H]1CC(=O)N(c2ccc(F)c([N+](=O)[O-])c2)C1 105660113 QDLTVOVOIJXWEU-AWEZNQCLSA-N 476.489 5.002 5 20 JKBD C[C@H](OC(=O)c1c2c(nc3ccccc13)/C(=C\c1ccco1)CC2)C(=O)Nc1ccccc1[N+](=O)[O-] 213749740 ZECQIWRZRAXOHQ-SCDSTIRESA-N 483.480 5.407 5 20 JKBD COc1cc(C(=O)Nc2ccccc2-c2ccc(-c3ccccc3)cc2)c([N+](=O)[O-])cc1OC 410045441 HECJJBKBXFJTBR-UHFFFAOYSA-N 454.482 6.198 5 20 JKBD O=C(NCc1ccnc(N2CCCC2)c1)c1cc([N+](=O)[O-])ccc1Sc1ccc(Cl)cc1 477236454 SBYDGZSJPIFGPS-UHFFFAOYSA-N 468.966 5.325 5 20 JKBD O=C(C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)N1CCCCC[C@@H]1c1ccncc1 479304851 SUNFQZJUXXJXMK-UIXYPFHGSA-N 498.608 6.674 5 20 JKBD Cc1c(NC(=O)c2ccccc2OCC(=O)Nc2cccc(C(F)(F)F)c2)cccc1[N+](=O)[O-] 481325777 SUONNYOUUNBFFP-UHFFFAOYSA-N 473.407 5.192 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)Nc2nc(-c3ccc(F)c(Cl)c3)cs2)cc1SC 483325623 URWWLVHQRWWBKH-UHFFFAOYSA-N 453.904 5.494 5 20 JKBD O=C(Nc1cccc(COCc2ccco2)c1)c1cc([N+](=O)[O-])ccc1Sc1ccccc1 502699041 WUYSHLMFLUCAJO-UHFFFAOYSA-N 460.511 6.308 5 20 JKBD Cn1cc(C(=O)Nc2ncc(Cc3ccc(C(F)(F)F)cc3)s2)c(-c2ccc([N+](=O)[O-])cc2)n1 507252704 NKZWJBITWONZKG-UHFFFAOYSA-N 487.463 5.314 5 20 JKBD C[C@@H](NC[C@@H](c1ccccc1)c1c[nH]c2ccccc12)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 510297341 KCZBSECZZXDHJF-VGSWGCGISA-N 453.502 5.609 5 20 JKBD COc1ccccc1-c1nnc(SCC(=O)c2ccc([N+](=O)[O-])cc2)n1-c1ccc(C)cc1 514240432 BOSLNWHAWKCMEG-UHFFFAOYSA-N 460.515 5.135 5 20 JKBD C[C@@H](Nc1ccc(NC(=O)c2cc([N+](=O)[O-])cc(S(C)(=O)=O)c2)cc1Cl)c1ccccc1 524141018 CNGZUGCEVDXGMK-CQSZACIVSA-N 473.938 5.077 5 20 JKBD O=C(Nc1nc(-c2cccc(C(F)(F)F)c2)cs1)c1ccn(-c2cccc([N+](=O)[O-])c2)n1 603863262 BIHWCQXXRHHHIB-UHFFFAOYSA-N 459.409 5.175 5 20 JKBD Cc1nn(CCC(=O)Nc2ccccc2OCc2ncc(-c3cccc(Cl)c3)o2)c(C)c1[N+](=O)[O-] 608850323 HGHYYBQHPLGQER-UHFFFAOYSA-N 495.923 5.324 5 20 JKBD CC(C)Oc1ccc(NC(=O)c2ccc([N+](=O)[O-])cc2I)c(C(F)(F)F)c1 609189175 XUSOIFHYYHPUFF-UHFFFAOYSA-N 494.207 5.258 5 20 JKBD COCCN(C(=O)C[C@H]1CCCc2ccccc21)c1nc(-c2ccc([N+](=O)[O-])cc2)cs1 609372094 VVZKIDIANCMTCF-LJQANCHMSA-N 451.548 5.208 5 20 JKBD O=[N+]([O-])c1cc(C(F)(F)F)ccc1Sc1nnc(-c2c[nH]c3ccccc23)n1C[C@H]1CCCO1 619671203 UZCUJAZLMBTZGO-CQSZACIVSA-N 489.479 5.684 5 20 JKBD O=C(Oc1ccccc1OCC(F)(F)F)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 727642255 GUUDAMIPCKKZKR-UHFFFAOYSA-N 492.372 5.377 5 20 JKBD CSc1ccc([N+](=O)[O-])c(C(=O)Nc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(C(F)(F)F)c2)c1 728013502 MYSSKIMSKVDCQE-STQMWFEESA-N 469.485 5.201 5 20 JKBD O=C(Nc1ccc(-n2nccn2)cc1C(F)(F)F)c1ccc(Nc2ccccc2)c([N+](=O)[O-])c1 728167830 VNCZZYLPJHJICQ-UHFFFAOYSA-N 468.395 5.190 5 20 JKBD CCN(CC)c1nc2sc(C(=O)O[C@H](C)c3nnc(-c4ccc([N+](=O)[O-])cc4)o3)cc2s1 744556103 LLCIZUWVTDSKNL-LLVKDONJSA-N 473.536 5.080 5 20 JKBD COc1ccc([C@@H](CNc2c([N+](=O)[O-])cc(CO)c(C)c2[N+](=O)[O-])c2c[nH]c3ccccc23)cc1 796442141 DXYJGZNVAHQNIP-HXUWFJFHSA-N 476.489 5.038 5 20 JKBD COc1ccc([N+](=O)[O-])cc1NC(=O)[C@@H](C)OC(=O)c1csc(-c2ccc(C(C)C)cc2)n1 900227224 VRLHQHQNNCBFMY-CQSZACIVSA-N 469.519 5.034 5 20 JKBD CCN1C(=S)N[C@@H](c2ccc(Cl)c([N+](=O)[O-])c2)C(C(=O)Nc2ccccc2C(F)(F)F)=C1C 916164393 ZRBSNDYRPLABEB-SFHVURJKSA-N 498.914 5.431 5 20 JKBD COc1ccc(C(=O)O[C@H](C(=O)Nc2ccc(C)cc2[N+](=O)[O-])c2ccccc2)cc1OC(F)F 919214244 NEKWDLAHOBYULG-NRFANRHFSA-N 486.427 5.050 5 20 JKBD O=C(/C=C/c1ccc([N+](=O)[O-])o1)Nc1ccc(C2(NC(=O)CCc3c[nH]c4ccccc34)CCC2)cc1 1786204805 UTHLMHZCMWKAGA-SDNWHVSQSA-N 498.539 5.449 5 20 JKBD O=C(CCc1cccc([N+](=O)[O-])c1)Nc1ccc(C2(NC(=O)c3cnccc3Cl)CCC2)cc1 1786602105 BXSDHMRQCZECID-UHFFFAOYSA-N 478.936 5.024 5 20 JKBD COc1cc(CC(=O)NC2(c3ccc(NC(=O)[C@@H](C)c4cccs4)cc3)CCC2)ccc1[N+](=O)[O-] 1791816526 SNWMUZHKIYXVAP-KRWDZBQOSA-N 493.585 5.145 5 20 JKBD C[C@@H](C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)C1(c3cccc([N+](=O)[O-])c3)CCC1)C2)c1ccc(Cl)cc1 1792820370 ASFIVYYIAKLDHR-OCYFJXFZSA-N 496.007 5.112 5 20 JKBD Cc1cc(CCCC(=O)Nc2cc([C@@H]3CCCCN3C(=O)c3ccsc3)[nH]n2)c([N+](=O)[O-])cc1F 1815071466 TYJHFWKMOKUZMO-FQEVSTJZSA-N 499.568 5.156 5 20 JKBD O=C(Nc1cc([C@H]2CCCCN2C(=O)CSc2ccccc2[N+](=O)[O-])[nH]n1)c1ccc(Cl)cc1 1820564549 YPLGBBDITKLFKJ-GOSISDBHSA-N 499.980 5.070 5 20 JKBD Cc1ccc(CCC(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3cccc(F)c3[N+](=O)[O-])CC2)cc1F 1824456885 IYKKGWKSVZSIGM-XMMPIXPASA-N 499.558 5.048 5 20 JKBD O=C(Cc1cccc([N+](=O)[O-])c1)N1CCC([C@H]2CCCCN2C(=O)c2cc3sccc3s2)CC1 1828547374 RCYXFANJUIZNJJ-HXUWFJFHSA-N 497.642 5.347 5 20 JKBD C[C@@H]1C[C@@]1(C)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)CC1 1830223036 CTTZHKGPIFVKJW-KQUPGTECSA-N 469.607 5.089 5 20 JKBD Cc1c(Cl)cccc1-n1c(SCC(=O)Nc2cc([N+](=O)[O-])ccc2F)nnc1-c1ccncc1 10318281 WDYNKVOULSWLAE-UHFFFAOYSA-N 498.927 5.069 5 20 JKBD CCOC(=O)Nc1ccc(C(=O)O[C@H](C(=O)Nc2ccc(C)cc2[N+](=O)[O-])c2ccccc2)cc1 10702031 MCILBLJEHPJBRK-QFIPXVFZSA-N 477.473 5.008 5 20 JKBD C[C@H](OC(=O)c1cc(Cl)cc(Cl)c1)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 11117816 SVXHFXXKUUPHRD-QMMMGPOBSA-N 451.184 5.104 5 20 JKBD O=C(NC1CCN(C(=O)Nc2ccccc2)CC1)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1 12812111 TUHUZQIHRGLXMR-UHFFFAOYSA-N 494.935 5.467 5 20 JKBD O=C(Cn1c2ccccc2c(=O)c2ccccc21)Nc1ccccc1Oc1ccccc1Cl 14809668 PFQQUPYODWZCBU-UHFFFAOYSA-N 454.913 6.239 5 20 JKBD CC(=O)N(c1nc(COC(=O)c2cc([N+](=O)[O-])ccc2N2CCCCC2)cs1)c1ccccc1F 25324913 NVQMBANKFXIFKN-UHFFFAOYSA-N 498.536 5.222 5 20 JKBD C[C@@H](Sc1nccn1-c1ccc(Cl)cc1)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 26679299 YGMJUKVGPHWPCE-LLVKDONJSA-N 470.860 5.572 5 20 JKBD Cn1cnnc1-c1cccc(NC(=O)c2ccc(Sc3nc4ccccc4s3)c([N+](=O)[O-])c2)c1 33126835 GQACYMWLRRYWMX-UHFFFAOYSA-N 488.554 5.404 5 20 JKBD O=C(CSc1ccc(C(F)(F)F)cc1[N+](=O)[O-])N1CCc2sccc2[C@@H]1c1cccs1 105120259 ODDRZJKYEZBTAV-LJQANCHMSA-N 484.546 6.003 5 20 JKBD O=C(Nc1ccc(CN2C(=O)CSC2=O)cc1)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1 110103440 ZGPWJMUKVIDWHG-UHFFFAOYSA-N 497.916 5.488 5 20 JKBD O=C(Nc1c(F)cccc1Oc1ccccc1)c1ccc([N+](=O)[O-])cc1I 410034221 OMRNBPBELFCUJU-UHFFFAOYSA-N 478.217 5.383 5 20 JKBD O=C(Nc1nnc(SCc2cccs2)s1)c1ccc(NCc2ccccc2)c([N+](=O)[O-])c1 498828668 CRJMHZSNLWPLCW-UHFFFAOYSA-N 483.600 5.665 5 20 JKBD COc1cc(C(=O)NCCSCc2cccc3ccccc23)c([N+](=O)[O-])cc1OC(F)F 500711711 NRFDDALAVJTLFG-UHFFFAOYSA-N 462.474 5.021 5 20 JKBD CC(C)OC(=O)C[C@@H](NC(=O)Nc1ccccc1N1CCCCCC1)c1ccccc1[N+](=O)[O-] 503968072 DEIZSOQUSUPVAU-OAQYLSRUSA-N 468.554 5.180 5 20 JKBD O=C(N[C@H](c1ccccc1)c1nccs1)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1 505048741 QVSJYMOTFRRPDA-OAQYLSRUSA-N 465.918 6.016 5 20 JKBD O=C(NC1CC1)c1cccc(CNCc2ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])cc2)c1 507900445 AFXXUEMWDJKTRZ-UHFFFAOYSA-N 451.910 5.223 5 20 JKBD COc1cc(C(=O)N[C@@H](c2ccccc2)C2CCCC2)c([N+](=O)[O-])cc1OCc1cscn1 512216282 ZJZGTBGOGMCNES-QHCPKHFHSA-N 467.547 5.300 5 20 JKBD CCCS(=O)(=O)Nc1cccc(NC(=O)c2cc([N+](=O)[O-])ccc2Oc2ccccc2)c1C 568683429 PNCSZGIBCXPIDS-UHFFFAOYSA-N 469.519 5.100 5 20 JKBD Cc1csc(Sc2ccc(C(=O)N3C[C@H](c4ccccc4)OC[C@@H]3C)cc2[N+](=O)[O-])n1 608966179 GTRCWVVBCYBYIA-HNAYVOBHSA-N 455.561 5.113 5 20 JKBD C[C@H](OC(=O)c1cc(F)c(F)cc1[N+](=O)[O-])C(=O)Nc1c(Cl)cc(Cl)cc1Cl 725936633 DWCOSXIZVDBQSM-LURJTMIESA-N 453.612 5.017 5 20 JKBD C[C@@H](NCc1ccc(-c2ccc([N+](=O)[O-])cc2Br)o1)c1ccc(N2CCCC2=O)cc1 726606139 ACNAMWFISNSXDQ-OAHLLOKOSA-N 484.350 5.595 5 20 JKBD C[C@H](Nc1ccc(C(=O)Oc2cccc(OCC(F)(F)F)c2)cc1[N+](=O)[O-])c1ccccn1 727053101 MBCLENRQTSAZIY-AWEZNQCLSA-N 461.396 5.323 5 20 JKBD O=C(Nc1ccccc1SC(F)F)N1CCN(c2ccc([N+](=O)[O-])cc2C(F)(F)F)CC1 727586901 HQDAPRZDHFRVAI-UHFFFAOYSA-N 476.427 5.282 5 20 JKBD C[C@H](OC(=O)[C@@H]1C[C@H]1c1ccc(Cl)c(Cl)c1)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 727927051 LNANLQQIKOTEEE-TVYUQYBPSA-N 491.249 5.594 5 20 JKBD CC(C)(C)OC(=O)N1CCN(C(=O)c2csc(-c3ccc([N+](=O)[O-])cc3)n2)c2ccccc2C1 728002751 HKWQGWBXHSUZOU-UHFFFAOYSA-N 480.546 5.116 5 20 JKBD Cc1ccccc1OCCCNC(=O)c1ccccc1NC(=O)c1ccc([N+](=O)[O-])cc1Cl 729438884 ODPRVGQOPKNIFK-UHFFFAOYSA-N 467.909 5.008 5 20 JKBD CC(C)(C)OC(=O)N1CCC(NCc2ccc(-c3ccc([N+](=O)[O-])cc3Br)o2)CC1 729680508 SAUVIAPUZKQQLP-UHFFFAOYSA-N 480.359 5.106 5 20 JKBD C[C@@H](OC(=O)c1ccccc1C(=O)c1ccc(Cl)c([N+](=O)[O-])c1)c1nnc(-c2ccc(F)cc2)o1 745907329 JYMCAVJCZPZHJJ-CYBMUJFWSA-N 495.850 5.586 5 20 JKBD CCN(C(=O)c1cc(OC)c(OCc2cscn2)cc1[N+](=O)[O-])c1ccc2ccccc2c1 747654469 QNSBFFZLOOCYCZ-UHFFFAOYSA-N 463.515 5.459 5 20 JKBD Cc1c(Br)cc([N+](=O)[O-])cc1-c1nc(-c2cccc(OCc3cccnc3)c2)no1 904503888 RKUGVBAUEWCOPH-UHFFFAOYSA-N 467.279 5.357 5 20 JKBD Cc1nc(CSc2ccccc2C(=O)OCc2nc(-c3cccc([N+](=O)[O-])c3)no2)cs1 914889920 OGMJOMPYZLFRJH-UHFFFAOYSA-N 468.516 5.059 5 20 JKBD CCOc1ccc(-c2nc(C)c(C(=O)O[C@@H](C)C(=O)Nc3ccc([N+](=O)[O-])cc3Cl)s2)cc1 914909886 RIRRRFDSLVJSBO-ZDUSSCGKSA-N 489.937 5.263 5 20 JKBD Cc1ccc(-n2ncc(C(=O)O[C@@H](C)c3nnc(-c4ccc([N+](=O)[O-])cc4)o3)c2C(C)C)cc1 914977543 ZFSYPDQAVQHZRS-INIZCTEOSA-N 461.478 5.180 5 20 JKBD O=C(Nc1ccccc1SCc1ccccc1)c1cc([N+](=O)[O-])ccc1I 915277577 WPWPKPLUOKNQJQ-UHFFFAOYSA-N 490.322 5.744 5 20 JKBD O=[N+]([O-])c1cccc(-c2ccc(/C=C(\c3nc4ccccc4[nH]3)S(=O)(=O)c3ccccc3)o2)c1 915852450 YREZOUGXTYEZIA-LFVJCYFKSA-N 471.494 5.703 5 20 JKBD CC(C)Oc1ccc(N[C@@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Br)c2ccccc2)cc1 917935395 FSTHCRNLNHISAQ-JOCHJYFZSA-N 484.350 5.936 5 20 JKBD C[C@@H](Nc1ccc(C(=O)OCc2noc(-c3ccc(Cl)cc3)n2)cc1[N+](=O)[O-])c1ccccn1 920545761 JCNPYQWVUXAODT-CQSZACIVSA-N 479.880 5.223 5 20 JKBD O=C(c1cc([N+](=O)[O-])ccc1SC1CCCC1)N1CCc2c(ncn2CCc2ccccc2)C1 929070407 PDZKPKGJLSXNIM-UHFFFAOYSA-N 476.602 5.267 5 20 JKBD CNc1ccc(C(=O)NC2(c3ccc(NC(=O)Cn4ccc5ccc([N+](=O)[O-])cc54)cc3)CCC2)cc1 1786277606 OYIMDBJLFMEADX-UHFFFAOYSA-N 497.555 5.039 5 20 JKBD O=C(NC1(c2ccc(NC(=O)c3cccc(F)c3[N+](=O)[O-])cc2)CCC1)c1cc2cccnc2s1 1790698665 HTYJPXIBFMJQPK-UHFFFAOYSA-N 490.516 5.405 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)Nc1ccc(C2(NC(=O)CNc3ccc(F)cc3)CCC2)cc1 1790771431 ZYDKBCSRURWHAL-UHFFFAOYSA-N 494.498 5.041 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)c3ccccc3Cl)CCC2)cc1)c1nc2cc([N+](=O)[O-])ccc2[nH]1 1790827358 KYBGBOGMJOTRFS-UHFFFAOYSA-N 489.919 5.186 5 20 JKBD Cc1cc(C(=O)NC2(c3ccc(NC(=O)/C=C/c4ccccc4[N+](=O)[O-])cc3)CCC2)c(C)o1 1792315668 NOVZFUAUACFIEJ-MDWZMJQESA-N 459.502 5.266 5 20 JKBD Cc1c(C(=O)Nc2cc([C@H]3CCCCN3C(=O)c3ccc([N+](=O)[O-])cc3F)[nH]n2)oc2ccccc12 1818569606 ADWDEUWRQQUGKO-HXUWFJFHSA-N 491.479 5.131 5 20 JKBD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2ccc(Cl)o2)[nH]n1)c1cc2cc([N+](=O)[O-])ccc2s1 1821609260 AUYIAGQWVRXHLZ-HNNXBMFYSA-N 499.936 5.399 5 20 JKBD C/C(=C\c1cccs1)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)Cc2cc([N+](=O)[O-])ccc2F)CC1 1823714868 LUMFFHMVKYXXQZ-MMYRTMNYSA-N 499.608 5.061 5 20 JKBD Cc1cc2cccc(C(=O)N3CCCC[C@@H]3C3CCN(C(=O)c4cc(F)cc([N+](=O)[O-])c4)CC3)c2[nH]1 1828214133 CXFFDFKQMYWHBT-XMMPIXPASA-N 492.551 5.071 5 20 JKBD COc1cc(C(=O)N2CCC([C@H]3CCCCN3C(=O)c3ccc(C)cc3Cl)CC2)ccc1[N+](=O)[O-] 1832608278 MAVITNOGCFMNLW-JOCHJYFZSA-N 499.995 5.112 5 20 JKBD COc1cc(C(=O)Nc2ccc(OC(F)F)c(Cc3ccccc3)c2)c([N+](=O)[O-])cc1OC(F)F 11917053 DAVHABZRENSOAD-UHFFFAOYSA-N 494.397 5.649 5 20 JKBD C[C@@H](OC(=O)c1ccc(Cl)c([N+](=O)[O-])c1)C(=O)Nc1ccc(Cl)cc1C(F)(F)F 15644143 GXGLNLDUFASLLX-MRVPVSSYSA-N 451.184 5.104 5 20 JKBD COc1cc2c(cc1OC)[C@H](c1cccs1)N(C(=O)c1ccc([N+](=O)[O-])cc1Cl)CC2 16002522 WCQJUBMDWQRXPN-OAQYLSRUSA-N 458.923 5.115 5 20 JKBD CC(C)N(Cc1nnc(-c2cccc([N+](=O)[O-])c2)o1)C(=O)COc1cc(Cl)c(Cl)cc1Cl 16014879 WYZHWCHXOMEOML-UHFFFAOYSA-N 499.738 5.421 5 20 JKBD C[C@H](Sc1nc2ccc([N+](=O)[O-])cc2s1)C(=O)Nc1ccc(Cl)cc1C(F)(F)F 16054209 SLTJEMCMSOGFTE-QMMMGPOBSA-N 461.874 5.996 5 20 JKBD CSc1ccc([N+](=O)[O-])c(C(=O)Oc2ccc(NC(=O)c3ccccc3Br)cc2)c1 16260678 CCUWQUBZEJINGO-UHFFFAOYSA-N 487.331 5.551 5 20 JKBD Cc1nc(-c2ccc(F)cc2)sc1C(=O)O[C@H](C)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl 18017953 NGQDMRMYNWSEPM-LLVKDONJSA-N 463.874 5.003 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Cl)[C@@H](NC1CCN(Cc2ccccc2)CC1)c1ccccc1 21819393 FYYTUCCDRXKWHY-VWLOTQADSA-N 478.980 5.182 5 20 JKBD CC(C)c1cc(C(=O)Nc2nc(-c3cccc([N+](=O)[O-])c3)cs2)c2cnn(C(C)C)c2n1 22570412 INJDEKYKYLVXNH-UHFFFAOYSA-N 450.524 5.420 5 20 JKBD CC(=O)c1ccc(C(=O)O[C@H](C(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)c2ccccc2)s1 25267017 DAUXNINJCGWRNS-IBGZPJMESA-N 458.879 5.049 5 20 JKBD COc1ccc(-c2nnc(SCCC(=O)Nc3ccc([N+](=O)[O-])cc3C)n2C2CCCCC2)cc1 26368261 MTGQDKLQWCMSSL-UHFFFAOYSA-N 495.605 5.796 5 20 JKBD CCOc1cc(NC(=O)c2ccc(Cl)cc2[N+](=O)[O-])c(OCC)cc1NC(=O)c1ccccc1 57325661 APOVNZCWRZBBRO-UHFFFAOYSA-N 483.908 5.550 5 20 JKBD COc1cccc([C@H](CNc2nc3sccn3c2[N+](=O)[O-])c2c[nH]c3ccccc23)c1OC 247904796 HNBFZQLBHKUHAY-KRWDZBQOSA-N 463.519 5.047 5 20 JKBD O=C(CCn1cc([N+](=O)[O-])cn1)Nc1cc(Cl)ccc1Oc1ccc(C(=O)c2ccccc2)cc1 303031218 XHDWJHAPTCXRNF-UHFFFAOYSA-N 490.903 5.497 5 20 JKBD C[C@@H](NC(=O)CSc1ccc(C(F)(F)F)cc1[N+](=O)[O-])c1nc(-c2ccccc2)cs1 410292154 QBSGVBYLBTZDLK-GFCCVEGCSA-N 467.494 5.707 5 20 JKBD O=C(N[C@@H](c1ccccc1)c1cccnc1)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 485509901 KGCRGGOAQRNOSP-QHCPKHFHSA-N 484.478 5.131 5 20 JKBD Cc1cc(Sc2nnc(-c3ccccc3Br)o2)nc(-c2ccc([N+](=O)[O-])cc2)n1 489227890 AEBUPYXJSUPFDY-UHFFFAOYSA-N 470.308 5.324 5 20 JKBD Cc1noc(C)c1NC(=O)c1c2c(nc3ccccc13)/C(=C/c1ccc([N+](=O)[O-])cc1)CCC2 499450739 DZMTXPNPQLORSJ-NBVRZTHBSA-N 454.486 5.877 5 20 JKBD COc1ccc(Br)cc1[C@H]1CCCN1C(=O)c1csc(-c2cccc([N+](=O)[O-])c2)n1 504970554 IJDNFTCBRWIEKS-GOSISDBHSA-N 488.363 5.467 5 20 JKBD COc1ccc(NC(=O)c2ccc(N3C[C@@H](C)C[C@H](C)C3)c([N+](=O)[O-])c2)cc1OCc1cccnc1 515498020 GNLUHFKEVLHCCI-OALUTQOASA-N 490.560 5.312 5 20 JKBD O=[N+]([O-])c1ccc(-c2nn(-c3ccccc3)cc2CNCc2cc(Br)cs2)cc1 517543210 YXTRBXIDCAJRCD-UHFFFAOYSA-N 469.364 5.561 5 20 JKBD CCN(C(=O)c1ccc(N2CCCC2)c([N+](=O)[O-])c1)[C@H](c1cccnc1)c1ccc(F)c(F)c1 517810304 XQHRXEKRCJZCCP-DEOSSOPVSA-N 466.488 5.120 5 20 JKBD CCCNC(=O)c1ccc(NC(=O)c2ccc(N[C@@H](C)c3ccccn3)c([N+](=O)[O-])c2)cc1Cl 520423052 DKBBGKHIQVCASO-HNNXBMFYSA-N 481.940 5.208 5 20 JKBD CC(C)Oc1ccc(NC(=O)CSc2ccc(C(F)(F)F)cc2[N+](=O)[O-])c(C(F)(F)F)c1 521526556 WHAAPELWUXAFGT-UHFFFAOYSA-N 482.402 6.150 5 20 JKBD C[C@@H](NCc1ccc(-c2ccccc2[N+](=O)[O-])o1)c1cccc(NC(=O)Cc2ccccc2F)c1 521816167 OQXPOGVZKYMTKZ-GOSISDBHSA-N 473.504 6.026 5 20 JKBD Cc1ccc(NS(=O)(=O)c2ccc(N3CCC(C(=O)c4ccccc4)CC3)c([N+](=O)[O-])c2)c(C)c1 590108175 CMEFTZPIBHYNBB-UHFFFAOYSA-N 493.585 5.112 5 20 JKBD O=C(Nc1cc(-c2nnc3n2CCCCC3)ccc1Cl)c1ccc(N2CCCC2)c([N+](=O)[O-])c1 591557672 FYQKRSBCNKDESV-UHFFFAOYSA-N 480.956 5.086 5 20 JKBD COc1cc(C(=O)Nc2ccc(C)c(NC(C)=O)c2)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 603774492 SJKBWMMULJCMDC-UHFFFAOYSA-N 469.881 5.568 5 20 JKBD Cc1cc(Oc2ncccn2)ccc1NC(=O)c1ccc(N2C[C@@H](C)C[C@@H](C)C2)c([N+](=O)[O-])c1 604452386 UWQLLBKWLDEWKI-CALCHBBNSA-N 461.522 5.220 5 20 JKBD COc1ccc(CC(=O)Nc2sc3c(c2-c2nc4ccccc4[nH]2)CCCC3)cc1[N+](=O)[O-] 609009104 CWPYUCJGWVPENI-UHFFFAOYSA-N 462.531 5.268 5 20 JKBD CCOc1cc(CN[C@@H](C)c2ccc(C)s2)ccc1OCc1cc([N+](=O)[O-])cc2c1OCOC2 725846360 HSMGITMFDQAJAI-KRWDZBQOSA-N 484.574 5.660 5 20 JKBD CS(=O)(=O)c1ccc(Oc2ccc(NC(=O)c3cc([N+](=O)[O-])ccc3N3CCCCC3)cc2)cc1 726517577 AHTYQVVNDXUMTJ-UHFFFAOYSA-N 495.557 5.033 5 20 JKBD COc1cc([C@@H](C[N+](=O)[O-])c2c[nH]c3ccccc23)ccc1OS(=O)(=O)c1ccc(SC)cc1 747452424 BUSSVHGRRLVXHO-OAQYLSRUSA-N 498.582 5.075 5 20 JKBD CCOc1cc(C(=O)Nc2scc(-c3ccccc3Cl)c2C(=O)OC)c([N+](=O)[O-])cc1OC 747623194 FLOSIYCNXWVRGM-UHFFFAOYSA-N 490.921 5.423 5 20 JKBD CC(=O)N(c1ccccc1)c1nc(COC(=O)c2csc(-c3ccc([N+](=O)[O-])cc3)n2)cs1 747958890 ZXRSUIZURBTNNK-UHFFFAOYSA-N 480.527 5.216 5 20 JKBD O=C(Nc1ccc(Cc2nc3ccccc3s2)cc1)c1cc([N+](=O)[O-])ccc1Br 751056716 ARXOZUQSXOABCT-UHFFFAOYSA-N 468.332 5.810 5 20 JKBD Cc1csc(Sc2ccc(C(=O)O[C@H](C)C(=O)c3ccc(F)cc3F)cc2[N+](=O)[O-])n1 760256937 QECSGECTRBMGJF-LLVKDONJSA-N 464.471 5.217 5 20 JKBD CCOc1ccccc1NC(=O)[C@@H](OC(=O)c1ccc(N2CCCC2)c([N+](=O)[O-])c1)c1ccccc1 798273089 QHXZAAFVYWJQKU-VWLOTQADSA-N 489.528 5.131 5 20 JKBD CCOC(=O)c1c(-c2ccc(OC)c(OC)c2)csc1NC(=O)c1cccc([N+](=O)[O-])c1C 863982555 SUJHYPXMCIBAJK-UHFFFAOYSA-N 470.503 5.078 5 20 JKBD Cc1cccc([N+](=O)[O-])c1NC(=O)COC(=O)[C@H](C)SCc1ncc(-c2ccc(Cl)cc2)o1 920671728 AEAKJTNAKIRKRE-AWEZNQCLSA-N 489.937 5.015 5 20 JKBD O=C(/C=C/c1ccc([N+](=O)[O-])o1)Nc1ccc(C2(NC(=O)c3cccc4ncsc34)CCC2)cc1 1786207351 CBFSRXUEUKBSEC-PKNBQFBNSA-N 488.525 5.259 5 20 JKBD C[C@@]1(C(=O)Nc2ccc(C3(NC(=O)c4cc([N+](=O)[O-])cc5c4OCC5)CCC3)cc2)CC=CCC1 1791991866 NNXVXKVUDMRPLB-AREMUKBSSA-N 475.545 5.024 5 20 JKBD Cc1c(C(=O)N2CC[C@H](CNC(=O)C3(C(C)C)CCC3)[C@@H]2c2cccnc2)cc(Cl)cc1[N+](=O)[O-] 1813665834 LEYRJCWXPLYCHF-XXBNENTESA-N 499.011 5.098 5 20 JKBD CC(C)c1ccc(CC(=O)N2CCC([C@@H]3CCCCN3C(=O)Cc3cccc([N+](=O)[O-])c3)CC2)cc1 1823681139 CFPOBRHVIQERCL-MHZLTWQESA-N 491.632 5.123 5 20 JKBD Cc1csc(C(=O)N2CCC([C@H]3CCCCN3C(=O)Cc3ccc(Cl)cc3[N+](=O)[O-])CC2)c1 1824161366 LPPKSQUCTMCLPP-HXUWFJFHSA-N 490.025 5.094 5 20 JKBD O=C(c1cc2ccccc2o1)N1CCC([C@H]2CCCCN2C(=O)c2ccc([N+](=O)[O-])cc2F)CC1 1830496223 KKEKBVMQICDNAO-JOCHJYFZSA-N 479.508 5.027 5 20 JKBD Cc1cccc(-n2c(SCC(=O)Nc3cc([N+](=O)[O-])ccc3F)nnc2-c2ccccc2)c1 9924861 MKYHNWDRLWYVBU-UHFFFAOYSA-N 463.494 5.021 5 20 JKBD CC(=O)N(c1nc(CSc2nc3ccc([N+](=O)[O-])cc3s2)cs1)c1cccc(C)c1C 10592367 PTTZLMBONBUOBV-UHFFFAOYSA-N 470.601 6.255 5 20 JKBD CSc1ccc(NC(=O)COc2ccc3c(-c4ccc([N+](=O)[O-])cc4)cc(=O)oc3c2)cc1 10850120 YGIBGCDPPIWLDP-UHFFFAOYSA-N 462.483 5.108 5 20 JKBD CC(C)c1ccc([C@H](NC(=O)c2ccc(Sc3nncn3C)c([N+](=O)[O-])c2)c2cccs2)cc1 15616518 KMQAFELQXGKRRQ-QFIPXVFZSA-N 493.614 5.579 5 20 JKBD C[C@H](OC(=O)c1ccc(-c2ccc(F)cc2)s1)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 23266737 STRLHZPXRUKFQG-NSHDSACASA-N 482.411 5.665 5 20 JKBD CC(=O)N(c1ccc(Cl)c(Cl)c1)c1nc(COC(=O)c2ccc(C)c([N+](=O)[O-])c2)cs1 23633914 NGFVKKCIHSTLJJ-UHFFFAOYSA-N 480.329 5.708 5 20 JKBD O=C(CSc1nnc(-c2ccccc2Cl)n1C1CCCC1)Nc1ccccc1[N+](=O)[O-] 36184257 HZFCTOMJBIIXKH-UHFFFAOYSA-N 457.943 5.353 5 20 JKBD O=c1ccc(-c2cccc([N+](=O)[O-])c2)nn1Cc1csc(-c2ccc(C(F)(F)F)cc2)n1 195741416 YRDWHLXMOHCBPG-UHFFFAOYSA-N 458.421 5.009 5 20 JKBD O=C(CCNc1ccc(C(F)(F)F)cc1[N+](=O)[O-])Nc1ccccc1NC(=O)C[C@@H]1C=CCC1 409976270 ATGHUCWOBQDZMK-OAHLLOKOSA-N 476.455 5.349 5 20 JKBD O=C(Nc1nc(-c2sccc2Br)cs1)c1cc2cc([N+](=O)[O-])ccc2o1 500707919 FFXFZQZMOISISQ-UHFFFAOYSA-N 450.295 5.541 5 20 JKBD Cc1cccn2c(NC(=O)c3ccc(N[C@@H](C)c4ccccn4)c([N+](=O)[O-])c3)c(-c3ccccc3)nc12 506011153 YUEPROMGKSTVOM-IBGZPJMESA-N 492.539 6.038 5 20 JKBD COc1ccc(CN[C@H](C)c2cnn(-c3ccc(F)cc3)c2C)cc1OCc1ccc([N+](=O)[O-])cc1 507958067 YGWSVLXCUMSHDK-GOSISDBHSA-N 490.535 5.666 5 20 JKBD Cc1ccc(C(C)C)c(Oc2ccc(CNCc3ccccc3CN3CCCC3=O)cc2[N+](=O)[O-])c1 513593890 HUCCULATDMZVPR-UHFFFAOYSA-N 487.600 6.231 5 20 JKBD COc1ccc(-c2nnc(S[C@H](C)C(=O)Nc3ccc([N+](=O)[O-])cc3Cl)n2CC(C)C)cc1 513917234 TWVDBSGESXRXTQ-CQSZACIVSA-N 489.985 5.291 5 20 JKBD O=C(Nc1nc(-c2ccco2)c(-c2ccco2)s1)c1ccc(N2CCCC2)c([N+](=O)[O-])c1 514471980 JQYBDUMCDSEQOS-UHFFFAOYSA-N 450.476 5.424 5 20 JKBD CCOc1ccc(NC(=O)c2ccc(NC(=O)[C@H](C)Oc3ccc(Cl)cc3[N+](=O)[O-])cc2)cc1 518829273 KHPYVMKIXGMHBQ-HNNXBMFYSA-N 483.908 5.305 5 20 JKBD O=C(NCc1cn2ccsc2n1)c1ccccc1Sc1ccc(C(F)(F)F)cc1[N+](=O)[O-] 520503036 KCAMZWCAYMYNOA-UHFFFAOYSA-N 478.477 5.404 5 20 JKBD Cc1ncsc1CN(C)C(=O)c1c2c(nc3ccccc13)/C(=C/c1ccc([N+](=O)[O-])cc1)CCC2 520892621 KLZHMPZJAMQJCU-XMHGGMMESA-N 484.581 6.057 5 20 JKBD COCCN(C(=O)[C@H]1C[C@H]1c1ccc(C(F)(F)F)cc1)c1nc(-c2ccc([N+](=O)[O-])cc2)cs1 589197828 CPWGVNIUMJKUAD-OALUTQOASA-N 491.491 5.520 5 20 JKBD Cc1nc(-c2cccc(NC(=O)C/C(=C\c3ccc([N+](=O)[O-])cc3)c3nc4ccccc4s3)c2)no1 604441079 YWDUYXMYUDGZPD-CPNJWEJPSA-N 497.536 6.132 5 20 JKBD CN(Cc1nnc2ccccn12)C(=O)c1ccccc1Sc1ccc(C(F)(F)F)cc1[N+](=O)[O-] 604539298 IQLRRYCDXHVAKT-UHFFFAOYSA-N 487.463 5.080 5 20 JKBD O=C(c1ccc(C(=O)N2CCC[C@H]2c2cccs2)c([N+](=O)[O-])c1)N1CCC[C@H]1c1cccs1 609043745 PUEFHFAAJDWVNN-OALUTQOASA-N 481.599 5.672 5 20 JKBD COc1ccc(CSCC(=O)Nc2ccc(N[C@@H](C)c3ccccc3)cc2)cc1[N+](=O)[O-] 609071823 GKASYPJIKAZQFA-KRWDZBQOSA-N 451.548 5.648 5 20 JKBD COc1cc(C(=O)N[C@@H](c2ccc(C)cc2)c2ccc(F)cc2Cl)c([N+](=O)[O-])cc1OC 609374143 IIDHBNNAGAXRTK-QFIPXVFZSA-N 458.873 5.232 5 20 JKBD Cc1oc(-c2ccsc2)nc1CN(c1ccccc1)S(=O)(=O)c1ccc(Cl)c([N+](=O)[O-])c1 726787679 RBCYHTJAOTXALR-UHFFFAOYSA-N 489.962 5.669 5 20 JKBD O=C(Nc1cc(Cl)c([N+](=O)[O-])cc1OCc1ccccc1)c1sc(N2CCCC2)nc1Cl 728160874 AUHDWWGEPDZZMX-UHFFFAOYSA-N 493.372 5.790 5 20 JKBD CCOC(=O)c1c(-c2ccc(C)cc2)csc1NC(=O)c1cc(SC)c(OC)cc1[N+](=O)[O-] 728455967 DBRWIHJCPUCUAJ-UHFFFAOYSA-N 486.571 5.791 5 20 JKBD C[C@@H](Nc1ccc(C(=O)Oc2ccc(NC(=O)c3ccsc3)cc2)cc1[N+](=O)[O-])c1ccccn1 728885197 QDFPVRXUQFJTCB-MRXNPFEDSA-N 488.525 5.696 5 20 JKBD Cc1ccc(NC(=O)[C@@H](OC(=O)c2cnc(-c3ccco3)s2)c2ccccc2)c([N+](=O)[O-])c1 729023349 FXFXPEBGQGMYMQ-FQEVSTJZSA-N 463.471 5.157 5 20 JKBD O=C(COC(=O)[C@H]1C[C@@H]1c1ccc2ccccc2c1)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 731279256 XJSVSJOAYKLXBE-MSOLQXFVSA-N 458.392 5.052 5 20 JKBD Cc1cc(C)c(NC(=O)[C@H](C)OC(=O)c2csc(-c3cccc([N+](=O)[O-])c3)n2)c(Cl)c1 747961874 LRTKTRKBLLCVRI-ZDUSSCGKSA-N 459.911 5.173 5 20 JKBD CC(=O)Nc1cccc([C@@H](C)N(Cc2ccccc2)C(=O)c2cc([N+](=O)[O-])c(C)c([N+](=O)[O-])c2C)c1 748617429 JFJYXXSLVWIEPJ-GOSISDBHSA-N 490.516 5.482 5 20 JKBD COc1cc2c(cc1NC(=O)CNc1cc([N+](=O)[O-])ccc1OC(F)F)oc1ccccc12 917813987 PFNYKIXIAPSCNG-UHFFFAOYSA-N 457.389 5.155 5 20 JKBD CCOc1cc(NC(=O)c2cc([N+](=O)[O-])ccc2F)c(OCC)cc1NC(=O)c1ccccc1 919679283 MQCKPRTVPCKWCD-UHFFFAOYSA-N 467.453 5.036 5 20 JKBD O=C(c1ccc(-n2ccc(C(F)(F)F)n2)cc1)N(Cc1ccccc1[N+](=O)[O-])CC(F)(F)F 920002523 JMBNQTKSKMLWAK-UHFFFAOYSA-N 472.345 5.004 5 20 JKBD CCCCCc1ncc(C(=O)NC2(c3ccc(NC(=O)c4ccc([N+](=O)[O-])o4)cc3)CCC2)s1 1785751056 LXOWLRSSUHKZCT-UHFFFAOYSA-N 482.562 5.439 5 20 JKBD O=C(COC1CCCCC1)Nc1ccc(C2(NC(=O)CCc3cccc([N+](=O)[O-])c3)CCC2)cc1 1786014364 PJPCHTQAGPMGLF-UHFFFAOYSA-N 479.577 5.011 5 20 JKBD COc1cc(C(=O)NC2(c3ccc(NC(=O)[C@H](F)c4ccccc4)cc3)CCC2)ccc1[N+](=O)[O-] 1786616924 WHENHCLAQOIENH-HSZRJFAPSA-N 477.492 5.062 5 20 JKBD Cc1c(C(=O)NC2(c3ccc(NC(=O)CC(F)(F)F)cc3)CCC2)cc(Cl)cc1[N+](=O)[O-] 1787876389 CRIOLTTZXJPYTM-UHFFFAOYSA-N 469.847 5.257 5 20 JKBD Cc1ccccc1NCC(=O)Nc1ccc(C2(NC(=O)/C=C/c3ccccc3[N+](=O)[O-])CCC2)cc1 1788112397 PBZXTMWVXXJKPG-LFIBNONCSA-N 484.556 5.163 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)c3ccc([N+](=O)[O-])o3)CCC2)cc1)c1ccc(C(F)(F)F)cc1 1790310459 CZECQNDZVVPKKE-UHFFFAOYSA-N 473.407 5.268 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)c3ccc(Cl)cc3)CCC2)cc1)c1ccc(O)c([N+](=O)[O-])c1 1790619271 VDUBKFJTYZLWRI-UHFFFAOYSA-N 465.893 5.015 5 20 JKBD O=C(Cc1cccc([N+](=O)[O-])c1)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(Cl)c(Cl)c(Cl)c1 1803893340 LTUZFLICJHNAMI-MUJYYYPQSA-N 496.778 5.050 5 20 JKBD CC[C@@H](C)[C@@H](C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)/C=C/c1ccccc1[N+](=O)[O-])c1ccccc1 1804338108 CFQAEBKAFCMULJ-DMLMBLHWSA-N 475.589 5.076 5 20 JKBD CC(C)=CCCC(=O)N1CCCC[C@H]1c1cc(NC(=O)C2(c3cccc([N+](=O)[O-])c3)CCC2)n[nH]1 1820843888 XJYUTPIEEJEJSU-QFIPXVFZSA-N 479.581 5.178 5 20 JKBD Cc1ccc(CCC(=O)N2CCCC[C@H]2C2CCN(C(=O)c3ccc([N+](=O)[O-])cc3F)CC2)cc1F 1824456019 DLQQIWDOWQOJFI-VWLOTQADSA-N 499.558 5.048 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2ccc3ccoc3c2)CC1 1830729237 KQXLLTJRUGNRAU-QHCPKHFHSA-N 493.535 5.336 5 20 JKBD C[C@@]1(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3cc4cc([N+](=O)[O-])ccc4s3)CC2)CC1(F)F 1832810120 PVDOZKUYHAZJKW-JPYJTQIMSA-N 491.560 5.088 5 20 JKBD Cc1sc2nc(SCC(=O)Nc3ccc([N+](=O)[O-])cc3Cl)n(C3CCCC3)c(=O)c2c1C 21138689 AQJWGYRHNWKTOJ-UHFFFAOYSA-N 493.010 5.482 5 20 JKBD C[C@@H](NC(=O)c1sc(-c2ccccc2)cc1OCC(=O)N1CCCCC1)c1cccc([N+](=O)[O-])c1 108291995 JGOHRGCZRBLBHH-GOSISDBHSA-N 493.585 5.206 5 20 JKBD C[C@H]1CCCN(c2ccc(C(=O)Nc3ccccc3NC(=O)C[C@H]3C=CCC3)cc2[N+](=O)[O-])C1 410092981 FXWSKFWVSIAGEI-OALUTQOASA-N 462.550 5.378 5 20 JKBD COc1ccc([C@H](Cc2ccc(F)cc2)NC(=O)c2cc(SC)c(OC)cc2[N+](=O)[O-])cc1 483402598 FPGQKBKZUUPQFQ-FQEVSTJZSA-N 470.522 5.187 5 20 JKBD C[C@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)N[C@H](Cn1cnc2ccccc21)c1ccc(F)cc1 484051112 WMAUVJZGKRWVQB-KSFYIVLOSA-N 464.522 5.122 5 20 JKBD O=C(Nc1cccc(N2C(=O)c3ccccc3C2=O)c1)c1ccc(NCc2ccccc2)c([N+](=O)[O-])c1 487755750 HNYMCSYWYVQDIH-UHFFFAOYSA-N 492.491 5.260 5 20 JKBD C[C@@H](N[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1)c1ccc(OC(F)F)cc1 493604710 WCACMEOZCFKTPU-SPLOXXLWSA-N 475.879 5.880 5 20 JKBD COc1ccc(N(C(=O)c2ccc(N[C@H](C)c3ccccn3)c([N+](=O)[O-])c2)[C@@H](C)C2CC2)cc1 499600648 YTFYPYZCWZELJP-MSOLQXFVSA-N 460.534 5.617 5 20 JKBD C[C@@H](Sc1nc(-c2ccccc2)c(-c2ccccc2)[nH]1)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 501217832 MIXPRPJZLFMKKX-MRXNPFEDSA-N 469.526 6.555 5 20 JKBD Cc1ccc(C(C)C)c(Oc2ccc(CNCc3ccnc(-n4cccn4)c3)cc2[N+](=O)[O-])c1 509615749 FXLVUDSIANXSMH-UHFFFAOYSA-N 457.534 5.689 5 20 JKBD O=C(Nc1ncc(Cc2ccc(F)cc2F)s1)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-] 511460685 JEZPITVEYFVXOW-UHFFFAOYSA-N 473.379 5.114 5 20 JKBD COc1ccc(CNC(=O)[C@](C)(Cc2nc3ccccc3s2)c2ccccc2)cc1[N+](=O)[O-] 516536674 JSLUVORVVPLVTD-RUZDIDTESA-N 461.543 5.030 5 20 JKBD CCOc1cc(CN[C@H]2CCC(C)(C)c3ccccc32)ccc1OCCn1c([N+](=O)[O-])cnc1C 517547522 YFQYLFGQFMAZFG-QHCPKHFHSA-N 478.593 5.480 5 20 JKBD CCC(=O)Nc1ccc(N[C@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2ccccc2)cc1 520741892 DRQCJYHOIMUCRE-QFIPXVFZSA-N 452.898 5.389 5 20 JKBD C[C@@H](Nc1ccc(C(=O)Nc2ccc(-c3noc(C(F)(F)F)n3)cc2)cc1[N+](=O)[O-])c1ccccn1 608875535 RIOFWOHZVNSZLI-CYBMUJFWSA-N 498.421 5.484 5 20 JKBD Cc1cc2c[nH]nc2cc1NC(=O)C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1 609174072 ZNIPNTIRTPPALK-BOPFTXTBSA-N 469.526 5.959 5 20 JKBD CC(C)(C)c1nc(C(=O)O[C@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2ccccc2)cs1 726687047 RTXQSEIXGDVQCA-SFHVURJKSA-N 473.938 5.539 5 20 JKBD Cc1nn(C)c2nc(-c3ccccc3)cc(C(=O)N(CC3CC3)c3ccc(Cl)c([N+](=O)[O-])c3)c12 728165334 HBPHUJJBGBGSRA-UHFFFAOYSA-N 475.936 5.562 5 20 JKBD O=C(Nc1ccn(Cc2ccccn2)n1)c1ccc(Sc2nc3ccccc3s2)c([N+](=O)[O-])c1 748671973 NMXNOYFRBMZWPY-UHFFFAOYSA-N 488.554 5.248 5 20 JKBD COc1ccccc1[C@@H](NCc1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1)c1nccn1C 915226092 AWFGMMUQKYFZNJ-XMMPIXPASA-N 478.936 5.662 5 20 JKBD C[C@@H](OC(=O)c1c(Cl)c2ccccc2n1C)C(=O)Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1 915462658 ILHUWELXSYOWKE-GFCCVEGCSA-N 484.921 5.047 5 20 JKBD Cc1ccc(NC(=O)c2sc3[nH]c(-c4ccc(Cl)c([N+](=O)[O-])c4)nc(=O)c3c2C)c(C)c1 917260453 NXMQXVIUSWGDBS-UHFFFAOYSA-N 468.922 5.391 5 20 JKBD C[C@H](OC(=O)c1ccc(SCc2ccccc2)cc1)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 919504348 LDRJPORULACLMK-INIZCTEOSA-N 461.499 5.855 5 20 JKBD CC(=O)N(c1ccc(C(F)(F)F)cc1)c1nc(COC(=O)c2ccc([N+](=O)[O-])cc2)cs1 920517266 ZZYMEIKXCMAWNJ-UHFFFAOYSA-N 465.409 5.112 5 20 JKBD Cc1cccc(-c2nnc([C@@H](C)OC(=O)c3ccc(N[C@@H](C)c4ccccn4)c([N+](=O)[O-])c3)o2)c1 920544900 NGTCWHKEJIQWOC-DLBZAZTESA-N 473.489 5.439 5 20 JKBD CC(C)n1ccc(C(=O)NC2(c3ccc(NC(=O)Cc4ccc(Cl)cc4[N+](=O)[O-])cc3)CCC2)n1 1786115726 GSSORLRMBHGNGN-UHFFFAOYSA-N 495.967 5.016 5 20 JKBD O=C(NC1(c2ccc(NC(=O)[C@@H](F)c3ccccc3)cc2)CCC1)c1cc(F)cc([N+](=O)[O-])c1 1786613343 MNFBATQUNHFBOC-QFIPXVFZSA-N 465.456 5.192 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)c3sccc3Cl)CCC2)cc1)c1ccc([N+](=O)[O-])c2c1OCO2 1790096077 FYHRJDDLSCOKCK-UHFFFAOYSA-N 499.932 5.100 5 20 JKBD O=C(Cc1cccc2ncccc12)NC1(c2ccc(NC(=O)c3cc(F)cc([N+](=O)[O-])c3)cc2)CCC1 1790695946 WUSZFNUZGFMJHC-UHFFFAOYSA-N 498.514 5.273 5 20 JKBD O=C(CSc1ccccc1[N+](=O)[O-])Nc1ccc(C2(NC(=O)c3cnccc3Cl)CCC2)cc1 1791522451 UCFIUUGPQUEAFS-UHFFFAOYSA-N 496.976 5.183 5 20 JKBD COc1cc(C(=O)Nc2ccc(C3(NC(=O)c4ccc5ncccc5c4)CCC3)cc2)ccc1[N+](=O)[O-] 1792164701 RGMQASYLFABUSP-UHFFFAOYSA-N 496.523 5.213 5 20 JKBD Cc1oc(C(C)(C)C)cc1C(=O)N1CCCC2(CCN(C(=O)Cc3cc(F)ccc3[N+](=O)[O-])CC2)C1 1808388793 JHTFJMDAPOKRQW-UHFFFAOYSA-N 499.583 5.020 5 20 JKBD O=C(Nc1cc([C@@H]2CCCCN2C(=O)Cc2cccc([N+](=O)[O-])c2)[nH]n1)c1cccc2ccccc12 1818450995 QXKLAJXYXJOSNK-DEOSSOPVSA-N 483.528 5.020 5 20 JKBD Cc1ccc(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)CSc3ccccc3[N+](=O)[O-])[nH]n2)c(C)c1 1820481706 YTOGJWKYACLYJZ-FQEVSTJZSA-N 493.589 5.033 5 20 JKBD Cc1c(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)[C@@H](C)Cc3ccco3)n[nH]2)cc(Cl)cc1[N+](=O)[O-] 1822846933 MBKVIPIEWZKFLK-VBKZILBWSA-N 499.955 5.057 5 20 JKBD C/C(=C\c1ccc(C)o1)C(=O)N1CCC([C@@H]2CCCCN2C(=O)CCc2cccc([N+](=O)[O-])c2)CC1 1824841080 ADWHNEFZUSZSFB-IZWLMUMNSA-N 493.604 5.152 5 20 JKBD O=C(N1CCC([C@@H]2CCCCN2C(=O)C2(c3cccc([N+](=O)[O-])c3)CCC2)CC1)C1(F)CCCCC1 1830293153 SVUUKQNRBCHOEL-DEOSSOPVSA-N 499.627 5.309 5 20 JKBD C/C=C(/C)C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)CC1 1831061361 QYRNHMNEEZOICL-SAMDCNTISA-N 455.580 5.009 5 20 JKBD O=C(Cc1cccs1)N1CCC([C@H]2CCCCN2C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)CC1 1831061434 SOONIBSMTMOMAF-OAQYLSRUSA-N 497.642 5.347 5 20 JKBD CN(Cc1cc([N+](=O)[O-])ccc1Cl)C(=O)C[C@H](NC(=O)c1ccccc1Cl)c1ccccc1 10899666 DCOQPTWPUVXGAY-QFIPXVFZSA-N 486.355 5.421 5 20 JKBD COc1ccc(NC(=O)C/C(=C/c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)c(OC)c1 15654545 FYHHBYVBNOQQNQ-LGMDPLHJSA-N 475.526 5.791 5 20 JKBD Cc1ccc(C(=O)COC(=O)c2ccccc2NC(=O)c2ccc([N+](=O)[O-])cc2Cl)cc1C 16660369 OVSWTOCZBRLSKP-UHFFFAOYSA-N 466.877 5.157 5 20 JKBD CCn1c(S[C@H](C(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)c2ccccc2)nnc1C1CC1 17769327 CIMXCQLFXOIGPQ-SFHVURJKSA-N 457.943 5.209 5 20 JKBD Cc1ccc(N[C@@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Br)c2ccccc2)cc1C 21818503 GKZPTXRWABFFFO-OAQYLSRUSA-N 454.324 5.766 5 20 JKBD COc1ccc(C)cc1NC(=O)[C@H](Sc1nc2cc3ccccc3cc2c(=O)n1C)c1ccccc1 22253201 QTIVLBJLBDWYTN-AREMUKBSSA-N 495.604 5.876 5 20 JKBD COc1cccc(NCc2nnc(SCC(=O)Nc3ccccc3[N+](=O)[O-])n2C2CCCCC2)c1 25255737 OHGHJFKGYFNIMK-UHFFFAOYSA-N 496.593 5.043 5 20 JKBD Cc1cc([N+](=O)[O-])ccc1NC(=O)CSc1nnc(-c2ccc(F)cc2)n1-c1ccccc1 28797755 NPQSGMNXMZTVFE-UHFFFAOYSA-N 463.494 5.021 5 20 JKBD O=C(OCc1nnc(-c2ccccc2)o1)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1 28931253 HPQNJWXBGOOFRG-UHFFFAOYSA-N 451.822 5.448 5 20 JKBD COc1cc(C(=O)Nc2ccc(-c3cnc(C)o3)cc2)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 29204666 LPZAUMYSIXSVIB-UHFFFAOYSA-N 479.876 6.265 5 20 JKBD COc1cc(C(=O)Nc2ccnn2Cc2c(Cl)cccc2Cl)c([N+](=O)[O-])cc1OC(F)F 31772426 VKCBNOZDPZTGMC-UHFFFAOYSA-N 487.246 5.009 5 20 JKBD COc1ccc(CN(C)C(=O)c2ccc(NCc3ccccc3)c([N+](=O)[O-])c2)cc1OC(F)F 33079317 TUOOIUUJZFQGLT-UHFFFAOYSA-N 471.460 5.089 5 20 JKBD CCOc1cc(C(=O)Nc2ccc(NC(=O)c3ccoc3)cc2C(F)(F)F)c([N+](=O)[O-])cc1OC 107885771 BKJUVHPHMIKQDW-UHFFFAOYSA-N 493.394 5.119 5 20 JKBD C[C@@H](Oc1cccc(Cl)c1Cl)C(=O)N(Cc1ccccc1[N+](=O)[O-])CC(F)(F)F 486065317 ANJZFPGOVFUYAQ-LLVKDONJSA-N 451.228 5.260 5 20 JKBD CCN(CC)C(=O)c1ccc(NC(=O)c2csc(-c3cccc([N+](=O)[O-])c3)n2)cc1Cl 496346957 OEUCRILJMQUGNU-UHFFFAOYSA-N 458.927 5.106 5 20 JKBD CC(C)CCSc1ccc(C(=O)N(C)[C@@H](C)c2ccc(-n3cncn3)cc2)cc1[N+](=O)[O-] 499193488 NWGBCUDNTPOQRK-KRWDZBQOSA-N 453.568 5.147 5 20 JKBD CC[C@@H](C)Sc1ccc(NC(=O)CCNC(=O)c2ccc([N+](=O)[O-])cc2)c(C(F)(F)F)c1 499572516 OZFBUCVQNDICLV-CYBMUJFWSA-N 469.485 5.263 5 20 JKBD C[C@@H]1CCCN(c2ccc(C(=O)N(C)CCCc3cc(-c4ccccc4)no3)cc2[N+](=O)[O-])C1 505343331 GQPMHVAVAVESSH-LJQANCHMSA-N 462.550 5.191 5 20 JKBD C[C@@H](Nc1ccc(C(=O)Nc2ccc(OC(F)F)cc2OC(F)F)cc1[N+](=O)[O-])c1ccccn1 507052655 MGTDXPKHADCHFE-GFCCVEGCSA-N 494.401 5.618 5 20 JKBD Cc1ccc([N+](=O)[O-])cc1C(=O)Nc1ccc(Cl)c(S(=O)(=O)Nc2ccccc2Cl)c1 508726990 NLTPQDUEJYKGSR-UHFFFAOYSA-N 480.329 5.263 5 20 JKBD CC[C@H](c1ccc(F)cc1)N(Cc1cccc(F)c1)C(=O)CSc1ccc(C(N)=O)cc1[N+](=O)[O-] 512334310 PMKSDVNELZOXSJ-OAQYLSRUSA-N 499.539 5.244 5 20 JKBD CCCN(C(=O)NCCc1cc(OC)c(OC)cc1[N+](=O)[O-])[C@H](C)c1cc2ccccc2o1 521062410 JUWGOIPLGRLTCZ-MRXNPFEDSA-N 455.511 5.084 5 20 JKBD C[C@@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)NC1CCN(Cc2ccc(Cl)c(Cl)c2)CC1 521329005 LPRUAPWNOJVEET-CYBMUJFWSA-N 486.783 5.103 5 20 JKBD COCCOc1cc([N+](=O)[O-])c(C(=O)Nc2ccc(-c3nc4c(Cl)cccc4[nH]3)cc2)cc1OC 524236122 YUQSCCQKAZFWAM-UHFFFAOYSA-N 496.907 5.078 5 20 JKBD Cc1c(NC(=O)c2ccc(NCc3ccccc3)c([N+](=O)[O-])c2)cccc1-c1nnc2n1CCCCC2 524324723 UWKSFYCRPSFNCB-UHFFFAOYSA-N 496.571 5.753 5 20 JKBD COc1ccccc1OCCNC(=O)C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1 603468506 FMVSFZYUUXPADB-KNTRCKAVSA-N 489.553 5.339 5 20 JKBD C[C@H](N[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1)c1cccc(C(F)(F)F)c1 603744360 OPARBDYHBPOJPI-LHSJRXKWSA-N 477.870 6.298 5 20 JKBD COc1cc(NC(=O)c2cc([N+](=O)[O-])ccc2Sc2ccc(Cl)cc2)ccc1NC(C)=O 603774961 CYBWNKJLVYQMCQ-UHFFFAOYSA-N 471.922 5.619 5 20 JKBD COc1ccc(Oc2ccc([N+](=O)[O-])cc2C(=O)Nc2ccc(Sc3nncs3)cc2)cc1 604118646 BODJPZJIQNANHA-UHFFFAOYSA-N 480.527 5.651 5 20 JKBD COc1ccc(CNC(=O)c2ccc(N[C@@H](C)c3ccccn3)c([N+](=O)[O-])c2)c(C(F)(F)F)c1 608807527 OLVIWLFSDGKHRK-AWEZNQCLSA-N 474.439 5.120 5 20 JKBD Cc1ccc(NC(=O)c2ccc(N3CCC(C(=O)Nc4cccc(F)c4)CC3)c([N+](=O)[O-])c2)cc1 608973495 JLOBRRZRZVOQDF-UHFFFAOYSA-N 476.508 5.150 5 20 JKBD CC(C)c1noc2nc(-c3ccco3)cc(C(=O)Nc3cc([N+](=O)[O-])ccc3OC(F)F)c12 609020198 GRQXHZBKYAPMLY-UHFFFAOYSA-N 458.377 5.368 5 20 JKBD C[C@@H](CC(=O)Nc1cc(Cl)c([N+](=O)[O-])cc1OCc1ccccc1)NC(=O)C1CCCCC1 727298018 QKCXIDABDVNDCM-INIZCTEOSA-N 473.957 5.241 5 20 JKBD O=C(Cn1c2ccccc2c(=O)c2ccccc21)N1CCC[C@H]1c1ccccc1C(F)(F)F 728034823 HCGBZCNTOQXDAT-NRFANRHFSA-N 450.460 5.537 5 20 JKBD O=C(Nc1ccc(F)cc1-c1ccc(Cl)cc1)c1cc([N+](=O)[O-])ccc1I 728484945 PQYKGJULTAGRAM-UHFFFAOYSA-N 496.663 5.911 5 20 JKBD O=C(COC(=O)c1csc(-c2cccc([N+](=O)[O-])c2)n1)c1ccc(OCc2ccccc2)cc1 730602151 HRJNNLVKHLYXIR-UHFFFAOYSA-N 474.494 5.337 5 20 JKBD CC(C)(C)c1ccc([C@@H]2CCCN2C(=O)COC(=O)c2csc(-c3cccc([N+](=O)[O-])c3)n2)cc1 747955537 INXMXEOARPURID-QFIPXVFZSA-N 493.585 5.536 5 20 JKBD CCc1cc[n+](/C(C(=S)Nc2ccc3c(c2)CCC3)=C(/O)c2ccc(C)c([N+](=O)[O-])c2)cc1 920395235 INHNUJYFFQNFIS-UHFFFAOYSA-O 460.579 5.565 5 20 JKBD O=C(CCc1cccc([N+](=O)[O-])c1)Nc1ccc(C2(NC(=O)c3cc4sccn4c3)CCC2)cc1 1786600076 IIPGDJFMZGWOCG-UHFFFAOYSA-N 488.569 5.290 5 20 JKBD Cc1cc(O)c([N+](=O)[O-])cc1C(=O)NC1(c2ccc(NC(=O)c3cc4ccccc4o3)cc2)CCC1 1789004422 HFCNEJWAUYQIQK-UHFFFAOYSA-N 485.496 5.417 5 20 JKBD O=C(/C=C/c1cc2ccccc2o1)Nc1ccc(C2(NC(=O)c3ccc(O)c([N+](=O)[O-])c3)CCC2)cc1 1789116114 HAOINFUSXTWXTE-ACCUITESSA-N 497.507 5.508 5 20 JKBD COc1ccc(C(=O)Nc2ccc(C3(NC(=O)CSc4ccccc4[N+](=O)[O-])CCC3)cc2)cc1 1790302338 SSNICUAWDKLIRR-UHFFFAOYSA-N 491.569 5.143 5 20 JKBD Cc1ccc(CC(=O)NC2(c3ccc(NC(=O)c4cc(Cl)cc([N+](=O)[O-])c4C)cc3)CCC2)o1 1790773527 AFRAJOGSLGXCDL-UHFFFAOYSA-N 481.936 5.448 5 20 JKBD Cc1cc(CC(=O)NC2(c3ccc(NC(=O)c4cc5cc([N+](=O)[O-])ccc5s4)cc3)CCC2)no1 1791009858 ARFPWVVQQVKLKD-UHFFFAOYSA-N 490.541 5.096 5 20 JKBD Cc1cscc1C(=O)N1CCCC[C@H]1c1cc(NC(=O)C2(c3cccc([N+](=O)[O-])c3)CCC2)n[nH]1 1820840303 BJLNFGKZNPGFHC-NRFANRHFSA-N 493.589 5.116 5 20 JKBD C/C(=C\c1cccs1)C(=O)N1CCCC[C@H]1c1cc(NC(=O)Cc2ccc(C)c([N+](=O)[O-])c2)n[nH]1 1820916200 MRHPNTRFXJSIFA-RKCQOLGWSA-N 493.589 5.026 5 20 JKBD O=C(Nc1cc([C@@H]2CCCCN2C(=O)/C=C/c2ccccc2[N+](=O)[O-])[nH]n1)c1ccc(C2CC2)cc1 1821307384 PRGMDIDMGOLXFS-ZXYASIKESA-N 485.544 5.215 5 20 JKBD Cc1ccc(C(=O)N2CCCC[C@H]2C2CCN(C(=O)c3cc(F)cc([N+](=O)[O-])c3)CC2)cc1Cl 1823910255 KROYTEFVTFEHAQ-QHCPKHFHSA-N 487.959 5.243 5 20 JKBD O=C(/C=C/c1ccccc1[N+](=O)[O-])N1CCC([C@H]2CCCCN2C(=O)/C=C/c2cccs2)CC1 1827079850 LHNVUQSIPBVBBC-GQNLSCDNSA-N 479.602 5.003 5 20 JKBD O=C(c1cc(Cl)ccc1F)N1CCC([C@@H]2CCCCN2C(=O)c2ccc([N+](=O)[O-])cc2F)CC1 1830492919 QJTVSCZNJVCRDW-QFIPXVFZSA-N 491.922 5.074 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)N1CCC([C@@H]2CCCCN2C(=O)[C@H](C)c2cccs2)CC1 1832144937 DRCJBOFFCXHPIU-UTKZUKDTSA-N 487.597 5.141 5 20 JKBD O=C(c1ccc(Cl)cc1)N1CCC([C@@H]2CCCCN2C(=O)/C=C/c2ccccc2[N+](=O)[O-])CC1 1832903957 JBFJNUGBYASEKA-YYVWFHOOSA-N 481.980 5.195 5 20 JKBD C[C@H](OC(=O)c1ccc(COc2ccccc2)cc1)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl 9480557 ZWGWJPRYWXCHNU-HNNXBMFYSA-N 454.866 5.011 5 20 JKBD C[C@@H](Sc1nc(C2CC2)nn1-c1ccccc1)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 10202027 VFDBEKLNKAXLRO-GFCCVEGCSA-N 477.468 5.191 5 20 JKBD O=C(COC(=O)CCc1ccc(-c2ccccc2F)o1)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 16320302 RAPARUXWMOHNTE-UHFFFAOYSA-N 480.370 5.127 5 20 JKBD CCn1c(SCC(=O)Nc2c(C)cccc2[N+](=O)[O-])nnc1-c1ccc(C(C)(C)C)cc1 23554483 NSUWGWWRPFHMPO-UHFFFAOYSA-N 453.568 5.210 5 20 JKBD COc1ccc([N+](=O)[O-])cc1NC(=O)[C@H](C)OC(=O)c1ccc(CSc2ccccc2)cc1 23876833 CCFTWJXUMLAICZ-INIZCTEOSA-N 466.515 5.080 5 20 JKBD Cc1c(NC(=O)[C@H](C)Sc2nc3cc(Cl)ccc3c(=O)n2Cc2ccco2)cccc1[N+](=O)[O-] 24016436 RTPFBXJOPAXYEK-AWEZNQCLSA-N 498.948 5.027 5 20 JKBD Cc1c(Cl)cccc1-n1c(SCCC(=O)Nc2ccc([N+](=O)[O-])cc2)nnc1-c1ccncc1 26361941 FWWQIWVYUSISBM-UHFFFAOYSA-N 494.964 5.320 5 20 JKBD COc1ccc([N+](=O)[O-])cc1NC(=O)CCSc1nnc(-c2ccc(C(C)(C)C)cc2)o1 26409138 MXDXKEQTEUHQMD-UHFFFAOYSA-N 456.524 5.072 5 20 JKBD COc1cccc(NCc2nnc(SCc3cccc([N+](=O)[O-])c3C)n2C2CCCCC2)c1 59124247 PGOWHOVHDXAGGE-UHFFFAOYSA-N 467.595 5.913 5 20 JKBD CC(C)Oc1ccc(CNC(=O)Cn2c3ccccc3c(=O)c3ccccc32)c(C(F)(F)F)c1 72081385 ZWLJMXKHMIXWPD-UHFFFAOYSA-N 468.475 5.277 5 20 JKBD O=C(Nc1cc(F)cc(N2CCOCC2)c1)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1 216418579 PUBMFUQNCGNNSV-UHFFFAOYSA-N 471.872 5.269 5 20 JKBD CCOc1cc(C(=O)Nc2cc(C(F)(F)F)ccc2N2CCCCC2)c([N+](=O)[O-])cc1OC 248129805 JGAIAEGHCHUXSB-UHFFFAOYSA-N 467.444 5.264 5 20 JKBD CC[C@@H](C)Sc1ccc(NC(=O)c2ccc(N3CCCC3)c([N+](=O)[O-])c2)c(C(F)(F)F)c1 303047895 UPZSQFOUWINGQX-CQSZACIVSA-N 467.513 6.357 5 20 JKBD C[C@H](NC(=O)c1ccc(N[C@H](C)c2ccccn2)c([N+](=O)[O-])c1)c1nc(-c2ccccc2)cs1 410288343 KTZIVODFDIHUBG-SJORKVTESA-N 473.558 5.777 5 20 JKBD O=C(C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)N1CCCCC[C@H]1c1ccncc1 479304848 SUNFQZJUXXJXMK-DMUXHOQQSA-N 498.608 6.674 5 20 JKBD COc1cc([C@@H](C)NC(=O)c2cc([N+](=O)[O-])ccc2Sc2ccccc2)cc(OC)c1OC 482622899 GGTMRWBGDOMTHV-OAHLLOKOSA-N 468.531 5.263 5 20 JKBD O=C(Nc1cccc(S(=O)(=O)Nc2ccccc2Cl)c1)c1cc2cc([N+](=O)[O-])ccc2o1 492927574 IRTHACFHUJUYMC-UHFFFAOYSA-N 471.878 5.048 5 20 JKBD O=C(Cn1c2ccccc2c(=O)c2ccccc21)Nc1ccc(-c2nc3c(F)cccc3[nH]2)cc1 502563913 SQIHHFGQKGSHAF-UHFFFAOYSA-N 462.484 5.476 5 20 JKBD CCCN(C(=O)c1nn(-c2ccccc2[N+](=O)[O-])c(C)cc1=O)[C@@H](C)c1ccc(Cl)c(Cl)c1 502829860 OHVASQOJMNBCML-HNNXBMFYSA-N 489.359 5.369 5 20 JKBD Cc1ccc(NS(=O)(=O)c2ccc(N[C@H](c3ccccc3)c3nccs3)c([N+](=O)[O-])c2)c(C)c1 505570923 RHWNDAFMTAIZNO-HSZRJFAPSA-N 494.598 5.670 5 20 JKBD COc1ccc([N+](=O)[O-])cc1NC(=O)[C@@H]1C[C@H]2CCCC[C@@H]2N1C(=O)c1ccc2ccccc2c1 508778691 NOMNBYJYFKOQKD-YGOYIFOWSA-N 473.529 5.169 5 20 JKBD Cc1cc(NC(=O)c2cc(OCC(F)(F)F)ccc2[N+](=O)[O-])n(-c2ccccc2C(F)(F)F)n1 514431894 QEXPHJVROFHTKY-UHFFFAOYSA-N 488.344 5.301 5 20 JKBD O=C(C1CCC(NCc2ccc(Oc3ccccc3Cl)c([N+](=O)[O-])c2)CC1)N1CCSCC1 518277885 AQFNJVAFXLEXPN-UHFFFAOYSA-N 490.025 5.264 5 20 JKBD O=C(NCc1cccc(Cn2ccnc2)c1)c1cc([N+](=O)[O-])ccc1Sc1ccc(Cl)cc1 603626351 JKFXRRJQAOFPQM-UHFFFAOYSA-N 478.961 5.574 5 20 JKBD CCN(Cc1ccc(OCc2cccs2)c(OC)c1)C(=O)Nc1cccc([N+](=O)[O-])c1C 603645947 NACYNUFDUAGIGH-UHFFFAOYSA-N 455.536 5.606 5 20 JKBD CCCCCNC(=O)C1CCN(C(=O)c2cc([N+](=O)[O-])ccc2Sc2ccc(Cl)cc2)CC1 603890513 YTNUUNSWYCMCMR-UHFFFAOYSA-N 490.025 5.558 5 20 JKBD CCCc1ccc([C@@H](NC(=O)C(=O)Nc2cc([N+](=O)[O-])ccc2OC(F)F)c2cccs2)cc1 604140732 XHYMNWYNTMWDBY-HXUWFJFHSA-N 489.500 5.055 5 20 JKBD COc1cc(C(=O)Nc2ccc(N(C)C(C)=O)cc2)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 604478978 PQDRNWGTDSZQRO-UHFFFAOYSA-N 469.881 5.284 5 20 JKBD O=C(C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)N1CCC[C@H]1CN1CCCC1 608813895 FMKVLUREOLRFKT-YEMUAQJGSA-N 476.602 5.222 5 20 JKBD C[C@H]1CCCN(c2ccc(C(=O)N3CCC([C@@H]4C(=O)Nc5cc(Cl)ccc54)CC3)cc2[N+](=O)[O-])C1 608971104 IGQFRTNXLXZQPP-FYSMJZIKSA-N 496.995 5.073 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)Nc2ccccc2C(=O)N[C@H](C)c2ccccc2)cc1SC 728458477 MOBFNPHAXVWCRT-OAHLLOKOSA-N 465.531 5.069 5 20 JKBD CC1=C(C(=O)Nc2ccccc2C)[C@H](c2ccc(-c3ccc([N+](=O)[O-])cc3)s2)NC(=S)N1 818328960 IQTQQARMAZNPMQ-NRFANRHFSA-N 464.572 5.063 5 20 JKBD COc1ccc(NC(=O)COC(=O)c2sc3cc(C(F)(F)F)ccc3c2Cl)c([N+](=O)[O-])c1 914963252 BYXHBANDHKSCBV-UHFFFAOYSA-N 488.827 5.286 5 20 JKBD O=C(Nc1nc2c(C(F)(F)F)cccc2s1)c1cc([N+](=O)[O-])ccc1I 915277553 RSHIDIFTZIQEFI-UHFFFAOYSA-N 493.204 5.080 5 20 JKBD O=C(Nc1ccc(NC(=O)c2cc([N+](=O)[O-])cc([N+](=O)[O-])c2)c(C(F)(F)F)c1)c1ccc(F)cc1 915869361 DVLOYIFRQLTCRA-UHFFFAOYSA-N 492.341 5.166 5 20 JKBD O=C(Cc1ccc([N+](=O)[O-])cc1F)Nc1ccc(C2(NC(=O)[C@@]3(F)CCCC=C3F)CCC2)cc1 1791185656 DBPFHFRFMJEMEC-RUZDIDTESA-N 487.478 5.156 5 20 JKBD COc1cc(C(=O)Nc2ccc(C3(NC(=O)c4cc5[nH]ccc5s4)CCC3)cc2)ccc1[N+](=O)[O-] 1792164457 GOMPXPNQWJNDGP-UHFFFAOYSA-N 490.541 5.208 5 20 JKBD Cc1cccc(Cl)c1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(Cl)cc([N+](=O)[O-])c1C 1800712867 KSKXZYCUQXGUPZ-BJWYYQGGSA-N 476.360 5.084 5 20 JKBD O=C(Nc1cc([C@@H]2CCCCN2C(=O)Cc2cccc([N+](=O)[O-])c2)[nH]n1)[C@@H]1CCC[C@@H]2CCCC[C@@H]21 1818927381 UTSQDMYCKYTKDY-KZDDHRSZSA-N 493.608 5.159 5 20 JKBD CC1(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)c3cc4cc([N+](=O)[O-])ccc4s3)n[nH]2)CCC1 1821610906 JRMJPFFBACXLKW-QGZVFWFLSA-N 467.551 5.029 5 20 JKBD CC1(C)CCC(CC(=O)N2CCCC[C@H]2C2CCN(C(=O)c3ccc([N+](=O)[O-])cc3F)CC2)CC1 1830423876 ZRLACXKLLCRTHY-DEOSSOPVSA-N 487.616 5.574 5 20 JKBD C[C@@H](Sc1nnc(-c2cccs2)n1-c1ccccc1)C(=O)Nc1ccc([N+](=O)[O-])cc1 11209777 ZJYHDXYYGPNMFL-CQSZACIVSA-N 451.533 5.023 5 20 JKBD CCc1ccc(N(C(C)=O)c2nc(COC(=O)c3cc(SC)ccc3[N+](=O)[O-])cs2)cc1 16196858 PMENKHIWXQWLIQ-UHFFFAOYSA-N 471.560 5.377 5 20 JKBD C[C@H](OC(=O)[C@H](C)Sc1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccc(Cl)cc1C(F)(F)F 17048802 AIJNLFRUORNYLL-QWRGUYRKSA-N 476.860 5.318 5 20 JKBD Cc1nn(Cc2ccc(C(=O)OCC(=O)Nc3c(C(C)C)cccc3C(C)C)cc2)c(C)c1[N+](=O)[O-] 17158352 GOIMUXXJYDKSDR-UHFFFAOYSA-N 492.576 5.499 5 20 JKBD Cc1cccc([N+](=O)[O-])c1NC(=O)CSc1nc2scc(C3CC3)c2c(=O)n1-c1ccccc1 23587069 ADJKEILTOIPZBW-UHFFFAOYSA-N 492.582 5.272 5 20 JKBD C[C@@H](Nc1ccc(C(=O)Nc2ccc(SCc3cccnc3)cc2)cc1[N+](=O)[O-])c1ccccn1 302961307 GMYUEMHLRJDLLN-GOSISDBHSA-N 485.569 6.103 5 20 JKBD C[C@@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)N[C@@H](Cn1cnc2ccccc21)c1ccc(F)cc1 484051114 WMAUVJZGKRWVQB-ZHRRBRCNSA-N 464.522 5.122 5 20 JKBD COc1ccc2ccccc2c1CN[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1 493476839 DVWVTBVRZMDQOP-VWLOTQADSA-N 475.932 5.880 5 20 JKBD Cc1ccc(C)n1C1CCN(C(=O)C2CCN(c3ccc(C(F)(F)F)cc3[N+](=O)[O-])CC2)CC1 499022219 OUAQSSBVLAPZNN-UHFFFAOYSA-N 478.515 5.112 5 20 JKBD COc1ccc(NC(=O)c2ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])c(OC)c2)c(C(F)(F)F)c1 500757262 HAZXNSGUDNCLTH-UHFFFAOYSA-N 496.825 6.329 5 20 JKBD CC[C@H](C)Sc1ccc(NC(=O)C(=O)N(C)Cc2ccccc2[N+](=O)[O-])c(C(F)(F)F)c1 501240510 VWZLEAYSGMDZPE-ZDUSSCGKSA-N 469.485 5.101 5 20 JKBD CCOc1cc(C(=O)Nc2ccc(Cl)cc2C(=O)N2[C@@H](C)CCC[C@@H]2C)c([N+](=O)[O-])cc1OC 508283946 CZIDSOISJYJZHG-GJZGRUSLSA-N 489.956 5.311 5 20 JKBD COc1cc(CNC2CCN(Cc3ccc(F)cc3)CC2)c([N+](=O)[O-])cc1OCc1ccccc1 509594634 VKDMMODCOIFXIC-UHFFFAOYSA-N 479.552 5.076 5 20 JKBD COc1cc(C(=O)Nc2ccc3c(c2)OC2(CCCCC2)O3)c([N+](=O)[O-])cc1OCc1cscn1 509862887 IACALPJGULRMPO-UHFFFAOYSA-N 497.529 5.323 5 20 JKBD C[C@H](NC(=O)CSc1nnc(-c2ccc(F)cc2)n1-c1ccc(F)cc1)c1cccc([N+](=O)[O-])c1 517413370 RZRVHZGLGUQAQJ-HNNXBMFYSA-N 495.511 5.090 5 20 JKBD Cn1c([C@@H](NCc2ccc(-c3ccccc3[N+](=O)[O-])s2)c2ccccc2)nc2ccccc21 517549362 LRLVAOSVFXLMOQ-VWLOTQADSA-N 454.555 6.089 5 20 JKBD O=[N+]([O-])c1ccc(-c2ccc(CNCc3cc(Cl)c4c(c3)OCCO4)o2)c(Br)c1 517549944 FGIKOHKWKWTJAK-UHFFFAOYSA-N 479.714 5.332 5 20 JKBD COCCN(C(=O)[C@H]1C[C@H]1c1ccc2ccccc2c1)c1nc(-c2ccc([N+](=O)[O-])cc2)cs1 518701606 UTWQJDAXUIQESM-GOTSBHOMSA-N 473.554 5.655 5 20 JKBD Cc1ccc(NC(=O)c2cccc(C(F)(F)F)c2)cc1NC(=O)COc1ccc([N+](=O)[O-])cc1 518889530 TUZYXQXHCYXRCM-UHFFFAOYSA-N 473.407 5.192 5 20 JKBD CO[C@H](C)C(=O)Nc1cccc(NC(=O)c2ccc(Sc3ccc(C)cc3)c([N+](=O)[O-])c2)c1 520449108 HJGDZTJDNUPCBF-MRXNPFEDSA-N 465.531 5.280 5 20 JKBD O=[N+]([O-])c1ccc(-c2ccc(CNCc3ccc(Oc4ccccc4)nc3)o2)c(Br)c1 520957591 LCIOEIMVNXLAHH-UHFFFAOYSA-N 480.318 6.094 5 20 JKBD Cc1ccc(Sc2ccc(C(=O)N(C)[C@H](C)c3ccc(S(C)(=O)=O)cc3)cc2[N+](=O)[O-])cc1 603458819 BXHDAQLBCPIVRK-QGZVFWFLSA-N 484.599 5.291 5 20 JKBD O=[N+]([O-])c1cc(S(=O)(=O)Nc2ccccc2)ccc1N1CCC[C@H]1c1nc2ccccc2s1 603473298 XDSQPXWGRPRBJK-FQEVSTJZSA-N 480.571 5.347 5 20 JKBD COc1cccc(/C=C(\CC(=O)N(C)Cc2ccccc2[N+](=O)[O-])c2nc3ccccc3s2)c1 603569097 OPHCTFMTYHSFCX-XSFVSMFZSA-N 473.554 5.802 5 20 JKBD C[C@@H](NC(=O)N[C@H](C)c1cccc([N+](=O)[O-])c1)c1ccc(NC(=O)c2ccc(F)cc2)cc1 604104519 OXNRZYIBPZDXJA-HZPDHXFCSA-N 450.470 5.108 5 20 JKBD COc1ccc([N+](=O)[O-])c(C(=O)Nc2ccccc2OCc2ncc(-c3cccc(Cl)c3)o2)c1 608850845 LYKLTFRPBKUVIN-UHFFFAOYSA-N 479.876 5.743 5 20 JKBD COc1ccc(NC(=S)/C(=C(/O)c2cccc([N+](=O)[O-])c2)[n+]2cccc(C)c2)cc1Cl 726962599 QNQYYMPUGKMXSC-UHFFFAOYSA-O 456.931 5.176 5 20 JKBD CCn1c(SCC(=O)OCc2c(F)cccc2[N+](=O)[O-])nnc1-c1ccc(Cl)cc1Cl 728986993 RHWVBZSXVQVGPE-UHFFFAOYSA-N 485.324 5.155 5 20 JKBD O=C(O[C@@H](c1ccc(Br)cc1)C(F)(F)F)c1csc(-c2cccc([N+](=O)[O-])c2)n1 731146176 PHAFNQVIHVQSTR-HNNXBMFYSA-N 487.253 5.941 5 20 JKBD CC(=O)c1cccc(O[C@H](C)C(=O)Nc2cc(Cl)c([N+](=O)[O-])cc2OCc2ccccc2)c1 745043098 NWONFFLRGQGTMW-MRXNPFEDSA-N 468.893 5.436 5 20 JKBD Cc1ccc(NC(=O)Nc2ccccc2)cc1NS(=O)(=O)c1cc(Cl)ccc1[N+](=O)[O-] 751269125 KIPNMHBSPNFDCA-UHFFFAOYSA-N 460.899 5.001 5 20 JKBD O=[N+]([O-])c1ccc2nc(SCc3nc(O)c4c(-c5ccccc5Cl)csc4n3)sc2c1 788010050 QUKGIRLSHRNUER-UHFFFAOYSA-N 486.987 6.528 5 20 JKBD O=C(Nc1nc2ccc(SC(F)F)cc2s1)C1CCN(c2ccccc2[N+](=O)[O-])CC1 855611488 NXHHTDLCNUAKHW-UHFFFAOYSA-N 464.519 5.374 5 20 JKBD Cc1nn(Cc2ccc(-c3nc(-c4cccc(NC(=O)OC(C)(C)C)c4)no3)cc2)c(C)c1[N+](=O)[O-] 904632447 RXZDSOZVQVVJSZ-UHFFFAOYSA-N 490.520 5.520 5 20 JKBD Cc1cc([C@H](C)NC(=O)c2ccccc2NC(=O)c2ccc([N+](=O)[O-])cc2Cl)c(C)s1 914762305 OKYYUAKGZANKAY-ZDUSSCGKSA-N 457.939 5.670 5 20 JKBD Cc1nn(Cc2ccc(C(=O)OCc3cc(Cl)cc4cccnc34)cc2)c(C)c1[N+](=O)[O-] 914897234 FKZBHTNUFRHJFD-UHFFFAOYSA-N 450.882 5.015 5 20 JKBD CCCc1cc[n+](/C(C(=S)Nc2ccc(Cl)cc2)=C(/O)c2cccc([N+](=O)[O-])c2)cc1 916204555 ZHXOQYOGJTYGRA-UHFFFAOYSA-O 454.959 5.812 5 20 JKBD COc1c([N+](=O)[O-])cc(N[C@@H](C)c2cccc(OC(C)C)c2)c([N+](=O)[O-])c1Br 917073843 DALXTLMJWOCQOH-NSHDSACASA-N 454.277 5.234 5 20 JKBD CCOC(=O)/C(=C/c1ccc(-c2ccc(OC)cc2[N+](=O)[O-])o1)c1nccn1Cc1ccccc1 920068155 KMULXKXVCUYJOQ-PXLXIMEGSA-N 473.485 5.212 5 20 JKBD C[C@H](OC(=O)c1ccc(N[C@@H](C)c2ccccn2)c([N+](=O)[O-])c1)C(=O)N1CCC[C@@H]1c1cccs1 920546446 YHIBSQLNDBVVND-XGHQBKJUSA-N 494.573 5.133 5 20 JKBD Cc1ccc(C)c2c(C)c(C(=O)O[C@@H](C)C(=O)Nc3ccc([N+](=O)[O-])cc3C(F)(F)F)oc12 920649136 BIECUNWBHXCSNU-ZDUSSCGKSA-N 464.396 5.469 5 20 JKBD C[C@H](Nc1ccc(C(=O)O[C@@H](c2ccccc2)c2ccccn2)cc1[N+](=O)[O-])c1ccccn1 920771117 LPEJULXHGOVAGE-BVZFJXPGSA-N 454.486 5.504 5 20 JKBD Cc1ccc(C(=O)Nc2cccc(C(F)(F)F)c2)cc1NS(=O)(=O)c1cc(F)ccc1[N+](=O)[O-] 920834452 DARDZKVNOOQYGP-UHFFFAOYSA-N 497.426 5.114 5 20 JKBD O=C(NC1(c2ccc(NC(=O)c3cc(-c4ccccc4)on3)cc2)CCC1)c1cc(O)cc([N+](=O)[O-])c1 1785785622 XLMYFKOBBJBWQD-UHFFFAOYSA-N 498.495 5.017 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)C3(c4cccc([N+](=O)[O-])c4)CCC3)CCC2)cc1)[C@@H]1CCC(F)(F)C1 1785804426 JOGHJCJKAVQEAS-GOSISDBHSA-N 497.542 5.586 5 20 JKBD Cc1cc(C(=O)NC2(c3ccc(NC(=O)Cc4ccc(Cl)cc4[N+](=O)[O-])cc3)CCC2)c(C)n1C 1786115638 BUTCCIWMYDYLAZ-UHFFFAOYSA-N 494.979 5.194 5 20 JKBD O=C(/C=C/c1ccc([N+](=O)[O-])o1)Nc1ccc(C2(NC(=O)c3cccc4ccoc34)CCC2)cc1 1786207988 XQKVZSSDIKPHEO-PKNBQFBNSA-N 471.469 5.395 5 20 JKBD O=C(CC1CCC1)Nc1ccc(C2(NC(=O)c3cc(Br)ccc3[N+](=O)[O-])CCC2)cc1 1792272693 YSRFZOKDWLHICV-UHFFFAOYSA-N 486.366 5.295 5 20 JKBD CCC[C@H]1CC[C@H](C(=O)N2CC[C@H](CNC(=O)c3cccc(F)c3[N+](=O)[O-])[C@@H]2c2cccnc2)CC1 1811322512 FOSXPTDPAXHTJU-ZRXZBVFWSA-N 496.583 5.055 5 20 JKBD Cc1c(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)c3cccc(F)c3[N+](=O)[O-])n[nH]2)oc2ccccc12 1821169453 HXTRFUCCUXFBCE-LJQANCHMSA-N 491.479 5.131 5 20 JKBD Cc1c(C(=O)Nc2cc([C@H]3CCCCN3C(=O)CCC(C)C)[nH]n2)cc(Cl)cc1[N+](=O)[O-] 1821292174 BGRBDWQILKTAMA-GOSISDBHSA-N 461.950 5.022 5 20 JKBD Cc1c(C(=O)N2CCC([C@@H]3CCCCN3C(=O)[C@H]3CCC(F)(F)C3)CC2)cc(Cl)cc1[N+](=O)[O-] 1823695443 IVZHMNUFMJZTNR-PXNSSMCTSA-N 497.970 5.225 5 20 JKBD O=C(CCc1ccccc1)N1CCC([C@@H]2CCCCN2C(=O)Cc2ccc(Cl)cc2[N+](=O)[O-])CC1 1824162380 XEGZXCCLONFDCS-DEOSSOPVSA-N 498.023 5.043 5 20 JKBD CCCOc1ccc(C(=O)N2CCCC[C@H]2C2CCN(C(=O)c3cccc(F)c3[N+](=O)[O-])CC2)cc1 1830102192 AWAPOXFEKWFJKN-DEOSSOPVSA-N 497.567 5.070 5 20 JKBD O=C(c1ccc(Cl)cc1F)N1CCC([C@H]2CCCCN2C(=O)c2cccc(F)c2[N+](=O)[O-])CC1 1830615867 AIGAOAKWXJFWMJ-OAQYLSRUSA-N 491.922 5.074 5 20 JKBD O=C(CCc1ccc[nH]1)N1CCC([C@H]2CCCCN2C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)CC1 1831061404 SDVLMRKZCSCNCS-JOCHJYFZSA-N 494.617 5.004 5 20 JKBD C[C@H](C(=O)N1CCC([C@@H]2CCCCN2C(=O)/C=C/c2ccccc2[N+](=O)[O-])CC1)c1cccs1 1832903420 BWBSFMRDSALGIS-PIYNUTBUSA-N 481.618 5.093 5 20 JKBD O=C(CCc1c[nH]c2ccccc12)O[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1 8649511 LPKLYHPBOLUQFI-XMMPIXPASA-N 477.904 5.585 5 20 JKBD CCn1c(S[C@@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2C(F)(F)F)nnc1-c1cccc(Cl)c1 9822370 MBNKVQMVEGXUGE-NSHDSACASA-N 499.902 5.665 5 20 JKBD C[C@H](OC(=O)c1ccc(Cl)c([N+](=O)[O-])c1)C(=O)Nc1c(Cl)cc(Cl)cc1Cl 11025338 BNBBYPHXWDLNAT-ZETCQYMHSA-N 452.077 5.392 5 20 JKBD COc1cc(/C=C(\Cl)c2nc3c(C)cccc3c(=O)[nH]2)ccc1OCc1ccc([N+](=O)[O-])cc1 18076475 RKYBOKRCWBAAHT-NDENLUEZSA-N 477.904 5.464 5 20 JKBD Cn1cnnc1Sc1ccc(C(=O)Nc2cc(Cl)c(Cl)cc2Cl)cc1[N+](=O)[O-] 26399275 AIGHIROYXKVDNQ-UHFFFAOYSA-N 458.714 5.087 5 20 JKBD COc1ccc(Cl)cc1CC(=O)Oc1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2Cl)cc1 29476350 QPOHYIIEFCPVRX-UHFFFAOYSA-N 475.284 5.311 5 20 JKBD COc1cc(C(=O)Nc2nc(-c3ccc(C(C)(C)C)cc3)cs2)c([N+](=O)[O-])cc1OC(F)F 45644358 JALIRSVOUCTWFI-UHFFFAOYSA-N 477.489 5.878 5 20 JKBD CC(C)N(C[C@@H](O)COc1cccc2ccccc12)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl 97529236 KFSITYPPPJRJAL-GOSISDBHSA-N 457.914 5.084 5 20 JKBD O=C(c1cc([N+](=O)[O-])ccc1Oc1ccccc1)N1CCC[C@@H](c2nc(-c3cccc(F)c3)no2)C1 110013786 LVMDKRBUCICWMU-GOSISDBHSA-N 488.475 5.596 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)Nc2nc(-c3ccc(Br)cc3)c(C)s2)cc1SC 112529961 LCNLOJAWUNKWHP-UHFFFAOYSA-N 494.392 5.772 5 20 JKBD COc1ccc(/C=C\C(=O)O[C@@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2ccccc2)cc1OC 215037891 ZYVOSXUBNNAUSJ-OXJALOGWSA-N 496.903 5.202 5 20 JKBD O=C(CSc1nc2ccccc2c(=O)n1C1CCCC1)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 255931389 ZKAPMCOPGGSVJK-UHFFFAOYSA-N 492.479 5.169 5 20 JKBD C[C@H](Nc1ccc(C(=O)N(C)[C@@H](c2ccccc2)C(F)(F)F)cc1[N+](=O)[O-])c1ccccn1 485353124 RHJBCNCPTMTFAR-BTYIYWSLSA-N 458.440 5.539 5 20 JKBD COc1cc(C(=O)Nc2ccc(OCc3ccccc3F)cc2)c([N+](=O)[O-])cc1OC(F)F 493601916 KXIQVKUMFFUMPY-UHFFFAOYSA-N 462.380 5.175 5 20 JKBD CCN(C(=O)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])c(OC)c1)c1ccc(OC)cc1 498920416 ZMDPFYQFEHKSQR-UHFFFAOYSA-N 456.882 5.724 5 20 JKBD O=C(Nc1ccc(-c2nc3c(F)cccc3[nH]2)cc1)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-] 502484341 GFJXXRLPJMIMCW-UHFFFAOYSA-N 474.370 5.471 5 20 JKBD COc1cc([C@@H](C)NC(=O)c2ccc(C(C)(C)C)c([N+](=O)[O-])c2)ccc1OCc1ccncc1 502697704 JALYPJCQFYYPAV-QGZVFWFLSA-N 463.534 5.366 5 20 JKBD COc1cc(C(=O)NCc2ccc(OC3CCCCC3)cc2)c([N+](=O)[O-])cc1OCc1cscn1 504938756 HZFOXVDLUYVLDQ-UHFFFAOYSA-N 497.573 5.280 5 20 JKBD C[C@H](Nc1ccc(C(=O)N(C)CCc2cccc3ccccc23)cc1[N+](=O)[O-])c1ccccn1 505104063 KHJQZMFZSAAEAC-IBGZPJMESA-N 454.530 5.631 5 20 JKBD Cc1ccc(NC(=O)c2ccc(N[C@@H](C)c3ccccn3)c([N+](=O)[O-])c2)c(Br)c1 506230304 BNBFHUQTSNOBID-AWEZNQCLSA-N 455.312 5.486 5 20 JKBD CC(C)N(C)C(=O)C1CCN(C(=O)c2cc([N+](=O)[O-])ccc2Sc2ccc(Cl)cc2)CC1 516317472 ZOWPLYGVKQGJBL-UHFFFAOYSA-N 475.998 5.118 5 20 JKBD COCCN(C(=O)[C@H](C)Sc1ccc(Cl)cc1)c1nc(-c2ccc([N+](=O)[O-])cc2)cs1 517303724 RUSVCHMAPVLFRH-AWEZNQCLSA-N 477.995 5.532 5 20 JKBD O=C(Nc1ccccc1OCc1ncc(-c2cccc(Cl)c2)o1)c1ccc([N+](=O)[O-])s1 524209380 SOEYRYIGNMAVRX-UHFFFAOYSA-N 455.879 5.796 5 20 JKBD O=C(CNC(=O)c1cccc([N+](=O)[O-])c1)Nc1ccc(Oc2ccnc3cc(Cl)ccc23)c(F)c1 524442638 VGZQTCMSUPJLQJ-UHFFFAOYSA-N 494.866 5.096 5 20 JKBD O=[N+]([O-])c1ccc(-c2ncn(C[C@@H](O)COC(c3ccc(Cl)cc3)c3ccc(Cl)cc3)n2)cc1 549192339 SWRKIGBNAASVOA-JOCHJYFZSA-N 499.354 5.327 5 20 JKBD CNC(=O)c1cccc(NC(=O)C/C(=C\c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)c1C 603624426 QQYCHLNSLAZCJJ-NBVRZTHBSA-N 486.553 5.442 5 20 JKBD COc1ccc(CSCC(=O)Nc2ccccc2Oc2ncc(Cl)cc2Cl)cc1[N+](=O)[O-] 603744278 BMIYARSIJLCKOK-UHFFFAOYSA-N 494.356 5.969 5 20 JKBD C[C@H](NC(=O)c1cc2cc([N+](=O)[O-])ccc2o1)c1cccc(NC(=O)Cc2ccccc2F)c1 603765032 UDERGGWYKCHIPA-HNNXBMFYSA-N 461.449 5.152 5 20 JKBD COc1ccc(C(=O)c2c(NC(=O)c3cc(OC)c(OC)cc3[N+](=O)[O-])sc3c2CCCC3)cc1 603820824 TXXGGEVRUGMXJS-UHFFFAOYSA-N 496.541 5.044 5 20 JKBD O=C(C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1)N1CCC(=Cc2cccc(F)c2)CC1 603928677 SYNJEXCOVMOFMY-UHFFFAOYSA-N 491.485 5.675 5 20 JKBD Cc1csc(Sc2ccc(C(=O)Nc3ccc(C(=O)N4CCCC[C@H]4C)cc3)cc2[N+](=O)[O-])n1 603993303 QTESKGSZDVHCHO-MRXNPFEDSA-N 496.614 5.778 5 20 JKBD CCOC(=O)c1cc(NC(=O)c2ccc(N[C@H](C)c3ccccn3)c([N+](=O)[O-])c2)ccc1Cl 604338880 HREWUDUELXRPHR-CQSZACIVSA-N 468.897 5.245 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Cl)[C@@H](N[C@@H]1CCc2c(Cl)cccc21)c1ccccc1 604403754 QBJZDAZTNBMOFJ-IRLDBZIGSA-N 456.329 5.859 5 20 JKBD CC1CCN(c2ccc(C(=O)Nc3cc(C(=O)N4CCCCC4)ccc3Cl)cc2[N+](=O)[O-])CC1 608873350 UWEBMUPSHVBENU-UHFFFAOYSA-N 484.984 5.363 5 20 JKBD Cc1nc(-c2ccccc2)sc1CNC(=O)c1ccc(N[C@H](C)c2ccccn2)c([N+](=O)[O-])c1 608954473 PEFOSLYTDKZYRP-MRXNPFEDSA-N 473.558 5.525 5 20 JKBD C[C@H](NC(=O)c1cccc([N+](=O)[O-])c1)C(=O)Nc1ccc(N[C@H](C)c2ccccc2)c(Cl)c1 609072004 CEJLXKBIOXEUDI-CVEARBPZSA-N 466.925 5.178 5 20 JKBD Cc1ccc(-c2nc(C)c([C@H](C)N[C@H](C)C(=O)Nc3ccc([N+](=O)[O-])cc3Cl)s2)cc1 609352749 BYOCCDYRRMHDOQ-DZGCQCFKSA-N 458.971 5.666 5 20 JKBD O=C(OCc1cc([N+](=O)[O-])cc2c1OCOC2)c1cc(-c2ccc(F)cc2)nc2onc(C3CC3)c12 727897851 FMKOCSCSKCMGRY-UHFFFAOYSA-N 491.431 5.038 5 20 JKBD Cc1noc2nc(-c3ccccc3)cc(C(=O)N(CC3CC3)c3ccc(Cl)c([N+](=O)[O-])c3)c12 745344939 QLOZUDSUMLULNM-UHFFFAOYSA-N 462.893 5.817 5 20 JKBD CC(C)[C@@H](OC(=O)c1csc(-c2ccc([N+](=O)[O-])cc2)n1)C(=O)Nc1ccccc1C(F)(F)F 747954899 NXPHZYYXLJFLIJ-GOSISDBHSA-N 493.463 5.557 5 20 JKBD O=C(Nc1ccc2c(c1)oc1ccccc12)c1ccc([N+](=O)[O-])cc1I 751083025 GULIOKULLHCCEM-UHFFFAOYSA-N 458.211 5.351 5 20 JKBD C[C@@H](OC(=O)c1cc2c(Cl)cccc2s1)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 825217981 FFJJZKSYNMMLSN-SECBINFHSA-N 472.828 5.666 5 20 JKBD CCC(C)(C)NC(=O)c1ccc(NCc2c(Br)cccc2[N+](=O)[O-])cc1Cl 864041080 IWMNBGIUNPNESM-UHFFFAOYSA-N 454.752 5.541 5 20 JKBD COc1ccc(Cl)cc1C(=O)N1CCC(C(=O)OCc2nc3ccccc3c3ccccc23)CC1 915004644 OCTKQTMCCKCDJD-UHFFFAOYSA-N 488.971 5.646 5 20 JKBD Cc1nn(Cc2ccccc2Cl)c(Cl)c1C(=O)Nc1cc([N+](=O)[O-])ccc1OC(F)F 915283028 BBECHVCEQVJAQU-UHFFFAOYSA-N 471.247 5.309 5 20 JKBD Cc1c(NC(=O)c2ccccc2)cccc1NC(=O)c1ccc(Br)c([N+](=O)[O-])c1 917790712 LEMWVYJWOSLVGS-UHFFFAOYSA-N 454.280 5.170 5 20 JKBD O=C(OCc1nnc(-c2ccc([N+](=O)[O-])cc2)o1)c1nn(-c2ccc(Cl)cc2)c2c1CCCCC2 919515600 YTPRSJFWPVGFHX-UHFFFAOYSA-N 493.907 5.110 5 20 JKBD Cc1ccccc1NC(=O)c1cc2ccccc2cc1OS(=O)(=O)c1ccc([N+](=O)[O-])s1 920041901 SGWICWJUYNLGEB-UHFFFAOYSA-N 468.512 5.138 5 20 JKBD Cc1ccc(C(=O)N(C)c2ccc(OC(=O)[C@H](C)Oc3ccc(Cl)cc3[N+](=O)[O-])cc2)cc1 920791688 CFKJVWHSYIGNOD-INIZCTEOSA-N 468.893 5.206 5 20 JKBD O=C(Cc1cc([N+](=O)[O-])ccc1F)NC1(c2ccc(NC(=O)[C@]3(F)CCCC=C3F)cc2)CCC1 1792374512 ZEAJBLJKULWPPL-VWLOTQADSA-N 487.478 5.156 5 20 JKBD O=C(/C=C/c1ccoc1)Nc1cc([C@@H]2CCCCN2C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)[nH]n1 1815751554 BOEVTVVUIZXZJL-QTWIXLPOSA-N 491.529 5.145 5 20 JKBD CCC[C@H]1CC[C@H](C(=O)Nc2cc([C@H]3CCCCN3C(=O)c3ccc([N+](=O)[O-])c(OC)c3)[nH]n2)CC1 1822100024 FMUUPNGXKVHJJM-DBXWQHBBSA-N 497.596 5.239 5 20 JKBD O=C(c1cc(F)cc([N+](=O)[O-])c1)N1CCC([C@@H]2CCCCN2C(=O)c2cc(Cl)ccc2F)CC1 1823939149 SXQGOVLIMGOUNC-QFIPXVFZSA-N 491.922 5.074 5 20 JKBD Cc1cc(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3cc(Cl)cc([N+](=O)[O-])c3C)CC2)cnc1C 1825393356 ANHRINNQALUQEU-HSZRJFAPSA-N 499.011 5.116 5 20 JKBD Cc1oc(C(C)(C)C)cc1C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cccc(F)c2[N+](=O)[O-])CC1 1825951441 QMTXVDSRYIBZGF-QFIPXVFZSA-N 499.583 5.480 5 20 JKBD CCCCC[C@@H](C)C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cc(N(C)C)ccc2[N+](=O)[O-])CC1 1829648246 GVWZOIVLQSJUTB-HYBUGGRVSA-N 486.657 5.111 5 20 JKBD CC(C)c1ccc(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)Cc3cccc([N+](=O)[O-])c3)CC2)cc1 1830055327 SNBIPGRQJFORLV-AREMUKBSSA-N 477.605 5.194 5 20 JKBD CC[C@@H](C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2ccc([N+](=O)[O-])cc2F)CC1)c1ccccc1 1830495822 WXJDKDXWNDTZED-RDGATRHJSA-N 481.568 5.161 5 20 JKBD Cc1ccc([C@H](C)C(=O)N2CCCC[C@H]2C2CCN(C(=O)Cc3ccc([N+](=O)[O-])cc3F)CC2)cc1 1831531609 YEOSZVKRJGRUNB-FNZWTVRRSA-N 495.595 5.008 5 20 JKBD CCCc1ccc(C(=O)N2CCC([C@H]3CCCCN3C(=O)c3ccc([N+](=O)[O-])c(OC)c3)CC2)cc1 1832695936 QCDISJACVUIZII-XMMPIXPASA-N 493.604 5.103 5 20 JKBD Cc1ccc(-c2cc(C(=O)OCc3cc([N+](=O)[O-])cc4c3OCOC4)c3cnn(C(C)C)c3n2)s1 11260746 DPIVVDMCCNNWLK-UHFFFAOYSA-N 494.529 5.181 5 20 JKBD O=C(CCSc1ccccc1F)Oc1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2Cl)cc1 15516132 HNZNMHGVBRZLRU-UHFFFAOYSA-N 474.897 5.727 5 20 JKBD COc1cc(C(=O)N[C@@H](C)c2ccc(-n3cncn3)cc2)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 18158146 OWBFZNSLVVHWHW-HNNXBMFYSA-N 493.907 5.121 5 20 JKBD CC(C)CC(=O)Nc1ccc(N[C@@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2C(F)(F)F)cc1 25496189 KHZYHMYSISJKIP-ZDUSSCGKSA-N 452.433 5.037 5 20 JKBD CNC(=O)c1ccc(C)c(NC(=O)c2ccc(Sc3nc4ccccc4s3)c([N+](=O)[O-])c2)c1 31919985 YVIMLROYIOAVBJ-UHFFFAOYSA-N 478.555 5.276 5 20 JKBD COc1ccc(/C=C2/N=C(SCc3cccc([N+](=O)[O-])c3)N(c3cccc(OC)c3)C2=O)cc1 107960354 JPKYIGSNFFROCF-OEAKJJBVSA-N 475.526 5.289 5 20 JKBD Cc1ccc(-c2nnco2)cc1NC(=O)C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1 483296785 ORMZSYIOIOXBAO-UNOMPAQXSA-N 497.536 6.132 5 20 JKBD Cn1cnnc1Sc1ccc(C(=O)N[C@@H](c2ccc(Cl)cc2)c2cccs2)cc1[N+](=O)[O-] 500774609 MVNPCTMTZCTGTC-IBGZPJMESA-N 485.978 5.109 5 20 JKBD O=C(Cc1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1)Nc1ccc(CN2CCCC2)cc1 507047806 LGWDILQWTNNJRX-UHFFFAOYSA-N 481.556 5.225 5 20 JKBD C[C@H](Nc1ccc(C(=O)N2CCC[C@@H]2c2cccc(Cl)c2)cc1[N+](=O)[O-])c1ccccn1 507407289 VAVWFSUTBLSGSQ-KSFYIVLOSA-N 450.926 5.794 5 20 JKBD COc1ccc(CN[C@@H](c2ccc(F)cc2)[C@H]2CCCO2)cc1OCc1ccc([N+](=O)[O-])cc1 507915903 WGTUNYINSMFSCJ-RSXGOPAZSA-N 466.509 5.331 5 20 JKBD O=C(c1c2c(nc3ccccc13)/C(=C\c1ccc([N+](=O)[O-])cc1)CCC2)N1CCCn2nccc21 509204677 VYVFFLIZWSIQAK-ZPHPHTNESA-N 465.513 5.267 5 20 JKBD CN(CCC(F)(F)F)C(=O)c1c2c(nc3ccccc13)/C(=C/c1cccc([N+](=O)[O-])c1)CCC2 511377598 KOBMUODWFXDKEP-SAPNQHFASA-N 469.463 6.044 5 20 JKBD C[C@@H](CC(=O)Nc1ncc(S(=O)(=O)c2ccc([N+](=O)[O-])cc2)s1)c1ccc(C(F)(F)F)cc1 512960961 FEKFJIOFAUBZKJ-LBPRGKRZSA-N 499.492 5.035 5 20 JKBD CCOc1cc(NC(=O)N2CCC(C(=O)c3ccc(Cl)cc3)CC2)c([N+](=O)[O-])cc1OCC 516078040 YZSDBPUEYOXSAF-UHFFFAOYSA-N 475.929 5.172 5 20 JKBD CS(=O)(=O)c1cc(C(=O)Nc2ccc(Oc3cc(Cl)ccc3Cl)c(F)c2)cc([N+](=O)[O-])c1 520968310 FXPJBSVKRWRIOU-UHFFFAOYSA-N 499.303 5.489 5 20 JKBD C[C@@H](Nc1ccc2c(c1)CCC(=O)N2Cc1ccc(Cl)cc1)C(=O)Nc1ccccc1[N+](=O)[O-] 521667218 NRMSUMKPKHPTAD-MRXNPFEDSA-N 478.936 5.167 5 20 JKBD Cc1ccc(/C=C\c2nc(S[C@@H](C)C(=O)Nc3nc(-c4cccc([N+](=O)[O-])c4)cs3)n[nH]2)o1 591374503 JHRDLIRTEUVMAE-YXVBKTCISA-N 482.547 5.028 5 20 JKBD O=C(c1cc(N2CCC[C@H]2c2ccc(F)c(C(F)(F)F)c2)ccc1[N+](=O)[O-])N1CCCC1 600850998 DUPRUPBTULRVOU-IBGZPJMESA-N 451.420 5.330 5 20 JKBD CCOC(=O)c1c(NC(=O)c2ccc([N+](=O)[O-])s2)sc(C(=O)Nc2ccc(C)cc2C)c1C 603466355 NFOWRJGLVGXWOS-UHFFFAOYSA-N 487.559 5.324 5 20 JKBD Cc1c(NC(=O)c2ccccc2)cccc1N[C@@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl 603954819 INNNRLJZKOQBBC-HNNXBMFYSA-N 452.898 5.248 5 20 JKBD O=C(C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)N1CCC[C@@H](c2cc[nH]n2)C1 608813094 AKWFLYXCUNCKJL-XWALVKJWSA-N 473.558 5.265 5 20 JKBD Cc1ccc(-c2nsc(NC(=O)c3ccc(N[C@H](C)c4ccccn4)c([N+](=O)[O-])c3)n2)s1 608944852 JOVTXMLVTHSYMV-CYBMUJFWSA-N 466.548 5.304 5 20 JKBD CCCCN1Cc2cccc(N[C@H](C)C(=O)Nc3ccc([N+](=O)[O-])cc3C(F)(F)F)c2C1 608981184 LLDDNPMOZBOZRT-CQSZACIVSA-N 450.461 5.168 5 20 JKBD COc1ccccc1[C@H]1CCCN1C(=O)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 609036850 RHDFGWZWZVPDDM-LJQANCHMSA-N 477.483 5.202 5 20 JKBD Cc1cc(OCc2cccc(Cl)c2)ccc1NC(=O)c1nnn(-c2cccc([N+](=O)[O-])c2)c1C 609062197 FHGWOWONJORNCB-UHFFFAOYSA-N 477.908 5.277 5 20 JKBD CC(C)c1nc(C(=O)O[C@@H](C(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)c2ccccc2)cs1 726689323 JXLDHCORLNYFQS-GOSISDBHSA-N 459.911 5.365 5 20 JKBD Cc1cccc(Cc2cnc(NC(=O)c3cc([N+](=O)[O-])ccc3Br)s2)c1Cl 751076988 MWOHEVSROKJKMO-UHFFFAOYSA-N 466.744 5.619 5 20 JKBD COc1ccc([N+](=O)[O-])cc1CN(CC(=O)Nc1ccc(Cl)cc1C(F)(F)F)C(C)C 764404871 QCVOERBTIJFKPG-UHFFFAOYSA-N 459.852 5.125 5 20 JKBD CC(C)N(Cc1nnc(-c2cccc([N+](=O)[O-])c2)o1)C(=O)c1cc2c(Cl)cccc2s1 864244840 QMIDKZBVRLSRAL-UHFFFAOYSA-N 456.911 5.564 5 20 JKBD CSc1ccc(C(=O)c2ccccc2C(=O)OCc2coc(-c3cccc(F)c3)n2)cc1[N+](=O)[O-] 914617392 WYJHHXJKHOXBHJ-UHFFFAOYSA-N 492.484 5.699 5 20 JKBD CC1CCN(c2ccc([N+](=O)[O-])cc2C(=O)Nc2ccc(F)c(NC(=O)Cc3ccccc3)c2)CC1 918645151 BUBLPGQTINOPAR-UHFFFAOYSA-N 490.535 5.404 5 20 JKBD COc1cc(C)ccc1Oc1ccc(F)cc1NC(=O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1C 920028677 KVEXYCUFSURJGT-UHFFFAOYSA-N 455.398 5.312 5 20 JKBD C[C@H](Nc1ccc(C(=O)OCC(=O)Nc2cc(Cl)ccc2Cl)cc1[N+](=O)[O-])c1ccccn1 920545719 IOXSHGIVDMSVBA-ZDUSSCGKSA-N 489.315 5.265 5 20 JKBD O=C(Cc1cc([N+](=O)[O-])ccc1F)Nc1ccc(C2(NC(=O)[C@H]3CCCCC3(F)F)CCC2)cc1 1786669957 NXVNVAZCLUZSEN-HXUWFJFHSA-N 489.494 5.236 5 20 JKBD O=C(Cc1ccc([N+](=O)[O-])cc1F)NC1(c2ccc(NC(=O)c3scnc3C3CC3)cc2)CCC1 1787185473 IICAPWQJOHCPAA-UHFFFAOYSA-N 494.548 5.058 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)[C@H]3C[C@H]3C3CC3)CCC2)cc1)c1cc(Br)ccc1[N+](=O)[O-] 1790663925 MNWHALXYSRURJT-OALUTQOASA-N 498.377 5.151 5 20 JKBD Cc1c(C(=O)Nc2ccc(C3(NC(=O)c4ccns4)CCC3)cc2)cc(Cl)cc1[N+](=O)[O-] 1790773795 IAWUBUIEUYWVHG-UHFFFAOYSA-N 470.938 5.075 5 20 JKBD O=C(C[C@@H]1C[C@@H]2CC[C@H]1C2)Nc1ccc(C2(NC(=O)c3ccc([N+](=O)[O-])cc3F)CCC2)cc1 1791323534 IVMPZSGCYXOFGB-SQNIBIBYSA-N 465.525 5.308 5 20 JKBD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(Cl)cc1)c1cc2cc([N+](=O)[O-])ccc2s1 1799678440 BTBYYDDWWLSIKG-BCDXTJNWSA-N 469.950 5.029 5 20 JKBD CC1(C)CCC(CC(=O)NC[C@H]2CCN(C(=O)c3cc(F)cc([N+](=O)[O-])c3)[C@@H]2c2cccnc2)CC1 1808902372 KPUXBKMXBCCWLV-CJFMBICVSA-N 496.583 5.055 5 20 JKBD C/C(=C\c1cccs1)C(=O)Nc1cc([C@H]2CCCCN2C(=O)Cc2ccc(C)c([N+](=O)[O-])c2)[nH]n1 1814413735 SUESKYOWMFXUAY-GUOCTKQSSA-N 493.589 5.026 5 20 JKBD CC1=CC[C@H](C(=O)N2CCCC[C@@H]2C2CCN(C(=O)CSc3ccccc3[N+](=O)[O-])CC2)CC1 1828352317 OMEKGGZGLWHMRT-FCHUYYIVSA-N 485.650 5.053 5 20 JKBD C[C@H](Sc1nnc(-c2ccco2)n1C1CCCCC1)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl 10014913 FFWYXLVUHNGIRK-ZDUSSCGKSA-N 475.958 5.724 5 20 JKBD CC(=O)N(c1ccc(Cl)c(Cl)c1)c1nc(COC(=O)c2ccc([N+](=O)[O-])cc2)cs1 10646827 CGZZGKKDDAJLIN-UHFFFAOYSA-N 466.302 5.400 5 20 JKBD O=C(O[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Br)c1ccccc1)c1ccc(F)c(F)c1 22430245 CFQWPSRMNDICMQ-LJQANCHMSA-N 491.244 5.172 5 20 JKBD CC(C)c1ccccc1NC(=O)COC(=O)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 24848456 QEMKJPYWAWHNIT-UHFFFAOYSA-N 493.482 5.135 5 20 JKBD CCN(Cc1cccc(NC(=O)c2cc([N+](=O)[O-])ccc2Sc2ccc(Cl)cc2)c1)C(C)=O 31591295 JPLBJJNDBVAWBX-UHFFFAOYSA-N 483.977 6.020 5 20 JKBD Cc1csc(Sc2ccc(NC(=O)c3ccc(N[C@H](C)c4ccccn4)c([N+](=O)[O-])c3)cc2)n1 108866277 XGOAKRMKCPLHSD-MRXNPFEDSA-N 491.598 6.331 5 20 JKBD COc1cccc([C@@H]2CCCN2C(=O)Cc2cn(-c3ccccc3)nc2-c2ccc([N+](=O)[O-])cc2)c1 248260166 VRONWNUQQFCYNC-SANMLTNESA-N 482.540 5.362 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)Nc2ccccc2-c2nc3ccccc3s2)cc1SC 481916169 FEKLBGSQHZDPMZ-UHFFFAOYSA-N 451.529 5.854 5 20 JKBD Cc1csc(Sc2ccc(C(=O)N[C@@H](c3ccccc3)c3ccncc3)cc2[N+](=O)[O-])n1 486767191 DOWNBRRVSQUVMB-NRFANRHFSA-N 462.556 5.425 5 20 JKBD CCN(C(=O)c1csc(-c2ccc([N+](=O)[O-])cc2)n1)[C@@H]1CCN([C@H](C)c2ccccc2)C1 501948588 PZLWZXAQOZVMLD-DYESRHJHSA-N 450.564 5.016 5 20 JKBD CCc1ccc(Cl)c(CC)c1NC(=O)c1ccc(N[C@@H](C)c2ccccn2)c([N+](=O)[O-])c1 506220565 QNGSOWVALNEHHH-HNNXBMFYSA-N 452.942 6.193 5 20 JKBD C[C@@H]1CN(Cc2ccccc2NC(=O)c2ccc(N[C@H](C)c3ccccn3)c([N+](=O)[O-])c2)C[C@@H](C)O1 508946655 AZSHQBBZQVUSDD-VAMGGRTRSA-N 489.576 5.024 5 20 JKBD C[C@H]1CCC[C@@H](OCc2cccc(NC(=O)c3ccc(Sc4nncn4C)c([N+](=O)[O-])c3)c2)C1 509024571 XFTRBPDCHIAYKK-OXJNMPFZSA-N 481.578 5.222 5 20 JKBD COc1cc(C(=O)Nc2cc(Br)cnc2O)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 517983704 NMGRLCXUQGQMJR-UHFFFAOYSA-N 494.685 5.165 5 20 JKBD CCN(C)Cc1cccc(CNCc2cn(-c3ccccc3)nc2-c2ccc([N+](=O)[O-])cc2)c1 520958697 AMDJLZOHJMNMTL-UHFFFAOYSA-N 455.562 5.189 5 20 JKBD CCN(c1ccccc1)S(=O)(=O)c1ccc(NCc2coc(-c3cccs3)n2)c([N+](=O)[O-])c1 521237028 ODAOOYDOZZNKCA-UHFFFAOYSA-N 484.559 5.139 5 20 JKBD O=C(C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)N1CCC[C@H]1c1cccs1 603451596 INCROFYZWZOPDA-RHYRFBSLSA-N 475.595 6.560 5 20 JKBD O=C(C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)N[C@H]1CCCc2nc(O)ccc21 603461322 SZIILQGPXJKVLA-UEBLJOKOSA-N 486.553 5.430 5 20 JKBD Cc1ccccc1CN(Cc1ccccc1)C(=O)c1ccc(Sc2nncn2C)c([N+](=O)[O-])c1 603531147 ZEPAJTLLDWAJOC-UHFFFAOYSA-N 473.558 5.026 5 20 JKBD CSc1ccc(C(=O)N[C@H](C)c2ccc(NC(=O)Nc3ccccc3)cc2)cc1[N+](=O)[O-] 603900401 GIUQYGAGVKTMIE-OAHLLOKOSA-N 450.520 5.452 5 20 JKBD O=C(c1cc(F)ccc1F)C1CCN(C(=O)c2cc([N+](=O)[O-])ccc2Oc2ccccc2)CC1 603905923 LWWCSNQZZVQRHJ-UHFFFAOYSA-N 466.440 5.400 5 20 JKBD C[C@@H](NC(=O)CSc1nnc(-c2ccccc2F)n1-c1ccc(F)cc1)c1cccc([N+](=O)[O-])c1 603965793 LOAQNBGHICCDBV-OAHLLOKOSA-N 495.511 5.090 5 20 JKBD COCCOc1cccc(NC(=O)c2ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])c(OC)c2)c1 603972712 BTNDJRFSOULANB-UHFFFAOYSA-N 472.881 5.327 5 20 JKBD O=C(C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)Nc1cccc2[nH]ccc12 608879849 BDDMOEWABDVDDB-VKAVYKQESA-N 454.511 6.255 5 20 JKBD Cc1ccc(NC(=O)c2ccc(NCC(=O)Nc3ccc(C)cc3Cl)c([N+](=O)[O-])c2)cc1 608974665 WDMSMGLGKIUFPF-UHFFFAOYSA-N 452.898 5.168 5 20 JKBD CC(C)(C)c1cc(NC(=O)CSc2ccc(C(F)(F)F)cc2[N+](=O)[O-])n(-c2ccccn2)n1 609151983 KIZOMAVIVXZXDJ-UHFFFAOYSA-N 479.484 5.223 5 20 JKBD COc1ccc(CC[C@@H]2CCCCN2C(=O)c2cc([N+](=O)[O-])ccc2Br)cc1OC 726150358 KLZSZCHXDXDRBZ-INIZCTEOSA-N 477.355 5.002 5 20 JKBD CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccc(-c2nnc3n2CCCCCC3)cc1 729033983 ZELDKILGUKRMEF-UHFFFAOYSA-N 462.554 5.412 5 20 JKBD O=C(COC(=O)c1csc(-c2ccc(Cl)c(Cl)c2)n1)Nc1ccc([N+](=O)[O-])cc1Cl 744605306 RTNGFFNYZGAMBO-UHFFFAOYSA-N 486.720 5.474 5 20 JKBD O=C(Nc1ccccc1)c1ccc(COC(=O)c2csc(-c3cccc([N+](=O)[O-])c3)n2)cc1 747960773 BNCXKUMQUHKESE-UHFFFAOYSA-N 459.483 5.328 5 20 JKBD C[C@H](OC(=O)c1csc(-c2cccc([N+](=O)[O-])c2)n1)C(=O)N[C@H](C)c1ccc2ccccc2c1 747963735 ZPOGVCKZOVWFGR-CVEARBPZSA-N 475.526 5.294 5 20 JKBD CC(C)(C)OC(=O)Nc1ccc(F)c(NC(=O)c2cc([N+](=O)[O-])ccc2Br)c1 751078809 AKSUNXWDGFCYDC-UHFFFAOYSA-N 454.252 5.096 5 20 JKBD COc1ccc(-c2cc3[nH]c(/C(Cl)=C/c4cc(OC)c(O)c([N+](=O)[O-])c4)nc(=O)c3s2)cc1 797250546 YFNAZRJZERDMPS-AUWJEWJLSA-N 485.905 5.020 5 20 JKBD CC(C)N(Cc1nnc(-c2cccc([N+](=O)[O-])c2)o1)C(=O)[C@H](C)Oc1ccc(Cl)c(Cl)c1 916369626 LYDYSQPMJFZYEC-ZDUSSCGKSA-N 479.320 5.156 5 20 JKBD O=C(CSc1nc2ccc([N+](=O)[O-])cc2s1)N1CCc2sccc2[C@@H]1c1ccccc1 917170980 KMMRQNXKTZAMPG-NRFANRHFSA-N 467.597 5.532 5 20 JKBD Cc1ccccc1NC(=O)c1cc2ccccc2cc1OS(=O)(=O)c1ccc([N+](=O)[O-])cc1F 917862548 GQVNUIZDWDAKAL-UHFFFAOYSA-N 480.473 5.216 5 20 JKBD CSCC(=O)Nc1ccc(OC(=O)c2ccc(Sc3nc(C)cs3)c([N+](=O)[O-])c2)cc1 920295397 SHEYLIORFIVOMB-UHFFFAOYSA-N 475.573 5.032 5 20 JKBD Cc1ccc(/C(O)=C(/C(=S)Nc2ccc3ccccc3c2)[n+]2cc(O)ccc2C)cc1[N+](=O)[O-] 920487009 SEECEJCMJSPZPB-UHFFFAOYSA-O 472.546 5.681 5 20 JKBD O=C(CCC1CCC1)Nc1ccc(C2(NC(=O)CSc3ccccc3[N+](=O)[O-])CCC2)cc1 1786263039 CKKLEYMEEHPUJZ-UHFFFAOYSA-N 467.591 5.401 5 20 JKBD Cc1occc1C(=O)Nc1ccc(C2(NC(=O)CSc3ccccc3[N+](=O)[O-])CCC2)cc1 1787367278 KIKGDKXWAYWMJH-UHFFFAOYSA-N 465.531 5.036 5 20 JKBD COc1cc(CC(=O)NC2(c3ccc(NC(=O)c4cccc5cc[nH]c45)cc3)CCC2)ccc1[N+](=O)[O-] 1789093684 HXAWNTICXNLMMC-UHFFFAOYSA-N 498.539 5.075 5 20 JKBD CC1=CC[C@H](C(=O)Nc2ccc(C3(NC(=O)c4cc(F)cc([N+](=O)[O-])c4)CCC3)cc2)CC1 1789114516 HIEMNFPTTFUSJB-KRWDZBQOSA-N 451.498 5.228 5 20 JKBD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc2c(Cl)cccc2s1)c1cc(F)cc([N+](=O)[O-])c1 1797650232 REPBWNBMQXSXRF-MUJYYYPQSA-N 487.940 5.168 5 20 JKBD Cc1cc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cc(Cl)cc([N+](=O)[O-])c2C)c(C(F)(F)F)o1 1800709810 DKNGTHRPJGEVDX-QDMKHBRRSA-N 499.873 5.042 5 20 JKBD O=C(Cc1ccc2ccccc2c1)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc2cc([N+](=O)[O-])ccc2s1 1801207441 MJSGUTIOFODFDH-NUNAXRQHSA-N 499.592 5.457 5 20 JKBD O=C(CCc1cccc([N+](=O)[O-])c1)Nc1cc([C@@H]2CCCCN2C(=O)c2c(F)cccc2Cl)[nH]n1 1815538276 FXBQSIGZVUVDQN-FQEVSTJZSA-N 499.930 5.049 5 20 JKBD O=C(c1c(F)cc(Cl)cc1Cl)N1CCC([C@H]2CCCCN2C(=O)c2ccc([N+](=O)[O-])o2)CC1 1823615056 LZWIJHAGODEGNW-QGZVFWFLSA-N 498.338 5.181 5 20 JKBD O=C(/C=C/c1ccccc1[N+](=O)[O-])N1CCC([C@H]2CCCCN2C(=O)c2cc3sccc3[nH]2)CC1 1828714306 UUXRQYLWIQWBRB-HYGBKTPJSA-N 492.601 5.084 5 20 JKBD O=C(C[C@H]1C[C@@H]2CC[C@H]1C2)N1CCC([C@H]2CCCCN2C(=O)/C=C/c2ccccc2[N+](=O)[O-])CC1 1832903822 LHYNSIRJXJTKJR-XBLDVUCKSA-N 479.621 5.054 5 20 JKBD COc1ccc(C)cc1NC(=O)[C@@H](OC(=O)c1ccc(Br)c([N+](=O)[O-])c1)c1ccccc1 9848917 PFSQGQWLDOFBBA-NRFANRHFSA-N 499.317 5.211 5 20 JKBD O=C(NC[C@@H](c1cccs1)N1CCCC1)c1cc([N+](=O)[O-])ccc1Sc1ccccc1 32762755 MUPSMDKLBCIJSG-FQEVSTJZSA-N 453.589 5.374 5 20 JKBD O=C(CN(Cc1ccco1)C(=O)Cc1ccc([N+](=O)[O-])cc1)Nc1ccc(Cl)c(C(F)(F)F)c1 69057148 RECDLMGLMNUMOO-UHFFFAOYSA-N 495.841 5.070 5 20 JKBD C[C@@H](Nc1ccc(C(=O)N(Cc2ccco2)Cc2cccs2)cc1[N+](=O)[O-])c1ccccn1 72016639 YWZAHHYNVGQDEK-QGZVFWFLSA-N 462.531 5.660 5 20 JKBD COc1ccc([C@H](Cc2ccc(F)cc2)NC(=O)Cn2c3ccccc3c(=O)c3ccccc32)cc1 72040250 KDBCWXLHIRVPMC-SANMLTNESA-N 480.539 5.403 5 20 JKBD COc1ccc(C(=O)N[C@H](c2ccccc2)c2ccc3nc(C(F)(F)F)[nH]c3c2)cc1[N+](=O)[O-] 248142923 TYHXOVLYYCLXDF-HXUWFJFHSA-N 470.407 5.018 5 20 JKBD C[C@H]1CN(c2ccccc2NC(=O)c2ccc(N[C@@H](C)c3ccccn3)c([N+](=O)[O-])c2)C[C@@H](C)O1 410054358 JSBSFADXTMVWJA-OTWHNJEPSA-N 475.549 5.029 5 20 JKBD CCOc1ccccc1-c1nnc(S[C@@H](C)C(=O)Nc2nc(-c3cccc([N+](=O)[O-])c3)cs2)o1 488608284 DMXRMYUXDOWOTL-ZDUSSCGKSA-N 497.558 5.286 5 20 JKBD O=C(C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)NCC(=O)Nc1ccc(F)cc1 493983286 NERSZBIGKFOPBP-LGMDPLHJSA-N 490.516 5.029 5 20 JKBD C[C@@H](Nc1ccc(C(=O)NCc2cccc(OCC(F)(F)F)c2)cc1[N+](=O)[O-])c1ccccn1 507338515 GCIQYVXTGZRAIN-OAHLLOKOSA-N 474.439 5.034 5 20 JKBD C[C@@H](Nc1ccc(C(=O)Nc2ccc(C(=O)NC3CCCC3)cc2)cc1[N+](=O)[O-])c1ccccn1 507402599 LRKRFJDMPKFNKK-QGZVFWFLSA-N 473.533 5.088 5 20 JKBD COC(=O)[C@@H](NC(=O)C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)c1cccs1 509170113 QWCZNANNEBNFMI-ANCZKMTESA-N 493.566 5.227 5 20 JKBD Cc1ccc(C(C)C)c(Oc2ccc(CNCc3ccc(CS(C)(=O)=O)cc3)cc2[N+](=O)[O-])c1 513621911 JKKNYVBQARNQBQ-UHFFFAOYSA-N 482.602 5.653 5 20 JKBD Cc1nn(Cc2ccc(C(=O)Nc3ccc(C(=O)N(C)C4CCCCC4)cc3)cc2)c(C)c1[N+](=O)[O-] 515872483 CNYQXYNOYKFVSZ-UHFFFAOYSA-N 489.576 5.113 5 20 JKBD COc1cc(OCC(=O)Nc2cccc(NC(=O)Nc3cccc4c3CCCC4)c2)ccc1[N+](=O)[O-] 519505097 CZHVQNXYBNCHOS-UHFFFAOYSA-N 490.516 5.144 5 20 JKBD C[C@@H](c1cccc([N+](=O)[O-])c1)S(=O)(=O)Cc1csc(-c2ccc(Br)cc2)n1 520669034 MEGYBPDZBWGXEO-LBPRGKRZSA-N 467.366 5.157 5 20 JKBD Cc1cc(OCc2cccc(Cl)c2)ccc1NC(=O)CNC(=O)c1c(Cl)cccc1[N+](=O)[O-] 521725742 JFSQFRCGMDSHDP-UHFFFAOYSA-N 488.327 5.158 5 20 JKBD CCN(Cc1ccc(Cl)cc1)C(=O)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 603526322 OIINJUHLUHYEBF-UHFFFAOYSA-N 469.891 5.532 5 20 JKBD CCOc1ccc([C@H](NC(=O)c2cc(OC)c(OC(F)F)cc2[N+](=O)[O-])c2ccccc2)cc1 603623046 NQZONTFQTKLVBP-JOCHJYFZSA-N 472.444 5.123 5 20 JKBD COc1ccccc1CN(C(=O)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1)C1CC1 603986865 ZFPKRIWRTSDXGV-UHFFFAOYSA-N 477.483 5.030 5 20 JKBD O=C(CCNc1ccc(C(F)(F)F)cc1[N+](=O)[O-])Nc1ccc(Sc2nncs2)cc1 604119016 MCFXRHBBAMOGQO-UHFFFAOYSA-N 469.470 5.057 5 20 JKBD O=C(c1ccc(-c2ccc(Cl)c(Cl)c2)s1)N1CCN(C(=O)c2ccc([N+](=O)[O-])s2)CC1 604174724 MLCYTHGZFRSLRG-UHFFFAOYSA-N 496.397 5.290 5 20 JKBD C[C@@H](Nc1ccc(C(=O)N2C[C@@H](C(F)(F)F)C[C@@H](C(F)(F)F)C2)cc1[N+](=O)[O-])c1ccccn1 604310686 CXYXTUIEEYHQDE-YUELXQCFSA-N 490.404 5.366 5 20 JKBD O=C(c1csc(-c2ccccc2Cl)n1)N(Cc1ccccc1[N+](=O)[O-])CC(F)(F)F 608937409 VUCLCPGKBSYGMU-UHFFFAOYSA-N 455.845 5.576 5 20 JKBD Cc1ccc(C(=O)N2CCC(NC(=O)c3cc([N+](=O)[O-])ccc3Sc3ccccc3)CC2)cc1 608964576 TVWPOLVOSXATEJ-UHFFFAOYSA-N 475.570 5.089 5 20 JKBD COc1cc(CSc2nnc(-c3ccccc3)n2Cc2ccco2)c([N+](=O)[O-])cc1OC(F)F 619252916 YXRQHHMPBIYFRJ-UHFFFAOYSA-N 488.472 5.397 5 20 JKBD CC(C)(C)OC(=O)NC[C@@H]1CCN(C(=O)c2ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])cc2)C1 725734418 RIWGBNSVWCTMJJ-HNNXBMFYSA-N 475.929 5.027 5 20 JKBD O=C(Oc1ccc2c(-c3ccc([N+](=O)[O-])cc3)cc(=O)oc2c1)c1cnc(-c2ccccn2)s1 727661950 KNAUOXOSVOJCDH-UHFFFAOYSA-N 471.450 5.106 5 20 JKBD CCN(Cc1cccc(NC(=O)c2cc(SC)c(OC)cc2[N+](=O)[O-])c1)C(=O)OC(C)(C)C 728516847 XTENLDDHPMCWQW-UHFFFAOYSA-N 475.567 5.335 5 20 JKBD CC(C)N(Cc1nnc(-c2cccc([N+](=O)[O-])c2)o1)C(=O)[C@H]1C[C@@H]1c1ccc(Cl)cc1Cl 730449095 AWAXRJJTTOYLEB-MSOLQXFVSA-N 475.332 5.492 5 20 JKBD O=C(Nc1ccccc1)c1cccc(COC(=O)c2csc(-c3ccc([N+](=O)[O-])cc3)n2)c1 747955687 WBFQQGUOKQGMPT-UHFFFAOYSA-N 459.483 5.328 5 20 JKBD C[C@@H](OC(=O)c1[nH]c2ccc(Cl)cc2c1Cl)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl 915417895 STZFQWVSJNMSOQ-MRVPVSSYSA-N 456.669 5.220 5 20 JKBD Cc1sc(NC(=O)c2ccc(CNC(=O)OC(C)(C)C)cc2)nc1-c1cccc([N+](=O)[O-])c1 917792085 VMHLHHAEDKCFSC-UHFFFAOYSA-N 468.535 5.304 5 20 JKBD Cc1ccc(Cn2ccccc2=NC(=O)c2ccc(N[C@@H](C)c3ccccn3)c([N+](=O)[O-])c2)cc1 919746091 SPPMTUNOJSPGEC-FQEVSTJZSA-N 467.529 5.062 5 20 JKBD CN(C(=O)c1ccc(Cl)cc1)c1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2N2CCCCC2)cc1 920009294 GRHZHBBKPBPQEK-UHFFFAOYSA-N 492.963 5.767 5 20 JKBD COc1cc(C(=O)NC2(c3ccc(NC(=O)CCc4cccs4)cc3)CCC2)ccc1[N+](=O)[O-] 1786950564 IZOHDMNBHJIOKH-UHFFFAOYSA-N 479.558 5.045 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)c3ccc([N+](=O)[O-])cc3F)CCC2)cc1)c1cc2cc(F)ccc2[nH]1 1789235798 JPRCRZYNGUIRDA-UHFFFAOYSA-N 490.466 5.416 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)c3cc(O)cc([N+](=O)[O-])c3)CCC2)cc1)c1cccc(Cl)c1 1790265567 QRHOQKWDUXAWKU-UHFFFAOYSA-N 465.893 5.015 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)Nc1ccc(C2(NC(=O)c3ccnc(Cl)c3)CCC2)cc1 1790771126 RCZVKRCZQBNVGC-UHFFFAOYSA-N 482.899 5.152 5 20 JKBD C[C@@H](CC(=O)Nc1ccc(C2(NC(=O)/C=C/c3ccc([N+](=O)[O-])o3)CCC2)cc1)Oc1ccccc1 1791144143 KOSYYVPEYHZSCY-XUDAUXSOSA-N 489.528 5.193 5 20 JKBD CC(=O)Nc1cccc(C(=O)NC2(c3ccc(NC(=O)/C=C/c4ccccc4[N+](=O)[O-])cc3)CCC2)c1 1792319411 SCDPTVVYIVVCOP-XNTDXEJSSA-N 498.539 5.014 5 20 JKBD CC(C)[C@@H](C(=O)N1CCCC2(CCN(C(=O)c3ccc([N+](=O)[O-])cc3F)CC2)C1)c1ccccc1 1805624011 XZYFFTYBRIXRMG-XMMPIXPASA-N 481.568 5.019 5 20 JKBD C[C@H](C(=O)N1CCCC[C@@H]1c1cc(NC(=O)Cc2cccc([N+](=O)[O-])c2)n[nH]1)c1ccc(Cl)cc1 1814372770 CVBZVRDRWPZIMR-KSFYIVLOSA-N 495.967 5.010 5 20 JKBD CC(C)c1ccc(C(=O)N2CCCC[C@H]2c2cc(NC(=O)c3ccc([N+](=O)[O-])cc3F)n[nH]2)cc1 1821052883 OFMBCQMRMCXXTB-QFIPXVFZSA-N 479.512 5.200 5 20 JKBD O=C(Nc1cc([C@H]2CCCCN2C(=O)Cc2cccs2)[nH]n1)c1cc2cc([N+](=O)[O-])ccc2s1 1821609700 KUFQPMJTJLWNBZ-GOSISDBHSA-N 495.586 5.143 5 20 JKBD CC(C)c1ccc(CC(=O)N2CCCC[C@@H]2C2CCN(C(=O)Cc3cccc([N+](=O)[O-])c3)CC2)cc1 1831593924 CUUGOCGLABYLSD-HHHXNRCGSA-N 491.632 5.123 5 20 JKBD COc1ccc(Br)cc1-c1nc(COC(=O)CSc2ccc([N+](=O)[O-])cc2)cs1 9352745 MPNGZBRWLSVJSI-UHFFFAOYSA-N 495.376 5.325 5 20 JKBD O=C(Nc1ccccc1C(=O)NCC1(c2ccccc2)CCC1)c1ccc([N+](=O)[O-])cc1Cl 25610701 OJLBDPSGLNHXMU-UHFFFAOYSA-N 463.921 5.352 5 20 JKBD CCN(CC(=O)Nc1cccc(OC)c1)C(=O)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1 30420218 WIPKUBKCCBDSIN-UHFFFAOYSA-N 483.908 5.150 5 20 JKBD CC1CCN(Cc2csc(NC(=O)c3ccc(N[C@@H](C)c4ccccn4)c([N+](=O)[O-])c3)n2)CC1 72016712 FUARGQSBTCQIGM-KRWDZBQOSA-N 480.594 5.104 5 20 JKBD O=C(O[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1)c1cccc2ncccc12 105482203 LWZKEOLNSAULFX-JOCHJYFZSA-N 461.861 5.333 5 20 JKBD Cc1sc(NC(=O)CSc2ccc(C(F)(F)F)cc2[N+](=O)[O-])c(C(N)=O)c1-c1ccccc1 105829347 VUNSLYAHBMZFCO-UHFFFAOYSA-N 495.504 5.480 5 20 JKBD CC(C)N(C)C(=O)c1ccc(Cl)c(NC(=O)c2ccc(N3C[C@@H](C)C[C@H](C)C3)c([N+](=O)[O-])c2)c1 303158045 UPAVSUZFHCUOIQ-IRXDYDNUSA-N 487.000 5.463 5 20 JKBD Cc1cc(NC(=O)c2ccc(NCc3ccccc3Cl)c([N+](=O)[O-])c2)n(-c2ccccn2)n1 486423297 QOBKIUIMAFEOPM-UHFFFAOYSA-N 462.897 5.002 5 20 JKBD CC(=O)c1cccc(NC(=O)[C@@H](Sc2nc3cc4ccccc4cc3c(=O)n2C)C(C)C)c1 498081870 HGNDKYFOVOCEKM-QHCPKHFHSA-N 459.571 5.045 5 20 JKBD Cc1c(NC(=O)c2ccc(N3C[C@H](C)C[C@@H](C)C3)c([N+](=O)[O-])c2)cccc1C(=O)Nc1ccccc1 498468426 YUQLSEIPNMLBJB-RTBURBONSA-N 486.572 5.890 5 20 JKBD Cc1c(NC(=O)c2ccccc2)cccc1NC(=O)c1csc(-c2cccc([N+](=O)[O-])c2)n1 498714814 BPZCVBFCJYMKEW-UHFFFAOYSA-N 458.499 5.531 5 20 JKBD Cc1cc2cc(NC(=O)Cc3cn(-c4ccccc4)nc3-c3ccc([N+](=O)[O-])cc3)ccc2[nH]1 505601406 FDBHHQWBFTTZBL-UHFFFAOYSA-N 451.486 5.418 5 20 JKBD C[C@@H](Nc1ccc(C(=O)NCCc2c(Cl)cccc2Cl)cc1[N+](=O)[O-])c1ccccn1 507650662 QBFKMUONGSVFLA-CQSZACIVSA-N 459.333 5.442 5 20 JKBD O=C(Nc1cc(Br)ccc1Br)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-] 515171582 HRBWZRUWDIIMHO-UHFFFAOYSA-N 498.049 5.313 5 20 JKBD O=C(CSc1ccc(C(F)(F)F)cc1[N+](=O)[O-])N[C@H](CC(F)(F)F)c1ccccc1 515656027 BUXFFNHTQTXJGY-CYBMUJFWSA-N 452.376 5.516 5 20 JKBD O=C(C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)N1CCC[C@H]1c1cccc(F)c1 516142311 RSSUMHKYQKISKJ-ZTTNJJDWSA-N 487.556 6.638 5 20 JKBD C[C@@H]1CN(C(=O)C/C(=C/c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)C[C@H](c2ccccc2)O1 516754655 SOJKROKOLQGXMO-ZMLNIQHFSA-N 499.592 6.124 5 20 JKBD CC(=O)Nc1cc(N[C@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2ccccc2)ccc1Cl 516835769 SGUDGEMHFHHRQZ-NRFANRHFSA-N 473.316 5.652 5 20 JKBD O=C(Nc1cc([N+](=O)[O-])ccc1OC(F)F)c1cccnc1Oc1ccc(Cl)cc1Cl 518948123 NIKCBFXVUUROPD-UHFFFAOYSA-N 470.215 5.943 5 20 JKBD CSc1ccc(C(=O)c2ccccc2C(=O)Nc2ccc(OCc3ccncc3)cc2)cc1[N+](=O)[O-] 519123782 WXVWHTTXGWLTBJ-UHFFFAOYSA-N 499.548 5.774 5 20 JKBD COc1ccc([C@H](Cc2ccccc2C)NC(=O)CSc2ccc([N+](=O)[O-])cc2)cc1OC 519174646 SWBNIIHVOHPGEN-QFIPXVFZSA-N 466.559 5.113 5 20 JKBD O=C(N[C@H]1CCN(CC(F)(F)F)C1)c1ccccc1Sc1ccc(C(F)(F)F)cc1[N+](=O)[O-] 519937981 PPDBDNUVGADQSE-ZDUSSCGKSA-N 493.429 5.131 5 20 JKBD COc1ccc2c(c1)CCN2C(=O)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])c(OC)c1 520179345 BPXAVTZQYCDQFL-UHFFFAOYSA-N 454.866 5.261 5 20 JKBD Cc1ccc(-c2cc(C(=O)Nc3cc4c(cc3[N+](=O)[O-])OCCCO4)c3cnn(C(C)C)c3n2)s1 590646899 VWUYZFASBMRSML-UHFFFAOYSA-N 493.545 5.371 5 20 JKBD COc1ccc(CSc2nnc([C@H](C)N3CCCCC3)n2-c2ccccc2)cc1[N+](=O)[O-] 603722411 MKUGRRMODIIKOP-KRWDZBQOSA-N 453.568 5.023 5 20 JKBD CC1CCN(c2ccc(CN[C@@H](C(=O)Nc3ccc([N+](=O)[O-])cc3Cl)c3ccccc3)cn2)CC1 604045230 KHGKBLZWBVWVRV-RUZDIDTESA-N 493.995 5.349 5 20 JKBD CC(=O)Nc1cccc2c1CCN(C(=O)c1ccc(Sc3ccc(C)cc3)c([N+](=O)[O-])c1)C2 604191346 HNIWUCOVTPGTPV-UHFFFAOYSA-N 461.543 5.211 5 20 JKBD O=C(Nc1nc(C2CC2)c(Cc2ccccc2Cl)s1)c1cc2c(cc1[N+](=O)[O-])OCO2 608850157 KMSGCDQCFVSKAR-UHFFFAOYSA-N 457.895 5.154 5 20 JKBD O=C(C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)Nc1ccc(-c2ncon2)cc1 608874381 DYFPMADJWUOPFD-AQTBWJFISA-N 483.509 5.824 5 20 JKBD CC[C@H](C)Sc1ccc(NC(=O)c2cc([N+](=O)[O-])cc3c2OCCO3)c(C(F)(F)F)c1 608942602 LHGZWVFTUMGPBX-NSHDSACASA-N 456.442 5.528 5 20 JKBD COc1ccc(CN(Cc2ccc(OC)cc2)C(=O)c2cc(SC)c(OC)cc2[N+](=O)[O-])cc1 609219106 GKTFZEQUDKBHJW-UHFFFAOYSA-N 482.558 5.185 5 20 JKBD COC1CCN(c2ccc(NC(=O)c3ccc(Cl)cc3[N+](=O)[O-])cc2C(F)(F)F)CC1 728041415 OTUGPSRZNRHYCQ-UHFFFAOYSA-N 457.836 5.135 5 20 JKBD O=C(OCC(=O)N1Cc2ccccc2[C@@H](c2ccccc2)C1)c1csc(-c2cccc([N+](=O)[O-])c2)n1 747954500 ACGPDOHWONTHTN-HSZRJFAPSA-N 499.548 5.049 5 20 JKBD COc1cc(C(=O)O[C@@H](C)c2ccccc2NC(=O)c2ccccc2)c([N+](=O)[O-])cc1OC(F)F 748017950 COFIMBOAMKSENI-AWEZNQCLSA-N 486.427 5.375 5 20 JKBD C[C@@H](Sc1nc(-c2ccc(F)cc2)cs1)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 786589596 BJSGYYWTRKRUMW-SNVBAGLBSA-N 471.457 5.996 5 20 JKBD COCCn1c(S[C@@H](C(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)c2ccccc2)nc(C)c1C 817747920 VXUXHSWIJLHKPI-HXUWFJFHSA-N 474.970 5.180 5 20 JKBD O=C(Nc1ccc(NCc2c(Br)cccc2[N+](=O)[O-])c(C(F)(F)F)c1)C1CC1 863995607 YADLSSOAMLTONS-UHFFFAOYSA-N 458.234 5.337 5 20 JKBD CSc1ccc(C(=O)c2ccccc2C(=O)Nc2ccc(N3CCCC3)cc2)cc1[N+](=O)[O-] 902577136 VTYIDGKDOBFPSD-UHFFFAOYSA-N 461.543 5.400 5 20 JKBD Cc1cc(C)n(Cc2cccc(-c3noc([C@@H](C)Oc4ccc(Cl)cc4[N+](=O)[O-])n3)c2)n1 904531496 XEVANLPCZOAAIS-OAHLLOKOSA-N 453.886 5.300 5 20 JKBD Cc1noc(C)c1CN(C)C(=O)C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1 915194827 ACDKBHCANKYCQG-LDADJPATSA-N 462.531 5.399 5 20 JKBD O=C(CCCc1nnc(-c2ccccc2)o1)Nc1cc(Cl)c([N+](=O)[O-])cc1OCc1ccccc1 915277462 NRLLPGFGMVHKHH-UHFFFAOYSA-N 492.919 5.839 5 20 JKBD Cc1cc[n+](/C(C(=S)Nc2c(C(C)C)cccc2C(C)C)=C(/O)c2ccc(C)c([N+](=O)[O-])c2)cc1 917611291 YULVHINKKGHMQC-UHFFFAOYSA-O 490.649 7.069 5 20 JKBD C[C@H](Nc1ccc(C(=O)O[C@@H](C)c2nc3ccccc3n2C(F)F)cc1[N+](=O)[O-])c1ccccn1 919684212 IQRFMVURNFIIRN-GJZGRUSLSA-N 481.459 5.826 5 20 JKBD COc1ccc(Cl)cc1C(=O)N1CCC(C(=O)Oc2ccc(-c3ccccc3)cc2[N+](=O)[O-])CC1 920329183 AGZLRLSNAGBICW-UHFFFAOYSA-N 494.931 5.382 5 20 JKBD Cc1ccc(O)c[n+]1/C(C(=S)Nc1c(C(C)C)cccc1C(C)C)=C(/O)c1ccc([N+](=O)[O-])cc1 920487536 UGJBNKMSPBFUTL-UHFFFAOYSA-O 492.621 6.466 5 20 JKBD O=C(CNc1ccc(C(F)(F)F)cc1[N+](=O)[O-])OCc1nnc(-c2ccc(Cl)cc2Cl)o1 920491939 BHXDFKQAWIKANM-UHFFFAOYSA-N 491.209 5.126 5 20 JKBD Cc1nc(-c2ccc(Cl)s2)sc1C(=O)OCC(=O)Nc1cc([N+](=O)[O-])ccc1Cl 921103136 JRGUTKVDQULLIV-UHFFFAOYSA-N 472.331 5.191 5 20 JKBD O=C(COC(=O)c1csc(-c2ccc(Cl)cc2Cl)n1)Nc1cc(Cl)ccc1[N+](=O)[O-] 921223374 KSOXXOMTWXQRCN-UHFFFAOYSA-N 486.720 5.474 5 20 JKBD O=C(Cc1cccc([N+](=O)[O-])c1)Nc1ccc(C2(NC(=O)c3ccoc3C(F)(F)F)CCC2)cc1 1785791626 ICSGBWZLJIXAMO-UHFFFAOYSA-N 487.434 5.197 5 20 JKBD O=C(NC1(c2ccc(NC(=O)C3CCC(F)(F)CC3)cc2)CCC1)c1cc([N+](=O)[O-])cc2c1OCC2 1786244891 TYYYHBVGTMBQQE-UHFFFAOYSA-N 499.514 5.103 5 20 JKBD Cc1ccc(CCC(=O)Nc2ccc(C3(NC(=O)/C=C/c4ccccc4[N+](=O)[O-])CCC3)cc2)cn1 1786840018 IIGRRLYMJDYRNN-MHWRWJLKSA-N 484.556 5.078 5 20 JKBD Cc1c(C(=O)NC[C@H]2CCN(C(=O)C3(C)CCCCC3)[C@H]2c2cccnc2)cc(Cl)cc1[N+](=O)[O-] 1811796763 KZEMJENGAXYGBV-XXBNENTESA-N 499.011 5.242 5 20 JKBD COc1cc(C(=O)N2CCC([C@@H]3CCCCN3C(=O)C[C@H](C)c3ccccc3)CC2)ccc1[N+](=O)[O-] 1831510266 LDNBPGZAWXFGQR-RDPSFJRHSA-N 493.604 5.031 5 20 JKBD C[C@@H](C(=O)N1CCC([C@@H]2CCCCN2C(=O)CSc2ccccc2[N+](=O)[O-])CC1)c1ccccc1 1831777096 CWPKWNTXTZLADN-OFNKIYASSA-N 495.645 5.110 5 20 JKBD O=C(c1cc(F)cc([N+](=O)[O-])c1)N1CCC([C@H]2CCCCN2C(=O)C2(c3ccccc3)CCC2)CC1 1831781871 JYTUIKVZGBALQP-RUZDIDTESA-N 493.579 5.089 5 20 JKBD Cc1ccc(/C=C/C(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3cc(F)cc([N+](=O)[O-])c3)CC2)s1 1832173981 NXPFPHJGWWIWNZ-NDEDVSTASA-N 485.581 5.051 5 20 JKBD O=C(c1c[nH]c2c(Cl)cccc12)N1CC2(CCCN2C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)C1 1845739650 WSGLKOCBVMJHNF-UHFFFAOYSA-N 494.960 5.075 5 20 JKBD COc1cc(C(=O)N[C@@H](C)c2cc(F)c(Cl)cc2Cl)c([N+](=O)[O-])cc1OC(F)F 10966168 NWGYJGBKHGUENT-ZETCQYMHSA-N 453.200 5.142 5 20 JKBD O=C(Nc1ccccc1C(=O)NC[C@H]1CCCO1)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1 15638847 VIGGEWSNZIPZHR-LJQANCHMSA-N 495.919 5.202 5 20 JKBD CCOc1ccccc1NC(=O)[C@H](C)OC(=O)c1ccccc1C(=O)c1ccc(Cl)c([N+](=O)[O-])c1 15710274 RBDGOONHOMZBRU-HNNXBMFYSA-N 496.903 5.062 5 20 JKBD C[C@H](Sc1nnc(-c2c[nH]c3ccccc23)n1C1CC1)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl 17881935 VGIUPSHSGGVKAQ-LBPRGKRZSA-N 482.953 5.442 5 20 JKBD COc1ccc(-c2nnc(COC(=O)c3ccc(Oc4ccc(Cl)cc4[N+](=O)[O-])cc3)o2)cc1 18334355 FTYLIYKDJBXWPD-UHFFFAOYSA-N 481.848 5.456 5 20 JKBD CCN(CC)c1ccc(-c2nnc(SCc3nnc(-c4ccc([N+](=O)[O-])cc4)o3)n2CC)cc1 21115803 NQQSHMWRIJECHV-UHFFFAOYSA-N 479.566 5.062 5 20 JKBD C[C@H](Nc1ccc(C(=O)N(C)CCCc2cc(-c3ccccc3)n[nH]2)cc1[N+](=O)[O-])c1ccccn1 108830509 ZXYXLIHFRMKDIS-IBGZPJMESA-N 484.560 5.258 5 20 JKBD COc1ccc(N2C(=O)/C(=C\c3cccs3)N=C2SCc2csc([N+](=O)[O-])c2)cc1Cl 216073828 ZEFPYTKWWGJLSO-CXUHLZMHSA-N 492.003 6.057 5 20 JKBD Cc1cc(-c2csc(NC(=O)c3ccc(N[C@@H](C)c4ccccn4)c([N+](=O)[O-])c3)n2)c(C)o1 410080237 CFZZHTUADFOJSJ-AWEZNQCLSA-N 463.519 5.749 5 20 JKBD CCOc1ccc(NS(=O)(=O)c2cc(NC(=O)c3cc4cc([N+](=O)[O-])ccc4o3)ccc2C)cc1 491901031 WVPSSTVPNNYDBQ-UHFFFAOYSA-N 495.513 5.101 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Cl)[C@@H](NCc1cccc(OC(F)F)c1)c1ccccc1 497508391 MQPVGSOKWFQLPQ-FQEVSTJZSA-N 461.852 5.319 5 20 JKBD C[C@H](Nc1ccc(C(=O)NCc2ccc(OCc3ccccn3)cc2)cc1[N+](=O)[O-])c1ccccn1 507400508 GHKSZLKGXVGCCS-IBGZPJMESA-N 483.528 5.067 5 20 JKBD CCOc1cc(NC(=O)N(C)Cc2c(C)nn(-c3ccccc3C)c2C)c([N+](=O)[O-])cc1OCC 510411396 HOQBNBOXPZGMPI-UHFFFAOYSA-N 481.553 5.167 5 20 JKBD O=C(Nc1ccc(C(=O)N2CCCC2)cc1)c1cc([N+](=O)[O-])ccc1Sc1ccc(Cl)cc1 601968259 JLYXEOQOSXGNFE-UHFFFAOYSA-N 481.961 5.888 5 20 JKBD O=C(N[C@@H]1CCCc2nc(O)ccc21)c1ccc(Sc2nc3ccccc3s2)c([N+](=O)[O-])c1 603011116 SVHPLTDPXLAALI-MRXNPFEDSA-N 478.555 5.264 5 20 JKBD COC(=O)c1cc(CNC(=O)C/C(=C\c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)oc1C 603571670 OFYDCXYCZNVGPG-GZTJUZNOSA-N 491.525 5.140 5 20 JKBD O=C(c1cc(NC2C[C@H](C(F)(F)F)C[C@@H](C(F)(F)F)C2)ccc1[N+](=O)[O-])N1CCCC1 603943526 MXJICEHWGUAMSW-VXGBXAGGSA-N 453.383 5.152 5 20 JKBD O=C(C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)N1CCC[C@H](c2cc[nH]n2)C1 608813092 AKWFLYXCUNCKJL-OGBKAESYSA-N 473.558 5.265 5 20 JKBD CCn1c(S[C@@H](C)C(=O)Nc2cc(Cl)ccc2F)nc2cc3ccccc3cc2c1=O 622146236 MOTDWGRINZJXIS-ZDUSSCGKSA-N 455.942 5.481 5 20 JKBD Cc1ccc[n+](/C(C(=S)NCCc2ccc(Cl)cc2Cl)=C(/O)c2cccc([N+](=O)[O-])c2)c1 726572626 FOEGBEXWWJAYPX-UHFFFAOYSA-O 489.404 5.541 5 20 JKBD O=C(Nc1cc(C(=O)N2CCCCC2)ccc1Cl)c1cc([N+](=O)[O-])ccc1N1CCCCC1 726926448 YHOMJIHVHWVCAS-UHFFFAOYSA-N 470.957 5.117 5 20 JKBD Cn1nc(C(F)(F)F)c(-c2ccc(Cl)cc2)c1NC(=O)c1cc(Cl)ccc1[N+](=O)[O-] 728149295 CZGXQOIPTCAXMH-UHFFFAOYSA-N 459.211 5.573 5 20 JKBD O=C(Oc1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2Cl)cc1)c1cc(F)c(F)c(F)c1 728457298 YCJRHOBHHCXTOB-UHFFFAOYSA-N 450.756 5.137 5 20 JKBD O=C(O[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1)c1cnc(C2CC2)s1 729773431 NTAJBQDCLRFKLS-GOSISDBHSA-N 457.895 5.119 5 20 JKBD Cc1cc(C)n(-c2ccc(C(F)(F)F)cc2NC(=O)c2cc([N+](=O)[O-])c(C)c([N+](=O)[O-])c2C)n1 748621172 IDJKGBDWLMHLIP-UHFFFAOYSA-N 477.399 5.193 5 20 JKBD O=C(Nc1cccc(Cl)c1SC(F)F)c1ccc([N+](=O)[O-])cc1I 751228131 JMODMAUDASTZEC-UHFFFAOYSA-N 484.649 5.420 5 20 JKBD O=C(/C=C/c1ccc([N+](=O)[O-])cc1)N[C@@H](C(=O)Nc1ccc(Br)cc1F)c1ccccc1 751231015 NVZCOFKXBUTWJP-MKGTUJQCSA-N 498.308 5.006 5 20 JKBD C[C@@H](Sc1ncc(-c2ccccc2)n1C[C@H]1CCCO1)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 828604405 OXNBHJIRAXFENA-OXQOHEQNSA-N 477.546 5.541 5 20 JKBD O=[N+]([O-])c1ccc(-c2nc(-c3ccc(Oc4ccc(F)cc4)nc3)no2)c(Br)c1 904511586 RHZUIBIOASYLSD-UHFFFAOYSA-N 457.215 5.401 5 20 JKBD CCC(=O)Nc1ccc(Nc2ccc(S(=O)(=O)Nc3ccc(C)cc3C)cc2[N+](=O)[O-])cc1 917078681 HUTXAGGEVXNMIQ-UHFFFAOYSA-N 468.535 5.105 5 20 JKBD CC1=C(C(=O)Nc2cccnc2Cl)[C@H](c2ccc([N+](=O)[O-])cc2)NC(=S)N1c1cccc(C)c1 917378371 JXGQGGXXDWTRFL-NRFANRHFSA-N 493.976 5.300 5 20 JKBD C[C@H](OC(=O)c1cc([N+](=O)[O-])ccc1Oc1ccccc1)C(=O)Nc1ccc(N2CCCC2)cc1 919192958 QYZOZTWLVPCUCM-SFHVURJKSA-N 475.501 5.171 5 20 JKBD C[C@H](OC(=O)CCOc1ccccc1[N+](=O)[O-])C(=O)N1c2ccccc2Sc2ccccc21 919491228 JOTBJZIGDBCLLI-INIZCTEOSA-N 464.499 5.125 5 20 JKBD Cc1oc(-c2cccs2)nc1COC(=O)c1ccc(N[C@@H](C)c2ccccn2)c([N+](=O)[O-])c1 920546614 LLRHKACSGHEVHX-AWEZNQCLSA-N 464.503 5.545 5 20 JKBD Cc1cc(COc2ccc(C(=O)N(C)Cc3cc([N+](=O)[O-])ccc3Cl)cc2Br)no1 921306095 OOIQYMKOVKHUID-UHFFFAOYSA-N 494.729 5.158 5 20 JKBD O=C(Cc1cc([N+](=O)[O-])ccc1F)Nc1ccc(C2(NC(=O)[C@@]3(F)CCCC=C3F)CCC2)cc1 1786671651 OUAZKVNPOUDFFV-RUZDIDTESA-N 487.478 5.156 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)c3cc4c(Cl)cncc4s3)CCC2)cc1)c1ccc([N+](=O)[O-])[nH]1 1790185283 MQZIGGVMIBPGKG-UHFFFAOYSA-N 495.948 5.248 5 20 JKBD O=C(NC1(c2ccc(NC(=O)C3(c4cccc([N+](=O)[O-])c4)CCC3)cc2)CCC1)[C@H]1C[C@@]1(F)Cl 1790476332 BRAJDANBASPMQG-NLFFAJNJSA-N 485.943 5.075 5 20 JKBD CC1(C)CCC(CC(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)Cc2ccc(Cl)cc2[N+](=O)[O-])C3)CC1 1800227774 OBHOTUGNVFFIJW-WKCHPHFGSA-N 476.017 5.035 5 20 JKBD CC(C)(C)CCCCCC(=O)N1CC[C@H](CNC(=O)c2ccc([N+](=O)[O-])cc2F)[C@H]1c1cccnc1 1810745930 JEOUGPCMKVXYPP-CJFMBICVSA-N 498.599 5.445 5 20 JKBD CC[C@H](C)[C@@H](C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2ccc([N+](=O)[O-])o2)n[nH]1)c1ccccc1 1814310237 SYQGYXHVEFMRIR-XKDCRVNJSA-N 479.537 5.047 5 20 JKBD CC(C)(C)CCCCCC(=O)N1CCC([C@H]2CCCCN2C(=O)c2ccc([N+](=O)[O-])o2)CC1 1823618059 ORQLSCHCQFKHIR-HXUWFJFHSA-N 461.603 5.418 5 20 JKBD C/C(=C\c1cccs1)C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cc([N+](=O)[O-])c(O)cc2C)CC1 1823718343 DHSQHFWTUAHFPH-RRXSNJIPSA-N 497.617 5.007 5 20 JKBD Cc1cc(C(=O)N2CCCC[C@H]2C2CCN(C(=O)CSc3ccccc3[N+](=O)[O-])CC2)ccc1F 1830570191 RAWVMBMXGPGADZ-QFIPXVFZSA-N 499.608 5.068 5 20 JKBD Cc1c(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)/C=C/C(C)C)CC2)cc(Cl)cc1[N+](=O)[O-] 1830738564 UPGYECARARXBJP-QQUYBBDPSA-N 461.990 5.002 5 20 JKBD c1ccc(-c2ccc3c(c2)oc2cccc(-c4c5ccccc5c(-c5ccccc5)c5ccccc45)c23)cc1 2088642678 WWKYJGZOPBLJKK-UHFFFAOYSA-N 496.609 10.893 5 20 JKBD C[C@H](OC(=O)c1ccc(NCc2ccccc2)c([N+](=O)[O-])c1)C(=O)N1CCC[C@H]1c1cccs1 23768372 WVNBTQIPLQFBHO-UWJYYQICSA-N 479.558 5.177 5 20 JKBD COc1ccc(N[C@@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2C(F)(F)F)cc1Cc1ccccc1 28888973 DBSMQEBUOUOLOQ-HNNXBMFYSA-N 473.451 5.652 5 20 JKBD CSc1ccc(C(=O)c2ccccc2C(=O)Nc2cccc(-c3ccnc(C)n3)c2)cc1[N+](=O)[O-] 33126028 ZCXOINHVVZEZQS-UHFFFAOYSA-N 484.537 5.565 5 20 JKBD COc1ccc(Oc2ccc([N+](=O)[O-])cc2C(=O)Nc2ccccc2I)cc1 33145723 PWXPVUWLIHYNMX-UHFFFAOYSA-N 490.253 5.253 5 20 JKBD CCC(=O)Nc1ccc(NC(=O)c2ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])c(OC)c2)cc1 107916110 GQWGFCPKOXIHPQ-UHFFFAOYSA-N 469.881 5.650 5 20 JKBD COc1ccc(Oc2cc(CNC(=O)CSc3ccc(C(F)(F)F)cc3[N+](=O)[O-])ccn2)cc1 501900708 OWWZLQRPBCEKHD-UHFFFAOYSA-N 493.463 5.218 5 20 JKBD C[C@@H]1CCCN(c2ccc(C(=O)Nc3ccccc3OC[C@@H]3CCCCO3)cc2[N+](=O)[O-])C1 510010638 AUYITQJSZIYARH-QUCCMNQESA-N 453.539 5.031 5 20 JKBD Cc1nc(-c2ccc(F)cc2)sc1[C@@H](C)Nc1cnn(-c2ccc([N+](=O)[O-])cc2)c(=O)c1Cl 511439794 ZMHUUUGBMKTSEV-GFCCVEGCSA-N 485.928 5.538 5 20 JKBD COc1cc(CSc2nnc(-c3ccc4ccccc4c3)o2)c([N+](=O)[O-])cc1OC(F)F 514427682 FWRBEXMIKNNQRH-UHFFFAOYSA-N 459.430 5.700 5 20 JKBD COc1ccc([C@H](C)NC(=O)CSc2ccc(C(F)(F)F)cc2[N+](=O)[O-])cc1Br 515201780 QGHLOVROSDYTTQ-JTQLQIEISA-N 493.301 5.354 5 20 JKBD CCOc1ccc(C(=O)Nc2ccc(NC(=O)c3ccc(F)cc3)cc2C(F)(F)F)cc1[N+](=O)[O-] 515294111 ZHKHLOJFTSJGKL-UHFFFAOYSA-N 491.397 5.656 5 20 JKBD O=C(Nc1cccc(C(F)(F)F)c1)c1ccccc1NCc1nc(-c2cccc([N+](=O)[O-])c2)no1 519873899 CMPWLCJCNCADMJ-UHFFFAOYSA-N 483.406 5.528 5 20 JKBD O=C(Nc1ncc(Cc2ccc(C(F)(F)F)cc2)s1)c1ccn(-c2ccc([N+](=O)[O-])cc2)n1 520021893 FAZJVVHEZLTIPC-UHFFFAOYSA-N 473.436 5.099 5 20 JKBD COc1cc(C(=O)Nc2ccc(Oc3ccccc3)cc2C(F)(F)F)c([N+](=O)[O-])cc1OC(F)F 520653411 MEWWTAYOIOWZGI-UHFFFAOYSA-N 498.360 6.268 5 20 JKBD CCOc1cc(NC(=O)Cc2c(C)nn(-c3ccc(Cl)cc3)c2C)c([N+](=O)[O-])cc1OCC 603733582 CHYHQHLENKMMQD-UHFFFAOYSA-N 472.929 5.029 5 20 JKBD CN(C(=O)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1)[C@H](c1cccc(F)c1)c1cnn(C)c1 608799921 RGRUNLRRPSZNJF-XMMPIXPASA-N 494.910 5.775 5 20 JKBD CCOc1cc([N+](=O)[O-])c(C(=O)Nc2ccc(OCc3cccc(F)c3)cc2C)cc1OC 609064582 GMJIWIKCFQIXON-UHFFFAOYSA-N 454.454 5.281 5 20 JKBD O=C(COC(=O)Cc1csc(-c2cccc(C(F)(F)F)c2)n1)Nc1cc([N+](=O)[O-])ccc1Cl 725969557 MFAZELGWGXTMMD-UHFFFAOYSA-N 499.854 5.115 5 20 JKBD COc1ccc(C[C@@H](N[C@H](C)C(=O)Nc2cc([N+](=O)[O-])ccc2Cl)c2ccccc2)cc1OC 727464516 TYVWSALCLNAARL-IIBYNOLFSA-N 483.952 5.166 5 20 JKBD C[C@H]1CN(c2ccc(NC(=O)c3cc4cc([N+](=O)[O-])ccc4o3)cc2C(F)(F)F)C[C@@H](C)O1 728011098 BZCPSYKKFIYFJA-BETUJISGSA-N 463.412 5.226 5 20 JKBD O=C(NCc1ccccc1-c1ccc(Cn2ccnc2)cc1)c1cc([N+](=O)[O-])ccc1Br 728841673 CBCQHGSETOBGCF-UHFFFAOYSA-N 491.345 5.199 5 20 JKBD Cc1ccc(-c2nnc(-c3ccc(C(=O)N(C)Cc4cc([N+](=O)[O-])ccc4Cl)cc3)o2)cc1 758867394 ZKCLMXUZWASZDS-UHFFFAOYSA-N 462.893 5.546 5 20 JKBD COc1cc(/C=C(/Cl)c2nc(=O)c3ccc(Cl)cc3[nH]2)ccc1OCc1ccc([N+](=O)[O-])cc1 916157462 KRWOHMHSRQVRTO-VXLYETTFSA-N 498.322 5.809 5 20 JKBD C[C@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)Nc1cccc(CN(C)C(=O)OC(C)(C)C)c1 920806694 ZUQDWRLSLZULKQ-AWEZNQCLSA-N 463.918 5.021 5 20 JKBD Cc1cc(C(=O)Oc2ccc(NC(=O)c3ccccc3Br)cc2)cc([N+](=O)[O-])c1 920838672 MEZNTWAMEUKNIF-UHFFFAOYSA-N 455.264 5.137 5 20 JKBD O=C(CC[C@H]1CNc2ccccc2C1)NC1(c2ccc(NC(=O)c3ccc([N+](=O)[O-])o3)cc2)CCC1 1785748547 QJMNRPRWLPBSPI-GOSISDBHSA-N 488.544 5.000 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)c3ccc([N+](=O)[O-])cc3F)CCC2)cc1)c1ccc2cnccc2c1 1789014708 OSXLFESHYISGOX-UHFFFAOYSA-N 484.487 5.344 5 20 JKBD O=C(NC1(c2ccc(NC(=O)c3cccc4ccncc34)cc2)CCC1)c1cc(F)cc([N+](=O)[O-])c1 1790859544 LXQBWKDBHGIFCJ-UHFFFAOYSA-N 484.487 5.344 5 20 JKBD O=C(/C=C/c1cc(F)c(F)c(F)c1)Nc1ccc(C2(NC(=O)c3ccc([N+](=O)[O-])o3)CCC2)cc1 1791502115 KEXCBPTXPPIJIR-KRXBUXKQSA-N 485.418 5.066 5 20 JKBD O=C(NC1(c2ccc(NC(=O)C34CCC(CC3)CC4)cc2)CCC1)c1ccc([N+](=O)[O-])c2c1OCO2 1791980747 JXVRGVLPBSXFHY-UHFFFAOYSA-N 491.544 5.042 5 20 JKBD Cc1cc(Cl)ccc1C(=O)N1CCC2(CCCN(C(=O)CCc3cccc([N+](=O)[O-])c3)C2)CC1 1806486285 FQFKEHBGYULZDU-UHFFFAOYSA-N 483.996 5.034 5 20 JKBD CC(C)c1csc(C(=O)N2CCCC[C@H]2C2CCN(C(=O)CCc3cccc([N+](=O)[O-])c3)CC2)n1 1825383661 UNFPUOWRQSRLLP-QHCPKHFHSA-N 498.649 5.041 5 20 JKBD CC1=CC[C@@H](C(=O)N2CCC([C@@H]3CCCCN3C(=O)C3(c4cccc([N+](=O)[O-])c4)CCC3)CC2)CC1 1830293149 SVLXQVTUAVMDIP-BVAGGSTKSA-N 493.648 5.383 5 20 JKBD C[C@@H](CC(=O)N1CCCC[C@@H]1C1CCN(C(=O)CCc2cccc([N+](=O)[O-])c2)CC1)c1ccccc1 1831503053 HSJVKPYKURTFFK-WXVAWEFUSA-N 491.632 5.341 5 20 JKBD COc1cc(C(=O)N2CCCC[C@H]2C2CCN(C(=O)C[C@@H](C)c3ccccc3)CC2)ccc1[N+](=O)[O-] 1832697227 KRGKBWGPWQTROZ-YKSBVNFPSA-N 493.604 5.031 5 20 JKBD O=C(Nc1ccccc1Oc1ccccc1Cl)c1cc([N+](=O)[O-])ccc1N1CCOCC1 14673755 WZEHPSCOYXQJHQ-UHFFFAOYSA-N 453.882 5.129 5 20 JKBD COc1cc(CN[C@@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2ccccc2)ccc1OC(F)F 15499594 HNEJGCOOISHEIE-OAQYLSRUSA-N 491.878 5.328 5 20 JKBD CC(C)OCCCn1c(S[C@@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)nc2ccccc2c1=O 17723595 ACWQIILUJBWHRC-INIZCTEOSA-N 495.561 5.023 5 20 JKBD Cc1c(NC(=O)[C@H](C)OC(=O)Cc2csc(-c3ccc(C(C)C)cc3)n2)cccc1[N+](=O)[O-] 22390216 OMWUQYWCPXLGSH-INIZCTEOSA-N 467.547 5.263 5 20 JKBD Cc1ccc(/C=C/c2nc(S[C@H](C)C(=O)Nc3nc(-c4cccc([N+](=O)[O-])c4)cs3)n[nH]2)o1 23223179 JHRDLIRTEUVMAE-MMQHEFTJSA-N 482.547 5.028 5 20 JKBD Cc1ccc(CN(C(=O)CCCn2c(=O)oc3cc([N+](=O)[O-])ccc32)[C@@H]2CCc3ccccc32)cc1 68710747 RZXIFYFQHNYORZ-XMMPIXPASA-N 485.540 5.308 5 20 JKBD O=C(COc1ccc([N+](=O)[O-])cc1F)Nc1cccc(C(=O)Nc2cccc(C(F)(F)F)c2)c1 71918632 VHFKLFUHZQKOJA-UHFFFAOYSA-N 477.370 5.023 5 20 JKBD CC(C)n1ncc2c(C(=O)N(Cc3ccccc3[N+](=O)[O-])CC(F)(F)F)cc(-c3ccccc3)nc21 106188525 IFUXKQNYPMJRRQ-UHFFFAOYSA-N 497.477 5.792 5 20 JKBD C[C@@H]1CCC[C@H](OCc2cccc(NC(=O)CCCn3c(=O)oc4cc([N+](=O)[O-])ccc43)c2)C1 303027515 WGHSLVHPNBYFPH-UTKZUKDTSA-N 467.522 5.017 5 20 JKBD C[C@H](Nc1ccc(C(=O)Nc2ccccc2N2C[C@@H](C)O[C@H](C)C2)cc1[N+](=O)[O-])c1ccccn1 410054359 JSBSFADXTMVWJA-QRVBRYPASA-N 475.549 5.029 5 20 JKBD C[C@H](Nc1ccc(C(=O)N(C)c2cccc(OC(F)(F)F)c2)cc1[N+](=O)[O-])c1ccccn1 485507922 CESUKSZQDAQQGC-AWEZNQCLSA-N 460.412 5.338 5 20 JKBD CC(=O)Nc1nc2ccc(NC(=O)c3cc([N+](=O)[O-])ccc3Sc3ccccc3)cc2s1 488519175 YYHKZYIHOSKMNB-UHFFFAOYSA-N 464.528 5.566 5 20 JKBD O=C(Nc1cccc(COCC(F)(F)C(F)F)c1)c1csc(-c2cccc([N+](=O)[O-])c2)n1 498597491 CGNZEYAORICLBM-UHFFFAOYSA-N 469.416 5.388 5 20 JKBD CSc1ccc(C(=O)c2ccccc2C(=O)NCCc2nc3ccccc3s2)cc1[N+](=O)[O-] 500490364 VSTXAULPVJHPJG-UHFFFAOYSA-N 477.567 5.130 5 20 JKBD COc1c(Cl)cc(NC(=O)c2ccc(N[C@H](C)c3ccccn3)c([N+](=O)[O-])c2)cc1Cl 506323421 RXYUXDRAMWCCKX-GFCCVEGCSA-N 461.305 5.731 5 20 JKBD O=C(CSc1ccc(C(F)(F)F)cc1[N+](=O)[O-])N[C@@H](CC(F)(F)F)c1ccccc1 515656028 BUXFFNHTQTXJGY-ZDUSSCGKSA-N 452.376 5.516 5 20 JKBD CSc1ccc([N+](=O)[O-])c(C(=O)Nc2cccc(NC(=O)Nc3cccc4c3CCCC4)c2)c1 517509395 REDZCPDRSHQWDL-UHFFFAOYSA-N 476.558 6.092 5 20 JKBD CC[C@H](NCc1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1)c1nnc2n1CCCCC2 518783638 QGUZFTOINGTOBC-QHCPKHFHSA-N 471.565 5.006 5 20 JKBD Cc1ccc([N+](=O)[O-])cc1NC(=O)c1cnn(-c2ncc(C(F)(F)F)cc2Cl)c1C(F)F 577641061 UULFYCOMVQSIOI-UHFFFAOYSA-N 475.761 5.346 5 20 JKBD CN(C)[C@@H](CNC(=O)C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)c1cccs1 600838716 NQNFIENLXRTOGJ-TVADFSRQSA-N 492.626 5.616 5 20 JKBD CCn1c(SCC(=O)N[C@@H](C)c2cccc([N+](=O)[O-])c2)nnc1-c1ccc(Cl)cc1Cl 603900458 LDMVBTLHVUMIPX-LBPRGKRZSA-N 480.377 5.150 5 20 JKBD C[C@H](Nc1ccc(C(=O)Nc2cccc(-c3cn4cccnc4n3)c2)cc1[N+](=O)[O-])c1ccccn1 604338040 IJESSZSYBIEIRG-KRWDZBQOSA-N 479.500 5.125 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1F)c1c2c(nc3ccccc13)CCN(Cc1ccccc1)C2 608870941 RPOYHCUHLMAJPU-UHFFFAOYSA-N 456.477 5.093 5 20 JKBD O=C(Nc1cccc(/C=C/c2ncc([N+](=O)[O-])cc2C(=O)O)c1)c1ccc(Cl)cc1Cl 609336777 AXSCAJZDCDKVBU-QPJJXVBHSA-N 458.257 5.418 5 20 JKBD C[C@H](OC(=O)[C@H]1C[C@H]1c1ccc(Cl)c(Cl)c1)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 727927052 LNANLQQIKOTEEE-XDTLVQLUSA-N 491.249 5.594 5 20 JKBD O=C(Nc1ccc(OC(=O)c2sccc2SC(F)F)cc1)c1cc([N+](=O)[O-])ccc1Cl 730468985 BDXJEAUEBRHIQF-UHFFFAOYSA-N 484.889 6.096 5 20 JKBD COc1cc(F)c(NC(=O)c2cc([N+](=O)[O-])ccc2N2CCC(Cc3ccccc3)CC2)cc1OC 730504192 QUXNCQKNZJKMAB-UHFFFAOYSA-N 493.535 5.463 5 20 JKBD C[C@H](OC(=O)COc1ccc2ccccc2c1Br)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 746065704 HYAOCMOTOBNNDG-ZDUSSCGKSA-N 498.289 5.244 5 20 JKBD CC(C)OC(=O)C[C@H](NC(=O)c1cc(-c2ccncc2)nc2ccccc12)c1ccccc1[N+](=O)[O-] 789839154 BTPCCRKMDFGXSO-DEOSSOPVSA-N 484.512 5.018 5 20 JKBD O=C1/C(=C/c2ccc(-c3ccc([N+](=O)[O-])cc3)o2)NC(=S)N1c1ccccc1C(F)(F)F 917606474 RXDDRJULBRJOTH-WJDWOHSUSA-N 459.405 5.136 5 20 JKBD CCOc1ccsc1C(=O)Nc1ccc(C2(NC(=O)c3cc([N+](=O)[O-])c(O)cc3C)CCC2)cc1 1785774419 VUMWXSBHIRCCIC-UHFFFAOYSA-N 495.557 5.131 5 20 JKBD O=C(/C=C/c1ccc([N+](=O)[O-])o1)NC1(c2ccc(NC(=O)c3cc(F)c(F)cc3F)cc2)CCC1 1790633621 MSJCJRMAGSSHDY-SOFGYWHQSA-N 485.418 5.066 5 20 JKBD CCn1nc(C(C)C)cc1C(=O)NC1(c2ccc(NC(=O)c3cc(F)cc([N+](=O)[O-])c3)cc2)CCC1 1790697677 LGMHIABQGMHJIJ-UHFFFAOYSA-N 493.539 5.135 5 20 JKBD O=C(NC1(c2ccc(NC(=O)c3cccc(F)c3[N+](=O)[O-])cc2)CCC1)c1ccc2ccoc2c1 1790699271 YQFRYEUWPFFDER-UHFFFAOYSA-N 473.460 5.542 5 20 JKBD O=C(NC1(c2ccc(NC(=O)[C@@H]3[C@H]4C=CS[C@H]43)cc2)CCC1)c1cc2cc([N+](=O)[O-])ccc2s1 1791093684 QFWUBXPEGRRQOM-STZQEDGTSA-N 491.594 5.432 5 20 JKBD O=C(NC1(c2ccc(NC(=O)[C@@H]3C[C@@]3(F)Cl)cc2)CCC1)c1cc2cc([N+](=O)[O-])ccc2s1 1791675832 AXYLZYRJPAOCFG-SBUREZEXSA-N 487.940 5.482 5 20 JKBD Cc1c(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)[C@H](C)Sc2cccs2)cc(Cl)cc1[N+](=O)[O-] 1798285094 NOWBMIPEIKHQGP-LLLHUVSDSA-N 494.038 5.051 5 20 JKBD Cc1cc(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3cc4sccc4s3)CC2)ncc1[N+](=O)[O-] 1827828161 PCGYPEZPBCYUQP-GOSISDBHSA-N 498.630 5.122 5 20 JKBD O=C(Cc1cc(F)ccc1[N+](=O)[O-])N1CCC([C@@H]2CCCCN2C(=O)/C=C/C2CCCCC2)CC1 1830356114 GWOCMYFSHLLETG-LUFJGRFYSA-N 485.600 5.033 5 20 JKBD Cc1ccc([C@@H](C)C(=O)N2CCC([C@H]3CCCCN3C(=O)c3cccc(F)c3[N+](=O)[O-])CC2)cc1 1830623634 XGJLPVOYPGWXJW-NTKDMRAZSA-N 481.568 5.079 5 20 JKBD Cc1c(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)[C@@H]3CCC(F)(F)C3)CC2)cc(Cl)cc1[N+](=O)[O-] 1830734248 GQTHLNRPOGBSOQ-YLJYHZDGSA-N 497.970 5.225 5 20 JKBD Cc1ccc(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)CCc3cccc([N+](=O)[O-])c3)CC2)c(F)c1F 1832611493 JRCNBTRZZRDEEK-HSZRJFAPSA-N 499.558 5.048 5 20 JKBD O=C([C@@H]1C[C@@H]1c1ccccc1)N1CCC([C@@H]2CCCCN2C(=O)/C=C/c2ccccc2[N+](=O)[O-])CC1 1832904236 PUUVUANDPFPEBB-VOYQLMGGSA-N 487.600 5.031 5 20 JKBD Cc1sc2nc(COC(=O)c3ccccc3C(=O)c3ccc(Cl)c([N+](=O)[O-])c3)nc(N)c2c1C 10390135 CGVJKNBGJCPQSH-UHFFFAOYSA-N 496.932 5.040 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Cl)[C@H](Nc1cccc(C2SCCS2)c1)c1ccccc1 15500389 VWXPRFGVZBOPLZ-OAQYLSRUSA-N 486.018 6.519 5 20 JKBD Cc1nn(Cc2ccc(C(=O)O[C@@H](C)C(=O)Nc3ccccc3-c3ccccc3)cc2)c(C)c1[N+](=O)[O-] 17158872 CTVKOBFRRKIRJB-FQEVSTJZSA-N 498.539 5.307 5 20 JKBD CCOc1cc([N+](=O)[O-])c(C(=O)Nc2nc3ccc(Oc4ccccc4)cc3s2)cc1OC 19202299 DPPUQPCIJKZIOF-UHFFFAOYSA-N 465.487 5.656 5 20 JKBD CCn1c(SCC(=O)Nc2ccc(N3CCCC3)cc2C)nc2cc3ccccc3cc2c1=O 19241445 ARKSIPOWVDUGSW-UHFFFAOYSA-N 472.614 5.209 5 20 JKBD CCn1c(SCc2csc(-c3ccccc3OC)n2)nc2cc3ccccc3cc2c1=O 22178418 NBBLCGYEMUUACI-UHFFFAOYSA-N 459.596 5.994 5 20 JKBD CCN(CC)c1ccc(-c2nnc(SCc3nc(-c4ccc([N+](=O)[O-])cc4)no3)n2CC)cc1 107841581 KDSQEBDWGRTRKG-UHFFFAOYSA-N 479.566 5.062 5 20 JKBD C[C@@H](Cc1nnc(SCC(=O)Nc2ccc([N+](=O)[O-])cc2C(F)(F)F)o1)c1ccccc1 255937672 KIDHBQROFHXLRI-LBPRGKRZSA-N 466.441 5.074 5 20 JKBD Cc1cc(C)c(NC(=O)CNCc2ccc(Oc3ccccc3Cl)c([N+](=O)[O-])c2)c(C)c1 409522300 VNVHHYGBELJNMP-UHFFFAOYSA-N 453.926 5.694 5 20 JKBD CCOc1ccc([C@@H](CNC(=O)c2cc(OC)ccc2[N+](=O)[O-])c2c[nH]c3ccccc23)cc1OC 410093935 LDVNJUSNZFOPOO-OAQYLSRUSA-N 489.528 5.054 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)Nc2cc(C(=O)Nc3ccccc3)ccc2Cl)cc1SC 482542037 FJNWTVIXONPHKH-UHFFFAOYSA-N 471.922 5.483 5 20 JKBD CSc1ccc(C(=O)c2ccccc2C(=O)Nc2ccc(Cn3cccn3)cc2)cc1[N+](=O)[O-] 486578424 HUEDMJUTVNBTHU-UHFFFAOYSA-N 472.526 5.045 5 20 JKBD COc1ccc(CSCC(=O)Nc2ccc(C(=O)N3CCCC[C@@H]3C)c(Cl)c2)cc1[N+](=O)[O-] 496933654 WRSBWWFQLYZZRB-HNNXBMFYSA-N 491.997 5.143 5 20 JKBD O=C(Nc1ccc(Oc2ccncc2)cc1)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 497320956 ZJIQKHJRDZHWTQ-UHFFFAOYSA-N 486.450 5.656 5 20 JKBD Cn1cnnc1Sc1ccc(C(=O)N[C@@H](c2ccc(F)cc2)c2ccccc2Cl)cc1[N+](=O)[O-] 502343443 FCGJAOSWWXFZRC-NRFANRHFSA-N 497.939 5.186 5 20 JKBD Cc1csc(Sc2ccc(C(=O)N[C@H](C)c3ccc(NC(=O)NC4CC4)cc3)cc2[N+](=O)[O-])n1 515161670 PVPASDBIHFOORY-CQSZACIVSA-N 497.602 5.286 5 20 JKBD C[C@@H]1CN(Cc2cccc(CNCc3ccc(Oc4ccc(F)cc4)c([N+](=O)[O-])c3)c2)CCO1 517549415 PSWILMZGNRJNNA-LJQANCHMSA-N 465.525 5.037 5 20 JKBD O=[N+]([O-])c1ccc(-c2ccc(CNCc3ccc(OC(F)F)cc3)o2)c(Br)c1 520210383 LBIZXSVSYLPQKS-UHFFFAOYSA-N 453.239 5.509 5 20 JKBD COc1ccc(CCNC(=O)C/C(=C\c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)cc1 603468874 RMCBZDRGLREWGI-CAPFRKAQSA-N 473.554 5.503 5 20 JKBD O=C(C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1)N1CCC[C@H]1c1ccsc1 603671926 KVJYKGNVRHWSRA-KRWDZBQOSA-N 453.486 5.255 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Cl)C(=O)N[C@@H](c1ccc2c(c1)CCCC2)c1cccs1 603708832 QHEBCOOMXCLHHY-NRFANRHFSA-N 469.950 5.033 5 20 JKBD O=[N+]([O-])c1ccc(-c2nn(-c3ccccc3)cc2CN[C@@H](c2ccc3c(c2)OCCO3)C2CC2)cc1 608836466 JBIVIOYUUOHRBJ-HHHXNRCGSA-N 482.540 5.460 5 20 JKBD COCCc1ccc(Oc2ccc(NC(=O)c3ccn(-c4cccc([N+](=O)[O-])c4)n3)cc2)cc1 609375870 QGYYDPAQUGPNAM-UHFFFAOYSA-N 458.474 5.014 5 20 JKBD CC(C)(C)c1nc(CC(=O)Oc2ccc3c(-c4ccc([N+](=O)[O-])cc4)cc(=O)oc3c2)cs1 726753289 YPJBOPTVAJWIGR-UHFFFAOYSA-N 464.499 5.270 5 20 JKBD CC(C)c1cccc(O[C@@H](C(=O)OCc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)c2ccccc2)c1 730643641 OFPGROWSRPWFAX-XMMPIXPASA-N 473.485 5.632 5 20 JKBD O=C(Cn1c2ccccc2c(=O)c2ccccc21)Oc1c(Cl)cc(Br)cc1Cl 731178768 PNPXRBLAKYMJCZ-UHFFFAOYSA-N 477.141 5.830 5 20 JKBD COC(=O)c1c(-c2ccccc2Cl)csc1NC(=O)c1ccc([N+](=O)[O-])cc1Cl 747614210 GCMOCQRGRVKKBW-UHFFFAOYSA-N 451.287 5.669 5 20 JKBD Cc1c(C(=O)O[C@H](C)C(=O)N2c3ccccc3Sc3ccccc32)cc([N+](=O)[O-])c(C)c1[N+](=O)[O-] 748952466 VOWZUVKSQSMTPV-OAHLLOKOSA-N 493.497 5.495 5 20 JKBD O=C(COC(=O)c1cc(-c2cccnc2)nc2ccccc12)Nc1ccc(C(F)(F)F)cc1[N+](=O)[O-] 793112222 YMUIQWGTCROAGD-UHFFFAOYSA-N 496.401 5.019 5 20 JKBD Cc1cc[n+](/C(C(=S)Nc2ccccc2C(F)(F)F)=C(/O)c2cccc([N+](=O)[O-])c2)cc1 912791394 KWUIPGUCBXXGQR-UHFFFAOYSA-O 460.457 5.533 5 20 JKBD Cc1c(NC(=O)c2ccccc2OCC(=O)Nc2ccc(SC(F)F)cc2)cccc1[N+](=O)[O-] 913413041 UGMXAVPNDOGHOU-UHFFFAOYSA-N 487.484 5.488 5 20 JKBD Cc1cc(-c2cc(C(=O)OCc3nc(-c4cccc([N+](=O)[O-])c4)no3)c3c(C)noc3n2)c(C)s1 914901887 CFNBSBTVIQSSOO-UHFFFAOYSA-N 491.485 5.192 5 20 JKBD Cc1[nH]c2ccc(Br)cc2c1CC(=O)N(C)Cc1cc([N+](=O)[O-])ccc1Cl 915068235 YMQZSPRPARYQIE-UHFFFAOYSA-N 450.720 5.002 5 20 JKBD CC(=O)N(c1ccc(C(F)(F)F)cc1)c1nc(COC(=O)c2ccc(Cl)c([N+](=O)[O-])c2)cs1 920497055 UJNIBMIMZSTEOW-UHFFFAOYSA-N 499.854 5.765 5 20 JKBD O=C(NC1(c2ccc(NC(=O)c3cc4c(Cl)cncc4s3)cc2)CCC1)c1ccc([N+](=O)[O-])o1 1788312726 QVOHASLFJZRNEJ-UHFFFAOYSA-N 496.932 5.512 5 20 JKBD O=C(CCc1ccc[nH]1)NC1(c2ccc(NC(=O)C3(c4cccc([N+](=O)[O-])c4)CCC3)cc2)CCC1 1790476000 RLAFHKYRSWLWCH-UHFFFAOYSA-N 486.572 5.112 5 20 JKBD COc1cc(CC(=O)Nc2ccc(C3(NC(=O)/C=C/C4CCCC4)CCC3)cc2)ccc1[N+](=O)[O-] 1790479522 OVKVAKCCOLHZPM-RIYZIHGNSA-N 477.561 5.026 5 20 JKBD Cc1ccc(CC(=O)Nc2ccc(C3(NC(=O)c4cccc5cnccc45)CCC3)cc2)cc1[N+](=O)[O-] 1790524841 QTOADFLHXBNCKA-UHFFFAOYSA-N 494.551 5.442 5 20 JKBD Cc1ccc2c(/C=C/C(=O)Nc3ccc(C4(NC(=O)c5ccc([N+](=O)[O-])[nH]5)CCC4)cc3)c[nH]c2c1 1792364573 XNQJJHHZNIFFPZ-UUILKARUSA-N 483.528 5.174 5 20 JKBD Cc1c(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)/C=C/c2ccccc2[N+](=O)[O-])C3)[nH]c2c(Cl)cccc12 1796704120 NAYRAVJGOPEUHK-UNGCYLFBSA-N 492.963 5.003 5 20 JKBD O=C(c1cc(F)cc([N+](=O)[O-])c1)N1CCC([C@@H]2CCCCN2C(=O)c2ccc3occc3c2)CC1 1828258408 PLGUQATWBKQLMD-QHCPKHFHSA-N 479.508 5.027 5 20 JKBD Cc1cccc2cc(C(=O)N3CCC([C@@H]4CCCCN4C(=O)c4cc(F)cc([N+](=O)[O-])c4)CC3)[nH]c12 1830617492 RHUJVEFCVGQJLT-DEOSSOPVSA-N 492.551 5.071 5 20 JKBD CCC[C@H]1CC[C@H](C(=O)N2CCCC[C@@H]2C2CCN(C(=O)/C=C/c3ccc([N+](=O)[O-])o3)CC2)CC1 1831561499 LMZXWJZHYRBSAZ-FPFOLYEOSA-N 485.625 5.427 5 20 JKBD O=C(c1ccc([N+](=O)[O-])cc1)N(C[C@@H]1CCCO1)c1nc(-c2ccc(Cl)cc2Cl)cs1 14819631 PMHIDSCGXPZPGG-INIZCTEOSA-N 478.357 5.851 5 20 JKBD CCOc1ccc([C@@H](CNC(=O)c2ccc([N+](=O)[O-])cc2Cl)c2c[nH]c3ccccc23)cc1OC 18136634 ZCKBHNZJZLAABF-HXUWFJFHSA-N 493.947 5.699 5 20 JKBD Cc1nc2cc(N[C@H](C(=O)Nc3ccc([N+](=O)[O-])cc3Br)c3ccccc3)ccc2o1 21794643 WFINIOFSZUTPAL-NRFANRHFSA-N 481.306 5.599 5 20 JKBD O=C(CS[C@@H](c1ccccc1)c1ccc(Cl)cc1)OCc1nnc(-c2ccc([N+](=O)[O-])cc2)o1 22525189 RUMKJQKFERVDOH-QHCPKHFHSA-N 495.944 5.864 5 20 JKBD Cc1ccc(-n2c(Cc3ccccc3)nnc2SCC(=O)Nc2c(C)cccc2[N+](=O)[O-])c(C)c1 23537043 SPMZDJYCQAOSRY-UHFFFAOYSA-N 487.585 5.422 5 20 JKBD CC(C)C(=O)Nc1ccc(N[C@@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2ccccc2)cc1 25426433 ZAOUYELSFPWGAL-JOCHJYFZSA-N 466.925 5.635 5 20 JKBD COc1cc(C(=O)Nc2ccc(-c3nc4ccc(C)cc4s3)cc2)c([N+](=O)[O-])cc1OC(F)F 25982507 HVDSUAPHFCCAMY-UHFFFAOYSA-N 485.468 6.042 5 20 JKBD O=C(NCc1nnc2ccc(C(F)(F)F)cn12)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1 28719541 BNUGVGMIECESEE-UHFFFAOYSA-N 491.813 5.032 5 20 JKBD CCC(C)(C)NC(=O)c1ccc(NC(=O)c2csc(-c3ccc([N+](=O)[O-])cc3)n2)cc1Cl 495505161 ZHZCOAADOVJSHP-UHFFFAOYSA-N 472.954 5.542 5 20 JKBD CC(=O)c1oc2ccccc2c1NC(=O)[C@@H](C)Sc1nc2cc3ccccc3cc2c(=O)n1C 498102538 RGUKUVJOKBRGKG-OAHLLOKOSA-N 471.538 5.155 5 20 JKBD Cn1cc(C(=O)Nc2nc(-c3ccc(Br)cc3)cs2)c(-c2ccc([N+](=O)[O-])cc2)n1 506218474 IDGFNDJRTSDHLY-UHFFFAOYSA-N 484.335 5.134 5 20 JKBD O=C(Nc1nc(-c2ccc(OC(F)F)cc2OC(F)F)cs1)c1ccc([N+](=O)[O-])cc1F 520327174 CIBMLHAWWCNCSV-UHFFFAOYSA-N 475.351 5.313 5 20 JKBD O=C(Nc1cc([N+](=O)[O-])ccc1OC(F)F)c1ccccc1-c1ncc(-c2ccccc2F)o1 521549089 AMNBSHAANGPXLI-UHFFFAOYSA-N 469.375 5.910 5 20 JKBD C[C@H]1CCN(C(=O)c2cnn(-c3ccc([N+](=O)[O-])cc3)c2)c2cc(C(F)(F)F)ccc2S1 603961592 HHQOSMUXNYRIBJ-ZDUSSCGKSA-N 462.453 5.330 5 20 JKBD O=C(N[C@H](CC(F)(F)F)c1ccccc1)N1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 604103656 BKEFMRCMZJLOHH-MRXNPFEDSA-N 490.404 5.139 5 20 JKBD CCN(Cc1cccc(F)c1)C(=O)Cc1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1 604564189 OMCBEFKFHPZRNK-UHFFFAOYSA-N 458.493 5.178 5 20 JKBD COC1CCN(c2ccc(NC(=O)c3ccc(Cl)c([N+](=O)[O-])c3)cc2C(F)(F)F)CC1 728013357 YJRHMQGADVHWMZ-UHFFFAOYSA-N 457.836 5.135 5 20 JKBD O=C(OC[C@@H]1CCCN1C(=O)c1ccccc1[N+](=O)[O-])c1nc(-c2ccccc2)oc1-c1ccccc1 731414491 UEIAMWYQXZDVTG-NRFANRHFSA-N 497.507 5.378 5 20 JKBD C[C@H]1CN(c2ccc(NC(=O)c3ccc(NCc4ccccc4)c([N+](=O)[O-])c3)cc2)C[C@H](C)O1 747435438 YDPKVJMVZNIFBS-OALUTQOASA-N 460.534 5.073 5 20 JKBD O=C(Nc1nc(-c2ccc(OC(F)F)cc2)cs1)c1cc([N+](=O)[O-])ccc1Br 751080022 RTOGSFJGLPGDJN-UHFFFAOYSA-N 470.251 5.335 5 20 JKBD CC(C)N(Cc1nnc(-c2cccc([N+](=O)[O-])c2)o1)C(=O)c1cc(Br)ccc1Cl 864244974 XISUICAZOVXBPP-UHFFFAOYSA-N 479.718 5.112 5 20 JKBD O=C(NCc1ccc(-n2ccnc2)nc1)c1ccccc1Sc1ccc(C(F)(F)F)cc1[N+](=O)[O-] 914723703 VUBZVRWQVGVMAC-UHFFFAOYSA-N 499.474 5.276 5 20 JKBD C[C@@H](OC(=O)[C@@H]1CCCN(C(=O)c2ccc(Cl)c(Cl)c2)C1)c1cccc([N+](=O)[O-])c1 915020431 RJOCIRFQOLIYRO-CZUORRHYSA-N 451.306 5.058 5 20 JKBD O=C(Nc1ccc(Cl)cc1Cl)[C@H]1CCCCN1C(=O)c1ccc(Cl)c([N+](=O)[O-])c1 915159408 NVJXXKFVTOXCEN-MRXNPFEDSA-N 456.713 5.188 5 20 JKBD COc1cc(C(=O)Nc2ccc(N3CCC(O)CC3)cc2)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 915644319 XBVHGFJTIRXNNZ-UHFFFAOYSA-N 497.935 5.263 5 20 JKBD O=C(Nc1cc([N+](=O)[O-])c(F)cc1F)c1ccc(Oc2ccc(Br)cc2)nc1 916135251 OJAZZTFJYPXSEH-UHFFFAOYSA-N 450.195 5.075 5 20 JKBD O=C(OCC(=O)N1CCC[C@@H]1c1ccc(Cl)c(Cl)c1)c1ccc([N+](=O)[O-])cc1Cl 918855399 OGDQPBDLPQGCIG-QGZVFWFLSA-N 457.697 5.076 5 20 JKBD O=C(Cn1c2ccccc2c(=O)c2ccccc21)Oc1ccc(-c2ccccc2)cc1[N+](=O)[O-] 920331129 VPMANVIJMPIXQU-UHFFFAOYSA-N 450.450 5.336 5 20 JKBD C[C@H](OC(=O)c1cn(C)nc1-c1ccc([N+](=O)[O-])cc1)c1cccc(NC(=O)c2ccccc2)c1 920554995 XBMNBEQQKTUWRD-KRWDZBQOSA-N 470.485 5.166 5 20 JKBD Cc1cc(C(=O)Nc2ccc(C3(NC(=O)CSc4ccccc4[N+](=O)[O-])CCC3)cc2)cnc1C 1787009806 CJTPXGAHLVEVFW-UHFFFAOYSA-N 490.585 5.147 5 20 JKBD CC1(C)CCC(CC(=O)N2CC[C@@H](CNC(=O)c3cccc(F)c3[N+](=O)[O-])[C@H]2c2cccnc2)CC1 1811319995 GGAMLKCDBKIZCF-GBXCKJPGSA-N 496.583 5.055 5 20 JKBD COc1ccc(-c2nnc(Sc3ccc(C(F)(F)F)cc3[N+](=O)[O-])n2C[C@H]2CCCO2)cc1 15130908 DQTCNVXRUGPQKP-MRXNPFEDSA-N 480.468 5.211 5 20 JKBD C[C@@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)Nc1cccc(S(=O)(=O)Nc2ccccc2Cl)c1 22591089 OAKJYGRAYUJAFO-CQSZACIVSA-N 491.978 5.168 5 20 JKBD Cc1c(-c2ccccc2)sc(NC(=O)Cc2ccccc2[N+](=O)[O-])c1C(=O)N1CCCCC1 23271920 MMBHUZKRUVXARH-UHFFFAOYSA-N 463.559 5.439 5 20 JKBD CC(C)n1c(S[C@H](C)C(=O)Nc2cc([N+](=O)[O-])ccc2Cl)nc2cc(Cl)ccc2c1=O 24966638 NGNSYJRVWCFWBG-LLVKDONJSA-N 481.361 5.312 5 20 JKBD Cc1ccc(NC(=O)[C@H](Sc2nc3sc(C)c(C)c3c(=O)n2C)c2ccccc2)c([N+](=O)[O-])c1 25023984 LYILGVQIISPMAQ-HXUWFJFHSA-N 494.598 5.301 5 20 JKBD Cc1cccc(-c2nnc(S[C@H](C)C(=O)Nc3cccc([N+](=O)[O-])c3C)n2Cc2ccco2)c1 26488490 VQAUSCXMAQAUJY-QGZVFWFLSA-N 477.546 5.231 5 20 JKBD C[C@H](Sc1nnc(C2CC2)n1-c1ccccc1)C(=O)Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1 28797912 CENFUTADHUCINN-AWEZNQCLSA-N 492.586 5.296 5 20 JKBD Cc1nc(-c2ccc(N[C@@H](C)C(=O)Nc3ccc([N+](=O)[O-])cc3C(F)(F)F)cc2)cs1 28912579 QZILOIUVSDGWNL-NSHDSACASA-N 450.442 5.485 5 20 JKBD C[C@H](NC(=O)c1ccc(N2CCCC2)c([N+](=O)[O-])c1)c1ccc(NC(=O)Nc2ccccc2)cc1 71958896 XTMXTDKQLMDNAS-SFHVURJKSA-N 473.533 5.330 5 20 JKBD C[C@H](Nc1ccc(C(=O)Nc2ncccc2OCC2CCCCC2)cc1[N+](=O)[O-])c1ccccn1 109862260 COAHAZXNONLZTM-SFHVURJKSA-N 475.549 5.769 5 20 JKBD Cc1nn(Cc2ccc(C(=O)Nc3cccc(Cl)c3SC(F)F)cc2)c(C)c1[N+](=O)[O-] 110209414 ATDVYKHUXHRKAC-UHFFFAOYSA-N 466.897 5.677 5 20 JKBD O=C(NCc1cccnc1OCC(F)(F)F)c1cc([N+](=O)[O-])ccc1Sc1ccccc1 477435837 IXGNDFSEQUCODE-UHFFFAOYSA-N 463.437 5.012 5 20 JKBD COCCN(C(=O)[C@H](C)c1ccc2cc(OC)ccc2c1)c1nc(-c2ccc([N+](=O)[O-])cc2)cs1 483263619 BBIKBSVNYYAHRN-QGZVFWFLSA-N 491.569 5.663 5 20 JKBD CCCn1c(S[C@@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)nc2ccc(C(F)(F)F)cc21 501236276 SSSKUCCLDRLUIK-LBPRGKRZSA-N 477.468 6.277 5 20 JKBD Cc1c(C(=O)Nc2ccc(CNC(=O)c3ccc(C(F)(F)F)cc3)cc2)cccc1[N+](=O)[O-] 502550209 HZFULRTVEFIQBQ-UHFFFAOYSA-N 457.408 5.104 5 20 JKBD CC(C)CN1CCC(NC(=O)C/C(=C/c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)CC1 502625608 LWTNLRPGGYIGLA-HKWRFOASSA-N 478.618 5.372 5 20 JKBD CCOc1cc(CN[C@H]2CCSc3ccc(F)cc32)ccc1OCCn1c([N+](=O)[O-])cnc1C 507947702 FNODTNLNYJANEM-FQEVSTJZSA-N 486.569 5.043 5 20 JKBD CC(C)c1nccn1Cc1cccc(NC(=O)NCCNc2ccc(C(F)(F)F)cc2[N+](=O)[O-])c1 509891918 ZAQIXNXIHPAIQU-UHFFFAOYSA-N 490.486 5.215 5 20 JKBD CSc1ccc([C@H](CNc2cc3ncnc(O)c3cc2[N+](=O)[O-])N2CCc3sccc3C2)cc1 515550211 GLQYCLGXSNXSBY-QFIPXVFZSA-N 493.614 5.239 5 20 JKBD C[C@@H](Nc1ccc(C(=O)N2CCC[C@H](c3nc4ccccc4s3)C2)cc1[N+](=O)[O-])c1ccccn1 518421824 XMTPNLWMLHIVTF-MJGOQNOKSA-N 487.585 5.792 5 20 JKBD COc1cc(/C=C(\c2ccncc2)c2ccc([N+](=O)[O-])cc2)cc(I)c1OC 520116003 CEPVCZJQYQWYAV-WQRHYEAKSA-N 488.281 5.201 5 20 JKBD CSc1ccc(C(=O)Nc2ccc(=O)n(Cc3ccc(Cl)c(Cl)c3)c2)cc1[N+](=O)[O-] 520959257 SPLVMOAWFXGNQE-UHFFFAOYSA-N 464.330 5.086 5 20 JKBD CC(C)(C)N1CCCN(C(=O)C/C(=C/c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)CC1 521141528 FYLBDFZOLIYMCM-JZJYNLBNSA-N 478.618 5.468 5 20 JKBD COc1ccc(Br)cc1[C@H]1CCCN1C(=O)Nc1cc([N+](=O)[O-])ccc1OC(F)F 522955974 YBQZRBKDYLKNPK-OAHLLOKOSA-N 486.269 5.336 5 20 JKBD COc1ccc(Sc2ccc(NC(=O)c3ccc(S(C)(=O)=O)c([N+](=O)[O-])c3)cc2Cl)cc1 557484915 UGEQRXWRFVIJKA-UHFFFAOYSA-N 492.962 5.064 5 20 JKBD Cc1cccc(NC(=O)c2ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])cc2)c1C(=O)N1CCCC1 603756096 ATJRXEZAJMKRBM-UHFFFAOYSA-N 479.920 5.837 5 20 JKBD O=C(NCc1ccc(OCc2ccccc2)cc1)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-] 603871335 WIPFZJTZDDOOEB-UHFFFAOYSA-N 460.408 5.045 5 20 JKBD CC(C)CCSc1ccc(C(=O)NC2CCN(C(=O)CCc3ccccc3)CC2)cc1[N+](=O)[O-] 603905775 RSTOMLRFMVGOPX-UHFFFAOYSA-N 483.634 5.087 5 20 JKBD CN(C[C@H]1CCCO[C@@H]1c1ccccc1)C(=O)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1 604519243 WKNMMEZXXMCVGM-CJFMBICVSA-N 480.948 6.280 5 20 JKBD COc1cccc(N2CC[C@H](CNCc3ccc(Oc4ccc(F)cc4)c([N+](=O)[O-])c3)C2)c1 608837854 RAIAZPNZRZTXHK-LJQANCHMSA-N 451.498 5.151 5 20 JKBD O=C(Cn1cc(-c2ccc([N+](=O)[O-])cc2)cn1)N1N=C(c2cc3ccccc3o2)C[C@H]1c1ccco1 609150770 NXBPMXGWFCVPAQ-QFIPXVFZSA-N 481.468 5.175 5 20 JKBD CC[C@H](NC(=O)c1ccccc1C(=O)c1ccc(SC)c([N+](=O)[O-])c1)c1nc(C)cs1 609191814 IRQXMHHIBMKBGS-KRWDZBQOSA-N 455.561 5.194 5 20 JKBD CCOc1cc(NC(=O)c2c(-c3c(F)cccc3Cl)noc2C)c([N+](=O)[O-])cc1OCC 619213001 RRKBWXXKZWRMFA-UHFFFAOYSA-N 463.849 5.400 5 20 JKBD CSc1ccc2cc(COC(=O)[C@H]3CCCN3C(=O)c3ccc([N+](=O)[O-])c(C)c3)c(Cl)nc2c1 726676459 RSMAGDLBIFPUGV-OAQYLSRUSA-N 499.976 5.175 5 20 JKBD C[C@H](Nc1ccc(OCc2cccnc2)cc1)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 728592268 BEBAVHSTBYHDRU-AWEZNQCLSA-N 460.412 5.027 5 20 JKBD Cc1cccc(-c2nnc([C@H](C)OC(=O)CCNc3ccc(C(F)(F)F)cc3[N+](=O)[O-])o2)c1 750503628 AIVKDMPRCXPFAJ-ZDUSSCGKSA-N 464.400 5.078 5 20 JKBD C[C@H](OC(=O)CCc1ccc(-c2ccccc2F)o1)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 762411044 SCIXATTUVPKGCZ-AWEZNQCLSA-N 451.410 5.281 5 20 JKBD O=C(Cc1cc(F)cc2c1OCOC2)Nc1cc(Cl)c([N+](=O)[O-])cc1OCc1ccccc1 783483606 CMLHAOZNRIUMGF-UHFFFAOYSA-N 472.856 5.014 5 20 JKBD Cc1ccc(Cn2nc(C)c(C(=O)Nc3nc(-c4cccc([N+](=O)[O-])c4)cs3)c2Cl)cc1 871590332 MRGAGQGZIRWZOV-UHFFFAOYSA-N 467.938 5.486 5 20 JKBD C[C@H](Oc1ccc(Cl)cc1[N+](=O)[O-])c1nc(-c2cccc(OCc3cccnc3)c2)no1 904502118 XYLCQTPNVFSREF-AWEZNQCLSA-N 452.854 5.412 5 20 JKBD CCOc1cc(C(=O)O[C@@H](C)c2cccc(NC(=O)c3ccccc3)c2)c([N+](=O)[O-])cc1OC 918903866 UDTYOJWHGHQHQM-INIZCTEOSA-N 464.474 5.172 5 20 JKBD C[C@H](OC(=O)[C@@H](C)Sc1ccc(Br)cc1)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl 919468532 WMZJQPIBSFCILL-WDEREUQCSA-N 487.759 5.062 5 20 JKBD CCOc1ccc([N+](=O)[O-])cc1COC(=O)CCc1ncc(-c2ccccc2Br)o1 920121949 XAIAJKKQYOUJNR-UHFFFAOYSA-N 475.295 5.087 5 20 JKBD C[C@H](Nc1ccc(C(=O)OCc2nc3cc(Cl)ccc3n2C)cc1[N+](=O)[O-])c1ccccn1 920544922 NNZTYJZEJPHYSK-AWEZNQCLSA-N 465.897 5.060 5 20 JKBD O=C(NC1(c2ccc(NC(=O)c3ccc([N+](=O)[O-])o3)cc2)CCC1)c1ccc(N2CCCCC2)cc1 1785751013 FHLWCEDNELSSBH-UHFFFAOYSA-N 488.544 5.240 5 20 JKBD CN(C)c1ccc([N+](=O)[O-])c(C(=O)Nc2ccc(C3(NC(=O)CCCC(F)(F)F)CCC3)cc2)c1 1790054952 MJXACFOGQXPGQG-UHFFFAOYSA-N 492.498 5.141 5 20 JKBD O=C(NC1(c2ccc(NC(=O)c3cccc4c3oc3ccccc34)cc2)CCC1)c1ccc([N+](=O)[O-])[nH]1 1791008585 LHRDPYNBXZGVOI-UHFFFAOYSA-N 494.507 5.884 5 20 JKBD CC(C)c1cc(C(=O)NC2(c3ccc(NC(=O)CSc4ccccc4[N+](=O)[O-])cc3)CCC2)no1 1791521487 MEEMBEFTZQQHAE-UHFFFAOYSA-N 494.573 5.246 5 20 JKBD C[C@H](CC(=O)N1CCCC[C@@H]1c1cc(NC(=O)CCc2cccc([N+](=O)[O-])c2)n[nH]1)c1ccccc1 1815538439 JRLKKDRYUPPXLY-NTKDMRAZSA-N 489.576 5.137 5 20 JKBD Cc1c(C(=O)Nc2cc([C@H]3CCCCN3C(=O)c3cccc(F)c3[N+](=O)[O-])[nH]n2)oc2ccccc12 1818569748 JFZBGBACDVLRTP-LJQANCHMSA-N 491.479 5.131 5 20 JKBD Cc1ccc(CC(=O)Nc2cc([C@H]3CCCCN3C(=O)c3ccc(C4CC4)cc3)[nH]n2)cc1[N+](=O)[O-] 1820918459 BAARRFOXLZHEMM-HSZRJFAPSA-N 487.560 5.052 5 20 JKBD Cc1cc2cc(C(=O)N3CCCC[C@H]3c3cc(NC(=O)/C=C/c4ccccc4[N+](=O)[O-])n[nH]3)ccc2[nH]1 1823503025 HVMCXAGWXHYNJJ-YKATVRGKSA-N 498.543 5.127 5 20 JKBD Cc1ccc(C(=O)N2CCCC[C@H]2C2CCN(C(=O)c3cc4cc([N+](=O)[O-])ccc4s3)CC2)o1 1824684974 BUWVZWYITNOAJP-FQEVSTJZSA-N 481.574 5.258 5 20 JKBD C[C@H](CC(=O)N1CCC([C@H]2CCCCN2C(=O)c2ccc([N+](=O)[O-])cc2F)CC1)c1ccccc1 1830498464 WEXPUIBGNKNGPE-KBMIEXCESA-N 481.568 5.161 5 20 JKBD CC[C@H](C)c1ccc([C@H](NC(=O)CSc2ccc(C(N)=O)cc2[N+](=O)[O-])c2cccs2)cc1 15616428 HCVSSPGIPRBEKL-WNSKOXEYSA-N 483.615 5.267 5 20 JKBD CN(C)c1ccc(C(=O)c2ccccc2C(=O)N2CCC[C@H](c3nc4ccccc4o3)C2)cc1[N+](=O)[O-] 27381899 WOIMLNXESRGWAE-IBGZPJMESA-N 498.539 5.053 5 20 JKBD Cc1csc(Sc2ccc(C(=O)Nc3ccc(-c4cnc(C)o4)cc3)cc2[N+](=O)[O-])n1 29859276 JDDYLEGEGAPOCQ-UHFFFAOYSA-N 452.517 5.727 5 20 JKBD COc1cc2c(cc1OC)[C@H](c1ccccc1)N(C(=O)[C@H](C)Sc1ccc([N+](=O)[O-])cc1)CC2 32891785 ZDGFTFCLWDFPEP-GKVSMKOHSA-N 478.570 5.267 5 20 JKBD Cc1ccc(NC(=O)c2ccccc2NC(=O)c2ccccc2Br)cc1[N+](=O)[O-] 104798235 QZDWHGZUPNVSBV-UHFFFAOYSA-N 454.280 5.170 5 20 JKBD CCOc1cc(C(=O)Nc2sc3c(c2C(=O)c2cccs2)CCCC3)c([N+](=O)[O-])cc1OC 105520775 QWNWEPUXEYFBBC-UHFFFAOYSA-N 486.571 5.487 5 20 JKBD C[C@H]1CCCN(c2ccc(C(=O)Nc3ccc(N(C)C)cc3C(F)(F)F)cc2[N+](=O)[O-])C1 116996426 XVUHKBCQCQOROZ-AWEZNQCLSA-N 450.461 5.168 5 20 JKBD CSCC[C@H](NC(=O)c1cccc([N+](=O)[O-])c1)C(=O)NCc1ccccc1-c1ccc(Cl)cc1 303157141 OEFKUNDAKLJTTR-QHCPKHFHSA-N 498.004 5.083 5 20 JKBD CSc1ccc(C(=O)c2ccccc2C(=O)NC[C@@H]2CCCO[C@@H]2c2ccccc2)cc1[N+](=O)[O-] 409547498 JNWGLMFBYRUTCO-RXFWQSSRSA-N 490.581 5.445 5 20 JKBD CC(C)Oc1ccc(CNC(=O)C/C(=C\c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)cn1 483462301 FJVYXMPHJBATBR-DEDYPNTBSA-N 488.569 5.634 5 20 JKBD COc1cc(C(=O)Nc2ccccc2COCc2ccccc2)c([N+](=O)[O-])cc1OC(F)F 499953819 LTSVTERYPNJZMY-UHFFFAOYSA-N 458.417 5.174 5 20 JKBD CCOc1c(Br)cc(Cl)cc1NC(=O)c1ccc(NC2CC2)c([N+](=O)[O-])c1 504737037 HXSURRKQEIRLQA-UHFFFAOYSA-N 454.708 5.236 5 20 JKBD CCN(C(=O)c1ccc(Sc2nc(C)cs2)c([N+](=O)[O-])c1)c1ccc(Br)cn1 507920418 BCRUPMJXLHTGFR-UHFFFAOYSA-N 479.381 5.335 5 20 JKBD Cc1cc([N+](=O)[O-])ccc1C(=O)Nc1ccc(Cl)c(S(=O)(=O)Nc2ccccc2Cl)c1 508726993 ZBMRYGBBUOMHHE-UHFFFAOYSA-N 480.329 5.263 5 20 JKBD C[C@H](c1ccco1)N(C(=O)C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)C1CC1 509840486 RDRMGZCNDFVWFJ-VXNZKSKFSA-N 473.554 6.480 5 20 JKBD COCCOc1ccc(NC(=O)c2ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])c(OC)c2)c(C)c1 516521825 BPMGKCZDDWCSTI-UHFFFAOYSA-N 486.908 5.635 5 20 JKBD O=C(Nc1ccc2nc([C@H]3CCCO3)[nH]c2c1)c1cc([N+](=O)[O-])ccc1Sc1ccc(Cl)cc1 520261810 NPNCHELRASATLC-OAQYLSRUSA-N 494.960 6.380 5 20 JKBD CCn1c(SCC(=O)c2sccc2Br)nc2cc3ccccc3cc2c1=O 564060915 AVCRTNCMKKAZNM-UHFFFAOYSA-N 459.390 5.369 5 20 JKBD CC(=O)Nc1cc(NC(=O)c2cc([N+](=O)[O-])ccc2Sc2ccc(Cl)cc2)ccc1F 602030309 KGEJAARWUIYTJE-UHFFFAOYSA-N 459.886 5.749 5 20 JKBD COCCN(C(=O)CSc1ccccc1Cl)c1nc(-c2ccc([N+](=O)[O-])cc2)cs1 603461432 SKMNBXBSJRAFSW-UHFFFAOYSA-N 463.968 5.143 5 20 JKBD Cc1cccc(NC(=O)Nc2cccc(CNc3ccc([N+](=O)[O-])c(C(=O)N4CCCC4)c3)c2)c1 603943438 GAQDRCUNRLRRKT-UHFFFAOYSA-N 473.533 5.395 5 20 JKBD O=C(CCCn1c(=O)oc2cc([N+](=O)[O-])ccc21)Nc1ccc(NCc2ccccc2)c(Cl)c1 604490108 NIDYATYQZKULJG-UHFFFAOYSA-N 480.908 5.187 5 20 JKBD C[C@H](Nc1ccc(C(=O)N(CCc2ccccc2)Cc2ccncc2)cc1[N+](=O)[O-])c1ccccn1 608879645 ZMKVOPMUPJTQDV-NRFANRHFSA-N 481.556 5.443 5 20 JKBD CC[C@@H](C)n1c(SCC(=O)N(C)Cc2cc([N+](=O)[O-])ccc2Cl)nnc1-c1ccccc1 749842760 KOZHJYSUHLSZKY-OAHLLOKOSA-N 473.986 5.228 5 20 JKBD O=C(NCc1ccc(OCc2cccc(F)c2)cc1)c1cc([N+](=O)[O-])ccc1Br 751078570 ZQTFUUYKZYJMNB-UHFFFAOYSA-N 459.271 5.005 5 20 JKBD O=C(Nc1cc(Cl)ccc1Cl)[C@H]1CCCCN1C(=O)c1cc([N+](=O)[O-])ccc1Cl 751246520 MXVIXOXVHFJOBT-QGZVFWFLSA-N 456.713 5.188 5 20 JKBD CN(C(=O)c1ccc(NS(=O)(=O)c2cc(Cl)ccc2[N+](=O)[O-])cc1Cl)C1CCCCC1 751271233 UDFIOXOWEOYERV-UHFFFAOYSA-N 486.377 5.107 5 20 JKBD C[C@H](OC(=O)c1cc2c3ccccc3n(C)c2s1)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl 762196808 SWHHIBWYVBQLCN-NSHDSACASA-N 457.895 5.139 5 20 JKBD CN(C(=O)COC(=O)c1c2c(nc3ccccc13)/C(=C\c1ccco1)CC2)c1ccc([N+](=O)[O-])cc1 799715270 CHDZAJGZSJMQPR-ICFOKQHNSA-N 483.480 5.043 5 20 JKBD O=C(Nc1ccc(NCc2cccc([N+](=O)[O-])c2Br)c(C(F)(F)F)c1)C1CC1 864001428 BHZYFYDQTYUXSR-UHFFFAOYSA-N 458.234 5.337 5 20 JKBD CC(C)c1cc(C(=O)N(Cc2nnc(-c3cccc([N+](=O)[O-])c3)o2)C(C)C)c(O)c(C(C)C)c1 864242294 ASAVMXGWLURRSO-UHFFFAOYSA-N 466.538 5.648 5 20 JKBD O=C(c1cc([N+](=O)[O-])ccc1N1CCC(Cc2ccccc2)CC1)N1CCn2c1nc1ccccc12 917638034 MWCVSUAFHOQNDU-UHFFFAOYSA-N 481.556 5.064 5 20 JKBD C[C@@H](OC(=O)c1cc([N+](=O)[O-])ccc1Oc1ccccc1)C(=O)Nc1ccc(N2CCCC2)cc1 919192946 QYZOZTWLVPCUCM-GOSISDBHSA-N 475.501 5.171 5 20 JKBD C[C@@H](Nc1ccc(C(=O)OCC(=O)Nc2cc(Cl)ccc2Cl)cc1[N+](=O)[O-])c1ccccn1 920545718 IOXSHGIVDMSVBA-CYBMUJFWSA-N 489.315 5.265 5 20 JKBD Cc1ccc(-c2nc(CC(=O)N(Cc3nnc(-c4cccc([N+](=O)[O-])c4)o3)C(C)C)cs2)cc1 921240730 NZOORLHHJHAIOH-UHFFFAOYSA-N 477.546 5.056 5 20 JKBD CCc1ccc(C(=O)Nc2ccc(C3(NC(=O)c4c(F)ccc([N+](=O)[O-])c4C)CCC3)cc2)cn1 1787257850 QDBWEPGTRRAMCZ-UHFFFAOYSA-N 476.508 5.061 5 20 JKBD Cc1oc(C(C)(C)C)cc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cc3cc([N+](=O)[O-])ccc3s1)C2 1795128381 SHRJVSKAAVXLDB-BCDXTJNWSA-N 495.601 5.574 5 20 JKBD Cc1ccc(CC(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cccc4c2oc2ccccc24)C3)cc1[N+](=O)[O-] 1800139150 BOQMWECUAFGDHV-WKCHPHFGSA-N 497.551 5.297 5 20 JKBD Cc1c(C(=O)N2CCCC[C@H]2c2cc(NC(=O)[C@H](F)c3ccccc3)n[nH]2)cc(Cl)cc1[N+](=O)[O-] 1815557393 VSZMZEDQJPGMHU-SIKLNZKXSA-N 499.930 5.296 5 20 JKBD Cc1c(C(=O)Nc2cc([C@H]3CCCCN3C(=O)CCC3CCC3)[nH]n2)cc(Cl)cc1[N+](=O)[O-] 1821288459 DWVBIGAXMORQHE-LJQANCHMSA-N 473.961 5.166 5 20 JKBD Cc1c(C(=O)N2CCC([C@H]3CCCCN3C(=O)c3sccc3F)CC2)cc(Cl)cc1[N+](=O)[O-] 1824731145 XVUTWSUKSCHYMJ-LJQANCHMSA-N 493.988 5.304 5 20 JKBD Cc1cc(C(=O)N2CCC([C@@H]3CCCCN3C(=O)c3cc4cc([N+](=O)[O-])ccc4s3)CC2)ccn1 1831061139 NEUDIZCOSXYJDO-QFIPXVFZSA-N 492.601 5.060 5 20 JKBD Cc1ccc([C@H](C)C(=O)N2CCC([C@@H]3CCCCN3C(=O)Cc3cc(F)ccc3[N+](=O)[O-])CC2)cc1 1832888114 FJMZFVWIPCRPSF-CPJSRVTESA-N 495.595 5.008 5 20 JKBD CC(C)c1ccc([C@H](NC(=O)CCCn2c(=O)oc3cc([N+](=O)[O-])ccc32)c2cccs2)cc1 9984195 NHZYZWJEBRBBFP-DEOSSOPVSA-N 479.558 5.374 5 20 JKBD CCn1c(SCC(=O)N2N=C(c3ccco3)C[C@H]2c2ccco2)nc2cc3ccccc3cc2c1=O 24891950 ZRRQYSUVVSKZNS-QFIPXVFZSA-N 498.564 5.226 5 20 JKBD CCN(CC)C(=O)c1ccc(NC(=O)c2ccccc2C(=O)c2ccc(SC)c([N+](=O)[O-])c2)cc1 26625527 NTVYVLUPRGYHBQ-UHFFFAOYSA-N 491.569 5.282 5 20 JKBD COc1cccc(Nc2nn(CN(C)Cc3cc([N+](=O)[O-])ccc3Cl)c(=S)s2)c1 27533327 USCOQFYRHNTXLD-UHFFFAOYSA-N 451.961 5.077 5 20 JKBD C[C@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)N(Cc1cccs1)c1ccc2c(c1)OCCO2 32480181 MYNUSHAILZIGCT-HNNXBMFYSA-N 456.545 5.142 5 20 JKBD Cc1ccc(CN(C(=O)c2nn(-c3ccccc3[N+](=O)[O-])c(C)cc2=O)[C@@H]2CCc3ccccc32)cc1 68710753 VOWHQLMWACDLCN-XMMPIXPASA-N 494.551 5.087 5 20 JKBD COc1ccc(CSCC(=O)Nc2nc(-c3ccccc3OC(F)F)cs2)cc1[N+](=O)[O-] 110600630 YWJMQASSWSMTPP-UHFFFAOYSA-N 481.502 5.200 5 20 JKBD C[C@H]1CCCN(c2ccc(C(=O)Nc3ccc(F)c(-c4nnc5n4CCCCC5)c3)cc2[N+](=O)[O-])C1 115560635 FYRRANAPSNSASP-KRWDZBQOSA-N 492.555 5.207 5 20 JKBD COc1cccc([C@H](CNC(=O)N[C@@H](C)c2cccc([N+](=O)[O-])c2)c2c[nH]c3ccccc23)c1OC 195559672 ZQGGCSPODGXBGP-SBUREZEXSA-N 488.544 5.286 5 20 JKBD NC(=O)c1ccc(NC(=O)c2ccccc2Sc2ccc(C(F)(F)F)cc2[N+](=O)[O-])cc1Cl 482257290 KIAFQNNZGAHGEL-UHFFFAOYSA-N 495.866 5.769 5 20 JKBD CN(C(=O)c1ccc(Cl)cc1)c1ccc(NC(=O)c2csc(-c3ccc([N+](=O)[O-])cc3)n2)cc1 496613288 UFVWXUQFCXQDJT-UHFFFAOYSA-N 492.944 5.901 5 20 JKBD Cc1ccc(Sc2ccc(C(=O)Nc3ccc(NC(=O)[C@H]4CCCO4)cc3)cc2[N+](=O)[O-])cc1 502861358 JVVDUIFAYWTTTA-JOCHJYFZSA-N 477.542 5.424 5 20 JKBD Cc1cc(-c2cc(C(=O)N3c4ccc([N+](=O)[O-])cc4C[C@H]3C)c3cnn(C(C)C)c3n2)c(C)s1 504330384 ZXINOKKYZCAAGP-CQSZACIVSA-N 475.574 5.857 5 20 JKBD Cc1nnc(Sc2ccc(NC(=O)[C@@H](C)Oc3ccc(Cl)cc3[N+](=O)[O-])c(C)c2)s1 505894301 RUTIPWGWGLFVOL-LLVKDONJSA-N 464.956 5.274 5 20 JKBD CCOc1cc(Br)c(NC(=O)c2ccc(N3CCCC3)c([N+](=O)[O-])c2)cc1OCC 508013361 IHXGWHBUSGBWMD-UHFFFAOYSA-N 478.343 5.007 5 20 JKBD COc1ccc(-c2[nH]c3ccccc3c2CCC(=O)N2CCc3cc([N+](=O)[O-])ccc32)c(OC)c1 512982595 HGHUHLOSAFXTLP-UHFFFAOYSA-N 471.513 5.282 5 20 JKBD O=C(Nc1ccccc1OCC(F)(F)F)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 514490208 JWYNDJSKTLOAIY-UHFFFAOYSA-N 491.388 5.410 5 20 JKBD COc1ccc(NC(=O)c2ccc(C)c(NC(=O)c3ccc(Br)cc3)c2)c([N+](=O)[O-])c1 514501753 GTVDUKYMDAUXLZ-UHFFFAOYSA-N 484.306 5.179 5 20 JKBD COc1ccc(Oc2ccc([N+](=O)[O-])cc2C(=O)NCC(=O)Nc2cc(Cl)ccc2Cl)cc1 515064391 KEFCVCUKVFLQRS-UHFFFAOYSA-N 490.299 5.071 5 20 JKBD CN(Cc1cscn1)C(=O)c1c2c(nc3ccccc13)/C(=C\c1ccc([N+](=O)[O-])cc1)CCC2 516336934 WKBFXIOYNXDCKD-AQTBWJFISA-N 470.554 5.749 5 20 JKBD COc1ccc(CCCNC(=O)c2cc([N+](=O)[O-])ccc2Sc2ccccc2)cc1OC 520446624 QVZCTHJONDRZKX-UHFFFAOYSA-N 452.532 5.126 5 20 JKBD Cc1ccc(C(N)=O)cc1NC(=O)C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1 521185901 XQTXTCZFBHZJFF-LDADJPATSA-N 472.526 5.181 5 20 JKBD Cc1ccc(-c2ccncc2)cc1NC(=O)c1ccc(N[C@@H](C)c2ccccn2)c([N+](=O)[O-])c1 522395131 RXWYVUABAZCKBQ-SFHVURJKSA-N 453.502 5.786 5 20 JKBD COC(=O)[C@H](c1ccc(Cl)c(Cl)c1)N(C)C(=O)c1csc(-c2ccc([N+](=O)[O-])cc2)n1 523419906 BKRJSCXWBWCHCQ-KRWDZBQOSA-N 480.329 5.011 5 20 JKBD Cc1sc(NC(=O)c2cnc(Sc3nccn3C)c(Cl)c2)nc1-c1cccc([N+](=O)[O-])c1 550919161 FGOYRJSBMOLLSD-UHFFFAOYSA-N 486.966 5.212 5 20 JKBD COc1cc(C(=O)Nc2ccccc2CN(C)C2CCCCC2)c([N+](=O)[O-])cc1OC(F)F 591766393 PFFHDTMQBYTVHO-UHFFFAOYSA-N 463.481 5.222 5 20 JKBD O=C(Nc1ccc(Cc2nc3ccccc3s2)cc1)C1CCN(c2ccccc2[N+](=O)[O-])CC1 600875171 RUQZWPANEZCYOU-UHFFFAOYSA-N 472.570 5.650 5 20 JKBD COc1cccc(N2C(=O)c3ccccc3N[C@@H]2c2csc(-c3cccc([N+](=O)[O-])c3)n2)c1 602756647 BSIQBNFPJBXGCL-QFIPXVFZSA-N 458.499 5.498 5 20 JKBD C[C@@H]1C[C@@H](C)CN(c2ccc(C(=O)N3CCC(C(=O)c4cc(F)ccc4F)CC3)cc2[N+](=O)[O-])C1 603905531 HUKZIGQIEFMMOQ-IAGOWNOFSA-N 485.531 5.090 5 20 JKBD O=C(NC[C@@H](c1ccccc1Cl)c1c[nH]c2ccccc12)c1cc2c(cc1[N+](=O)[O-])OCO2 603941073 FTSAZAFKJGFHNW-KRWDZBQOSA-N 463.877 5.020 5 20 JKBD C[C@@H]1CCCCN1C(=O)c1ccc(NC(=O)c2cc3cc([N+](=O)[O-])ccc3s2)cc1Cl 603986534 FDJMXQABOPBBQV-CYBMUJFWSA-N 457.939 5.730 5 20 JKBD O=C(NCc1ccc(OCc2ccccn2)cc1)c1ccc(NCc2ccccc2)c([N+](=O)[O-])c1 604180150 YVQUEXYWFQQHPJ-UHFFFAOYSA-N 468.513 5.111 5 20 JKBD COc1ccc([C@H](Cc2ccc(F)cc2)N[C@@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)cc1 604459744 IZEUCPFMMWLAIE-HJPURHCSSA-N 462.481 5.427 5 20 JKBD COc1cc(C(=O)Nc2nc(C3CC3)c(Cc3ccccc3Cl)s2)c([N+](=O)[O-])cc1OC 608850198 LAXKJWBQSOSIJQ-UHFFFAOYSA-N 473.938 5.442 5 20 JKBD O=C(Nc1ccccc1OCc1ncc(-c2cccc(Cl)c2)o1)c1cc2c(cc1[N+](=O)[O-])OCO2 608850645 KAXNHCNPEFVGNQ-UHFFFAOYSA-N 493.859 5.463 5 20 JKBD COc1ccc(CC(=O)NC[C@H](c2ccccc2Cl)c2c[nH]c3ccccc23)cc1[N+](=O)[O-] 609010072 WVLLUFGHXKGTJP-LJQANCHMSA-N 463.921 5.229 5 20 JKBD COc1cc([C@@H](C)NC(=O)Cn2c3ccccc3c(=O)c3ccccc32)ccc1OCc1ccccc1 614896529 VATKCZKYTXUUNN-OAQYLSRUSA-N 492.575 5.620 5 20 JKBD Cc1cc(SC(C)(C)C)ccc1NC(=O)[C@H]1CCCN1C(=O)c1ccc([N+](=O)[O-])c(C)c1 726509811 SBGLZHNAEUOIGW-OAQYLSRUSA-N 455.580 5.346 5 20 JKBD Cc1ccc([N+](=O)[O-])cc1C(=O)O[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1 742997720 DTPSPYDDPVENII-HXUWFJFHSA-N 469.837 5.002 5 20 JKBD O=C(C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)OCC(=O)c1ccccc1 748578998 FFDYGFRCTINMGT-XMHGGMMESA-N 458.495 5.561 5 20 JKBD CC(=O)[C@H](OC(=O)C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)c1ccccc1 748579055 JTMGYSUAFBXUEU-GCNVJJAOSA-N 472.522 6.009 5 20 JKBD O=C(N[C@@H](c1ccc(Cl)cc1)c1cccs1)c1cc([N+](=O)[O-])ccc1Br 751090121 XEZOXGVNQJYKMF-KRWDZBQOSA-N 451.729 5.592 5 20 JKBD Cc1cc(NC(=O)C2CCN(c3ccc(C(F)(F)F)cc3[N+](=O)[O-])CC2)ccc1N1CCCC1 802329966 UHLRTMCIDAJXDX-UHFFFAOYSA-N 476.499 5.377 5 20 JKBD O=C(Oc1ccc2c(-c3ccc([N+](=O)[O-])cc3)cc(=O)oc2c1)c1ccc(C(F)(F)F)cn1 844264675 CZZUDFGEPNJFKW-UHFFFAOYSA-N 456.332 5.001 5 20 JKBD C[C@H](Sc1nnc(-c2ccccc2Br)o1)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl 848971053 VDPLMJCBSFIXLC-VIFPVBQESA-N 483.731 5.180 5 20 JKBD Cc1cc([N+](=O)[O-])ccc1NC(=O)COC(=O)c1ccsc1NC(=O)c1ccc(C(C)C)cc1 919400338 PKRWZVOGLBKBET-UHFFFAOYSA-N 481.530 5.136 5 20 JKBD COc1ccc([C@H]2C[C@@H]2C(=O)Nc2ccc(C3(NC(=O)Cc4cccc([N+](=O)[O-])c4)CCC3)cc2)cc1 1786328807 UOZSTLNFUGKBKS-FTJBHMTQSA-N 499.567 5.084 5 20 JKBD O=C(NC1(c2ccc(NC(=O)c3cc4ccccc4o3)cc2)CCC1)c1ccc(O)c([N+](=O)[O-])c1 1789004716 UKNOPTYRZVJXHK-UHFFFAOYSA-N 471.469 5.108 5 20 JKBD Cc1ccc(-c2ccccc2C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)/C=C/c2ccc([N+](=O)[O-])o2)C3)cc1 1800603442 BLQOLUWFNRWKAA-JUOQVHBBSA-N 485.540 5.128 5 20 JKBD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)[nH]n1)C1CCCCC1 1816709003 ZEQUYYHINZCJDS-IBGZPJMESA-N 481.578 5.419 5 20 JKBD Cc1cc(O)c([N+](=O)[O-])cc1C(=O)Nc1cc([C@H]2CCCCN2C(=O)CC2CCC(C)(C)CC2)[nH]n1 1821345516 KWKIRXAKICFEAF-HXUWFJFHSA-N 497.596 5.244 5 20 JKBD O=C(c1ccsc1)N1CCCC[C@H]1C1CCN(C(=O)C2(c3cccc([N+](=O)[O-])c3)CCC2)CC1 1825795802 WZAHZEBBPNFKTF-QHCPKHFHSA-N 481.618 5.012 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)N1CCCC[C@@H]1C1CCN(C(=O)[C@@H]2C[C@@H]2c2ccccc2)CC1 1830728411 CAUKUVHXNKSWKA-TZBSWOFLSA-N 493.579 5.079 5 20 JKBD C[C@@H](Sc1nnc(-c2ccccc2)n1Cc1ccco1)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl 3412868 SFEKIZYBWJUHBT-CQSZACIVSA-N 483.937 5.267 5 20 JKBD Cc1ccc(NC(=O)[C@@H](Sc2nncn2-c2ccccc2C)c2ccccc2)c([N+](=O)[O-])c1 10243629 PRQBHXHYDPAOED-QFIPXVFZSA-N 459.531 5.264 5 20 JKBD CCOc1cc([N+](=O)[O-])c(C(=O)Nc2ccc(OC(F)F)c(Cc3ccccc3)c2)cc1OC 16297919 NZPRESSMDZROPZ-UHFFFAOYSA-N 472.444 5.447 5 20 JKBD Cc1cccc(C)c1NC(=O)[C@H](C)OC(=O)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1 16906094 LWXPCEDTGMWSCF-INIZCTEOSA-N 468.893 5.841 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Br)[C@@H](NCCc1ccc(F)cc1)c1ccccc1 21819966 HALCEHYJWWXDRL-NRFANRHFSA-N 472.314 5.009 5 20 JKBD C[C@@H](OC(=O)c1ccc(NCc2ccccc2)c([N+](=O)[O-])c1)C(=O)N1CCC[C@@H]1c1cccs1 23768361 WVNBTQIPLQFBHO-DYESRHJHSA-N 479.558 5.177 5 20 JKBD Cc1ccc(NC(=O)c2ccc(Cn3nc(C)c([N+](=O)[O-])c3C)cc2)c(OCc2ccccc2)c1 59784692 CSDGVSSBLAMHKE-UHFFFAOYSA-N 470.529 5.596 5 20 JKBD Cc1cc(C)n(-c2ccc(CNC(=O)[C@H](C)Sc3ccc([N+](=O)[O-])cc3)c(C(F)(F)F)c2)n1 72037093 DKPRZYDWTKZWAR-HNNXBMFYSA-N 478.496 5.213 5 20 JKBD CCN(c1ccccc1)S(=O)(=O)c1cc(NC(=O)c2ccc([N+](=O)[O-])cc2C)ccc1Cl 72068437 PIERQKPWAVWPTP-UHFFFAOYSA-N 473.938 5.024 5 20 JKBD COc1cc(CN(C)C(=O)c2cc([N+](=O)[O-])ccc2Oc2ccccc2)ccc1OC(F)F 107764207 RQXIERHTDKMVBH-UHFFFAOYSA-N 458.417 5.269 5 20 JKBD O=C(Nc1ccccc1C(=O)N1CCC[C@@H](c2ccccc2)CC1)c1ccc([N+](=O)[O-])cc1Cl 303206437 QBSQXZMZFYBXGK-LJQANCHMSA-N 477.948 5.910 5 20 JKBD CS(=O)(=O)Cc1ccccc1NC(=O)c1ccc(Sc2nc3ccccc3s2)c([N+](=O)[O-])c1 477910669 NSEZHTBQDHXDQJ-UHFFFAOYSA-N 499.595 5.153 5 20 JKBD COCCN(C(=O)c1nc(-c2ccco2)sc1C)c1nc(-c2ccc([N+](=O)[O-])cc2)cs1 483483766 AJGCKFTZXPZUCR-UHFFFAOYSA-N 470.532 5.036 5 20 JKBD COc1ccc([C@@H](NC(=O)N[C@@H](C)c2cccc([N+](=O)[O-])c2)c2ccccc2)cc1Br 490268204 CNWFIMMUJPACRS-NYHFZMIOSA-N 484.350 5.516 5 20 JKBD Cc1ccc(NC(=O)c2cnn(-c3ncc(Cl)cc3Cl)c2C(F)(F)F)cc1[N+](=O)[O-] 502846873 UHLIWBMQMJONBX-UHFFFAOYSA-N 460.199 5.062 5 20 JKBD COc1ccc([C@@H](Cc2ccccc2C)Nc2cc3c(cc2[N+](=O)[O-])CCC(=O)N3)cc1OC 507037905 NGPCAMNJZBSQGF-HXUWFJFHSA-N 461.518 5.201 5 20 JKBD COc1ccc(Oc2ccc([N+](=O)[O-])cc2C(=O)Nc2cc(C(=O)N(C)C(C)C)ccc2Cl)cc1 509291734 VOAZHSVSKYPDIH-UHFFFAOYSA-N 497.935 5.782 5 20 JKBD Cn1ncc2c1CCC[C@@H]2NC(=O)C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1 512787315 HRZGCUAQISLDBI-NXNYUAIASA-N 473.558 5.063 5 20 JKBD Cc1cccc(-n2c(SCc3nnc(-c4ccc([N+](=O)[O-])cc4)o3)nc3ccccc3c2=O)c1C 513655691 TYTQJBDYGVHISQ-UHFFFAOYSA-N 485.525 5.253 5 20 JKBD CCN(C(=O)c1ccc(N[C@H](C)c2ccccn2)c([N+](=O)[O-])c1)[C@H](C)Cc1ccc(OC)cc1 520914368 KUVCVPQOAASFNG-RTBURBONSA-N 462.550 5.265 5 20 JKBD Cc1cc(N[C@@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2ccccc2)ccc1C(=O)NC(C)C 582066603 JXHZMCJXMIFLNH-HSZRJFAPSA-N 480.952 5.487 5 20 JKBD COc1cccc(/C=C(/CC(=O)N(C)Cc2ccccc2[N+](=O)[O-])c2nc3ccccc3s2)c1 603569098 OPHCTFMTYHSFCX-ZHZULCJRSA-N 473.554 5.802 5 20 JKBD C[C@H]1CCCN(c2ccc(C(=O)Nc3ccccc3COCc3ccccc3)cc2[N+](=O)[O-])C1 603912011 IIMNWZOYKSAVBW-FQEVSTJZSA-N 459.546 5.800 5 20 JKBD COc1cccc(/C=C(/CC(=O)Nc2ccc([N+](=O)[O-])cc2F)c2nc3ccccc3s2)c1 608870819 OFPMVVWPDDWGGE-WJDWOHSUSA-N 463.490 5.922 5 20 JKBD O=C(Nc1ccc(OCc2ccncc2)cc1)c1ccc(NCc2ccccc2)c([N+](=O)[O-])c1 609178445 PWNPRPNAMNQFCC-UHFFFAOYSA-N 454.486 5.433 5 20 JKBD CN(C)C1CCN(C(=O)c2c3c(nc4ccccc24)/C(=C\c2ccc([N+](=O)[O-])cc2)CCC3)CC1 609417147 JDQMCOCJHUQQLX-ZZEZOPTASA-N 470.573 5.186 5 20 JKBD Cc1cc(NC(=O)c2ccccc2Cl)sc1C(=O)Nc1ccc([N+](=O)[O-])c(Cl)c1 727711571 LEGXKXVCSBIJML-UHFFFAOYSA-N 450.303 5.776 5 20 JKBD Cc1ccc(/C(O)=C(/C(=S)Nc2c(Cl)ccc(C)c2Cl)[n+]2ccccc2)cc1[N+](=O)[O-] 728558238 INNMODHKSUXWEZ-UHFFFAOYSA-O 475.377 6.129 5 20 JKBD COc1ccc2cc(/C=C\C(=O)N(Cc3nnc(-c4cccc([N+](=O)[O-])c4)o3)C(C)C)ccc2c1 744001485 POXFMILLOPNXHM-WQLSENKSSA-N 472.501 5.257 5 20 JKBD C[C@H](Nc1ccc(C(=O)Nc2ccc(N3C[C@@H](C)O[C@H](C)C3)cc2)cc1[N+](=O)[O-])c1ccccn1 747390982 WNQJMWWPVQXCOP-QRVBRYPASA-N 475.549 5.029 5 20 JKBD Cc1ccc([C@H](NC(=O)COC(=O)c2csc(-c3cccc([N+](=O)[O-])c3)n2)c2cccs2)cc1 747961870 LQGCRWQEMQDSGO-QFIPXVFZSA-N 493.566 5.151 5 20 JKBD C[C@H](Nc1ccc(C(=O)O[C@@H](c2cccc(F)c2)c2ccccn2)cc1[N+](=O)[O-])c1ccccn1 750629871 AVZHRDGMVMFDMW-GKVSMKOHSA-N 472.476 5.643 5 20 JKBD COc1cc(C(=O)Oc2ccc3c(c2)CCC(=O)N3)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 817767650 YWZZJRFDFQNKIE-UHFFFAOYSA-N 468.849 5.153 5 20 JKBD Cc1ccc(N2C(=O)CC[C@@H](C(=O)Nc3cc([N+](=O)[O-])c(F)cc3F)[C@@H]2c2cccs2)cc1 825487355 APQGVBZYJMKBGK-IVZQSRNASA-N 471.485 5.366 5 20 JKBD COc1ccc([N+](=O)[O-])cc1NC(=O)[C@H](C)OC(=O)c1csc(-c2ccc(C(C)C)cc2)n1 900227223 VRLHQHQNNCBFMY-AWEZNQCLSA-N 469.519 5.034 5 20 JKBD CCOC(=O)c1c(-c2ccc(C)cc2)csc1NC(=O)c1cc(OC)c(OC)cc1[N+](=O)[O-] 904233586 VETDIJUVPYSZFH-UHFFFAOYSA-N 470.503 5.078 5 20 JKBD C[C@@H](Cc1noc(-c2ccc(NCc3ccccc3)c([N+](=O)[O-])c2)n1)N(C)C(=O)OC(C)(C)C 904655333 KFZWEBLTCYDOOP-INIZCTEOSA-N 467.526 5.055 5 20 JKBD O=C(C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)NCCSC(F)(F)F 918591316 RNTFUULMKLZXAR-KAMYIIQDSA-N 467.494 5.504 5 20 JKBD COc1cc(C(=O)O[C@@H](C)c2nc(C3CC3)no2)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 918953870 ZNAPRGWRGUMBOS-NSHDSACASA-N 459.842 5.228 5 20 JKBD CCCc1noc2nc(-c3ccco3)cc(C(=O)O[C@H](C)C(=O)Nc3ccc([N+](=O)[O-])cc3Cl)c12 920679312 FOBLTHAABNFSKD-GFCCVEGCSA-N 498.879 5.181 5 20 JKBD Cc1c(C(=O)Nc2ccc(C3(NC(=O)c4ccc([N+](=O)[O-])[nH]4)CCC3)cc2)[nH]c2c(Cl)cccc12 1788501547 KESPWKWDRQKUFW-UHFFFAOYSA-N 491.935 5.428 5 20 JKBD Cc1cc(C(=O)Nc2ccc(C3(NC(=O)c4cc5ccccc5o4)CCC3)cc2)ncc1[N+](=O)[O-] 1788766393 KSFDSBSNYQJFFS-UHFFFAOYSA-N 470.485 5.106 5 20 JKBD Cc1ccc2c(/C=C/C(=O)NC3(c4ccc(NC(=O)c5ccc([N+](=O)[O-])[nH]5)cc4)CCC3)c[nH]c2c1 1790188657 ZNDPSYTYOGPANE-UUILKARUSA-N 483.528 5.174 5 20 JKBD O=C(CSc1ccccc1[N+](=O)[O-])Nc1ccc(C2(NC(=O)C[C@@H]3C[C@@H]4CC[C@H]3C4)CCC2)cc1 1791523290 OSSXBCWEOJFYSI-AABGKKOBSA-N 493.629 5.647 5 20 JKBD Cc1ccc(CC(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2ccc(Cl)c(C)c2Cl)C3)cc1[N+](=O)[O-] 1800141499 RDNSWTVFKRJRSB-BCDXTJNWSA-N 490.387 5.013 5 20 JKBD CC(C)[C@@H](C(=O)N1CCCC2(CCN(C(=O)CCc3cccc([N+](=O)[O-])c3)CC2)C1)c1ccccc1 1805617936 OSWSGMNMZHSXMJ-HHHXNRCGSA-N 491.632 5.198 5 20 JKBD CC(C)(C)CC(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cc(Br)ccc2[N+](=O)[O-])CC1 1826337700 CJNVFEPKWQHHKK-IBGZPJMESA-N 494.430 5.027 5 20 JKBD CC(C)(C)c1ccc(C(=O)N2CCCC[C@H]2C2CCN(C(=O)c3cc(O)cc([N+](=O)[O-])c3)CC2)s1 1827903557 FYSFYQRNMJPWMW-NRFANRHFSA-N 499.633 5.207 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)N1CCCC[C@@H]1C1CCN(C(=O)CCCC(F)(F)F)CC1 1830728140 AZDAOJDGSSVNNA-LJQANCHMSA-N 487.494 5.008 5 20 JKBD Cc1csc(Sc2ccc(C(=O)N3CCC(C(=O)c4ccccc4)CC3)cc2[N+](=O)[O-])n1 9987256 CTRSDADMMSNIFY-UHFFFAOYSA-N 467.572 5.246 5 20 JKBD O=C(O[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1)c1cnn(Cc2ccccc2)c1 12854135 AYFOKPXEVZJDIG-QHCPKHFHSA-N 490.903 5.030 5 20 JKBD O=C(CSc1nnc(Cc2cccs2)n1C1CC1)Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1 17273085 ONFJDWVTCHKTET-UHFFFAOYSA-N 498.615 5.028 5 20 JKBD Cc1ccccc1-n1c(S[C@@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)nc2ccccc2c1=O 17532580 ZBWVIJKZGCCEJI-INIZCTEOSA-N 485.525 5.506 5 20 JKBD CCn1c(S[C@@H](C)C(=O)Nc2c(C)cccc2C(C)C)nc2cc3ccccc3cc2c1=O 22178396 WNPDPONPJPAEHB-SFHVURJKSA-N 459.615 6.121 5 20 JKBD Cc1c(Cl)cccc1Nc1nnc(S[C@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)s1 24506314 CEWFZXVSWCWZRD-LLVKDONJSA-N 474.955 6.055 5 20 JKBD CSc1ccc(C(=O)c2ccccc2C(=O)N2CCc3[nH]c4ccccc4c3C2)cc1[N+](=O)[O-] 26710818 CQHMBROEGWFXBL-UHFFFAOYSA-N 471.538 5.228 5 20 JKBD CCOCc1ccc(CN[C@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Br)c2ccccc2)cc1 28386502 XXUDDFMHSHVTAA-QHCPKHFHSA-N 498.377 5.363 5 20 JKBD Cc1cc([N+](=O)[O-])ccc1NC(=O)COC(=O)c1ccc(-c2nc3ccccc3s2)s1 28786276 SCANWCROSZNZMU-UHFFFAOYSA-N 453.501 5.037 5 20 JKBD C[C@@H](c1ccc(F)c(F)c1)N(C)C(=O)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 45777359 OFXPIIYNXDSFQG-ZDUSSCGKSA-N 471.426 5.328 5 20 JKBD O=C(Cn1c2ccccc2c(=O)c2ccccc21)Nc1nc(-c2ccc(Cl)s2)cs1 58537055 CTVNESUNUXFOSL-UHFFFAOYSA-N 451.960 5.632 5 20 JKBD CCOc1cc(C(=O)Nc2ccc3nc(-c4cc(F)ccc4F)[nH]c3c2)c([N+](=O)[O-])cc1OC 71938803 RKHHENDERNLLBO-UHFFFAOYSA-N 468.416 5.076 5 20 JKBD Cc1c([C@@H](C)NC(=O)c2ccc(N[C@@H](C)c3ccccn3)c([N+](=O)[O-])c2)cnn1-c1ccc(F)cc1 108776995 GXGJNWLNHGSLBO-SJORKVTESA-N 488.523 5.287 5 20 JKBD C[C@H]1CCC[C@@H](C)N1C(=O)c1cc(Cl)ccc1NC(=O)C1CCN(c2ccccc2[N+](=O)[O-])CC1 302990261 XHFJRLWZHZUIOI-HDICACEKSA-N 499.011 5.506 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)Nc2sc3c(c2C(=O)c2ccco2)CC[C@H](C)C3)cc1SC 482601044 FIGCJYLTKZIXFM-LBPRGKRZSA-N 486.571 5.588 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)Nc2nc(-c3ccc(OC(C)C)cc3)cs2)cc1SC 483726842 QWANVOLYLAQCCC-UHFFFAOYSA-N 459.549 5.488 5 20 JKBD COCCN(Cc1ccco1)C(=O)C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1 497473952 CCNXJKATLGZEAR-XDJHFCHBSA-N 477.542 5.403 5 20 JKBD O=C(Cn1c2ccccc2c(=O)c2ccccc21)N[C@@H](c1ccc(Cl)cc1)c1cccs1 500785243 FUTXVKVTGYQAJS-VWLOTQADSA-N 458.970 5.775 5 20 JKBD CC[C@H](C)n1c(S[C@@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)nnc1-c1ccccc1 504288553 IMITZXDIGILYRC-KBPBESRZSA-N 459.959 5.597 5 20 JKBD C[C@H](Nc1ccc(C(=O)Nc2ccc(N(C)C)cc2C(F)(F)F)cc1[N+](=O)[O-])c1ccccn1 509183468 JTHREPMETLNYHL-AWEZNQCLSA-N 473.455 5.500 5 20 JKBD Cc1cc(CN2CCSCC2)ccc1NC(=O)c1cc([N+](=O)[O-])ccc1NCc1ccccc1 509204698 WFRGAMJEMOOROI-UHFFFAOYSA-N 476.602 5.316 5 20 JKBD COc1cc(CNCc2nn(-c3ccccc3)c3c2CCC3)c([N+](=O)[O-])cc1OCc1ccccc1 509578066 DLOKUQZVVQHHFN-UHFFFAOYSA-N 484.556 5.147 5 20 JKBD Cc1ccc(C(=O)N2CCc3cc([N+](=O)[O-])ccc32)cc1NC(=O)c1ccc(Br)cc1 515216384 MXFMPWCZSDPGIQ-UHFFFAOYSA-N 480.318 5.121 5 20 JKBD O=C(CC1CCCC1)NC1CCN(C(=O)c2ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])cc2)CC1 519509049 XHVDIEILIQTZSQ-UHFFFAOYSA-N 485.968 5.342 5 20 JKBD CC(=O)NC[C@@H]1CCCN(C(=O)c2c3c(nc4ccccc24)/C(=C/c2cccc([N+](=O)[O-])c2)CCC3)C1 521418285 KXRSOIFCWZSAJF-FNNTWHHHSA-N 498.583 5.008 5 20 JKBD CN(Cc1cnn(C)c1)C(=O)c1c2c(nc3ccccc13)/C(=C\c1ccc([N+](=O)[O-])cc1)CCC2 569464844 LRBJDPNWIVIKLS-ZHZULCJRSA-N 467.529 5.026 5 20 JKBD C[C@@H](Cc1nnc(SCC(=O)Nc2nc(-c3cccc([N+](=O)[O-])c3)cs2)o1)c1ccccc1 594639277 WLNJNQIYKCEMBD-AWEZNQCLSA-N 481.559 5.178 5 20 JKBD COc1cccc(/C=C(/CC(=O)NCc2ccc(OC)c([N+](=O)[O-])c2)c2nc3ccccc3s2)c1 604018603 JVOYDTMSHRZIRE-UNOMPAQXSA-N 489.553 5.469 5 20 JKBD O=C(Nc1ccccc1NC(=O)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-])c1ccccc1 604113764 GBRWYZUTUPCVOW-UHFFFAOYSA-N 459.380 5.041 5 20 JKBD Cc1ccc(C(=O)N2C[C@H](C)C[C@@H](C)C2)cc1NC(=O)[C@H](C)Oc1ccc(Cl)cc1[N+](=O)[O-] 604443681 KJUSQDGPFWLESI-INMHGKMJSA-N 473.957 5.081 5 20 JKBD Cc1cc(C(=O)N2CCCC[C@H]2C)ccc1NC(=O)c1ccc(Cn2nc(C)c([N+](=O)[O-])c2C)cc1 604465725 FDVZAKQEUUFUPQ-GOSISDBHSA-N 489.576 5.032 5 20 JKBD C[C@@H](Nc1ccc(NC(=O)CSc2ccc(C(N)=O)cc2[N+](=O)[O-])cc1Cl)c1ccccc1 604513523 VMBJYOQONMGIQM-CQSZACIVSA-N 484.965 5.251 5 20 JKBD CCOc1cc(NC(=O)N2CCO[C@@H](c3ccc(Cl)c(Cl)c3)C2)c([N+](=O)[O-])cc1OCC 608993631 GICJANJKWRHCJV-HXUWFJFHSA-N 484.336 5.304 5 20 JKBD CC(C)(NC(=O)c1ccc(NCc2ccccc2Cl)c([N+](=O)[O-])c1)C(=O)Nc1ccccc1 609376815 UHPRUROCFUFXPC-UHFFFAOYSA-N 466.925 5.007 5 20 JKBD COc1ccc(CSCC(=O)Oc2cccc(C(=O)Nc3ccc(C)cc3)c2)cc1[N+](=O)[O-] 727328423 XSRGUVIMRBGSDO-UHFFFAOYSA-N 466.515 5.003 5 20 JKBD C[C@@H](OC(=O)CNc1ccc(C(F)(F)F)cc1[N+](=O)[O-])c1nnc(-c2cccc(Cl)c2)o1 746091679 ODZCFXZUOVQYKQ-SNVBAGLBSA-N 470.791 5.033 5 20 JKBD CCOc1cc(C(=O)O[C@@H](C)c2ccc(NC(=O)c3ccccc3)cc2)c([N+](=O)[O-])cc1OC 748014511 OHGAZICEUCCAMZ-INIZCTEOSA-N 464.474 5.172 5 20 JKBD O=C(OCC[C@@H]1CCCCN1C(=O)c1ccnc(Oc2ccccc2)c1)c1cccc([N+](=O)[O-])c1 749171943 JLGAKZBSJKRGCA-NRFANRHFSA-N 475.501 5.024 5 20 JKBD O=C(CCC(=O)c1ccc(-c2ccccc2)cc1)OCC1CCN(c2ncccc2[N+](=O)[O-])CC1 749357332 AOGDWSHSWCPNIK-UHFFFAOYSA-N 473.529 5.080 5 20 JKBD O=C(Oc1cccc(Oc2ncccn2)c1)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 751193305 CZTVVGXRASJQDS-UHFFFAOYSA-N 488.422 5.018 5 20 JKBD CCc1cccc(C)c1NC(=O)COC(=O)c1cc([N+](=O)[O-])ccc1Oc1ccc(OC)cc1 915442766 UBRHZRYZPYFCPP-UHFFFAOYSA-N 464.474 5.062 5 20 JKBD Cc1ccc(NC(=S)Nc2ccc(NS(=O)(=O)c3ccc(C)c([N+](=O)[O-])c3)cc2)cc1C 916120149 SAGPSFPRWSHNPG-UHFFFAOYSA-N 470.576 5.130 5 20 JKBD O=C(Cc1cccc([N+](=O)[O-])c1)Nc1ccc(C2(NC(=O)c3ccc4cnccc4c3)CCC2)cc1 1785791692 LFFDUIQLHCUCAB-UHFFFAOYSA-N 480.524 5.133 5 20 JKBD Cc1ccc(C(=O)NC2(c3ccc(NC(=O)/C=C/c4ccc([N+](=O)[O-])o4)cc3)CCC2)c(F)c1 1786207733 KMLZXJGUERHKHL-DHZHZOJOSA-N 463.465 5.096 5 20 JKBD O=C(/C=C/c1ccccc1[N+](=O)[O-])NC1(c2ccc(NC(=O)c3cnccc3Cl)cc2)CCC1 1789682583 DADPYUDKKOYDMH-IZZDOVSWSA-N 476.920 5.104 5 20 JKBD CC[C@H](C)[C@@H](C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)Cc1ccc(Cl)cc1[N+](=O)[O-])c1ccccc1 1793078093 GJEQFJBBLNYXIF-QJHLOFPWSA-N 498.023 5.259 5 20 JKBD C[C@@H](C(=O)N1CCCC2(CCN(C(=O)c3ccc([N+](=O)[O-])cc3F)CC2)C1)c1ccc(Cl)cc1 1805198631 QIWBOLSBQZIBNR-QGZVFWFLSA-N 487.959 5.036 5 20 JKBD Cc1ccc([N+](=O)[O-])cc1NC(=O)CSc1nnc(-c2ccccc2)n1-c1ccc(F)cc1 10212541 UKXBAKKYIBAGAJ-UHFFFAOYSA-N 463.494 5.021 5 20 JKBD COc1ccc(-n2c(SCC(=O)Nc3ccc([N+](=O)[O-])cc3Cl)nnc2-c2ccccc2)cc1 11196894 HGWITCTXNFLVHQ-UHFFFAOYSA-N 495.948 5.235 5 20 JKBD C[C@@H](OC(=O)c1sc2ccccc2c1Cl)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 11331806 UUJWLMUQSUJOMB-SECBINFHSA-N 472.828 5.666 5 20 JKBD CSCc1c(C(=O)N[C@H](CC(=O)OC(C)C)c2ccccc2[N+](=O)[O-])oc2ccccc12 16144778 AZZVRAJVYZBCGD-GOSISDBHSA-N 456.520 5.017 5 20 JKBD COc1ccc(C[C@H](N[C@@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2ccc(OC)cc2)cc1 19670888 QUTDDTZYLANBID-FYSMJZIKSA-N 483.952 5.166 5 20 JKBD O=C(N[C@@H](c1ccccc1)c1ccccn1)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 23685367 GQLXNGCVRLGAEL-QHCPKHFHSA-N 484.478 5.131 5 20 JKBD Cc1ccc(N2C(=O)CC[C@@H](C(=O)Nc3cc([N+](=O)[O-])ccc3F)[C@@H]2c2cccs2)cc1 57564586 XFLDMDULLDKLLJ-VGOFRKELSA-N 453.495 5.227 5 20 JKBD CC(=O)N(c1nc(COc2ccc([N+](=O)[O-])cc2C(F)(F)F)cs1)c1c(C)cc(C)cc1Cl 72033587 MLCPSLFNFZKURB-UHFFFAOYSA-N 499.898 6.604 5 20 JKBD O=C(Cc1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1)Nc1nnc(-c2ccccc2)s1 105011428 VMGPQAOSVUIVRF-UHFFFAOYSA-N 482.525 5.147 5 20 JKBD O=C(/C=C\c1cnc2ccccc2n1)O[C@H](C(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1)c1ccccc1 207446884 MGKLZYRNWNVPSO-XZBOQHEZSA-N 488.887 5.128 5 20 JKBD Cc1csc(Sc2ccc(C(=O)Nc3nc4c(s3)C(=O)CC(C)(C)C4)cc2[N+](=O)[O-])n1 409543803 IFMVGVWZIZFOBL-UHFFFAOYSA-N 474.589 5.375 5 20 JKBD C[C@H](NC(=O)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1)c1cc2ccccc2o1 500420158 DRCOTZVOBRTCGO-AWEZNQCLSA-N 461.440 5.454 5 20 JKBD CCN(C(=O)c1ccc(OC)c([N+](=O)[O-])c1)[C@H]1CCSc2ccc(Br)cc21 504630623 ZSIDKXDRQCXULK-HNNXBMFYSA-N 451.342 5.065 5 20 JKBD COc1ccc(CSCC(=O)N[C@H]2CCOc3c(-c4ccccc4)cccc32)cc1[N+](=O)[O-] 505162260 LVGFNINOYCQIHM-NRFANRHFSA-N 464.543 5.144 5 20 JKBD O=C(Cc1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1)N[C@H](c1ccccc1)c1ccco1 507019557 CZPSORGJBJIYGR-MUUNZHRXSA-N 478.508 5.489 5 20 JKBD COc1ccc(N(C(=O)c2ccc(N[C@@H](C)c3ccccn3)c([N+](=O)[O-])c2)C(C)C)cc1F 509823201 YJUUWGQTEXPYIS-INIZCTEOSA-N 452.486 5.366 5 20 JKBD CCc1sc(NC(=O)c2cc(OC)c(OCc3cscn3)cc2[N+](=O)[O-])nc1-c1ccccc1 511073812 MTDFJZMPTNMZSA-UHFFFAOYSA-N 496.570 5.577 5 20 JKBD Cc1ccc(-c2csc(NC(=O)CS[C@@H](C)c3nc4ccccc4[nH]3)n2)cc1[N+](=O)[O-] 515164170 ORZXPWXKWOFHRJ-ZDUSSCGKSA-N 453.549 5.336 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Br)[C@@H](NCCc1c(F)cccc1F)c1ccccc1 515717546 OADIXNSQKVIQAN-NRFANRHFSA-N 490.304 5.148 5 20 JKBD COc1c(Cl)cccc1NC(=O)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 516207633 JDAHFYZHBHLZHB-UHFFFAOYSA-N 457.836 5.131 5 20 JKBD CN(C(=O)c1cccc(C(=O)N(Cc2ccccc2[N+](=O)[O-])CC(F)(F)F)c1)c1ccccc1 517928049 GDVUAHZJQVLFJX-UHFFFAOYSA-N 471.435 5.076 5 20 JKBD COc1ccc([C@@H](Cc2ccccc2C)NC(=O)c2ccc([N+](=O)[O-])cc2Cl)cc1OC 520030959 HRYKWUBTIUHDRB-OAQYLSRUSA-N 454.910 5.288 5 20 JKBD O=C(NCCc1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccc(Oc2cc(Cl)ccc2Cl)c(F)c1 520119818 KVICUWDZWLFPST-UHFFFAOYSA-N 492.290 5.130 5 20 JKBD CN(Cc1ccccc1[N+](=O)[O-])C(=O)C(=O)Nc1ccc(Oc2ccccc2C(F)(F)F)cc1 520670030 XPFMFVDJQKIQAN-UHFFFAOYSA-N 473.407 5.003 5 20 JKBD Cc1nnc(SCc2c(C(=O)Nc3cc([N+](=O)[O-])ccc3OC(F)F)oc3ccccc23)s1 521644792 FQHNNOZVKBDJJB-UHFFFAOYSA-N 492.485 5.647 5 20 JKBD Cc1ccc2sc(N(Cc3ccccc3)C(=O)CCn3nc(C)c([N+](=O)[O-])c3C)nc2c1C 522483447 MXGTXBIFUGECPT-UHFFFAOYSA-N 463.563 5.258 5 20 JKBD CCOc1cc(C(=O)Nc2ccc(N[C@H](C)c3ccccc3)c(Cl)c2)c([N+](=O)[O-])cc1OC 524139635 REGLFTZZWJWLAM-OAHLLOKOSA-N 469.925 6.081 5 20 JKBD COc1ccc(Cc2nnc(Sc3ccc(C(=O)Nc4ccc(C)cc4)cc3[N+](=O)[O-])o2)cc1 524171167 LMFBYLLSCOPHNS-UHFFFAOYSA-N 476.514 5.289 5 20 JKBD O=[N+]([O-])c1ccc(-c2ccc(CN[C@H](c3ccccc3)[C@H]3CCCO3)o2)c(Br)c1 555190346 AXEQLTWBEFGIRA-FGZHOGPDSA-N 457.324 5.627 5 20 JKBD O=[N+]([O-])c1ccc(OCc2nnc(-c3ccccc3Br)o2)c(-c2cccs2)c1 590654691 CDCHRMJPVRTVON-UHFFFAOYSA-N 458.293 5.715 5 20 JKBD Cc1ccc(-c2csc(NC(=O)c3cccc(CS(=O)(=O)c4ccccc4)c3)n2)cc1[N+](=O)[O-] 603752010 BISDZVZWZWDPLY-UHFFFAOYSA-N 493.566 5.253 5 20 JKBD C[C@H]1CCN(C(=O)CCCn2c(=O)oc3cc([N+](=O)[O-])ccc32)c2cc(C(F)(F)F)ccc2S1 603961978 SEDZBPYLZFRIDN-ZDUSSCGKSA-N 495.479 5.219 5 20 JKBD O=C(CNc1cc([N+](=O)[O-])ccc1OC(F)F)N1N=C(c2cccs2)C[C@H]1c1cccs1 604006179 OEXBHXBSSJYVIZ-HNNXBMFYSA-N 478.502 5.109 5 20 JKBD CC1CCN(c2ccc(C(=O)Nc3ccc(NC(=O)c4ccco4)c(Cl)c3)cc2[N+](=O)[O-])CC1 604119206 GNIYEVYIPIYESB-UHFFFAOYSA-N 482.924 5.582 5 20 JKBD O=C(Nc1ccccc1-n1cncn1)c1ccc(Sc2nc3ccccc3s2)c([N+](=O)[O-])c1 604228602 OXFIVYKLETUOBL-UHFFFAOYSA-N 474.527 5.189 5 20 JKBD C[C@@H](Nc1ccc(C(=O)Nc2cccc(-c3n[nH]c4c3CCCC4)c2)cc1[N+](=O)[O-])c1ccccn1 604335879 BINKLYIHIDMZOK-QGZVFWFLSA-N 482.544 5.684 5 20 JKBD COc1ccc(Br)c(NC(=O)c2ccc(N[C@H](C)c3ccccn3)c([N+](=O)[O-])c2)c1 604543369 YEUJLXXSIKMPDZ-CYBMUJFWSA-N 471.311 5.186 5 20 JKBD O=[N+]([O-])c1ccc(-c2ccc(CNc3cc(-c4ccc(Br)cc4)nn3CCO)o2)cc1 608982716 NGBLGSWWJXQELN-UHFFFAOYSA-N 483.322 5.085 5 20 JKBD COc1cc(COC(=O)c2csc(-c3cccc([N+](=O)[O-])c3)n2)cc(Cl)c1OC(F)F 747635383 XUPPKACSKBVKRX-UHFFFAOYSA-N 470.837 5.339 5 20 JKBD Cc1nc(CSc2ccc(C(=O)OCC3CCN(c4ccc([N+](=O)[O-])cn4)CC3)cc2)cs1 750429547 YVBBIHHHZWYYRF-UHFFFAOYSA-N 484.603 5.120 5 20 JKBD Cc1nc(NC(=O)c2cc([N+](=O)[O-])ccc2Br)sc1Cc1ccc(F)cc1 751092322 CMMZYYWUXIIGDP-UHFFFAOYSA-N 450.289 5.104 5 20 JKBD Cc1ccc(Sc2ccc(-c3nc([C@H]4CCC(=O)N(CC5CCC5)C4)no3)cc2[N+](=O)[O-])cc1 856563989 ABISSWHHBWROFA-IBGZPJMESA-N 478.574 5.611 5 20 JKBD Cc1c(Br)cc([N+](=O)[O-])cc1-c1nc(-c2ccc(OCc3cccnc3)cc2)no1 904465863 JWWOWYAQTWPRSS-UHFFFAOYSA-N 467.279 5.357 5 20 JKBD O=[N+]([O-])c1ccc(-c2nc(-c3ccc(Oc4ncc(C(F)(F)F)cc4Cl)cc3)no2)nc1 904667621 CQAVEMGTRUFCKI-UHFFFAOYSA-N 463.759 5.566 5 20 JKBD CC(C)(C)c1noc(CCC(=O)Nc2cc(Cl)c([N+](=O)[O-])cc2OCc2ccccc2)n1 915139095 KKNDMCZCDOYIQG-UHFFFAOYSA-N 458.902 5.079 5 20 JKBD COc1ccc(Oc2ccc([N+](=O)[O-])cc2C(=O)Oc2ccc(NC(=O)c3ccco3)cc2)cc1 916956942 OEZQPJNOJCGJJL-UHFFFAOYSA-N 474.425 5.460 5 20 JKBD Cc1c(NC(=O)c2cc([N+](=O)[O-])ccc2N2CCC(C)CC2)cccc1-c1nnc2n1CCCCC2 917677223 QXRUPOYNWXDZLE-UHFFFAOYSA-N 488.592 5.377 5 20 JKBD O=C(Nc1cccc(NC(=O)c2cc([N+](=O)[O-])ccc2F)c1)Nc1cccc(C(F)(F)F)c1 920011265 QBKZGTXSJDXTIV-UHFFFAOYSA-N 462.359 5.649 5 20 JKBD Cc1nc(-c2cccc(NC(=O)c3ccccc3NC(=O)c3ccc([N+](=O)[O-])cc3Cl)c2)[nH]c1C 920251339 IXWGDEMRBHZSGW-UHFFFAOYSA-N 489.919 5.760 5 20 JKBD O=C(/C=C/c1ccc([N+](=O)[O-])o1)Nc1ccc(C2(NC(=O)c3cc4cccnc4s3)CCC2)cc1 1786207377 GNJMKCDMPFKYMO-CSKARUKUSA-N 488.525 5.259 5 20 JKBD O=C(NC1(c2ccc(NC(=O)[C@@H](F)c3ccccc3)cc2)CCC1)c1ccc([N+](=O)[O-])cc1F 1786613242 JRACQEFFLBUJRG-QFIPXVFZSA-N 465.456 5.192 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)c3ccc([N+](=O)[O-])[nH]3)CCC2)cc1)c1c[nH]c(-c2ccc(F)cc2)c1 1787134499 FHFASRVGGPDKCV-UHFFFAOYSA-N 487.491 5.119 5 20 JKBD O=C(NC1(c2ccc(NC(=O)c3cc4ccoc4s3)cc2)CCC1)c1ccc(O)c([N+](=O)[O-])c1 1788415742 OOEZXNJCJMFAFF-UHFFFAOYSA-N 477.498 5.170 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)NC1(c2ccc(NC(=O)c3cc(C(C)C)no3)cc2)CCC1 1790162345 LRQDHRSHUCGJTN-UHFFFAOYSA-N 480.496 5.215 5 20 JKBD Cc1ccc(C(=O)Nc2ccc(C3(NC(=O)/C=C/c4ccc([N+](=O)[O-])o4)CCC3)cc2)c(F)c1 1790605576 WVYAQVGAGILQJT-DHZHZOJOSA-N 463.465 5.096 5 20 JKBD C[C@@]1(C(=O)NC2(c3ccc(NC(=O)c4cc5cc([N+](=O)[O-])ccc5s4)cc3)CCC2)CC1(F)F 1791010799 ZFBCTEXMTRTZTH-QFIPXVFZSA-N 485.512 5.603 5 20 JKBD O=C(CSc1ccccc1[N+](=O)[O-])Nc1ccc(C2(NC(=O)Cc3cccs3)CCC2)cc1 1791522182 IXMYCYJEMZQMEH-UHFFFAOYSA-N 481.599 5.125 5 20 JKBD COc1cc(C(=O)Nc2ccc(C3(NC(=O)c4cc(C)cs4)CCC3)cc2)ccc1[N+](=O)[O-] 1792164263 YAERPONJNBUJCI-UHFFFAOYSA-N 465.531 5.035 5 20 JKBD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)[nH]n1)[C@@H]1CC=CCC1 1814793222 ZQYXLEQOHXUEPN-BEFAXECRSA-N 479.562 5.195 5 20 JKBD Cc1cccc2[nH]c(C(=O)N3CCCC[C@@H]3C3CCN(C(=O)c4cccc(F)c4[N+](=O)[O-])CC3)cc12 1828577649 NRGFIPSIVNKEBI-XMMPIXPASA-N 492.551 5.071 5 20 JKBD C[C@H](Sc1ccccc1)C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cc(F)cc([N+](=O)[O-])c2)CC1 1830612324 ANLDBDCLERQIGQ-UUOWRZLLSA-N 499.608 5.148 5 20 JKBD O=C(c1ccccc1C1CC1)N1CCC([C@@H]2CCCCN2C(=O)c2cccc(F)c2[N+](=O)[O-])CC1 1830622731 MCXGYPWRKNIGMY-DEOSSOPVSA-N 479.552 5.158 5 20 JKBD CC1(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)CCc3cccc([N+](=O)[O-])c3)CC2)CCCCC1 1831792422 RFGFTWFVXSHKOW-XMMPIXPASA-N 469.626 5.118 5 20 JKBD O=C(NC1CCN(C2CC2)CC1)c1c2c(nc3ccccc13)/C(=C/c1ccc([N+](=O)[O-])cc1)CCC2 9962183 UDLOWXQJHKQLDB-CZIZESTLSA-N 482.584 5.377 5 20 JKBD COc1ccccc1NC(=O)c1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2N2CCC(C)CC2)cc1 15313495 BWSQLWQWSDYHJE-UHFFFAOYSA-N 488.544 5.344 5 20 JKBD COc1ccc(-n2c(SCc3cc([N+](=O)[O-])ccc3OC)nnc2-c2ccccc2OC)cc1 21368435 QCADGFADVGIZJQ-UHFFFAOYSA-N 478.530 5.161 5 20 JKBD Cc1ccsc1CN(C)[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Br)c1ccccc1 21793383 GRVPFSRFAZAEML-FQEVSTJZSA-N 474.380 5.539 5 20 JKBD CCCN(CC(=O)Nc1ccc(Cl)cc1Cl)C(=O)Cn1c2ccccc2c(=O)c2ccccc21 24354025 KCHOVMHFQLNFTN-UHFFFAOYSA-N 496.394 5.339 5 20 JKBD Cc1cccc(NC(=O)[C@@H](C)OC(=O)Cc2cn(-c3ccccc3)nc2-c2ccc([N+](=O)[O-])cc2)c1C 27258821 KVXGBXHCRRCZKY-HXUWFJFHSA-N 498.539 5.177 5 20 JKBD COc1cc(C(=O)N(C)Cc2ccccc2[N+](=O)[O-])ccc1OCc1ccc(Br)s1 32166856 FFXNCRYQTKJPEN-UHFFFAOYSA-N 491.363 5.279 5 20 JKBD CC[C@@H](C)Sc1ccc(NC(=O)c2ccc(-n3cncn3)c([N+](=O)[O-])c2)c(C(F)(F)F)c1 499535905 ZNMKGNGVHVRYRV-GFCCVEGCSA-N 465.457 5.337 5 20 JKBD O=C(NCC1CCOCC1)c1c2c(nc3ccccc13)/C(=C\c1ccc([N+](=O)[O-])cc1)CCC2 501722311 XSRNNNKNQFBFOD-SILNSSARSA-N 457.530 5.176 5 20 JKBD Cc1ccc(NC(=O)C2CCN(C(=O)c3ccc(Oc4ccc(Cl)cc4[N+](=O)[O-])cc3)CC2)nc1 503045205 HMYCNJFQTDMHPO-UHFFFAOYSA-N 494.935 5.235 5 20 JKBD COc1ccc(C(=O)Nc2cccc(NC(=O)c3cccc(C(F)(F)F)c3)c2)cc1[N+](=O)[O-] 504789212 DEKDNCOSLDZORI-UHFFFAOYSA-N 459.380 5.127 5 20 JKBD C[C@H](NC(=O)c1cc([N+](=O)[O-])ccc1Sc1ccccc1)C(=O)Nc1cccc(N2CCCC2)c1 505490206 ARDUTACJLNZLTF-SFHVURJKSA-N 490.585 5.103 5 20 JKBD CN(C)C(=O)c1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2Sc2ccc(Cl)cc2)cc1Cl 510205074 AYBIXOZHEHHISG-UHFFFAOYSA-N 490.368 6.007 5 20 JKBD O=C(C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)N[C@@H](c1cccs1)C1CC1 515008692 IFXKMIRZABWUAX-YLJZTEMXSA-N 475.595 6.464 5 20 JKBD Cc1cc([N+](=O)[O-])ccc1NC(=O)CSc1nnc(-c2ccccc2)n1[C@@H](C)c1ccccc1 515488842 ZFWNRWUTPWSZJM-SFHVURJKSA-N 473.558 5.502 5 20 JKBD CCOc1ccc(NC(=O)CNc2ccc(C(=O)N(C)C3CCCCC3)c(Cl)c2)c([N+](=O)[O-])c1 515657359 SWNJEFWNWACCTN-UHFFFAOYSA-N 488.972 5.102 5 20 JKBD C[C@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)NCC1(c2ccc(Cl)cc2Cl)CCOCC1 518856091 DRSKSEIGWZFRFY-ZDUSSCGKSA-N 487.767 5.187 5 20 JKBD O=[N+]([O-])c1ccc(-c2nn(-c3ccccc3)cc2CNC[C@@H]2CCCO[C@@H]2c2ccccc2)cc1 520960604 GGURUZORWOCBBB-NEKDWFFYSA-N 468.557 5.705 5 20 JKBD Cc1nn(C)c(C(=O)Nc2ccc(Oc3ccccc3Br)c(Cl)c2)c1[N+](=O)[O-] 521733620 JLACHJUGKUPVAR-UHFFFAOYSA-N 465.691 5.097 5 20 JKBD O=C(NCc1ccccc1NS(=O)(=O)c1ccccc1)c1cc2ccccc2c2cccnc12 522559754 YYWIPZHWANFZDR-UHFFFAOYSA-N 467.550 5.119 5 20 JKBD O=C(c1ccc(NCc2ccccc2Cl)c([N+](=O)[O-])c1)N1CCC(c2ccc(O)cc2)CC1 591532885 GDWSGNBMYFVHAI-UHFFFAOYSA-N 465.937 5.586 5 20 JKBD CCCSc1ccc([N+](=O)[O-])cc1C(=O)N1C[C@H]2CC[C@H]1[C@H]1CN(Cc3ccccc3)C[C@@H]21 594660120 JBNXLEWWQOTYJU-DLTYFMDKSA-N 465.619 5.080 5 20 JKBD Cc1c(NC(=O)N(CCO)Cc2cccc(OCc3ccccc3Cl)c2)cccc1[N+](=O)[O-] 603645979 XNAKPXNEFYLJPJ-UHFFFAOYSA-N 469.925 5.162 5 20 JKBD COc1cc([C@H]2Nc3cc(Cl)ccc3C(=O)N2C)ccc1OCc1ccc([N+](=O)[O-])cc1 603937895 BVAYOGHWAQILKV-QFIPXVFZSA-N 453.882 5.032 5 20 JKBD Cc1ccc(C(C)C)c(Oc2ccc(CNc3ccnn3C[C@H]3CCOC3)cc2[N+](=O)[O-])c1 608982748 RJALFJHNHPSUDH-HXUWFJFHSA-N 450.539 5.664 5 20 JKBD COc1cc(C(=O)Nc2ccc(Nc3ccccc3)nc2)c([N+](=O)[O-])cc1OCc1cscn1 609108558 AKERFXGCOCPDCE-UHFFFAOYSA-N 477.502 5.030 5 20 JKBD CCOc1ccc(OCC)c(NC(=S)/C(=C(/O)c2cccc([N+](=O)[O-])c2)[n+]2ccc(C)cc2)c1 726961630 DWQGAPGZZPUZHP-UHFFFAOYSA-O 480.566 5.311 5 20 JKBD CCn1c(COC(=O)c2ccc(N[C@H](C)c3ccccn3)c([N+](=O)[O-])c2)nc2cc(F)ccc21 727515064 GUTAOWRNPZOISE-OAHLLOKOSA-N 463.469 5.029 5 20 JKBD COc1cc(NC(=O)CCC(=O)c2ccc3ccc4cccc5ccc2c3c45)c(C(N)=O)cc1OC 727756797 DREPQBFLKJJOEB-UHFFFAOYSA-N 480.520 5.302 5 20 JKBD O=C(CCc1nc(-c2cccs2)no1)Oc1ccc2c(-c3ccc([N+](=O)[O-])cc3)cc(=O)oc2c1 728022130 NMPBALRKDDDKRP-UHFFFAOYSA-N 489.465 5.018 5 20 JKBD C[C@@H](OC(=O)c1c(Cl)cccc1[N+](=O)[O-])C(=O)Nc1ccc(Cl)cc1C(F)(F)F 730644724 FISTUHRTQFZTIH-MRVPVSSYSA-N 451.184 5.104 5 20 JKBD C[C@H](OC(=O)[C@H]1C[C@@H]1c1ccc2ccccc2c1)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 731272237 BEOPDJGZXGLQMQ-BKTGTZMESA-N 472.419 5.441 5 20 JKBD CC(=O)N(c1cccc(C(F)(F)F)c1)c1nc(COC(=O)c2cc(F)ccc2[N+](=O)[O-])cs1 743197118 DJYYLLLCILTOGM-UHFFFAOYSA-N 483.399 5.251 5 20 JKBD O=C(Nc1ccc(OC(=O)C2CCN(Cc3ccccc3)CC2)cc1)c1cc([N+](=O)[O-])ccc1Cl 743845207 YYOZBRKNXPVALO-UHFFFAOYSA-N 493.947 5.318 5 20 JKBD O=C(c1cc([N+](=O)[O-])ccc1N1CCC(Cc2ccccc2)CC1)N1CCC(OC2CCCC2)CC1 749526039 PNMMWABDOYUJNH-UHFFFAOYSA-N 491.632 5.618 5 20 JKBD Cc1c(Br)cc(-c2nc(C(C)(C)NC(=O)c3cccc(Cl)c3)no2)cc1[N+](=O)[O-] 904597524 FWMNBCVZDACDJK-UHFFFAOYSA-N 479.718 5.034 5 20 JKBD COc1ccc(-c2noc(CCCC(=O)OCc3nc4ccccc4c4ccccc34)n2)cc1 915455902 GMLCTZNCMUARBH-UHFFFAOYSA-N 453.498 5.513 5 20 JKBD O=C(Cn1c2ccccc2c(=O)c2ccccc21)OCc1nnc(-c2ccc(Cl)cc2Cl)o1 920518978 CFAZOPDMYSBPNP-UHFFFAOYSA-N 480.307 5.255 5 20 JKBD CC(C)[C@H](OC(=O)c1ccc(N[C@@H](C)c2ccccn2)c([N+](=O)[O-])c1)C(=O)Nc1ccccc1F 920545607 UHMJLODPTRNTKR-HJPURHCSSA-N 480.496 5.122 5 20 JKBD C[C@H](Nc1ccc(C(=O)OCC(=O)Nc2cccc3ccccc23)cc1[N+](=O)[O-])c1ccccn1 920546958 MGKGSPAWNUDQNN-KRWDZBQOSA-N 470.485 5.112 5 20 JKBD O=C(Cc1cc([N+](=O)[O-])ccc1F)Nc1ccc(C2(NC(=O)c3cccc4cnccc34)CCC2)cc1 1786672604 FCEDRPHXZUEDJF-UHFFFAOYSA-N 498.514 5.273 5 20 JKBD O=C(Cc1ccccc1)Nc1ccc(C2(NC(=O)CSc3ccccc3[N+](=O)[O-])CCC2)cc1 1787745648 DQQLJZOTXWGGLJ-UHFFFAOYSA-N 475.570 5.064 5 20 JKBD O=C(Cc1cc([N+](=O)[O-])ccc1F)NC1(c2ccc(NC(=O)c3cccc4ncccc34)cc2)CCC1 1788904826 SEUMWPRQNHNRHY-UHFFFAOYSA-N 498.514 5.273 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)c3cc(Cl)nc4ccccc34)CCC2)cc1)c1ccc([N+](=O)[O-])[nH]1 1790185696 CFPAACRSVQYIGW-UHFFFAOYSA-N 489.919 5.186 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)c3cccc(C(F)(F)F)c3F)CCC2)cc1)c1ccc([N+](=O)[O-])[nH]1 1790187182 COZYOHURUOHUKY-UHFFFAOYSA-N 490.413 5.142 5 20 JKBD COc1ccc(CC(=O)Nc2ccc(C3(NC(=O)C[C@@H]4C[C@@H]5CC[C@H]4C5)CCC3)cc2)c([N+](=O)[O-])c1 1790571558 AKVFOSGAQULBSP-DYXWJJEUSA-N 491.588 5.106 5 20 JKBD O=C(NC1(c2ccc(NC(=O)c3ccc([N+](=O)[O-])cc3F)cc2)CCC1)c1cc2cccnc2s1 1790621802 HQFALXCPDRVVJR-UHFFFAOYSA-N 490.516 5.405 5 20 JKBD Cc1cccc(F)c1C(=O)Nc1ccc(C2(NC(=O)/C=C/c3ccc([N+](=O)[O-])o3)CCC2)cc1 1792081682 PZCTXTCLWURBPV-ZRDIBKRKSA-N 463.465 5.096 5 20 JKBD Cc1cc(O)c([N+](=O)[O-])cc1C(=O)NC1(c2ccc(NC(=O)[C@]3(F)CCCC=C3F)cc2)CCC1 1792377606 GBJKBNRVXSNSMX-VWLOTQADSA-N 485.487 5.102 5 20 JKBD Cc1cccc(Cl)c1C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2ccc([N+](=O)[O-])cc2F)[nH]n1 1821144699 RIDJKCMQKBIECP-IBGZPJMESA-N 485.903 5.039 5 20 JKBD CC[C@@H](C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cc([N+](=O)[O-])c(O)cc2C)CC1)c1ccccc1 1830788272 IMBDMLNNDNCTGI-ISKFKSNPSA-N 493.604 5.036 5 20 JKBD Cc1ncsc1C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)CC1 1831059017 AWPFAQBIXWXCCH-LJQANCHMSA-N 498.630 5.122 5 20 JKBD COc1cc(-c2nnc(SCc3ccccc3[N+](=O)[O-])n2-c2ccccc2F)cc(OC)c1OC 8622080 DRKVILVPJRWEQG-UHFFFAOYSA-N 496.520 5.300 5 20 JKBD COc1cc(C(=O)O[C@@H](C(=O)Nc2ccc(C)cc2[N+](=O)[O-])c2ccccc2)ccc1OC(F)F 8853970 HOURAJRQLBPZAT-OAQYLSRUSA-N 486.427 5.050 5 20 JKBD CC(=O)N(c1cccc(Cl)c1)c1nc(COC(=O)c2ccc(Cl)cc2[N+](=O)[O-])cs1 10748690 CAGNJJZHCNRBKT-UHFFFAOYSA-N 466.302 5.400 5 20 JKBD COc1ccccc1NC(=O)c1cc2ccccc2cc1OS(=O)(=O)c1cc([N+](=O)[O-])ccc1C 15329481 FMCRYDMQERMMDR-UHFFFAOYSA-N 492.509 5.085 5 20 JKBD O=C(CSc1nccn1-c1cccc(Cl)c1)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 21421887 KOVITRLOUAKKFT-UHFFFAOYSA-N 456.833 5.184 5 20 JKBD CCN(C(C)=O)c1nc(COC(=O)c2ccc(Sc3ccc(C)cc3)c([N+](=O)[O-])c2)cs1 23943756 MCAUOOWLOQPBIO-UHFFFAOYSA-N 471.560 5.241 5 20 JKBD Cc1ccc(N[C@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Br)c2ccccc2)cc1F 25425424 SJVDLQZOSVLFSA-FQEVSTJZSA-N 458.287 5.597 5 20 JKBD O=C(C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)NCCc1nc2ccccc2[nH]1 50942213 TVXFXQUOOPEJQR-OBGWFSINSA-N 483.553 5.370 5 20 JKBD C[C@@H](NC(=O)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1)c1ccc2c(c1)CCC(=O)N2 71930062 UUJGTZXAPMYRSN-CQSZACIVSA-N 465.893 5.416 5 20 JKBD COc1ccc(F)cc1-c1csc(NC(=O)Cn2c3ccccc3c(=O)c3ccccc32)n1 107625916 IUXIYWSWQPCUGR-UHFFFAOYSA-N 459.502 5.065 5 20 JKBD CN(Cc1nccn1CC(F)(F)F)C(=O)c1cc([N+](=O)[O-])ccc1Sc1ccc(Cl)cc1 486472216 KKUCGZMMUOJIOY-UHFFFAOYSA-N 484.887 5.430 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Cl)[C@@H](c1ccccc1)N1CCC(OC2CCCCC2)CC1 497379876 ADGCLKAFTSLUGM-XMMPIXPASA-N 471.985 5.742 5 20 JKBD COc1ccc([N+](=O)[O-])c(C(=O)Nc2cccc(NC(=O)c3cccc(C(F)(F)F)c3)c2)c1 504820637 TWPVQTAYKHBJPT-UHFFFAOYSA-N 459.380 5.127 5 20 JKBD CN1CCC(CN(C)C(=O)c2c3c(nc4ccccc24)/C(=C\c2ccc([N+](=O)[O-])cc2)CCC3)CC1 505720558 PUBHPQLMUAORHT-PYCFMQQDSA-N 484.600 5.434 5 20 JKBD O=C(Cc1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1)N1CCC[C@H]1c1cccs1 506960289 BIJXSSZVZRBQTH-QFIPXVFZSA-N 458.543 5.415 5 20 JKBD CC(C)CCSc1ccc(C(=O)Nc2cc(C(=O)N(C)C(C)C)ccc2Cl)cc1[N+](=O)[O-] 509292124 YUIJMDXIOPAQGJ-UHFFFAOYSA-N 478.014 6.119 5 20 JKBD O=C(CCCNc1ccc([N+](=O)[O-])cc1)Nc1ccc(NC(=O)c2ccc(Cl)cc2)cc1 509829100 UOTXNJFDWIDYOF-UHFFFAOYSA-N 452.898 5.331 5 20 JKBD O=C(Nc1ccc(CCN2CCCC2)cc1)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 516674397 CCJSGVPPMQWDSM-UHFFFAOYSA-N 490.526 5.107 5 20 JKBD CCOc1ccc(NC(=O)c2ccc(N3CCC[C@H](C)C3)c([N+](=O)[O-])c2)c(C(F)(F)F)c1 520403737 WZXNMTWILRKUOK-AWEZNQCLSA-N 451.445 5.501 5 20 JKBD CCCCc1ccc(-c2csc(NC(=O)CNC(=O)c3c(Cl)cccc3[N+](=O)[O-])n2)cc1 520818816 DXCKNKODKHDJDE-UHFFFAOYSA-N 472.954 5.083 5 20 JKBD O=C1c2ccccc2N[C@@H](c2csc(-c3cccc([N+](=O)[O-])c3)n2)N1c1ccc2c(c1)OCCO2 602758700 KWZPEJLDWGYEMJ-HSZRJFAPSA-N 486.509 5.261 5 20 JKBD CC(C)(C)c1ccc(C(=O)Nc2ccc(NC(=O)[C@@H]3CCCO3)cc2C(F)(F)F)cc1[N+](=O)[O-] 603761572 IPASORDHBDJDQT-IBGZPJMESA-N 479.455 5.281 5 20 JKBD COc1ccc(Oc2ccc([N+](=O)[O-])cc2C(=O)N2CCC(CN3CCCCCC3)CC2)cc1 604437492 SINPSRJUJSHLJK-UHFFFAOYSA-N 467.566 5.124 5 20 JKBD CC(C)(C)c1nc(CC(=O)O[C@@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2ccccc2)cs1 726835200 RZBMSOBUEIVXAV-HXUWFJFHSA-N 487.965 5.468 5 20 JKBD CCc1cccc[n+]1/C(C(=S)Nc1c(Cl)ccc(C)c1Cl)=C(/O)c1cccc([N+](=O)[O-])c1 728558486 NAQNLBDASDBIPU-UHFFFAOYSA-O 489.404 6.383 5 20 JKBD CC(C)c1nc(C(=O)Nc2cc([N+](=O)[O-])c(F)cc2F)nn1-c1c(Cl)cccc1Cl 728806327 XXDKJBLIGLYRAJ-UHFFFAOYSA-N 456.236 5.136 5 20 JKBD COc1ccc(NC(=O)[C@@H](OC(=O)c2c(Cl)cccc2[N+](=O)[O-])c2ccccc2)cc1Cl 730645946 VJNXZCPCEZGHGX-FQEVSTJZSA-N 475.284 5.447 5 20 JKBD Cc1c(NC(=O)[C@H](C)OC(=O)c2csc(-c3ccc(Cl)c(Cl)c3)n2)cccc1[N+](=O)[O-] 744604401 FLCAIKUFTUEJBA-NSHDSACASA-N 480.329 5.518 5 20 JKBD Cc1sc(CNC(=O)c2cc([N+](=O)[O-])c(C)c([N+](=O)[O-])c2C)nc1-c1ccc(Cl)cc1 748718124 SEGOOGYWJTYMLP-UHFFFAOYSA-N 460.899 5.135 5 20 JKBD Cc1oc(-c2ccco2)nc1CC(=O)Nc1cc(Cl)c([N+](=O)[O-])cc1OCc1ccccc1 749472643 OVXXSVZQBPPIAK-UHFFFAOYSA-N 467.865 5.565 5 20 JKBD O=C(CC[C@@H]1Cc2ccccc2NC1=O)Nc1cc(Cl)c([N+](=O)[O-])cc1OCc1ccccc1 818893743 DLFYTBVIFQOGBZ-GOSISDBHSA-N 479.920 5.357 5 20 JKBD O=C(Nc1ccc(Cl)c([N+](=O)[O-])c1)C(=O)N[C@H](CCCc1ccccc1)c1ccccc1 915744653 LWZMRKYFOQYIJS-OAQYLSRUSA-N 451.910 5.067 5 20 JKBD O=C(Nc1ccc(Cl)c([N+](=O)[O-])c1)NC1CCN(Cc2cccc(C(F)(F)F)c2)CC1 916706150 IRDWUCBBZRSTQL-UHFFFAOYSA-N 456.852 5.053 5 20 JKBD O=C(NC1(c2ccc(NC(=O)[C@H]3C[C@H]3C3CC3)cc2)CCC1)c1ccc(Br)c([N+](=O)[O-])c1 1786057675 XDFOGSXORJICEP-OALUTQOASA-N 498.377 5.151 5 20 JKBD O=C(Cc1ccccn1)NC1(c2ccc(NC(=O)c3cc4cc([N+](=O)[O-])ccc4s3)cc2)CCC1 1791010966 KRQSQJMDZGCJMD-UHFFFAOYSA-N 486.553 5.195 5 20 JKBD COc1cc(C(=O)NC2(c3ccc(NC(=O)[C@H]4C[C@H]4c4ccccc4)cc3)CCC2)ccc1[N+](=O)[O-] 1791531606 HVWJIZLKWZKAAT-GOTSBHOMSA-N 485.540 5.155 5 20 JKBD CN(C)c1ccc([N+](=O)[O-])c(C(=O)NC2(c3ccc(NC(=O)[C@@]4(F)CCCC=C4F)cc3)CCC2)c1 1792379280 IHWRDYKOOBQXSB-AREMUKBSSA-N 498.530 5.154 5 20 JKBD CCC[C@H]1CC[C@H](C(=O)NC[C@H]2CCN(C(=O)c3ccc([N+](=O)[O-])cc3F)[C@H]2c2cccnc2)CC1 1812789321 IERQJOKXZVTITN-JDFHOKRYSA-N 496.583 5.055 5 20 JKBD CCc1ncccc1C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cc(Cl)cc([N+](=O)[O-])c2C)CC1 1830734530 MMDZQMGZJARFLY-HSZRJFAPSA-N 499.011 5.061 5 20 JKBD O=C(c1ccc([N+](=O)[O-])cc1F)N1CC2(CCCN2C(=O)C2CCC(c3ccc(Cl)cc3)CC2)C1 1841409364 JOJUGZRXJHDEIR-UHFFFAOYSA-N 499.970 5.178 5 20 JKBD COc1cc2c(cc1OC)[C@@H](c1cccs1)N(C(=O)c1ccc(SC)c([N+](=O)[O-])c1)CC2 16002381 AAPRIAKUYRMBDL-QFIPXVFZSA-N 470.572 5.183 5 20 JKBD COc1ccc(N2C(=O)CC[C@@H](C(=O)Nc3cc([N+](=O)[O-])ccc3C)[C@@H]2c2ccccc2OC)cc1 19161038 JYQXVMGYHBIKCM-GJZUVCINSA-N 489.528 5.043 5 20 JKBD CCn1c(SCC(=O)Nc2c(Cl)cc(Cl)cc2Cl)nc2cc3ccccc3cc2c1=O 22177825 GHHJGGJCODZDRC-UHFFFAOYSA-N 492.815 6.261 5 20 JKBD CC(C)n1nccc1NC(=O)[C@@H](C)OC(=O)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1 23467982 ISYDTKYMMJPKPX-CQSZACIVSA-N 472.885 5.002 5 20 JKBD Cc1ccc(Sc2ccc(C(=O)NCc3ccc(C(=O)N4CCCC4)cc3)cc2[N+](=O)[O-])cc1 25326688 PBIOHDAYAFFTRW-UHFFFAOYSA-N 475.570 5.220 5 20 JKBD COc1ccc(CSCC(=O)Nc2ccc(Cl)c(C(=O)NC3CCCCC3)c2)cc1[N+](=O)[O-] 108397040 FDRCMGRLIZRSLD-UHFFFAOYSA-N 491.997 5.191 5 20 JKBD CC1CCN(C(=O)c2ccccc2NC(=O)c2ccc(N[C@@H](C)c3ccccn3)c([N+](=O)[O-])c2)CC1 195628172 LDVIKNJYCYIHAA-IBGZPJMESA-N 487.560 5.287 5 20 JKBD O=C(CCNc1ccc(C(F)(F)F)cc1[N+](=O)[O-])Nc1cc(C(=O)N2CCCCC2)ccc1Cl 303171040 RKEDAJYVQPISHX-UHFFFAOYSA-N 498.889 5.334 5 20 JKBD CC(C)OC(=O)C[C@H](NC(=O)c1ccc(NC(=O)Nc2ccccc2)cc1)c1ccccc1[N+](=O)[O-] 504389208 VADYAKADANIDHZ-QFIPXVFZSA-N 490.516 5.052 5 20 JKBD COc1ccc(C[C@H](NC(=O)N(Cc2ccc([N+](=O)[O-])cc2)C(C)C)c2ccc(OC)cc2)cc1 509374845 WRAOBEOMOJATTE-SANMLTNESA-N 477.561 5.516 5 20 JKBD COc1cc(CN[C@H]2CCSc3c(F)cccc32)c([N+](=O)[O-])cc1OCc1ccccc1 509611109 ZFLBBYNHPVVUDE-FQEVSTJZSA-N 454.523 5.648 5 20 JKBD CCn1c(SCc2cc(OC)c(OC(F)F)cc2[N+](=O)[O-])nnc1-c1cccc(C)c1 514723538 NMGMEHXWKXNKOL-UHFFFAOYSA-N 450.467 5.084 5 20 JKBD Cc1cnn([C@@H]2CCCc3ccccc32)c1NC(=O)Cn1c2ccccc2c(=O)c2ccccc21 519037665 KUGZEBXDOKBYQW-AREMUKBSSA-N 462.553 5.224 5 20 JKBD CC(=O)N1CCC(CNC(=O)c2c3c(nc4ccccc24)/C(=C/c2ccc([N+](=O)[O-])cc2)CCC3)CC1 519114981 VXIPTURXSYWHPG-OQKWZONESA-N 498.583 5.008 5 20 JKBD CC[C@H](NCc1ccc(Oc2cc(C)ccc2C(C)C)c([N+](=O)[O-])c1)c1nnc2n1CCCCC2 521831877 UTAPSCLGRPOIEJ-QFIPXVFZSA-N 477.609 6.378 5 20 JKBD Cc1ccc(C(=O)NCC(F)(F)F)cc1NC(=O)c1cc([N+](=O)[O-])ccc1Oc1ccccc1 603774373 RFERVXUNURAAEY-UHFFFAOYSA-N 473.407 5.240 5 20 JKBD CN(CCCc1cc(-c2ccc(F)cc2)n[nH]1)C(=O)c1ccc(NCc2ccccc2)c([N+](=O)[O-])c1 603921983 RLIRDDWCGBUAKD-UHFFFAOYSA-N 487.535 5.441 5 20 JKBD COc1ccc(CCNC(=O)C/C(=C/c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)cc1F 609116404 KIWGADBJQVLHCJ-RGEXLXHISA-N 491.544 5.642 5 20 JKBD CC(C)OC(=O)C[C@H](NC(=O)Nc1cccc(SC(F)F)c1)c1ccccc1[N+](=O)[O-] 727598503 ONRZPLJEIYJPEN-INIZCTEOSA-N 453.467 5.114 5 20 JKBD CC(C)c1noc2nc(-c3ccco3)cc(C(=O)N(C)Cc3cc([N+](=O)[O-])ccc3Cl)c12 727724952 GLAFEHBQBMJOEI-UHFFFAOYSA-N 454.870 5.440 5 20 JKBD COc1cc(NC(=O)N(Cc2ccc([N+](=O)[O-])cc2)C(C)C)ccc1NC(=O)OC(C)(C)C 729037658 WYRKMDAITKRBLR-UHFFFAOYSA-N 458.515 5.393 5 20 JKBD CC1=C(C(=O)Nc2ccccc2C)[C@H](c2ccc([N+](=O)[O-])cc2)NC(=O)N1Cc1cccs1 732040750 CLXUGYRWLJAUJG-QFIPXVFZSA-N 462.531 5.144 5 20 JKBD Cc1ccc(-c2nnc([C@H](C)OC(=O)c3ccc(N4CCC[C@@H](C)C4)c([N+](=O)[O-])c3)o2)cc1 745930548 OWUVQECCHKOCQG-SJORKVTESA-N 450.495 5.108 5 20 JKBD O=C(NO[C@H]1CCCCO1)c1c2c(nc3ccccc13)/C(=C/c1cccc([N+](=O)[O-])c1)CCC2 749620363 RFDSUFBWZAHRCX-ZGSOLVRCSA-N 459.502 5.208 5 20 JKBD O=C(Nc1nc(-c2sccc2Br)cs1)c1cc([N+](=O)[O-])ccc1Br 751088706 BOONTEDPHRBOFS-UHFFFAOYSA-N 489.170 5.557 5 20 JKBD Cc1cc(SC(C)(C)C)ccc1NC(=O)c1ccc(Cn2nc(C)c([N+](=O)[O-])c2C)cc1 751256505 FACWXZUIICRUHE-UHFFFAOYSA-N 452.580 5.908 5 20 JKBD C[C@H](OC(=O)/C(=C\c1ccc(F)cc1)c1cccs1)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl 772120351 AMSZSOOJXJAGDB-MFVBVHDHSA-N 474.897 5.560 5 20 JKBD O=[N+]([O-])c1cc(C(F)(F)F)c(Cl)cc1Sc1nnc(CN2CCCC2)n1Cc1ccccc1 799984212 WWLXRHVOBJDWCR-UHFFFAOYSA-N 497.930 5.654 5 20 JKBD Cc1nc(COc2ccc(Cl)cc2)sc1C(=O)O[C@@H](C)C(=O)Nc1cccc([N+](=O)[O-])c1C 857838456 SSVWAJNBLWSYRK-AWEZNQCLSA-N 489.937 5.085 5 20 JKBD O=C(Oc1ccc2c(-c3ccc([N+](=O)[O-])cc3)cc(=O)oc2c1)c1nc(Cl)ccc1Cl 890409351 FDMYBEWNQQDOQJ-UHFFFAOYSA-N 457.225 5.289 5 20 JKBD O=C(OCc1nc(O)c2ccc(C(F)(F)F)cc2n1)c1cc([N+](=O)[O-])ccc1Oc1ccccc1 919193636 ZHSJBCIGKADKLJ-UHFFFAOYSA-N 485.374 5.412 5 20 JKBD Cc1nn(C(C)(C)C)c2nc(C3CC3)cc(C(=O)O[C@@H](C)C(=O)Nc3ccc([N+](=O)[O-])cc3Cl)c12 919195931 OCSYQXAJRRBNCO-ZDUSSCGKSA-N 499.955 5.118 5 20 JKBD C[C@H](Sc1ccccc1)C(=O)NC1(c2ccc(NC(=O)c3ccc([N+](=O)[O-])o3)cc2)CCC1 1785748923 ZNCZHUHPINWKKM-INIZCTEOSA-N 465.531 5.116 5 20 JKBD Cc1ccc(CC(=O)Nc2ccc(C3(NC(=O)c4cc(Cl)cc([N+](=O)[O-])c4C)CCC3)cc2)cn1 1786940214 PJHWMIKAPLFFGF-UHFFFAOYSA-N 492.963 5.250 5 20 JKBD Cc1ccoc1C(=O)NC1(c2ccc(NC(=O)c3cccc(Br)c3[N+](=O)[O-])cc2)CCC1 1790752055 WTPPOHLNMGMVOS-UHFFFAOYSA-N 498.333 5.320 5 20 JKBD CCc1ncccc1C(=O)NC1(c2ccc(NC(=O)/C=C/c3ccccc3[N+](=O)[O-])cc2)CCC1 1792315745 YAOWRSJLXSPCBN-XNTDXEJSSA-N 470.529 5.013 5 20 JKBD O=C(CCC1CCC1)NC[C@H]1CCN(C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)[C@@H]1c1cccnc1 1803377066 BAVKMMLZGYQOJR-KBMIEXCESA-N 492.601 5.104 5 20 JKBD CC1=CC[C@H](C(=O)N2CC[C@H](CNC(=O)c3cc(Cl)cc([N+](=O)[O-])c3C)[C@H]2c2cccnc2)CC1 1811794812 UQQZYTISZJEKEJ-MFSJNOQSSA-N 496.995 5.018 5 20 JKBD Cc1ccc(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)c3cc(F)cc([N+](=O)[O-])c3)[nH]n2)cc1Cl 1814590537 LYCSKFWGURAOHN-FQEVSTJZSA-N 485.903 5.039 5 20 JKBD Cc1ccc(C(=O)N2CCC([C@@H]3CCCCN3C(=O)Cc3cccc([N+](=O)[O-])c3)CC2)c(Cl)c1 1823683992 PSAYSEHYWNRANA-DEOSSOPVSA-N 483.996 5.033 5 20 JKBD CCCc1ccc(C(=O)N2CCC([C@H]3CCCCN3C(=O)/C=C/c3ccc([N+](=O)[O-])o3)CC2)cc1 1824276810 YOWWZOCFJFBSFC-CYNGKWMKSA-N 479.577 5.087 5 20 JKBD O=C(c1cccs1)N1CCC([C@@H]2CCCCN2C(=O)C2(c3cccc([N+](=O)[O-])c3)CCC2)CC1 1830291865 UTQQWUOOQLBTOU-QFIPXVFZSA-N 481.618 5.012 5 20 JKBD Cc1c(C(=O)N2CCCC[C@H]2C2CCN(C(=O)CCC3CCC3)CC2)cc(Cl)cc1[N+](=O)[O-] 1830734844 UBCQBIIMXHUCID-QFIPXVFZSA-N 476.017 5.370 5 20 JKBD CC[C@@H](C)c1ccccc1NC(=O)[C@H](C)OC(=O)Cn1c2ccccc2c(=O)c2ccccc21 10722839 NOTAMPOOXPBJGA-MOPGFXCFSA-N 456.542 5.239 5 20 JKBD COc1cc(C(=O)OCC(=O)c2ccccc2F)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 10912158 KDZPMTJKLYYQFS-UHFFFAOYSA-N 459.813 5.228 5 20 JKBD Cc1ccc(NC(=O)[C@H](OC(=O)c2ccc(Cl)c([N+](=O)[O-])c2)c2ccccc2)c([N+](=O)[O-])c1 11025164 QIPKDQCOKGVZJX-HXUWFJFHSA-N 469.837 5.002 5 20 JKBD CCCn1c(S[C@H](C(=O)Nc2ccc(C)cc2[N+](=O)[O-])c2ccccc2)nnc1-c1ccncc1 11212694 WUTIHNOBHZVZMR-QFIPXVFZSA-N 488.573 5.439 5 20 JKBD CCOc1cc(NC(=O)c2cccc([N+](=O)[O-])c2C)c(OCC)cc1NC(=O)c1ccccc1 14717335 KAVZRBFBWNAOLM-UHFFFAOYSA-N 463.490 5.205 5 20 JKBD COc1cc(C(=O)NCc2ccc(CN(C)C)cc2)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 15171824 LSTYIOGUTRIPDP-UHFFFAOYSA-N 469.925 5.041 5 20 JKBD CCOc1ccc(NS(=O)(=O)c2cc(NC(=O)c3ccc(Cl)cc3[N+](=O)[O-])ccc2C)cc1 15898537 XYNNSJVLDMKJIE-UHFFFAOYSA-N 489.937 5.008 5 20 JKBD CSc1ccc([N+](=O)[O-])c(C(=O)O[C@@H](C)C(=O)Nc2c(Cl)cc(Cl)cc2Cl)c1 16196519 XIQCUBSJEVZXEF-QMMMGPOBSA-N 463.726 5.461 5 20 JKBD C[C@@H](OC(=O)c1ccc(NCc2ccccc2)c([N+](=O)[O-])c1)c1nnc(-c2cccs2)o1 17656736 OMBDDCIVMGKGBI-CQSZACIVSA-N 450.476 5.236 5 20 JKBD CC1CCN(c2ccc([N+](=O)[O-])cc2C(=O)Nc2nnc(SCc3ccccc3)s2)CC1 104684392 KYYGFVYJQWQBEK-UHFFFAOYSA-N 469.592 5.227 5 20 JKBD Cc1cc(C(=O)NC(C)C)ccc1NC(=O)Cc1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1 490063609 XSQAQGWQYNNIDH-UHFFFAOYSA-N 497.555 5.075 5 20 JKBD COc1cc(CN(C(=O)c2csc(-c3ccc([N+](=O)[O-])cc3)n2)C2CC2)ccc1OC(F)F 498346703 YBZHVPKGGRRBJN-UHFFFAOYSA-N 475.473 5.133 5 20 JKBD CCOc1cc(NC(=O)c2ccccc2C(=O)c2ccc(SC)c([N+](=O)[O-])c2)ccc1OC 502028503 NQZJXMONNODQFJ-UHFFFAOYSA-N 466.515 5.207 5 20 JKBD COC(=O)[C@H](NC(=O)C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)c1cccs1 509170137 QWCZNANNEBNFMI-ORYIKVKISA-N 493.566 5.227 5 20 JKBD Cc1cccc(Cc2sc(NC(=O)c3ccc([N+](=O)[O-])cc3I)nc2C)c1 511849717 JRKFHQCQZCWREX-UHFFFAOYSA-N 493.326 5.116 5 20 JKBD Cc1csc(N(C)C(=O)c2c3c(nc4ccccc24)/C(=C\c2ccc([N+](=O)[O-])cc2)CCC3)n1 512019169 WCARBFXPTJEFSR-JXAWBTAJSA-N 470.554 6.061 5 20 JKBD CCOc1ncccc1NC(=O)C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1 512931498 LGKSXNYLMOCGBJ-SAPNQHFASA-N 460.515 5.568 5 20 JKBD O=C(Nc1cc([N+](=O)[O-])ccc1OC(F)F)c1cccnc1Oc1ccc(Br)cc1 515215231 LZZQINMHFOFSNH-UHFFFAOYSA-N 480.221 5.398 5 20 JKBD CCOc1cc(CNCc2ccc(C)cc2)ccc1OCc1cc([N+](=O)[O-])cc2c1OCOC2 517542022 GYKSVHCHSODACW-UHFFFAOYSA-N 464.518 5.037 5 20 JKBD Cc1csc(Sc2ccc(NC(=O)[C@@H]3CCCN3C(=O)c3ccc([N+](=O)[O-])c(C)c3)cc2)n1 522573075 WFKWZOKTCPRIGV-FQEVSTJZSA-N 482.587 5.063 5 20 JKBD COc1ccc(Br)c(NC(=O)c2ccc(N3C[C@@H](C)C[C@@H](C)C3)c([N+](=O)[O-])c2)c1 523356346 AKDSSSRUZFADKB-OKILXGFUSA-N 462.344 5.101 5 20 JKBD CCN1CCC(CNC(=O)c2ccccc2Sc2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 583339563 SQWZSFNLJOOSSU-UHFFFAOYSA-N 467.513 5.227 5 20 JKBD CC(=O)Nc1ccc2nc(NC(=O)c3ccc(NCc4ccccc4)c([N+](=O)[O-])c3)sc2c1 591724789 XGMFLGIRVHFYLS-UHFFFAOYSA-N 461.503 5.027 5 20 JKBD O=C(CSc1ccc(C(F)(F)F)cc1[N+](=O)[O-])Nc1ccc(NC(=O)Nc2ccccc2)cc1 594667664 LMPOKZXRFXMRQZ-UHFFFAOYSA-N 490.463 5.988 5 20 JKBD Cc1ccc2sc(N(Cc3ccccc3)C(=O)c3ccc(S(C)(=O)=O)c([N+](=O)[O-])c3)nc2c1C 600814722 KVLPFAGFTWVNGB-UHFFFAOYSA-N 495.582 5.072 5 20 JKBD CC[C@@H](C)c1ccc([C@@H](NC(=O)C(=O)Nc2cccc([N+](=O)[O-])c2C)c2cccs2)cc1 603706275 WBXPKZAUTZBWGX-IVZQSRNASA-N 451.548 5.323 5 20 JKBD O=C(c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-])N1CCC[C@H](c2nc3ccccc3s2)C1 603777284 MWOXAJNLLQKMEP-ZDUSSCGKSA-N 465.453 5.165 5 20 JKBD C[C@H](Nc1ccc(NC(=O)CCNC(=O)c2ccc([N+](=O)[O-])cc2)cc1Cl)c1ccccc1 604512903 DIVUYXWYAKQRNZ-INIZCTEOSA-N 466.925 5.180 5 20 JKBD CCN(CC)S(=O)(=O)c1ccc([C@H](C)NCc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)cc1 608835531 RZRCIOQCFZWGMD-KRWDZBQOSA-N 473.620 5.205 5 20 JKBD CC[C@@H](NC(=O)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1)c1nnc2n1CCCCC2 608866389 LIVZNXOSXJDJMQ-GOSISDBHSA-N 469.929 5.240 5 20 JKBD O=C(Nc1cc([N+](=O)[O-])ccc1OC(F)F)c1ccc(Cl)c(NC(=O)c2cccs2)c1 609096081 CBZVCAMCZZNWJI-UHFFFAOYSA-N 467.837 5.416 5 20 JKBD CCCCCOc1ccc([C@H](C)NC(=O)Cn2c3ccccc3c(=O)c3ccccc32)cc1OC 611958747 IMJXYCGKGCVIKO-FQEVSTJZSA-N 472.585 5.610 5 20 JKBD CC(=O)N1CCC(COC(=O)c2c3c(nc4ccccc24)/C(=C/c2ccc([N+](=O)[O-])cc2)CCC3)CC1 727768623 IMMVITMSRVQORA-OQKWZONESA-N 499.567 5.435 5 20 JKBD COc1ccc(-c2cc3[nH]c(/C(Cl)=C\c4ccc(C)c([N+](=O)[O-])c4)nc(=O)c3s2)cc1 797247054 DOBDVICTIQETNQ-CXUHLZMHSA-N 453.907 5.614 5 20 JKBD C[C@H](Oc1ccc(F)cc1)C(=O)O[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1 825380208 MJWBLHYZWRQXBC-LHSJRXKWSA-N 472.856 5.078 5 20 JKBD O=C(CSc1nnc(Nc2ccc(SC(F)F)cc2)s1)N1CCc2ccc([N+](=O)[O-])cc21 831130993 CXTNLVIQCXZIND-UHFFFAOYSA-N 495.558 5.186 5 20 JKBD O=C(Nc1ccc(OC[C@@H](O)c2cccc(C(F)(F)F)c2)cc1)c1cc([N+](=O)[O-])ccc1Cl 917004189 ZQBOCDNCUPCWIY-HXUWFJFHSA-N 480.826 5.632 5 20 JKBD Cc1ccc(NC(=O)Nc2ccccc2)cc1NS(=O)(=O)c1ccc(Cl)cc1[N+](=O)[O-] 917739507 ICVNVWQDAPXNGU-UHFFFAOYSA-N 460.899 5.001 5 20 JKBD O=C(Nc1cc([N+](=O)[O-])c(F)cc1F)c1cc(-c2ccncc2)nc2ccc(Br)cc12 919993967 KVLDMBGOKXWRLD-UHFFFAOYSA-N 485.244 5.498 5 20 JKBD O=C(NC1(c2ccc(NC(=O)c3ccc([N+](=O)[O-])o3)cc2)CCC1)c1cc(F)c(F)c(Cl)c1 1785751578 KEOYENJPDRORQW-UHFFFAOYSA-N 475.835 5.181 5 20 JKBD CC(C)c1nc(C(=O)Nc2ccc(C3(NC(=O)CSc4ccccc4[N+](=O)[O-])CCC3)cc2)co1 1787029158 QMBRBSUSQKMNRO-UHFFFAOYSA-N 494.573 5.246 5 20 JKBD CC(C)(C)c1ncccc1C(=O)NC1(c2ccc(NC(=O)c3ccc(O)c([N+](=O)[O-])c3)cc2)CCC1 1790619427 JVTIPVGIJKFJRG-UHFFFAOYSA-N 488.544 5.054 5 20 JKBD COc1cc(CC(=O)NC2(c3ccc(NC(=O)C[C@@H]4C[C@@H]5CC[C@H]4C5)cc3)CCC2)ccc1[N+](=O)[O-] 1791323461 HLKUCPVPBPEPEP-GIVPXCGWSA-N 491.588 5.106 5 20 JKBD O=C(Cc1cc(F)ccc1[N+](=O)[O-])Nc1ccc(C2(NC(=O)c3cc4sccc4[nH]3)CCC2)cc1 1792308836 QIUFGPIPYQDXIT-UHFFFAOYSA-N 492.532 5.267 5 20 JKBD O=C(Cc1ccc(Cl)cc1[N+](=O)[O-])N1CCC2(CCCN(C(=O)c3ccc(Cl)s3)C2)CC1 1808203946 PGVONRUUKPGFGE-UHFFFAOYSA-N 496.416 5.051 5 20 JKBD CC[C@H](C)[C@@H](C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2ccc([N+](=O)[O-])o2)CC1)c1ccccc1 1826419307 REXAOGKRZLYJJQ-KIVTUJJHSA-N 481.593 5.251 5 20 JKBD Cc1ccn(C)c1C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)CC1 1829833032 IDQHHVGVEUNVCI-NRFANRHFSA-N 494.617 5.004 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2ccc3occc3c2)CC1 1830734052 UOPRUJBREPXSFF-QHCPKHFHSA-N 493.535 5.336 5 20 JKBD CCCCn1c(S[C@H](C)C(=O)Nc2cc([N+](=O)[O-])ccc2Cl)nnc1-c1ccc(OC)cc1 9482760 WBYAAJGUXYKLTF-CQSZACIVSA-N 489.985 5.435 5 20 JKBD Cc1cc2ccccc2n1CC(=O)Oc1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2Cl)cc1 15623231 NLKYDPATEIJPJZ-UHFFFAOYSA-N 463.877 5.369 5 20 JKBD COc1ccc2c(CC(=O)O[C@H](C(=O)Nc3ccc([N+](=O)[O-])cc3Cl)c3ccccc3)coc2c1 20974145 CVTNECWCVLVAFE-DEOSSOPVSA-N 494.887 5.469 5 20 JKBD C[C@@H](Sc1nnc(-c2nn(Cc3ccccc3)c(=O)c3ccccc23)o1)c1cccc([N+](=O)[O-])c1 23272965 NSGLQXFYLIZTNW-MRXNPFEDSA-N 485.525 5.256 5 20 JKBD Cc1csc(-c2ccc(NC(=O)c3ccc(N[C@@H](C)c4ccccn4)c([N+](=O)[O-])c3)cc2)n1 303120854 MJMUDXNNEMKJIL-INIZCTEOSA-N 459.531 5.847 5 20 JKBD COc1ccc(-c2nn(-c3ccccc3)cc2C(=O)Nc2cc([N+](=O)[O-])ccc2C)c(OC)c1 481162720 GZDQEDVUXOLENC-UHFFFAOYSA-N 458.474 5.025 5 20 JKBD O=C(Nc1ccccc1C(=O)N1CCC(OC2CCCCC2)CC1)c1ccc([N+](=O)[O-])cc1Cl 497437691 HNCGIMMGMFRIRA-UHFFFAOYSA-N 485.968 5.454 5 20 JKBD Cc1cccc(N2C(=O)N[C@H](CCC(=O)Nc3c4ccccc4n4c(C)nc5ccccc5c34)C2=O)c1 503148110 HOVZUUPYGVPZBC-HSZRJFAPSA-N 491.551 5.101 5 20 JKBD Cc1cccc(-c2nc(C(C)C)no2)c1NC(=O)c1ccc(Cn2nc(C)c([N+](=O)[O-])c2C)cc1 504818643 KPZVHNNHZSQMKA-UHFFFAOYSA-N 474.521 5.191 5 20 JKBD C[C@H](Nc1ccc(C(=O)Nc2ccccc2OCC(F)(F)F)cc1[N+](=O)[O-])c1ccccn1 506073071 PYLSFCYVNNCDAE-AWEZNQCLSA-N 460.412 5.356 5 20 JKBD Cc1ccc(I)c(C(=O)Nc2nc(-c3ccc(C)c([N+](=O)[O-])c3)cs2)c1 508804563 ZNKDAHUGFWZEHZ-UHFFFAOYSA-N 479.299 5.192 5 20 JKBD COc1cc(C(=O)Nc2ccc(NC(=O)Nc3ccc(Cl)cc3)cc2)c([N+](=O)[O-])cc1OC 512959126 UMXMRIADSILIPY-UHFFFAOYSA-N 470.869 5.162 5 20 JKBD COc1ccccc1NC(=O)c1ccc(NC(=O)c2cc(OCC(F)(F)F)ccc2[N+](=O)[O-])cc1 514428243 DWOYIYMMHFUPCV-UHFFFAOYSA-N 489.406 5.049 5 20 JKBD C[C@@H]1CCCN(c2ccc(C(=O)N3CCC[C@@H](c4nc(-c5cccc(F)c5)no4)C3)cc2[N+](=O)[O-])C1 522577645 VICCWUUKRIIVPI-YLJYHZDGSA-N 493.539 5.040 5 20 JKBD Cc1nn(CCC(=O)N(c2nc3ccccc3s2)c2ccccc2C(C)C)c(C)c1[N+](=O)[O-] 523228221 NQIHSVKZLRASCY-UHFFFAOYSA-N 463.563 5.896 5 20 JKBD C[C@H]1CN(c2ccc(N[C@H](C(=O)Nc3ccc([N+](=O)[O-])cc3Cl)c3ccccc3)cn2)C[C@@H](C)O1 559912729 DPHMVTHAPYQSOZ-SRGWNRLKSA-N 495.967 5.049 5 20 JKBD Cn1ccnc1[C@H](NCc1ccc(Oc2ccc(F)cc2)c([N+](=O)[O-])c1)c1ccc(F)cc1 603633410 DAZXUBUEUKMWDG-HSZRJFAPSA-N 450.445 5.278 5 20 JKBD O=C(Cc1csc(-c2cccc(Br)c2)n1)Nc1cc([N+](=O)[O-])ccc1OC(F)F 603638878 JETPUICLNBEDEM-UHFFFAOYSA-N 484.278 5.263 5 20 JKBD CCOc1cc(NC(=O)NC2C[C@H](C(F)(F)F)C[C@@H](C(F)(F)F)C2)c([N+](=O)[O-])cc1OCC 603651021 ZVUWOJQGTVAPPI-GHMZBOCLSA-N 487.397 5.423 5 20 JKBD CC[C@H](C)c1ccc([C@@H](NC(=O)C(=O)Nc2cccc([N+](=O)[O-])c2C)c2cccs2)cc1 603706277 WBXPKZAUTZBWGX-OYHNWAKOSA-N 451.548 5.323 5 20 JKBD C[C@@H](CNC(=O)c1ccccc1Sc1ccc(C(F)(F)F)cc1[N+](=O)[O-])CN1CCCC1 603971233 RTNUTMTVKNQGON-HNNXBMFYSA-N 467.513 5.227 5 20 JKBD Cc1cc(-c2csc(NC(=O)c3ccc(Cn4nc(C)c([N+](=O)[O-])c4C)cc3)n2)c(C)o1 604118827 MBRKKTJTQGXHCP-UHFFFAOYSA-N 451.508 5.042 5 20 JKBD O=[N+]([O-])c1ccccc1-c1ccc(CNCc2cn(-c3ccccc3)nc2-c2ccncc2)o1 608836885 OWLPBDHHOLHGDK-UHFFFAOYSA-N 451.486 5.392 5 20 JKBD C[C@@H](Oc1cc(Cl)cc(Cl)c1)C(=O)O[C@H](C)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 727216795 DGVPVNUZTSYTLH-GHMZBOCLSA-N 452.250 5.023 5 20 JKBD COCCN(C(=O)c1ccc(NC(=O)OC(C)(C)C)cc1)c1nc(-c2ccc([N+](=O)[O-])cc2)cs1 747497532 XAOZNVPYKUOGHG-UHFFFAOYSA-N 498.561 5.359 5 20 JKBD C[C@H](NC(=O)c1ccccc1NC(=O)c1cc([N+](=O)[O-])ccc1Br)c1ccccc1 751055651 AUGNBXGOMSHXAZ-AWEZNQCLSA-N 468.307 5.101 5 20 JKBD O=C(Nc1cc([N+](=O)[O-])c(F)cc1F)c1cnn(-c2cccc(C(F)(F)F)c2)c1C1CC1 914721085 FBYZNHXGTLQURS-UHFFFAOYSA-N 452.339 5.207 5 20 JKBD Cc1c(C(=O)O[C@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2ccccc2)oc2c1C(=O)CCC2 915454064 ZTSXXXVBXCHRKT-QFIPXVFZSA-N 482.876 5.205 5 20 JKBD O=C(Nc1ccccc1SC[C@@H]1CC1(Cl)Cl)N1CCN(c2cccc([N+](=O)[O-])c2)CC1 916697884 YAQWTHFKEIWVFE-HNNXBMFYSA-N 481.405 5.235 5 20 JKBD Cc1ccc(OCCCCNC(=O)c2ccccc2NC(=O)c2ccc([N+](=O)[O-])cc2Cl)cc1 918600405 MNVRUCHGHONDNZ-UHFFFAOYSA-N 481.936 5.398 5 20 JKBD Cc1cccc(C(=O)Nc2ccc(N3CCN(Cc4ccccc4)CC3)c(Cl)c2)c1[N+](=O)[O-] 919829571 OZSHIMOYQACFNF-UHFFFAOYSA-N 464.953 5.131 5 20 JKBD CC(C)c1cccc(NC(=O)COC(=O)c2ccc(N[C@H](C)c3ccccn3)c([N+](=O)[O-])c2)c1 920543654 HDJDNZVVVVVGHZ-QGZVFWFLSA-N 462.506 5.082 5 20 JKBD COc1ccc(Cl)cc1NC(=O)[C@H](C)OC(=O)c1ccc(N[C@@H](C)c2ccccn2)c([N+](=O)[O-])c1 920543940 BCPQOBCTNTXVHT-GJZGRUSLSA-N 498.923 5.009 5 20 JKBD Cc1nc2ccccc2n1CCCOC(=O)c1ccc(N[C@H](C)c2ccccn2)c([N+](=O)[O-])c1 920792485 XVPHRJFBWYLBNT-QGZVFWFLSA-N 459.506 5.068 5 20 JKBD O=C(/C=C\c1c[nH]c2ccccc12)NC1(c2ccc(NC(=O)/C=C/c3ccc([N+](=O)[O-])o3)cc2)CCC1 1786205576 HWGBNHLUCWTUBA-NUARCNNVSA-N 496.523 5.530 5 20 JKBD Cc1cc(O)c([N+](=O)[O-])cc1C(=O)NC1(c2ccc(NC(=O)[C@@H]3CCCCC3(F)F)cc2)CCC1 1786465767 VFCKJOWBVWHONR-IBGZPJMESA-N 487.503 5.182 5 20 JKBD O=C(NC1(c2ccc(NC(=O)[C@@H]3C[C@H]3c3ccccc3)cc2)CCC1)c1cc([N+](=O)[O-])cc2c1OCC2 1791533978 PKMWOGIQWPIFAB-BJKOFHAPSA-N 497.551 5.081 5 20 JKBD COc1cc(C(=O)Nc2ccc(C3(NC(=O)[C@H]4CC=C(C)CC4)CCC3)cc2)ccc1[N+](=O)[O-] 1792164804 XUXBLAHNQUOVRS-SFHVURJKSA-N 463.534 5.098 5 20 JKBD Cc1c(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)C(C)(C)C(C)(F)F)n[nH]2)cc(Cl)cc1[N+](=O)[O-] 1815337944 QOGIQBVXXPGKCY-MRXNPFEDSA-N 497.930 5.267 5 20 JKBD CC(C)=CCCC(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cc(Cl)cc([N+](=O)[O-])c2C)[nH]n1 1820804615 RALJPHFGVLJYQW-LJQANCHMSA-N 473.961 5.332 5 20 JKBD Cc1ccc([C@@H](C)C(=O)N2CCC([C@H]3CCCCN3C(=O)Cc3cc([N+](=O)[O-])ccc3F)CC2)cc1 1824950135 YZMKAMWCJGQXEV-FQRUVTKNSA-N 495.595 5.008 5 20 JKBD O=C(/C=C/c1ccccc1[N+](=O)[O-])N1CCC([C@H]2CCCCN2C(=O)c2cccc3ncccc23)CC1 1828031105 CQNNTBALHUHRSW-JBXKERDYSA-N 498.583 5.090 5 20 JKBD CC1(C)CCC(CC(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3cc(F)cc([N+](=O)[O-])c3)CC2)CC1 1830423742 XKWDLGXXZJBNCB-XMMPIXPASA-N 487.616 5.574 5 20 JKBD C[C@H](CC(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cc(F)cc([N+](=O)[O-])c2)CC1)c1ccccc1 1830615468 GVZJGTPKWHTIKI-CLOONOSVSA-N 481.568 5.161 5 20 JKBD COc1cc(C(=O)N2CCCC[C@H]2C2CCN(C(=O)c3ccc(C(C)C)cc3)CC2)ccc1[N+](=O)[O-] 1832696514 ZLEFALQDTVVPNV-DEOSSOPVSA-N 493.604 5.274 5 20 JKBD c1ccc(C[C@H]2COC(c3cccc4cc5cccc(C6=N[C@@H](Cc7ccccc7)CO6)c5nc34)=N2)cc1 1988188018 JIAJCADSWUFNGV-SVBPBHIXSA-N 497.598 6.164 5 20 JKBD NC(=O)[C@@H](OC(=O)C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)c1ccc(F)cc1 11002800 WLYHTBSBSSYGON-DICZOGMTSA-N 491.500 5.044 5 20 JKBD CSc1ccc(NC(=O)COC(=O)c2ccc(Sc3nc(C)cs3)c([N+](=O)[O-])c2)cc1 11944288 KLWLTUWASRVICD-UHFFFAOYSA-N 475.573 5.028 5 20 JKBD C[C@H](OC(=O)[C@H](Sc1ccccc1)c1ccccc1)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 16614938 NEBPSCSJPOTIQS-HRAATJIYSA-N 461.499 5.783 5 20 JKBD Cc1ccc(-n2c(S[C@H](C)c3nnc(-c4ccc([N+](=O)[O-])cc4)o3)nnc2-c2ccccc2)cc1 17707065 AJSIKMHSGYVLNM-QGZVFWFLSA-N 484.541 6.054 5 20 JKBD Cc1sc2nc(SCC(=O)Nc3cc([N+](=O)[O-])ccc3Cl)n(C3CCCC3)c(=O)c2c1C 22034390 JEDNSIKPYAUFTG-UHFFFAOYSA-N 493.010 5.482 5 20 JKBD O=C(Nc1ncc(S(=O)(=O)c2ccc([N+](=O)[O-])cc2)s1)c1ccc(-c2ccccc2Cl)o1 22424190 RAPGEFIXDVRKIP-UHFFFAOYSA-N 489.918 5.050 5 20 JKBD CCC(=O)Nc1ccc(C)c(NC(=O)Cc2cn(-c3ccccc3)nc2-c2ccc([N+](=O)[O-])cc2)c1 107637978 AZRDWTHEVWQEBF-UHFFFAOYSA-N 483.528 5.286 5 20 JKBD CCN(Cc1ccc(Cl)s1)C(=O)c1cc(OC)c(OCc2cscn2)cc1[N+](=O)[O-] 108905734 GCEHQRFFNXXYCH-UHFFFAOYSA-N 467.956 5.016 5 20 JKBD O=C(Nc1ccccc1C(=O)OCc1ccn(-c2ccccc2)n1)c1ccc([N+](=O)[O-])cc1Cl 109392561 USLMKMNLLFMTLB-UHFFFAOYSA-N 476.876 5.043 5 20 JKBD O=C(Nc1ccc(CN2CCOCC2)cc1)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1 216691327 SPKSIRQZOUGMCB-UHFFFAOYSA-N 467.909 5.125 5 20 JKBD Cc1csc(Sc2ccc(C(=O)N3CC=C(c4ccc(O)cc4)CC3)cc2[N+](=O)[O-])n1 216850290 LRZRETAQNRICFX-UHFFFAOYSA-N 453.545 5.146 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)Nc2sc3c(c2C(=O)OC(C)C)CC[C@@H](C)C3)cc1SC 482868433 LWNQZYFAVWKPJT-GFCCVEGCSA-N 478.592 5.329 5 20 JKBD CC(=O)N1CCc2cc(NC(=O)C/C(=C/c3ccc([N+](=O)[O-])cc3)c3nc4ccccc4s3)ccc21 492419695 RJNASKUDMJRRNR-ZHZULCJRSA-N 498.564 5.683 5 20 JKBD COc1cccc(OC)c1OC1CCN(C(=O)c2cc([N+](=O)[O-])ccc2Sc2ccccc2)CC1 501939379 SFCMMQRJLYDJIR-UHFFFAOYSA-N 494.569 5.447 5 20 JKBD CC(C)CC(=O)Nc1ccc(NC(=O)c2ccc(N[C@@H](C)c3ccccn3)c([N+](=O)[O-])c2)cc1 506140375 AYJAMYMZDNSACW-KRWDZBQOSA-N 461.522 5.400 5 20 JKBD C[C@@H]1CCC[C@H](OCc2cccc(NC(=O)c3ccc(Sc4nncn4C)c([N+](=O)[O-])c3)c2)C1 509024575 XFTRBPDCHIAYKK-UZLBHIALSA-N 481.578 5.222 5 20 JKBD COC(=O)CCCN(C)C(=O)c1c2c(nc3ccccc13)/C(=C\c1ccc([N+](=O)[O-])cc1)CCC2 514542552 CQUSZFSLDFTDQL-ZPHPHTNESA-N 473.529 5.045 5 20 JKBD CC(C)c1ccc([C@@H](NC(=O)C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2cccs2)cc1 515143968 WRTDTXMWZLNSFB-HXUWFJFHSA-N 457.939 5.277 5 20 JKBD O=C(CSc1ccc(C(F)(F)F)cc1[N+](=O)[O-])Nc1ccc2nc([C@H]3CCCO3)[nH]c2c1 516771636 XHXRPTNXVGFLPG-MRXNPFEDSA-N 466.441 5.072 5 20 JKBD O=C(Nc1ccc(Cl)cc1)Nc1ccc(NC(=O)c2cnn(-c3ccc([N+](=O)[O-])cc3)c2)cc1 517935631 JBZFORLODDPDJN-UHFFFAOYSA-N 476.880 5.330 5 20 JKBD O=C(Nc1cccc(OC[C@H]2CCCO2)c1)c1cc([N+](=O)[O-])ccc1Sc1ccccc1 519959357 NVRRHDFKLCPLGU-HXUWFJFHSA-N 450.516 5.556 5 20 JKBD C[C@@H](NCc1ccc(-c2ccc([N+](=O)[O-])cc2)o1)c1cc2c(cc1Br)OCCO2 520205339 MTSALXFDYSYLNY-CYBMUJFWSA-N 459.296 5.239 5 20 JKBD COCCN(C(=O)Cc1ccc(Cl)c(Cl)c1)c1nc(-c2ccc([N+](=O)[O-])cc2)cs1 603461190 CNRFIDKYKUNQMT-UHFFFAOYSA-N 466.346 5.247 5 20 JKBD COc1cccc(CN(C)C(=O)C/C(=C/c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)c1 603466683 MSLNYXMCVIDLAD-ZHZULCJRSA-N 473.554 5.802 5 20 JKBD Cc1ccc(-c2cc(-c3nnc(SCC(=O)Nc4ccccc4[N+](=O)[O-])o3)c3ccccc3n2)cc1 603597664 NGJBTIHHUGGRRH-UHFFFAOYSA-N 497.536 5.899 5 20 JKBD CCN(CC)C(=O)c1ccc(Nc2ccc(S(=O)(=O)Nc3ccc(C)cc3C)cc2[N+](=O)[O-])cc1 603821475 SQKPCHYGGDDZLQ-UHFFFAOYSA-N 496.589 5.238 5 20 JKBD CN(C(=O)C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)c1ccc(F)c(F)c1 604343392 HJOOTMOYDUNXLV-FOWTUZBSSA-N 465.481 6.076 5 20 JKBD COCCn1ncc2ccc(NC(=O)c3cc([N+](=O)[O-])ccc3Sc3ccc(Cl)cc3)cc21 604509193 LYWXMRVGRUXBOW-UHFFFAOYSA-N 482.949 5.648 5 20 JKBD O=C(Nc1cc([N+](=O)[O-])ccc1OC(F)F)c1ccccc1-c1nc(-c2cccc(Cl)c2)no1 609020447 MDNQYHTUMFSTFW-UHFFFAOYSA-N 486.818 5.819 5 20 JKBD Cc1ccc(Cn2nccc2NC(=O)C2CCN(c3ccc(C(F)(F)F)cc3[N+](=O)[O-])CC2)cc1 609346869 XZMJOQSFYZFILJ-UHFFFAOYSA-N 487.482 5.022 5 20 JKBD COc1ccc(NS(=O)(=O)c2ccc(Cl)c([N+](=O)[O-])c2)cc1OCc1ccc2ccccc2n1 728017466 QKZMSXYDHTUWAX-UHFFFAOYSA-N 499.932 5.185 5 20 JKBD C[C@@H](OC(=O)Cc1coc(-c2ccc(Cl)cc2)n1)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 729782015 YUCIILJCQXXUMC-LLVKDONJSA-N 497.813 5.035 5 20 JKBD CCC(CC)(NCn1nc(-c2cccc([N+](=O)[O-])c2)ccc1=O)c1ccc(Cl)c(Cl)c1 730933325 WUSFCBDNWYKCPQ-UHFFFAOYSA-N 461.349 5.388 5 20 JKBD COc1cccc(NC(=O)c2ccccc2NC(=O)c2csc(-c3ccc([N+](=O)[O-])cc3)n2)c1 747622341 BQNLTURHIKFAAT-UHFFFAOYSA-N 474.498 5.232 5 20 JKBD C[C@H](OC(=O)c1c2ccccc2cc2ccccc12)C(=O)Nc1ccc(N2CCOCC2)cc1 754619319 LVBFCEFNJRHLCW-IBGZPJMESA-N 454.526 5.014 5 20 JKBD Cc1onc(-c2ccccc2Cl)c1C(=O)O[C@@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 763057016 VFPOWGFCZWSXOF-NSHDSACASA-N 497.813 5.414 5 20 JKBD C[C@@H](CO)n1c(C(F)(F)F)nc2cc(NCc3cc([N+](=O)[O-])ccc3C(F)(F)F)ccc21 864039550 GZBIISHJPAUTSV-JTQLQIEISA-N 462.350 5.148 5 20 JKBD COc1cc(C(=O)Nc2cc([N+](=O)[O-])ccc2F)ccc1OCc1ccc(Br)s1 917611631 MPGXEBCJYAGYTP-UHFFFAOYSA-N 481.299 5.398 5 20 JKBD COc1ccc([C@@H](Cc2ccccc2C)NC(=O)c2cc([N+](=O)[O-])ccc2Cl)cc1OC 921284896 MRSDAQCVGBMOMM-OAQYLSRUSA-N 454.910 5.288 5 20 JKBD Cc1ccc(-c2cc(C(=O)Nc3ccc(C4(NC(=O)c5ccc([N+](=O)[O-])[nH]5)CCC4)cc3)c[nH]2)cc1 1787029858 CVBUPPHTMULFJS-UHFFFAOYSA-N 483.528 5.288 5 20 JKBD Cc1ccc(C(=O)Nc2ccc(C3(NC(=O)Cn4ccc5ccc([N+](=O)[O-])cc54)CCC3)cc2)nc1C 1787168063 JUSDSJBQRGGRCB-UHFFFAOYSA-N 497.555 5.009 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)c3ccc(F)cc3C(F)(F)F)CCC2)cc1)c1ccc([N+](=O)[O-])[nH]1 1790188357 JXAFOQDHLTXTNJ-UHFFFAOYSA-N 490.413 5.142 5 20 JKBD Cc1nnsc1C(=O)NC1(c2ccc(NC(=O)c3cc4cc([N+](=O)[O-])ccc4s3)cc2)CCC1 1791011188 NUMQVMZCMXRFRV-UHFFFAOYSA-N 493.570 5.031 5 20 JKBD Cc1cc(Cl)c(Cl)cc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)/C=C/c1ccccc1[N+](=O)[O-] 1804345359 ACWAHBOYPSDSPE-RGKVLUKRSA-N 488.371 5.175 5 20 JKBD O=C(c1cc2cc([N+](=O)[O-])ccc2s1)N1CCC2(CCCN(C(=O)[C@H]3CCC(F)(F)C3)C2)CC1 1804776119 VWDBVNIDRWDQAQ-INIZCTEOSA-N 491.560 5.090 5 20 JKBD O=C(CC1CCCC1)NC[C@@H]1CCN(C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)[C@@H]1c1cccnc1 1806196032 WPNXHNXTMUFICH-UQBPGWFLSA-N 492.601 5.104 5 20 JKBD Cc1cccc(Cl)c1C(=O)N1CCC([C@H]2CCCCN2C(=O)/C=C/c2ccc([N+](=O)[O-])o2)CC1 1824276486 TXHZDDHEAQRZLF-ZQAUEJBPSA-N 485.968 5.096 5 20 JKBD O=C(c1cc(F)cc([N+](=O)[O-])c1)N1CCC([C@@H]2CCCCN2C(=O)c2ccc(Cl)c(F)c2)CC1 1830486157 IKBOJXZEHPNFBB-QFIPXVFZSA-N 491.922 5.074 5 20 JKBD Cc1cc2cc(C(=O)N3CCCC[C@H]3C3CCN(C(=O)c4ccc([N+](=O)[O-])cc4F)CC3)ccc2[nH]1 1831035590 FEBXFDCWMFIXPF-VWLOTQADSA-N 492.551 5.071 5 20 JKBD O=C(c1cc2cc([N+](=O)[O-])ccc2s1)N1CC2(CCCN2C(=O)c2cccc3ccccc23)C1 1843624257 WMRRQFLWHMEZKS-UHFFFAOYSA-N 471.538 5.094 5 20 JKBD CCN(CC)C(=O)c1cccc(NC(=O)c2ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])cc2)c1 15618967 STJLTFCRYZHJAG-UHFFFAOYSA-N 467.909 5.775 5 20 JKBD CCOc1cc(C(=O)OCc2csc(N(C(C)=O)c3ccc(C)cc3C)n2)c([N+](=O)[O-])cc1OC 19473976 NFXOJYOKJOSJFZ-UHFFFAOYSA-N 499.545 5.117 5 20 JKBD CCN(CC)c1ccc(-c2nnc(SCC(=O)Nc3ccc(Cl)cc3[N+](=O)[O-])n2CC)cc1 21116542 XWUDBHVCVMGMLW-UHFFFAOYSA-N 489.001 5.104 5 20 JKBD CCCn1c(S[C@@H](C)C(=O)Nc2cc([N+](=O)[O-])ccc2Cl)nnc1-c1cccc(C)c1 21262808 FVIVSUPQNSCAAP-AWEZNQCLSA-N 459.959 5.344 5 20 JKBD Cc1noc(C)c1CSCC(=O)O[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1 22523663 QWIBEZGPGKXQHD-OAQYLSRUSA-N 489.937 5.009 5 20 JKBD C[C@H](NC(=O)[C@@H](C)Sc1nc2cc3ccccc3cc2c(=O)n1C)c1ccc(Cl)cc1 26580944 CHAVXYNLUVCFBA-LSDHHAIUSA-N 451.979 5.098 5 20 JKBD O=C(O[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Br)c1ccccc1)c1cccc(F)c1 28300845 RMDWPWWEPWKZLD-IBGZPJMESA-N 473.254 5.033 5 20 JKBD O=[N+]([O-])c1cccc(-c2noc(CSc3nnc(-c4ccccc4)n3-c3ccc(F)cc3F)n2)c1 31840940 CILUCBLIBMXRCB-UHFFFAOYSA-N 492.467 5.463 5 20 JKBD O=C(CSc1ccc(C(F)(F)F)cc1[N+](=O)[O-])Nc1ccccc1NC(=O)c1ccccc1 106255466 DUFCVWAAOHDKLS-UHFFFAOYSA-N 475.448 5.597 5 20 JKBD C[C@H](Nc1ccc(C(=O)Nc2cccc(I)c2)cc1[N+](=O)[O-])c1ccccn1 108754639 KAIJHRPFMPUPBJ-ZDUSSCGKSA-N 488.285 5.020 5 20 JKBD C[C@H]1c2ccsc2CCN1C(=O)Cc1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1 477385602 NISVZOOVXNEFCB-KRWDZBQOSA-N 458.543 5.197 5 20 JKBD C[C@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccc(Cl)c(C(=O)NCc2ccccc2F)c1 484220732 NYHZSKVGJMCFJV-AWEZNQCLSA-N 487.940 5.437 5 20 JKBD CC(=O)N(c1ccc(Cl)cc1)c1nc(COc2ccc([N+](=O)[O-])cc2C(F)(F)F)cs1 488975054 MXHLBDQOSXTJBL-UHFFFAOYSA-N 471.844 5.987 5 20 JKBD Cc1ccc(NC(=O)[C@@H](Sc2nnc(NCC(F)(F)F)s2)c2ccccc2)c([N+](=O)[O-])c1 489036675 OUCXVGQPYJJKSC-HNNXBMFYSA-N 483.497 5.201 5 20 JKBD COc1cc(C(=O)Nc2nnc(-c3ccccn3)s2)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 502894559 LVZHBVVPANJCTL-UHFFFAOYSA-N 483.893 5.215 5 20 JKBD COc1cccc([C@@H](CNC(=O)Nc2ccc(C)c([N+](=O)[O-])c2)c2c[nH]c3ccccc23)c1OC 503694727 HZURCZCJYPTAQA-OAQYLSRUSA-N 474.517 5.355 5 20 JKBD C[C@H](NC(=O)c1ccc(N[C@H](C)c2ccccn2)c([N+](=O)[O-])c1)c1ccccc1OC(F)F 506190396 MQKAXNKAXXEFJS-LSDHHAIUSA-N 456.449 5.255 5 20 JKBD C[C@@H](Nc1ccc(C(=O)NCCCc2cccc(C(F)(F)F)c2)cc1[N+](=O)[O-])c1ccccn1 507017302 ULRYUEDXANTOGC-MRXNPFEDSA-N 472.467 5.544 5 20 JKBD CC(C)Oc1ccc([N+](=O)[O-])cc1CSc1nnc(-c2ccc(Br)cc2)o1 511058216 QHBKESAMNGZWHR-UHFFFAOYSA-N 450.314 5.487 5 20 JKBD CCCOc1ccc(Cl)cc1NC(=O)[C@@H](NC(=O)c1ccc([N+](=O)[O-])cc1Cl)C(C)C 511116881 SZOLQALQTOGRKW-IBGZPJMESA-N 468.337 5.084 5 20 JKBD Cc1cc([N+](=O)[O-])ccc1NC(=O)CNc1ccc(NC(=O)c2ccccc2F)cc1C(F)(F)F 518701207 GNNUOLFJLRZGPR-UHFFFAOYSA-N 490.413 5.364 5 20 JKBD Cc1cc(C)n([C@H](C)C(=O)Nc2ccc(NC(=O)N[C@H](C)c3cccc([N+](=O)[O-])c3)cc2Cl)n1 519501102 HNXILQBFYKVZEC-HZPDHXFCSA-N 484.944 5.144 5 20 JKBD C[C@H](NC(=O)C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)c1nc2ccccc2[nH]1 560276589 OARXDBUYVBLNAZ-IYWFSZBXSA-N 483.553 5.889 5 20 JKBD COc1cc(CNc2ccc(N=S3(=O)CCCC3)cc2)c([N+](=O)[O-])cc1OCc1ccccc1 600852602 WHZFFYRLZYFITF-UHFFFAOYSA-N 481.574 5.688 5 20 JKBD Cc1cc(C)nc(Sc2ccc(NC(=O)c3cc(OCC(F)(F)F)ccc3[N+](=O)[O-])cc2)n1 603734962 UYQXUMQMUVPUPE-UHFFFAOYSA-N 478.452 5.346 5 20 JKBD O=C(c1ccc(Cl)cc1)C1CCN(C(=O)c2ccc(NCc3ccccc3)c([N+](=O)[O-])c2)CC1 604195699 MBXASQQFXYXJEI-UHFFFAOYSA-N 477.948 5.595 5 20 JKBD Cn1c(=O)oc2ccc(NC(=O)c3ccccc3Sc3ccc(C(F)(F)F)cc3[N+](=O)[O-])cc21 608808077 ABRANKKTUMLCDK-UHFFFAOYSA-N 489.431 5.462 5 20 JKBD COc1ccc([C@H](NCc2cn(-c3ccccc3)nc2-c2ccc([N+](=O)[O-])cc2)C2CC2)cc1 608835701 LQLZZCQCPXQDOL-AREMUKBSSA-N 454.530 5.697 5 20 JKBD O=C(Nc1nc2c(s1)COCC2)c1ccc(Sc2nc3ccccc3s2)c([N+](=O)[O-])c1 609022414 MCTQGPAWHZQRFV-UHFFFAOYSA-N 470.557 5.137 5 20 JKBD O=C(Nc1nc2c(s1)COCC2)c1ccccc1Sc1ccc(C(F)(F)F)cc1[N+](=O)[O-] 609022722 ZOZJQASSQDVGBR-UHFFFAOYSA-N 481.477 5.546 5 20 JKBD Cc1c(NC(=O)c2cnn(-c3ncc(C(F)(F)F)cc3Cl)c2C(F)F)cccc1[N+](=O)[O-] 609371937 UEQIIMCHXIRETC-UHFFFAOYSA-N 475.761 5.346 5 20 JKBD O=C(Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1)C1(S(=O)(=O)c2ccc(Cl)cc2)CCCC1 619123305 CSUZUSTXPZEZCZ-UHFFFAOYSA-N 491.978 5.097 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)O[C@@H](C(=O)Nc2ccc(F)cc2)c2ccccc2)cc1SC 728650159 DIQLJQHMICBFRC-OAQYLSRUSA-N 470.478 5.001 5 20 JKBD COC(=O)c1sc2nc(/C(Cl)=C\c3ccc(-c4ccccc4[N+](=O)[O-])o3)nc(O)c2c1C 746014935 HUIGDVGGDPMOOA-UKTHLTGXSA-N 471.878 5.397 5 20 JKBD CC(C)c1cccc(C(C)C)c1NC(=O)COC(=O)c1csc(-c2ccc([N+](=O)[O-])cc2)n1 747958823 WATQONDSXSOIOG-UHFFFAOYSA-N 467.547 5.761 5 20 JKBD O=[N+]([O-])c1ccc(/C=C(/Cl)c2nc(O)c3c(-c4ccccc4Cl)csc3n2)cc1O 748146720 LRGKXBIKDJDBBK-VGOFMYFVSA-N 460.298 6.068 5 20 JKBD Cc1ccc(N(Cc2cccs2)C(=O)c2ccc(Sc3nncn3C)c([N+](=O)[O-])c2)cc1 914524879 PMCDFGOPNOWJBG-UHFFFAOYSA-N 465.560 5.091 5 20 JKBD CC(C)N(Cc1nnc(-c2cccc([N+](=O)[O-])c2)o1)C(=O)c1ccc(OC2CCCC2)cc1 914713174 HIPUWOMOWXBKMD-UHFFFAOYSA-N 450.495 5.017 5 20 JKBD CN(Cc1ccccc1[N+](=O)[O-])Cn1nc(-c2ccccc2F)n(Cc2ccccc2)c1=S 914783570 WTWIUSDJZXCGPM-UHFFFAOYSA-N 463.538 5.266 5 20 JKBD CCNC(=O)COc1ccc(CNCc2c3ccccc3c(Cl)c3ccccc23)cc1OC 915680699 ZWYCLBBSSUHFMT-UHFFFAOYSA-N 462.977 5.460 5 20 JKBD C[C@@H](OC(=O)CSc1ccc(C(F)(F)F)cc1[N+](=O)[O-])c1nc2ccccc2n1C(F)F 917366609 GFFNMQAXMLHDCG-SNVBAGLBSA-N 475.395 5.755 5 20 JKBD CCOc1cc(C(=O)O[C@H](C)c2cccc(NC(=O)c3ccccc3)c2)c([N+](=O)[O-])cc1OC 918903867 UDTYOJWHGHQHQM-MRXNPFEDSA-N 464.474 5.172 5 20 JKBD COc1ccc([N+](=O)[O-])c(C(=O)Nc2cc([N+](=O)[O-])ccc2Nc2cccc(C(F)(F)F)c2)c1 920277909 IMYYDSNZRQDEDV-UHFFFAOYSA-N 476.367 5.526 5 20 JKBD O=C(Cn1c2ccccc2c(=O)c2ccccc21)OCc1coc(-c2ccc(Br)cc2)n1 920519052 MMCABPXPNNDSLQ-UHFFFAOYSA-N 489.325 5.316 5 20 JKBD Cc1ccc(-c2nnc([C@@H](C)OC(=O)c3ccc(N[C@H](C)c4ccccn4)c([N+](=O)[O-])c3)o2)cc1 920545825 JNTQNZMZWMEXMX-IAGOWNOFSA-N 473.489 5.439 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)[C@@H]3C[C@H]3c3ccc(Cl)cc3)CCC2)cc1)c1ccc([N+](=O)[O-])o1 1785750265 AVJGVTIFSRPQSZ-VQTJNVASSA-N 479.920 5.393 5 20 JKBD O=C(/C=C/c1ccc([N+](=O)[O-])o1)Nc1ccc(C2(NC(=O)c3cccc4cc[nH]c34)CCC2)cc1 1786207545 XXBNJYCGPWUCPC-PKNBQFBNSA-N 470.485 5.130 5 20 JKBD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C1(c2ccccc2)CCC1)c1cc2cc([N+](=O)[O-])ccc2s1 1802196966 YLNKZUXOPOCXBO-WKCHPHFGSA-N 489.597 5.183 5 20 JKBD COc1cc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cc4c(Cl)cccc4s2)C3)ccc1[N+](=O)[O-] 1803818646 BUDYBHVBGPBDHX-MUJYYYPQSA-N 499.976 5.037 5 20 JKBD Cc1cc(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)[C@@H]3CCC[C@H]4CCCC[C@@H]43)CC2)ncc1[N+](=O)[O-] 1827828475 YZMUVRGFKVDLSZ-JVICHNFNSA-N 496.652 5.138 5 20 JKBD O=C(c1cc2sccc2s1)N1CCC([C@@H]2CCCCN2C(=O)c2ccc(O)c([N+](=O)[O-])c2)CC1 1830489669 UWGDEDRACTVTBO-KRWDZBQOSA-N 499.614 5.124 5 20 JKBD O=C(COC(=O)c1ccccc1C(=O)c1ccc(Cl)c([N+](=O)[O-])c1)Nc1cccc2ccccc12 11029341 LJXWPGYJWCKVCT-UHFFFAOYSA-N 488.883 5.428 5 20 JKBD Cc1ccc(NC(=O)c2ccc([N+](=O)[O-])cc2)cc1S(=O)(=O)Nc1ccc(SC(F)F)cc1 15705258 QUXSDXHKPBLUEB-UHFFFAOYSA-N 493.513 5.271 5 20 JKBD CN(Cc1ccccc1NC(=O)C1CCN(c2ccccc2[N+](=O)[O-])CC1)C1CCCCC1 43766773 JSRIOMWVJLLXIL-UHFFFAOYSA-N 450.583 5.214 5 20 JKBD Cc1ccc(-n2ncc(C(=O)Nc3nc(-c4ccc(C)c([N+](=O)[O-])c4)cs3)c2C(F)(F)F)cc1 105351095 HQCGOIWIDPPOIT-UHFFFAOYSA-N 487.463 5.792 5 20 JKBD CCOc1ccc(Br)cc1N[C@@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 303160113 HLYQBGHTQYXQOI-JTQLQIEISA-N 476.249 5.214 5 20 JKBD Cc1ccc(Sc2ccc(C(=O)NCc3ccccc3CN3CCCC3=O)cc2[N+](=O)[O-])cc1 481964574 NSNDWQQOBWULLO-UHFFFAOYSA-N 475.570 5.107 5 20 JKBD COc1ccc(CN(Cc2ccccc2)C(=O)c2cc(SC)c(OC)cc2[N+](=O)[O-])cc1 482491490 DWQTWGAYKICDHC-UHFFFAOYSA-N 452.532 5.177 5 20 JKBD Cc1ccc(-c2nnco2)cc1NC(=O)c1ccc(NCc2ccccc2Cl)c([N+](=O)[O-])c1 483266443 HHXZPOUCSAPNHH-UHFFFAOYSA-N 463.881 5.471 5 20 JKBD COC(=O)CSCc1cccc(NC(=O)c2cc([N+](=O)[O-])ccc2Sc2ccccc2)c1 485233106 VWQVHTDCGVWOJM-UHFFFAOYSA-N 468.556 5.405 5 20 JKBD Cc1cccc(-n2c(S[C@@H](C)c3nnc(-c4ccc([N+](=O)[O-])cc4)o3)nnc2-c2ccccc2)c1 501210485 NSWYUGMRVZLRSY-KRWDZBQOSA-N 484.541 6.054 5 20 JKBD COc1cc(CNCc2ccc(-n3ccnc3C)c(F)c2)c([N+](=O)[O-])cc1OCc1ccccc1 509623713 ZHULBNUNUAWABE-UHFFFAOYSA-N 476.508 5.105 5 20 JKBD CC(C)COc1ccc(NC(=O)c2ccc([N+](=O)[O-])cc2I)cc1Cl 511243546 VJSYNZUAHWYJQN-UHFFFAOYSA-N 474.682 5.140 5 20 JKBD Cc1cc(Sc2ncccn2)ccc1NC(=O)NCCNc1ccc(C(F)(F)F)cc1[N+](=O)[O-] 517101505 UZPOFPPVXOLKRA-UHFFFAOYSA-N 492.483 5.097 5 20 JKBD O=C(NCc1nccn1C(F)F)c1ccccc1Sc1ccc(C(F)(F)F)cc1[N+](=O)[O-] 520991612 USYXMTIHEKJRPQ-UHFFFAOYSA-N 472.395 5.286 5 20 JKBD Cc1cc(=O)nc(-c2ccc(NC(=O)c3ccc(Oc4ccc(Cl)cc4[N+](=O)[O-])cc3)cc2)[nH]1 523709721 MEPJNUCUQDSEKO-UHFFFAOYSA-N 476.876 5.352 5 20 JKBD Cc1ccc2c(c1)CC[C@@H]2NC(=O)c1ccc(C(=O)N[C@H]2CCc3cc(C)ccc32)c([N+](=O)[O-])c1 524353943 SUDRPVWOLFCNIU-DQEYMECFSA-N 469.541 5.046 5 20 JKBD O=C(Nc1ccnn1Cc1c(Cl)cccc1Cl)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-] 603732927 GDPCZFXQWUDJNR-UHFFFAOYSA-N 489.237 5.340 5 20 JKBD C[C@H](N[C@H](C)c1cccc([N+](=O)[O-])c1)C(=O)N1N=C(c2ccc(Cl)cc2)C[C@@H]1c1ccco1 604044540 UTAUWMKZCBEDMQ-ZMPRRUGASA-N 466.925 5.258 5 20 JKBD O=C(Nc1ccc(NC(=O)c2ccco2)c(Cl)c1)c1ccc(Nc2ccccc2)c([N+](=O)[O-])c1 604196952 CEJXLRLPDNMONB-UHFFFAOYSA-N 476.876 6.089 5 20 JKBD Cc1ncc([N+](=O)[O-])n1CC(=O)Nc1cc(C(F)(F)F)ccc1Oc1ccc(Br)cc1 604476718 KAHMNWNUIBKRKA-UHFFFAOYSA-N 499.243 5.312 5 20 JKBD COCCNC(=O)c1ccc(Cl)c(NC(=O)c2ccc(Sc3ccc(C)cc3)c([N+](=O)[O-])c2)c1 609060540 DWFOPNIUZWZIGN-UHFFFAOYSA-N 499.976 5.336 5 20 JKBD O=C(CSc1ncnc2scc(-c3ccc(F)cc3)c12)N1CCc2cc([N+](=O)[O-])ccc21 612359276 JGBYTGDOUCMKHP-UHFFFAOYSA-N 466.519 5.087 5 20 JKBD Cc1nc(-c2ccc([C@@H](C)N[C@@H](C)C(=O)Nc3ccc([N+](=O)[O-])cc3C(F)(F)F)cc2)cs1 619556407 GZAASBPLRCNJAP-OLZOCXBDSA-N 478.496 5.723 5 20 JKBD C[C@@H](Nc1ccc(C(=O)Nc2ccc(SC(C)(C)C)cc2)cc1[N+](=O)[O-])c1ccccn1 726758275 UUTIEMXUMWFZSH-MRXNPFEDSA-N 450.564 6.306 5 20 JKBD CN(C)C1CCN(c2ccc(NC(=O)c3cc([N+](=O)[O-])ccc3NCc3ccccc3)cc2F)CC1 728256452 CQFNJBMTSHGOQY-UHFFFAOYSA-N 491.567 5.129 5 20 JKBD COc1cc(C(=O)NC[C@H]2COc3ccccc3C2)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 747581603 OONBSXUFSSKXKH-HNNXBMFYSA-N 468.893 5.030 5 20 JKBD O=C(Nc1ccccc1SC[C@H]1CC1(Cl)Cl)c1cc([N+](=O)[O-])ccc1Br 751093765 QXQUMSLMLFTBCO-SNVBAGLBSA-N 476.179 5.896 5 20 JKBD CC(C)Cn1cc([C@@H]2N(C(=O)c3cc([N+](=O)[O-])ccc3SC3CCCC3)CC23CCOCC3)cn1 849539521 VKRQZMPIQKXYCA-DEOSSOPVSA-N 498.649 5.476 5 20 JKBD C[C@@H]1Cc2cc([N+](=O)[O-])ccc2N1Cn1nc(-c2c[nH]c3ccccc23)n(C[C@@H]2CCCO2)c1=S 915205124 JDVITUCDSGOBPL-APWZRJJASA-N 490.589 5.058 5 20 JKBD O=C(Nc1ccccc1SC[C@@H]1CC1(Cl)Cl)[C@@H]1CC(=O)N(c2ccc(F)c([N+](=O)[O-])c2)C1 917751778 OUTZOOKFNMLZIP-OLZOCXBDSA-N 498.363 5.011 5 20 JKBD Cc1ccc(NC(=O)[C@H](OC(=O)c2cccn2Cc2cccs2)c2ccccc2)c([N+](=O)[O-])c1 919624874 LMTFWYVWLFTRCI-HSZRJFAPSA-N 475.526 5.351 5 20 JKBD O=C(NC1(c2ccc(NC(=O)c3cccc(F)c3[N+](=O)[O-])cc2)CCC1)c1ccc2cc[nH]c2c1 1790699108 XLNILZFJZIFZHT-UHFFFAOYSA-N 472.476 5.277 5 20 JKBD O=C(NC1(c2ccc(NC(=O)c3cc4cc([N+](=O)[O-])ccc4s3)cc2)CCC1)c1ccccn1 1791011211 QJFCVQMBGUTTPE-UHFFFAOYSA-N 472.526 5.266 5 20 JKBD C/C(=C\c1cccnc1)C(=O)Nc1ccc(C2(NC(=O)/C=C/c3ccccc3[N+](=O)[O-])CCC2)cc1 1791857051 SEZSZNZXYUGRKG-QECFJDBTSA-N 482.540 5.241 5 20 JKBD O=C(CCc1ccoc1)Nc1ccc(C2(NC(=O)Cc3ccc(Cl)cc3[N+](=O)[O-])CCC2)cc1 1791954329 MPYNMYRTDDZCBQ-UHFFFAOYSA-N 481.936 5.151 5 20 JKBD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C1(c2cccc(Cl)c2)CCCC1)c1ccc([N+](=O)[O-])cc1F 1802186823 BQZGZSZOHQGACE-ACDBMABISA-N 499.970 5.151 5 20 JKBD Cc1cc(Cl)ccc1C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2ccc([N+](=O)[O-])cc2F)CC1 1823911571 CUWNOGMIBALVTQ-HSZRJFAPSA-N 487.959 5.243 5 20 JKBD COc1ccccc1C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cc(Cl)cc([N+](=O)[O-])c2C)CC1 1829909718 SLKPLPQSJUAGFQ-QFIPXVFZSA-N 499.995 5.112 5 20 JKBD Cc1ccc2cc(C(=O)N3CCCC[C@H]3C3CCN(C(=O)c4ccc([N+](=O)[O-])o4)CC3)sc2c1 1830978106 NUUAZWHDOAVYNG-IBGZPJMESA-N 481.574 5.258 5 20 JKBD CC1=CC[C@H](C(=O)N2CCC([C@H]3CCCCN3C(=O)c3cc4cc([N+](=O)[O-])ccc4s3)CC2)CC1 1831061577 WTFVKRLUQIMTDF-NZQKXSOJSA-N 495.645 5.789 5 20 JKBD CC(=O)CCc1ccc2oc(C(=O)O[C@H](C)C(=O)Nc3cc([N+](=O)[O-])ccc3Cl)c(C)c2c1 8807433 BHCIUZXSQJQIPM-CQSZACIVSA-N 472.881 5.008 5 20 JKBD Cc1ccc(NC(=O)[C@H](OC(=O)c2ccc(Cl)cc2[N+](=O)[O-])c2ccccc2)c([N+](=O)[O-])c1 20751078 SRIOVQAXAXQHTP-HXUWFJFHSA-N 469.837 5.002 5 20 JKBD CSc1ccc(C(=O)c2ccccc2C(=O)Nc2ccc(NC(=O)NC(C)C)cc2)cc1[N+](=O)[O-] 27096266 CSQQRCAMVQFFBU-UHFFFAOYSA-N 492.557 5.330 5 20 JKBD Cc1noc2nc(-c3ccccc3)cc(C(=O)O[C@@H](C)c3nnc(-c4ccc([N+](=O)[O-])cc4)o3)c12 105435888 XYFCDVCTNOZXNI-AWEZNQCLSA-N 471.429 5.074 5 20 JKBD Cc1cccc([N+](=O)[O-])c1NC(=O)COC(=O)c1c2c(nc3ccccc13)/C(=C\c1ccco1)CC2 206725995 DPGBVJGLXRVQKT-VKAVYKQESA-N 483.480 5.327 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Cl)N(CCCn1ccnc1)Cc1c(F)cccc1Cl 303071302 XERSGRAYZWFECY-UHFFFAOYSA-N 466.300 5.362 5 20 JKBD O=C(c1ccccc1O)N1CCC(NCc2ccc(Oc3ccccc3Cl)c([N+](=O)[O-])c2)CC1 436520636 IBICJXXPPXFKHH-UHFFFAOYSA-N 481.936 5.141 5 20 JKBD O=C(Nc1ccc2c(c1)CCC(=O)N2Cc1ccc(Cl)cc1)c1cc2cccc([N+](=O)[O-])c2[nH]1 499157345 ULMUWJANBHFUDF-UHFFFAOYSA-N 474.904 5.461 5 20 JKBD Cc1cccc(OCc2nnc(S[C@@H](C)C(=O)Nc3nc(-c4cccc([N+](=O)[O-])c4)cs3)o2)c1 500354533 ZQIYEPXQCDSPJQ-AWEZNQCLSA-N 497.558 5.108 5 20 JKBD CSc1ccc([N+](=O)[O-])c(C(=O)NCC2(c3ccc(Cl)cc3Cl)CCOCC2)c1 500881475 XERGKLHNPNQKIY-UHFFFAOYSA-N 455.363 5.102 5 20 JKBD C[C@H](Nc1ccc(C(=O)N(Cc2cccs2)C[C@@H]2CCCO2)cc1[N+](=O)[O-])c1ccccn1 506164521 SKKOCUWVDNZJLL-HKUYNNGSSA-N 466.563 5.046 5 20 JKBD C[C@H](Nc1ccc(C(=O)N[C@H]2CCOc3c(Cl)cccc32)cc1[N+](=O)[O-])c1ccccn1 507891235 IBENDUNMIBYROM-LIRRHRJNSA-N 452.898 5.070 5 20 JKBD Cc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)NC(c1ccc(Cl)cc1)c1ccc(Cl)cc1 517179921 RPLTVOUPTNRVHQ-UHFFFAOYSA-N 458.301 5.054 5 20 JKBD COc1ccc(CNCc2ccc(N3CCC(C)CC3)nc2)cc1OCc1ccc([N+](=O)[O-])cc1 518267842 WOZFIRHNYCLSMC-UHFFFAOYSA-N 476.577 5.104 5 20 JKBD CC(C)C[C@@H](NC(=O)c1ccc(N[C@H](C)c2ccccn2)c([N+](=O)[O-])c1)c1nc2ccccc2[nH]1 520614519 QSKMSBCLLWMCOK-UZUQRXQVSA-N 472.549 5.556 5 20 JKBD O=C(Cc1csc(-c2cc(Br)cs2)n1)Nc1cc(-c2cccc([N+](=O)[O-])c2)[nH]n1 523161747 ODQAMUIOJYWNLT-UHFFFAOYSA-N 490.364 5.114 5 20 JKBD O=C(N[C@H]1CCCc2nc(O)ccc21)c1cc([N+](=O)[O-])ccc1Sc1ccc(Cl)cc1 603209865 CHKDVCSHXISSHP-IBGZPJMESA-N 455.923 5.307 5 20 JKBD COc1cc(NC(=O)c2cc3cc([N+](=O)[O-])ccc3o2)c(C(=O)N2[C@H](C)CCC[C@H]2C)cc1OC 603738324 VBLANSPRQOISHD-HUUCEWRRSA-N 481.505 5.014 5 20 JKBD COc1cccc(OC)c1Oc1ccc(CNCc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)cn1 608836047 FZKRSFRSKKNHNR-UHFFFAOYSA-N 477.542 5.818 5 20 JKBD CNC(=O)CCOc1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2Sc2ccc(Cl)cc2)cc1 609191043 VFEWYIJFGAFGQL-UHFFFAOYSA-N 485.949 5.167 5 20 JKBD Cc1ccc(-c2csc(NC(=O)c3cc(C4CC4)nc4c3cnn4C(C)C)n2)cc1[N+](=O)[O-] 619729517 YWOFPSGAWSCAMK-UHFFFAOYSA-N 462.535 5.482 5 20 JKBD O=C(c1c2c(nc3ccccc13)/C(=C/c1cccc([N+](=O)[O-])c1)CCC2)N1CCC(C2OCCO2)CC1 726773915 NSPOCIDCCJKCEN-HEHNFIMWSA-N 499.567 5.245 5 20 JKBD C[C@@H](OC(=O)CCc1nc2cc(Cl)ccc2s1)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl 730607810 ACPRGFCVGLHEQB-SNVBAGLBSA-N 468.318 5.014 5 20 JKBD O=C1Cc2ccc(Cl)cc2N1Cc1ccc(NC(=S)Nc2ccc([N+](=O)[O-])cc2)cc1 745030532 BDCCWYUUOBUZAN-UHFFFAOYSA-N 452.923 5.146 5 20 JKBD C[C@H]1CN(c2ccc(NC(=O)c3ccc(N[C@@H](C)c4ccccn4)c([N+](=O)[O-])c3)cc2)C[C@@H](C)O1 747390980 WNQJMWWPVQXCOP-OTWHNJEPSA-N 475.549 5.029 5 20 JKBD O=C(COC(=O)c1csc(-c2ccc([N+](=O)[O-])cc2)n1)Nc1ccccc1Cc1ccccc1 747958405 KPCVRSNBVYSELI-UHFFFAOYSA-N 473.510 5.105 5 20 JKBD C[C@H](Oc1ccc(Cl)cc1Br)C(=O)O[C@H](C)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 907683923 OMMGDJKMCNOSLN-MNOVXSKESA-N 496.701 5.132 5 20 JKBD Cc1ccc(NC(=O)[C@@H](OC(=O)Cc2nc(-c3cccs3)oc2C)c2ccccc2)c([N+](=O)[O-])c1 919248187 FIFLJWVQUBVFAL-QHCPKHFHSA-N 491.525 5.394 5 20 JKBD O=C(Oc1ccc(-c2ccccc2)cc1[N+](=O)[O-])C1CCN(C(=O)c2ccc(C(F)(F)F)cc2)CC1 920330102 SMBZMAHNJIWQQV-UHFFFAOYSA-N 498.457 5.738 5 20 JKBD Cc1c(C(=O)NC2(c3ccc(NC(=O)CC4CCN(C)CC4)cc3)CCC2)cc(Cl)cc1[N+](=O)[O-] 1785914419 PSHPIDJMQWHNLM-UHFFFAOYSA-N 499.011 5.036 5 20 JKBD Cc1cc(F)cc(CC(=O)NC2(c3ccc(NC(=O)/C=C/c4ccc([N+](=O)[O-])o4)cc3)CCC2)c1 1786208209 NNINDSQIUWMMOB-VQHVLOKHSA-N 477.492 5.025 5 20 JKBD Cc1cc(C(=O)NC2(c3ccc(NC(=O)/C=C\c4c[nH]c5ccccc45)cc3)CCC2)ncc1[N+](=O)[O-] 1786779363 GCYQIUPKMIDWGB-GHXNOFRVSA-N 495.539 5.241 5 20 JKBD O=C(/C=C/c1ccccc1[N+](=O)[O-])NC1(c2ccc(NC(=O)Cc3noc4ccccc34)cc2)CCC1 1788173322 NENMVBOIVBIDNU-XNTDXEJSSA-N 496.523 5.126 5 20 JKBD Cc1ccc(CCC(=O)NC2(c3ccc(NC(=O)c4nc[nH]c4[N+](=O)[O-])cc3)CCC2)c2ccccc12 1788612935 CQLTXGXFTYKIRP-UHFFFAOYSA-N 497.555 5.160 5 20 JKBD O=C(CCc1ccccn1)NC1(c2ccc(NC(=O)C3(c4cccc([N+](=O)[O-])c4)CCC3)cc2)CCC1 1790475924 LETCENKJPYZXBZ-UHFFFAOYSA-N 498.583 5.178 5 20 JKBD COc1ccc(C(=O)NC2(c3ccc(NC(=O)c4ccc(O)c([N+](=O)[O-])c4)cc3)CCC2)c(Cl)c1 1790620640 FBSAFKNBQCWVBS-UHFFFAOYSA-N 495.919 5.024 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)[C@@H]3CCCCC3(F)F)CCC2)cc1)c1nc2cc([N+](=O)[O-])ccc2[nH]1 1790829420 QGWUIVRRBSJHIC-SFHVURJKSA-N 497.502 5.044 5 20 JKBD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H]1C[C@H]1c1ccc(F)cc1)c1cc2cc([N+](=O)[O-])ccc2s1 1792918492 RRWLJMACNFYXMD-HIHICTBBSA-N 493.560 5.004 5 20 JKBD O=C(/C=C/c1ccc([N+](=O)[O-])o1)N1CCCC2(CCN(C(=O)c3cc4cc(F)ccc4s3)CC2)C1 1805684396 KYWYBPMQMYCXRE-ZZXKWVIFSA-N 497.548 5.100 5 20 JKBD CC1=CC[C@H](C(=O)NC[C@@H]2CCN(C(=O)c3cc(Cl)cc([N+](=O)[O-])c3C)[C@@H]2c2cccnc2)CC1 1809481876 AMWRHBXPJAAIGE-VAXXYWNWSA-N 496.995 5.018 5 20 JKBD CC(C)(C)c1ccc(C(=O)N2CCCC[C@H]2c2cc(NC(=O)/C=C/c3ccc([N+](=O)[O-])o3)n[nH]2)s1 1814968258 UUZFBTWNLLBQHJ-ZBZNSMLMSA-N 497.577 5.289 5 20 JKBD Cc1c(C(=O)N2CCC([C@@H]3CCCCN3C(=O)CCc3ccco3)CC2)cc(Cl)cc1[N+](=O)[O-] 1825248933 IQHNABWZMDIIQD-QFIPXVFZSA-N 487.984 5.016 5 20 JKBD CC[C@H](C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cc([N+](=O)[O-])c(O)cc2C)CC1)c1ccccc1 1830788274 IMBDMLNNDNCTGI-UPVQGACJSA-N 493.604 5.036 5 20 JKBD Cc1noc(C)c1CSc1ccccc1C(=O)O[C@@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl 8712523 ZROTWZOZRISJIT-AWEZNQCLSA-N 489.937 5.329 5 20 JKBD Cc1ccc(NC(=O)[C@H](Sc2nncn2-c2ccccc2C)c2ccccc2)c([N+](=O)[O-])c1 10243626 PRQBHXHYDPAOED-JOCHJYFZSA-N 459.531 5.264 5 20 JKBD Cc1cc(C)nc(Sc2ccc(NC(=O)C3CCN(c4ccccc4[N+](=O)[O-])CC3)cc2)n1 11287187 RGNGCBIMOLDHDI-UHFFFAOYSA-N 463.563 5.008 5 20 JKBD O=C(COC(=O)c1cccc(Oc2ccccc2)c1)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 11456922 DQNZXWWTOBECMD-UHFFFAOYSA-N 460.364 5.201 5 20 JKBD Cc1ccc(-c2cc(C(=O)O[C@@H](C)c3nnc(-c4ccc([N+](=O)[O-])cc4)o3)c3c(C)noc3n2)cc1 12178037 QDSLSDGCEMVQSB-HNNXBMFYSA-N 485.456 5.383 5 20 JKBD O=C(Cn1c2ccccc2c(=O)c2ccccc21)N1CCC(c2nc3ccccc3s2)CC1 14729716 KKVQHYRQWKUHGF-UHFFFAOYSA-N 453.567 5.171 5 20 JKBD COC(=O)c1ccc(NC(=O)c2ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])c(OC)c2)s1 15194061 XBQFDELNEKBLJT-UHFFFAOYSA-N 462.867 5.150 5 20 JKBD C[C@H](Sc1nccn1-c1ccc(Br)cc1)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 16678939 SQOWAAAGDYIKQI-LBPRGKRZSA-N 472.324 5.446 5 20 JKBD Cc1nc(-c2cccs2)sc1C(=O)O[C@@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 17831171 YPCBKEJIENJCBY-JTQLQIEISA-N 485.465 5.291 5 20 JKBD C[C@@H](Sc1nnc(-c2ccncc2)n1-c1ccccc1)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl 20860353 AOFNEAGYAOMWGE-CQSZACIVSA-N 480.937 5.010 5 20 JKBD CCN(c1ccccc1)S(=O)(=O)c1ccc(NCc2ccc(NC(=O)C(C)C)cc2)c([N+](=O)[O-])c1 25568413 WKMUBTFEZAXPMG-UHFFFAOYSA-N 496.589 5.017 5 20 JKBD Cc1ccc(-c2nnc3n2CCCCC3)cc1NC(=O)[C@H](C)Sc1ccc([N+](=O)[O-])cc1 25849627 PPKFQNXAPUTKGJ-INIZCTEOSA-N 451.552 5.007 5 20 JKBD O=C(Nc1cc([N+](=O)[O-])ccc1Nc1cccc(C(F)(F)F)c1)c1ccc(N2C(=O)CCC2=O)cc1 32531751 HWGLQDSVYNOUGT-UHFFFAOYSA-N 498.417 5.263 5 20 JKBD C[C@H](Sc1nc(C2CC2)n(-c2ccccc2)n1)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 36202619 NEMILPNZBYWTGQ-LBPRGKRZSA-N 477.468 5.191 5 20 JKBD Cc1ccc(C(=O)N2C[C@@H](C)C[C@@H](C)C2)cc1NC(=O)[C@@H](C)Sc1ccc([N+](=O)[O-])cc1 59775717 DUZQEWMMHNEZKK-SOLBZPMBSA-N 455.580 5.141 5 20 JKBD O=C(NC1CCN(c2ccc(C(F)(F)F)cn2)CC1)c1ccc(NCc2ccccc2)c([N+](=O)[O-])c1 479545677 WLAPKUITBWXMKP-UHFFFAOYSA-N 499.493 5.020 5 20 JKBD COc1ccc(NC(=O)[C@H](C)Sc2ccc([N+](=O)[O-])cc2)cc1NC(=O)c1cccc(F)c1 482467929 TYYIVSPLUIUTJO-AWEZNQCLSA-N 469.494 5.114 5 20 JKBD CCOC(=O)c1sc(N(C(=O)c2cc(SC)c(OC)cc2[N+](=O)[O-])c2ccccc2)nc1C 482879514 RDZAZDVMLOSDAV-UHFFFAOYSA-N 487.559 5.245 5 20 JKBD Cc1ccc(Oc2ccc(NC(=O)c3cc(OCC(F)(F)F)ccc3[N+](=O)[O-])cn2)cc1C 483970576 HFCXIINNPKEPKH-UHFFFAOYSA-N 461.396 5.592 5 20 JKBD CC(=O)N(c1ccc(F)cc1)c1nc(COc2ccc([N+](=O)[O-])cc2C(F)(F)F)cs1 488979576 VBBASCNAPOWRKE-UHFFFAOYSA-N 455.389 5.473 5 20 JKBD Cc1c(NC(=O)c2cc([N+](=O)[O-])ccc2Oc2ccccc2)cccc1C(=O)N1CCSCC1 499497779 QJYGUUUKQJNGIN-UHFFFAOYSA-N 477.542 5.137 5 20 JKBD CSc1ccc(C(=O)c2ccccc2C(=O)N2CCC(OCCC(C)C)CC2)cc1[N+](=O)[O-] 500500744 SZCIAXAWJWEPTB-UHFFFAOYSA-N 470.591 5.215 5 20 JKBD Cc1cc(NC(=O)NCCNc2ccc(C(F)(F)F)cc2[N+](=O)[O-])ccc1NC(=O)c1ccco1 503116810 FRNNVCDXCBYBFP-UHFFFAOYSA-N 491.426 5.001 5 20 JKBD COc1cc(CNC[C@H]2CCCO[C@@H]2c2ccccc2)c([N+](=O)[O-])cc1OCc1ccccc1 509614463 BOINQAQLZXAINR-AJTFRIOCSA-N 462.546 5.440 5 20 JKBD Cc1ccc(Sc2ccc(C(=O)N3CCC[C@H](OCC(F)(F)F)C3)cc2[N+](=O)[O-])cc1 515623197 CYDYGUUIWKXLDM-INIZCTEOSA-N 454.470 5.238 5 20 JKBD Cc1[nH]nc2ncc(NC(=O)c3ccccc3Sc3ccc(C(F)(F)F)cc3[N+](=O)[O-])cc12 517908784 POXVQULWNVCDON-UHFFFAOYSA-N 473.436 5.597 5 20 JKBD C[C@@H](Nc1ccc(C(=O)N2CCC(CCc3ccc(O)cc3)CC2)cc1[N+](=O)[O-])c1ccccn1 518035996 NXFRNXIDPFKONK-LJQANCHMSA-N 474.561 5.354 5 20 JKBD COc1ccc(Oc2ccc([N+](=O)[O-])cc2C(=O)Nc2ccc(C(=O)NC3CCCC3)cc2C)cc1 519954625 HQISTNNGLPPEHK-UHFFFAOYSA-N 489.528 5.629 5 20 JKBD C[C@H](C[C@H]1CCCO1)NC(=O)C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1 522552085 QWUVHOKBHNADGR-CSTQPDNXSA-N 451.548 5.209 5 20 JKBD O=C(c1ccc(C(=O)N2CCC[C@@H]2c2ccccc2)cc1[N+](=O)[O-])N1CCC[C@H]1c1ccccc1 524353868 OUVWKRJSVPVGHL-RPBOFIJWSA-N 469.541 5.549 5 20 JKBD O=[N+]([O-])c1ccccc1-c1ccc(CNCc2ccnc(N3CCN(c4ccc(F)cc4)CC3)c2)o1 558943231 UPRLYJTULOUWSI-UHFFFAOYSA-N 487.535 5.005 5 20 JKBD COc1cccc(/C=C(/CC(=O)N(C)c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)c1 590645645 OMNFBGBVHVQMMF-JXAWBTAJSA-N 459.527 5.807 5 20 JKBD CCN(Cc1ccc(OCc2cccs2)c(OC)c1)C(=O)Nc1cc([N+](=O)[O-])ccc1C 603643151 PPYRLHPRUOPBPH-UHFFFAOYSA-N 455.536 5.606 5 20 JKBD CC(C)OC(=O)C[C@H](NC(=O)Nc1cccc(NC(=O)c2cccs2)c1)c1ccccc1[N+](=O)[O-] 603653935 MNWWZQNUAOPKRV-IBGZPJMESA-N 496.545 5.113 5 20 JKBD CSc1ccc(C(=O)c2ccccc2C(=O)Nc2cc(NC(=O)C3CC3)ccc2C)cc1[N+](=O)[O-] 603673078 WCESVJJSNHJIJW-UHFFFAOYSA-N 489.553 5.457 5 20 JKBD Cc1cc(NC(=O)c2ccccc2Cl)sc1C(=O)Nc1cc2c(cc1[N+](=O)[O-])OCCCO2 603952837 KXQSZKOSLWWHKB-UHFFFAOYSA-N 487.921 5.284 5 20 JKBD CCc1cccc2c(C3CCN(C(=O)Cn4c5ccccc5c(=O)c5ccccc54)CC3)c[nH]c12 617321143 FKOQCHVZYREDNC-UHFFFAOYSA-N 463.581 5.605 5 20 JKBD CCC(CC)c1cc[n+](/C(C(=S)Nc2ccc(Cl)nc2)=C(/O)c2ccc(C)c([N+](=O)[O-])c2)cc1 727159825 MCSGDLGORGGMLG-UHFFFAOYSA-O 498.028 6.466 5 20 JKBD CC(C)CC(=O)N1CCC(NC(=O)CCC(=O)c2ccc3ccc4cccc5ccc2c3c45)CC1 728152198 WMWGXWFNVLLHQM-UHFFFAOYSA-N 468.597 5.700 5 20 JKBD Cc1ncsc1CN(C)C(=O)c1cc([N+](=O)[O-])ccc1N1CCC(Cc2ccccc2)CC1 731173743 SCIHQAYIDCTMIB-UHFFFAOYSA-N 464.591 5.091 5 20 JKBD C[C@@H](OC(=O)c1occc1CSc1ccccc1)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl 792737899 ZUHZUEDTKSGVCO-CYBMUJFWSA-N 460.895 5.318 5 20 JKBD COc1cc(CNc2cccc(N=S(C)(C)=O)c2)c([N+](=O)[O-])cc1OCc1ccccc1 864015349 MBMVUSRIXFJENI-UHFFFAOYSA-N 455.536 5.154 5 20 JKBD CCOC(=O)Nc1ccc(NC(=O)c2ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])c(OC)c2)cc1 916069854 KJRZNLPMPLNAMP-UHFFFAOYSA-N 485.880 5.870 5 20 JKBD COc1ccccc1C(=O)Nc1ccc(OC(=O)c2cc(OCC(F)(F)F)ccc2[N+](=O)[O-])cc1 916951806 ISOIQVPMRSETRT-UHFFFAOYSA-N 490.390 5.016 5 20 JKBD O=C(N[C@@H](c1ccccc1)c1ccc2nc(C(F)(F)F)[nH]c2c1)c1cc([N+](=O)[O-])ccc1F 921161438 RTUWNUOBULUMNC-IBGZPJMESA-N 458.371 5.148 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)[C@H]3CCc4cccc(Cl)c43)CCC2)cc1)c1ccc([N+](=O)[O-])[nH]1 1790185983 AZGXLIIUXBAPEO-SFHVURJKSA-N 478.936 5.054 5 20 JKBD Cc1ccc2[nH]c(C(=O)N3[C@H]4CC[C@@H]3C[C@H](NC(=O)c3cc5cc([N+](=O)[O-])ccc5s3)C4)cc2c1 1797415035 WQZAAXRYZNXDMN-REPLKXPHSA-N 488.569 5.165 5 20 JKBD Cc1oc(C(C)(C)C)cc1C(=O)N1CCCC[C@@H]1c1cc(NC(=O)Cc2cccc([N+](=O)[O-])c2)n[nH]1 1814373701 AURURWFWKQLSPW-OAQYLSRUSA-N 493.564 5.065 5 20 JKBD O=C(CCc1cccc([N+](=O)[O-])c1)Nc1cc([C@H]2CCCCN2C(=O)c2ccc(Cl)cc2F)[nH]n1 1815536072 MKHVPBIABWYZRX-OAQYLSRUSA-N 499.930 5.049 5 20 JKBD CC1(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)CSc3ccccc3[N+](=O)[O-])[nH]n2)CCCCC1 1822337696 WLDKGEDGVPFYSB-SFHVURJKSA-N 485.610 5.073 5 20 JKBD O=C(c1ccc([N+](=O)[O-])o1)N1CCCC[C@H]1C1CCN(C(=O)C2(c3ccc(Cl)cc3)CCC2)CC1 1823618220 PVEYDYSVHISVGU-NRFANRHFSA-N 499.995 5.196 5 20 JKBD O=C(c1cc(Cl)ccc1F)N1CCC([C@H]2CCCCN2C(=O)c2cccc(F)c2[N+](=O)[O-])CC1 1830617584 WXPZNSGAJYFYBC-OAQYLSRUSA-N 491.922 5.074 5 20 JKBD O=C(CCC1CCCC1)N1CCC([C@H]2CCCCN2C(=O)CSc2ccccc2[N+](=O)[O-])CC1 1831776211 LDUUIZLTTAYCFM-JOCHJYFZSA-N 487.666 5.277 5 20 JKBD C[C@@H](Sc1nnc(-c2ccccc2F)n1Cc1ccccc1)C(=O)Nc1cccc([N+](=O)[O-])c1 3562959 FZNDENPRUMZKMS-MRXNPFEDSA-N 477.521 5.160 5 20 JKBD C[C@@H](Sc1nnc(CN2CCCCC2)n1-c1ccc(OC(F)F)cc1)c1cccc([N+](=O)[O-])c1 24226719 PCTITQYZXQMFIT-MRXNPFEDSA-N 489.548 5.616 5 20 JKBD O=C(OCc1nnc(-c2ccc([N+](=O)[O-])cc2)o1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 28614416 RUHVZPOBHKZNPJ-UHFFFAOYSA-N 461.274 5.039 5 20 JKBD C[C@@H](Nc1ccc(Oc2ncc(Cl)cc2Cl)cc1)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl 71992616 CMDGTLGEVICDMK-LLVKDONJSA-N 481.723 6.181 5 20 JKBD Cc1ccc([N+](=O)[O-])cc1C(=O)Nc1sc(-c2ccccc2)c(C)c1C(=O)N1CCCCC1 72042859 WOUVFQMRAQSLIP-UHFFFAOYSA-N 463.559 5.819 5 20 JKBD O=C(C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1)N1CCC[C@H]1Cc1cccc(F)c1 107986634 SPFAMQYHMUSIQV-FQEVSTJZSA-N 479.474 5.203 5 20 JKBD Cc1cccc(C)c1NS(=O)(=O)c1ccc(NC(=O)[C@H](C)Sc2ccc([N+](=O)[O-])cc2)cc1 108239168 LLAARCXRYIPEPW-KRWDZBQOSA-N 485.587 5.132 5 20 JKBD CN(Cc1ccccc1)c1ccccc1NC(=O)c1cc([N+](=O)[O-])ccc1I 109402720 HHPQVIRLVQBCDO-UHFFFAOYSA-N 487.297 5.088 5 20 JKBD CCN(CC)C(=O)c1ccc(NC(=O)c2ccc(N[C@H](C)c3ccccn3)c([N+](=O)[O-])c2)cc1Cl 303024908 RZKIIRWILBCINT-MRXNPFEDSA-N 495.967 5.551 5 20 JKBD O=C(NC1CCN(c2ccccn2)CC1)c1cc([N+](=O)[O-])ccc1Sc1ccc(Cl)cc1 478833446 PFMABUMKFXELIW-UHFFFAOYSA-N 468.966 5.193 5 20 JKBD CCOc1ccc(-n2c(SCC(=O)Nc3ccccc3[N+](=O)[O-])nnc2-c2cccs2)cc1 479750014 QEQADMHOELGEHI-UHFFFAOYSA-N 481.559 5.034 5 20 JKBD Cc1cc(NC(=O)c2ccc(SCCC(C)C)c([N+](=O)[O-])c2)ccc1NC(=O)c1ccco1 490142531 NUBGWPUQAYKDBN-UHFFFAOYSA-N 467.547 6.139 5 20 JKBD CCC(=O)N[C@@H]1CCCN(C(=O)c2c3c(nc4ccccc24)/C(=C\c2cccc([N+](=O)[O-])c2)CCC3)C1 499568440 BPTHAFULPYGFQM-OYQOIYBLSA-N 498.583 5.151 5 20 JKBD Cc1ccc(C(C)C)c(Oc2ccc(CNCc3cccnc3N3CCN(C)CC3)cc2[N+](=O)[O-])c1 507929987 KCKPWQYPFZVQOZ-UHFFFAOYSA-N 489.620 5.256 5 20 JKBD O=C(c1csc(-c2cccc(C(F)(F)F)c2)n1)N(Cc1ccccc1[N+](=O)[O-])CC(F)(F)F 508919013 FGMXGQBUERVTGP-UHFFFAOYSA-N 489.397 5.942 5 20 JKBD O=C(C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)Nc1ccc2n[nH]cc2c1 515762941 XUIUINCPOZBTCU-LFIBNONCSA-N 455.499 5.650 5 20 JKBD COc1ccc(CNCc2ccc(N3CCCCCC3)nc2)cc1OCc1ccc([N+](=O)[O-])cc1 518765637 SJRJOOBNPNYXQM-UHFFFAOYSA-N 476.577 5.248 5 20 JKBD COc1ccc(CNCc2csc(Br)c2)cc1OCc1ccc([N+](=O)[O-])cc1 567397208 QEOVXKQNQQJYCY-UHFFFAOYSA-N 463.353 5.296 5 20 JKBD O=C(Cc1ccccc1[N+](=O)[O-])N(C[C@@H]1CCCO1)c1nc(-c2ccc(Cl)cc2Cl)cs1 603463233 SFBQVVCSRJIYAN-INIZCTEOSA-N 492.384 5.780 5 20 JKBD CCCOc1cc(NC(=O)N2CCC(c3nc4ccccc4[nH]3)CC2)c([N+](=O)[O-])cc1OCCC 603652545 HQTSZDCUTZHYGZ-UHFFFAOYSA-N 481.553 5.460 5 20 JKBD CCCN(CC(=O)Nc1cc(Cl)ccc1Cl)C(=O)c1cc2cc([N+](=O)[O-])ccc2s1 603819058 XFVYUXGPPZNNHV-UHFFFAOYSA-N 466.346 5.607 5 20 JKBD COc1ccccc1NS(=O)(=O)c1cc([N+](=O)[O-])ccc1N[C@@H](C)c1cccc(OC(F)F)c1 603858497 INLNZMDZLKUHOG-AWEZNQCLSA-N 493.488 5.179 5 20 JKBD Cc1cc(-c2noc(CCC(=O)Nc3nc(-c4ccc(C)c([N+](=O)[O-])c4)cs3)n2)ccc1F 604115133 HAAIIHZNLPNRLV-UHFFFAOYSA-N 467.482 5.096 5 20 JKBD C[C@@H](Nc1ccc(C(=O)NCc2ccnc(Oc3ccccc3)c2)cc1[N+](=O)[O-])c1ccccn1 604309115 QJVDTJSILBLICP-GOSISDBHSA-N 469.501 5.280 5 20 JKBD O=C(c1ccc(N[C@H](c2ccccc2)c2ccc(Br)cc2)c([N+](=O)[O-])c1)N1CCOCC1 604451561 PTCBBOREMCTDCA-HSZRJFAPSA-N 496.361 5.031 5 20 JKBD COc1ccc(CC(=O)Nc2cc(NC(=O)c3cccc(C(F)(F)F)c3)ccc2C)cc1[N+](=O)[O-] 609012085 MBECWPKAHWHQIE-UHFFFAOYSA-N 487.434 5.364 5 20 JKBD CC(=O)Nc1ccc(-c2csc(NC(=O)c3ccc(N4CCC(C)CC4)c([N+](=O)[O-])c3)n2)c(F)c1 619213888 UOCGLDIEZIKNFS-UHFFFAOYSA-N 497.552 5.304 5 20 JKBD COc1cc2c(cc1NC(=O)[C@@H]1CCCN1C(=O)c1ccc([N+](=O)[O-])c(C)c1)oc1ccccc12 726496462 YSOBVWWFBYKOCR-NRFANRHFSA-N 473.485 5.055 5 20 JKBD C[C@@H](C(=O)O[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1)c1ccccc1F 731395870 XJZWMLCURDVOGM-SPLOXXLWSA-N 456.857 5.414 5 20 JKBD CC(C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OCc1nc2ccccc2c2ccccc12 915424656 VCCAECCSJORMMY-SANMLTNESA-N 465.553 5.296 5 20 JKBD Cc1csc(SCc2c(C(=O)Nc3cc([N+](=O)[O-])c(C)cc3C)oc3ccccc23)n1 916828280 KNFGIBZBOZBEQP-UHFFFAOYSA-N 453.545 6.267 5 20 JKBD C[C@@H](OC(=O)c1ccc(N[C@H](C)c2ccccn2)c([N+](=O)[O-])c1)C(=O)c1ccc(Cl)cc1 920548153 QDEFPQPTJHAOMZ-HUUCEWRRSA-N 453.882 5.245 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)c3ccc([N+](=O)[O-])cc3F)CCC2)cc1)c1cc(C(F)(F)F)c[nH]1 1788721649 SBARYCQPYWUUGB-UHFFFAOYSA-N 490.413 5.142 5 20 JKBD O=C(NC1(c2ccc(NC(=O)c3ccc([N+](=O)[O-])[nH]3)cc2)CCC1)c1ccc(-c2ccccc2)nc1 1790185482 FEZRQFSYZYYYQD-UHFFFAOYSA-N 481.512 5.046 5 20 JKBD COc1ccc(CC(=O)Nc2ccc(C3(NC(=O)CCC4CCCC4)CCC3)cc2)c([N+](=O)[O-])c1 1790571081 WFZFTVKOIWFVLL-UHFFFAOYSA-N 479.577 5.250 5 20 JKBD O=C(/C=C/c1ccccc1[N+](=O)[O-])NC1(c2ccc(NC(=O)c3ccc4occc4c3O)cc2)CCC1 1790931081 DUNYKAWKRIKZOS-AWNIVKPZSA-N 497.507 5.508 5 20 JKBD CC(C)(C)CCCCCC(=O)NC[C@H]1CCN(C(=O)c2cc(F)cc([N+](=O)[O-])c2)[C@H]1c1cccnc1 1812808295 GNTCMAYFKFEWDI-NLFFAJNJSA-N 498.599 5.445 5 20 JKBD O=C(/C=C/c1ccc([N+](=O)[O-])o1)Nc1cc([C@H]2CCCCN2C(=O)Cc2ccc3ccccc3c2)[nH]n1 1814966971 YRHLMHUOUBHSEY-JBOJMBJVSA-N 499.527 5.012 5 20 JKBD Cc1oc(C(C)(C)C)cc1C(=O)N1CCC([C@H]2CCCCN2C(=O)Cc2cccc([N+](=O)[O-])c2)CC1 1823679274 DNPGWIJQNBAQQW-XMMPIXPASA-N 495.620 5.270 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)N1CCC([C@@H]2CCCCN2C(=O)/C=C/c2ccsc2)CC1 1825302365 KYMRFLMNRWNGIM-PABBZOGXSA-N 485.581 5.051 5 20 JKBD O=C(c1ccc([N+](=O)[O-])cc1F)N1CCC([C@H]2CCCCN2C(=O)c2cccc(F)c2Cl)CC1 1830571722 AEYOJWPHPVQVGA-OAQYLSRUSA-N 491.922 5.074 5 20 JKBD CC(C)Cn1c(SCc2ccc(C(N)=O)cc2[N+](=O)[O-])nnc1-c1ccc(Cl)cc1Cl 16817624 OFXFHAIOVDWAFP-UHFFFAOYSA-N 480.377 5.207 5 20 JKBD CCN(CC)c1ccc(-c2nnc(S[C@H](C)c3nnc(-c4ccc([N+](=O)[O-])cc4)o3)n2CC)cc1 17957404 JADFNHGXJFBTPN-MRXNPFEDSA-N 493.593 5.623 5 20 JKBD CCn1c(S[C@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2C(F)(F)F)nnc1-c1ccccc1OC 21957478 GMLFXMRZTQREJX-GFCCVEGCSA-N 495.483 5.020 5 20 JKBD CCCCSc1nnc(S[C@H](C)C(=O)Nc2nc(-c3cccc([N+](=O)[O-])c3)cs2)s1 22489934 OWBSBMMDZDGZRF-LLVKDONJSA-N 481.650 5.581 5 20 JKBD COc1cc(C(=O)NCc2cccc(-c3cccc(C)c3)c2)c([N+](=O)[O-])cc1OCc1cscn1 72084965 JTOVNWFKMOCRLD-UHFFFAOYSA-N 489.553 5.544 5 20 JKBD Cc1ccc([N+](=O)[O-])cc1NC(=O)c1cc(OCC(F)(F)F)cc(OCC(F)(F)F)c1 409465819 XDIZPHDCEFUEMF-UHFFFAOYSA-N 452.307 5.038 5 20 JKBD O=C(C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)N1CC[C@H](c2ccccc2)C1 476172681 UZQDXPMESMCZAH-IFRHDIGASA-N 469.566 6.151 5 20 JKBD O=C(Cn1c2ccccc2c(=O)c2ccccc21)N(Cc1ccco1)C12CC3CC(CC(C3)C1)C2 498911473 AHRRYHAJDDGYJL-UHFFFAOYSA-N 466.581 5.745 5 20 JKBD CCOc1cc2c(cc1OCC)CN(C(=O)c1ccc(N[C@H](C)c3ccccn3)c([N+](=O)[O-])c1)CC2 506029490 CBHWLWINGFZXTO-GOSISDBHSA-N 490.560 5.159 5 20 JKBD C[C@H](Nc1ccc(C(=O)N(C)Cc2ccccc2OC(F)(F)F)cc1[N+](=O)[O-])c1ccccn1 506124491 HHTMAKNHEGRPBL-HNNXBMFYSA-N 474.439 5.334 5 20 JKBD C[C@@H](Nc1ccc(C(=O)Nc2ccc3oc(C(C)(C)C)nc3c2)cc1[N+](=O)[O-])c1ccccn1 506172694 FNQHWQTXYOGOGY-OAHLLOKOSA-N 459.506 5.854 5 20 JKBD Cc1c(NC(=O)[C@H](C)Sc2nnc(-c3ccccc3)n2[C@@H](C)c2ccccc2)cccc1[N+](=O)[O-] 515574035 CQTXNBRBKJMRKZ-OALUTQOASA-N 487.585 5.890 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Br)[C@@H](NCc1ccc(F)c(F)c1)c1ccccc1 516378212 SZWIAYRXIPVHLQ-FQEVSTJZSA-N 476.277 5.105 5 20 JKBD CN(C)C[C@@H]1CCCCN1C(=O)C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1 517861746 LHQXEMGGDNYUPN-SACXWWFQSA-N 464.591 5.078 5 20 JKBD COc1ccc(N(C)C(=O)c2ccccc2Sc2ccc(C(F)(F)F)cc2[N+](=O)[O-])cn1 521181936 GPEZBEYSZRFSHP-UHFFFAOYSA-N 463.437 5.445 5 20 JKBD O=C(Nc1ccc(NCc2ccc(C(F)(F)F)cc2[N+](=O)[O-])cc1F)c1cccc(Cl)c1 600856627 BMYSQXAAGDJFGS-UHFFFAOYSA-N 467.806 6.271 5 20 JKBD C[C@H](NC(=O)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1)c1cccc(C(F)(F)F)c1 603437392 ZYELJOKTUCAWHG-ZDUSSCGKSA-N 489.416 5.726 5 20 JKBD Cc1ccc(NS(=O)(=O)c2ccc(Sc3nnc(-c4ccccc4)o3)c([N+](=O)[O-])c2)c(C)c1 603839557 AWVNSHRNAUKFNF-UHFFFAOYSA-N 482.543 5.214 5 20 JKBD Cc1cccc(Cc2sc(NC(=O)c3cc(OCC(F)(F)F)ccc3[N+](=O)[O-])nc2C)c1 603974350 QFVCNUVAKUDSND-UHFFFAOYSA-N 465.453 5.452 5 20 JKBD Cc1nc(CNC(=O)C/C(=C\c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)cs1 604248600 XSBQOPAVYNQZEC-MHWRWJLKSA-N 450.545 5.217 5 20 JKBD COc1cc(C(=O)Nc2ccc(Oc3ccnc4cc(Cl)ccc34)c(F)c2)c([N+](=O)[O-])cc1OC 609066114 IJUDLOMBXOOEFL-UHFFFAOYSA-N 497.866 5.997 5 20 JKBD O=C(NCc1ccncc1)Nc1cccc(NC(=O)c2cc([N+](=O)[O-])ccc2Sc2ccccc2)c1 609175173 YYWUSVHDEIHTHK-UHFFFAOYSA-N 499.552 5.715 5 20 JKBD O=C(CCc1nnc(-c2cc3ccccc3o2)o1)Oc1ccc(-c2ccccc2)cc1[N+](=O)[O-] 726326393 HWPSTTKOBMMFIS-UHFFFAOYSA-N 455.426 5.596 5 20 JKBD Cc1sc2nc(CS[C@H](C)C(=O)OCc3cc([N+](=O)[O-])ccc3OC(C)C)nc(O)c2c1C 729114859 QVCKDWIRZSWHEF-CQSZACIVSA-N 491.591 5.074 5 20 JKBD O=C(OCc1nnc(-c2ccc([N+](=O)[O-])cc2)o1)c1c2c(nc3ccccc13)/C(=C/c1ccco1)CC2 765486214 QAZQZKHUZYITFA-SAPNQHFASA-N 494.463 5.630 5 20 JKBD CC(C)Cn1cc([C@H]2N(Cc3ccc(-c4ccc([N+](=O)[O-])cc4Cl)o3)CC23CCOCC3)cn1 849479561 RQYCGKZBROAZLF-XMMPIXPASA-N 484.984 5.714 5 20 JKBD C[C@H](OC(=O)Cn1c2ccccc2c(=O)c2ccccc21)C(=O)N[C@H](C)c1ccc2ccccc2c1 858085442 SNLXLVJRJPVWGM-UXHICEINSA-N 478.548 5.117 5 20 JKBD CC(=O)Nc1cccc(NC(=S)/C(=C(/O)c2ccc([N+](=O)[O-])cc2)[n+]2ccc3c(c2)CCCC3)c1 913141255 JTJCKZGNQCPOQX-UHFFFAOYSA-O 489.577 5.043 5 20 JKBD Cc1ccc(-c2nnc([C@H](C)OC(=O)c3ccc(N[C@H](C)c4ccccn4)c([N+](=O)[O-])c3)o2)cc1 920545830 JNTQNZMZWMEXMX-SJORKVTESA-N 473.489 5.439 5 20 JKBD Cc1cc(O)c([N+](=O)[O-])cc1C(=O)Nc1ccc(C2(NC(=O)CCCC(F)(F)F)CCC2)cc1 1790806375 LXEUNOGLHUIWJI-UHFFFAOYSA-N 479.455 5.089 5 20 JKBD O=C(/C=C/c1ccccc1[N+](=O)[O-])Nc1ccc(C2(NC(=O)c3cccnc3Cl)CCC2)cc1 1792315414 MGHPYNRQIYSMKK-MDWZMJQESA-N 476.920 5.104 5 20 JKBD O=C([C@@H]1CCC[C@@H]2CCCC[C@H]21)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)C1(c3cccc([N+](=O)[O-])c3)CCC1)C2 1797874194 JKIZXIZMJAJENE-RCDFJRNUSA-N 493.648 5.261 5 20 JKBD Cc1ccccc1CCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc2cc([N+](=O)[O-])ccc2s1 1801206672 DCNAVBCWTUQPHY-WKCHPHFGSA-N 477.586 5.003 5 20 JKBD Cc1c(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)[C@@H]3CCC[C@@H]3C)n[nH]2)cc(Cl)cc1[N+](=O)[O-] 1818958879 IKSKDHNEUIPOIY-URKNILKWSA-N 473.961 5.022 5 20 JKBD CCCc1ccc(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)/C=C/c3ccc([N+](=O)[O-])o3)CC2)cc1 1830102555 FNENFBGCKCBJFM-CYNGKWMKSA-N 479.577 5.087 5 20 JKBD Cc1cccc(Cl)c1C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cccc(F)c2[N+](=O)[O-])CC1 1830620485 BZSSPJSFTZUHSC-NRFANRHFSA-N 487.959 5.243 5 20 JKBD C[C@H](CC(=O)N1CCCC[C@@H]1C1CCN(C(=O)Cc2cc([N+](=O)[O-])ccc2F)CC1)c1ccccc1 1831504361 RLDSPPSQPAOSQN-FQRUVTKNSA-N 495.595 5.090 5 20 JKBD Cc1ccc(C(=O)N2CCC([C@@H]3CCCCN3C(=O)CSc3ccccc3[N+](=O)[O-])CC2)cc1F 1831777351 QMPQGKFNQMHGKF-QFIPXVFZSA-N 499.608 5.068 5 20 JKBD Cc1ccc(-c2cc(C(=O)OCC(=O)Nc3ccc([N+](=O)[O-])cc3C)c3cnn(C(C)C)c3n2)s1 11260364 RWYHNXSFGPYIDO-UHFFFAOYSA-N 493.545 5.061 5 20 JKBD Cc1ccc(NC(=O)[C@@H](Sc2nnc(-c3ccncc3)n2C2CC2)c2ccccc2)c([N+](=O)[O-])c1 11541488 VLRBLSLOJDSXFG-QFIPXVFZSA-N 486.557 5.364 5 20 JKBD O=C(C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)NCCOc1ccccc1 16009473 RBXDACDNESMUNG-MNDPQUGUSA-N 459.527 5.330 5 20 JKBD C[C@H](Sc1nnc(N2CCCC2)n1-c1ccccc1Cl)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 17880600 NJAYHZZRXDUAKK-AWEZNQCLSA-N 497.968 5.332 5 20 JKBD Cc1ccc(-c2cc(C(=O)OCC(=O)Nc3cc([N+](=O)[O-])ccc3Cl)c3ccccc3n2)o1 28610644 UHCMSUDIHACDTM-UHFFFAOYSA-N 465.849 5.160 5 20 JKBD O=C1CSc2ccc(NC(=O)c3cc([N+](=O)[O-])ccc3Sc3ccc(Cl)cc3)cc2N1 29772410 NQCCUEWPRFZKOU-UHFFFAOYSA-N 471.947 5.696 5 20 JKBD O=C(Cn1c2ccccc2c(=O)c2ccccc21)Nc1cccc(OCc2ccc(F)cc2)c1 43754141 RIHJNKCGWALSIV-UHFFFAOYSA-N 452.485 5.512 5 20 JKBD O=C(Nc1ccc(-n2ccnc2)c(Cl)c1)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 68805536 XTPHDNFAHAWQBG-UHFFFAOYSA-N 493.873 5.308 5 20 JKBD Cc1cccc(C(=O)N2CCCC2)c1NC(=O)c1ccc(SCCC(C)C)c([N+](=O)[O-])c1 106220608 YFFRPHWZELYSBS-UHFFFAOYSA-N 455.580 5.530 5 20 JKBD O=C(CSc1nnc(-c2ccc(Cl)cc2)n1Cc1ccco1)c1cccc([N+](=O)[O-])c1 108188823 OUXRUDQBQHKHOD-UHFFFAOYSA-N 454.895 5.123 5 20 JKBD CC(=O)Nc1ccc(Cl)cc1NC(=O)c1ccc(N[C@@H](C)c2ccccn2)c([N+](=O)[O-])c1 303001047 OFJOPLAUEFADIZ-ZDUSSCGKSA-N 453.886 5.027 5 20 JKBD CC(C)(CNC(=O)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1)c1ccccc1F 303170078 YNTGMQWSKPSZIP-UHFFFAOYSA-N 467.463 5.063 5 20 JKBD O=C(c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-])N1CCc2sccc2[C@H]1c1cccs1 478063580 OUEKVZPVFAQUPM-SFHVURJKSA-N 468.478 5.447 5 20 JKBD CCOc1ccc([C@@H](NC(=O)c2cc(SC)c(OC)cc2[N+](=O)[O-])c2ccccc2)cc1 482812972 NZDVECZDPRJTAM-QHCPKHFHSA-N 452.532 5.243 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)Nc2cc(-c3ccccc3C)nn2Cc2ccccc2)cc1SC 484399495 VNOLPLPDFORXLT-UHFFFAOYSA-N 488.569 5.798 5 20 JKBD COc1cc(C(=O)Nc2cc(C)nn2-c2ccccn2)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 486337432 LMJQKCDRLNLKAI-UHFFFAOYSA-N 479.880 5.191 5 20 JKBD COc1ccc(CC[C@H]2CCCCN2C(=O)Nc2cc([N+](=O)[O-])ccc2OC(F)F)cc1OC 503268506 MYRUMJYRNUHVRY-MRXNPFEDSA-N 479.480 5.233 5 20 JKBD CC[C@H](C)n1c(S[C@@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)nnc1-c1ccccc1 504312642 ABGWWEFZMNKSON-GJZGRUSLSA-N 450.524 5.728 5 20 JKBD COc1ccc(CSCC(=O)N(C)[C@H]2CCSc3ccc(Br)cc32)cc1[N+](=O)[O-] 504552909 MLGPVBUGMJKOTD-INIZCTEOSA-N 497.436 5.295 5 20 JKBD COC(=O)c1ccc(OCc2csc(N(C(C)=O)c3ccc(C(F)(F)F)cc3)n2)c([N+](=O)[O-])c1 505898963 SGFRZOZTPIYDHX-UHFFFAOYSA-N 495.435 5.120 5 20 JKBD CCCc1noc2nc(-c3ccco3)cc(C(=O)N(Cc3ccccc3[N+](=O)[O-])CC(F)(F)F)c12 516780211 TWEQEIHINHDDJY-UHFFFAOYSA-N 488.422 5.548 5 20 JKBD Cc1c(NC(=O)c2ccc(NC(=O)c3cccc(Br)c3)cc2)cccc1[N+](=O)[O-] 518093672 QQIGPTPAUGOXGM-UHFFFAOYSA-N 454.280 5.170 5 20 JKBD Cc1ccc(NC(=O)c2cccc(C(F)(F)F)c2)cc1NCC(=O)Nc1cc([N+](=O)[O-])ccc1C 518910260 FMPBDAJEQNXKPO-UHFFFAOYSA-N 486.450 5.533 5 20 JKBD Cc1ccc(Sc2ccc(CN[C@@H](c3ccc(F)cc3)c3nccn3C)cc2[N+](=O)[O-])cc1 521822040 RNPMKAXTQXTWBE-DEOSSOPVSA-N 462.550 5.806 5 20 JKBD Cc1cc(C)c(-c2csc(NC(=O)c3ccc([N+](=O)[O-])cc3I)n2)c(C)c1 523378508 ZREFXVIUJQRPOK-UHFFFAOYSA-N 493.326 5.500 5 20 JKBD O=C(c1ccc([N+](=O)[O-])s1)N(C[C@H]1CCCO1)c1nc(-c2ccc(Cl)cc2Cl)cs1 603463242 ULXGVIZQPRPIPG-GFCCVEGCSA-N 484.386 5.912 5 20 JKBD C[C@H]1CCCCN1C(=O)c1ccc(NC(=O)c2cc3cc([N+](=O)[O-])ccc3s2)cc1Cl 603986539 FDJMXQABOPBBQV-ZDUSSCGKSA-N 457.939 5.730 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)Nc2cc(Cl)cc(Br)c2OC)cc1SC 609125949 ARPGFHQGGBGOOG-UHFFFAOYSA-N 461.721 5.002 5 20 JKBD O=C(Cn1c2ccccc2c(=O)c2ccccc21)Nc1nc(-c2ccc(OC(F)F)cc2)cs1 642156112 XTHHNKWEXRDQNX-UHFFFAOYSA-N 477.492 5.518 5 20 JKBD O=C(Nc1ccc(N2C(=O)c3ccccc3C2=O)cc1)c1cc([N+](=O)[O-])ccc1NCc1ccccc1 728479377 QEHHXBHOPHCEFW-UHFFFAOYSA-N 492.491 5.260 5 20 JKBD COc1ccc(NC(=O)c2c(NC(=O)c3cc(SC)ccc3[N+](=O)[O-])sc3c2CCCC3)cc1 755382196 GEOKFYOYEHIMKE-UHFFFAOYSA-N 497.598 5.770 5 20 JKBD O=C(OCc1nnc(-c2ccc([N+](=O)[O-])cc2)o1)C1(c2ccc(Br)cc2)CCCCC1 913349502 FFZTWVMOTWRHBJ-UHFFFAOYSA-N 486.322 5.353 5 20 JKBD CCN(C(=O)c1ccc([N+](=O)[O-])c(C)c1)c1cccc(NC(=O)c2ccc([N+](=O)[O-])c(C)c2)c1 916506013 SJNYYTWINZRRTQ-UHFFFAOYSA-N 462.462 5.039 5 20 JKBD COc1ccc(/C=C2\N=C(SCc3csc([N+](=O)[O-])c3)N(c3cccc(OC)c3)C2=O)cc1 917415194 DJRCYCGQTJDXLD-JMIUGGIZSA-N 481.555 5.351 5 20 JKBD O=C(Nc1ccc(OC(=O)c2ccc(Oc3cccnc3)cc2)cc1)c1cccc([N+](=O)[O-])c1 920339149 DWLWCWPEXSMKQX-UHFFFAOYSA-N 455.426 5.254 5 20 JKBD COc1ccc(C)cc1NC(=O)[C@H](OC(=O)[C@H](C)Oc1ccc(Cl)cc1[N+](=O)[O-])c1ccccc1 920778135 IILWPDIYVDOLTK-QMHKHESXSA-N 498.919 5.256 5 20 JKBD CN(C)c1ccc([N+](=O)[O-])cc1C(=O)NC1(c2ccc(NC(=O)[C@@H](F)c3ccccc3)cc2)CCC1 1786612436 DDLHBJKKVGUUJK-DEOSSOPVSA-N 490.535 5.119 5 20 JKBD Cc1ccc2[nH]c(C(=O)Nc3ccc(C4(NC(=O)c5ccc(O)c([N+](=O)[O-])c5)CCC4)cc3)cc2c1 1788964117 MUYBWIBJKZXDQY-UHFFFAOYSA-N 484.512 5.152 5 20 JKBD COc1cc(CC(=O)NC2(c3ccc(NC(=O)C[C@H]4C[C@@H]5CC[C@H]4C5)cc3)CCC2)ccc1[N+](=O)[O-] 1791323464 HLKUCPVPBPEPEP-HLAWJBBLSA-N 491.588 5.106 5 20 JKBD O=C(NC1(c2ccc(NC(=O)c3ccc(F)cc3C(F)(F)F)cc2)CCC1)c1ccc([N+](=O)[O-])o1 1792170468 CLECRUWAFSEMMS-UHFFFAOYSA-N 491.397 5.407 5 20 JKBD CC(C)[C@H]1CC[C@H](C(=O)N2CCCC[C@@H]2c2cc(NC(=O)Cc3cccc([N+](=O)[O-])c3)n[nH]2)CC1 1814377106 SSXBMSOZUMHIFO-TXTKFYIRSA-N 481.597 5.015 5 20 JKBD O=C(Nc1cc([C@H]2CCCCN2C(=O)c2cccc3ccccc23)[nH]n1)c1ccc([N+](=O)[O-])cc1F 1821051806 KMBYKKKYVRGEDC-HSZRJFAPSA-N 487.491 5.230 5 20 JKBD CC(C)c1ccc(C(=O)N2CCC([C@H]3CCCCN3C(=O)Cc3cccc([N+](=O)[O-])c3)CC2)cc1 1823679377 CZERIGRYAYWWOB-AREMUKBSSA-N 477.605 5.194 5 20 JKBD Cc1cc(Cl)cc(C(=O)N2CCC([C@@H]3CCCCN3C(=O)/C=C/c3ccc([N+](=O)[O-])o3)CC2)c1 1824278261 CTTYNRDRABZMAR-HVPBSWBLSA-N 485.968 5.096 5 20 JKBD O=C(Cc1cc([N+](=O)[O-])ccc1F)N1CCC([C@H]2CCCCN2C(=O)c2cc3ccoc3s2)CC1 1827407284 MEZKNMFFSALMDS-OAQYLSRUSA-N 499.564 5.018 5 20 JKBD Cc1cc(F)c(F)c(C(=O)N2CCCC[C@H]2C2CCN(C(=O)CCc3cccc([N+](=O)[O-])c3)CC2)c1 1830776887 VPHPBEMIDJIQNO-DEOSSOPVSA-N 499.558 5.048 5 20 JKBD O=C(COC(=O)Cn1c2ccccc2c(=O)c2ccccc21)Nc1ccccc1Sc1ccccc1 11276234 JFTMWPSACWTYII-UHFFFAOYSA-N 494.572 5.488 5 20 JKBD C[C@H](c1ccc(F)c(F)c1)N(C)C(=O)Cc1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1 23765015 XALPSCGEXAQLJE-QGZVFWFLSA-N 476.483 5.488 5 20 JKBD COc1ccc(Oc2ccc([N+](=O)[O-])cc2C(=O)N2CCC(c3nc4ccccc4[nH]3)CC2)cc1 33007455 FTPIWAUBAYHJHK-UHFFFAOYSA-N 472.501 5.292 5 20 JKBD CCCN(C(=O)C1CCN(c2ccccc2[N+](=O)[O-])CC1)[C@H](C)c1ccccc1Br 59120418 OIOPDPLPEHSJTR-QGZVFWFLSA-N 474.399 5.574 5 20 JKBD Cc1ccc(-c2csc(NC(=O)c3ccc(N[C@@H](C)c4ccccn4)c([N+](=O)[O-])c3)n2)s1 72016876 GYDRFIWQKGVTAO-AWEZNQCLSA-N 465.560 5.909 5 20 JKBD Cc1cc(O[C@@H](C)c2ccccc2)ccc1NC(=O)Cn1c2ccccc2c(=O)c2ccccc21 303210585 QYWUPISXYZKSNU-NRFANRHFSA-N 462.549 6.242 5 20 JKBD CCOc1ccc([C@H](NC(=O)C2CCN(c3ccccc3[N+](=O)[O-])CC2)c2ccccc2)cc1 478257438 XXMHCJQOEFHZJB-AREMUKBSSA-N 459.546 5.116 5 20 JKBD CCCCCC(=O)NC1CCN(C(=O)c2ccc(NCc3ccccc3Cl)c([N+](=O)[O-])c2)CC1 498444020 OJEOIBAMPSMJRZ-UHFFFAOYSA-N 487.000 5.161 5 20 JKBD O=C(Cn1c2ccccc2c(=O)c2ccccc21)Nc1ccc(Oc2ncc(Cl)cc2Cl)cc1 500321600 KOKBOVCIKPQTAO-UHFFFAOYSA-N 490.346 6.288 5 20 JKBD CCOc1cc([N+](=O)[O-])c(C(=O)Nc2ncc(Cc3cccc(Br)c3)s2)cc1OC 505422761 XGZDCVQRPGVJKX-UHFFFAOYSA-N 492.351 5.064 5 20 JKBD C[C@@H]1CCCN(Cc2csc(NC(=O)c3ccc(N[C@H](C)c4ccccn4)c([N+](=O)[O-])c3)n2)C1 507161846 SVIHHYUEJSWJDO-IAGOWNOFSA-N 480.594 5.104 5 20 JKBD C[C@H](Nc1cccc(NC(=O)c2cccc(C(F)(F)F)c2)c1)C(=O)Nc1cccc([N+](=O)[O-])c1 507544167 CHJKTAHETJCXKI-AWEZNQCLSA-N 472.423 5.305 5 20 JKBD C[C@H](Cc1ccc(Br)cc1)NC(=O)c1ccc(N[C@H](C)c2ccccn2)c([N+](=O)[O-])c1 508840929 FXHWYJDLSFYJGM-HZPDHXFCSA-N 483.366 5.286 5 20 JKBD COc1ccc(CNC2CCN(Cc3ccc(F)c(F)c3)CC2)cc1OCc1ccc([N+](=O)[O-])cc1 513633582 ZQZZEUVIPWOVAN-UHFFFAOYSA-N 497.542 5.215 5 20 JKBD C[C@@H](Oc1ccc(Cl)cc1Br)C(=O)Nc1cc([N+](=O)[O-])ccc1OC(F)F 515216179 AQXXCBZBANQDIA-MRVPVSSYSA-N 465.634 5.018 5 20 JKBD CCC(CC)C(=O)N1CCC(NC(=O)c2ccc(NCc3ccccc3Cl)c([N+](=O)[O-])c2)CC1 518061389 GWGCDOQRIWZGQW-UHFFFAOYSA-N 487.000 5.017 5 20 JKBD O=C(NCc1ccc([N+](=O)[O-])cc1)c1ccccc1SCc1ccc(Br)cc1 603999793 PFTMWBBGGCZJSG-UHFFFAOYSA-N 457.349 5.580 5 20 JKBD Cn1ccnc1[C@@H](NCc1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1)c1ccc(Cl)cc1 604417842 BHVDLVFRRZYMBI-QHCPKHFHSA-N 483.355 6.307 5 20 JKBD CN(C[C@@H]1CCCO[C@@H]1c1ccccc1)C(=O)c1ccc(NCc2ccccc2Cl)c([N+](=O)[O-])c1 604519119 MENLUPBBMXXWTO-BKMJKUGQSA-N 493.991 6.100 5 20 JKBD Cc1c(N[C@@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2C(F)(F)F)cccc1OCC(F)(F)F 609041954 PKFCUGCIHXMRDD-NSHDSACASA-N 465.350 5.302 5 20 JKBD C[C@@H](OC(=O)CC[C@@H](O)c1ccc(C(C)(C)C)cc1)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 726873099 OVWVYFJBAIKNSV-FOIQADDNSA-N 453.495 5.060 5 20 JKBD O=C(O[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1)c1cnc(-c2ccccn2)s1 727890825 MYRAOZZXVNSQHJ-FQEVSTJZSA-N 494.916 5.304 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)Nc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(C(F)(F)F)c2)cc1SC 728475443 PANXGYUOGFFNOL-STQMWFEESA-N 499.511 5.210 5 20 JKBD Cc1cccc(NC(=O)[C@H](OC(=O)c2csc(-c3cccc([N+](=O)[O-])c3)n2)C(C)C)c1C 747963640 XELUWDGOFGSDBK-HXUWFJFHSA-N 453.520 5.155 5 20 JKBD Cc1ccc(NC(=O)[C@@H](OC(=O)c2csc(-c3cccc([N+](=O)[O-])c3)n2)c2ccccc2)cc1 747963767 REDGBXWVBMNSIQ-QFIPXVFZSA-N 473.510 5.564 5 20 JKBD Cc1cc(NC(=O)c2ccc(N[C@@H](C)c3ccccn3)c([N+](=O)[O-])c2)ccc1N1CCSCC1 749819108 QNJQUNKVBOVGMM-SFHVURJKSA-N 477.590 5.277 5 20 JKBD CN(C)c1ccc([C@@H](CNc2cc3ncnc(O)c3cc2[N+](=O)[O-])c2c[nH]c3ccccc23)cc1 784157497 ISHONARZHNPDNX-HXUWFJFHSA-N 468.517 5.035 5 20 JKBD C[C@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)O[C@H](C)C(=O)Nc1c(Cl)cc(Cl)cc1Cl 916522719 JPYILOSFHKPATG-ZJUUUORDSA-N 477.753 5.606 5 20 JKBD O=C(OCC(=O)N1c2ccccc2Sc2ccc(Cl)cc21)c1cc([N+](=O)[O-])ccc1F 919250737 TYUNHZFKWOWASV-UHFFFAOYSA-N 458.854 5.374 5 20 JKBD CC(C)c1ccc(CCC(=O)O[C@@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2C(F)(F)F)cc1 919394844 IFCQZZLPSUJBST-AWEZNQCLSA-N 452.429 5.240 5 20 JKBD Cc1ccc(NC(=O)[C@H](OC(=O)c2cc(F)cc3nc(C)c(C)nc23)c2ccccc2)c([N+](=O)[O-])c1 919546901 UAXYDJQELBMGID-XMMPIXPASA-N 488.475 5.139 5 20 JKBD CC1=C(C(=O)Nc2ccc([N+](=O)[O-])cc2)[C@@H](c2ccc(O)c(Cl)c2)NC(=O)N1Cc1cccs1 921298642 KEKYFMJPKBXENA-OAQYLSRUSA-N 498.948 5.195 5 20 JKBD Cc1oc2cc(O)ccc2c1C(=O)Nc1ccc(C2(NC(=O)c3ccc([N+](=O)[O-])o3)CCC2)cc1 1789020261 AVLPPWZLUHZNTP-UHFFFAOYSA-N 475.457 5.010 5 20 JKBD O=C(NC1(c2ccc(NC(=O)c3ccc([N+](=O)[O-])[nH]3)cc2)CCC1)c1cc(F)cc(C(F)(F)F)c1 1790187350 YAPVKEROKUXLLL-UHFFFAOYSA-N 490.413 5.142 5 20 JKBD COc1cc(CC(=O)Nc2ccc(C3(NC(=O)[C@H]4CC=C(C)CC4)CCC3)cc2)ccc1[N+](=O)[O-] 1790477788 ACLUHPBEHABOLP-FQEVSTJZSA-N 477.561 5.026 5 20 JKBD Cc1ccc(CC(=O)Nc2ccc(C3(NC(=O)c4ccc5cnccc5c4)CCC3)cc2)cc1[N+](=O)[O-] 1790524784 OVVRXBVGBMOMJV-UHFFFAOYSA-N 494.551 5.442 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C1(c2ccc(Cl)cc2)CCC1 1801550740 VYDVYCYKNPCPCY-ACDBMABISA-N 499.970 5.069 5 20 JKBD Cc1c(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)C[C@@H](C)c2ccccc2)cc(Cl)cc1[N+](=O)[O-] 1801751730 AFUDQEFHVUBYIW-HUJKARHJSA-N 469.969 5.002 5 20 JKBD CC[C@H](C)[C@H](C(=O)N1CCC2(CCCN(C(=O)Cc3cccc([N+](=O)[O-])c3)C2)CC1)c1ccccc1 1804751439 QJAFMBAXLSKPDN-CUNXSJBXSA-N 491.632 5.198 5 20 JKBD Cc1ccc(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)c3cccc(F)c3[N+](=O)[O-])n[nH]2)c(Cl)c1 1821175250 YWPCYRGSOYBJDL-LJQANCHMSA-N 485.903 5.039 5 20 JKBD C/C(=C\c1cccs1)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)Cc2cc(F)ccc2[N+](=O)[O-])CC1 1823722096 HCVGGVQEPSGBHA-KEWFZMHCSA-N 499.608 5.061 5 20 JKBD Cc1oc(C(C)(C)C)cc1C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cc(F)cc([N+](=O)[O-])c2)CC1 1825951770 ZWYVLDKTSRLBLY-QHCPKHFHSA-N 499.583 5.480 5 20 JKBD O=C(c1ccc(F)cc1)N1CCCC[C@@H]1C1CCN(C(=O)C2(c3cccc([N+](=O)[O-])c3)CCC2)CC1 1830021135 WDUYLFUPIAFZJN-RUZDIDTESA-N 493.579 5.089 5 20 JKBD O=C(c1c(F)cccc1Cl)N1CCC([C@H]2CCCCN2C(=O)c2cc(F)cc([N+](=O)[O-])c2)CC1 1830617482 CAFLJZIIXFXGIW-OAQYLSRUSA-N 491.922 5.074 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)N1CCCC[C@H]1C1CCN(C(=O)[C@@H]2C[C@H]2c2ccccc2)CC1 1830728401 CAUKUVHXNKSWKA-FBLLAGFSSA-N 493.579 5.079 5 20 JKBD O=C(c1cc2ccoc2s1)N1CCC([C@@H]2CCCCN2C(=O)Cc2ccc([N+](=O)[O-])cc2F)CC1 1831291396 UTRUTRYMZJILNX-NRFANRHFSA-N 499.564 5.018 5 20 JKBD O=C(c1ccc(C2CC2)cc1)N1CCC([C@@H]2CCCCN2C(=O)Cc2cc(F)ccc2[N+](=O)[O-])CC1 1832888449 JTWSQECLBCSBHG-VWLOTQADSA-N 493.579 5.087 5 20 JKBD CCOC(=O)c1cc(C(=O)N2CCC(c3nc4cc(Cl)ccc4s3)CC2)cc([N+](=O)[O-])c1 10235563 BJOUZXRTBAMMRT-UHFFFAOYSA-N 473.938 5.054 5 20 JKBD Cc1c(NC(=O)[C@@H](C)Sc2nnc(COc3ccccc3Cl)n2C2CC2)cccc1[N+](=O)[O-] 22077899 VEGFAMXLANYSMB-CQSZACIVSA-N 487.969 5.181 5 20 JKBD COc1ccc(NC(=O)[C@@H](C)OC(=O)c2ccc(COc3ccc4ccccc4c3)o2)c([N+](=O)[O-])c1 24070282 NCGFSZMDOMYEDX-MRXNPFEDSA-N 490.468 5.113 5 20 JKBD O=C(O[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1)c1ccc(C(F)(F)F)nc1 26434655 FZKPFQDQXHUTJI-SFHVURJKSA-N 479.798 5.199 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Cl)[C@@H](Nc1cccc(CN2CCCC2=O)c1)c1ccccc1 28386670 DEGXRFZLPJOYSL-DEOSSOPVSA-N 478.936 5.163 5 20 JKBD CCN(CC)c1ccc(-c2nnc(SCc3nc(-c4cccc([N+](=O)[O-])c4)no3)n2CC)cc1 31844616 RYEZEIAMIRBWAD-UHFFFAOYSA-N 479.566 5.062 5 20 JKBD O=C(CSCc1cccc(Cl)c1)Nc1c(Br)cc([N+](=O)[O-])cc1Br 115876610 OFPZSLHAHZSHSI-UHFFFAOYSA-N 494.592 5.645 5 20 JKBD Cc1ccc(-c2nc(C)c([C@@H](C)NC(=O)Cn3c4ccccc4c(=O)c4ccccc43)s2)cc1 303312713 RKQFYEBMEFDKJU-GOSISDBHSA-N 467.594 5.772 5 20 JKBD COC(=O)c1ccccc1C(=O)c1ccc(N[C@H](c2ccccc2)c2nccs2)c([N+](=O)[O-])c1 505630670 DKQXNKLUEHNUSG-JOCHJYFZSA-N 473.510 5.270 5 20 JKBD O=C(Nc1ccc(Br)cn1)C1CCN(C(=O)c2cc3ccccc3c3cccnc23)CC1 509507635 MCPLHKPEFVEYST-UHFFFAOYSA-N 489.373 5.036 5 20 JKBD C[C@@H](NCC1(c2ccc3c(c2)OCO3)CCCCC1)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 513192573 MTOFDOMTZLPUPF-OAHLLOKOSA-N 493.482 5.161 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Cl)[C@@H](NCCCc1c[nH]c2ccccc12)c1ccccc1 521688758 ISDXGMVLWXZJMM-DEOSSOPVSA-N 462.937 5.632 5 20 JKBD O=C(Nc1ccc(S(=O)(=O)Nc2ccc(F)c(Cl)c2)cc1)c1ccc([N+](=O)[O-])cc1Cl 550307058 LYPYSWOVNYECMA-UHFFFAOYSA-N 484.292 5.094 5 20 JKBD CCCSc1ccc([N+](=O)[O-])cc1C(=O)N1C[C@H]2CC[C@H]1[C@@H]1CN(Cc3ccccc3)C[C@@H]21 594660121 JBNXLEWWQOTYJU-GOUWZUTHSA-N 465.619 5.080 5 20 JKBD Cc1c(Oc2nc(CN3CCOCC3)nc3scc(-c4ccccc4)c23)cccc1[N+](=O)[O-] 603870305 MFFCDALMFLGNAV-UHFFFAOYSA-N 462.531 5.199 5 20 JKBD COc1cc(N[C@@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2ccccc2)ccc1NC(C)=O 604045566 UXANNPJUKLHRHK-JOCHJYFZSA-N 468.897 5.007 5 20 JKBD C[C@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)Nc1ccc(C(=O)N2CCCC[C@@H]2C)c(Cl)c1 604443645 GQNWDTRMATYBDR-KBPBESRZSA-N 480.348 5.322 5 20 JKBD COc1ccc(Sc2ccc(NC(=O)c3cc(OC)c(OC(F)F)cc3[N+](=O)[O-])cc2)cc1 609103585 LFPOEGJZYUKJRE-UHFFFAOYSA-N 476.457 5.617 5 20 JKBD COc1ccc(CSCC(=O)Nc2ccc(Sc3nncs3)c(Cl)c2)cc1[N+](=O)[O-] 609107500 MUUSVVZIVQZLAH-UHFFFAOYSA-N 482.996 5.131 5 20 JKBD O=C(NCc1nc(-c2ccccc2)n[nH]1)c1ccccc1Sc1ccc(C(F)(F)F)cc1[N+](=O)[O-] 726774903 KTWWGFKSMJQIIQ-UHFFFAOYSA-N 499.474 5.480 5 20 JKBD C[C@H](OC(=O)c1csc(-c2ccccc2Cl)n1)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl 727564424 XWVKWFSAMZKZHT-JTQLQIEISA-N 466.302 5.209 5 20 JKBD CC(C)N(C(=O)COC(=O)c1ccc([N+](=O)[O-])c(F)c1)c1ccc(Nc2ccccc2)cc1 728154743 LXPSDOOYUWFQIO-UHFFFAOYSA-N 451.454 5.076 5 20 JKBD CN(Cc1ccccc1NC(=O)CSc1ccc(C(F)(F)F)cc1[N+](=O)[O-])C(=O)OC(C)(C)C 742530296 ITDBZPMYSJFODT-UHFFFAOYSA-N 499.511 5.711 5 20 JKBD CC(C)N(Cc1ccc(-c2ccc(F)cc2)s1)Cn1nc(-c2cccc([N+](=O)[O-])c2)ccc1=O 747074281 OBOCLDDCAOJDGA-UHFFFAOYSA-N 478.549 5.554 5 20 JKBD Cc1cc([N+](=O)[O-])ccc1NC(=O)COC(=O)Cc1csc(-c2ccc(Cl)cc2Cl)n1 747254152 ISWVBWHASYOKBO-UHFFFAOYSA-N 480.329 5.058 5 20 JKBD O=C(Nc1ccc(Cl)cc1)c1ccccc1NC(=O)C1CCN(c2ccccc2[N+](=O)[O-])CC1 798124690 IKNDPKBZRPDVTA-UHFFFAOYSA-N 478.936 5.356 5 20 JKBD Cc1nc(-c2ccc(C(F)(F)F)cc2)sc1C(=O)OCC(=O)c1ccc([N+](=O)[O-])cc1 825349003 JVGHQVRVFAJCRU-UHFFFAOYSA-N 450.394 5.085 5 20 JKBD Cc1nn(Cc2ccccc2Cl)c2sc(C(=O)Nc3cc([N+](=O)[O-])c(F)cc3F)cc12 825487361 AVYDZCNEHNMFAY-UHFFFAOYSA-N 462.865 5.547 5 20 JKBD CCOc1cc([N+](=O)[O-])c(C(=O)Nc2sc(C)c(-c3ccccc3)c2C(=O)OC(C)C)cc1OC 913193166 BBPDMUOJFGNTFP-UHFFFAOYSA-N 498.557 5.857 5 20 JKBD CC(C)c1c(C(=O)O[C@@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2C(F)(F)F)cnn1-c1ccccc1 913379295 HIXFXXZPXWCKSP-AWEZNQCLSA-N 490.438 5.107 5 20 JKBD Cc1cc(C(=O)O[C@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)c(C)n1[C@@H](C)c1ccccc1 914662685 KXJMERTULMABSK-FUHWJXTLSA-N 460.490 5.590 5 20 JKBD O=C(Nc1ccc(OC[C@H](O)COc2cccc3ccccc23)cc1)c1cc([N+](=O)[O-])ccc1Cl 914795189 LIPIKVVYCYGEIW-FQEVSTJZSA-N 492.915 5.472 5 20 JKBD Cc1cc(C)c(/C=C/C(=O)O[C@@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2C(F)(F)F)cc1C 915494200 ZVQZAYNGQZYNCM-PXTSUWAFSA-N 450.413 5.122 5 20 JKBD COc1ccc([C@@H]2[C@@H](C(=O)Nc3cc([N+](=O)[O-])ccc3OC)CCC(=O)N2c2ccc(C)cc2)cc1 916665258 QHLBIZHGUIMXSC-BKMJKUGQSA-N 489.528 5.043 5 20 JKBD O=C(Nc1ccccc1C(=O)NCc1ncc(-c2ccccc2)o1)c1ccc([N+](=O)[O-])cc1Cl 918114717 OBKQOMGKDFZIQF-UHFFFAOYSA-N 476.876 5.086 5 20 JKBD CCc1nc2cc(NC(=O)c3ccccc3NC(=O)c3ccc([N+](=O)[O-])cc3Cl)ccc2o1 918641261 HLEDFXWJEABZSD-UHFFFAOYSA-N 464.865 5.456 5 20 JKBD COc1cc(C(=O)Oc2ccc(C(=O)c3ccccc3)cc2)c([N+](=O)[O-])cc1OCc1cscn1 919974558 JWKRJZNOJCKDLD-UHFFFAOYSA-N 490.493 5.089 5 20 JKBD CCn1ccc(C(=O)NC2(c3ccc(NC(=O)c4cc5cc([N+](=O)[O-])ccc5s4)cc3)CCC2)n1 1791011242 SMUOGNCFPLUYKQ-UHFFFAOYSA-N 489.557 5.087 5 20 JKBD O=C(/C=C/c1ccc([N+](=O)[O-])o1)NC1(c2ccc(NC(=O)C34CCC(CC3)CC4)cc2)CCC1 1791977365 BBPPMFSWSHNISC-SOFGYWHQSA-N 463.534 5.306 5 20 JKBD Cc1c(C(=O)N2CC[C@H](CNC(=O)[C@H]3CC[C@H](C)CC3)[C@H]2c2cccnc2)cc(Cl)cc1[N+](=O)[O-] 1813550404 YVGVLNMNWOHQMA-UKWAKIAUSA-N 499.011 5.098 5 20 JKBD CC1=CC[C@@H](C(=O)Nc2cc([C@@H]3CCCCN3C(=O)C3(c4cccc([N+](=O)[O-])c4)CCC3)[nH]n2)CC1 1818807474 BSGNUCLOWSHDKG-XXBNENTESA-N 491.592 5.178 5 20 JKBD O=C(CCC1CCC1)N[C@H]1CCc2nc(NC(=O)c3cc4cc([N+](=O)[O-])ccc4s3)sc2C1 1824426163 HJOHMHZNLKEWNT-HNNXBMFYSA-N 484.603 5.072 5 20 JKBD O=C(/C=C/c1ccccc1[N+](=O)[O-])N1CCC([C@@H]2CCCCN2C(=O)Cc2ccc(Cl)cc2)CC1 1826503550 LNGHJZLKCBKOLT-MURVUTHMSA-N 496.007 5.124 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)N1CCC([C@@H]2CCCCN2C(=O)[C@]2(F)CCCC=C2F)CC1 1832983370 GZLVKJDAOSHPHI-CPJSRVTESA-N 493.526 5.021 5 20 JKBD COc1cc(NC(=O)c2ccco2)c(C(=O)OCc2nc3ccccc3c3ccccc23)cc1OC 18253293 JWOYQPRPTFBRJS-UHFFFAOYSA-N 482.492 5.608 5 20 JKBD Cc1nn(Cc2ccc(C(=O)OCc3coc(-c4ccc(Cl)cc4)n3)cc2)c(C)c1[N+](=O)[O-] 24423006 MVDVVNQVYZKDTE-UHFFFAOYSA-N 466.881 5.122 5 20 JKBD CNC(=O)Nc1cccc(NC(=O)c2cc([N+](=O)[O-])ccc2Sc2ccc(Cl)cc2)c1 29155701 DHGCCYATAIAPNT-UHFFFAOYSA-N 456.911 5.403 5 20 JKBD CCOc1ccc(C(F)(F)F)cc1NC(=O)c1ccc(N[C@@H](C)c2ccccn2)c([N+](=O)[O-])c1 108984897 ZNMSWTKDYLYXDY-AWEZNQCLSA-N 474.439 5.833 5 20 JKBD O=C(c1csc(-c2cccc([N+](=O)[O-])c2)n1)N(Cc1cccnc1)c1ccc(Cl)cc1 496268592 VIDNQCALQBUEPE-UHFFFAOYSA-N 450.907 5.614 5 20 JKBD Cc1ccc(-c2cc(C(=O)N3c4ccc([N+](=O)[O-])cc4C[C@@H]3C)c3cnn(C(C)C)c3n2)s1 504326259 ZNXUZSBCPPCICL-AWEZNQCLSA-N 461.547 5.549 5 20 JKBD COc1ccccc1N1CC[C@@H](CNC(=O)c2cc([N+](=O)[O-])ccc2Sc2ccccc2)C1 504931850 AQHHEQRVJSHXBS-SFHVURJKSA-N 463.559 5.011 5 20 JKBD C[C@H](Nc1ccc(C(=O)Nc2cccc(NC(=O)Nc3ccccc3)c2)cc1[N+](=O)[O-])c1ccccn1 506086076 NGALWYLVJOCMMD-SFHVURJKSA-N 496.527 6.059 5 20 JKBD COc1cc(C(=O)Nc2cccc(CN(C)C)c2)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 506773051 CXSCQJPGVWMLEA-UHFFFAOYSA-N 455.898 5.363 5 20 JKBD Cc1ncc([N+](=O)[O-])cc1C(=O)Nc1cccc(NC(=O)Nc2cccc(C(F)(F)F)c2)c1 510290356 VDUCQJUXMUBORT-UHFFFAOYSA-N 459.384 5.213 5 20 JKBD CCN(C)C(=O)c1cccc(C(=O)Nc2cc([N+](=O)[O-])ccc2Nc2cccc(C(F)(F)F)c2)c1 512026581 RVOBWDSSNOITNS-UHFFFAOYSA-N 486.450 5.701 5 20 JKBD CCCC(=O)Nc1cccc(NC(=O)c2ccc(N3C[C@@H](C)C[C@@H](C)C3)c([N+](=O)[O-])c2)c1C 517906113 QZGUNOVRWZJMDU-CALCHBBNSA-N 452.555 5.376 5 20 JKBD O=C(Nc1ccc2nc([C@H]3CCCO3)[nH]c2c1)c1cc([N+](=O)[O-])ccc1Sc1ccccc1 519931486 ALGYFWCBTCTDQP-OAQYLSRUSA-N 460.515 5.726 5 20 JKBD C[C@@H](N[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1)c1cccc(C(F)(F)F)c1 603744462 OPARBDYHBPOJPI-SPLOXXLWSA-N 477.870 6.298 5 20 JKBD O=C(c1cc2cc([N+](=O)[O-])ccc2s1)N(Cc1nnc(-c2ccc(Cl)cc2)o1)C1CC1 603818775 RMTPZAPHWKIAAF-UHFFFAOYSA-N 454.895 5.318 5 20 JKBD COc1cc(C(=O)Nc2ccc3nccnc3c2)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 603964142 BOEHNFCHBJGVLT-UHFFFAOYSA-N 450.838 5.245 5 20 JKBD COc1cc(C(=O)Nc2ccc(C(=O)NC(C)C)cc2)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 603993517 YWLNKQSTMQUSLH-UHFFFAOYSA-N 483.908 5.440 5 20 JKBD O=C(c1ccsc1)N1CCN(C(=O)c2cc([N+](=O)[O-])ccc2Sc2ccc(Cl)cc2)CC1 604184100 QYTMYJSJDBBVTF-UHFFFAOYSA-N 487.990 5.059 5 20 JKBD CCOc1cc([N+](=O)[O-])c(C(=O)N[C@H](c2ccc(C(C)(C)C)cc2)C(F)(F)F)cc1OC 604257407 HPKWVADUZBHDHN-LJQANCHMSA-N 454.445 5.333 5 20 JKBD O=C(Nc1cnn(-c2ccncc2)c1)c1ccccc1Sc1ccc(C(F)(F)F)cc1[N+](=O)[O-] 608900942 PRGJNVRUOSPZQI-UHFFFAOYSA-N 485.447 5.598 5 20 JKBD COc1cc(C(=O)Nc2ncccc2OC(F)F)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 609025362 FHQCJKTZBFZQMF-UHFFFAOYSA-N 465.796 5.298 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Cl)[C@H](c1ccccc1)N1CCCO[C@H](c2ccccc2)C1 609233244 BSSMTRRCZVUMMT-ZEQRLZLVSA-N 465.937 5.392 5 20 JKBD Cc1cnc(-c2cccc(NC(=O)Cc3cn(-c4ccccc4)nc3-c3ccc([N+](=O)[O-])cc3)c2)o1 609428012 FRJUPZQHKIMZCL-UHFFFAOYSA-N 479.496 5.592 5 20 JKBD Cc1ccc(Br)cc1NC(=O)N1CCN(c2ccc([N+](=O)[O-])cc2C(F)(F)F)CC1 727589838 MMQIBHVYHVAHNB-UHFFFAOYSA-N 487.276 5.039 5 20 JKBD Cc1cccc2c1CCN(C(=O)C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc3ccccc3s1)C2 729413671 CRAHGSJDWFLICR-QNGOZBTKSA-N 469.566 6.029 5 20 JKBD COc1cc(/C=C(\Cl)c2nc(=O)c3sc(-c4ccc(F)cc4)cc3[nH]2)cc([N+](=O)[O-])c1O 747139962 MHQOSUNYUCJQNL-MLPAPPSSSA-N 473.869 5.150 5 20 JKBD Cc1c(C(=O)Nc2nc3ccc(SC(F)F)cc3s2)cc([N+](=O)[O-])c(C)c1[N+](=O)[O-] 748600672 AWDIJMKDCRCFAK-UHFFFAOYSA-N 454.436 5.297 5 20 JKBD CC[C@@H](C)C(=O)N1CCC[C@H](C(=O)Nc2cc(Cl)c([N+](=O)[O-])cc2OCc2ccccc2)C1 751062259 FJKNICVFNZZGGO-AEFFLSMTSA-N 473.957 5.050 5 20 JKBD O=C(COC(=O)c1cc([N+](=O)[O-])ccc1NCc1ccccc1)Nc1c(Cl)cccc1Cl 812358722 DBWPWZFAJFGGCK-UHFFFAOYSA-N 474.300 5.309 5 20 JKBD CCN(CC)C(=O)COc1ccc(NCc2ccc(C(F)(F)F)cc2[N+](=O)[O-])cc1Cl 864019710 QATPTTNZFCLQCY-UHFFFAOYSA-N 459.852 5.126 5 20 JKBD COc1cc(-c2noc(-c3ccc(Sc4nc(C)cs4)c([N+](=O)[O-])c3)n2)cc(OC)c1OC 904674312 MQFPLMSLUKIHJT-UHFFFAOYSA-N 486.531 5.254 5 20 JKBD CN(Cc1ccccc1[N+](=O)[O-])C(=O)C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1 914729213 YXBPETDCHRICIB-RGEXLXHISA-N 488.525 5.702 5 20 JKBD C[C@@H](OCc1ccccc1)C(=O)O[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1 915248175 IYLCDRBYIGGEIW-OPAMFIHVSA-N 468.893 5.077 5 20 JKBD Cc1c(C(=O)O[C@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)cnn1-c1cccc(C(F)(F)F)c1 918941989 KZIMESFCMHNAAC-CYBMUJFWSA-N 487.394 5.076 5 20 JKBD CC(=O)N(c1ccc(C)cc1)c1nc(COC(=O)c2cc([N+](=O)[O-])ccc2N2CCCC2)cs1 918968405 KTXDPCQBTFJPDS-UHFFFAOYSA-N 480.546 5.002 5 20 JKBD Cc1nn(C(C)(C)C)c2nc(C3CC3)cc(C(=O)O[C@H](C)c3nnc(-c4ccc([N+](=O)[O-])cc4)o3)c12 919194972 JKBVZHVQJIDAAO-CQSZACIVSA-N 490.520 5.248 5 20 JKBD C[C@H](OC(=O)[C@@H](C)Sc1ccc(Br)cc1)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 919469419 ZIQBWQDDZLYXKZ-NWDGAFQWSA-N 478.324 5.192 5 20 JKBD Cc1ccc(NC(=O)[C@H](OC(=O)CCC(=O)c2ccc(F)cc2F)c2ccccc2)c([N+](=O)[O-])c1 919534729 XETGFUFQLXIGSX-XMMPIXPASA-N 482.439 5.068 5 20 JKBD O=C(OCc1nc(-c2cccc([N+](=O)[O-])c2)no1)c1csc(-c2ccc(Cl)cc2Cl)n1 921219891 VWPCNARZOREQJY-UHFFFAOYSA-N 477.285 5.432 5 20 JKBD O=C(OCc1nc2ccccc2c2ccccc12)C1CCN(S(=O)(=O)/C=C\c2ccccc2)CC1 921307425 JAYHUQFYFSIPAQ-MNDPQUGUSA-N 486.593 5.144 5 20 JKBD Cc1nc(C(=O)NC2(c3ccc(NC(=O)Cc4ccc(Cl)cc4[N+](=O)[O-])cc3)CCC2)ccc1F 1786115133 WUYYVACLQUYMGU-UHFFFAOYSA-N 496.926 5.081 5 20 JKBD O=C(Cc1cccs1)Nc1ccc(C2(NC(=O)CSc3ccccc3[N+](=O)[O-])CCC2)cc1 1788233403 NGXDJBOBCROPSI-UHFFFAOYSA-N 481.599 5.125 5 20 JKBD CC(C)Oc1ccc(C(=O)NC2(c3ccc(NC(=O)c4ccc([N+](=O)[O-])[nH]4)cc3)CCC2)cc1Cl 1790187264 OBNHVJBNBVEGJX-UHFFFAOYSA-N 496.951 5.425 5 20 JKBD CC(C)CC(=O)NC1(c2ccc(NC(=O)c3cc(Br)ccc3[N+](=O)[O-])cc2)CCC1 1790663931 MOAVUWXKLUUHAK-UHFFFAOYSA-N 474.355 5.151 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)C34CC(F)(C3)C4)CCC2)cc1)c1cc2cc([N+](=O)[O-])ccc2s1 1791011374 ZSRNMSLALCOFJP-UHFFFAOYSA-N 479.533 5.449 5 20 JKBD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc2cc([N+](=O)[O-])ccc2s1)c1ccc2ccoc2c1 1801206679 FFBMHUYOEBUBRN-REPLKXPHSA-N 475.526 5.121 5 20 JKBD Cc1oc(C(C)(C)C)cc1C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cccc(F)c2[N+](=O)[O-])[nH]n1 1816462681 DBPOSWUWDMAOQS-IBGZPJMESA-N 497.527 5.276 5 20 JKBD Cc1ccc(NC(=O)[C@@H](OC(=O)CCc2c[nH]c3ccccc23)c2ccccc2)c([N+](=O)[O-])c1 8649499 GYVFMANWFJWERG-VWLOTQADSA-N 457.486 5.240 5 20 JKBD Cc1nc(CSc2ccc(C(=O)OCC(=O)Nc3ccc(Cl)cc3[N+](=O)[O-])cc2)cs1 11698206 SKGBKPLMZXUKBT-UHFFFAOYSA-N 477.951 5.101 5 20 JKBD O=C(c1ccccc1)C1CCN([C@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2ccccc2)CC1 14320292 PJABMMYTBVFTEX-DEOSSOPVSA-N 477.948 5.523 5 20 JKBD COc1ccc(Br)cc1-c1nc(COC(=O)c2ccc([N+](=O)[O-])c(C)c2)cs1 21328968 OVTJOINPRFNUJO-UHFFFAOYSA-N 463.309 5.155 5 20 JKBD O=C(Nc1cc2c(cc1Cl)OCCCO2)c1cc([N+](=O)[O-])ccc1NCc1ccccc1 26981882 HPXUSXWHLFDHOM-UHFFFAOYSA-N 453.882 5.274 5 20 JKBD O=C(COC(=O)c1c2c(nc3ccccc13)/C(=C\c1ccco1)CC2)Nc1cc([N+](=O)[O-])ccc1F 206746181 UQKYMYWXCQLBBW-QINSGFPZSA-N 487.443 5.157 5 20 JKBD CCOc1ccc(C(=O)N(Cc2ccccc2)[C@@H](C)c2cccc(NC(C)=O)c2)cc1[N+](=O)[O-] 302982628 UHEBASLSMYAOLD-SFHVURJKSA-N 461.518 5.356 5 20 JKBD CCN(CC(=O)Nc1c(Cl)cccc1Cl)C(=O)c1csc(-c2cccc([N+](=O)[O-])c2)n1 496316926 YLRWVVRSCCTWET-UHFFFAOYSA-N 479.345 5.126 5 20 JKBD O=C(Nc1cc(F)ccc1OC[C@H]1CCCO1)c1ccc(Nc2ccccc2)c([N+](=O)[O-])c1 502402890 CVMDGJBDMYCBHH-LJQANCHMSA-N 451.454 5.288 5 20 JKBD Cc1cc(-c2cc(C(=O)N3c4ccc([N+](=O)[O-])cc4C[C@@H]3C)c3cnn(C(C)C)c3n2)c(C)s1 504330383 ZXINOKKYZCAAGP-AWEZNQCLSA-N 475.574 5.857 5 20 JKBD COc1ccc(CNCc2ccc(OC)c(OCc3ccc([N+](=O)[O-])cc3)c2)cc1Br 508053920 MGZUGERHWLYGSD-UHFFFAOYSA-N 487.350 5.243 5 20 JKBD Cc1ccc(Sc2ccc(C(=O)N3CCC(NC(=O)NC4CCCCC4)CC3)cc2[N+](=O)[O-])cc1 508323744 GELLOSJTRUHLAH-UHFFFAOYSA-N 496.633 5.291 5 20 JKBD CC(C)Oc1ccc([N+](=O)[O-])cc1CSc1nnc(COc2ccc(Cl)cc2Cl)o1 511072721 LXBHJPFCRPGDJR-UHFFFAOYSA-N 470.334 5.943 5 20 JKBD C[C@@H](N[C@H](C)c1cccc(NC(=O)Cc2ccccc2F)c1)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl 515523537 OGAWTDDBPUZMKL-HZPDHXFCSA-N 498.942 5.246 5 20 JKBD COc1cc(C(=O)N2CC[C@@H](C)Sc3ccc(C(F)(F)F)cc32)c([N+](=O)[O-])cc1OC(F)F 515701929 SNUQVFGNMNKGIY-SNVBAGLBSA-N 492.422 5.755 5 20 JKBD CC(C)N1CCC[C@@H](CNC(=O)C/C(=C/c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)C1 521143243 RXQKWHQRWFAFKQ-RUAJRXAUSA-N 478.618 5.372 5 20 JKBD O=C(C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)NC1(c2ccccc2)CC1 522559751 YUIIGABCGOGEPE-MNDPQUGUSA-N 455.539 5.941 5 20 JKBD C[C@H](NC(=O)c1csc(-c2cccc([N+](=O)[O-])c2)n1)c1ccc(OCc2cccnc2)cc1 523301479 HOPTVKYATUBJPN-INIZCTEOSA-N 460.515 5.183 5 20 JKBD O=C(Nc1cc([N+](=O)[O-])ccc1OC(F)F)N1CCC[C@@H](c2nc(-c3ccc(Cl)cc3)no2)C1 524003701 YEVJEVOWMPELAK-CYBMUJFWSA-N 493.854 5.311 5 20 JKBD Cc1c(C(=O)Nc2sc3c(c2-c2nc4ccccc4[nH]2)CCCC3)nnn1-c1cccc([N+](=O)[O-])c1 603563432 BREUCBMLUGNHGQ-UHFFFAOYSA-N 499.556 5.220 5 20 JKBD O=C(Nc1nc2cc(C(F)(F)F)ccc2n1Cc1ccco1)c1cc2cc([N+](=O)[O-])ccc2o1 603837445 JVUHJPSWHNPWDQ-UHFFFAOYSA-N 470.363 5.603 5 20 JKBD O=C(c1ccc(COc2ccccc2Br)cc1)N1CCc2ccc([N+](=O)[O-])cc21 604077738 ZKMNRVBKTGWITQ-UHFFFAOYSA-N 453.292 5.139 5 20 JKBD CCOc1cc(NC(=O)N(C)C[C@@H]2CCCO[C@@H]2c2ccccc2)c([N+](=O)[O-])cc1OCC 604522377 XIMQRBJWCKRRFX-FDDCHVKYSA-N 457.527 5.024 5 20 JKBD Cc1ccc(NC(=O)c2ccc(N3C[C@@H](C(F)(F)F)C[C@@H](C(F)(F)F)C3)c([N+](=O)[O-])c2)cc1 608974488 ATEHOIRDPAKWIS-GASCZTMLSA-N 475.389 5.723 5 20 JKBD Cc1ccsc1C(=O)Nc1ccc(OC(=O)c2ccc(N3CCCC3)c([N+](=O)[O-])c2)cc1 729213863 FISSQBNXFNJHLN-UHFFFAOYSA-N 451.504 5.036 5 20 JKBD CN(C)CCCOc1ccc(NC(=O)c2ccccc2NC(=O)c2ccc([N+](=O)[O-])cc2Cl)cc1 730557456 FXYMCDLKTGNNGD-UHFFFAOYSA-N 496.951 5.083 5 20 JKBD CC(C)(C)OC(=O)N1CCC[C@@H]1C1CCN(C(=O)c2ccc(C(C)(C)C)c([N+](=O)[O-])c2)CC1 742507894 QMKJHZWZPWWUAE-HXUWFJFHSA-N 459.587 5.144 5 20 JKBD Cc1ccc(NC(=O)[C@@H](OC(=O)c2nc(C(C)C)ncc2Cl)c2ccccc2)c([N+](=O)[O-])c1 744673911 FAPHXUMKCXEALV-FQEVSTJZSA-N 468.897 5.007 5 20 JKBD Cc1cc(C(=O)Oc2ccc(NC(=O)c3cc([N+](=O)[O-])ccc3Cl)cc2)c(C)n1CC(F)(F)F 793468990 PUGGCCRUPOMNSV-UHFFFAOYSA-N 495.841 5.700 5 20 JKBD Cc1c(NC(=O)[C@H](C)OC(=O)/C(=C\c2ccc(F)cc2)c2cccs2)cccc1[N+](=O)[O-] 825738967 VWVJGRIMALVXPO-LUJRCDHRSA-N 454.479 5.215 5 20 JKBD COc1cc(CNc2cc(C(=O)N(C)C)ccc2Cl)c([N+](=O)[O-])cc1OCc1ccccc1 863996638 QZGDMLINJZNBOW-UHFFFAOYSA-N 469.925 5.150 5 20 JKBD O=C(C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)OCc1nc(-c2ccco2)no1 899217501 GIGUYICRSLSDLQ-FOWTUZBSSA-N 488.481 5.522 5 20 JKBD COC(=O)Nc1cccc(N[C@@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2ccccc2)c1 917938078 DJZMKROIQGTSJD-HXUWFJFHSA-N 454.870 5.218 5 20 JKBD CC(C)N(Cc1ccc([N+](=O)[O-])cc1)Cn1nc(-c2cccs2)n(C[C@H]2CCCO2)c1=S 919950886 WAGOIATXENKTRU-LJQANCHMSA-N 473.624 5.098 5 20 JKBD Cc1nc2ccc(NC(=O)c3ccccc3NC(=O)c3ccc([N+](=O)[O-])cc3Cl)cc2o1 934123561 LWZGGGXQMWYINE-UHFFFAOYSA-N 450.838 5.202 5 20 JKBD CC(F)(F)C(C)(C)C(=O)NC1(c2ccc(NC(=O)/C=C/c3ccc([N+](=O)[O-])o3)cc2)CCC1 1786205685 NVSSUEBVDGUHGS-PKNBQFBNSA-N 461.465 5.017 5 20 JKBD O=C(CCCC(F)(F)F)Nc1ccc(C2(NC(=O)c3cccc(F)c3[N+](=O)[O-])CCC2)cc1 1786621348 HWDHMOQNNNKSPJ-UHFFFAOYSA-N 467.419 5.214 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)C3CCC(O)CC3)CCC2)cc1)c1cc2cc([N+](=O)[O-])ccc2s1 1791010350 JGLHZDPTUBOJOJ-UHFFFAOYSA-N 493.585 5.108 5 20 JKBD O=C(Cc1cc(F)ccc1[N+](=O)[O-])Nc1ccc(C2(NC(=O)C3CCC(F)(F)CC3)CCC2)cc1 1792307593 JCDHRBYOVWQOMH-UHFFFAOYSA-N 489.494 5.236 5 20 JKBD CC1=CC[C@@H](C(=O)NC2(c3ccc(NC(=O)Cc4cc(F)ccc4[N+](=O)[O-])cc3)CCC2)CC1 1792308750 IGHCTHOFWYQCMQ-GOSISDBHSA-N 465.525 5.157 5 20 JKBD C[C@@H](C(=O)Nc1cc([C@@H]2CCCCN2C(=O)/C=C/c2ccc([N+](=O)[O-])o2)[nH]n1)c1ccc(Cl)cc1 1814656529 XCNOGSGQTKOXHZ-AZJMGTQTSA-N 497.939 5.074 5 20 JKBD CC(C)=CCCC(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)CC1 1830256304 PHLSHQDGXKAYLS-QFIPXVFZSA-N 483.634 5.789 5 20 JKBD Cc1cc(F)cc(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)CSc3ccccc3[N+](=O)[O-])CC2)c1 1830508579 MRAYSDCWQXYUQO-JOCHJYFZSA-N 499.608 5.068 5 20 JKBD COc1ccc([N+](=O)[O-])cc1NC(=O)[C@@H](C)OC(=O)[C@H](Sc1ccccc1)c1ccccc1 10588833 QJCHWHBTKMBHJA-OPAMFIHVSA-N 466.515 5.007 5 20 JKBD Cc1csc(Sc2ccc(C(=O)NCc3ccc(NC(=O)c4ccco4)cc3)cc2[N+](=O)[O-])n1 11534324 MADUTIXCCAIJSD-UHFFFAOYSA-N 494.554 5.286 5 20 JKBD C[C@@H](OC(=O)COc1ccc(Oc2ccccc2)cc1)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 12844335 KFFJSTOGNBXQEO-MRXNPFEDSA-N 461.430 5.120 5 20 JKBD Cc1ccc([N+](=O)[O-])cc1NC(=O)c1cccc(NS(=O)(=O)c2cc(Cl)ccc2Cl)c1 15411083 KXPSRVOKCMFGDE-UHFFFAOYSA-N 480.329 5.263 5 20 JKBD C[C@H](OC(=O)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1)C(=O)Nc1cccnc1Cl 16906081 CPJCAHPWBNEMKD-LBPRGKRZSA-N 476.272 5.273 5 20 JKBD COc1cc(C(=O)O[C@@H](C)C(=O)Nc2c(C)cccc2C)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 16941324 AUOXQMXVSMEWJS-INIZCTEOSA-N 498.919 5.850 5 20 JKBD COc1cc2c(cc1OC)[C@H](c1cccs1)N(C(=O)[C@H](C)Sc1ccc([N+](=O)[O-])cc1)CC2 24445907 CVHNENBBKUFTCK-NPMXOYFQSA-N 484.599 5.328 5 20 JKBD CC(C)c1ccc(CSc2nnc(SCC(=O)Nc3ccccc3[N+](=O)[O-])s2)cc1 25132888 XFDMCOFRRDLXBG-UHFFFAOYSA-N 460.606 5.593 5 20 JKBD CC[C@H](C)c1ccccc1NC(=O)[C@H](C)OC(=O)c1ccc(Cn2nc(C)c([N+](=O)[O-])c2C)cc1 26160864 ASUXKWUCCMTFIN-LPHOPBHVSA-N 478.549 5.154 5 20 JKBD COc1ccc(CN(C(=O)c2ccc(Sc3nc(C)cs3)c([N+](=O)[O-])c2)C2CC2)cc1 26385097 YTABFDOINREUGM-UHFFFAOYSA-N 455.561 5.324 5 20 JKBD Cc1ccc(NC(=O)[C@@H](Sc2nc3ccccc3c3nc(C)nn23)c2ccccc2)c([N+](=O)[O-])c1 69507127 GFZXRIIWODKZNQ-QFIPXVFZSA-N 484.541 5.275 5 20 JKBD Cc1c(C(=O)N(Cc2ccc(Cl)c(Cl)c2)Cc2ccccn2)nnn1-c1cccc([N+](=O)[O-])c1 72052659 JYLJDHPSLWFTGD-UHFFFAOYSA-N 497.342 5.028 5 20 JKBD COCc1c(C(=O)Nc2nc(-c3ccc(C)c([N+](=O)[O-])c3)cs2)sc2cccc(F)c12 105355900 VPAFNZWXRRRVKF-UHFFFAOYSA-N 457.508 5.779 5 20 JKBD COc1cc2c(cc1OC)[C@H](c1ccccc1)N(C(=O)c1ccc(Cl)cc1[N+](=O)[O-])CC2 255943206 HUVVILBVYCMDDW-QHCPKHFHSA-N 452.894 5.053 5 20 JKBD COc1ccccc1N1CC[C@H](CNC(=O)c2ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])cc2)C1 303111370 NXDPWJNKWRCMBK-QGZVFWFLSA-N 481.936 5.305 5 20 JKBD CC1(C)CC(=O)c2sc(NC(=O)C3CCN(c4ccc(C(F)(F)F)cc4[N+](=O)[O-])CC3)nc2C1 409557110 PTXGVKOWNOZCPU-UHFFFAOYSA-N 496.511 5.080 5 20 JKBD CCOc1cc(CN[C@@H](C)c2ccccc2)ccc1OCc1cc([N+](=O)[O-])cc2c1OCOC2 409611467 IYXJWMNIEXEGHD-SFHVURJKSA-N 464.518 5.290 5 20 JKBD COC(=O)C1(NC(=O)C/C(=C/c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)CCCCC1 489901534 RQBAKOWYXLBTJZ-SDXDJHTJSA-N 479.558 5.127 5 20 JKBD CC(=O)Nc1cccc([C@@H](C)NC(=O)c2ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])cc2)c1 498537203 PRZDPJGXMBSAMB-CQSZACIVSA-N 453.882 5.490 5 20 JKBD CC1CCN(c2ccc(C(=O)Nc3nnc(SCc4cccs4)s3)cc2[N+](=O)[O-])CC1 498848435 WCPVWBGMOZBZRF-UHFFFAOYSA-N 475.621 5.289 5 20 JKBD COc1ccc([C@H]2CCN(C(=O)c3ccccc3NC(=O)c3ccc([N+](=O)[O-])cc3Cl)C2)cc1 504920212 SXPUPTHNGHOGSM-KRWDZBQOSA-N 479.920 5.139 5 20 JKBD Cc1csc(Sc2ccc(C(=O)N3CCO[C@@H](c4ccccc4Cl)C3)cc2[N+](=O)[O-])n1 505155534 VOSZZPJTFHPQQE-GOSISDBHSA-N 475.979 5.378 5 20 JKBD CCCN(CC(=O)Nc1ccccc1OC)C(=O)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1 514596547 WDUQFLIJRVTFEK-UHFFFAOYSA-N 497.935 5.540 5 20 JKBD Cc1ccc([C@H](NC(=O)C2CCN(c3ccc(C(F)(F)F)cc3[N+](=O)[O-])CC2)C2CC2)cc1 514765980 FPUYHQGTRATHIS-QFIPXVFZSA-N 461.484 5.406 5 20 JKBD CC[C@H](NCc1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1)c1nnc2n1CCCCC2 517551864 UKAUWLCVPBMXAH-IBGZPJMESA-N 455.946 5.599 5 20 JKBD CCOc1cc([N+](=O)[O-])c(C(=O)N[C@H](c2ccccc2)c2ccc(Br)cc2)cc1OC 518939870 KCBIPJYJSPTEKK-JOCHJYFZSA-N 485.334 5.284 5 20 JKBD O=C(c1c2c(nc3ccccc13)/C(=C/c1cccc([N+](=O)[O-])c1)CCC2)N1CCC(n2ccnc2)CC1 522387248 FNVASMFISSPICC-HEHNFIMWSA-N 493.567 5.694 5 20 JKBD Cc1c(NC(=O)[C@@H](C)Sc2nnc(-c3ccncc3)n2-c2ccc(Cl)cc2)cccc1[N+](=O)[O-] 597255687 YSLGLFXOJJGFQR-OAHLLOKOSA-N 494.964 5.319 5 20 JKBD Cc1ccc(NC(=O)c2ccc(N[C@H](CO)c3cccc(C(F)(F)F)c3)c([N+](=O)[O-])c2)cc1 600853458 WIFBCEMNSURHOJ-HXUWFJFHSA-N 459.424 5.320 5 20 JKBD O=C(NCc1ccc(OCc2cccc(F)c2)cc1)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-] 603866173 LSSXADMRMVVXHA-UHFFFAOYSA-N 478.398 5.184 5 20 JKBD Cn1ccnc1[C@H](NCc1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1)c1ccccc1F 608835763 OBYLJEHILJBYIG-AREMUKBSSA-N 482.519 5.199 5 20 JKBD O=C(NCc1ccc(NC(=O)c2c[nH]c3ccc([N+](=O)[O-])cc23)cc1)c1ccc(C(F)(F)F)cc1 609347110 QPAXBFZYEUJXPM-UHFFFAOYSA-N 482.418 5.277 5 20 JKBD Cc1nn(Cc2ccc(C(=O)N3CCc4sccc4[C@@H]3c3cccs3)cc2)c(C)c1[N+](=O)[O-] 609549835 NPYXOTFWRKTHOD-HSZRJFAPSA-N 478.599 5.367 5 20 JKBD O=C(N[C@H](c1ccccc1)c1cc2ccccc2o1)C1CCN(c2ccccc2[N+](=O)[O-])CC1 619110830 TUGVZRUZTXCEAF-AREMUKBSSA-N 455.514 5.463 5 20 JKBD Cc1cc(C(=O)O[C@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2cc(Br)ccc2n1 725976975 SUYAFZJGCPHHNJ-LLVKDONJSA-N 492.713 5.051 5 20 JKBD CCc1cccc(CC)c1NC(=O)N1CCN(c2ccc([N+](=O)[O-])cc2C(F)(F)F)CC1 727586440 ORTHEVFKQWZSNU-UHFFFAOYSA-N 450.461 5.093 5 20 JKBD Cc1ccsc1C(=O)Nc1ccc(OC(=O)[C@@H](C)Oc2ccc(Cl)cc2[N+](=O)[O-])cc1 729216065 HWTGFQDRORSHAA-CYBMUJFWSA-N 460.895 5.243 5 20 JKBD O=C(OCC(=O)N1Cc2ccccc2[C@H](c2ccccc2)C1)c1csc(-c2ccc([N+](=O)[O-])cc2)n1 747955350 RKVHRSOCKLZVPK-QHCPKHFHSA-N 499.548 5.049 5 20 JKBD Cc1ccc(C(C)C)c(Oc2ccc(CN3Cc4cccnc4N4C[C@H](O)C[C@H]4C3)cc2[N+](=O)[O-])c1 856533467 GLTBDBZUDRKKAR-XZOQPEGZSA-N 488.588 5.169 5 20 JKBD O=C(Cc1noc(-c2ccc(Sc3nc4ccccc4s3)c([N+](=O)[O-])c2)n1)Nc1ccccc1 904383482 MPUMQDJVEFVHFS-UHFFFAOYSA-N 489.538 5.587 5 20 JKBD O=[N+]([O-])c1ccc(/C=C(/Cc2nc(Cc3cccnc3)no2)c2nc3ccccc3s2)cc1 904678556 PCZGAZIHQYMDEY-PDGQHHTCSA-N 455.499 5.357 5 20 JKBD O=C(C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)OCc1nc(C2CC2)no1 913389042 WRXDFRABAJWBCP-WJDWOHSUSA-N 462.487 5.139 5 20 JKBD O=C(Nc1ccccc1)Nc1cccc(NC(=O)c2cc([N+](=O)[O-])ccc2N2CCCCC2)c1 918558345 GNSIECDRYNLOKJ-UHFFFAOYSA-N 459.506 5.481 5 20 JKBD C[C@@H]1C[C@H]1c1ccc(CNC(=O)c2ccccc2NC(=O)c2ccc([N+](=O)[O-])cc2Cl)o1 918632465 HGMRJZNPKOHEDJ-FZKQIMNGSA-N 453.882 5.147 5 20 JKBD O=C(Nc1ccccc1C(=O)NC[C@@H]1CCCO[C@@H]1c1ccccc1)c1ccc([N+](=O)[O-])cc1Cl 920297751 RZBJCRKBTMNUST-MHECFPHRSA-N 493.947 5.398 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)C3CCC(C(F)(F)F)CC3)CCC2)cc1)c1ccc([N+](=O)[O-])o1 1785748734 NUAGWHHVHXSLPZ-UHFFFAOYSA-N 479.455 5.304 5 20 JKBD O=C(CCc1cccc([N+](=O)[O-])c1)Nc1ccc(C2(NC(=O)c3ccc(Cl)nc3)CCC2)cc1 1786598861 DKSWTNGLHMHVNT-UHFFFAOYSA-N 478.936 5.024 5 20 JKBD O=C(Cc1cccc([N+](=O)[O-])c1)NC1(c2ccc(NC(=O)c3cc4[nH]ccc4s3)cc2)CCC1 1789101191 VVVSNULNGSXCEB-UHFFFAOYSA-N 474.542 5.128 5 20 JKBD O=C(/C=C/c1ccc([N+](=O)[O-])o1)NC1(c2ccc(NC(=O)C3(F)CCCCC3)cc2)CCC1 1789157744 JXPSIKPANLVQLD-PKNBQFBNSA-N 455.486 5.008 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)[C@@H]3C[C@@H]3C3CC3)CCC2)cc1)c1ccc(Br)c([N+](=O)[O-])c1 1790641669 CCFLZAKRYDVIQN-RTBURBONSA-N 498.377 5.151 5 20 JKBD Cc1[nH]ccc1C(=O)NC1(c2ccc(NC(=O)c3cc(Br)ccc3[N+](=O)[O-])cc2)CCC1 1790664203 WBXJGEPZLDUHDY-UHFFFAOYSA-N 497.349 5.055 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)c3cccc4cc[nH]c34)CCC2)cc1)c1cccc(F)c1[N+](=O)[O-] 1790700939 DGFOJDRXAGOJGV-UHFFFAOYSA-N 472.476 5.277 5 20 JKBD Cc1csc(CCC(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cc4cc([N+](=O)[O-])ccc4s2)C3)c1 1794358040 KFPCRFXPITUQRR-BCDXTJNWSA-N 483.615 5.064 5 20 JKBD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(Oc2ccccc2)cc1)c1cccc(F)c1[N+](=O)[O-] 1800348588 PZMGPMDCIVIURF-ACDBMABISA-N 489.503 5.092 5 20 JKBD COc1cc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2ccccc2-c2ccc(C)cc2)ccc1[N+](=O)[O-] 1800606188 NRVXDMHVYOPWSK-NUNAXRQHSA-N 499.567 5.144 5 20 JKBD CC[C@H](C)[C@H](C(=O)N1CCCC2(CCN(C(=O)c3ccc([N+](=O)[O-])cc3F)CC2)C1)c1ccccc1 1809161979 IOYJGMJPMOXWBA-CPJSRVTESA-N 495.595 5.409 5 20 JKBD O=C(c1cccc(F)c1[N+](=O)[O-])N1CCC([C@H]2CCCCN2C(=O)c2ccc(Cl)c(F)c2)CC1 1830486387 XCMVBMQHLWRFHX-OAQYLSRUSA-N 491.922 5.074 5 20 JKBD Cc1ccc(-c2nc(C)sc2CC(=O)O[C@@H](C)C(=O)Nc2cc([N+](=O)[O-])ccc2Cl)cc1 11216217 JLCLDRDRGKHJQT-ZDUSSCGKSA-N 473.938 5.101 5 20 JKBD COc1cc(C(=O)NC[C@@H](c2ccsc2)N(C)C)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 25811415 YFNMWJZLFFGXSM-SFHVURJKSA-N 475.954 5.143 5 20 JKBD CCc1ccccc1NC(=O)[C@@H](C)OC(=O)Cc1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1 27258858 BMNJDIADGCIVQJ-LJQANCHMSA-N 498.539 5.123 5 20 JKBD Cc1cc(C(=O)O[C@@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2ccccc2)ccc1[N+](=O)[O-] 28300891 JJFLGCFVDWEMJH-HXUWFJFHSA-N 469.837 5.002 5 20 JKBD O=C(Nc1cc(Br)ccc1Br)c1ccc(Br)c([N+](=O)[O-])c1 31950619 XEIJNUYEAWIMIS-UHFFFAOYSA-N 478.922 5.135 5 20 JKBD COc1ccc(CSCC(=O)NCc2cccc(NC(=O)Nc3cccc(C)c3)c2)cc1[N+](=O)[O-] 68708911 OEUMKRRFLFPANF-UHFFFAOYSA-N 494.573 5.105 5 20 JKBD COc1ccc(Sc2ccc(NC(=O)c3cc([N+](=O)[O-])cc(S(C)(=O)=O)c3)cc2Cl)cc1 109199277 VIDBMMUHMUFZLT-UHFFFAOYSA-N 492.962 5.064 5 20 JKBD C[C@@H](Nc1ccc(C(=O)N(CCc2ccccn2)Cc2ccc(F)cc2)cc1[N+](=O)[O-])c1ccccn1 303148681 MFSGTRYHMDDFAI-HXUWFJFHSA-N 499.546 5.582 5 20 JKBD C[C@H](NC(C)(C)CNC(=O)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1)c1ccccc1 303176841 CGUWCAROOYMPDY-KRWDZBQOSA-N 492.542 5.076 5 20 JKBD O=C(NCc1ccccc1F)c1cc(NC(=O)c2ccc(Cl)cc2[N+](=O)[O-])ccc1Cl 484264301 GXKOUCZUAUQSNB-UHFFFAOYSA-N 462.264 5.223 5 20 JKBD O=C(Nc1ccc(NC(=O)N2CCCCCC2)cc1)c1cc([N+](=O)[O-])ccc1Sc1ccccc1 498507165 QHXHLPLPYQYHAK-UHFFFAOYSA-N 490.585 6.406 5 20 JKBD C[C@@H](NC(=O)C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)c1ccc2c(c1)CC(=O)N2 501049668 CHOGKTAPOXOWIT-DDLUMYACSA-N 498.564 5.507 5 20 JKBD COc1ccc(OC)c([C@H]2CCCN2C(=O)c2ccc(N[C@@H](C)c3ccccn3)c([N+](=O)[O-])c2)c1 506088039 TWSJOLYOTRYSQU-GAJHUEQPSA-N 476.533 5.157 5 20 JKBD CC(C)CC(=O)Nc1ccc(NC(=O)c2ccc(N[C@H](C)c3ccccn3)c([N+](=O)[O-])c2)cc1 506140376 AYJAMYMZDNSACW-QGZVFWFLSA-N 461.522 5.400 5 20 JKBD C[C@H]1CCC[C@H](C)N1C(=O)c1cc(Cl)ccc1NC(=O)c1ccc(-n2ccnc2)c([N+](=O)[O-])c1 512340145 GGPNURIZYIAESA-HOTGVXAUSA-N 481.940 5.089 5 20 JKBD C[C@H](NCc1ccc(-c2ccc([N+](=O)[O-])cc2)s1)c1cc(F)ccc1N1CCN(C)CC1 518275106 BUPTWKPRDYQYHK-KRWDZBQOSA-N 454.571 5.065 5 20 JKBD COc1ccc(Sc2ccc(NC(=O)C(=O)N[C@@H](C)c3cccc([N+](=O)[O-])c3)cc2Cl)cc1 520003540 HEVIKZMAZGGNQA-AWEZNQCLSA-N 485.949 5.224 5 20 JKBD CC(C)CCSc1ccc(C(=O)N2CCC(C(=O)NCCc3cccs3)CC2)cc1[N+](=O)[O-] 520126611 CFEZZCPFDLXMHP-UHFFFAOYSA-N 489.663 5.006 5 20 JKBD Cc1ccc(C(=O)Nc2ccccc2)cc1NC(=O)[C@H](C)Oc1ccc(Cl)cc1[N+](=O)[O-] 520409905 CBEKKSKDMIMPIH-HNNXBMFYSA-N 453.882 5.215 5 20 JKBD CSc1cccc(N(C)C(=O)C2CCN(c3ccc(C(F)(F)F)cc3[N+](=O)[O-])CC2)c1 523169918 OIKINTAIVOZHOY-UHFFFAOYSA-N 453.486 5.215 5 20 JKBD CCOc1cc(NC(=O)c2ccccc2SCc2cccs2)c([N+](=O)[O-])cc1OCC 590646979 KFRLTVOVHRKNLZ-UHFFFAOYSA-N 458.561 5.998 5 20 JKBD Cc1ccc(C(C)C)c(Oc2ccc(CN[C@H](c3ccccc3)c3nccn3C)cc2[N+](=O)[O-])c1 603633617 YWTIMTXGWBVGHC-HHHXNRCGSA-N 470.573 6.432 5 20 JKBD COc1ccc([N+](=O)[O-])cc1NC(=O)[C@H](Oc1ccccc1Br)c1ccccc1 603750392 NGCATCBYHKCYCL-HXUWFJFHSA-N 457.280 5.125 5 20 JKBD C[C@H]1CCCCN1C(=O)c1ccc(NC(=O)c2ccc(N3CCC[C@@H](C)C3)c([N+](=O)[O-])c2)cc1 603993309 QVVXMQXLQKILQH-MOPGFXCFSA-N 464.566 5.098 5 20 JKBD CCc1nc2cc(N[C@H](C(=O)Nc3ccc([N+](=O)[O-])cc3Cl)c3ccccc3)ccc2o1 604046871 BACKYWHPGQIEDQ-QFIPXVFZSA-N 450.882 5.744 5 20 JKBD O=C(NCc1nccn1CC(F)(F)F)c1ccc(Sc2nc3ccccc3s2)c([N+](=O)[O-])c1 609037922 ULJGRHONRDNVPZ-UHFFFAOYSA-N 493.492 5.045 5 20 JKBD C[C@@H](OC(=O)CC[C@H](O)c1ccc(C(C)(C)C)cc1)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 726873101 OVWVYFJBAIKNSV-QRWLVFNGSA-N 453.495 5.060 5 20 JKBD O=C(Nc1ccc(OC(=O)c2nccnc2-c2nc3ccccc3s2)cc1)c1cccc([N+](=O)[O-])c1 747473194 YDGNIDPZKXENFH-UHFFFAOYSA-N 497.492 5.133 5 20 JKBD Cc1c(C(=O)N(Cc2ccc(Cl)c(Cl)c2)Cc2ccccn2)cc([N+](=O)[O-])cc1[N+](=O)[O-] 748640419 JZHZPRVIHKEMTA-UHFFFAOYSA-N 475.288 5.356 5 20 JKBD O=C(OCC(=O)N1c2ccccc2Sc2ccccc21)c1cc([N+](=O)[O-])ccc1N1CCCCC1 823299574 BJGXJINUDPQZCK-UHFFFAOYSA-N 489.553 5.571 5 20 JKBD C[C@H]1C[C@@H](C)CN(c2ccc(-c3nc([C@H]4CCC(=O)N(CC5CCCC5)C4)no3)cc2[N+](=O)[O-])C1 856582799 VWBYWMMDBZCNFB-UEXGIBASSA-N 481.597 5.023 5 20 JKBD C[C@H](OC(=O)Cn1c2ccccc2c(=O)c2ccccc21)C(=O)N[C@@H](C)c1ccc2ccccc2c1 858085441 SNLXLVJRJPVWGM-PMACEKPBSA-N 478.548 5.117 5 20 JKBD COc1ccc(Oc2ccc([N+](=O)[O-])cc2C(=O)O[C@@H](C)C(=O)N2CCC[C@@H]2c2cccs2)cc1 915443114 YRJFBOUOSMJGNH-HRAATJIYSA-N 496.541 5.366 5 20 JKBD COc1ccc(C)cc1NC(=O)c1cc2ccccc2cc1OC(=O)Cc1ccccc1[N+](=O)[O-] 916878510 MWDHIPZTJLFAOX-UHFFFAOYSA-N 470.481 5.465 5 20 JKBD CN(C(=O)c1ccc(NS(=O)(=O)c2ccc(Cl)c([N+](=O)[O-])c2)cc1Cl)C1CCCCC1 917754012 VYFJDUIZSQAFMA-UHFFFAOYSA-N 486.377 5.107 5 20 JKBD O=C(/C=C/c1ccc([N+](=O)[O-])o1)Nc1ccc(C2(NC(=O)c3cc(-c4ccccc4)no3)CCC2)cc1 1786207518 UTIOMIAMSGTVGD-ACCUITESSA-N 498.495 5.304 5 20 JKBD Cc1cc(O)c([N+](=O)[O-])cc1C(=O)NC1(c2ccc(NC(=O)C3CCC(F)(F)CC3)cc2)CCC1 1786246131 SRFUXJMPGHDTDK-UHFFFAOYSA-N 487.503 5.182 5 20 JKBD COc1ccsc1C(=O)Nc1ccc(C2(NC(=O)CCc3cccc([N+](=O)[O-])c3)CCC2)cc1 1789929038 DFDZKYWZCKGDGK-UHFFFAOYSA-N 479.558 5.045 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)[C@H]3C[C@@]3(F)Cl)CCC2)cc1)c1cc2cc([N+](=O)[O-])ccc2s1 1791009846 AIFBNUYIXWZQOV-HXOBKFHXSA-N 487.940 5.482 5 20 JKBD O=C(/C=C/c1ccccc1[N+](=O)[O-])Nc1ccc(C2(NC(=O)[C@]3(F)CCCC=C3F)CCC2)cc1 1792318975 CEWFAUCXLCTGMI-BULTVDLSSA-N 481.499 5.488 5 20 JKBD O=C(Nc1cc([C@H]2CCCCN2C(=O)c2ccc([N+](=O)[O-])o2)[nH]n1)c1sc2ccccc2c1Cl 1818605380 DQYLWUNPWIUVSI-CQSZACIVSA-N 499.936 5.399 5 20 JKBD Cc1ccc(CC(=O)N2CCC([C@H]3CCCCN3C(=O)c3cc4ccccc4o3)CC2)cc1[N+](=O)[O-] 1828188424 DCNFZWCUWPPYFN-HSZRJFAPSA-N 489.572 5.125 5 20 JKBD O=C(/C=C/c1ccccc1[N+](=O)[O-])N1CCC([C@H]2CCCCN2C(=O)c2cccc(F)c2Cl)CC1 1830575276 QOCOYTUULUVUAU-VDZCTEQFSA-N 499.970 5.334 5 20 JKBD C[C@H](CC(=O)N1CCCC[C@H]1C1CCN(C(=O)/C=C/c2ccc([N+](=O)[O-])o2)CC1)c1ccccc1 1831502602 CKHQWCBUBPSPRU-KAYDMBQGSA-N 479.577 5.015 5 20 JKBD COc1cc(C(=O)N2CCC([C@H]3CCCCN3C(=O)c3cccc(C)c3Cl)CC2)ccc1[N+](=O)[O-] 1832603960 XQNXWALLKSDYFK-OAQYLSRUSA-N 499.995 5.112 5 20 JKBD O=C(COC(=O)C1c2ccccc2Oc2ccccc21)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 9138887 OYIXVIXQQOBZPK-UHFFFAOYSA-N 472.375 5.033 5 20 JKBD Cc1ccc(NC(=O)[C@H](Sc2nnc(-c3ccccc3C)o2)c2ccccc2)c([N+](=O)[O-])c1 10015581 OIZUPOPIPJRULE-OAQYLSRUSA-N 460.515 5.734 5 20 JKBD O=C(Nc1cccc(S(=O)(=O)Nc2ccccc2Cl)c1)c1cc2cc([N+](=O)[O-])ccc2s1 15630517 KTSVHKQMIZKPAB-UHFFFAOYSA-N 487.946 5.516 5 20 JKBD CCOc1ccc([C@@H](CNC(=O)c2cccc([N+](=O)[O-])c2)c2c[nH]c3ccccc23)cc1OC 16176371 CECMNJCIALKZEY-OAQYLSRUSA-N 459.502 5.045 5 20 JKBD C[C@@H](OC(=O)c1ccc(NC2CC2)c([N+](=O)[O-])c1)C(=O)Nc1ccc(Cl)cc1C(F)(F)F 16926038 IFCJJRJQYWOTEG-SNVBAGLBSA-N 471.819 5.025 5 20 JKBD C[C@@H](Sc1nnc(-c2cccs2)n1Cc1ccccc1)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 17653091 PMISVKNXSWMYPO-OAHLLOKOSA-N 490.570 5.866 5 20 JKBD CC(C)n1nccc1NC(=O)[C@H](C)OC(=O)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1 23467984 ISYDTKYMMJPKPX-AWEZNQCLSA-N 472.885 5.002 5 20 JKBD O=C(Nc1cccc(NC(=O)c2cc([N+](=O)[O-])ccc2N2CCCCC2)c1)c1cccs1 24033308 XWTDMFWIPJWQKN-UHFFFAOYSA-N 450.520 5.151 5 20 JKBD O=C(Nc1ccc(Cn2cncn2)cc1)c1cc([N+](=O)[O-])ccc1Sc1ccc(Cl)cc1 24626844 JZZQIBAIJPSPQK-UHFFFAOYSA-N 465.922 5.292 5 20 JKBD C[C@H](NC(=O)c1cccc(NS(=O)(=O)c2cc(Cl)ccc2Cl)c1)c1cccc([N+](=O)[O-])c1 108456857 MYKQZPSUJSPDHK-ZDUSSCGKSA-N 494.356 5.193 5 20 JKBD CSc1ccc(C(=O)c2ccccc2C(=O)NC[C@H]2CCCO[C@@H]2c2ccccc2)cc1[N+](=O)[O-] 409547493 JNWGLMFBYRUTCO-FQRUVTKNSA-N 490.581 5.445 5 20 JKBD O=C(Nc1cc([N+](=O)[O-])ccc1OC(F)F)[C@@H](Oc1ccc(F)c(F)c1)c1ccccc1 409798969 YWYLRSGOVVMDKO-IBGZPJMESA-N 450.344 5.233 5 20 JKBD COc1cc(C(=O)N2CCc3cc([N+](=O)[O-])ccc32)ccc1OCc1ccc(Br)cc1 478131416 HXQZITTZXMDBRP-UHFFFAOYSA-N 483.318 5.148 5 20 JKBD O=C(Nc1ncc(Cc2cc(C(F)(F)F)cc(C(F)(F)F)c2)s1)c1ccc([N+](=O)[O-])[nH]1 487357151 SKVOQVAFZAMWGI-UHFFFAOYSA-N 464.347 5.260 5 20 JKBD CC(C)c1ccccc1N(C(=O)Cn1c(=O)oc2cc([N+](=O)[O-])ccc21)c1nc2ccccc2s1 495804073 LBLZQEJUURFIHE-UHFFFAOYSA-N 488.525 5.601 5 20 JKBD Cc1ccc(NC(=O)c2csc(-c3cccc([N+](=O)[O-])c3)n2)cc1NS(=O)(=O)c1ccccc1 497495953 FSDQPPYUJOUFNN-UHFFFAOYSA-N 494.554 5.080 5 20 JKBD CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)CCc1ncc(-c2ccc(Cl)cc2Cl)o1 501998682 PDRAUFLBTAOWJM-UHFFFAOYSA-N 462.333 5.926 5 20 JKBD C[C@H](Nc1ccc(C(=O)Nc2cc(F)ccc2OC[C@@H]2CCCO2)cc1[N+](=O)[O-])c1ccccn1 502287231 ZOKWVQDALJXIGW-LPHOPBHVSA-N 480.496 5.112 5 20 JKBD C[C@@H]1CCCN(c2ccc(C(=O)N(C)c3ccc(Br)cc3F)cc2[N+](=O)[O-])C1 509703709 DSODXGZHBNCCBQ-CYBMUJFWSA-N 450.308 5.009 5 20 JKBD COc1cc2c(cc1OC)[C@@H](c1ccccc1)N(C(=O)Nc1cc([N+](=O)[O-])ccc1OC(F)F)CC2 510825504 NYWQVUOVWYODEI-HSZRJFAPSA-N 499.470 5.393 5 20 JKBD O=C(c1cccc(C(F)(F)F)c1)N1CCN(C(=O)c2cc([N+](=O)[O-])ccc2Oc2ccccc2)CC1 514515862 FOUVIUMZHYHVNK-UHFFFAOYSA-N 499.445 5.004 5 20 JKBD COc1cc(C(=O)Nc2ccc(NC(=O)c3ccccc3)cc2C(F)(F)F)c([N+](=O)[O-])cc1OC 514568297 DVHBKCUJFBDIKQ-UHFFFAOYSA-N 489.406 5.135 5 20 JKBD Cc1ccc2nc([C@@H]3CCCN3C(=O)c3ccc(N[C@H](C)c4ccccn4)c([N+](=O)[O-])c3)[nH]c2c1 522040626 MCRUFBRDZKKXJK-HXOBKFHXSA-N 470.533 5.325 5 20 JKBD CC(C)CCSc1ccc(C(=O)N[C@@H](c2nc(-c3cccnc3)no2)C(C)C)cc1[N+](=O)[O-] 524379052 PPRYKRUTTMVAKB-HXUWFJFHSA-N 469.567 5.305 5 20 JKBD O=C(NC1C[C@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1)c1cc([N+](=O)[O-])ccc1Sc1ccccc1 603573178 VKGPHASGUYXXPH-CHWSQXEVSA-N 492.441 6.385 5 20 JKBD C[C@@H](c1ccccc1)n1c(SCC(=O)N(C)c2ccc([N+](=O)[O-])cc2)nnc1-c1ccccc1 603917237 HVNAZXLAIDRMPU-SFHVURJKSA-N 473.558 5.218 5 20 JKBD CC(C)c1nccn1Cc1cccc(NC(=O)c2cc(OCC(F)(F)F)ccc2[N+](=O)[O-])c1 603927173 VOXIMYCIRGRNKA-UHFFFAOYSA-N 462.428 5.156 5 20 JKBD CCOc1cc([N+](=O)[O-])c(C(=O)N[C@@H](c2ccc(Br)cc2)C2CCC2)cc1OC 604016838 GVJGAYXXBNNJJJ-HXUWFJFHSA-N 463.328 5.036 5 20 JKBD CSc1ccc(C(=O)NCc2cccc(NC(=O)Nc3cccc(C)c3)c2)cc1[N+](=O)[O-] 604180397 RZDDDEVHFUTMNM-UHFFFAOYSA-N 450.520 5.199 5 20 JKBD C[C@@H](Nc1ccc(C(=O)Nc2ccc3nc([C@@H]4CCCO4)[nH]c3c2)cc1[N+](=O)[O-])c1ccccn1 604480919 BASTYZLGJHFIQQ-CMJOXMDJSA-N 472.505 5.143 5 20 JKBD O=C(COc1ccc([N+](=O)[O-])cc1)Nc1ccccc1OCc1ncc(-c2cccc(Cl)c2)o1 608850542 IPQMECNWDIOKDQ-UHFFFAOYSA-N 479.876 5.500 5 20 JKBD C[C@@H](Nc1ccc(C(=O)N2CCO[C@@H](c3ccc(F)c(Cl)c3)C2)cc1[N+](=O)[O-])c1ccccn1 608963057 OPOISHSSGSBTGI-IQMFZBJNSA-N 484.915 5.169 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Cl)[C@@H](c1ccccc1)N1CCO[C@@H](c2cccc(F)c2)C1 608975946 BAPDHHSIMXTSLL-DHIUTWEWSA-N 469.900 5.141 5 20 JKBD Cc1ccc(C(C)C)c(Oc2ccc(CNCCc3nnc4n3CCCCC4)cc2[N+](=O)[O-])c1 609006469 GRQQKGDFAPQRJU-UHFFFAOYSA-N 463.582 5.469 5 20 JKBD CC(=O)Nc1ccc(NC(=O)c2ccc(N[C@@H](C)c3ccccn3)c([N+](=O)[O-])c2)c(Cl)c1 609018689 LGRNMYFSZACYHT-ZDUSSCGKSA-N 453.886 5.027 5 20 JKBD O=C(OC[C@@H]1CCCN1C(=O)c1ccccc1[N+](=O)[O-])c1sc2cc(F)ccc2c1Cl 730704627 PRBBBLHSAMQUBZ-ZDUSSCGKSA-N 462.886 5.064 5 20 JKBD Cc1cc(C)c(NC(=S)/C(=C(/O)c2ccc(C)c([N+](=O)[O-])c2)n2ccc(=[N+](C)C)cc2)c(Cl)c1 747892023 RTBFSMNPZGTQQN-UHFFFAOYSA-O 498.028 5.330 5 20 JKBD C[C@@H](Oc1ccc(Cl)cc1[N+](=O)[O-])c1nc(C2(NC(=O)OC(C)(C)C)CCCC2)no1 904416352 ONMBNUWUTTVSJP-GFCCVEGCSA-N 452.895 5.065 5 20 JKBD Cc1cccc(N2CCN(Cc3ccc(NC(=S)Nc4ccc([N+](=O)[O-])cc4)cc3)CC2)c1 916011258 UWKGWFOAPFIKLF-UHFFFAOYSA-N 461.591 5.034 5 20 JKBD O=C(/C=C/c1ccsc1)Nc1ccc(C2(NC(=O)/C=C/c3ccc([N+](=O)[O-])o3)CCC2)cc1 1786941145 KDQFBLJLIGEEGL-QZYCOVMASA-N 463.515 5.110 5 20 JKBD Cc1ccc(SCC(=O)Nc2ccc(C3(NC(=O)c4ccc([N+](=O)[O-])o4)CCC3)cc2)cc1 1789107214 PFKZZNRZODLOAW-UHFFFAOYSA-N 465.531 5.036 5 20 JKBD O=C(NC1(c2ccc(NC(=O)C3(c4cccc(Cl)c4)CC3)cc2)CCC1)c1ccc([N+](=O)[O-])[nH]1 1789107629 YNPKURBJZBYSCS-UHFFFAOYSA-N 478.936 5.056 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)NC1(c2ccc(NC(=O)c3ccncc3Cl)cc2)CCC1 1789730675 ALNAENHWYVVWDF-UHFFFAOYSA-N 482.899 5.152 5 20 JKBD O=C(NC1(c2ccc(NC(=O)c3ccc([N+](=O)[O-])c4c3OCO4)cc2)CCC1)c1cc2ccccc2o1 1790094775 DABATEAYUQKCRC-UHFFFAOYSA-N 499.479 5.131 5 20 JKBD O=C(CSc1ccccc1[N+](=O)[O-])Nc1ccc(C2(NC(=O)C[C@H]3C[C@@H]4CC[C@H]3C4)CCC2)cc1 1791523292 OSSXBCWEOJFYSI-HSALFYBXSA-N 493.629 5.647 5 20 JKBD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc2c(Cl)cccc2s1)c1cccc(F)c1[N+](=O)[O-] 1797649774 KHVRQZQUVJDHEQ-BTTYYORXSA-N 487.940 5.168 5 20 JKBD O=C(CCc1ccsc1)N1CCCC2(CCN(C(=O)c3cc4cc([N+](=O)[O-])ccc4s3)CC2)C1 1810039598 VHHIXYRVKRGRGS-UHFFFAOYSA-N 497.642 5.349 5 20 JKBD O=C(Nc1cc([C@@H]2CCCCN2C(=O)CCc2cccc([N+](=O)[O-])c2)[nH]n1)c1cc(Cl)ccc1F 1814618247 ANGDVDOVXYZZQI-NRFANRHFSA-N 499.930 5.049 5 20 JKBD CCC[C@H]1CC[C@H](C(=O)Nc2cc([C@H]3CCCCN3C(=O)/C=C/c3ccc([N+](=O)[O-])o3)[nH]n2)CC1 1822099476 XDTRALRLYLKKRU-LGPFQHAYSA-N 483.569 5.223 5 20 JKBD C[C@@H](OC(=O)c1ccccc1NCc1ccco1)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 9023163 KKRWUERLMBHNEC-CYBMUJFWSA-N 477.395 5.003 5 20 JKBD Cc1ccc(NC(=O)[C@H](Sc2nnc(-c3ccc(Cl)cc3)n2C)c2ccccc2)c([N+](=O)[O-])c1 9459195 ZGRNXMQNGGJMFO-OAQYLSRUSA-N 493.976 5.824 5 20 JKBD Cn1c(S[C@H](C(=O)Nc2ccccc2)c2ccccc2)nc2cc3ccccc3cc2c1=O 11059659 HIKNQZAQQOUMSU-DEOSSOPVSA-N 451.551 5.559 5 20 JKBD CCOc1ccccc1Nc1nnc(S[C@@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)s1 20789654 UDMWDJHOFJDFNB-NSHDSACASA-N 479.971 5.361 5 20 JKBD Cc1c(NC(=O)[C@H](C)OC(=O)[C@@H](Sc2ccccc2)c2ccccc2)cccc1[N+](=O)[O-] 23202239 MBVGCFVZCNRUDK-JTSKRJEESA-N 450.516 5.307 5 20 JKBD COCCOc1cc([N+](=O)[O-])c(C(=O)Nc2nc(-c3ccc(Cl)cc3Cl)cs2)cc1OC 105335734 JYNAWKONWHSYGB-UHFFFAOYSA-N 498.344 5.311 5 20 JKBD O=C(Nc1ncc(Cc2cccc(Cl)c2)s1)C1CCN(c2ccccc2[N+](=O)[O-])CC1 477600728 KVIGDQMXGGRGIZ-UHFFFAOYSA-N 456.955 5.151 5 20 JKBD Cc1sc(NC(=O)C2CCN(c3ccccc3[N+](=O)[O-])CC2)nc1-c1ccc(OC(F)F)cc1 478104544 SALWCBZVPTWPBV-UHFFFAOYSA-N 488.516 5.483 5 20 JKBD O=C(CCCn1c(=O)oc2cc([N+](=O)[O-])ccc21)Nc1ccccc1NC12CC3CC(CC(C3)C1)C2 500016935 ITWBENQYPRWRKY-UHFFFAOYSA-N 490.560 5.302 5 20 JKBD CCOc1cc(F)ccc1NC(=O)Cc1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1 502061264 LNFJEMODGUXEIF-UHFFFAOYSA-N 460.465 5.167 5 20 JKBD Cc1ccc(NC(=O)[C@@H]2CCCN(C(=O)c3ccc(Oc4ccc(Cl)cc4[N+](=O)[O-])cc3)C2)nc1 503014221 LHDPJZSRQMIGSO-GOSISDBHSA-N 494.935 5.235 5 20 JKBD O=C(Nc1c(-c2cccs2)nc2ccccn12)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-] 509792616 QKJAQICKJVTXIV-UHFFFAOYSA-N 462.409 5.164 5 20 JKBD C[C@H](NC(=O)Nc1cccc(NC(=O)c2cccc(C(F)(F)F)c2)c1)c1cccc([N+](=O)[O-])c1 509876170 BMMOVOMGCAIIKR-AWEZNQCLSA-N 472.423 5.749 5 20 JKBD COc1cc(C(=O)Nc2ccccc2Oc2ccc(C)cc2)c([N+](=O)[O-])cc1OCc1cscn1 512375534 UEPJGMKWPLKNIS-UHFFFAOYSA-N 491.525 5.992 5 20 JKBD CN(Cc1ccccc1[N+](=O)[O-])C(=O)N[C@H](c1ccccc1)c1ccc(Br)cc1 518920846 QOSWIDVOMKJQQX-OAQYLSRUSA-N 454.324 5.288 5 20 JKBD Cc1ccc(C(=O)Nc2cccc(C(F)(F)F)c2)cc1NS(=O)(=O)c1c(F)cccc1[N+](=O)[O-] 520111909 KTABQDOQWIYKOI-UHFFFAOYSA-N 497.426 5.114 5 20 JKBD C[C@@H](NC(=O)c1cc([N+](=O)[O-])ccc1Sc1ccccc1)c1cccc(N2CCCC2=O)c1 520502978 FMYIRTRLSAZLBW-QGZVFWFLSA-N 461.543 5.364 5 20 JKBD O=C(CSc1ccc(C(F)(F)F)cc1[N+](=O)[O-])Nc1ccc(Cn2cnc3ccccc32)cc1 520923013 NBYGOGGPWZTOCY-UHFFFAOYSA-N 486.475 5.742 5 20 JKBD CN(C)CCn1ccc(NC(=O)c2c3c(nc4ccccc24)/C(=C\c2ccc([N+](=O)[O-])cc2)CCC3)n1 522269903 GNPFAFLCVSUNEN-ZZEZOPTASA-N 496.571 5.030 5 20 JKBD Cc1cccc2c1CC[C@@H]2NC(=O)c1ccc(C(=O)N[C@H]2CCc3c(C)cccc32)c([N+](=O)[O-])c1 552228013 AJTYCCGTKFCKTN-DQEYMECFSA-N 469.541 5.046 5 20 JKBD CCCN(CC(=O)Nc1ccc(Cl)cc1Cl)[C@@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl 559805021 SITXQPOUVIJUTR-LBPRGKRZSA-N 487.771 5.233 5 20 JKBD O=C(Nc1cc(Cl)ccc1OCC(F)(F)F)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-] 603738139 XBCPHGIGIDJWIF-UHFFFAOYSA-N 472.725 5.383 5 20 JKBD COc1cc(C(=O)NCCc2cccc(OC)c2OC)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 603968177 ZLRMMIHNNOSBST-UHFFFAOYSA-N 486.908 5.039 5 20 JKBD Cc1sc(NC(=O)c2cccc(N3C(=O)c4ccccc4C3=O)c2)nc1-c1cccc([N+](=O)[O-])c1 603997027 NOICBWDTZVJIHE-UHFFFAOYSA-N 484.493 5.080 5 20 JKBD O=C(Cc1cn(-c2ccccc2)nc1-c1ccc(F)cc1)Nc1cc([N+](=O)[O-])ccc1OC(F)F 604448043 FKVAWWPPSOELJA-UHFFFAOYSA-N 482.418 5.369 5 20 JKBD O=C(c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-])N1CCO[C@@H](c2ccc(Cl)c(Cl)c2)C1 608965526 YXSSASRLLGOKIO-QGZVFWFLSA-N 479.238 5.056 5 20 JKBD CCN(Cc1nc(O)c2ccccc2n1)C(=O)CCC(=O)c1ccc2ccc3cccc4ccc1c2c34 727753454 VOSGBOOUZUAQCH-UHFFFAOYSA-N 487.559 6.244 5 20 JKBD Cc1nc(C(=O)Nc2cc(Cl)c([N+](=O)[O-])cc2OCc2ccccc2)nn1-c1ccc(F)cc1 746091643 GTKOCLLDUBJBJH-UHFFFAOYSA-N 481.871 5.108 5 20 JKBD CCC(CC)c1cc[n+](/C(C(=S)NCc2cccs2)=C(/O)c2ccc([N+](=O)[O-])cc2)cc1 839411947 HOWAPEBPVRLXRK-UHFFFAOYSA-O 468.624 5.848 5 20 JKBD COCCN(C(=O)c1cc2cc([N+](=O)[O-])ccc2s1)c1nc(-c2ccc([N+](=O)[O-])cc2)cs1 916556693 ZAXKAXSXRMZIHJ-UHFFFAOYSA-N 484.515 5.134 5 20 JKBD O=C(Oc1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2Cl)cc1)c1cc(-c2cccs2)[nH]n1 917952601 ADMFIXIOZXGSOB-UHFFFAOYSA-N 468.878 5.171 5 20 JKBD CC(C)(C)C(=O)N1CCC[C@@H](C(=O)Nc2cc(Cl)c([N+](=O)[O-])cc2OCc2ccccc2)C1 920342545 YHYMLXAQQULWRR-QGZVFWFLSA-N 473.957 5.050 5 20 JKBD Cc1cc(Cl)c(Cl)cc1C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2ccc([N+](=O)[O-])o2)n[nH]1 1814312536 PNNRIDCPRGCSNM-INIZCTEOSA-N 492.319 5.146 5 20 JKBD CC(C)=CCCC(=O)Nc1cc([C@@H]2CCCCN2C(=O)C2(c3cccc([N+](=O)[O-])c3)CCC2)[nH]n1 1820805139 VEAKUYRNUZDNLK-QFIPXVFZSA-N 479.581 5.178 5 20 JKBD O=C(Nc1cc([C@H]2CCCCN2C(=O)c2ccccc2)[nH]n1)c1cc2cc([N+](=O)[O-])ccc2s1 1821609320 CFNFTNILAXLDBK-LJQANCHMSA-N 475.530 5.152 5 20 JKBD Cc1c(C(=O)N2CCCC[C@H]2c2cc(NC(=O)/C=C/c3ccccc3[N+](=O)[O-])n[nH]2)oc2ccccc12 1823504667 SBVRKXHNIGKRME-TWLJRWAQSA-N 499.527 5.392 5 20 JKBD Cc1c(C(=O)N2CCC([C@@H]3CCCCN3C(=O)c3ccc(F)cc3)CC2)cc(Cl)cc1[N+](=O)[O-] 1830021680 OMSDYABRTWAWDC-QFIPXVFZSA-N 487.959 5.243 5 20 JKBD CC(C)=CCCC(=O)N1CCC([C@H]2CCCCN2C(=O)c2c(F)ccc([N+](=O)[O-])c2C)CC1 1830732552 CGABOPDDQPCLSD-JOCHJYFZSA-N 459.562 5.022 5 20 JKBD COc1cc(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3cc(C)cc(Cl)c3)CC2)ccc1[N+](=O)[O-] 1832697546 PTLDQBNNKARMFM-JOCHJYFZSA-N 499.995 5.112 5 20 JKBD C[C@@H](OC(=O)c1ccc(OCc2ccccc2)cc1)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 8952371 YKUJLPFBIPLWOV-OAHLLOKOSA-N 488.418 5.377 5 20 JKBD COc1cc(C(=O)O[C@@H](C)C(=O)Nc2ccccc2C)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 10911925 SPPWQAOPHFEXDK-HNNXBMFYSA-N 484.892 5.542 5 20 JKBD CC(C)n1ncc2c(C(=O)O[C@H](C)C(=O)Nc3ccc([N+](=O)[O-])cc3Cl)cc(-c3ccco3)nc21 11041503 DNRISFHAEVGXDQ-CYBMUJFWSA-N 497.895 5.018 5 20 JKBD O=C1CCc2cc(-c3csc(NC(=O)c4cc5cc([N+](=O)[O-])ccc5s4)n3)ccc2N1 11451642 AULNKIMKSQKSQR-UHFFFAOYSA-N 450.501 5.070 5 20 JKBD COc1ccccc1NC(=O)c1ccc(NC(=O)c2ccc(N3CCC[C@@H](C)C3)c([N+](=O)[O-])c2)cc1 15313628 ZFPBXZMQCUZZDY-GOSISDBHSA-N 488.544 5.344 5 20 JKBD Cc1csc(Sc2ccc(C(=O)N(Cc3cccnc3)Cc3ccco3)cc2[N+](=O)[O-])n1 71835459 RSTCXWLXHFDDEB-UHFFFAOYSA-N 466.544 5.342 5 20 JKBD Cc1nn(Cc2ccc(C(=O)NCc3ccccc3COCc3ccccc3)cc2)c(C)c1[N+](=O)[O-] 106319265 ZLJFWGWVEFZJJE-UHFFFAOYSA-N 484.556 5.103 5 20 JKBD COc1cc2c(cc1OC)[C@@H](c1cccs1)N(C(=O)c1ccc(NC3CC3)c([N+](=O)[O-])c1)CC2 255944252 SSFALXDJFSRVNK-DEOSSOPVSA-N 479.558 5.036 5 20 JKBD CC(=O)NCc1ccc(-c2csc(NC(=O)c3cc4ccccc4c4cccnc34)n2)s1 302923779 ATIWYMQRZGDNJT-UHFFFAOYSA-N 458.568 5.461 5 20 JKBD O=C(Nc1cc(Cl)ccc1OC[C@H]1CCCO1)c1csc(-c2cccc([N+](=O)[O-])c2)n1 303006207 IKBDWRVUXXKTJR-MRXNPFEDSA-N 459.911 5.182 5 20 JKBD COc1ccc(CSCC(=O)N[C@@H](C)c2sc(-c3ccc(F)cc3)nc2C)cc1[N+](=O)[O-] 303304348 ZJXNSPYISZXMLZ-ZDUSSCGKSA-N 475.567 5.285 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)Nc2nc(C3CC3)c(Cc3ccc(F)cc3)s2)cc1SC 484283387 UFLFVEGUHHIMRV-UHFFFAOYSA-N 473.551 5.641 5 20 JKBD Cc1c(CN2CCSCC2)cccc1NC(=O)c1cc([N+](=O)[O-])ccc1Sc1ccccc1 490088187 KKWBHRVMUOOTGS-UHFFFAOYSA-N 479.627 5.856 5 20 JKBD O=C(Cn1c2ccccc2c(=O)c2ccccc21)N(Cc1ccccc1C(F)(F)F)C1CC1 498351005 AQVJGFIEJJZFDN-UHFFFAOYSA-N 450.460 5.365 5 20 JKBD C[C@@H](Nc1ccc(C(=O)Nc2cccc(OCc3cscn3)c2)cc1[N+](=O)[O-])c1ccccn1 505057512 JNNXUTRSFZTYBU-MRXNPFEDSA-N 475.530 5.451 5 20 JKBD COc1ccc(Oc2ccc([N+](=O)[O-])cc2C(=O)N2CCO[C@@H](c3ccccc3Cl)C2)cc1 505125571 OMGLYRDRBOPEEM-HSZRJFAPSA-N 468.893 5.263 5 20 JKBD CCOc1ccc(C(=O)C(c2nc3ccccc3s2)c2nc3ccccc3s2)cc1[N+](=O)[O-] 513648518 QUCUAKRLQHHHTI-UHFFFAOYSA-N 475.551 6.228 5 20 JKBD CC(C)Oc1ccc(NC(=O)c2ccc(N[C@H](C)c3ccccn3)c([N+](=O)[O-])c2)c(C(F)(F)F)c1 517921921 VFMJIYJFUYCUTA-OAHLLOKOSA-N 488.466 6.221 5 20 JKBD COc1cc(OCC(=O)N(c2nc3ccccc3s2)c2ccccc2C(C)C)ccc1[N+](=O)[O-] 520566842 QREUXOREZMUUQD-UHFFFAOYSA-N 477.542 6.080 5 20 JKBD O=C(NC1CCN(C(=O)c2ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])cc2)CC1)C1CCCCC1 521550930 IPYSZKHCSFMEIO-UHFFFAOYSA-N 485.968 5.342 5 20 JKBD O=C(c1c2c(nc3ccccc13)/C(=C/c1ccc([N+](=O)[O-])cc1)CCC2)N1CCC(n2ccnc2)CC1 523181259 DRAPDJCCKAAGLB-DYTRJAOYSA-N 493.567 5.694 5 20 JKBD CSc1ccc(C(=O)c2ccccc2C(=O)Nc2ccccc2Br)cc1[N+](=O)[O-] 601616730 ABVZXYAWFDPXHC-UHFFFAOYSA-N 471.332 5.563 5 20 JKBD CC[C@H](C)c1ccc([C@H](NC(=O)C(=O)Nc2cccc([N+](=O)[O-])c2C)c2cccs2)cc1 603706276 WBXPKZAUTZBWGX-NYHFZMIOSA-N 451.548 5.323 5 20 JKBD CC(=O)N(c1ccc(Cl)cc1)c1nc(/C=C2/CCn3c2nc2ccc([N+](=O)[O-])cc2c3=O)cs1 603945803 PMMQZZUZCKLHLY-UVTDQMKNSA-N 493.932 5.044 5 20 JKBD O=C(Nc1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2NCc2ccccc2)cc1Cl)c1ccco1 604119981 VANBVTFWBOPYME-UHFFFAOYSA-N 490.903 5.958 5 20 JKBD O=C(c1ccc(Sc2nc3ccccc3s2)c([N+](=O)[O-])c1)N1CCC[C@H]1c1ccccn1 604345770 GSCCPSDNKIUJSB-SFHVURJKSA-N 462.556 5.728 5 20 JKBD Cc1ccc(NC(=O)c2ccc(N[C@H](C)c3ccc(NC(=O)C4CC4)cc3)c([N+](=O)[O-])c2)cc1 608972440 KEUZVJODQJQDIO-QGZVFWFLSA-N 458.518 5.677 5 20 JKBD CCOc1cc(NC(=O)N2CCO[C@H](c3ccc(Cl)c(Cl)c3)C2)c([N+](=O)[O-])cc1OCC 608993630 GICJANJKWRHCJV-FQEVSTJZSA-N 484.336 5.304 5 20 JKBD O=C(c1ccc(C(=O)N2CCC[C@@H]2c2cccs2)c([N+](=O)[O-])c1)N1CCC[C@H]1c1cccs1 609043746 PUEFHFAAJDWVNN-RBUKOAKNSA-N 481.599 5.672 5 20 JKBD Cc1ccc[n+](/C(C(=S)N[C@H](C)c2ccc(Cl)cc2Cl)=C(/O)c2ccc([N+](=O)[O-])cc2)c1 726570732 RRDARKSISDNHQV-OAHLLOKOSA-O 489.404 6.060 5 20 JKBD Cc1cc[n+](/C(C(=S)NCCc2ccc(Cl)cc2Cl)=C(/O)c2cccc([N+](=O)[O-])c2)cc1 726572555 ASSHWZMMXFEEPI-UHFFFAOYSA-O 489.404 5.541 5 20 JKBD O=C(Nc1nc2ccccc2n1Cc1cccc(C(F)(F)F)c1)c1cc(F)ccc1[N+](=O)[O-] 727999073 JOLCFWRSGLSNCT-UHFFFAOYSA-N 458.371 5.403 5 20 JKBD CCOc1cc([C@@H](C[N+](=O)[O-])c2c[nH]c3ccccc23)ccc1OS(=O)(=O)Cc1ccccc1F 728056649 IZSFDJZIBCUPKA-OAQYLSRUSA-N 498.532 5.023 5 20 JKBD CC(C)N(Cc1nnc(-c2cccc([N+](=O)[O-])c2)o1)C(=O)C[C@H](c1ccccc1)C(F)(F)F 728458947 GQXGFASBXBFIGE-GOSISDBHSA-N 462.428 5.118 5 20 JKBD Cc1oc(-c2ccco2)nc1CC(=O)O[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1 750188959 BDEJMGIZOOLVAK-QFIPXVFZSA-N 495.875 5.270 5 20 JKBD Cc1c(Br)cc(-c2nc(-c3cccnc3Oc3ccccc3)no2)cc1[N+](=O)[O-] 904453318 RTNLZXPRJNULHW-UHFFFAOYSA-N 453.252 5.570 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Cl)[C@H](Nc1ccc(OC(F)F)c(F)c1)c1ccccc1 917939577 ZGLXRDWHDCLHCU-LJQANCHMSA-N 465.815 5.781 5 20 JKBD COc1cc(C(=O)N(Cc2ccccc2[N+](=O)[O-])CC(F)(F)F)ccc1OCc1ccccc1 918612085 KSMGOTLRSJLVAU-UHFFFAOYSA-N 474.435 5.387 5 20 JKBD Cc1nn(Cc2ccc(C(=O)NC3CCN(c4ccc(C(C)(C)C)cc4)CC3)cc2)c(C)c1[N+](=O)[O-] 919767569 IFLGLRIKTKZRLJ-UHFFFAOYSA-N 489.620 5.153 5 20 JKBD Cc1ccccc1-n1c(-c2cccnc2)nn(CN(Cc2ccc([N+](=O)[O-])cc2)C(C)C)c1=S 919950183 HLSUOMKOCQSMBR-UHFFFAOYSA-N 474.590 5.550 5 20 JKBD C[C@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)OCc1coc(-c2ccc(Br)cc2)n1 920499825 XOPPOFGHEXZURK-LBPRGKRZSA-N 463.309 5.236 5 20 JKBD C[C@H](Nc1ccc(C(=O)OCc2coc(-c3ccc(Cl)cc3)n2)cc1[N+](=O)[O-])c1ccccn1 920549084 VJGFNJUQOONUON-HNNXBMFYSA-N 478.892 5.828 5 20 JKBD O=C(/C=C/c1ccc([N+](=O)[O-])o1)Nc1ccc(C2(NC(=O)c3ccnc4ccccc34)CCC2)cc1 1786204422 GXRLKXGHBHCVNI-ZRDIBKRKSA-N 482.496 5.197 5 20 JKBD COc1cc(C(=O)NC2(c3ccc(NC(=O)CCCC(F)(F)F)cc3)CCC2)ccc1[N+](=O)[O-] 1786620959 CGUVZGUMBCSWSQ-UHFFFAOYSA-N 479.455 5.084 5 20 JKBD CN(C)c1ccc([N+](=O)[O-])c(C(=O)Nc2ccc(C3(NC(=O)CCc4ccsc4)CCC3)cc2)c1 1790055675 JJFXQUSSFUYWPF-UHFFFAOYSA-N 492.601 5.103 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)[C@@H]3CCC[C@H]4CCCC[C@@H]43)CCC2)cc1)c1ccc([N+](=O)[O-])[nH]1 1790185446 AAVQKWXEGPNFPJ-JRGCBEDISA-N 464.566 5.277 5 20 JKBD Cc1c(Br)cc(C(=O)Nc2ccc(C3(NC(=O)c4ccco4)CCC3)cc2)cc1[N+](=O)[O-] 1790816706 ZZHYDIMSGCSDIJ-UHFFFAOYSA-N 498.333 5.320 5 20 JKBD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)Cc1ccc(Cl)cc1[N+](=O)[O-])c1c(Cl)cccc1Cl 1793078806 BAGRTUOGUSMSIC-MUJYYYPQSA-N 496.778 5.050 5 20 JKBD C/C(=C\c1ccc(C)o1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CCCc1cc(C)c(F)cc1[N+](=O)[O-])C2 1798529470 YLUDRYACPZHHES-NQXDOIETSA-N 497.567 5.008 5 20 JKBD C[C@@H](C(=O)N1CCCC2(CCN(C(=O)CCc3cccc([N+](=O)[O-])c3)CC2)C1)c1ccc(Cl)cc1 1805193087 ZAFWEJOSWIYHEL-HXUWFJFHSA-N 498.023 5.216 5 20 JKBD O=C(c1cccs1)N1CCCC2(CCN(C(=O)c3cc4cc([N+](=O)[O-])ccc4s3)CC2)C1 1808069514 ATHDWPHTLABOBP-UHFFFAOYSA-N 469.588 5.030 5 20 JKBD O=C(CCc1ccccc1Cl)N1CCC([C@H]2CCCCN2C(=O)Cc2cccc([N+](=O)[O-])c2)CC1 1823678299 JHYXHWMXZGAVRF-RUZDIDTESA-N 498.023 5.043 5 20 JKBD Cc1ccc(C(=O)N2CCC([C@H]3CCCCN3C(=O)Cc3ccc(Cl)cc3[N+](=O)[O-])CC2)s1 1824159542 AIPOQQRHCXQKDE-HXUWFJFHSA-N 490.025 5.094 5 20 JKBD C[C@@H]1CCC[C@H]1C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)CC1 1828485973 DZGRXZSJROHZCA-YHYVQYDKSA-N 483.634 5.479 5 20 JKBD O=C(c1ccc([N+](=O)[O-])cc1F)N1CCCC[C@@H]1C1CCN(C(=O)C2(c3ccccc3)CCC2)CC1 1830498475 WOTOXQKBQYLVHZ-RUZDIDTESA-N 493.579 5.089 5 20 JKBD C[C@@H](CC(=O)N1CCC([C@H]2CCCCN2C(=O)c2cccc(F)c2[N+](=O)[O-])CC1)c1ccccc1 1830623467 VEPZITLCLZYRKH-YADARESESA-N 481.568 5.161 5 20 JKBD C[C@H](OC(=O)c1cc2c(s1)-c1ccccc1OC2)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl 9816412 OLXQLZWYOKTYFQ-NSHDSACASA-N 458.879 5.053 5 20 JKBD C[C@H](OC(=O)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1)c1nnc(-c2cccs2)o1 17716544 QEJXVJGODKOSLD-LBPRGKRZSA-N 471.878 6.070 5 20 JKBD CC(C)N(Cc1nnc(-c2cccc([N+](=O)[O-])c2)o1)C(=S)NCCSc1ccc(Cl)cc1 18143028 PRNFTSSJLLRHPH-UHFFFAOYSA-N 492.026 5.175 5 20 JKBD O=C(COC(=O)CSc1ccc2ccccc2c1)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 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O=C(Nc1ccc(F)c(-c2nnc3n2CCCCC3)c1)c1csc(-c2cccc([N+](=O)[O-])c2)n1 303075441 ZAEHWIINDWEDAI-UHFFFAOYSA-N 478.509 5.095 5 20 JKBD Cc1cc([C@@H]2CCCN2C(=O)c2ccc(Sc3nc4ccccc4s3)c([N+](=O)[O-])c2)on1 481601717 YMJWQYWOMCYWOY-INIZCTEOSA-N 466.544 5.629 5 20 JKBD O=C(c1csc(-c2ccc([N+](=O)[O-])cc2)n1)N(C[C@@H]1CCCO1)c1nc2ccccc2s1 496411806 OPOSEKZNWDRCTH-INIZCTEOSA-N 466.544 5.154 5 20 JKBD COc1cc(C(=O)Nc2ccc(CN3CCCC[C@H]3C)cc2)c([N+](=O)[O-])cc1OCc1cscn1 503162292 ROHXPRFARVENNX-QGZVFWFLSA-N 496.589 5.266 5 20 JKBD C[C@H]1Cc2cc([N+](=O)[O-])ccc2N1C(=O)c1cc(-c2ccc(F)cc2)nc2onc(C3CC3)c12 504376593 NSOZNGSWGZGUBU-ZDUSSCGKSA-N 458.449 5.406 5 20 JKBD O=C(Nc1ccc(NC(=O)c2cc(OCC(F)(F)F)ccc2[N+](=O)[O-])cc1)c1ccc(Cl)cc1 507606276 OWIAUNOAENBWIZ-UHFFFAOYSA-N 493.825 5.694 5 20 JKBD COc1ccc(Br)c(CNCc2ccc(OC)c(OCc3ccc([N+](=O)[O-])cc3)c2)c1 507914437 QDGXBPPLHWTLEB-UHFFFAOYSA-N 487.350 5.243 5 20 JKBD Cn1ncc2c1CCC[C@H]2NC(=O)C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1 512787316 HRZGCUAQISLDBI-XMJIKXADSA-N 473.558 5.063 5 20 JKBD C[C@H](Nc1ccc(C(=O)Nc2ccc(-c3cn4ccccc4n3)cc2)cc1[N+](=O)[O-])c1ccccn1 518394933 GACMRZBUYYOVIS-SFHVURJKSA-N 478.512 5.730 5 20 JKBD COCCN(C(=O)c1csc(-c2ccc(C)cc2C)n1)c1nc(-c2ccc([N+](=O)[O-])cc2)cs1 520079181 DMGUKSLLJPATAS-UHFFFAOYSA-N 494.598 5.752 5 20 JKBD Cc1ccc(-c2nc(CCNC(=O)c3ccc(N[C@@H](C)c4ccccn4)c([N+](=O)[O-])c3)co2)cc1 522578340 HFNDWVYSZHJLFZ-SFHVURJKSA-N 471.517 5.099 5 20 JKBD O=C(Nc1cc([N+](=O)[O-])ccc1OC(F)F)N1CCC[C@H](c2nc(-c3ccc(Cl)cc3)no2)C1 524003702 YEVJEVOWMPELAK-ZDUSSCGKSA-N 493.854 5.311 5 20 JKBD C[C@H](c1ccccc1F)N(C)C(=O)c1ccc(C(=O)N(C)[C@H](C)c2ccccc2F)c([N+](=O)[O-])c1 524353037 HWCIVJJZMFEDJS-IAGOWNOFSA-N 481.499 5.539 5 20 JKBD Cc1cc(C)c(S(=O)(=O)Nc2cc(C(=O)Nc3cc([N+](=O)[O-])ccc3C)ccc2C)c(C)c1 603479429 CXLDLOWPODDAGB-UHFFFAOYSA-N 467.547 5.190 5 20 JKBD C[C@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)N[C@H](C)c1ccc(NC(=O)Nc2ccccc2)cc1 604446126 DVIMBDKVJDYGIF-CVEARBPZSA-N 482.924 5.537 5 20 JKBD O=C(Nc1cnn(Cc2ccccn2)c1)c1cc([N+](=O)[O-])ccc1Sc1ccc(Cl)cc1 604549043 WLYHYLTVMFFYET-UHFFFAOYSA-N 465.922 5.292 5 20 JKBD CCOc1cc(NC(=O)CCc2nc3cc(C(F)(F)F)ccc3s2)c([N+](=O)[O-])cc1OCC 609328071 YKHGAJBCLWYGDV-UHFFFAOYSA-N 483.468 5.592 5 20 JKBD COc1cc(CSc2nnc(Cc3cccs3)n2C2CC2)c([N+](=O)[O-])cc1OC(F)F 619268314 ACGRXTITNXCVCF-UHFFFAOYSA-N 468.507 5.076 5 20 JKBD Cn1cnc([N+](=O)[O-])c1Sc1nnc(-c2ccc(Br)cc2)n1C1CCCCC1 619671916 RSKHQZDCSDPZBU-UHFFFAOYSA-N 463.361 5.006 5 20 JKBD CC(=O)N(c1nc(COC(=O)c2cc(F)ccc2[N+](=O)[O-])cs1)c1c(C)cc(C)cc1C 743197335 JNFHRADFJMIVRQ-UHFFFAOYSA-N 457.483 5.157 5 20 JKBD C[C@@H](OC(=O)c1csc(-c2cccc([N+](=O)[O-])c2)n1)C(=O)N(c1nccs1)C1CCCCC1 747960713 AHFBJIIPRBGDAT-CQSZACIVSA-N 486.575 5.086 5 20 JKBD COc1ccc(-c2ccc(/C=C(/Cl)c3nnc(C(=O)NCc4ccccc4)s3)o2)c([N+](=O)[O-])c1 797269745 QJGKGDUERQHROH-WOJGMQOQSA-N 496.932 5.382 5 20 JKBD Cc1ccc([N+](=O)[O-])cc1NC(=O)COC(=O)Cc1c(C)nc2ccccc2c1-c1ccccc1 800367438 HUIWRXDJIGNCKB-UHFFFAOYSA-N 469.497 5.151 5 20 JKBD C[C@H](Oc1cccc(Cl)c1Cl)C(=O)O[C@H](C)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 915496602 XPWYFKMTAIKYMP-MNOVXSKESA-N 452.250 5.023 5 20 JKBD CCOC(=O)Nc1ccc(NC(=O)C2CCN(c3ccc(C(F)(F)F)cc3[N+](=O)[O-])CC2)cc1 916069347 DMTIPGXHNAIOQO-UHFFFAOYSA-N 480.443 5.037 5 20 JKBD COc1ccc(N2C(=S)N[C@H](c3cccs3)C(C(=O)Nc3cccc([N+](=O)[O-])c3)=C2C)cc1 916168313 KYFFPHXYQPCQKZ-OAQYLSRUSA-N 480.571 5.013 5 20 JKBD CN(Cc1ccccc1[N+](=O)[O-])C(=O)c1cc(-c2ccncc2)nc2ccc(Br)cc12 919813801 PXVDEQOZFQCLGG-UHFFFAOYSA-N 477.318 5.240 5 20 JKBD CCCc1cc[n+](/C(C(=S)Nc2ccc3c(c2)CCC3)=C(/O)c2ccc(C)c([N+](=O)[O-])c2)cc1 920394912 AHQMWFOSSFPAAN-UHFFFAOYSA-O 474.606 5.955 5 20 JKBD COc1ccc(C)cc1NC(=O)[C@@H](OC(=O)[C@@H](C)Oc1ccc(Cl)cc1[N+](=O)[O-])c1ccccc1 920778132 IILWPDIYVDOLTK-MWTRTKDXSA-N 498.919 5.256 5 20 JKBD O=C(CCc1cccc([N+](=O)[O-])c1)Nc1ccc(C2(NC(=O)Cc3noc4ccccc34)CCC2)cc1 1786599859 BOSFAYVGQXTYPE-UHFFFAOYSA-N 498.539 5.045 5 20 JKBD CCOc1cccc(C(=O)Nc2ccc(C3(NC(=O)c4ccc([N+](=O)[O-])cc4F)CCC3)cc2)c1 1790342136 AAOKPDKWOBBSBR-UHFFFAOYSA-N 477.492 5.194 5 20 JKBD COc1cc(C(=O)Nc2ccc(C3(NC(=O)[C@]4(C)CC=CCC4)CCC3)cc2)cc([N+](=O)[O-])c1OC 1790812692 IJILDDXZKCWEOI-AREMUKBSSA-N 493.560 5.106 5 20 JKBD CCC[C@H]1CC[C@H](C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)Cc2ccc(Cl)cc2[N+](=O)[O-])CC1 1793080738 BBVMRLILLRLAIU-UXUYGWKFSA-N 476.017 5.035 5 20 JKBD CC[C@@H](C(=O)Nc1cc([C@H]2CCCCN2C(=O)CCc2cccc([N+](=O)[O-])c2)[nH]n1)c1ccccc1 1816735891 GFFIRXPCKHOPMP-ISKFKSNPSA-N 489.576 5.137 5 20 JKBD C[C@H](C(=O)N1CCC([C@@H]2CCCCN2C(=O)Cc2cccc([N+](=O)[O-])c2)CC1)c1ccc(Cl)cc1 1823676997 MRQRZKFFVWJXGH-DFBJGRDBSA-N 498.023 5.214 5 20 JKBD C[C@@H](C(=O)N1CCCC[C@@H]1C1CCN(C(=O)/C=C/c2ccc([N+](=O)[O-])o2)CC1)c1ccc(Cl)cc1 1823972481 ZYXULBQOUGLVEE-CBXSUMEWSA-N 499.995 5.278 5 20 JKBD Cc1cc(C(=O)N2CCC([C@@H]3CCCCN3C(=O)[C@@H]3CCC[C@H]4CCCC[C@@H]43)CC2)ncc1[N+](=O)[O-] 1828459449 CTQGNOOVDRMJOB-SJHORNLWSA-N 496.652 5.138 5 20 JKBD Cc1cccc2cc(C(=O)N3CCCC[C@H]3C3CCN(C(=O)c4cc(F)cc([N+](=O)[O-])c4)CC3)[nH]c12 1828549695 SFPBSTCHBNXGOI-DEOSSOPVSA-N 492.551 5.071 5 20 JKBD CC(C)(C)CC(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cccc(Br)c2[N+](=O)[O-])CC1 1830698202 TVUOTCXNXMBYSF-IBGZPJMESA-N 494.430 5.027 5 20 JKBD COc1cc(-c2nnc(SCc3ccccc3[N+](=O)[O-])n2C2CCCCC2)cc(OC)c1OC 11020205 MYINVDNGQVVMNW-UHFFFAOYSA-N 484.578 5.677 5 20 JKBD COc1cccc([C@H]2CCCN2C(=O)C2CCN(c3ccc(C(F)(F)F)cc3[N+](=O)[O-])CC2)c1 11486980 QPAAMWJBSZCYBW-HXUWFJFHSA-N 477.483 5.202 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Br)[C@H](NCCc1cccc(F)c1)c1ccccc1 15508979 PWJFIQISRGVLNR-OAQYLSRUSA-N 472.314 5.009 5 20 JKBD COC(=O)c1sccc1NC(=O)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])c(OC)c1 15606657 JWJVOEZGMYRMHL-UHFFFAOYSA-N 462.867 5.150 5 20 JKBD CCn1c(S[C@@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)nnc1-c1ccc(C(C)(C)C)cc1 17710882 KELFENGZLAPOTD-HNNXBMFYSA-N 478.578 6.074 5 20 JKBD COc1ccc(C[C@@H](NC(=O)c2cc(SC)ccc2[N+](=O)[O-])c2ccc(OC)cc2)cc1 18232034 JOWHOAWPCIXJPS-JOCHJYFZSA-N 452.532 5.048 5 20 JKBD C[C@@H](NC[C@@H](c1ccccc1)c1c[nH]c2ccccc12)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 19623562 IKOUMIXYAAIWAZ-UZLBHIALSA-N 496.489 5.844 5 20 JKBD COc1ccc(-c2nc(CN(c3ccccc3)S(=O)(=O)c3ccc(Cl)c([N+](=O)[O-])c3)co2)cc1 22841536 UWEKFFFDXIKLTE-UHFFFAOYSA-N 499.932 5.307 5 20 JKBD O=C(N[C@H](c1ccccc1)c1ccc2nc(C(F)(F)F)[nH]c2c1)c1cc([N+](=O)[O-])ccc1Cl 23359640 XDXXZYDPTJGECB-LJQANCHMSA-N 474.826 5.663 5 20 JKBD CSc1ccc(C(=O)c2ccccc2C(=O)N(C)CCCOc2ccccc2)cc1[N+](=O)[O-] 25905300 ACLXBYXBXDYBOD-UHFFFAOYSA-N 464.543 5.089 5 20 JKBD CSCC[C@@H](NC(=O)c1cccc([N+](=O)[O-])c1)C(=O)Nc1ccc(Oc2cccc(F)c2)cc1 108567998 AUQOKXDDTMSEKY-JOCHJYFZSA-N 483.521 5.016 5 20 JKBD COc1cc(C(=O)N2CCc3sccc3[C@H]2c2cccs2)c([N+](=O)[O-])cc1OC(F)F 115379589 MWEGEASJAUUVTG-SFHVURJKSA-N 466.487 5.116 5 20 JKBD C[C@@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)N1CCC(N(C)Cc2cccc(C(F)(F)F)c2)CC1 302974792 DSIQUUUNYVPGAG-MRXNPFEDSA-N 481.540 5.217 5 20 JKBD O=C(Cn1c2ccccc2c(=O)c2ccccc21)NCc1cccc(COCc2ccccc2)c1 480347022 FIDGUTACPHKRRP-UHFFFAOYSA-N 462.549 5.188 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)NC[C@@H](c2ccccc2)c2c[nH]c3ccccc23)cc1SC 482296545 SCEKAKUGQUUICM-IBGZPJMESA-N 461.543 5.369 5 20 JKBD O=C(Cc1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1)N1CCc2[nH]c3ccccc3c2C1 491409760 MBGUHDSTWDBLPX-UHFFFAOYSA-N 477.524 5.056 5 20 JKBD Cc1csc(Sc2ccc(C(=O)Nc3ccccc3CN3C[C@@H](C)O[C@H](C)C3)cc2[N+](=O)[O-])n1 501480445 OIRVUOLIVMCPST-IAGOWNOFSA-N 498.630 5.372 5 20 JKBD O=C(c1ccc(Sc2nc3ccccc3s2)c([N+](=O)[O-])c1)N1CCC(OC2CCCC2)CC1 503316975 RWSMKXHTXAQLKV-UHFFFAOYSA-N 483.615 5.920 5 20 JKBD COc1ccc(NC(C)=O)c(NC(=O)c2ccc(NCc3ccccc3Cl)c([N+](=O)[O-])c2)c1 509840775 SVAATNAFRJKOES-UHFFFAOYSA-N 468.897 5.080 5 20 JKBD CCN(CC)C(=O)c1ccc(CNC(=O)c2cc([N+](=O)[O-])ccc2Sc2ccccc2)cc1 512459471 HSKGCAFSPPGKDW-UHFFFAOYSA-N 463.559 5.158 5 20 JKBD COCCN(C(=O)C(c1ccccc1)c1ccccc1)c1nc(-c2ccc([N+](=O)[O-])cc2)cs1 515327727 FPYVPGYJRSHKRH-UHFFFAOYSA-N 473.554 5.530 5 20 JKBD O=C(C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)NCc1cc(F)ccc1F 517833818 KYQDUZHNTKDAGX-LFIBNONCSA-N 465.481 5.730 5 20 JKBD COc1ccc(COc2cccc(F)c2)cc1NC(=O)[C@H](C)Oc1ccc(Cl)cc1[N+](=O)[O-] 520954581 PDXHKHACBLROGP-AWEZNQCLSA-N 474.872 5.381 5 20 JKBD O=C(c1ccc(Sc2nc3ccccc3s2)c([N+](=O)[O-])c1)N1CCC(N2CCCCC2)CC1 521801786 OZVQLUPVKYCJRA-UHFFFAOYSA-N 482.631 5.446 5 20 JKBD CSc1cccc(NC(=O)c2ccc(C(=O)Nc3cccc(SC)c3)c([N+](=O)[O-])c2)c1 524353116 NJVHLJPETZDRDR-UHFFFAOYSA-N 453.545 5.543 5 20 JKBD COCCN(C(=O)c1cccc(Oc2ccccc2)c1)c1nc(-c2ccc([N+](=O)[O-])cc2)cs1 603461282 KTYZCIZDUBXMPO-UHFFFAOYSA-N 475.526 5.804 5 20 JKBD O=C(C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)N(Cc1cccnc1)C1CC1 604484983 HFUONAIXRFNTFJ-XSFVSMFZSA-N 470.554 5.721 5 20 JKBD C[C@H](Nc1ccc(C(=O)NC2(c3ccc4c(c3)OCCO4)CCCC2)cc1[N+](=O)[O-])c1ccccn1 604567590 UHGYTQHWAZPIDK-SFHVURJKSA-N 488.544 5.133 5 20 JKBD C[C@H]1C[C@@H](C)CN(c2ccc(C(=O)Nc3cc(C(=O)N4CCCCC4)ccc3Cl)cc2[N+](=O)[O-])C1 608872494 HALBCNRETMEOCE-HDICACEKSA-N 499.011 5.609 5 20 JKBD COc1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2Sc2ccccc2)c(Br)c1 608900649 NVYSJILRDFPRAF-UHFFFAOYSA-N 459.321 5.769 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)O[C@H](C)c2nc(-c3cccc(C(F)(F)F)c3)no2)cc1SC 728650265 WZLYEBQZPQNBPP-SNVBAGLBSA-N 483.424 5.312 5 20 JKBD Cc1nc(-c2ccc(F)cc2)sc1[C@H](C)NC(=O)c1cc([N+](=O)[O-])ccc1Br 729659584 VUAKGCGDNSOUOW-JTQLQIEISA-N 464.316 5.419 5 20 JKBD C[C@H](OC(=O)[C@@H]1C[C@@H]1c1cccc2ccccc12)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 730872152 CBANBQYAIFJZCR-MJXNMMHHSA-N 472.419 5.441 5 20 JKBD O=C(Nc1nc(-c2ccc(OC(F)F)cc2OC(F)F)cs1)c1cc(Cl)ccc1[N+](=O)[O-] 747387412 WUUDDBAHRYZLKI-UHFFFAOYSA-N 491.806 5.827 5 20 JKBD Cc1nn(Cc2ccc(C(=O)OCc3cccc(NC(=O)c4ccccc4)c3)cc2)c(C)c1[N+](=O)[O-] 750427599 GJNGYPCXQLWVBL-UHFFFAOYSA-N 484.512 5.066 5 20 JKBD CN(Cc1cc([N+](=O)[O-])ccc1Cl)C(=O)Cc1csc(COc2ccc(Cl)cc2)n1 758866565 SJOVAXSVPFBZJA-UHFFFAOYSA-N 466.346 5.138 5 20 JKBD O=c1cc(-c2ccc([N+](=O)[O-])cc2)c2ccc(Oc3cc(-c4ccccc4)nc4ncnn34)cc2o1 883999529 IFUYTYGTMFDDHV-UHFFFAOYSA-N 477.436 5.265 5 20 JKBD CC(C)(C)OC(=O)NC(C)(C)c1noc(C2CCN(c3ccc(C(F)(F)F)cc3[N+](=O)[O-])CC2)n1 904761698 HWGDBYAMQXHICJ-UHFFFAOYSA-N 499.490 5.140 5 20 JKBD O=C(O[C@H](c1ccccc1)c1ccccn1)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 912906320 BMUCQGACRWYWEX-HSZRJFAPSA-N 485.462 5.558 5 20 JKBD Cc1cc(C)cc(OCCC(=O)Oc2ccc(NC(=O)c3cc([N+](=O)[O-])ccc3Cl)cc2)c1 912984799 SABLHKFGVAARDW-UHFFFAOYSA-N 468.893 5.492 5 20 JKBD CC(C)[C@@H](OC(=O)Cn1c2ccccc2c(=O)c2ccccc21)C(=O)Nc1ccccc1Cl 915385419 XSWSLDQDXALPRV-RUZDIDTESA-N 462.933 5.015 5 20 JKBD CCN1C(=S)N[C@H](c2ccc(Cl)c([N+](=O)[O-])c2)C(C(=O)Nc2ccccc2C(F)(F)F)=C1C 916164390 ZRBSNDYRPLABEB-GOSISDBHSA-N 498.914 5.431 5 20 JKBD COc1ccc(-c2nc(COC(=O)c3ccc(N[C@@H](C)c4ccccn4)c([N+](=O)[O-])c3)cs2)cc1 920548223 ROOTXKUPIDPZEB-INIZCTEOSA-N 490.541 5.652 5 20 JKBD COc1ccc([C@@H](C)C(=O)NC2(c3ccc(NC(=O)/C=C/c4ccc([N+](=O)[O-])o4)cc3)CCC2)cc1 1786205572 HSFAGYPKPVCTTG-QIXNEVBVSA-N 489.528 5.147 5 20 JKBD CC(C)(C)c1ncccc1C(=O)Nc1ccc(C2(NC(=O)c3ccc(O)c([N+](=O)[O-])c3)CCC2)cc1 1788337199 YWIVVJJSKNDNCL-UHFFFAOYSA-N 488.544 5.054 5 20 JKBD CCc1oncc1C(=O)NC1(c2ccc(NC(=O)C3(c4cccc([N+](=O)[O-])c4)CCC3)cc2)CCC1 1790476064 XZKNFCHQLDUIQE-UHFFFAOYSA-N 488.544 5.015 5 20 JKBD Cc1cc[nH]c1C(=O)NC1(c2ccc(NC(=O)c3ccc(Br)c([N+](=O)[O-])c3)cc2)CCC1 1790642370 RNLKAJSICVFAQR-UHFFFAOYSA-N 497.349 5.055 5 20 JKBD O=C(NC1(c2ccc(NC(=O)[C@H]3C[C@H]3c3ccccc3)cc2)CCC1)c1nc2cc([N+](=O)[O-])ccc2[nH]1 1791533926 OMZVCLUKWYAXHW-VXKWHMMOSA-N 495.539 5.023 5 20 JKBD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)[nH]n1)c1ccccc1 1820405735 ISZVQAQCJHPWIU-IBGZPJMESA-N 475.530 5.152 5 20 JKBD O=C(CC1CCCC1)N1CCCC[C@H]1c1cc(NC(=O)C2(c3cccc([N+](=O)[O-])c3)CCC2)n[nH]1 1820841031 OETDGVXWHPLGRO-QFIPXVFZSA-N 479.581 5.012 5 20 JKBD O=C(Nc1cc([C@@H]2CCCCN2C(=O)/C=C/c2ccccc2[N+](=O)[O-])[nH]n1)c1ccccc1C1CC1 1823135036 CLBQLGGZUJXFNT-ZXYASIKESA-N 485.544 5.215 5 20 JKBD CCc1ccc(N(C(C)=O)c2nc(COC(=O)c3ccc(N4CCCC4)c([N+](=O)[O-])c3)cs2)cc1 10733612 CIGUZGSNVSFPPC-UHFFFAOYSA-N 494.573 5.256 5 20 JKBD C[C@H](OC(=O)c1nc(Cl)c(Cl)c(Cl)c1Cl)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl 12681989 OMAJCEWCIXXZGV-YFKPBYRVSA-N 487.510 5.441 5 20 JKBD COc1ccc(NC(C)=O)cc1NC(=O)c1ccc(Sc2ccc(C)cc2)c([N+](=O)[O-])c1 15982485 MGJPHNUGKJKUFU-UHFFFAOYSA-N 451.504 5.274 5 20 JKBD C[C@H](OC(=O)CSc1cc(Cl)ccc1Cl)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 17527819 DPXBMICIXHJAID-JTQLQIEISA-N 454.291 5.348 5 20 JKBD O=C(OCC(=O)N1N=C(c2cc3ccccc3o2)C[C@H]1c1ccco1)c1ccc(Cl)cc1[N+](=O)[O-] 24459352 QBCQHDGJFCPXTQ-IBGZPJMESA-N 493.859 5.122 5 20 JKBD O=C(CSc1nc2ccccc2n1C(F)F)Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1 25979874 RJVYXWWQKWNQMH-UHFFFAOYSA-N 461.475 5.194 5 20 JKBD COc1cc(NC(=O)c2ccc(NCc3ccccc3)c([N+](=O)[O-])c2)ccc1NC(=O)c1cccnc1 26236895 RBLXFZUZCISNQV-UHFFFAOYSA-N 497.511 5.115 5 20 JKBD Cc1c(Cl)cc(S(=O)(=O)N(Cc2cccnc2)c2ccc(Cl)cc2)cc1[N+](=O)[O-] 59122305 HUBYLYRZNJBJNE-UHFFFAOYSA-N 452.319 5.001 5 20 JKBD O=C(Cc1csc(-c2cccc(Br)c2)n1)Nc1ccc(Cl)c([N+](=O)[O-])c1 104845943 PBMKATGZFMCHNN-UHFFFAOYSA-N 452.717 5.315 5 20 JKBD C[C@@H](Sc1nc2sc(-c3ccccc3)cc2c(=O)n1C)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 115197436 UQQZZGPRZNGZIX-CYBMUJFWSA-N 491.554 5.474 5 20 JKBD C[C@H](Nc1ccc(C(=O)Nc2ccc(C(=O)N3CCCC[C@@H]3C)cc2)cc1[N+](=O)[O-])c1ccccn1 303007858 OCZSABKQBQGLBL-OALUTQOASA-N 487.560 5.430 5 20 JKBD C[C@@H](Nc1ccc(C(=O)NCc2ccccc2OCC(F)(F)F)cc1[N+](=O)[O-])c1ccccn1 410092359 ZCXSGTMPFVDVGO-OAHLLOKOSA-N 474.439 5.034 5 20 JKBD Cc1nn(Cc2ccc(C(=O)N3CCC(c4cccc5ccccc45)CC3)cc2)c(C)c1[N+](=O)[O-] 476155138 NZGXIQXXFHSYAF-UHFFFAOYSA-N 468.557 5.629 5 20 JKBD CCN(C(=O)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])c(OC)c1)c1ccc(OC)c(OC)c1 500914408 LHWGJHIRNAMQHU-UHFFFAOYSA-N 486.908 5.733 5 20 JKBD COc1ccc(-c2csc(NC(=O)c3ccc(N[C@H](C)c4ccccn4)c([N+](=O)[O-])c3)n2)cc1F 505983059 XUDCZLJJZDMRTP-CQSZACIVSA-N 493.520 5.686 5 20 JKBD CCOc1cc(C(=O)Nc2ccc(Cl)cc2C(=O)N2[C@H](C)CCC[C@H]2C)c([N+](=O)[O-])cc1OC 508283947 CZIDSOISJYJZHG-HUUCEWRRSA-N 489.956 5.311 5 20 JKBD COc1cc(C(=O)N(Cc2ccsc2)c2ccccc2)c([N+](=O)[O-])cc1OCc1cscn1 509158425 PKCBOSGQTKLYKE-UHFFFAOYSA-N 481.555 5.547 5 20 JKBD CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccc(NC(=O)c2ccc(Cl)cc2)cc1 509198885 ZRZINPTUIXNWMT-UHFFFAOYSA-N 466.925 5.943 5 20 JKBD CN(C(=O)c1cc([N+](=O)[O-])ccc1NCc1ccccc1)c1ccc(Br)cc1F 511489739 SQJSJBWMDMBCIW-UHFFFAOYSA-N 458.287 5.385 5 20 JKBD C[C@@H](Cc1nnc(S[C@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2C(F)(F)F)o1)c1ccccc1 514298460 PJSKZWLZOKCRJH-QWHCGFSZSA-N 480.468 5.462 5 20 JKBD Cc1ccc(C(C)C)c(Oc2ccc(CNCc3ccc(N4CCOCC4)nc3)cc2[N+](=O)[O-])c1 520953464 HHVMBWBEUPGUJA-UHFFFAOYSA-N 476.577 5.340 5 20 JKBD NC(=O)Nc1ccc(NC(=O)c2ccccc2Sc2ccc(C(F)(F)F)cc2[N+](=O)[O-])cc1 591887880 MJUZKDOWTPAXRN-UHFFFAOYSA-N 476.436 5.508 5 20 JKBD O=C(N[C@@H]1C[C@@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1)c1cc([N+](=O)[O-])ccc1Oc1ccccc1 603738253 PCIUUFPJORSZSX-WDNDVIMCSA-N 476.373 6.026 5 20 JKBD CCOC(=O)C[C@@H](c1ccccc1)C1CCN(C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)CC1 603830203 QBUJWTJHUAXKJO-IBGZPJMESA-N 459.930 5.229 5 20 JKBD C[C@@H]1CCC[C@@H](C)N1C(=O)c1cc(Cl)ccc1NC(=O)CCOc1ccccc1[N+](=O)[O-] 603959583 DIERMDGDTWLEPP-HZPDHXFCSA-N 459.930 5.059 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Cl)[C@@H](NCc1csc2ccccc12)c1ccccc1 604044783 BJFQRTLTTCFTQQ-QFIPXVFZSA-N 451.935 5.933 5 20 JKBD O=C(CC1CCN([C@@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2ccccc2)CC1)NC1CCCC1 604415765 DEXQNDRLYRNJJQ-RUZDIDTESA-N 499.011 5.089 5 20 JKBD CSc1ccc(C(=O)c2ccccc2C(=O)N2CCC(CN3CCCCCC3)CC2)cc1[N+](=O)[O-] 604437484 KUIHNUITMCABLM-UHFFFAOYSA-N 495.645 5.276 5 20 JKBD O=C(Nc1ccc(C(=O)Nc2ccc([N+](=O)[O-])cc2F)cc1)c1ccc(Br)cc1 608870620 IWKKFXXNPMKFAL-UHFFFAOYSA-N 458.243 5.001 5 20 JKBD CN(C)CCn1cc(NC(=O)c2c3c(nc4ccccc24)/C(=C/c2cccc([N+](=O)[O-])c2)CCC3)cn1 608878768 IGOOKRSWQJEQHR-HMMYKYKNSA-N 496.571 5.030 5 20 JKBD O=C(Nc1ccc(Oc2ncc(Cl)cc2Cl)cc1)c1cc([N+](=O)[O-])cc2c1OCCO2 608939237 YNLAGMIDAQJLFS-UHFFFAOYSA-N 462.245 5.112 5 20 JKBD CCOc1cccc2cc([C@@H](C)N[C@H](C)C(=O)Nc3ccc([N+](=O)[O-])cc3C(F)(F)F)oc12 610250138 DYRISNBZZVWSAK-CHWSQXEVSA-N 465.428 5.436 5 20 JKBD CCCCOc1c(Cl)cc(C(=O)Nc2cc3c(cc2[N+](=O)[O-])OCCCO3)cc1OCC 619214567 WXNBSGGDXYBZHG-UHFFFAOYSA-N 464.902 5.239 5 20 JKBD C[C@H](NCc1ccc(-c2ccc([N+](=O)[O-])cc2Br)o1)c1ccc(N2CCOC2=O)cc1 726606205 DGCWCMJWRMGAGA-AWEZNQCLSA-N 486.322 5.425 5 20 JKBD O=C(Nc1cc(Cl)c([N+](=O)[O-])cc1OCc1ccccc1)c1cnc(-c2ccccn2)s1 727661452 TUORSMKJVAHBBE-UHFFFAOYSA-N 466.906 5.598 5 20 JKBD CCOc1ccc(OC(C)(C)C(=O)Oc2ccc(NC(=O)c3cc([N+](=O)[O-])ccc3Cl)cc2)cc1 743886722 BXVYRDUUXTZMGG-UHFFFAOYSA-N 498.919 5.662 5 20 JKBD C[C@@H](OC(=O)c1csc(-c2ccc([N+](=O)[O-])cc2)n1)c1ccc(NC(=O)c2ccccc2)cc1 748016466 LPWLCVZBSOKFEV-MRXNPFEDSA-N 473.510 5.889 5 20 JKBD C[C@@H](Nc1ccc(C(=O)O[C@@H](c2ccncc2)c2ccc(F)cc2)cc1[N+](=O)[O-])c1ccccn1 748569913 AOMZYSREXHTAPU-CRICUBBOSA-N 472.476 5.643 5 20 JKBD Cc1cc(C)c(NC(=O)[C@@H](C)OC(=O)c2cc([N+](=O)[O-])ccc2Sc2nc(C)cs2)c(C)c1 849132677 NOYQIAXPZYNGLY-MRXNPFEDSA-N 485.587 5.620 5 20 JKBD CCCc1nc(C)c(C(=O)Oc2ccc(NC(=O)c3cc([N+](=O)[O-])ccc3Cl)cc2)s1 915275333 WRIWAGOMVOCAIB-UHFFFAOYSA-N 459.911 5.437 5 20 JKBD Cc1ccc([N+](=O)[O-])cc1NC(=O)C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1 916665430 FBXNMBDKCLKAKT-SFQUDFHCSA-N 474.498 5.991 5 20 JKBD O=C(O[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1)c1sccc1Br 917272928 DCERTJHDDAVMGK-MRXNPFEDSA-N 495.738 5.609 5 20 JKBD C[C@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)OCc1coc(-c2ccc(Br)cc2)n1 920777046 DKRVOMPIQKNVON-NSHDSACASA-N 481.686 5.176 5 20 JKBD CC1=CC[C@@H](C(=O)Nc2ccc(C3(NC(=O)Cc4ccc([N+](=O)[O-])cc4F)CCC3)cc2)CC1 1789113904 FDFJXXZSTOVLSE-GOSISDBHSA-N 465.525 5.157 5 20 JKBD COc1cc(C(=O)NC2(c3ccc(NC(=O)[C@H]4CC=C(C)CC4)cc3)CCC2)ccc1[N+](=O)[O-] 1789113937 GPIQDCCMSZNJPF-SFHVURJKSA-N 463.534 5.098 5 20 JKBD O=C(/C=C/c1ccccc1[N+](=O)[O-])Nc1ccc(C2(NC(=O)c3onc4ccccc34)CCC2)cc1 1792317453 RQQRPVQLYONTMY-XNTDXEJSSA-N 482.496 5.197 5 20 JKBD CCC[C@H]1CC[C@H](C(=O)N2CCC([C@@H]3CCCCN3C(=O)/C=C/c3ccc([N+](=O)[O-])o3)CC2)CC1 1824279347 UISFFDZUZLXBBR-MEVZXMIGSA-N 485.625 5.427 5 20 JKBD Cc1cscc1C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)CC1 1827809245 OCKIOIOLFBRRMT-NRFANRHFSA-N 497.642 5.727 5 20 JKBD CC1=CC[C@H](C(=O)N2CCCC[C@H]2C2CCN(C(=O)c3cc4cc([N+](=O)[O-])ccc4s3)CC2)CC1 1828352281 KBSVVBZTEQLWEW-REWPJTCUSA-N 495.645 5.789 5 20 JKBD CCC(C)(C)C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cc(Br)ccc2[N+](=O)[O-])CC1 1830563656 GCZABNBITJVACY-LJQANCHMSA-N 494.430 5.027 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)N1CCCC[C@H]1C1CCN(C(=O)CCC2CCCC2)CC1 1830728671 BKYUZWMODNVHQJ-QHCPKHFHSA-N 473.589 5.246 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)N1CCCC[C@@H]1C1CCN(C(=O)C2CCC(F)(F)CC2)CC1 1830729125 AYIUNLLSFCULRV-OAQYLSRUSA-N 495.542 5.101 5 20 JKBD Cc1c(C(=O)N2CCCC[C@H]2C2CCN(C(=O)c3ccc(Cl)o3)CC2)cc(Cl)cc1[N+](=O)[O-] 1830736160 RTRPBPNQGUUNDM-SFHVURJKSA-N 494.375 5.350 5 20 JKBD Cc1ccc(S/C=C/C(=O)N2CC3(CCCN3C(=O)c3cc4cc([N+](=O)[O-])ccc4s3)C2)cc1 1845739108 LRWAJTRZFDCWDN-FMIVXFBMSA-N 493.610 5.241 5 20 JKBD O=C(O[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1)c1ccc2ncsc2c1 8937356 SGRPJESSDRNETJ-FQEVSTJZSA-N 467.890 5.395 5 20 JKBD CC(C)c1noc2ncc(C(=O)Oc3ccc(NC(=O)c4cc([N+](=O)[O-])ccc4Cl)cc3)cc12 9675315 WPEDSDIXAQMZRK-UHFFFAOYSA-N 480.864 5.379 5 20 JKBD O=C(Cn1c2ccccc2c(=O)c2ccccc21)OCc1csc(-c2ccc(Cl)cc2)n1 11277811 VDDVHVLXJWATAH-UHFFFAOYSA-N 460.942 5.675 5 20 JKBD Cc1c(NC(=O)c2ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])cc2)c(=O)n(-c2ccccc2)n1C 15269179 SLIWVLBOQNEQRB-UHFFFAOYSA-N 478.892 5.091 5 20 JKBD C[C@H](OC(=O)c1ccc(NCc2ccccc2Cl)c([N+](=O)[O-])c1)C(=O)Nc1c(F)cccc1F 16868761 HSGJSPRNCWTYBN-ZDUSSCGKSA-N 489.862 5.323 5 20 JKBD C[C@@H](Sc1nnc(-c2ccc(F)cc2)n1Cc1ccccc1)C(=O)Nc1ccccc1[N+](=O)[O-] 21743534 XJVWJSRAGPBJQV-MRXNPFEDSA-N 477.521 5.160 5 20 JKBD O=C(O)C/C(=C/c1ccc(-c2ccc([N+](=O)[O-])cc2Br)o1)c1nc2ccccc2o1 25126572 YRICNLSWGQEUSU-XFXZXTDPSA-N 469.247 5.774 5 20 JKBD Cc1cc([N+](=O)[O-])ccc1NC(=O)CCSc1nnc(-c2cccs2)n1Cc1ccccc1 26220890 QYFYTYKTYVGDIC-UHFFFAOYSA-N 479.587 5.392 5 20 JKBD Cc1ccc(-c2nnc3n2CCCCC3)cc1NC(=O)c1ccc(NCc2ccccc2)c([N+](=O)[O-])c1 27630760 JJOZYGYZRUJAMW-UHFFFAOYSA-N 496.571 5.753 5 20 JKBD COc1cc(C(=O)NCCCCc2nc(C)cs2)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 110625265 JBBSHXJOLJRCIB-UHFFFAOYSA-N 475.954 5.567 5 20 JKBD Cc1nn(Cc2ccc(C(=O)Nc3ccccc3NC(=O)C[C@@H]3C=CCC3)cc2)c(C)c1[N+](=O)[O-] 409980705 PTCUOJNRVJOFDI-LJQANCHMSA-N 473.533 5.004 5 20 JKBD CCCOc1ccc(-c2csc(NC(=O)c3cc(SC)c(OC)cc3[N+](=O)[O-])n2)cc1 482221810 PDDDNRIEIWLMSA-UHFFFAOYSA-N 459.549 5.490 5 20 JKBD O=C(Nc1nnc2ccccn12)c1ccccc1Sc1ccc(C(F)(F)F)cc1[N+](=O)[O-] 487416121 BLNVBJSSLRMFFO-UHFFFAOYSA-N 459.409 5.060 5 20 JKBD O=C(CCCNc1ccc([N+](=O)[O-])cc1)Nc1ccc(Cl)c(C(=O)NC2CCCCC2)c1 490845928 ROWLZGAGGHAGFF-UHFFFAOYSA-N 458.946 5.142 5 20 JKBD O=C(Nc1cnccc1Oc1ccccc1)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 499621922 LUZRUWJMNFWSRD-UHFFFAOYSA-N 486.450 5.656 5 20 JKBD CCOc1ccc([C@@H](C)NC(=O)c2ccc(N[C@@H](C)c3ccccn3)c([N+](=O)[O-])c2)cc1OC 506244444 AUIRTCVJNMVNLX-SJORKVTESA-N 464.522 5.061 5 20 JKBD CCCN(C(=O)c1cc(OC)c(OCc2cscn2)cc1[N+](=O)[O-])[C@@H]1CCc2ccccc2C1 511383727 OKRYZOURBGPIAH-HXUWFJFHSA-N 481.574 5.049 5 20 JKBD COc1ccc([N+](=O)[O-])cc1NC(=O)c1ccccc1Sc1ccc(Br)cn1 516069227 HHECKGZDTJSZCN-UHFFFAOYSA-N 460.309 5.164 5 20 JKBD C[C@@H](Nc1ccc(C(=O)Nc2nnc(SCc3cccs3)s2)cc1[N+](=O)[O-])c1ccccn1 518627891 PXMYRIMYEBPPST-CYBMUJFWSA-N 498.615 5.621 5 20 JKBD O=C(CCn1cc([N+](=O)[O-])cn1)N(c1ccc(Oc2ccccc2)cc1)c1nc2ccccc2s1 520922953 DRKQHNHTGAVZTG-UHFFFAOYSA-N 485.525 5.948 5 20 JKBD COc1cc(C(=O)Nc2ccc(OCc3ccccn3)c(Cl)c2)c([N+](=O)[O-])cc1OC(F)F 521550307 IKGQYMGUPFXUGH-UHFFFAOYSA-N 479.823 5.085 5 20 JKBD COc1cc([C@@H](C)NCc2ccc(-c3ccccc3[N+](=O)[O-])o2)ccc1OCc1ccncc1 608836258 VWGPKLYGAKUKOD-GOSISDBHSA-N 459.502 5.688 5 20 JKBD O=C(c1csc(-c2cccc([N+](=O)[O-])c2)n1)N(CCc1ccccn1)Cc1ccc(F)cc1 608880519 FATKCZWJADGKIQ-UHFFFAOYSA-N 462.506 5.138 5 20 JKBD COc1cc(C(=O)N2C[C@@H](c3ccccc3)OC[C@H]2C)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 608966338 IXMKDHFJUQAVDD-GYCJOSAFSA-N 482.920 5.651 5 20 JKBD C[C@@H](Nc1ccc(NC(=O)c2cc3c(cc2[N+](=O)[O-])OCCO3)cc1Cl)c1ccccc1 609072157 JTCCJHMVDNCUMM-CQSZACIVSA-N 453.882 5.445 5 20 JKBD C[C@H](Sc1nc2cc3ccccc3cc2c(=O)n1C)C(=O)N[C@H](C)c1cc2ccccc2o1 622146055 HPVHJTXOJNRAQQ-CVEARBPZSA-N 457.555 5.191 5 20 JKBD O=C(Nc1ccccc1C(=O)NCc1cc(-c2ccccc2)on1)c1ccc([N+](=O)[O-])cc1Cl 726776215 BOYBAZIXGQSECR-UHFFFAOYSA-N 476.876 5.086 5 20 JKBD CCC(=O)Nc1ccc(C)c(NC(=O)CCC(=O)c2ccc3ccc4cccc5ccc2c3c45)c1 727767151 SJVFXANCRWPRGF-UHFFFAOYSA-N 462.549 6.843 5 20 JKBD Cc1cccc(-c2nnc(-c3ccc(C(=O)OCC4CCN(c5ncccc5[N+](=O)[O-])CC4)cc3)o2)c1 729194251 YPUMHCHIGPWKRL-UHFFFAOYSA-N 499.527 5.089 5 20 JKBD COc1ccc(Nc2nc(COC(=O)c3csc(-c4cccc([N+](=O)[O-])c4)n3)cs2)cc1 747956366 RPLHJRDKAUDIEA-UHFFFAOYSA-N 468.516 5.284 5 20 JKBD C[C@@H](OC(=O)Cn1c2ccccc2c(=O)c2ccccc21)c1ccccc1NC(=O)c1ccccc1 748021107 SOMFKMFHGKZPIZ-HXUWFJFHSA-N 476.532 5.711 5 20 JKBD O=C(Cc1c[nH]c2cc(F)ccc12)Oc1ccc2c(-c3ccc([N+](=O)[O-])cc3)cc(=O)oc2c1 751055240 QZYBNHPXNLNYHQ-UHFFFAOYSA-N 458.401 5.137 5 20 JKBD CC[C@H](C)n1ncc2c(C(=O)Oc3ccc(NC(=O)c4cccc([N+](=O)[O-])c4)cc3)cc(C)nc21 751055530 VKZXUPIPWMAOGR-INIZCTEOSA-N 473.489 5.090 5 20 JKBD O=C(CSc1nnc(-c2cccs2)n1Cc1ccccc1)Nc1cc(Cl)ccc1[N+](=O)[O-] 764241023 NBKZWLHXFSQEJH-UHFFFAOYSA-N 485.978 5.347 5 20 JKBD Cc1ccc(Oc2ccccc2NC(=O)COC(=O)C2CCN(c3ccccc3[N+](=O)[O-])CC2)cc1 802640742 MOPOHVNECVZNCS-UHFFFAOYSA-N 489.528 5.094 5 20 JKBD C[C@H](c1nn(CN(C)Cc2cc([N+](=O)[O-])ccc2Cl)c(=S)n1-c1ccc(Cl)cc1)N(C)C 813202873 QUERFLWPLRTERL-CQSZACIVSA-N 495.436 5.330 5 20 JKBD Cc1ccc([N+](=O)[O-])cc1NC(=O)CSc1nn(-c2ccc(Cl)cc2)c(=S)s1 819915599 KVZPUBPGTNNOJC-UHFFFAOYSA-N 452.970 5.264 5 20 JKBD CC(C)[C@H](OC(=O)[C@@H](C)Sc1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccccc1C(F)(F)F 915371053 MWFJLRNJWDSPTC-ACJLOTCBSA-N 470.469 5.301 5 20 JKBD CC(C)N(Cc1nnc(-c2cccc([N+](=O)[O-])c2)o1)C(=O)[C@@H](C)Oc1cccc(C(C)(C)C)c1 916036339 KCSXZEWYGPAKTK-QGZVFWFLSA-N 466.538 5.147 5 20 JKBD CC(=O)N(c1ccc(C(F)(F)F)cc1)c1nc(COC(=O)c2cc([N+](=O)[O-])ccc2F)cs1 920528809 AORVRCXQLKNVGX-UHFFFAOYSA-N 483.399 5.251 5 20 JKBD CN(C)c1ccc([N+](=O)[O-])c(C(=O)NC2(c3ccc(NC(=O)C4(F)CCCCC4)cc3)CCC2)c1 1789161048 GZQGQFRFOXOTSE-UHFFFAOYSA-N 482.556 5.081 5 20 JKBD CN(C)c1ccc([N+](=O)[O-])c(C(=O)Nc2ccc(C3(NC(=O)[C@]4(F)CCCC=C4F)CCC3)cc2)c1 1790056046 BOOWYMDNGFKAID-SANMLTNESA-N 498.530 5.154 5 20 JKBD Cc1oc(C(C)(C)C)cc1C(=O)NC1(c2ccc(NC(=O)c3ccc([N+](=O)[O-])[nH]3)cc2)CCC1 1790184559 VYLUKUSLQTUODP-UHFFFAOYSA-N 464.522 5.183 5 20 JKBD COc1ccc(CC(=O)Nc2ccc(C3(NC(=O)/C=C/c4cccs4)CCC3)cc2)c([N+](=O)[O-])c1 1790571297 OLEHSHNFQKFRHK-VAWYXSNFSA-N 491.569 5.055 5 20 JKBD O=C(CSc1ccccc1[N+](=O)[O-])Nc1ccc(C2(NC(=O)CCC3CCC3)CCC2)cc1 1791521573 YOLRDNWOUQTJTM-UHFFFAOYSA-N 467.591 5.401 5 20 JKBD Cc1ccc(CC(=O)N2CCC([C@H]3CCCCN3C(=O)c3c[nH]c(C(C)(C)C)c3)CC2)cc1[N+](=O)[O-] 1825439526 QNFKWCXHEJSYGG-HSZRJFAPSA-N 494.636 5.005 5 20 JKBD Cc1c(C(=O)N2CCC([C@@H]3CCCCN3C(=O)Cc3ccsc3)CC2)cc(Cl)cc1[N+](=O)[O-] 1827166846 OHRAFIJWOWDHOG-NRFANRHFSA-N 490.025 5.094 5 20 JKBD Cc1cccc2[nH]c(C(=O)N3CCCC[C@H]3C3CCN(C(=O)c4cccc(F)c4[N+](=O)[O-])CC3)cc12 1828577648 NRGFIPSIVNKEBI-DEOSSOPVSA-N 492.551 5.071 5 20 JKBD O=C(CCc1cccc([N+](=O)[O-])c1)N1CCC([C@H]2CCCCN2C(=O)c2cc3sccc3[nH]2)CC1 1828708578 GFJABPXMEYCYIG-HSZRJFAPSA-N 494.617 5.004 5 20 JKBD O=C(/C=C/C1CCCCC1)N1CCC([C@@H]2CCCCN2C(=O)CSc2ccccc2[N+](=O)[O-])CC1 1831777123 FGHJCJCDVYZNSU-ZVQQDINOSA-N 499.677 5.443 5 20 JKBD C[C@@H](Sc1nnc(-c2ccccc2)n1-c1ccc(F)cc1)C(=O)Nc1ccccc1[N+](=O)[O-] 10212687 WMGWMLDVWUJHPK-OAHLLOKOSA-N 463.494 5.101 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Cl)[C@@H](NCc1ccccc1CN1CCCCC1)c1ccccc1 15507401 RTLJURNXHOQEOO-SANMLTNESA-N 493.007 5.704 5 20 JKBD C[C@@H](Sc1nnc(-c2ccccc2F)n1C1CC1)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 17663680 KXZLDHZVPKXXAX-GFCCVEGCSA-N 452.471 5.231 5 20 JKBD C[C@H](Sc1nnc(-c2ccco2)n1-c1ccccc1)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 17664930 KIAFDICXRBYLHF-AWEZNQCLSA-N 460.475 5.339 5 20 JKBD CN(Cc1ccc(Cl)s1)C(=O)Cc1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1 20911323 NXFBABBGNUUVIA-UHFFFAOYSA-N 466.950 5.364 5 20 JKBD Cc1c(NC(=O)[C@@H](C)Sc2nnc(-c3ccc(F)cc3)c3ccccc23)cccc1[N+](=O)[O-] 21860533 OBDUDYSKHOHOCB-OAHLLOKOSA-N 462.506 5.772 5 20 JKBD O=[N+]([O-])c1cccc(-c2noc(CN3CCC(c4nc5cc(Cl)ccc5s4)CC3)n2)c1 25946507 VJOUPAMGBMGCNY-UHFFFAOYSA-N 455.927 5.288 5 20 JKBD COc1cc(C(=O)Nc2ccc(SCc3cccnc3)cc2)c([N+](=O)[O-])cc1OC(F)F 27120950 QPCZYRFEPSVRDD-UHFFFAOYSA-N 461.446 5.144 5 20 JKBD CC(C)N(CCNC(=O)C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)C(C)C 32245126 WMXCSWNZKUZTLF-HKWRFOASSA-N 466.607 5.370 5 20 JKBD COc1cc(C(=O)NCc2ccccc2Oc2ccccc2)c([N+](=O)[O-])cc1OCc1cscn1 68788117 ZXRVHYJGGDFCMZ-UHFFFAOYSA-N 491.525 5.361 5 20 JKBD C[C@H](NC(=O)Cn1c2ccccc2c(=O)c2ccccc21)c1cccc(NC(=O)c2ccccc2)c1 71898868 JTXHTAIBHBMODH-FQEVSTJZSA-N 475.548 5.284 5 20 JKBD CC(C)c1sc(NC(=O)c2cc(OCC(F)(F)F)ccc2[N+](=O)[O-])nc1-c1ccccc1 485891350 KEWIITZABOKNAF-UHFFFAOYSA-N 465.453 6.035 5 20 JKBD Cc1ccc(NS(=O)(=O)c2ccc(N[C@@H](c3ccccc3)c3cccnc3)c([N+](=O)[O-])c2)c(C)c1 488014716 NLZBIYKMOCGTPY-SANMLTNESA-N 488.569 5.609 5 20 JKBD O=C(C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)NCc1ccc(OC(F)F)cc1 489292755 OOBPQANERLTGKO-AQTBWJFISA-N 495.507 6.053 5 20 JKBD O=C(Nc1cc(Cl)ccc1NC(=O)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-])c1ccco1 489324641 IGCPFEDKZXPQEU-UHFFFAOYSA-N 483.786 5.287 5 20 JKBD Cc1c(NC(=O)c2ccc(NCc3ccccc3)c([N+](=O)[O-])c2)cccc1C(=O)Nc1ccccc1 498610059 JCARCNYHDWBRNL-UHFFFAOYSA-N 480.524 6.020 5 20 JKBD C[C@H](NCc1ccc(-c2ccc([N+](=O)[O-])cc2Br)o1)c1nc(-c2ccccc2)cs1 501349677 UQYSESYDYPYGMH-AWEZNQCLSA-N 484.375 6.592 5 20 JKBD CC(C)(C)NC(=O)c1cccc(NC(=O)Cc2cn(-c3ccccc3)nc2-c2ccc([N+](=O)[O-])cc2)c1 502166300 IXVWTOXYAYRMGH-UHFFFAOYSA-N 497.555 5.157 5 20 JKBD O=C(c1ccccc1Sc1ccc(C(F)(F)F)cc1[N+](=O)[O-])N1CCC(OC2CCCC2)CC1 503357540 RRIQOAWUFWLGTP-UHFFFAOYSA-N 494.535 6.329 5 20 JKBD C[C@H](Nc1ccc(C(=O)N2CCN([C@@H](C)c3ccccc3Cl)CC2)cc1[N+](=O)[O-])c1ccccn1 506160131 MPMWHEGAPXCFAY-OALUTQOASA-N 493.995 5.335 5 20 JKBD CCOc1ccc([C@@H](C)NC(=O)c2ccc(N[C@H](C)c3ccccn3)c([N+](=O)[O-])c2)cc1OC 506244442 AUIRTCVJNMVNLX-IAGOWNOFSA-N 464.522 5.061 5 20 JKBD CCN(Cc1cc([N+](=O)[O-])cc2c1OCOC2)[C@@H]1CCSc2ccc(Br)cc21 509068974 YGWSOIFTLIWZIS-GOSISDBHSA-N 465.369 5.283 5 20 JKBD Cc1ccc(Cc2cnc(NC(=O)c3ccc([N+](=O)[O-])cc3I)s2)cc1C 510896704 IPQVYXATMWGYFR-UHFFFAOYSA-N 493.326 5.116 5 20 JKBD Cn1cnnc1-c1ccc(NC(=O)c2ccccc2Sc2ccc(C(F)(F)F)cc2[N+](=O)[O-])cc1 515172059 QQTLVTHOYTWONJ-UHFFFAOYSA-N 499.474 5.813 5 20 JKBD O=C(Cn1cc([N+](=O)[O-])cn1)N(Cc1cccc(C(F)(F)F)c1)Cc1cccc(C(F)(F)F)c1 518175530 DBESHOHXLXYLJR-UHFFFAOYSA-N 486.372 5.058 5 20 JKBD CN(Cc1ccccc1[N+](=O)[O-])C(=O)NCc1ccc(OCCOc2ccc(Cl)cc2)cc1 524531163 YHOPPXQRTORQKS-UHFFFAOYSA-N 469.925 5.048 5 20 JKBD O=C(Nc1ccccc1N1CCCCC1)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 598197147 WNXLZWVKFCUADP-UHFFFAOYSA-N 476.499 5.459 5 20 JKBD O=C(C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)Nc1ccccc1-n1cncn1 603513986 AWLVHRBFNJYXTR-QGOAFFKASA-N 482.525 5.355 5 20 JKBD CCOc1cc(NC(=O)c2ccccc2)c(OCC)cc1NC(=O)Nc1ccc([N+](=O)[O-])cc1 603743690 KKLLCXMPCDMNOY-UHFFFAOYSA-N 464.478 5.289 5 20 JKBD COCCN(C(=O)CCc1ccc(Cl)s1)c1nc(-c2ccc([N+](=O)[O-])cc2)cs1 603750589 WDPSJNBGJSXEND-UHFFFAOYSA-N 451.957 5.045 5 20 JKBD CCOc1cc([N+](=O)[O-])c(C(=O)N[C@@H](C)c2ccc(Oc3ccccc3)c(F)c2)cc1OC 603990948 HMNWVPURTDRUFC-HNNXBMFYSA-N 454.454 5.425 5 20 JKBD O=C(Nc1ccc(-c2nn[nH]n2)cc1)c1ccccc1Sc1ccc(C(F)(F)F)cc1[N+](=O)[O-] 604490469 ZBPROAIQZOGWBU-UHFFFAOYSA-N 486.435 5.197 5 20 JKBD C[C@@H]1C[C@@H](C)CN(c2ccc(C(=O)Nc3c(-c4ccccc4)ncn3C3CC3)cc2[N+](=O)[O-])C1 604544159 QMJFYSGIKRNQRB-QZTJIDSGSA-N 459.550 5.528 5 20 JKBD O=C(c1ccc(Cl)cc1Cl)N1CCN(C(=O)c2cc3ccccc3c3cccnc23)CC1 613692688 LXAOEOAKUDXFPG-UHFFFAOYSA-N 464.352 5.293 5 20 JKBD C[C@@H](OC(=O)c1csc(-c2cccc(C(F)(F)F)c2)n1)C(=O)Nc1ccc(F)c([N+](=O)[O-])c1 725994721 JOPRCVCMJXNEFE-SNVBAGLBSA-N 483.399 5.060 5 20 JKBD Cc1noc(C)c1CSc1ncccc1C(=O)OCc1cc([N+](=O)[O-])ccc1OC(C)C 729116171 HBJCSVHYSXUBHH-UHFFFAOYSA-N 457.508 5.031 5 20 JKBD CC[C@@H](C)Oc1ccccc1/C=C\C(=O)N(Cc1nnc(-c2cccc([N+](=O)[O-])c2)o1)C(C)C 729825520 JEZRXNZUCPOFCZ-SWNWVQGVSA-N 464.522 5.273 5 20 JKBD O=C(Cn1c2ccccc2c(=O)c2ccccc21)Oc1ccc(C(=O)N2CCc3sccc3C2)cc1 731333798 NZZJYIIYIKSCKQ-UHFFFAOYSA-N 494.572 5.020 5 20 JKBD O=C(OCc1nc(-c2cccc([N+](=O)[O-])c2)no1)c1csc(-c2ccc(Cl)c(Cl)c2)n1 744595944 DHZWKPZUSGPWGM-UHFFFAOYSA-N 477.285 5.432 5 20 JKBD O=C(Nc1cccc(COC(=O)c2csc(-c3cccc([N+](=O)[O-])c3)n2)c1)c1ccccc1 750428302 ZMIKBHFNWAYIAO-UHFFFAOYSA-N 459.483 5.328 5 20 JKBD O=C(Nc1ccc(N2CCc3sccc3C2)cc1)c1cc([N+](=O)[O-])ccc1Br 751125473 LVOALESWMBLDGH-UHFFFAOYSA-N 458.337 5.234 5 20 JKBD COc1ccc(-n2c(SCC(=O)Nc3cc([N+](=O)[O-])ccc3F)nnc2-c2cccc(C)c2)cc1 799087662 WTTMJFKYWZBIKA-UHFFFAOYSA-N 493.520 5.029 5 20 JKBD COc1cccc([C@@H](CNC(=O)c2cc([N+](=O)[O-])ccc2Cl)c2c[nH]c3ccccc23)c1OC 912664095 QHZVWGLKNJEGJV-HXUWFJFHSA-N 479.920 5.309 5 20 JKBD Cc1ccc(-n2ncc(C(=O)OCC(=O)Nc3ccc([N+](=O)[O-])cc3C(F)(F)F)c2C(C)C)cc1 914977454 DOHBQZYFGDOOTA-UHFFFAOYSA-N 490.438 5.027 5 20 JKBD C[C@H](OC(=O)[C@H](C)Oc1cccc(Cl)c1Cl)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 915496471 GDSGLMILMHYGHP-UWVGGRQHSA-N 495.237 5.258 5 20 JKBD O=[N+]([O-])c1cc(/C=C(/Cl)c2nc(O)c3c(-c4ccc(Br)cc4)csc3n2)cs1 917144014 VQPQNNKFFWDDFE-WLRTZDKTSA-N 494.779 6.533 5 20 JKBD CC1CCN(c2ccc([N+](=O)[O-])cc2C(=O)N2CCC(c3nc4cc(Cl)ccc4o3)CC2)CC1 917342324 TVXMWKINIFPFQW-UHFFFAOYSA-N 482.968 5.646 5 20 JKBD CCOc1cc([N+](=O)[O-])c(C(=O)Nc2ccccc2SC[C@@H]2CC2(Cl)Cl)cc1OC 917751345 JWPLKBPLKLWMEB-LBPRGKRZSA-N 471.362 5.540 5 20 JKBD COc1ccc([N+](=O)[O-])cc1OC(=O)c1cc(-c2ccncc2)nc2ccc(Br)cc12 919983949 WSSJOWCPCRPUOS-UHFFFAOYSA-N 480.274 5.195 5 20 JKBD COc1ccc2cc(COC(=O)c3cc(OC)c(OCc4cscn4)cc3[N+](=O)[O-])ccc2c1 919993303 MRZWBJFCWJQNHZ-UHFFFAOYSA-N 480.498 5.158 5 20 JKBD O=C(OCc1nnc(C2CC2)o1)c1c2c(nc3ccccc13)/C(=C\c1cccc([N+](=O)[O-])c1)CCC2 920499700 SWTURIBSMCZNPB-AQTBWJFISA-N 482.496 5.637 5 20 JKBD C[C@@H]1CCC[C@H]1C(=O)Nc1ccc(C2(NC(=O)CSc3ccccc3[N+](=O)[O-])CCC2)cc1 1789213979 OEDOTKGTDVPANW-YLJYHZDGSA-N 467.591 5.257 5 20 JKBD O=C(NC1(c2ccc(NC(=O)c3ccc([N+](=O)[O-])[nH]3)cc2)CCC1)c1cnc2cccc(Cl)c2c1 1790186095 GVLRNVCEVMEVNA-UHFFFAOYSA-N 489.919 5.186 5 20 JKBD O=C(Cc1ccc([N+](=O)[O-])cc1F)NC1(c2ccc(NC(=O)c3ccc4ccoc4c3)cc2)CCC1 1790892765 SBTSTYCOHXAAHS-UHFFFAOYSA-N 487.487 5.471 5 20 JKBD O=C(/C=C/c1ccc([N+](=O)[O-])o1)Nc1cc([C@@H]2CCCCN2C(=O)c2cc3sccc3s2)[nH]n1 1814967214 ARQSYEFGXRVPFS-DRDHIDPGSA-N 497.558 5.206 5 20 JKBD CCCCCc1ccc(CC(=O)Nc2cc([C@@H]3CCCCN3C(=O)c3ccc([N+](=O)[O-])o3)[nH]n2)cc1 1822286778 AGUWHEHPBPBBFS-NRFANRHFSA-N 493.564 5.192 5 20 JKBD O=C(c1ccc(C2CC2)cc1)N1CCC([C@H]2CCCCN2C(=O)CCc2cccc([N+](=O)[O-])c2)CC1 1824842543 KJMXYIPULWJJCN-HHHXNRCGSA-N 489.616 5.338 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cc3ccsc3[nH]2)CC1 1830728879 GZOZAQQTYHSJNI-OAQYLSRUSA-N 498.580 5.132 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)N1CCCC[C@@H]1C1CCN(C(=O)/C=C/C2CCCC2)CC1 1830729730 VPGQQJCSMGQINL-JYLQPTBZSA-N 471.573 5.022 5 20 JKBD C[C@H](OC(=O)c1ccccc1C(=O)c1ccc(Cl)cc1)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl 10661609 SDTYSYJCWKVFPM-ZDUSSCGKSA-N 487.295 5.317 5 20 JKBD CC(=O)N(c1nc(COC(=O)c2ccc([N+](=O)[O-])cc2Cl)cs1)c1ccc(C)cc1C 11028700 QPOIOAADHJJUBN-UHFFFAOYSA-N 459.911 5.363 5 20 JKBD C[C@@H](NC(=O)c1ccccc1NC(=O)c1ccc(Br)c([N+](=O)[O-])c1)c1ccccc1 14792778 NPYGVHZEOJBQFF-CQSZACIVSA-N 468.307 5.101 5 20 JKBD C[C@H](OC(=O)COc1ccc2oc3ccccc3c2c1)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 17717817 JWRTYDICTNPZCV-AWEZNQCLSA-N 459.414 5.227 5 20 JKBD O=C(c1ccc([N+](=O)[O-])s1)N(C[C@H]1CCCO1)c1nc(-c2ccc(Br)cc2)cs1 21083682 WYSSAQVXLJDSLI-CQSZACIVSA-N 494.392 5.368 5 20 JKBD CCOc1ccc([C@@H](CNC(=O)c2cccc(C)c2[N+](=O)[O-])c2c[nH]c3ccccc23)cc1OC 23699206 NOGAKWUTDRNKLO-OAQYLSRUSA-N 473.529 5.354 5 20 JKBD COc1cc(C(=O)NCc2cccc(Cn3ccnc3)c2)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 24747584 HQWVMWREBSSTRC-UHFFFAOYSA-N 492.919 5.224 5 20 JKBD C[C@@H](NC(=O)c1ccccc1NC(=O)c1ccccc1Br)c1cccc([N+](=O)[O-])c1 109137141 VKZGQZJHGZBWMB-CQSZACIVSA-N 468.307 5.101 5 20 JKBD CC(=O)Nc1ccc(C(F)(F)F)cc1NC(=O)c1ccc(N[C@H](C)c2ccccn2)c([N+](=O)[O-])c1 109165795 PNDRVPNXFJHLJO-CYBMUJFWSA-N 487.438 5.392 5 20 JKBD O=C(/C=C\c1cccs1)O[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Br)c1ccccc1 207062939 APCQUWAPMXTWIA-YBNHLDJLSA-N 487.331 5.355 5 20 JKBD CCCOc1cc(NC(=O)N2CCC(OC3CCCCC3)CC2)c([N+](=O)[O-])cc1OCCC 497748471 YZUGHLIWMALTQF-UHFFFAOYSA-N 463.575 5.518 5 20 JKBD C[C@@H](NC(=O)c1ccc(N[C@H](C)c2ccccn2)c([N+](=O)[O-])c1)c1ccc(Br)cc1 505981067 HUTPWDQKUHRNKX-HUUCEWRRSA-N 469.339 5.416 5 20 JKBD COc1cc([C@H](C)NCc2ccc(Oc3ccccc3Cl)c([N+](=O)[O-])c2)cc(OC)c1OC 508104515 RCSZDMIURKGQML-HNNXBMFYSA-N 472.925 5.917 5 20 JKBD Cc1nnc(Sc2ccc(NC(=O)c3cc([N+](=O)[O-])ccc3NCc3ccccc3)c(C)c2)s1 509292347 YVYSQGVMEBNQQW-UHFFFAOYSA-N 491.598 6.079 5 20 JKBD COc1cc(C(=O)Nc2nc(-c3ccc(-c4ccccc4)cc3)cs2)c([N+](=O)[O-])cc1OC 514602746 ZSUPNZKVYDWTDV-UHFFFAOYSA-N 461.499 5.655 5 20 JKBD C[C@H](Nc1ccc(C(=O)Nc2ccc(NC(=O)Nc3ccccc3)cc2)cc1[N+](=O)[O-])c1ccccn1 516573598 XYJRUUDPCGUAKF-SFHVURJKSA-N 496.527 6.059 5 20 JKBD Cc1cc(CNC(=O)c2c3c(nc4ccccc24)/C(=C\c2cccc([N+](=O)[O-])c2)CCC3)no1 518681517 RANPIBPZJOWZDV-AQTBWJFISA-N 454.486 5.246 5 20 JKBD COc1cc(C(=O)Nc2ccc(N3CCCC3)nc2)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 590103600 PIYKZLQDWRGHJD-UHFFFAOYSA-N 468.897 5.297 5 20 JKBD CC(=O)Nc1ccc(NC(=O)c2ccc(N3CCC[C@H](C)C3)c([N+](=O)[O-])c2)c(C(F)(F)F)c1 590766437 AXAUECQVEMTIBE-ZDUSSCGKSA-N 464.444 5.061 5 20 JKBD CCNc1ccc(C(=O)Nc2ccc(NC(=O)c3ccco3)cc2C(F)(F)F)cc1[N+](=O)[O-] 590870852 NGFZCBODBIDIAN-UHFFFAOYSA-N 462.384 5.143 5 20 JKBD COc1ccc(CNC(=O)C/C(=C/c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)cc1OC 597994470 YWHWYGULSWJJJF-UYRXBGFRSA-N 489.553 5.469 5 20 JKBD O=C(Nc1ncc(S(=O)(=O)c2ccc([N+](=O)[O-])cc2)s1)c1cc2c(Cl)cccc2s1 603465293 BQUPLBZRMOIGRV-UHFFFAOYSA-N 479.948 5.005 5 20 JKBD Cc1ccc(CN[C@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Br)c2ccccc2)s1 604044680 FXTRQHFWRPLTOT-IBGZPJMESA-N 460.353 5.197 5 20 JKBD CCN(C[C@@H]1CCOC1)C(=O)c1c2c(nc3ccccc13)/C(=C\c1cccc([N+](=O)[O-])c1)CCC2 604431431 HNUJIWWXSBCFHZ-RLKVQFJASA-N 471.557 5.519 5 20 JKBD Cc1ccc(Sc2ccc(C(=O)N3CC[C@H](CNC(=O)OC(C)(C)C)C3)cc2[N+](=O)[O-])cc1 725735170 WYJSXBNOFNZVMX-QGZVFWFLSA-N 471.579 5.041 5 20 JKBD CC(C)c1noc2nc(-c3ccco3)cc(C(=O)O[C@@H](C)C(=O)Nc3ccc([N+](=O)[O-])cc3Cl)c12 727918587 LPGVLJTZWQZCKB-LBPRGKRZSA-N 498.879 5.352 5 20 JKBD Cc1sc2nc(CS[C@@H](C)C(=O)OCc3cc([N+](=O)[O-])ccc3OC(C)C)nc(O)c2c1C 729114857 QVCKDWIRZSWHEF-AWEZNQCLSA-N 491.591 5.074 5 20 JKBD COCCCn1c(Sc2nc3ccc([N+](=O)[O-])cc3s2)nnc1-c1ccccc1Cl 731205788 INOBBIMXNFAFED-UHFFFAOYSA-N 461.956 5.304 5 20 JKBD CC(=O)N(C)c1ccc(N[C@@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Br)c2ccccc2)cc1 744264505 OUVLHRYCCSHALX-JOCHJYFZSA-N 497.349 5.132 5 20 JKBD C[C@@H](OC(=O)c1csc(-c2ccc(Cl)c(Cl)c2)n1)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 744597511 SXMHMLWAQPZBFO-SNVBAGLBSA-N 491.312 5.993 5 20 JKBD CC1CCN(c2ccc([N+](=O)[O-])cc2C(=O)N2CCC[C@@H](c3nc(-c4ccc(F)cc4)no3)C2)CC1 750662456 LRATYVHKDMGASX-LJQANCHMSA-N 493.539 5.040 5 20 JKBD O=C(Nc1ccc(NCc2c(Br)cccc2[N+](=O)[O-])c(C(F)(F)F)c1)[C@@H]1CCCO1 863997198 UPMZVXUJZIHDJI-KRWDZBQOSA-N 488.260 5.106 5 20 JKBD Cc1c([N+](=O)[O-])cc(C(=O)N(CCc2ccccc2)c2nc3ccccc3s2)cc1[N+](=O)[O-] 877858083 CKKIRDJTBYBNRE-UHFFFAOYSA-N 462.487 5.311 5 20 JKBD O=C(Nc1ccc(OC(=O)C2(c3ccc(F)cc3)CC2)cc1)c1cc([N+](=O)[O-])ccc1Cl 907269465 SNQHZIKKMJESRR-UHFFFAOYSA-N 454.841 5.277 5 20 JKBD O=C(OCc1nnc(-c2ccc([N+](=O)[O-])cc2)o1)c1ccc(-c2ccc(Br)cc2)s1 915254302 YXXNFMRPHMLGTH-UHFFFAOYSA-N 486.303 5.493 5 20 JKBD CCCc1cc[n+](/C(C(=S)Nc2ccc3ccccc3c2)=C(/O)c2cccc([N+](=O)[O-])c2)cc1 917609887 HFQBSPMCEIGUBD-UHFFFAOYSA-O 470.574 6.311 5 20 JKBD C[C@H](NC(=O)NC[C@H](c1ccc(N(C)C)cc1)c1c[nH]c2ccccc12)c1cccc([N+](=O)[O-])c1 918169646 UBJHDXZKELSFNG-MHECFPHRSA-N 471.561 5.334 5 20 JKBD C[C@H](OC(=O)[C@@H](C)SCc1ncc(-c2ccc(Cl)cc2)o1)C(=O)Nc1cccc([N+](=O)[O-])c1 920673653 MSSYOFUUQLMQFH-UONOGXRCSA-N 489.937 5.095 5 20 JKBD CCC[C@@H](C(=O)NC1(c2ccc(NC(=O)/C=C/c3ccc([N+](=O)[O-])o3)cc2)CCC1)n1cccc1 1786205031 ZEEITGPZJOAYBJ-SDNYCIMKSA-N 476.533 5.178 5 20 JKBD Cc1cc(C(=O)Nc2ccc(C3(NC(=O)c4ccc5occc5c4)CCC3)cc2)ncc1[N+](=O)[O-] 1788766316 FVOBFPWSZLLUJS-UHFFFAOYSA-N 470.485 5.106 5 20 JKBD O=C(NC1(c2ccc(NC(=O)c3ccc(C(F)(F)F)[nH]3)cc2)CCC1)c1cc(F)cc([N+](=O)[O-])c1 1789674294 NLJKMHJUVFAUPN-UHFFFAOYSA-N 490.413 5.142 5 20 JKBD CCn1nc(C(C)C)cc1C(=O)NC1(c2ccc(NC(=O)c3cccc(F)c3[N+](=O)[O-])cc2)CCC1 1790700918 AMQWQUKVAVAQKJ-UHFFFAOYSA-N 493.539 5.135 5 20 JKBD Cc1[nH]nc(C(=O)NC2(c3ccc(NC(=O)c4cc5cc([N+](=O)[O-])ccc5s4)cc3)CCC2)c1F 1791011333 XKUDFMVJMHJPME-UHFFFAOYSA-N 493.520 5.042 5 20 JKBD Cc1nc(C)c(C(=O)NC2(c3ccc(NC(=O)/C=C/c4ccccc4[N+](=O)[O-])cc3)CCC2)s1 1792315685 QGXBEJVCSZFUMS-MDWZMJQESA-N 476.558 5.129 5 20 JKBD O=C(CCc1cccc([N+](=O)[O-])c1)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccccc1Oc1ccccc1 1799548522 RNFXKQRZFLGNQP-NUNAXRQHSA-N 499.567 5.272 5 20 JKBD CCCCC[C@@H](C)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cc3cc([N+](=O)[O-])ccc3s1)C2 1801716342 UNIVQCYHDFDASD-OQIJWPOYSA-N 457.596 5.278 5 20 JKBD CC(C)(C)c1ccc(C(=O)N2CCC3(CCCN(C(=O)Cc4cccc([N+](=O)[O-])c4)C3)CC2)s1 1804751601 BWSGXLWIFRFUNL-UHFFFAOYSA-N 483.634 5.041 5 20 JKBD CC[C@H](C(=O)N1CCCC2(CCN(C(=O)CSc3ccccc3[N+](=O)[O-])CC2)C1)c1ccccc1 1809013073 JMJMAJQKFPVNEV-QFIPXVFZSA-N 495.645 5.112 5 20 JKBD O=C(Nc1cc([C@H]2CCCCN2C(=O)c2ccc([N+](=O)[O-])[nH]2)[nH]n1)c1cccc2c1oc1ccccc12 1821612141 YVGCNZVORCGDGB-HXUWFJFHSA-N 498.499 5.165 5 20 JKBD CC(C)c1csc(C(=O)N2CCC([C@@H]3CCCCN3C(=O)CCc3cccc([N+](=O)[O-])c3)CC2)n1 1824838526 KDGGIOGLLIHRHX-QHCPKHFHSA-N 498.649 5.041 5 20 JKBD O=C(c1cccc(F)c1Cl)N1CCC([C@@H]2CCCCN2C(=O)c2ccc([N+](=O)[O-])cc2F)CC1 1830498659 BTSXEAAYGPUKEV-NRFANRHFSA-N 491.922 5.074 5 20 JKBD O=C(C[C@H]1C[C@@H]2CC[C@H]1C2)N1CCC([C@@H]2CCCCN2C(=O)CSc2ccccc2[N+](=O)[O-])CC1 1831777287 NVISAYVQKJJKDY-PNJWGLBASA-N 499.677 5.133 5 20 JKBD Cc1ccccc1-c1nnc(S[C@@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2C(F)(F)F)o1 10015731 JZXHAKAZLVCCSP-NSHDSACASA-N 452.414 5.091 5 20 JKBD CC1=C(C(=O)Nc2cc(C)on2)[C@@H](c2ccc(Cl)c([N+](=O)[O-])c2)NC(=S)N1c1cccc(C)c1 10355404 GLIOWGWGZVDKGE-OAQYLSRUSA-N 497.964 5.202 5 20 JKBD O=C(COC(=O)c1ccc(Oc2ccc(C(F)(F)F)cn2)cc1)Nc1ccc(Cl)cc1[N+](=O)[O-] 16168945 VQGCZTXABNBMDU-UHFFFAOYSA-N 495.797 5.250 5 20 JKBD Cc1cccc(-c2nc(CC(=O)O[C@@H](C)C(=O)Nc3ccc([N+](=O)[O-])cc3C(F)(F)F)cs2)c1 17229830 QOOXYZPMVRTISY-ZDUSSCGKSA-N 493.463 5.158 5 20 JKBD CC(C)c1ccc(Nc2nnc(S[C@@H](C)c3nnc(-c4ccc([N+](=O)[O-])cc4)o3)s2)cc1 17537894 UIZJIIMGNPCXDA-ZDUSSCGKSA-N 468.564 6.217 5 20 JKBD CC(C)N(Cc1nnc(-c2cccc([N+](=O)[O-])c2)o1)C(=S)Nc1ccc(Cl)cc1Cl 18142914 QIOXSZLNVZMCTK-UHFFFAOYSA-N 466.350 5.559 5 20 JKBD COc1ccc(CSc2nnc(SCC(=O)Nc3ccc([N+](=O)[O-])cc3Cl)s2)cc1 24773206 PLFIXLNLLDHCQR-UHFFFAOYSA-N 482.996 5.131 5 20 JKBD C[C@@H](Sc1nc2ccccc2c(=O)n1CCCc1ccccc1)C(=O)Nc1ccccc1[N+](=O)[O-] 25108706 VMEMWGVWTRGXAC-GOSISDBHSA-N 488.569 5.057 5 20 JKBD O=C(NCc1ccccc1)c1nnc(/C(Cl)=C\c2ccc(-c3cccc([N+](=O)[O-])c3)o2)s1 209438351 OHZCKRUFEAILNC-LDADJPATSA-N 466.906 5.373 5 20 JKBD CN(Cc1ccccn1)C(=O)c1c2c(nc3ccccc13)/C(=C\c1cccc([N+](=O)[O-])c1)CCC2 488609092 HOTLZBICNMHBIJ-SILNSSARSA-N 464.525 5.687 5 20 JKBD CC(=O)Nc1ccc(CCNC(=O)c2cc([N+](=O)[O-])ccc2Sc2ccc(Cl)cc2)cc1 504797604 SMDXFVIDOGXTLH-UHFFFAOYSA-N 469.950 5.330 5 20 JKBD O=C(CCOc1ccccc1[N+](=O)[O-])Nc1cccc(C(=O)Nc2cccc(C(F)(F)F)c2)c1 515608301 FGUPKWLVJMLURM-UHFFFAOYSA-N 473.407 5.274 5 20 JKBD COc1cc(C(=O)Nc2ccc(N[C@@H](C)c3ccccc3)cc2)c([N+](=O)[O-])cc1OC(F)F 518863967 KKDQJQRBFCARRE-AWEZNQCLSA-N 457.433 5.630 5 20 JKBD Cc1ccc(Sc2ccc(C(=O)N3CCCN(C(=O)c4ccccc4F)CC3)cc2[N+](=O)[O-])cc1 519962461 COKXVVPQHOKHPN-UHFFFAOYSA-N 493.560 5.182 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Br)[C@@H](NCc1cc(F)ccc1F)c1ccccc1 521535803 KZLXGCOJGNIJFR-FQEVSTJZSA-N 476.277 5.105 5 20 JKBD CC(C)N1CCC(NC(=O)C/C(=C/c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)CC1 603573879 XVLNSUWGTLLFJS-CYVLTUHYSA-N 464.591 5.124 5 20 JKBD COc1ccc([C@H](NCc2ccc(Sc3ccc(C)cc3)c([N+](=O)[O-])c2)c2nccn2C)cc1 603633415 DDJSJPXWBXUYBS-VWLOTQADSA-N 474.586 5.676 5 20 JKBD Cc1cc(C(=O)O[C@@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)sc1-c1ccc(F)cc1 726656867 QQNXLALZQMEYST-ZDUSSCGKSA-N 453.451 5.739 5 20 JKBD COc1cc(NC(=O)CCC(=O)c2ccc3ccc4cccc5ccc2c3c45)ccc1NC(C)=O 727769032 XCQJQFBXTBMARO-UHFFFAOYSA-N 464.521 6.153 5 20 JKBD COc1ccc(NC(=O)/C=C/c2ccc([N+](=O)[O-])cc2)cc1OCc1ccc2ccccc2n1 728009202 UJKSDWPVKYZOEU-OVCLIPMQSA-N 455.470 5.383 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Cl)[C@H](Nc1ccc(OCc2cccnc2)cc1)c1ccccc1 728591933 ORPWXTUSPXVGLO-RUZDIDTESA-N 488.931 6.014 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)O[C@@H](C)C(=O)N2c3ccccc3Sc3ccccc32)cc1SC 728650454 HAUJDZFFPTUARQ-AWEZNQCLSA-N 496.566 5.700 5 20 JKBD CN(Cc1ccc(F)cc1Cl)C(=O)c1ccccc1NC(=O)c1ccc([N+](=O)[O-])cc1Cl 730551472 MHGIVGSBHTVFFK-UHFFFAOYSA-N 476.291 5.565 5 20 JKBD C[C@H](OC(=O)[C@@H]1C[C@H]1c1ccc(Cl)cc1Cl)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 730613834 MHVLAEMWTBEFLQ-QCZZGDTMSA-N 491.249 5.594 5 20 JKBD Cc1ccc(-c2nn(-c3ccccc3)cc2C(=O)O[C@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)o1 746144068 QNNBVNNLFHKCMT-MRXNPFEDSA-N 485.456 5.317 5 20 JKBD Cc1cc(Cl)ccc1Cc1cnc(NC(=O)c2cc([N+](=O)[O-])ccc2Br)s1 751096900 TYEUWKTWZOVMEC-UHFFFAOYSA-N 466.744 5.619 5 20 JKBD COc1ccc([C@@H](Cc2ccc(F)cc2)NC(=O)c2cc([N+](=O)[O-])ccc2Br)cc1 751110161 JVZNUXPFBQSTLX-OAQYLSRUSA-N 473.298 5.219 5 20 JKBD O=C(CSc1nc2cc(C(F)(F)F)ccc2s1)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 753850669 HIYWOQOVADKTFJ-UHFFFAOYSA-N 481.399 5.973 5 20 JKBD COc1ccc2c(c1)CCCN2C(=O)c1ccccc1NC(=O)c1ccc([N+](=O)[O-])cc1Cl 791033043 UPJYNNOTCMGPMF-UHFFFAOYSA-N 465.893 5.102 5 20 JKBD COc1cc(-c2nc(-c3cccc(Cn4cnc5ccccc54)c3)no2)c([N+](=O)[O-])cc1OC(F)F 904490394 KEEZHPZEUYQLRB-UHFFFAOYSA-N 493.426 5.320 5 20 JKBD Cc1ccc(NS(=O)(=O)c2ccc(Cl)c(C(=O)Nc3cc([N+](=O)[O-])ccc3C)c2)cc1C 912934510 WQOAQZHWRISBQJ-UHFFFAOYSA-N 473.938 5.227 5 20 JKBD O=C(Nc1cccc(N2CCOC2=O)c1)c1ccc(Sc2nc3ccccc3s2)c([N+](=O)[O-])c1 914726438 SVTHLKAZRGJLGS-UHFFFAOYSA-N 492.538 5.565 5 20 JKBD C[C@H](Nc1cc(Cl)c(C(F)(F)F)cc1[N+](=O)[O-])c1ccc(OCC(=O)NC2CC2)cc1 917083500 LZVFPDXZGFMKCJ-NSHDSACASA-N 457.836 5.098 5 20 JKBD O=C(Nc1cc([N+](=O)[O-])ccc1F)c1cccnc1SCc1cccc(Br)c1 917611624 MDXKSYRNNFUJEE-UHFFFAOYSA-N 462.300 5.436 5 20 JKBD Cc1ccc([N+](=O)[O-])cc1NC(=O)c1cc(-c2ccncc2)nc2ccc(Br)cc12 919986025 ZTRWMONDVVTDCN-UHFFFAOYSA-N 463.291 5.528 5 20 JKBD O=C(/C=C/c1ccc([N+](=O)[O-])o1)NC1(c2ccc(NC(=O)CCc3ccsc3)cc2)CCC1 1788182279 PJJWRFPNHZBFRB-JXMROGBWSA-N 465.531 5.029 5 20 JKBD Cc1ccc2[nH]cc(CC(=O)NC3(c4ccc(NC(=O)c5cc(C)c([N+](=O)[O-])cn5)cc4)CCC3)c2c1 1788765201 WLBNJSAPECAMIJ-UHFFFAOYSA-N 497.555 5.078 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)[C@H]3C[C@@H]3C3CC3)CCC2)cc1)c1ccc(Br)c([N+](=O)[O-])c1 1790641661 CCFLZAKRYDVIQN-MOPGFXCFSA-N 498.377 5.151 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)c3ccc([N+](=O)[O-])[nH]3)CCC2)cc1)c1cnc2ccc(Cl)cc2c1 1790870926 IDYWOHPVWMIKSY-UHFFFAOYSA-N 489.919 5.186 5 20 JKBD Cc1c(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cc(Cl)c(F)cc2F)cc(Cl)cc1[N+](=O)[O-] 1800318989 OXEXJUDBPQOCRX-BTTYYORXSA-N 498.313 5.054 5 20 JKBD O=C(c1ccc([N+](=O)[O-])cc1F)N1CCC([C@@H]2CCCCN2C(=O)c2ccc(Cl)cc2F)CC1 1823899260 UACARJZMCKJWCN-QFIPXVFZSA-N 491.922 5.074 5 20 JKBD O=C(c1ccc(-c2ccccc2)cc1)N1CCC([C@H]2CCCCN2C(=O)c2ccc([N+](=O)[O-])[nH]2)CC1 1829838303 QZHCIFMDQXTJCE-RUZDIDTESA-N 486.572 5.137 5 20 JKBD CCC[C@H](C(=O)N1CCC([C@H]2CCCCN2C(=O)/C=C/c2ccccc2[N+](=O)[O-])CC1)n1cccc1 1832906609 CZYUIKPFKVSZQO-XOPPCCJWSA-N 492.620 5.071 5 20 JKBD CSc1ccc([N+](=O)[O-])c(C(=O)NCc2cn(Cc3ccccc3)nc2-c2ccccc2)c1 10484000 QYFJGHITULQTAG-UHFFFAOYSA-N 458.543 5.159 5 20 JKBD O=C(c1cccc([N+](=O)[O-])c1)N(C[C@H]1CCCO1)c1nc(-c2ccc(Cl)cc2Cl)cs1 14819619 ILTCARZHZGWBHG-MRXNPFEDSA-N 478.357 5.851 5 20 JKBD O=C(Nc1cccc(-c2nnc3n2CCCCC3)c1)c1ccc(NCc2ccccc2)c([N+](=O)[O-])c1 15379811 YFMLPQISSPDFTF-UHFFFAOYSA-N 482.544 5.444 5 20 JKBD CCOC(=O)c1nc(N(CCc2ccccc2)C(=O)c2ccc(SC)c([N+](=O)[O-])c2)sc1C 21825978 GVZICSCBCDZHSP-UHFFFAOYSA-N 485.587 5.148 5 20 JKBD COc1cccc([C@@H](CNC(=O)c2cc([N+](=O)[O-])c(C)s2)c2c[nH]c3ccccc23)c1OC 24441799 XYDYCRQNQMNVLD-GOSISDBHSA-N 465.531 5.025 5 20 JKBD COc1cc(C(=O)N2CCC[C@@H]2c2cccnc2)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 27163540 MCMHWDQSSIEOTJ-GOSISDBHSA-N 453.882 5.421 5 20 JKBD COc1cc(C(=O)Nc2nc(-c3ccc(Cl)s3)cs2)c([N+](=O)[O-])cc1OC(F)F 29583246 TWVYULDQSWIXAJ-UHFFFAOYSA-N 461.855 5.296 5 20 JKBD Cc1ccc(C)c(SCc2nc(=O)c3c(C)c(C(=O)Nc4cccc([N+](=O)[O-])c4C)sc3[nH]2)c1 29896736 YEZQQHFVEADSAI-UHFFFAOYSA-N 494.598 5.671 5 20 JKBD C[C@H](Sc1nnc(-c2cccs2)n1Cc1ccccc1)C(=O)Nc1ccc([N+](=O)[O-])cc1 36802157 NAHDCBSUNFFBKK-HNNXBMFYSA-N 465.560 5.082 5 20 JKBD CCN(Cc1cc(Br)ccc1F)C(=O)c1csc(-c2ccc([N+](=O)[O-])cc2)n1 303059707 UIIZJHLIYIDWEE-UHFFFAOYSA-N 464.316 5.282 5 20 JKBD CC(C)(C)C(=O)N1CCN(C(=O)c2ccccc2Sc2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 499914177 OSIPKNCVXRIGTA-UHFFFAOYSA-N 495.523 5.095 5 20 JKBD CC(C)c1nc(-c2ccccc2NC(=O)c2ccc(N[C@H](C)c3ccccn3)c([N+](=O)[O-])c2)n[nH]1 509137983 LWUGQSMZBHJGLJ-MRXNPFEDSA-N 471.521 5.324 5 20 JKBD Cc1nc(C(=O)N(C)C)ccc1C(=O)Nc1cc([N+](=O)[O-])ccc1Nc1cccc(C(F)(F)F)c1 512028530 XHCNBPWQASCLHJ-UHFFFAOYSA-N 487.438 5.015 5 20 JKBD CC[C@H](C)[C@@H](NC(=O)c1cc(OC)c(OCc2cscn2)cc1[N+](=O)[O-])c1nc2ccccc2[nH]1 512185151 ZRFOFHQYJCOTGT-RCDICMHDSA-N 495.561 5.032 5 20 JKBD C[C@@H]1CCCN(CCCCNC(=O)C/C(=C/c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)C1 517094678 FIRSLELMXUJSSH-KTXUMSRNSA-N 492.645 5.764 5 20 JKBD Cc1ncc2c(n1)CCN(C(=O)c1c3c(nc4ccccc14)/C(=C\c1ccc([N+](=O)[O-])cc1)CCC3)C2 517343238 WBSBTQFGTZVJNH-HKWRFOASSA-N 491.551 5.317 5 20 JKBD CCOCc1ccc(CNC(=O)c2ccccc2C(=O)c2ccc(SC)c([N+](=O)[O-])c2)cc1 517385677 AHFFNKRJMMEYLJ-UHFFFAOYSA-N 464.543 5.014 5 20 JKBD COc1ccc(Oc2ccc([N+](=O)[O-])cc2C(=O)N2CCC(C(=O)Nc3ccc(F)cc3)CC2)cc1 523854108 ZVRIHPPTXHANPD-UHFFFAOYSA-N 493.491 5.026 5 20 JKBD CC(C)(C)c1csc(NC(=O)C2CCN(c3ccc(C(F)(F)F)cc3[N+](=O)[O-])CC2)n1 548918213 GAAMNHGCVAWFQM-UHFFFAOYSA-N 456.490 5.223 5 20 JKBD COc1ccccc1Nc1nc(-c2ccccc2)c(CC(=O)N(C)Cc2ccccc2[N+](=O)[O-])s1 603575427 CKZOTMSAYKUJEG-UHFFFAOYSA-N 488.569 5.672 5 20 JKBD Cc1ccc(Sc2ccc(C(=O)N3CCCN(C(=O)c4ccsc4)CC3)cc2[N+](=O)[O-])cc1 604190820 WAKGMQNTHVBONR-UHFFFAOYSA-N 481.599 5.104 5 20 JKBD Cc1ccc(-c2nnc(S[C@H](C)C(=O)Nc3ccc([N+](=O)[O-])cc3C(F)(F)F)o2)cc1 619647624 YXBWKLWSTJZZDD-LLVKDONJSA-N 452.414 5.091 5 20 JKBD Cc1ccc(NC(=O)[C@@H](OC(=O)c2sccc2OC(F)F)c2ccccc2)c([N+](=O)[O-])c1 729774582 IGBMTKJGRNZDLO-KRWDZBQOSA-N 462.430 5.103 5 20 JKBD Cc1nnc(Sc2ccc(NC(=O)c3ccc(Br)c([N+](=O)[O-])c3)c(C)c2)s1 751198852 INSNWPVBFZQLJD-UHFFFAOYSA-N 465.354 5.229 5 20 JKBD CC(C)=CC(=O)Nc1scc(-c2ccccc2)c1C(=O)OCC(=O)N(C)c1ccc([N+](=O)[O-])cc1 800785066 IHEJOHWQMDQXEF-UHFFFAOYSA-N 493.541 5.048 5 20 JKBD O=C(c1cccc(NCc2c(Br)cccc2[N+](=O)[O-])c1)N1CCc2ccccc21 864002768 XAOPXBQTDTZMHO-UHFFFAOYSA-N 452.308 5.172 5 20 JKBD Cc1ccc(C)c(NC(=O)[C@H](OC(=O)c2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)c2ccccc2)c1 920550589 MZNYUWVCQLULCV-RUZDIDTESA-N 484.512 5.149 5 20 JKBD C[C@@H](OC(=O)Cn1c2ccccc2c(=O)c2ccccc21)c1ccc(F)c(Br)c1 920800149 JIGCDWWRSHEJLZ-CQSZACIVSA-N 454.295 5.361 5 20 JKBD CCOc1ccsc1C(=O)Nc1ccc(C2(NC(=O)c3cc(F)cc([N+](=O)[O-])c3)CCC2)cc1 1785773891 IBPGYBUDSHMXLN-UHFFFAOYSA-N 483.521 5.256 5 20 JKBD Cc1ccc(OCCC(=O)Nc2ccc(C3(NC(=O)/C=C/c4ccc([N+](=O)[O-])o4)CCC3)cc2)cc1 1785968597 PUKHNXYUGINAHX-ACCUITESSA-N 489.528 5.113 5 20 JKBD Cc1cc(F)cc(C(=O)NC2(c3ccc(NC(=O)/C=C/c4ccc([N+](=O)[O-])o4)cc3)CCC2)c1 1786207903 RZOGWKBNZPJMNR-VQHVLOKHSA-N 463.465 5.096 5 20 JKBD C[C@@H](Sc1ccccc1)C(=O)Nc1ccc(C2(NC(=O)/C=C/c3ccc([N+](=O)[O-])o3)CCC2)cc1 1786287303 ARJPIFMWNCIACM-QIXNEVBVSA-N 491.569 5.516 5 20 JKBD Cc1cccc(CCC(=O)NC2(c3ccc(NC(=O)/C=C/c4ccccc4[N+](=O)[O-])cc3)CCC2)n1 1792315441 OWQOCJWYMQQECR-MHWRWJLKSA-N 484.556 5.078 5 20 JKBD Cc1c(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)c3sccc3F)n[nH]2)cc(Cl)cc1[N+](=O)[O-] 1815429717 MJDKWKYOTLXSCT-MRXNPFEDSA-N 491.932 5.100 5 20 JKBD O=C(c1cc2ccoc2s1)N1CCC([C@@H]2CCCCN2C(=O)Cc2cc([N+](=O)[O-])ccc2F)CC1 1824949809 ZCMPAFYXTUUEMZ-NRFANRHFSA-N 499.564 5.018 5 20 JKBD O=C(c1cccc(F)c1[N+](=O)[O-])N1CCC([C@@H]2CCCCN2C(=O)c2cccc3ccoc23)CC1 1830990804 KOYQFMVIVGIUKR-QFIPXVFZSA-N 479.508 5.027 5 20 JKBD COc1cccc(Nc2nnc(S[C@@H](C)C(=O)Nc3ccc([N+](=O)[O-])cc3C(F)(F)F)s2)c1 10267559 FHWYPJFCVHWADR-JTQLQIEISA-N 499.496 5.337 5 20 JKBD Cc1csc(Sc2ccc(C(=O)N3CCC(c4c[nH]c5ccccc45)CC3)cc2[N+](=O)[O-])n1 11258233 MHYADGASIXFFFS-UHFFFAOYSA-N 478.599 6.012 5 20 JKBD Cc1ccc(Nc2nnc(SCC(=O)Nc3cc([N+](=O)[O-])ccc3F)s2)cc1Cl 16325305 BJBZSRBCRMTJQX-UHFFFAOYSA-N 453.908 5.022 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Br)[C@@H](N[C@H]1CCSc2ccccc21)c1ccccc1 19669658 KRFYFFDLYRXCNM-UGKGYDQZSA-N 498.402 5.864 5 20 JKBD COc1ccccc1N(Cc1coc(-c2ccccc2)n1)S(=O)(=O)c1cc([N+](=O)[O-])ccc1Cl 21027370 RYQZPHAODQCOJC-UHFFFAOYSA-N 499.932 5.307 5 20 JKBD C[C@@H](OC(=O)c1occc1COc1ccccc1)C(=O)Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1 21704008 NRMFENLZWFXTFK-OAHLLOKOSA-N 493.497 5.074 5 20 JKBD COc1cc(C(=O)NCC2(c3ccc(Cl)cc3)CCC2)c([N+](=O)[O-])cc1OCc1cscn1 72087334 SYUASGVFLMQBOD-UHFFFAOYSA-N 487.965 5.144 5 20 JKBD Cc1cc(NC(=O)c2ccc(SCc3cn4ccccc4n3)cc2)n(-c2ccc([N+](=O)[O-])cc2)n1 105583500 MWQAOUBVMDSFOV-UHFFFAOYSA-N 484.541 5.281 5 20 JKBD C[C@@H](Sc1ncc(-c2ccccc2)n1CC(F)(F)F)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl 109622524 QRQKVIUIGFKJJC-GFCCVEGCSA-N 484.887 5.793 5 20 JKBD O=C1CCCc2cc(NC(=O)c3ccc(Oc4ccc(Cl)cc4[N+](=O)[O-])cc3)ccc2N1 483895812 NVGWOCOQWDGZFV-UHFFFAOYSA-N 451.866 5.568 5 20 JKBD CNC(=O)c1cc(NC(=O)c2ccc(Sc3nc4ccccc4s3)c([N+](=O)[O-])c2)ccc1Cl 489218802 BBCNCQPOWOESMU-UHFFFAOYSA-N 498.973 5.621 5 20 JKBD CN(Cc1cccc(C(F)(F)F)c1)C1CCN(C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)CC1 490111584 JEXOOZJOGWVKAJ-UHFFFAOYSA-N 477.508 5.565 5 20 JKBD O=C(NCC1(c2c(F)cccc2F)CCCC1)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-] 500116534 CEZCVRLYBWUETG-UHFFFAOYSA-N 458.383 5.056 5 20 JKBD COc1ccc(Oc2ccc([N+](=O)[O-])cc2C(=O)N2CCC(Oc3ccc(F)cc3F)CC2)cc1 501682322 MDUNYCZGWAOUCS-UHFFFAOYSA-N 484.455 5.358 5 20 JKBD C[C@@H](COc1ccccc1C(F)(F)F)NC(=O)c1ccc(N[C@H](C)c2ccccn2)c([N+](=O)[O-])c1 507980568 SKJOOEQDMLPVMR-JKSUJKDBSA-N 488.466 5.379 5 20 JKBD Cc1cccn2c(NC(=O)c3ccc([N+](=O)[O-])cc3I)c(-c3ccccc3)nc12 508766240 WHTLAXZIQJSQFT-UHFFFAOYSA-N 498.280 5.075 5 20 JKBD CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)NCC1(c2cccc(Br)c2)CCOCC1 509448926 GPOJSCHBQSUTMT-UHFFFAOYSA-N 490.398 5.026 5 20 JKBD CCN(C(=O)c1cc(OC)c(OCc2cscn2)cc1[N+](=O)[O-])[C@@H](C)c1cc2ccccc2o1 511486833 ITAJOLGMYOTNKG-HNNXBMFYSA-N 481.530 5.608 5 20 JKBD C[C@@H](Sc1nnc(-c2ccncc2)n1-c1ccc(Cl)cc1)C(=O)Nc1ccccc1[N+](=O)[O-] 513844363 TYQULADTTUPIJI-CQSZACIVSA-N 480.937 5.010 5 20 JKBD O=C(c1oc2ccccc2c1CSc1cccs1)N1CCN(c2ccc([N+](=O)[O-])nc2)CC1 520675273 ZQJHVDVCRVVOFP-UHFFFAOYSA-N 480.571 5.052 5 20 JKBD COc1ccc(CC[C@@H]2CCCCN2C(=O)c2csc(-c3cccc([N+](=O)[O-])c3)n2)cc1OC 523842428 BDXKPXQAQBVIFO-IBGZPJMESA-N 481.574 5.363 5 20 JKBD Cc1cccc2c1CC[C@@H]2NC(=O)c1ccc(C(=O)N[C@@H]2CCc3c(C)cccc32)cc1[N+](=O)[O-] 552228016 AJTYCCGTKFCKTN-RPBOFIJWSA-N 469.541 5.046 5 20 JKBD Cc1sc(NC(=O)c2cc(OCC(F)(F)F)ccc2[N+](=O)[O-])nc1-c1cccc(Cl)c1 560286890 WCLQWPXEGRURIP-UHFFFAOYSA-N 471.844 5.874 5 20 JKBD O=C(Nc1ccccc1-c1nc2ccccc2[nH]1)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-] 603727430 GACBBUBHPOOAAF-UHFFFAOYSA-N 456.380 5.332 5 20 JKBD COc1cccc(N2CC[C@@H](CNCc3ccc(Oc4ccc(F)cc4)c([N+](=O)[O-])c3)C2)c1 608837853 RAIAZPNZRZTXHK-IBGZPJMESA-N 451.498 5.151 5 20 JKBD COc1cc(CSc2nnc(Cc3c(F)cccc3Cl)o2)c([N+](=O)[O-])cc1OC(F)F 608929813 UIKGOFGUGYOXDX-UHFFFAOYSA-N 475.832 5.263 5 20 JKBD CC1CCN(c2ccc(C(=O)N3CCC([C@@H]4C(=O)Nc5cc(Cl)ccc54)CC3)cc2[N+](=O)[O-])CC1 608971616 NIKQLHGZRPRPAT-DEOSSOPVSA-N 496.995 5.073 5 20 JKBD O=C(CCc1nc(-c2ccsc2)no1)Oc1ccc2c(-c3ccc([N+](=O)[O-])cc3)cc(=O)oc2c1 728021964 LFOLAMMOHUXBTG-UHFFFAOYSA-N 489.465 5.018 5 20 JKBD CC(=O)Nc1cccc([C@H](C)N(Cc2ccccc2)C(=O)c2cc([N+](=O)[O-])c(C)c([N+](=O)[O-])c2C)c1 748617431 JFJYXXSLVWIEPJ-SFHVURJKSA-N 490.516 5.482 5 20 JKBD O=C(CSc1nc2ccc([N+](=O)[O-])cc2s1)Nc1ccc(NC(=O)c2cccs2)cc1 749748454 BXSFIYCRAUPOPN-UHFFFAOYSA-N 470.557 5.249 5 20 JKBD CCn1c(CN[C@@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2ccccc2)nc2ccccc21 750297406 PMGODAYRCZWGDB-HSZRJFAPSA-N 463.925 5.087 5 20 JKBD Cc1nc(CSc2ccccc2C(=O)OCC2CCN(c3ccc([N+](=O)[O-])cn3)CC2)cs1 750428937 VLCXISGQFJDENX-UHFFFAOYSA-N 484.603 5.120 5 20 JKBD O=C(OCc1cc(=O)c(O)co1)c1c2c(nc3ccccc13)/C(=C\c1ccc([N+](=O)[O-])cc1)CCC2 752151631 ZVVYKYYFBSCAST-ATVHPVEESA-N 484.464 5.036 5 20 JKBD O=C(COC(=O)c1cc([N+](=O)[O-])ccc1N1CCCCC1)Nc1ccc(Cl)cc1C(F)(F)F 823290079 CUTVWBDIYKHUGR-UHFFFAOYSA-N 485.846 5.053 5 20 JKBD COc1c([N+](=O)[O-])cc(NC2CCN(Cc3ccc(Cl)cc3)CC2)c([N+](=O)[O-])c1Br 836182551 FKCPNKNUYBCBFN-UHFFFAOYSA-N 499.749 5.004 5 20 JKBD O=[N+]([O-])c1cc(I)cc(-c2nc(-c3cccnc3Oc3ccccc3)no2)c1 904452772 OZZAPAXJFURMGB-UHFFFAOYSA-N 486.225 5.104 5 20 JKBD C[C@H](OC(=O)c1sc2cc(C(F)(F)F)ccc2c1Cl)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 914963444 HIFRHVNHCXWCLH-VIFPVBQESA-N 497.838 6.450 5 20 JKBD COc1ccc(/C=C2/NC(=S)N(c3ccccc3Cl)C2=O)cc1OCc1ccc([N+](=O)[O-])cc1 917096500 UBYGMVFIGWQACC-XDHOZWIPSA-N 495.944 5.098 5 20 JKBD O=C(Cc1cc([N+](=O)[O-])ccc1F)NC1(c2ccc(NC(=O)c3cc4sccn4c3)cc2)CCC1 1788411092 SGGQDRMAFBVQPX-UHFFFAOYSA-N 492.532 5.039 5 20 JKBD O=C(CCc1cccc([N+](=O)[O-])c1)NC1(c2ccc(NC(=O)c3cccc4cnccc34)cc2)CCC1 1789325161 BSYKLGPKVMWRGX-UHFFFAOYSA-N 494.551 5.524 5 20 JKBD O=C(Cc1cccc([N+](=O)[O-])c1)NC1(c2ccc(NC(=O)[C@@H]3[C@H]4Sc5ccccc5[C@H]43)cc2)CCC1 1789527654 AIXZUHBREBYNOM-GSDHBNRESA-N 499.592 5.159 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)c3ccnc(C(F)F)c3)CCC2)cc1)c1cc(F)cc([N+](=O)[O-])c1 1790696564 JHIMBMMMWJYSTO-UHFFFAOYSA-N 484.434 5.128 5 20 JKBD O=C(NC1(c2ccc(NC(=O)c3cc4cc([N+](=O)[O-])ccc4s3)cc2)CCC1)c1cncs1 1791009861 BKKWGYZSVXKKKM-UHFFFAOYSA-N 478.555 5.328 5 20 JKBD O=C(CC1CCCC1)N1CCCC2(CCN(C(=O)c3cc4cc([N+](=O)[O-])ccc4s3)CC2)C1 1808939236 PFLIDAZXILSOGA-UHFFFAOYSA-N 469.607 5.235 5 20 JKBD Cc1c(C(=O)NC[C@@H]2CCN(C(=O)[C@H]3CC[C@H](C)CC3)[C@H]2c2cccnc2)cc(Cl)cc1[N+](=O)[O-] 1811796075 CTXIAYLNILNXAQ-ILXZRYGISA-N 499.011 5.098 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2sccc2Cl)n[nH]1 1819957385 LCUIDXXMPKSYHM-INIZCTEOSA-N 491.932 5.100 5 20 JKBD O=C(Cc1cc(F)ccc1[N+](=O)[O-])N1CCC([C@@H]2CCCCN2C(=O)c2ccc(C3CC3)cc2)CC1 1830752888 QTAZGLYXKSGIPM-VWLOTQADSA-N 493.579 5.087 5 20 JKBD Cc1cc(Cl)c(Cl)cc1C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2ccc([N+](=O)[O-])[nH]2)CC1 1830784767 UTUFHIRIBNWYTF-FQEVSTJZSA-N 493.391 5.085 5 20 JKBD COc1cc(C(=O)N2CCCC[C@H]2C2CCN(C(=O)/C(C)=C/c3cccs3)CC2)ccc1[N+](=O)[O-] 1832694401 IPKYIESSFNNOLQ-BKELBIJQSA-N 497.617 5.002 5 20 JKBD CCCn1c(S[C@H](C)C(=O)Nc2ccc(F)c([N+](=O)[O-])c2)nnc1-c1ccc(Cl)cc1 9139285 QSYKWVJIEOPVDA-GFCCVEGCSA-N 463.922 5.175 5 20 JKBD CC(C)N(C(=O)COC(=O)C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)C(C)C 18494131 JRAWYIQYCDHWSY-UYRXBGFRSA-N 481.574 5.324 5 20 JKBD Cc1nc(-c2cccs2)c(CC(=O)O[C@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2C(F)(F)F)s1 22104246 LSTAVLHGLXBUTC-SNVBAGLBSA-N 499.492 5.220 5 20 JKBD Cc1cccc([N+](=O)[O-])c1NC(=O)COC(=O)c1c2c(nc3ccccc13)/C(=C/c1cccs1)CC2 28786898 SWAADBZTOYINPR-SAPNQHFASA-N 499.548 5.795 5 20 JKBD NC(=O)c1ccc(NC(=O)c2ccc(Sc3nc4ccccc4s3)c([N+](=O)[O-])c2)cc1Cl 31954971 AOWNASYYPKJLJX-UHFFFAOYSA-N 484.946 5.360 5 20 JKBD O=C(Cn1c2ccccc2c(=O)c2ccccc21)Nc1cccc(NC(=O)c2cccs2)c1 45780316 SANMRMPABDRJMQ-UHFFFAOYSA-N 453.523 5.107 5 20 JKBD Cc1sc(NC(=O)CCc2ncc(-c3ccccc3Cl)o2)nc1-c1cccc([N+](=O)[O-])c1 195704198 DLSMNUHGGGFROM-UHFFFAOYSA-N 468.922 5.906 5 20 JKBD C[C@H](Nc1ccc(C(=O)Nc2cccc(NC(=O)c3ccccc3)c2)cc1[N+](=O)[O-])c1ccccn1 507404684 PPOHFLNYUIAVAZ-SFHVURJKSA-N 481.512 5.668 5 20 JKBD CCOC(=O)c1c(NC(=O)c2ccc([N+](=O)[O-])cc2C)sc(C(=O)Nc2ccc(C)cc2C)c1C 508914534 DGOTVHVQQFMHCF-UHFFFAOYSA-N 495.557 5.571 5 20 JKBD COc1cc(/C=C(/CC(=O)O)c2nc3cc(C(F)(F)F)ccc3s2)c([N+](=O)[O-])cc1OC 520764258 SEFFBFURSYNLMF-WZUFQYTHSA-N 468.409 5.256 5 20 JKBD O=C(CSc1ccc([N+](=O)[O-])cc1)Nc1ccc(CN2C(=O)Cc3ccc(Cl)cc32)cc1 521125581 YDGDZJBFURXBLP-UHFFFAOYSA-N 467.934 5.068 5 20 JKBD COc1ccccc1N1CCC(NC(=O)c2cc([N+](=O)[O-])ccc2Sc2ccccc2)CC1 522088015 DVOCXZAIWVZAMU-UHFFFAOYSA-N 463.559 5.153 5 20 JKBD O=C(c1ccc(Sc2nc3ccccc3s2)c([N+](=O)[O-])c1)N1CCC[C@@H]1c1ccccn1 604345769 GSCCPSDNKIUJSB-GOSISDBHSA-N 462.556 5.728 5 20 JKBD CCC[C@H](NC(=O)C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)c1ccccn1 609179959 XSJRPWREQGKWKO-MHZRJXOASA-N 472.570 6.188 5 20 JKBD Cc1ccc(Cc2cnc(NC(=O)Cn3c4ccccc4c(=O)c4ccccc43)s2)cc1C 611913767 KVVFUVDHCPVJJP-UHFFFAOYSA-N 453.567 5.458 5 20 JKBD COc1cccc(NCc2nnc(SCC(=O)c3cccc([N+](=O)[O-])c3)n2C2CCCCC2)c1 612393236 RCRYPICNHSRLDS-UHFFFAOYSA-N 481.578 5.287 5 20 JKBD CC(=O)N1CCN(c2ccccc2CNCc2c3ccccc3c(Cl)c3ccccc23)CC1 725852508 CCHCYBCZYOVFTJ-UHFFFAOYSA-N 458.005 5.605 5 20 JKBD O=C(Cc1csc(-c2cc(Br)cs2)n1)Nc1ccc([N+](=O)[O-])c(Cl)c1 727711622 NLQDOMKTJAZANX-UHFFFAOYSA-N 458.746 5.377 5 20 JKBD CC(=O)N1C=Cc2ccccc2[C@@H]1CC(=O)Nc1cc(Cl)c([N+](=O)[O-])cc1OCc1ccccc1 727961168 IENSNYCSFXATEX-QHCPKHFHSA-N 491.931 5.730 5 20 JKBD Cc1ccc(C(=O)Nc2nc3ccc(NC(=O)c4cc([N+](=O)[O-])c(C)c([N+](=O)[O-])c4)cc3s2)s1 729177727 CPRSKPUSMGJWNT-UHFFFAOYSA-N 497.514 5.296 5 20 JKBD COc1cc(CNc2cc(C(=O)N(C)C(C)C)ccc2Cl)c([N+](=O)[O-])cc1OCC(F)(F)F 864003162 FMGMBYSPNCEZIY-UHFFFAOYSA-N 489.878 5.290 5 20 JKBD Cc1cc(C(=O)N2CCC[C@@H]2c2nc(-c3cccnc3Oc3ccccc3)no2)ccc1[N+](=O)[O-] 904452692 MRPOLQDAACVQKK-OAQYLSRUSA-N 471.473 5.118 5 20 JKBD CSc1ccc(C(=O)c2ccccc2C(=O)N2CCC([C@@H](O)c3ccccc3)CC2)cc1[N+](=O)[O-] 914536090 HYVIAOXAZKZLJU-VWLOTQADSA-N 490.581 5.134 5 20 JKBD Cc1c(C(=O)O[C@@H](C)C(=O)N2c3ccccc3Sc3ccccc32)cc([N+](=O)[O-])cc1[N+](=O)[O-] 919227974 UDDDWOZKGLTTJI-AWEZNQCLSA-N 479.470 5.186 5 20 JKBD C[C@H](OC(=O)CCOc1ccc(Cl)cc1Cl)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 919490129 DOYRISRNGSUQOD-NSHDSACASA-N 452.250 5.025 5 20 JKBD CC(=O)N(c1nc(COC(=O)c2ccc([N+](=O)[O-])cc2F)cs1)c1c(C)cc(C)cc1Cl 919569157 DKXPYLIKLFNHQM-UHFFFAOYSA-N 477.901 5.502 5 20 JKBD C[C@H](OC(=O)c1ccc(N[C@H](C)c2ccccn2)c([N+](=O)[O-])c1)C(=O)Nc1ccc(F)cc1Cl 920544568 CVHQYVLLXYFGNK-KGLIPLIRSA-N 486.887 5.139 5 20 JKBD O=C(CCc1cccc([N+](=O)[O-])c1)NC1(c2ccc(NC(=O)c3cc(F)cnc3Cl)cc2)CCC1 1789716973 RXQSCXQAMMIWJE-UHFFFAOYSA-N 496.926 5.163 5 20 JKBD Cc1c[nH]cc1C(=O)NC1(c2ccc(NC(=O)c3ccc(Br)c([N+](=O)[O-])c3)cc2)CCC1 1790642495 YLIQLAFCUFSPOF-UHFFFAOYSA-N 497.349 5.055 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)c3cccc4cnccc34)CCC2)cc1)c1cccc(F)c1[N+](=O)[O-] 1790700917 AALHJMLUBBBJOC-UHFFFAOYSA-N 484.487 5.344 5 20 JKBD Cc1ccc(C(=O)NC2(c3ccc(NC(=O)c4c(F)ccc([N+](=O)[O-])c4C)cc3)CCC2)c(C)n1 1790772106 DGNCLLXJCDHUNB-UHFFFAOYSA-N 476.508 5.116 5 20 JKBD O=C(Nc1cc([C@@H]2CCCCN2C(=O)CSc2ccccc2[N+](=O)[O-])[nH]n1)c1ccc(Cl)cc1 1820564552 YPLGBBDITKLFKJ-SFHVURJKSA-N 499.980 5.070 5 20 JKBD CC(C)=CCCC(=O)N1CCC([C@H]2CCCCN2C(=O)CSc2ccccc2[N+](=O)[O-])CC1 1831777291 NYSODGPBXCJHNA-OAQYLSRUSA-N 473.639 5.053 5 20 JKBD CCCCn1c(S[C@@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)nnc1-c1ccc(OC)cc1 9482335 GIGJAFIDQULQRM-AWEZNQCLSA-N 489.985 5.435 5 20 JKBD C[C@H](c1nc2ccccc2s1)N(C)C(=O)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 15094627 QFYSGLDKQHHYTF-CQSZACIVSA-N 492.523 5.659 5 20 JKBD Cc1nn(Cc2ccc(C(=O)OCc3ncc(-c4ccc(Cl)cc4)o3)cc2)c(C)c1[N+](=O)[O-] 17159444 DEELLCQSLJMMQG-UHFFFAOYSA-N 466.881 5.122 5 20 JKBD Cc1cccc([N+](=O)[O-])c1NC(=O)CSc1nc2cc(Cl)ccc2c(=O)n1C1CCCCC1 21137152 BWLNAZSMGUMMOW-UHFFFAOYSA-N 486.981 5.503 5 20 JKBD O=C(OCc1nnc(-c2ccc([N+](=O)[O-])cc2)o1)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1 21229709 FCIMYJKRMGFLQA-UHFFFAOYSA-N 496.819 5.356 5 20 JKBD COc1ccc(NC(=O)CSc2nnc(SCc3ccc(C(C)C)cc3)s2)c([N+](=O)[O-])c1 24205020 WEXLKNQDMCCSQP-UHFFFAOYSA-N 490.632 5.601 5 20 JKBD O=C(Nc1cccc(NC(=O)C2CC2)c1)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1 46576874 ZHNZXLIEKFVKHM-UHFFFAOYSA-N 451.866 5.641 5 20 JKBD CCOc1ccc(Br)cc1N[C@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 303160115 HLYQBGHTQYXQOI-SNVBAGLBSA-N 476.249 5.214 5 20 JKBD CN(C(=O)CSc1ccc(C(F)(F)F)cc1[N+](=O)[O-])[C@@H](c1ccccc1)C(F)(F)F 303191299 MESBWNYLUALQQH-INIZCTEOSA-N 452.376 5.468 5 20 JKBD Cc1ccc2c(c1C)OC[C@@H]2N[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1 477031268 HCLPTUIYTGZSLK-VXKWHMMOSA-N 451.910 5.268 5 20 JKBD O=C(C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)NCc1ccc(OC(F)F)cc1 489292987 OOBPQANERLTGKO-QGOAFFKASA-N 495.507 6.053 5 20 JKBD CN(C(=O)c1ccc(NC(=O)c2csc(-c3cccc([N+](=O)[O-])c3)n2)cc1)C1CCCCC1 496613558 VNHQYKHBRRYUMU-UHFFFAOYSA-N 464.547 5.375 5 20 JKBD O=C(Nc1ccccc1)c1ccc(Cl)c(NC(=O)C2CCN(c3ccccc3[N+](=O)[O-])CC2)c1 502713294 RSTWENWNULHMPS-UHFFFAOYSA-N 478.936 5.356 5 20 JKBD Cc1cccc([N+](=O)[O-])c1NC(=O)CSc1nnc(-c2ccco2)n1[C@H](C)[C@@H]1C[C@H]2CC[C@H]1C2 515308968 LBESZUOHDVZAGO-OWSLCNJRSA-N 481.578 5.483 5 20 JKBD Cc1nc(-c2ccc(C(F)(F)F)cc2)sc1C(=O)Nc1cc2c(cc1[N+](=O)[O-])OCCCO2 591741464 MYIRCAMXFSFXLQ-UHFFFAOYSA-N 479.436 5.459 5 20 JKBD CS(=O)(=O)c1ccc(C(=O)N(c2cccc(Cl)c2)c2nc3ccccc3s2)cc1[N+](=O)[O-] 601864860 LARQGYJIQSGTLO-UHFFFAOYSA-N 487.946 5.240 5 20 JKBD COc1cccc([C@@H](CNC(=O)c2ccc([N+](=O)[O-])cc2Cl)c2c[nH]c3ccccc23)c1OC 603470031 ILIFOLGJAJOJNO-HXUWFJFHSA-N 479.920 5.309 5 20 JKBD COc1cc(C)ccc1NC(=O)C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1 604006808 YNXBZGDNHXLEGZ-JXAWBTAJSA-N 459.527 6.091 5 20 JKBD C[C@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)Nc1ccccc1Oc1ncc(Cl)cc1Cl 604448249 XQJGXAKGXNTMSL-NSHDSACASA-N 482.707 6.148 5 20 JKBD COC(=O)[C@@H](c1ccc(Cl)c(Cl)c1)N(C)C(=O)c1csc(-c2cccc([N+](=O)[O-])c2)n1 604570417 XAEFUTKWHGOLSY-QGZVFWFLSA-N 480.329 5.011 5 20 JKBD O=C(C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)N1CCCO[C@H](c2ccccc2)C1 609230560 LGXRQLPNOSHXFQ-MSMNXAATSA-N 499.592 6.125 5 20 JKBD COc1ccc(-c2[nH]c3ccccc3c2CCC(=O)Nc2cc3c(cc2[N+](=O)[O-])OCCCO3)cc1 619215529 CYHBJQLGLDUXDR-UHFFFAOYSA-N 487.512 5.484 5 20 JKBD COc1ccc(NC(C)=O)cc1NC(=O)[C@H](C)Sc1nc2ccccc2c2nc3ccccc3n12 662251582 FWYOKFWFQKCXSR-HNNXBMFYSA-N 485.569 5.122 5 20 JKBD Cc1ccc(/C(O)=C(/C(=S)Nc2ccccc2-c2ccccc2)[n+]2cc(O)ccc2C)cc1[N+](=O)[O-] 725763835 OKSDZGFGGYMRIF-UHFFFAOYSA-O 498.584 6.195 5 20 JKBD Cc1ccccc1NC(=O)[C@@H]1CCc2ccccc2N1C(=O)c1cc([N+](=O)[O-])ccc1Br 726918337 JOSVJESKIMWVDW-QFIPXVFZSA-N 494.345 5.266 5 20 JKBD CC(C)CCSc1ccc(C(=O)N2CC[C@@H](CN(C)C(=O)OC(C)(C)C)C2)cc1[N+](=O)[O-] 729386644 BUPSYVXNOWBLAE-KRWDZBQOSA-N 465.616 5.062 5 20 JKBD CN(C(=O)OC(C)(C)C)C1CCN(C(=O)c2ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])cc2)CC1 730559505 KZGWNBHNYKKVEN-UHFFFAOYSA-N 489.956 5.512 5 20 JKBD Cc1cc(NC(=O)c2ccc(N[C@H](C)c3ccccn3)c([N+](=O)[O-])c2)ccc1N1CCSCC1 749819107 QNJQUNKVBOVGMM-GOSISDBHSA-N 477.590 5.277 5 20 JKBD Cn1cnc([N+](=O)[O-])c1Sc1nnc(CSc2nc3ccccc3s2)n1Cc1ccccc1 799715052 BGUBMRSCYGBXND-UHFFFAOYSA-N 495.615 5.021 5 20 JKBD O=[N+]([O-])c1cc(Cl)ccc1OCCc1nc(-c2cccc(Cn3cnc4ccccc43)c2)no1 904492711 OYLOREXDQODNBX-UHFFFAOYSA-N 475.892 5.318 5 20 JKBD COc1cccc([C@@H](CNC(=O)/C=C\c2ccc([N+](=O)[O-])cc2)c2c[nH]c3ccccc23)c1OC 912664138 XFLRTVYEORDMQK-MGYADMTCSA-N 471.513 5.055 5 20 JKBD Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)c1cc(S(=O)(=O)N(C)c2ccc(F)cc2)ccc1Cl 913416858 XQZXARQKBQOBMH-UHFFFAOYSA-N 491.928 5.082 5 20 JKBD Cc1noc(C)c1CN(C)C(=O)c1c2c(nc3ccccc13)/C(=C/c1cccc([N+](=O)[O-])c1)CCC2 915195365 WVLOAMIHMAAVRM-XSFVSMFZSA-N 482.540 5.897 5 20 JKBD C[C@@H](OC(=O)c1cccc(NC(=O)C2CCCCC2)c1)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 915435062 AEGCFAZSRPLAEN-OAHLLOKOSA-N 464.478 5.082 5 20 JKBD COc1cc(/C=C\C(=O)O[C@@H](C)c2ccc([N+](=O)[O-])cc2)ccc1OCc1c(C)noc1C 920155040 GZCYFYCXCHRWGB-VDTUPGDHSA-N 452.463 5.105 5 20 JKBD Cc1ccccc1N1C(=O)/C(=C\c2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)c2ccccc2C1=O 920397005 GFVVAIDQVNGPCV-HAHDFKILSA-N 464.481 5.031 5 20 JKBD C[C@@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)Nc1ccc(-c2nnc3n2CCCCCC3)cc1 920766186 SBGSVUOYSDWNGD-OAHLLOKOSA-N 469.929 5.029 5 20 JKBD O=C(Cc1cccc([N+](=O)[O-])c1)NC1(c2ccc(NC(=O)c3ncc(Cl)cc3Cl)cc2)CCC1 1785788112 WVAMMCQACZGFOU-UHFFFAOYSA-N 499.354 5.287 5 20 JKBD O=C(CCOc1ccc(F)cc1)Nc1ccc(C2(NC(=O)c3cc(F)cc([N+](=O)[O-])c3)CCC2)cc1 1785986995 GSVDURQMBBIFCS-UHFFFAOYSA-N 495.482 5.090 5 20 JKBD O=C(Cc1cc([N+](=O)[O-])ccc1F)Nc1ccc(C2(NC(=O)[C@@H]3CCCCC3(F)F)CCC2)cc1 1786669953 NXVNVAZCLUZSEN-FQEVSTJZSA-N 489.494 5.236 5 20 JKBD Cc1cc(C(=O)Nc2ccc(C3(NC(=O)c4cc(F)cc([N+](=O)[O-])c4)CCC3)cc2)c(C)o1 1787346277 SCZFTHAQOGGERW-UHFFFAOYSA-N 451.454 5.005 5 20 JKBD Cc1cc2nc(C(=O)Nc3ccc(C4(NC(=O)/C=C/c5ccc([N+](=O)[O-])o5)CCC4)cc3)[nH]c2cc1C 1789468361 IAXFLJZSOIKETI-CSKARUKUSA-N 499.527 5.142 5 20 JKBD CC[C@H](C)[C@H](C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)Cc1ccc(Cl)cc1[N+](=O)[O-])c1ccccc1 1793078091 GJEQFJBBLNYXIF-IRVQMQQFSA-N 498.023 5.259 5 20 JKBD O=C(CCc1cccc([N+](=O)[O-])c1)N1CCCC2(CCN(C(=O)[C@@H]3CCC[C@@H]4CCCC[C@@H]43)CC2)C1 1806490065 GPTXRSQFEWTCEK-AYRHNUGRSA-N 495.664 5.365 5 20 JKBD C/C(=C\c1cccs1)C(=O)N1CCCC[C@H]1c1cc(NC(=O)CCc2cccc([N+](=O)[O-])c2)n[nH]1 1815535747 HRKCIDMPDPEUEJ-QMPJNXRZSA-N 493.589 5.108 5 20 JKBD CC(C)c1ccc(CC(=O)Nc2cc([C@@H]3CCCCN3C(=O)c3ccc([N+](=O)[O-])cc3F)[nH]n2)cc1 1822137970 GKXHBLCYQDMXFE-QHCPKHFHSA-N 493.539 5.129 5 20 JKBD CC(C)c1csc(C(=O)N2CCC([C@H]3CCCCN3C(=O)CCc3cccc([N+](=O)[O-])c3)CC2)n1 1824838525 KDGGIOGLLIHRHX-HSZRJFAPSA-N 498.649 5.041 5 20 JKBD CC[C@H]1CC[C@H](C(=O)N2CCCC[C@H]2C2CCN(C(=O)c3cc(N(C)C)ccc3[N+](=O)[O-])CC2)CC1 1831696758 XWZJIAHPVJBJDN-XTJBDQBJSA-N 498.668 5.111 5 20 JKBD CCn1c(S[C@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2C(F)(F)F)nnc1-c1ccccc1 9485125 MCEDBVUTENGKRQ-GFCCVEGCSA-N 465.457 5.011 5 20 JKBD Cc1ccc(NC(=O)[C@H](Sc2nnc(-c3c[nH]c4ccccc34)o2)c2ccccc2)c([N+](=O)[O-])c1 11346833 SGXBGTKCRNCCFH-JOCHJYFZSA-N 485.525 5.907 5 20 JKBD COCCOc1ccc(NC(=O)c2ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])c(OC)c2)cc1 106163986 QGYPSJYLKPFYQM-UHFFFAOYSA-N 472.881 5.327 5 20 JKBD C[C@H](NC(=O)c1sc(-c2ccccc2)cc1OCC(=O)N1CCCCC1)c1cccc([N+](=O)[O-])c1 108291992 JGOHRGCZRBLBHH-SFHVURJKSA-N 493.585 5.206 5 20 JKBD Cc1ccc(-c2csc3ncnc(SCC(=O)N(C)c4ccc([N+](=O)[O-])cc4)c23)cc1 478147858 RYBQGCFJGMEYHI-UHFFFAOYSA-N 450.545 5.330 5 20 JKBD C[C@H]1CCCCN1C(=O)c1ccc(NC(=O)c2ccc(NCc3ccccc3)c([N+](=O)[O-])c2)cc1 489454103 DMPYIABJHNAVOO-IBGZPJMESA-N 472.545 5.474 5 20 JKBD CCCOc1ccccc1Oc1ncccc1CNC(=O)C1CCN(c2ccccc2[N+](=O)[O-])CC1 502276961 AXEZQMOBBUGCPO-UHFFFAOYSA-N 490.560 5.104 5 20 JKBD COc1ccc([N+](=O)[O-])cc1NC(=O)[C@@H]1C[C@@H]2CCCC[C@H]2N1C(=O)c1ccc2ccccc2c1 508778688 NOMNBYJYFKOQKD-IEXUWNMDSA-N 473.529 5.169 5 20 JKBD CCOc1cc(CN[C@@H]2CCCc3occc32)ccc1OCc1cc([N+](=O)[O-])cc2c1OCOC2 509618912 NSXHMRYICXPXNR-JOCHJYFZSA-N 480.517 5.199 5 20 JKBD CC(C)N(Cc1ccc(Br)cc1)C(=O)Cn1c2ccccc2c(=O)c2ccccc21 510116875 CASIXTSIIGCPQU-UHFFFAOYSA-N 463.375 5.354 5 20 JKBD CCOc1ccc([C@@H]2CCCN2C(=O)c2cc(OC)c(OCc3cscn3)cc2[N+](=O)[O-])cc1 512305368 DHACKOIVCQNYGM-FQEVSTJZSA-N 483.546 5.015 5 20 JKBD C[C@H](Sc1nc2ccccc2c2nc3ccccc3n12)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 514846771 XTLXLGVMBVVSJB-AWEZNQCLSA-N 468.498 5.847 5 20 JKBD O=C(Nc1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2Sc2ccc(Cl)cc2)cc1)NC1CC1 514980681 LYDANHXWQNQAHB-UHFFFAOYSA-N 482.949 5.936 5 20 JKBD COc1ccc([N+](=O)[O-])c(C(=O)Nc2ccc(NC(=O)c3ccc(F)cc3)cc2C(F)(F)F)c1 516756802 BNVOLFJVTGATPN-UHFFFAOYSA-N 477.370 5.266 5 20 JKBD O=C(C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)N1CC[C@@H](N2CCCCC2)C1 518086816 DYIRKJTWNUGMMP-JXAXNMIRSA-N 476.602 5.222 5 20 JKBD Cc1cc(C(=O)N2CCC[C@@H](C)C2)ccc1NC(=O)c1cc([N+](=O)[O-])ccc1Sc1ccccc1 519986476 PGJCYNJTXFKPHK-GOSISDBHSA-N 489.597 6.179 5 20 JKBD CN(Cc1cccc(NS(=O)(=O)c2ccccc2)c1)C(=O)c1cc2ccccc2c2cccnc12 589969028 ZDQDSVQQLNQEHS-UHFFFAOYSA-N 481.577 5.461 5 20 JKBD C[C@H](NC(=O)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-])c1ccc(OCc2cccnc2)cc1 603692141 RBNFMWRUVFTGGF-HNNXBMFYSA-N 475.423 5.001 5 20 JKBD Cc1cccc(C(=O)Nc2nc(-c3cccc([N+](=O)[O-])c3)c(C)s2)c1I 603997487 KUZINUWNRKUGOX-UHFFFAOYSA-N 479.299 5.192 5 20 JKBD Cc1nc(CSc2ccccc2C(=O)Nc2nc(-c3cccc([N+](=O)[O-])c3)c(C)s2)cs1 603997572 OSBYWYLECKIEJF-UHFFFAOYSA-N 482.612 6.336 5 20 JKBD Cc1cccc(-n2ncc(C(=O)Nc3nc(-c4cccc([N+](=O)[O-])c4)c(C)s3)c2C(F)(F)F)c1 603997624 RSTWJQJRPSHIJU-UHFFFAOYSA-N 487.463 5.792 5 20 JKBD C[C@H](NCc1ccccc1CN1CCCC[C@H]1C)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 604045295 MSCQUZCOMJTKPY-SJORKVTESA-N 478.515 5.105 5 20 JKBD CCOc1cc(NC(=O)c2cc(C(C)C)nc3c2cnn3C(C)C)c([N+](=O)[O-])cc1OCC 619213096 NNSKKCZDDYLPHS-UHFFFAOYSA-N 455.515 5.094 5 20 JKBD Cc1ccc(NC(=O)[C@H](OC(=O)Cc2nc(-c3ccsc3)oc2C)c2ccccc2)c([N+](=O)[O-])c1 727023606 SPVUXEVXKPXEHT-HSZRJFAPSA-N 491.525 5.394 5 20 JKBD Cc1ccc(NC(=O)c2cccc(OC(=O)c3csc(-c4ccc([N+](=O)[O-])cc4)n3)c2)cc1 727327454 HEHOAZNFLQWQAO-UHFFFAOYSA-N 459.483 5.498 5 20 JKBD C[C@H](NC(=O)CCC(=O)c1ccc2ccc3cccc4ccc1c2c34)c1cccc(S(N)(=O)=O)c1 727764919 UWHBJDHBXRODPM-KRWDZBQOSA-N 484.577 5.072 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)Nc2ccccc2C(=O)Nc2cccc(C)c2)cc1SC 728458285 IGLWAPFQVYWSOJ-UHFFFAOYSA-N 451.504 5.138 5 20 JKBD O=C(/C=C\c1ccc([N+](=O)[O-])cc1)N[C@@H](C(=O)Nc1ccc(Br)cc1F)c1ccccc1 751231016 NVZCOFKXBUTWJP-NGHDKMLMSA-N 498.308 5.006 5 20 JKBD CC(C)(C)c1ccc(/C=C\C(=O)OCC(=O)Nc2ccc([N+](=O)[O-])cc2C(F)(F)F)cc1 904679329 XOJGRIPLIIGKIS-WDZFZDKYSA-N 450.413 5.106 5 20 JKBD O=C(Nc1ccccc1C(=O)Nc1ccc(C(F)(F)F)cc1)c1ccc([N+](=O)[O-])cc1Cl 912715699 GIJQSNFSNSUHTR-UHFFFAOYSA-N 463.799 5.772 5 20 JKBD O=[N+]([O-])c1cc(S(=O)(=O)N(Cc2cc(-c3ccccc3)no2)c2ccccc2)ccc1Cl 913029592 BKGSBGKKQFIBLJ-UHFFFAOYSA-N 469.906 5.299 5 20 JKBD Cc1cccc([N+](=O)[O-])c1NC(=O)COC(=O)c1ccccc1OCc1ccc(Br)cc1 915545308 KVRKLVHHKWQCGA-UHFFFAOYSA-N 499.317 5.040 5 20 JKBD O=C(C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)NCc1cccnc1-n1ccnc1 918043361 SFNNKQGGNWLLJO-XSFVSMFZSA-N 496.552 5.032 5 20 JKBD Cc1nn(-c2ccccc2)c2ncc(C(=O)Oc3ccc(NC(=O)c4cccc([N+](=O)[O-])c4)cc3)cc12 918214732 XZCLOSBDCLGAAD-UHFFFAOYSA-N 493.479 5.109 5 20 JKBD Cc1nn(C(C)(C)C)c2nc(C3CC3)cc(C(=O)O[C@@H](C)c3nnc(-c4ccc([N+](=O)[O-])cc4)o3)c12 919194971 JKBVZHVQJIDAAO-AWEZNQCLSA-N 490.520 5.248 5 20 JKBD CC(F)(F)CCC(=O)O[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Br)c1ccccc1 919293847 PPJKBFKRQRRXLT-QGZVFWFLSA-N 471.254 5.016 5 20 JKBD Cc1ccc(NC(=O)[C@H](OC(=O)[C@H]2CCC[C@H](C(F)(F)F)C2)c2ccccc2)c([N+](=O)[O-])c1 919372399 YGJWHACOHYKUCH-ABSDTBQOSA-N 464.440 5.495 5 20 JKBD C[C@@H](OC(=O)[C@@H]1CCCN(C(=O)c2ccc(Cl)c(Cl)c2)C1)c1ccccc1[N+](=O)[O-] 920267502 KALYMGKHXCEIMD-UKRRQHHQSA-N 451.306 5.058 5 20 JKBD Cc1ccc(-c2nnc([C@H](C)OC(=O)c3ccc(N[C@@H](C)c4ccccn4)c([N+](=O)[O-])c3)o2)cc1 920545827 JNTQNZMZWMEXMX-IRXDYDNUSA-N 473.489 5.439 5 20 JKBD C[C@H](Nc1ccc(C(=O)OCC(=O)c2ccc3ccccc3c2)cc1[N+](=O)[O-])c1ccccn1 920547488 OHKQUGYYODFZEI-KRWDZBQOSA-N 455.470 5.356 5 20 JKBD C[C@@H](OC(=O)c1cn(C)nc1-c1ccc([N+](=O)[O-])cc1)c1cccc(NC(=O)c2ccccc2)c1 920554998 XBMNBEQQKTUWRD-QGZVFWFLSA-N 470.485 5.166 5 20 JKBD Cc1nc2cccc(C(=O)NC3(c4ccc(NC(=O)c5ccc([N+](=O)[O-])o5)cc4)CCC3)c2s1 1785748995 VUJGZAKXYZIXOZ-UHFFFAOYSA-N 476.514 5.167 5 20 JKBD O=C(NC1(c2ccc(NC(=O)c3sccc3Cl)cc2)CCC1)c1ccc(O)c([N+](=O)[O-])c1 1789902836 CNQBDGSASRNNSL-UHFFFAOYSA-N 471.922 5.077 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)C3CCC(C(F)(F)F)CC3)CCC2)cc1)c1ccc([N+](=O)[O-])[nH]1 1790184390 NDHSEGHHACAXOM-UHFFFAOYSA-N 478.471 5.039 5 20 JKBD Cc1ncc(/C=C/C(=O)Nc2ccc(C3(NC(=O)/C=C/c4ccccc4[N+](=O)[O-])CCC3)cc2)s1 1791961399 JRXZVVYDPMVQDV-FELDBCONSA-N 488.569 5.220 5 20 JKBD O=C(/C=C/c1ccc([N+](=O)[O-])o1)N1CCCC2(CCN(C(=O)c3ccc(Cl)c(Cl)c3)CC2)C1 1805683112 YUVJAZVLNCGBJU-ZZXKWVIFSA-N 492.359 5.053 5 20 JKBD CC[C@H](C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cc(F)cc([N+](=O)[O-])c2)CC1)c1ccccc1 1826316576 KEQKIXWRBPLPQS-DQEYMECFSA-N 481.568 5.161 5 20 JKBD C/C(=C\c1cccs1)C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cc([N+](=O)[O-])c(O)cc2C)CC1 1830787849 QJIPITOJOFPMFI-RRXSNJIPSA-N 497.617 5.007 5 20 JKBD Cc1cc(F)c(C(=O)N2CCC([C@H]3CCCCN3C(=O)/C=C/c3ccccc3[N+](=O)[O-])CC2)cc1F 1832903478 DVZULNAWADPTNQ-HBRDYDSTSA-N 497.542 5.128 5 20 JKBD C[C@@H](NC(=O)c1ccc(NCc2ccccc2)c([N+](=O)[O-])c1)c1nc2ccccc2n1C(F)F 9758842 NUJMEBYPPVMKCI-OAHLLOKOSA-N 465.460 5.443 5 20 JKBD COc1ccc(-c2nnc(S[C@@H](C)C(=O)Nc3cccc([N+](=O)[O-])c3C)n2C2CCCCC2)cc1 23417525 SVTJQJVRHGPFPQ-KRWDZBQOSA-N 495.605 5.795 5 20 JKBD CC(C)c1ccc(CSc2nnc(SCc3cc([N+](=O)[O-])cc4c3OCOC4)s2)cc1 24657558 JWTAPFYUCYDPHQ-UHFFFAOYSA-N 475.617 6.021 5 20 JKBD O=C(Nc1ccccc1C(=O)NCc1ccccc1OC(F)(F)F)c1ccc([N+](=O)[O-])cc1Cl 27232589 ZDICRYJNRYNXLI-UHFFFAOYSA-N 493.825 5.329 5 20 JKBD COc1ccc(Oc2ccc([N+](=O)[O-])cc2C(=O)Nc2ccc(S(=O)(=O)C3CCCC3)cc2)cc1 33172365 FTZYXCACUUPVFK-UHFFFAOYSA-N 496.541 5.364 5 20 JKBD Cc1csc(N(C(=O)CSc2ccc(C(F)(F)F)cc2[N+](=O)[O-])c2ccccc2)n1 60391140 PNDAKCSZTUXBBL-UHFFFAOYSA-N 453.467 5.836 5 20 JKBD Cc1c(Br)cccc1NC(=O)c1ccc(N[C@H](C)c2ccccn2)c([N+](=O)[O-])c1 303126565 HCVDFZQKLWLHHS-CQSZACIVSA-N 455.312 5.486 5 20 JKBD C[C@H](Nc1ccc(C(=O)Nc2ccccc2NC(=O)C[C@H]2C=CCC2)cc1[N+](=O)[O-])c1ccccn1 409988498 WHUKTGWJSPWSQT-OALUTQOASA-N 485.544 5.710 5 20 JKBD COc1cccc(Cc2nnc(NC(=O)c3cc([N+](=O)[O-])ccc3Sc3ccccc3)s2)c1 410294065 NAUBVFXWQKFORK-UHFFFAOYSA-N 478.555 5.449 5 20 JKBD O=C1CCCc2cc(NC(=O)c3cc([N+](=O)[O-])ccc3Sc3ccc(Cl)cc3)ccc2N1 483912198 GTBLHHSPKMXDKX-UHFFFAOYSA-N 467.934 5.927 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)Nc2nc3ccccc3n2CCCc2ccccc2)cc1SC 484362115 MSGFSNKXCMWAQN-UHFFFAOYSA-N 476.558 5.560 5 20 JKBD O=C(NC1CCN(CC2CC2)CC1)c1ccccc1Sc1ccc(C(F)(F)F)cc1[N+](=O)[O-] 488408161 RWZHDXOEHHMCOJ-UHFFFAOYSA-N 479.524 5.369 5 20 JKBD Cc1nc([N+](=O)[O-])cn1CCC(=O)N(Cc1ccc(OCc2ccccc2)cc1)c1ccccc1 488803981 JHVSYLNPKOWHNN-UHFFFAOYSA-N 470.529 5.302 5 20 JKBD C[C@@H](Nc1ccc(C(=O)NCc2ccc(-n3cnc4ccccc43)cc2)cc1[N+](=O)[O-])c1ccccn1 490130695 NJMDOKFSTWGKAA-LJQANCHMSA-N 492.539 5.432 5 20 JKBD CN(C[C@H]1CCCCO1)C(=O)C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1 491922218 TYMSFDAQTLMOCW-WORNYLJVSA-N 451.548 5.163 5 20 JKBD O=C(C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1)N(Cc1ccc(F)cc1F)C1CC1 498320849 CHMSPAXWXMFBJI-UHFFFAOYSA-N 483.437 5.299 5 20 JKBD O=C(NCc1ccc(F)cc1)c1ccc(NC(=O)c2csc(-c3ccc([N+](=O)[O-])cc3)n2)cc1 498616775 NYCJPQYNRUPIPY-UHFFFAOYSA-N 476.489 5.040 5 20 JKBD CCOc1c(Br)cc(Cl)cc1NC(=O)C1CCN(c2ccccc2[N+](=O)[O-])CC1 504730741 LTOSDZNCTYGQAH-UHFFFAOYSA-N 482.762 5.265 5 20 JKBD Cc1ccc(C(C)C)c(Oc2ccc(CNCc3nnnn3-c3ccccc3)cc2[N+](=O)[O-])c1 507944789 HWGLWJDHEABPRW-UHFFFAOYSA-N 458.522 5.084 5 20 JKBD CCN(Cc1cc([N+](=O)[O-])cc2c1OCOC2)[C@H]1CCSc2ccc(Br)cc21 509068979 YGWSOIFTLIWZIS-SFHVURJKSA-N 465.369 5.283 5 20 JKBD C[C@H]1CN(c2ccc(CNCc3ccc(Oc4ccc(Cl)cc4[N+](=O)[O-])cc3)cn2)C[C@H](C)O1 509600734 JXVUXCGFYRRLDH-ROUUACIJSA-N 482.968 5.339 5 20 JKBD CCOc1cc([N+](=O)[O-])c(C(=O)Nc2cc(-c3ccccc3Cl)sc2C(=O)OC)cc1OC 511093068 JPCCHKNRRBUOOW-UHFFFAOYSA-N 490.921 5.423 5 20 JKBD CCOc1cc(-c2nc3ccc(F)cc3[nH]2)ccc1OCc1cc([N+](=O)[O-])cc2c1OCOC2 513867324 FKCVWJDLXLKUFS-UHFFFAOYSA-N 465.437 5.121 5 20 JKBD Cc1nc2ccccc2c(-c2ccccc2)c1CC(=O)Nc1cc2c(cc1[N+](=O)[O-])OCCCO2 514720906 DPQOBJFOIGYQKQ-UHFFFAOYSA-N 469.497 5.461 5 20 JKBD COc1cc(CNCc2ccc(N3CCCCCC3)nc2)ccc1OCc1ccc([N+](=O)[O-])cc1 520205864 HQQCRFBOPLRECI-UHFFFAOYSA-N 476.577 5.248 5 20 JKBD CC[C@H](C)C(=O)Nc1cccc(CN[C@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2ccccc2)c1 604044633 BFLZDMAEKRICHZ-XDHUDOTRSA-N 494.979 5.702 5 20 JKBD C[C@@H](Nc1ccc(C(=O)Nc2ccc(NC3CCCCC3)cc2)cc1[N+](=O)[O-])c1ccccn1 604539412 NPVHQFJYNCRLLW-GOSISDBHSA-N 459.550 6.160 5 20 JKBD Cc1cc(NC(=O)c2ccc(N[C@H](C)c3ccccn3)c([N+](=O)[O-])c2)n(-c2ccc(F)cc2)n1 608817224 GIPLQTVJRDYPJK-MRXNPFEDSA-N 460.469 5.048 5 20 JKBD O=C(Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1)c1ccc(-c2noc(C(F)(F)F)n2)cc1 609325479 LUHLXQHNFXSXAQ-UHFFFAOYSA-N 461.381 5.039 5 20 JKBD O=[N+]([O-])c1cccc(-c2noc(CNc3cc4c(cc3Sc3ccccc3)OCCO4)n2)c1 725794962 AOYOPQCQVPNHFI-UHFFFAOYSA-N 462.487 5.179 5 20 JKBD C[C@@H](CN(C)C(=O)c1ccccc1NC(=O)c1ccc([N+](=O)[O-])cc1Cl)c1ccccc1 727399858 LLCPQSOZNASCTK-INIZCTEOSA-N 451.910 5.376 5 20 JKBD Cc1nc(NC(=O)CCC(=O)c2ccc3ccc4cccc5ccc2c3c45)sc1SCC(N)=O 727767389 YKWGQQUAPGVSJY-UHFFFAOYSA-N 487.606 5.528 5 20 JKBD O=C(Nc1ccccc1C(=O)Nc1ccc(-c2ncc[nH]2)cc1)c1ccc([N+](=O)[O-])cc1Cl 749381716 KBLREKTZZYPDQN-UHFFFAOYSA-N 461.865 5.143 5 20 JKBD CC1=C(C(=O)Nc2cccc(Cl)c2)[C@H](c2ccc([N+](=O)[O-])o2)NC(=O)N1Cc1cccs1 812984289 WAYBNSYDHFGIIK-IBGZPJMESA-N 472.910 5.082 5 20 JKBD CN(Cc1nc(-c2cccc(OCc3cccnc3)c2)no1)c1cc(Br)ccc1[N+](=O)[O-] 904504554 ZFFZFUQWLYMRMK-UHFFFAOYSA-N 496.321 5.018 5 20 JKBD O=C(OCc1nnc(-c2ccc([N+](=O)[O-])cc2)o1)c1cnn(-c2cccc(C(F)(F)F)c2)c1C1CC1 914941856 HISVVRXZJNIONJ-UHFFFAOYSA-N 499.405 5.084 5 20 JKBD C[C@@H](OC(=O)c1cccc(OCc2cccs2)c1)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl 915463859 ASRLEJLTCWUHKQ-CYBMUJFWSA-N 460.895 5.073 5 20 JKBD CCOC(=O)/C(=C\c1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1)c1nc(O)c2c(C)c(C)sc2n1 916127019 VMJLIOBKABKXOJ-YBEGLDIGSA-N 499.932 5.939 5 20 JKBD CCOc1cc(N[C@@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2ccccc2)ccc1OC 917937759 IUPSUSGESCSTEQ-JOCHJYFZSA-N 455.898 5.447 5 20 JKBD C[C@H](OC(=O)c1[nH]c2ccc(F)cc2c1Cl)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 919424095 HXPQGHNAPXYFSH-QMMMGPOBSA-N 473.766 5.071 5 20 JKBD COc1ccc(-c2nnc(SCC(=O)Oc3ccc(-c4ccccc4)cc3[N+](=O)[O-])o2)cc1 920329414 KNGWGYAMAWFOFN-UHFFFAOYSA-N 463.471 5.018 5 20 JKBD Cc1cc2cccc(C(=O)NC3(c4ccc(NC(=O)/C=C/c5ccc([N+](=O)[O-])o5)cc4)CCC3)c2[nH]1 1786207490 RGADSFPRBFWJQE-ZRDIBKRKSA-N 484.512 5.439 5 20 JKBD O=C(/C=C/c1ccccc1[N+](=O)[O-])NC1(c2ccc(NC(=O)c3n[nH]c4c(F)cccc34)cc2)CCC1 1789337934 KHSSXICWCHVGOM-NTEUORMPSA-N 499.502 5.071 5 20 JKBD C[C@H](C(=O)Nc1ccc(C2(NC(=O)c3cc4cc([N+](=O)[O-])ccc4s3)CCC2)cc1)n1cccn1 1791883648 YWMJFNFEYFWBTB-MRXNPFEDSA-N 489.557 5.015 5 20 JKBD Cc1cc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cc(Cl)cc([N+](=O)[O-])c2C)C3)c(C(F)(F)F)o1 1795140786 ASBGVEQUQVIYFP-QDMKHBRRSA-N 499.873 5.042 5 20 JKBD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(F)cc([N+](=O)[O-])c1)c1cccc2c1oc1ccccc12 1800526117 JWCVBEARIQSXSC-REPLKXPHSA-N 487.487 5.199 5 20 JKBD O=C(Nc1cc([C@H]2CCCCN2C(=O)/C=C/c2ccccc2[N+](=O)[O-])[nH]n1)c1ccc2occc2c1 1818709102 BXZJOKXCPUQJBB-XBFAEUMISA-N 485.500 5.083 5 20 JKBD CC/C=C(\C)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)[nH]n1 1823097561 UJNQINLUJUMFRV-LQELHHAWSA-N 467.551 5.195 5 20 JKBD CCc1ccnc(C(=O)N2CCC([C@H]3CCCCN3C(=O)c3cc(Cl)cc([N+](=O)[O-])c3C)CC2)c1 1830736093 QOYNWQBCZVRVAC-HSZRJFAPSA-N 499.011 5.061 5 20 JKBD Cc1cc(CCCC(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)c2cc(C(C)(C)C)oc2C)c([N+](=O)[O-])cc1F 1847713646 DTKSWJCWCHVTON-VXKWHMMOSA-N 499.583 5.080 5 20 JKBD COc1ccc(-c2nnc(Sc3ccc(C(F)(F)F)cc3[N+](=O)[O-])n2C[C@@H]2CCCO2)cc1 15130907 DQTCNVXRUGPQKP-INIZCTEOSA-N 480.468 5.211 5 20 JKBD Cc1ccc(N(Cc2cc(-c3ccco3)on2)S(=O)(=O)c2ccc(Cl)c([N+](=O)[O-])c2)c(C)c1 15551527 XYIJEWDMRDVWFS-UHFFFAOYSA-N 487.921 5.509 5 20 JKBD CSc1ccc(C(=O)Nc2ccc(C)c(S(=O)(=O)Nc3ccccc3Cl)c2)cc1[N+](=O)[O-] 15705982 RPNPTQMFRSBUQM-UHFFFAOYSA-N 491.978 5.332 5 20 JKBD C[C@@H](Sc1nnc(Nc2cccc(Br)c2)s1)C(=O)Nc1ccccc1[N+](=O)[O-] 16543283 LLHGCNJURGDOLA-SNVBAGLBSA-N 480.369 5.072 5 20 JKBD Cc1sc2nc(S[C@@H](C)c3nnc(-c4ccc([N+](=O)[O-])cc4)o3)n(C(C)C)c(=O)c2c1C 17668046 VDSPIIYBTWDVGL-ZDUSSCGKSA-N 471.564 5.467 5 20 JKBD CSc1ccc([N+](=O)[O-])c(C(=O)Nc2nnc(SCc3c(Cl)cccc3Cl)s2)c1 18228273 HDAUIIFAZQXFNU-UHFFFAOYSA-N 487.415 6.020 5 20 JKBD Cc1c(NC(=O)[C@@H](C)OC(=O)c2cc(-c3cccs3)nc3c2cnn3C(C)C)cccc1[N+](=O)[O-] 28646444 FZWDLRRCUBPFQU-OAHLLOKOSA-N 493.545 5.141 5 20 JKBD COc1ccc([C@H](C)N[C@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2C(F)(F)F)cc1Br 30510225 NEKVYEOFJHIOFB-WDEREUQCSA-N 490.276 5.063 5 20 JKBD CCC(=O)Nc1ccc(Cl)c(NC(=O)CCNc2ccc(C(F)(F)F)cc2[N+](=O)[O-])c1 107960820 YYQJUOMSZNTGSK-UHFFFAOYSA-N 458.824 5.056 5 20 JKBD CC(=O)Nc1ccc(NC(=O)CSc2ccc(C(F)(F)F)cc2[N+](=O)[O-])c(C(F)(F)F)c1 247918961 GRCRFGKBKTYPRK-UHFFFAOYSA-N 481.374 5.322 5 20 JKBD CCCN(CCc1ccccn1)C(=O)C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1 489827054 RRBJBJOGYQZLJV-DYTRJAOYSA-N 486.597 6.012 5 20 JKBD COc1ccc([C@@H]2CCCN2C(=O)c2ccc(N[C@H](C)c3ccccn3)c([N+](=O)[O-])c2)c(OC)c1 506069043 DIYIVHPVCQCAFZ-HXOBKFHXSA-N 476.533 5.157 5 20 JKBD COc1ccc(CNCc2cc(OC)c(OCc3ccccc3)cc2[N+](=O)[O-])cc1Br 508097817 UYVDJZADBICFDS-UHFFFAOYSA-N 487.350 5.243 5 20 JKBD O=C(NCc1ccccc1-c1ccc(Cn2ccnc2)cc1)Nc1ccc([N+](=O)[O-])cc1Cl 508238219 VRMREIFOWPBXAG-UHFFFAOYSA-N 461.909 5.482 5 20 JKBD Cc1cc([N+](=O)[O-])ccc1C(=O)Nc1ccc(NC(=O)c2ccccc2F)cc1C(F)(F)F 508925075 SDHKSNPSWQOPEY-UHFFFAOYSA-N 461.371 5.566 5 20 JKBD CNS(=O)(=O)c1cccc(CNCc2ccc(Oc3cc(C)ccc3C(C)C)c([N+](=O)[O-])c2)c1 520201834 SYMPKJVLBZCYOG-UHFFFAOYSA-N 483.590 5.017 5 20 JKBD O=C(C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)N1CCc2sccc2C1 592901386 HZTBWRALUROGIH-AQTBWJFISA-N 461.568 5.782 5 20 JKBD COc1ccccc1CN(C)C(=O)C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1 603468549 KLSNGLPDAYIXPP-HKWRFOASSA-N 473.554 5.802 5 20 JKBD O=C(C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)Nc1ccc(N2CCCC2=O)cc1 603803162 KZAQZTIJTGRVJW-KNTRCKAVSA-N 498.564 5.901 5 20 JKBD Cc1ccc(C(=O)C2CCN(C(=O)c3ccc(NCc4ccccc4)c([N+](=O)[O-])c3)CC2)cc1 604187295 KKTJEKHFQQTCIL-UHFFFAOYSA-N 457.530 5.250 5 20 JKBD O=[N+]([O-])c1ccc(-c2nn(-c3ccccc3)cc2CNCc2ccc(CN3CCCC3)cc2)cc1 608841572 MXEQMYMESARIST-UHFFFAOYSA-N 467.573 5.333 5 20 JKBD C[C@@H]1CN(C(=O)c2c3c(nc4ccccc24)/C(=C\c2cccc([N+](=O)[O-])c2)CCC3)CCCO1 608946299 IBXJVNMUUVLDHF-CTBJKRMSSA-N 457.530 5.271 5 20 JKBD CCN(Cc1cccs1)C(=O)c1ccc(C(=O)N(CC)Cc2cccs2)c([N+](=O)[O-])c1 609043661 HQBZMAWNLWSOOM-UHFFFAOYSA-N 457.577 5.042 5 20 JKBD Cc1ccc(NC(=O)c2c[nH]c3cc([N+](=O)[O-])ccc23)cc1S(=O)(=O)Nc1ccccc1Cl 610892569 FMKCVRLQNPAUHR-UHFFFAOYSA-N 484.921 5.091 5 20 JKBD CCOc1cc(NC(=O)c2sc(-c3ccc(Cl)cc3)nc2C)c([N+](=O)[O-])cc1OCC 619212894 YVPAXSBFRLIQPO-UHFFFAOYSA-N 461.927 5.730 5 20 JKBD O=C(COC(=O)c1cc([N+](=O)[O-])ccc1Br)Nc1cc(Cl)c(Cl)cc1Cl 725985625 VBQSACZGFNARTM-UHFFFAOYSA-N 482.501 5.113 5 20 JKBD C[C@@H](NCc1ccc(-c2ccc([N+](=O)[O-])cc2)s1)C(=O)Nc1cccc(N2CCCC2)c1 726606036 QZLRAYVAJLGYMI-QGZVFWFLSA-N 450.564 5.040 5 20 JKBD O=C(Nc1ccccc1Oc1ccccc1NC(=O)c1ccccc1[N+](=O)[O-])c1ccccc1[N+](=O)[O-] 749555828 YTLNWFNNGJAAMN-UHFFFAOYSA-N 498.451 5.800 5 20 JKBD C[C@@H](OC(=O)c1c2ccccc2cc2ccccc12)C(=O)Nc1ccc(N2CCOCC2)cc1 754619323 LVBFCEFNJRHLCW-LJQANCHMSA-N 454.526 5.014 5 20 JKBD COCc1ccccc1C(=O)O[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Br)c1ccccc1 914807256 JMMFQVAPDRKZDX-OAQYLSRUSA-N 499.317 5.041 5 20 JKBD CC1=C(C(=O)Nc2ccccc2C)[C@@H](c2ccc([N+](=O)[O-])cc2)NC(=S)N1c1cccc(C)c1 916168283 JWPROACLWZEHOD-XMMPIXPASA-N 472.570 5.560 5 20 JKBD O=C(CSc1nnc(COc2ccccc2)n1-c1ccccc1)Nc1cc(Cl)ccc1[N+](=O)[O-] 916664732 YTWSUGDLHMRLKY-UHFFFAOYSA-N 495.948 5.139 5 20 JKBD COc1ccc(-c2[nH]c3ccccc3c2CCC(=O)OCc2csc([N+](=O)[O-])c2)c(OC)c1 920669117 QTLSIHSFUNLAQP-UHFFFAOYSA-N 466.515 5.498 5 20 JKBD O=C(Nc1cc([N+](=O)[O-])c(F)cc1F)c1oc2ccccc2c1CSc1ccc(F)cc1 921146603 CJUWXBIHFRSFJO-UHFFFAOYSA-N 458.417 6.303 5 20 JKBD COc1ccc([C@@H]2C[C@H]2C(=O)NC2(c3ccc(NC(=O)Cc4cccc([N+](=O)[O-])c4)cc3)CCC2)cc1 1785791488 DQLJJQYNEQCHBO-IZZNHLLZSA-N 499.567 5.084 5 20 JKBD Cc1cc2[nH]c(C(=O)NC3(c4ccc(NC(=O)/C=C/c5ccc([N+](=O)[O-])o5)cc4)CCC3)cc2s1 1786207697 FJTKFPBKVNPLPA-VQHVLOKHSA-N 490.541 5.500 5 20 JKBD O=C(CCc1cccc([N+](=O)[O-])c1)N1CCCC[C@H]1C1CCN(C(=O)C23CCC(CC2)CC3)CC1 1824843190 PZONYLMTGULVGQ-FJOOJYTASA-N 481.637 5.118 5 20 JKBD C[C@]1(C(=O)N2CCC([C@@H]3CCCCN3C(=O)c3cc4cc([N+](=O)[O-])ccc4s3)CC2)CC1(F)F 1831062104 PKQMWPGIAUQHEY-FDDCHVKYSA-N 491.560 5.088 5 20 JKBD O=C(CSc1ccccc1[N+](=O)[O-])N1CCCC[C@@H]1C1CCN(C(=O)C23CCC(CC2)CC3)CC1 1831777156 GKWRGUNPYGRLIV-QHMKHHNBSA-N 499.677 5.277 5 20 JKBD CC[C@@H](C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2ccc([N+](=O)[O-])c(OC)c2)CC1)c1ccccc1 1832696824 XNJVQPSGPXSNAW-RPWUZVMVSA-N 493.604 5.031 5 20 JKBD O=C(/C=C/c1ccsc1)N1CCC([C@H]2CCCCN2C(=O)/C=C/c2ccccc2[N+](=O)[O-])CC1 1832899576 DAEPCDLEYMZJFS-VSSKNMHGSA-N 479.602 5.003 5 20 JKBD COc1ccc([N+](=O)[O-])cc1NC(=O)[C@H](C)OC(=O)[C@H](Sc1ccccc1)c1ccccc1 10588830 QJCHWHBTKMBHJA-KSFYIVLOSA-N 466.515 5.007 5 20 JKBD C[C@H](OC(=O)c1ccc(N2CCCC2)c([N+](=O)[O-])c1)C(=O)Nc1ccccc1-c1ccccc1 10733816 OHIKXHBCTJLUEU-SFHVURJKSA-N 459.502 5.046 5 20 JKBD O=C(COC(=O)CCc1ncc(-c2ccc(Cl)cc2)o1)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 12257567 OWUQLBXWVWYIMR-UHFFFAOYSA-N 497.813 5.037 5 20 JKBD Cc1nn(Cc2ccc(C(=O)N[C@@H]3CCSc4ccc(Cl)cc43)cc2)c(C)c1[N+](=O)[O-] 12620413 RMPYIELHRALZBT-LJQANCHMSA-N 456.955 5.077 5 20 JKBD CCOc1cc(C(=O)OCc2csc(N(C(C)=O)c3cccc(C)c3C)n2)c([N+](=O)[O-])cc1OC 19473817 GILNEWXMGLRWBH-UHFFFAOYSA-N 499.545 5.117 5 20 JKBD CCCn1c(S[C@H](C)C(=O)Nc2cc([N+](=O)[O-])ccc2Cl)nnc1-c1cccc(C)c1 21262812 FVIVSUPQNSCAAP-CQSZACIVSA-N 459.959 5.344 5 20 JKBD Cc1cccc([N+](=O)[O-])c1NC(=O)COC(=O)/C=C/c1cc(C(F)(F)F)cc(C(F)(F)F)c1 25034867 UVRNJIMQVNGLKL-AATRIKPKSA-N 476.329 5.136 5 20 JKBD CCc1nc(COC(=O)C/C(=C/c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)cs1 28357194 VCMJCWDQZLDXCF-WJDWOHSUSA-N 465.556 5.898 5 20 JKBD COc1cc(C(=O)Nc2nc(-c3ccc(SC)cc3)cs2)c([N+](=O)[O-])cc1OC(F)F 29580026 UCAOFXIOAIXEKB-UHFFFAOYSA-N 467.475 5.303 5 20 JKBD Cc1nc2cc(NC(=O)c3ccccc3NC(=O)c3ccc([N+](=O)[O-])cc3Cl)ccc2o1 57622787 IEFYSPSERHFNHY-UHFFFAOYSA-N 450.838 5.202 5 20 JKBD Cc1cccc(Oc2ncccc2NC(=O)c2ccc(Cn3nc(C)c([N+](=O)[O-])c3C)cc2)c1C 71981916 VSXDCBGNZVGDSI-UHFFFAOYSA-N 471.517 5.513 5 20 JKBD Cc1cccc(-c2nnc(-c3ccc(C(=O)N(C)Cc4cc([N+](=O)[O-])ccc4Cl)cc3)o2)c1 248093480 NFRGNXHIVIKKEF-UHFFFAOYSA-N 462.893 5.546 5 20 JKBD COc1ccc(Oc2ccc([N+](=O)[O-])cc2C(=O)N(C)Cc2ccc(SC)c(OC)c2)cc1 477798955 YMWGMJRWQPZZKL-UHFFFAOYSA-N 468.531 5.398 5 20 JKBD C[C@H](NC(=O)c1ccc(NC2CC2)c([N+](=O)[O-])c1)c1ccc(NC(=O)Nc2ccccc2)cc1 480796914 YXLJMHWPOSEJBI-INIZCTEOSA-N 459.506 5.304 5 20 JKBD COc1cccc(-c2cc(NC(=O)c3cc(SC)c(OC)cc3[N+](=O)[O-])n(-c3ccccc3)n2)c1 482902189 VPQNUZGWTACVFU-UHFFFAOYSA-N 490.541 5.439 5 20 JKBD CC(C)(C)N1CCC(NC(=O)C/C(=C\c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)CC1 489835405 IVPINWWMVBUEHA-KNTRCKAVSA-N 478.618 5.514 5 20 JKBD C[C@H](N[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1)c1ccc(OC(F)F)cc1 493604698 WCACMEOZCFKTPU-LHSJRXKWSA-N 475.879 5.880 5 20 JKBD CCCOc1ccc(Oc2ncccc2CNC(=O)Cn2c3ccccc3c(=O)c3ccccc32)cc1 501683804 RGRVUUUMTDWTGA-UHFFFAOYSA-N 493.563 5.447 5 20 JKBD O=C(Cc1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1)Nc1cc(Cl)ccc1F 507009238 XIEJKZQROZMZIN-UHFFFAOYSA-N 450.857 5.421 5 20 JKBD COc1ccc(CSCC(=O)N(c2nc3ccccc3s2)c2ccc(C)cc2C)cc1[N+](=O)[O-] 508589865 SEQSNPHPUBSAHO-UHFFFAOYSA-N 493.610 6.428 5 20 JKBD O=C(C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1)N(Cc1ccccc1)Cc1ccco1 514603577 WRNFLYKQGWPZSB-UHFFFAOYSA-N 487.478 5.652 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1)c1cnn(-c2ncc(C(F)(F)F)cc2Cl)c1C(F)F 518107387 CVIMUESXVNVSOO-UHFFFAOYSA-N 461.734 5.038 5 20 JKBD Cn1cc(C(=O)Nc2nc(-c3ccco3)c(-c3ccco3)s2)c(-c2ccc([N+](=O)[O-])cc2)n1 518412633 WBMNCOJRSKOAGD-UHFFFAOYSA-N 461.459 5.224 5 20 JKBD CC(C)N(C)CC1CCN(C(=O)c2ccc(Sc3nc4ccccc4s3)c([N+](=O)[O-])c2)CC1 519920849 AYYKHEHRRQAAKD-UHFFFAOYSA-N 484.647 5.548 5 20 JKBD C[C@@H](NC(C)(C)CNC(=O)c1ccc(N[C@H](C)c2ccccn2)c([N+](=O)[O-])c1)c1ccccc1 552344041 UJQZRIGBHYTPQY-RTBURBONSA-N 461.566 5.022 5 20 JKBD O=C(Nc1nc2cc(C(F)(F)F)ccc2s1)C1CCN(c2ccccc2[N+](=O)[O-])CC1 603447714 ZRNHPDQSRQRLAH-UHFFFAOYSA-N 450.442 5.078 5 20 JKBD CCN(Cc1ccccc1NCc1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1)C(C)=O 603834951 PTDIITLNSFGAJW-UHFFFAOYSA-N 453.926 6.021 5 20 JKBD Cc1ccc(NC(=O)c2cc(OCC(F)(F)F)ccc2[N+](=O)[O-])c(OCc2ccccc2)c1 603997267 ASMHUZOERVLUOR-UHFFFAOYSA-N 460.408 5.676 5 20 JKBD Cn1cnnc1Sc1ccc(C(=O)N[C@H](c2cccc(C(F)(F)F)c2)C(C)(C)C)cc1[N+](=O)[O-] 608898877 IXUSALXWMQODHJ-GOSISDBHSA-N 493.511 5.411 5 20 JKBD O=C(C1CCN(c2ccccc2[N+](=O)[O-])CC1)N1CCCC[C@H]1c1ccccc1C(F)(F)F 608945296 DUYVEQHIIYQEDW-FQEVSTJZSA-N 461.484 5.584 5 20 JKBD C[C@@H](NC(=O)Cn1c2ccccc2c(=O)c2ccccc21)c1ccc(NC(=O)Nc2ccccc2)cc1 613849954 XUTKAPOIFRWSAL-HXUWFJFHSA-N 490.563 5.676 5 20 JKBD C[C@H](c1nnc(Sc2nc3ccc([N+](=O)[O-])cc3s2)n1-c1ccc(Cl)cc1)N(C)C 731208440 GKYUPUFHSGKBAQ-LLVKDONJSA-N 460.972 5.212 5 20 JKBD COc1cc(C)ccc1Oc1ccc(F)cc1NC(=O)c1cc([N+](=O)[O-])ccc1Br 751106620 AZYWZEHBQBRZKN-UHFFFAOYSA-N 475.270 5.858 5 20 JKBD Cc1noc2nc(C(C)C)cc(C(=O)Oc3ccc(NC(=O)c4cccc([N+](=O)[O-])c4)cc3)c12 835379141 SGRLUXVNQVXJKV-UHFFFAOYSA-N 460.446 5.034 5 20 JKBD C[C@H](OC(=O)/C=C/c1ccc2ccc(Cl)cc2n1)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 912873973 RKNTZFJOXQFYRF-YKWSONSWSA-N 450.838 5.164 5 20 JKBD C[C@H](OC(=O)[C@@H]1CCCN(C(=O)c2ccc(Cl)c(Cl)c2)C1)c1cccc([N+](=O)[O-])c1 915020432 RJOCIRFQOLIYRO-XJKSGUPXSA-N 451.306 5.058 5 20 JKBD O=C(Nc1cc([N+](=O)[O-])ccc1F)c1cccnc1Oc1ccc(F)cc1Br 917611489 HYXSURTXEQOMSX-UHFFFAOYSA-N 450.195 5.075 5 20 JKBD O=C(Nc1ccccc1SC[C@H]1CC1(Cl)Cl)c1ccc(N2CCCC2)c([N+](=O)[O-])c1 917749019 HHPZOTJQWHNRFP-OAHLLOKOSA-N 466.390 5.733 5 20 JKBD O=C(Nc1ccccc1Oc1ccccc1Cl)[C@@H]1CC(=O)N(c2ccc(F)c([N+](=O)[O-])c2)C1 918557107 AWZZJZMEIOMMFY-CQSZACIVSA-N 469.856 5.171 5 20 JKBD Cc1cccc([N+](=O)[O-])c1NC(=O)COC(=O)c1c(Cl)cc(C(F)(F)F)cc1Cl 919296198 HLEZDPWMCKNHIC-UHFFFAOYSA-N 451.184 5.024 5 20 JKBD C[C@H](OC(=O)Cc1csc(-c2ccc(Cl)s2)n1)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl 920677006 TYWQHFUYBJTPKI-VIFPVBQESA-N 486.358 5.200 5 20 JKBD C[C@@H](OC(=O)[C@@H](C)Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)Nc1ccc(Cl)cc1C(F)(F)F 920777745 GCCFZJQLBNGFJX-NXEZZACHSA-N 495.237 5.258 5 20 JKBD O=C(OCc1nc2ccccc2c2ccccc12)[C@@H]1CS[C@]2(c3ccc(F)cc3)CCC(=O)N12 921265319 WPJFIDVNKALFQW-IGKIAQTJSA-N 472.541 5.161 5 20 JKBD O=C(CCc1cccc([N+](=O)[O-])c1)Nc1ccc(C2(NC(=O)[C@]3(F)CCCC=C3F)CCC2)cc1 1786601590 ZPHMYGHAIWQNPN-SANMLTNESA-N 483.515 5.407 5 20 JKBD O=C(NC1(c2ccc(NC(=O)[C@H]3[C@@H]4CCC[C@H]3c3ccccc3N4)cc2)CCC1)c1ccc([N+](=O)[O-])[nH]1 1787949882 PWXUWPRELYLSAO-UWDQQESISA-N 499.571 5.049 5 20 JKBD Cc1c(C(=O)Nc2ccc(C3(NC(=O)[C@H]4C[C@]4(F)Cl)CCC3)cc2)cc(Cl)cc1[N+](=O)[O-] 1790774757 QSYPQSXLMJKBQU-VGOFRKELSA-N 480.323 5.229 5 20 JKBD CC(C)(C)CCCCCC(=O)N1CC[C@@H](CNC(=O)c2cc(F)cc([N+](=O)[O-])c2)[C@H]1c1cccnc1 1811306932 JDEZEEOKYWTOED-NBGIEHNGSA-N 498.599 5.445 5 20 JKBD CC[C@H](C)CC(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)[nH]n1 1815044487 NCMRFXDUUMTTED-KSSFIOAISA-N 469.567 5.275 5 20 JKBD O=C(Cc1ccsc1)Nc1cc([C@H]2CCCCN2C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)[nH]n1 1817586797 VHQMDLGMCXGQPR-GOSISDBHSA-N 495.586 5.143 5 20 JKBD CC(C)[C@H](C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2ccc([N+](=O)[O-])o2)CC1)c1ccc(F)cc1 1831751030 SZEXGIMJBRSBOI-QPPBQGQZSA-N 485.556 5.000 5 20 JKBD COc1cc(C(=O)N2CCCC[C@H]2C2CCN(C(=O)c3ccc(Cl)cc3C)CC2)ccc1[N+](=O)[O-] 1832694608 NLPKVRJAOBOHJU-QFIPXVFZSA-N 499.995 5.112 5 20 JKBD C[C@@H](CC(=O)N1CCC([C@@H]2CCCCN2C(=O)/C=C/c2ccccc2[N+](=O)[O-])CC1)c1ccccc1 1832903479 DWFROWPOCNTNBH-AINZQRSMSA-N 489.616 5.422 5 20 JKBD COc1cccc(-c2nnc(SCc3cc([N+](=O)[O-])cc4c3OCOC4)n2-c2ccccc2)c1 3426961 GKWDATQACMNVKT-UHFFFAOYSA-N 476.514 5.010 5 20 JKBD O=C(Nc1ccccc1C(=O)NCc1ccccc1OC(F)F)c1ccc([N+](=O)[O-])cc1Cl 10114922 JXTLHQZCFQAQRT-UHFFFAOYSA-N 475.835 5.032 5 20 JKBD O=C(O[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Br)c1ccccc1)c1ccccc1Cl 11026565 RWKJSHRXMASQLV-LJQANCHMSA-N 489.709 5.548 5 20 JKBD CCS(=O)(=O)c1ccc(NC(=O)c2ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])c(OC)c2)cc1 11542418 KAIBIPNTCXGSBE-UHFFFAOYSA-N 490.921 5.095 5 20 JKBD O=[N+]([O-])c1ccc(CSc2nnc(-c3ccc(Br)o3)n2Cc2ccccc2)cc1 14708633 KNEBGEVQKIRDHG-UHFFFAOYSA-N 471.336 5.549 5 20 JKBD COc1cc(C(=O)Nc2cccc(C(=O)Nc3cccc(C(F)(F)F)c3)c2)c([N+](=O)[O-])cc1OC 14907619 HRGNAXNYJWFHBX-UHFFFAOYSA-N 489.406 5.135 5 20 JKBD Cc1c(NC(=O)[C@@H](C)OC(=O)[C@@H](Sc2ccccc2)c2ccccc2)cccc1[N+](=O)[O-] 23202237 MBVGCFVZCNRUDK-VGSWGCGISA-N 450.516 5.307 5 20 JKBD C[C@H]1C[C@@H](C)CN(c2ccc(C(=O)N(C)CC(=O)Nc3c(Cl)cccc3Cl)cc2[N+](=O)[O-])C1 24860325 MHVFWUIYYPRDBE-GASCZTMLSA-N 493.391 5.095 5 20 JKBD O=C(NCc1ccc(Cn2ccnc2)cc1)c1ccc(NCc2ccccc2Cl)c([N+](=O)[O-])c1 28694740 CBVMKSDHSPLZDJ-UHFFFAOYSA-N 475.936 5.035 5 20 JKBD O=[N+]([O-])c1cccc(-c2noc(CSc3nnc(Cc4ccccc4)n3-c3ccccc3)n2)c1 31850499 CKHKJPBKBZDPHC-UHFFFAOYSA-N 470.514 5.109 5 20 JKBD Cc1cc([N+](=O)[O-])ccc1C(=O)Nc1sc(-c2ccccc2)c(C)c1C(=O)N1CCCCC1 72068603 FMJGYOAQFVNQOD-UHFFFAOYSA-N 463.559 5.819 5 20 JKBD C[C@@H](Nc1ccc(C(=O)Nc2nc(-c3ccc4c(c3)OCO4)cs2)cc1[N+](=O)[O-])c1ccccn1 108753099 WBFNBRUGVUIAOC-CQSZACIVSA-N 489.513 5.267 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)N[C@@H](Cc2cccc(F)c2)c2cccc(F)c2)cc1SC 112532371 PEUIJCDLONGQGW-IBGZPJMESA-N 458.486 5.317 5 20 JKBD COc1ccc(C2(CN[C@H](C)C(=O)Nc3ccc([N+](=O)[O-])cc3C(F)(F)F)CCCCC2)cc1 302949959 BWCHWKIMBVWDOJ-MRXNPFEDSA-N 479.499 5.441 5 20 JKBD O=C(c1cccc(OCc2cccs2)c1)N(Cc1ccccc1[N+](=O)[O-])CC(F)(F)F 486067411 GZCAJIDIJAXDOZ-UHFFFAOYSA-N 450.438 5.440 5 20 JKBD Cc1csc(N(CC(F)(F)F)C(=O)CSc2ccc(C(F)(F)F)cc2[N+](=O)[O-])n1 498083626 BUCWJFIMOCHTEG-UHFFFAOYSA-N 459.393 5.066 5 20 JKBD O=[N+]([O-])c1cc(S(=O)(=O)Nc2ccccc2)ccc1NCc1ccc(Oc2ccccc2)nc1 503581953 UAVMKXDIVCUSNQ-UHFFFAOYSA-N 476.514 5.195 5 20 JKBD C[C@H]1Cc2cc([N+](=O)[O-])ccc2N1C(=O)c1ccc(COc2cccc(Br)c2)o1 504303299 GATFNJTVKYRRRS-ZDUSSCGKSA-N 457.280 5.121 5 20 JKBD Cc1ncc([N+](=O)[O-])cc1C(=O)Nc1nc(-c2cc(C)n(CCc3ccccc3)c2C)cs1 506979459 OYEQKOVKJNXFCS-UHFFFAOYSA-N 461.547 5.335 5 20 JKBD C[C@@H](Nc1ccc(C(=O)NCCc2ccccc2C(F)(F)F)cc1[N+](=O)[O-])c1ccccn1 507870784 BMSUHIHIIPUGTR-OAHLLOKOSA-N 458.440 5.154 5 20 JKBD C[C@@H]1CN(C(=O)c2ccc(CNCc3ccc(Oc4ccc(F)cc4)c([N+](=O)[O-])c3)cc2)C[C@@H](C)O1 507904676 QWIZBKPNRZXROC-RTBURBONSA-N 493.535 5.065 5 20 JKBD CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)N[C@@H](C)c1cccc(NC(=O)c2ccccc2)c1 509294027 MRQQBEWCHCBYPU-IBGZPJMESA-N 460.534 5.528 5 20 JKBD COc1ccccc1NC(=O)Nc1cc(NC(=O)c2ccc(Cl)cc2[N+](=O)[O-])ccc1OC 509455295 ZMKPHNAXHHXKPK-UHFFFAOYSA-N 470.869 5.162 5 20 JKBD O=C(CCCc1cccs1)Nc1cccc(C(=O)Nc2cc([N+](=O)[O-])ccc2OC(F)F)c1 512002647 SQEQUYXHDWOJHP-UHFFFAOYSA-N 475.473 5.471 5 20 JKBD COc1ccc(CNc2cc(NC(=O)C3CC3)ccc2C)cc1OCc1ccc([N+](=O)[O-])cc1 513571523 JMHBOXOSZWMQNJ-UHFFFAOYSA-N 461.518 5.451 5 20 JKBD O=C(Nc1cccc(C(=O)N(Cc2ccccc2[N+](=O)[O-])CC(F)(F)F)c1)c1cccs1 514449507 APVMHHBWNFJTCS-UHFFFAOYSA-N 463.437 5.113 5 20 JKBD C[C@H](NC(=O)C(=O)Nc1cc(Cl)ccc1Sc1ccc(F)cc1)c1cccc([N+](=O)[O-])c1 517185245 YOMYCPZTNUVTPE-ZDUSSCGKSA-N 473.913 5.354 5 20 JKBD O=C(Nc1ccnc2ccnn12)c1ccccc1Sc1ccc(C(F)(F)F)cc1[N+](=O)[O-] 518195458 LIKPQFIDZTWHQL-UHFFFAOYSA-N 459.409 5.060 5 20 JKBD O=C(C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1)N1CCCC[C@H]1Cc1ccc(F)cc1 519132797 CEQCDZJQYIUICK-NRFANRHFSA-N 493.501 5.593 5 20 JKBD CCOc1cc(NC(=O)N[C@@H](c2ccccc2)c2nc3ccccc3n2C)c([N+](=O)[O-])cc1OCC 520438513 KLSPDDPXQDJZMQ-DEOSSOPVSA-N 489.532 5.190 5 20 JKBD O=C(Nc1ccc(CN2C(=O)Cc3ccc(Cl)cc32)cc1)c1ccc(Cl)cc1[N+](=O)[O-] 521125332 JUOBZKUVMAJTAM-UHFFFAOYSA-N 456.285 5.243 5 20 JKBD C[C@@H](Nc1ccc(C(=O)Nc2ccnn2[C@@H]2CCCc3ccccc32)cc1[N+](=O)[O-])c1ccccn1 522247198 KJQXEYQHGVKYGZ-HOYKHHGWSA-N 482.544 5.537 5 20 JKBD Cc1ccc(Sc2ccc(C(=O)N3CCC(NC(=O)c4ccccc4)CC3)cc2[N+](=O)[O-])cc1 588732631 KSWBZFITKMXFHI-UHFFFAOYSA-N 475.570 5.089 5 20 JKBD Cc1noc(C)c1COc1ccc(CC(=O)Nc2nc(-c3cccc([N+](=O)[O-])c3)cs2)cc1 601904852 RGXHUHPTZVKGSA-UHFFFAOYSA-N 464.503 5.083 5 20 JKBD Cc1ccc(S(=O)(=O)Nc2ccc(NC(=O)[C@H]3CCCC[C@@H]3C(F)(F)F)cc2)cc1[N+](=O)[O-] 603780512 OJXICWMXXMVLRE-ROUUACIJSA-N 485.484 5.011 5 20 JKBD Cc1ccc(NS(=O)(=O)c2ccc(NCc3ccc4ccccc4n3)c([N+](=O)[O-])c2)c(C)c1 604459598 FEYUALJRLGJJQZ-UHFFFAOYSA-N 462.531 5.173 5 20 JKBD COc1ccc(Br)c(NC(=O)c2ccc(N[C@@H](C)c3ccccn3)c([N+](=O)[O-])c2)c1 604543370 YEUJLXXSIKMPDZ-ZDUSSCGKSA-N 471.311 5.186 5 20 JKBD CCn1nc(C)c(CNC(=O)C/C(=C/c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)c1C 608948386 OAGVRSQGDJQNGJ-UYRXBGFRSA-N 475.574 5.285 5 20 JKBD C[C@H](NCc1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1)c1nc2ccccc2n1C(F)F 609006706 RCJAMSWZLAVKAW-AWEZNQCLSA-N 472.879 6.636 5 20 JKBD C[C@H]([C@H]1C[C@H]2CC[C@H]1C2)n1c(SCC(=O)N(C)c2ccc([N+](=O)[O-])cc2)nnc1-c1ccco1 619816339 DRPKITYFGFLMSY-NHAYFPRASA-N 481.578 5.199 5 20 JKBD C[C@@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)OCc1nnc(-c2c(Cl)cccc2Cl)o1 726633531 VPPGQTAICCAIIN-SNVBAGLBSA-N 454.291 5.176 5 20 JKBD Cc1oc(-c2ccsc2)nc1CC(=O)Oc1ccc2c(-c3ccc([N+](=O)[O-])cc3)cc(=O)oc2c1 726912801 WLYKUUYAZINXOV-UHFFFAOYSA-N 488.477 5.541 5 20 JKBD Cc1cc(N2CCOCC2)ccc1NC(=O)CCC(=O)c1ccc2ccc3cccc4ccc1c2c34 727754882 JGBNUCJXWBLHFD-UHFFFAOYSA-N 476.576 6.331 5 20 JKBD CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccccc1SC[C@@H]1CC1(Cl)Cl 729035444 JRWKWJIHWHPJQA-INIZCTEOSA-N 468.406 6.323 5 20 JKBD C[C@H](c1ccc(S(C)(=O)=O)cc1)N(C)C(=O)CCC(=O)c1ccc2ccc3cccc4ccc1c2c34 729259894 LJQPSYWXIGOXPF-LJQANCHMSA-N 497.616 6.170 5 20 JKBD CC(C)N(Cc1nnc(-c2cccc([N+](=O)[O-])c2)o1)C(=O)[C@@H](C)Cc1ccc(Cl)cc1Cl 730451232 SUIXVAOCIVERRP-AWEZNQCLSA-N 477.348 5.567 5 20 JKBD CCOC(=O)c1c(-c2ccc(F)cc2)csc1NC(=O)c1cc(OCC)c(OC)cc1[N+](=O)[O-] 747460035 JNBKTIZREPSADI-UHFFFAOYSA-N 488.493 5.299 5 20 JKBD CCNc1ccc(C(=O)OCc2csc(N(C(C)=O)c3ccc(C)cc3C)n2)cc1[N+](=O)[O-] 795844686 AHTUBRSFOISYEH-UHFFFAOYSA-N 468.535 5.142 5 20 JKBD CCC(=O)c1ccc(OC(=O)C2CCN(c3ccc(C(F)(F)F)cc3[N+](=O)[O-])CC2)cc1 855193049 UGIKCBQFAFKQBQ-UHFFFAOYSA-N 450.413 5.028 5 20 JKBD CSCC[C@@H](NC(=O)c1ccc(Cl)c([N+](=O)[O-])c1)C(=O)O[C@@H](C)c1ccc(Cl)cc1 857760875 UAVWXSPIEABUDI-YVEFUNNKSA-N 471.362 5.058 5 20 JKBD Cc1nn(Cc2ccc(-c3nc(-c4ccc(Oc5ccccc5)nc4)no3)cc2)c(C)c1[N+](=O)[O-] 904448006 QREHXEYBQCBUID-UHFFFAOYSA-N 468.473 5.361 5 20 JKBD Cc1ccc(Sc2ccc(C(=O)Nc3ccc(N4C(=O)CCCC4=O)cc3)cc2[N+](=O)[O-])cc1 915296891 YJFCGXLPLVCWJN-UHFFFAOYSA-N 475.526 5.350 5 20 JKBD O=C(OCc1nc2ccccc2c2ccccc12)C1CCN(C(=O)CCOc2ccccc2)CC1 919565367 PZCQKKLOXAHTGG-UHFFFAOYSA-N 468.553 5.139 5 20 JKBD COc1ccc(NC(=O)[C@@H](C)OC(=O)c2csc(-c3ccc(Cl)cc3Cl)n2)c([N+](=O)[O-])c1 921225940 XIIWWAKOXIJSKZ-SNVBAGLBSA-N 496.328 5.218 5 20 JKBD Cc1ncoc1C(=O)NC1(c2ccc(NC(=O)c3cc4cc([N+](=O)[O-])ccc4s3)cc2)CCC1 1791011268 VFOHVHZLSMNCLA-UHFFFAOYSA-N 476.514 5.167 5 20 JKBD C[C@@H](Cc1ccc(F)cc1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc2cc([N+](=O)[O-])ccc2s1 1801207246 QUSPENYVBDOXNR-KQLYMOGASA-N 495.576 5.079 5 20 JKBD Cc1ccc(CC(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)[C@@H](c2ccc(Cl)cc2)C(C)C)cc1[N+](=O)[O-] 1801551992 BHWRIIVCZKUICX-ZGXDEKTJSA-N 498.023 5.177 5 20 JKBD O=C(Cc1ccc([N+](=O)[O-])cc1F)N1CCC([C@@H]2CCCCN2C(=O)c2cc3ccoc3s2)CC1 1827414259 SPWZPQOOGABYDT-NRFANRHFSA-N 499.564 5.018 5 20 JKBD O=C(CCC1CCC1)N1CCC([C@H]2CCCCN2C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)CC1 1831060534 YXSRNIOFKPLGMK-JOCHJYFZSA-N 483.634 5.623 5 20 JKBD Cc1cc(C)cc(CCC(=O)N2CCCC[C@H]2C2CCN(C(=O)/C=C/c3ccc([N+](=O)[O-])o3)CC2)c1 1832041211 BZZRWGKFTYZXAB-HJKZNEBBSA-N 493.604 5.070 5 20 JKBD C[C@H](Sc1nnc(-c2ccccc2F)n1Cc1ccccc1)C(=O)Nc1cccc([N+](=O)[O-])c1 3562957 FZNDENPRUMZKMS-INIZCTEOSA-N 477.521 5.160 5 20 JKBD C[C@@H](Sc1nnc(-c2cccs2)n1-c1ccccc1)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl 11208839 FXONVCKDOAYGOA-CYBMUJFWSA-N 485.978 5.677 5 20 JKBD O=C(CSc1nnc(Cc2ccccc2)n1-c1ccccc1)Nc1ccc([N+](=O)[O-])cc1Cl 12105383 JTGQUOACRBCHSF-UHFFFAOYSA-N 479.949 5.151 5 20 JKBD Cn1ccnc1[C@H](NC(=O)c1ccc(NCc2ccccc2Cl)c([N+](=O)[O-])c1)c1ccc(F)cc1 14400385 QFZVSXDCZRIRJG-HSZRJFAPSA-N 493.926 5.252 5 20 JKBD O=C(Cn1c2ccccc2c(=O)c2ccccc21)N1CCc2sccc2[C@@H]1c1cccs1 14809683 VTNXQJCOILHSCZ-RUZDIDTESA-N 456.592 5.452 5 20 JKBD Cc1nc(-c2ccc(F)cc2)sc1C(=O)O[C@@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl 18017826 GIDDUSLZJOULCQ-NSHDSACASA-N 463.874 5.003 5 20 JKBD CS(=O)(=O)Nc1ccc(NC(=O)c2ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])cc2)cc1Cl 29309947 FCAZRLXBHNYJQN-UHFFFAOYSA-N 496.328 5.318 5 20 JKBD O=C(Nc1ccc(Cl)c(C(F)(F)F)c1)c1ccc([N+](=O)[O-])cc1I 72068406 WDAUABCRXRFZNI-UHFFFAOYSA-N 470.572 5.124 5 20 JKBD CCOC(=O)c1oc2ccccc2c1CNC(=O)c1ccc(N[C@@H](C)c2ccccn2)c([N+](=O)[O-])c1 116768705 ZXBGRWCLLCVHPR-INIZCTEOSA-N 488.500 5.016 5 20 JKBD C[C@H](N[C@H](Cc1cccc(F)c1)c1cccc(F)c1)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 303015498 SAXRWUNAZBZJFB-RCDICMHDSA-N 493.432 5.792 5 20 JKBD O=C(N[C@@H](Cc1ccc(O)cc1)c1nc2ccccc2[nH]1)c1csc(-c2cccc([N+](=O)[O-])c2)n1 496612860 RFTSLPHIFIRLJJ-NRFANRHFSA-N 485.525 5.014 5 20 JKBD O=C(Cn1c2ccccc2c(=O)c2ccccc21)N(Cc1ccc(F)cc1)c1nc2ccccc2s1 501763612 GFUKZLYFTPHWIH-UHFFFAOYSA-N 493.563 6.137 5 20 JKBD CC[C@H](C)n1c(S[C@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)nnc1-c1ccccc1 504312644 ABGWWEFZMNKSON-LSDHHAIUSA-N 450.524 5.728 5 20 JKBD Cc1noc([C@@H]2CCCN(C(=O)C/C(=C\c3ccc([N+](=O)[O-])cc3)c3nc4ccccc4s3)C2)n1 509150547 IICOJDGBDKUFRB-UIMCMNAESA-N 489.557 5.233 5 20 JKBD COc1cc([C@H](C)NC(=O)CSc2ccc(C(F)(F)F)cc2[N+](=O)[O-])ccc1OC(C)C 509326234 WVEQHYSYDMIUBQ-ZDUSSCGKSA-N 472.485 5.379 5 20 JKBD COc1ccc(CNCc2ccc(Oc3ccccc3Cl)c([N+](=O)[O-])c2)c(OC)c1OC 509611106 ZFDOQZFMGYTDKA-UHFFFAOYSA-N 458.898 5.356 5 20 JKBD COc1cc(C(=O)N2CC[C@H](C)Sc3ccccc32)c([N+](=O)[O-])cc1OCc1cscn1 512287734 VTKDIEWBXUTZRP-AWEZNQCLSA-N 471.560 5.170 5 20 JKBD COc1cc(C(=O)N(C)[C@@H](C)c2ccc(C(F)(F)F)cc2)c([N+](=O)[O-])cc1OCc1cscn1 512402597 DBUXAHVUVFJLHN-ZDUSSCGKSA-N 495.479 5.491 5 20 JKBD Cc1c(NC(=O)[C@@H](C)Nc2ccc(NC(=O)c3ccc(Cl)cc3)cc2)cccc1[N+](=O)[O-] 513208829 BJIVVOSBVBZLDO-OAHLLOKOSA-N 452.898 5.248 5 20 JKBD CCOc1ccc(-c2nc(NC(=O)c3cc(OCC(F)(F)F)ccc3[N+](=O)[O-])sc2C)cc1 516071945 WEVGJPLVJPYEQA-UHFFFAOYSA-N 481.452 5.619 5 20 JKBD COc1cc(C(=O)NCc2ccc(-c3csc(C)n3)cc2)c([N+](=O)[O-])cc1OCc1cscn1 520664274 RWZFPFBXLTWRGR-UHFFFAOYSA-N 496.570 5.001 5 20 JKBD CN(Cc1ccccc1[N+](=O)[O-])C(=O)C(=O)Nc1ccc(Oc2cc(Cl)ccc2Cl)c(F)c1 521619498 QPTMLEGBIUIMQI-UHFFFAOYSA-N 492.290 5.430 5 20 JKBD CC1(C)CN(CC2CN(C(=O)Cn3c4ccccc4c(=O)c4ccccc43)C2)c2cc(C3CC3)ccc21 566925770 DAKFUCOMBYSRFZ-UHFFFAOYSA-N 491.635 5.288 5 20 JKBD CCOC(=O)c1sc(-c2cccc([N+](=O)[O-])c2)cc1NC(=O)c1cnc2c(cnn2C(C)C)c1 589631125 ZKWVHLKJCJQUJH-UHFFFAOYSA-N 479.518 5.078 5 20 JKBD C[C@@H]1CCCN(c2ccc(C(=O)Nc3cccc(NC(=O)c4cccs4)c3)cc2[N+](=O)[O-])C1 591682049 PPXYTXIMRWEKIA-MRXNPFEDSA-N 464.547 5.397 5 20 JKBD CS(=O)(=O)c1ccc(NC(=O)c2ccccc2Sc2ccc(C(F)(F)F)cc2[N+](=O)[O-])cc1 603459964 JTBNDVHBFLLTBD-UHFFFAOYSA-N 496.488 5.421 5 20 JKBD COc1cc(C(=O)NC[C@H](c2ccccc2Cl)c2c[nH]c3ccccc23)c([N+](=O)[O-])cc1OC 603464070 HEMXEAWKUABFCV-GOSISDBHSA-N 479.920 5.309 5 20 JKBD Cc1ccc(-c2cc(C(=O)Nc3cc([N+](=O)[O-])ccc3OC(F)F)c3c(C)noc3n2)cc1 603638212 IJYHSPCMUUEMGL-UHFFFAOYSA-N 454.389 5.269 5 20 JKBD O=C(CCCOc1ccccc1)Nc1ccc(CNc2ccc([N+](=O)[O-])c3cnccc23)cc1 603859729 XKSMSQVTDRQKDK-UHFFFAOYSA-N 456.502 5.553 5 20 JKBD O=C(Nc1sc2c(c1-c1nc3ccccc3[nH]1)CCCC2)c1cc([N+](=O)[O-])cc2c1OCCO2 608931460 ULDABBAOOUKMNY-UHFFFAOYSA-N 476.514 5.102 5 20 JKBD O=C(N[C@@H](c1ccccc1)C1CC1)c1ccc(C(=O)N[C@@H](c2ccccc2)C2CC2)c([N+](=O)[O-])c1 609043634 FXGOZQVVSASPEU-UIOOFZCWSA-N 469.541 5.357 5 20 JKBD Cc1csc([C@H](C)NCc2ccc(Sc3nc4ccc([N+](=O)[O-])cc4s3)c([N+](=O)[O-])c2)n1 727837930 YRMVNXUKEXLYKD-LBPRGKRZSA-N 487.588 5.880 5 20 JKBD C[C@@H](OC(=O)c1cnn(-c2ncccc2Cl)c1C(F)(F)Cl)c1cccc([N+](=O)[O-])c1 730962611 XFEKOUFSFUAXLW-SNVBAGLBSA-N 457.220 5.035 5 20 JKBD Cc1ccc(OCc2nc(COC(=O)c3csc(-c4cccc([N+](=O)[O-])c4)n3)cs2)cc1 747961761 KFCZVNIYEIYFJN-UHFFFAOYSA-N 467.528 5.419 5 20 JKBD Cc1oc(-c2ccco2)nc1CC(=O)Oc1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2Cl)cc1 749475435 VSUHTHFCAZUAPM-UHFFFAOYSA-N 481.848 5.205 5 20 JKBD O=C(Nc1ccccc1SC(F)(F)F)c1ccc([N+](=O)[O-])cc1I 751086919 MNQSCFQQZBIRGL-UHFFFAOYSA-N 468.194 5.064 5 20 JKBD Cc1nc(COc2cccc(C(=O)N(Cc3nnc(-c4cccc([N+](=O)[O-])c4)o3)C(C)C)c2)cs1 783560045 CPYYZTVOKQLCQF-UHFFFAOYSA-N 493.545 5.040 5 20 JKBD CC(C)OC(=O)C[C@@H](NC(=O)c1nc(Cl)c(Cl)c(Cl)c1Cl)c1ccccc1[N+](=O)[O-] 836978730 VCBMVOHYQJHFOU-SNVBAGLBSA-N 495.146 5.416 5 20 JKBD CC(=O)Nc1cccc([C@@H](C)N(Cc2ccccc2)C(=O)c2cc(Cl)ccc2[N+](=O)[O-])c1 841837221 AXXFVGDKSJVYMU-MRXNPFEDSA-N 451.910 5.610 5 20 JKBD O=C(NCc1nc(C2CC2)no1)c1c2c(nc3ccccc13)/C(=C\c1cccc([N+](=O)[O-])c1)CCC2 917765364 ILCMBKMTDSISSQ-AQTBWJFISA-N 481.512 5.210 5 20 JKBD CCCN(C(=O)c1cccc([N+](=O)[O-])c1C)c1cccc(NC(=O)c2cccc([N+](=O)[O-])c2C)c1 920003171 HXQTWJFBASYLIX-UHFFFAOYSA-N 476.489 5.429 5 20 JKBD C[C@H](Nc1ccc(C(=O)O[C@H](C)c2nnc(-c3cccs3)o2)cc1[N+](=O)[O-])c1ccccn1 920545239 HOCNLLKNHWUXAK-UONOGXRCSA-N 465.491 5.192 5 20 JKBD CC(C)[C@@H](OC(=O)c1ccc(N[C@H](C)c2ccccn2)c([N+](=O)[O-])c1)C(=O)Nc1ccccc1F 920545614 UHMJLODPTRNTKR-WAIKUNEKSA-N 480.496 5.122 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Cl)[C@@H](c1ccccc1)N1CCc2c(ncn2-c2ccccc2)C1 929072334 LWNJTYBYGGVTFU-RUZDIDTESA-N 487.947 5.172 5 20 JKBD O=C(CCc1cccc([N+](=O)[O-])c1)NC1(c2ccc(NC(=O)c3ccc(Cl)nc3)cc2)CCC1 1785755466 CVHJCUNWEDVJHS-UHFFFAOYSA-N 478.936 5.024 5 20 JKBD C/C(=C\c1cccs1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc2cc([N+](=O)[O-])ccc2s1 1801206443 FPEWUIAMARVVFU-XOXKHUMBSA-N 481.599 5.226 5 20 JKBD COc1ccc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)c(Cl)c1 1801208831 RSJPLZLCGPSUTH-MUJYYYPQSA-N 499.976 5.037 5 20 JKBD CC(C)[C@H](C(=O)N1CCCC2(CCN(C(=O)/C=C/c3ccccc3[N+](=O)[O-])CC2)C1)c1ccccc1 1805623370 MXKVIQXKIKWJPL-DEIPZHPTSA-N 489.616 5.279 5 20 JKBD Cc1c(C(=O)N2CCC3(CCCN(C(=O)C(C)(C)C(C)(F)F)C3)CC2)cc(Cl)cc1[N+](=O)[O-] 1806183766 ZGOVSPVPQKHONJ-UHFFFAOYSA-N 485.959 5.083 5 20 JKBD CCCCC[C@H](C)C(=O)Nc1cc([C@H]2CCCCN2C(=O)CSc2ccccc2[N+](=O)[O-])[nH]n1 1822004994 HKSWIKOXTOXQGM-PKOBYXMFSA-N 487.626 5.319 5 20 JKBD O=C(c1cc2ccccc2o1)N1CCC([C@H]2CCCCN2C(=O)CCc2cccc([N+](=O)[O-])c2)CC1 1824839616 MSZKPDNZAAIMHP-XMMPIXPASA-N 489.572 5.207 5 20 JKBD CC(C)c1csc(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)/C=C/c3ccccc3[N+](=O)[O-])CC2)n1 1825385818 NWRFCAWQSXFGKR-NELJVSICSA-N 496.633 5.121 5 20 JKBD Cc1ccc(CC(=O)N2CCC([C@@H]3CCCCN3C(=O)c3sccc3Cl)CC2)cc1[N+](=O)[O-] 1829447414 XCPGGEQMFQMJKH-FQEVSTJZSA-N 490.025 5.094 5 20 JKBD C/C=C(\C)C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)CC1 1831061364 QYRNHMNEEZOICL-VYFWZWAVSA-N 455.580 5.009 5 20 JKBD O=C(c1cccc2ccoc12)N1CCC([C@@H]2CCCCN2C(=O)/C=C/c2ccccc2[N+](=O)[O-])CC1 1832903671 HIXGKOWOPVBJGQ-LCJITAHGSA-N 487.556 5.288 5 20 JKBD O=C(CSc1nnc(Cc2ccccc2)n1-c1ccccc1)Nc1cc([N+](=O)[O-])ccc1Cl 12105366 GBGBNKLRCKZEEW-UHFFFAOYSA-N 479.949 5.151 5 20 JKBD COCc1cccc(NC(=O)C/C(=C/c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)c1 25824992 WQPBDMGFDYVGNE-UYRXBGFRSA-N 459.527 5.920 5 20 JKBD Cc1c(Cl)cccc1-n1c(SCCC(=O)Nc2ccccc2[N+](=O)[O-])nnc1-c1ccncc1 26361938 ZISZOFMWWAQCEZ-UHFFFAOYSA-N 494.964 5.320 5 20 JKBD C[C@H]1Oc2ccc(NC(=O)c3ccc(Oc4ccc(Cl)cc4[N+](=O)[O-])cc3)cc2NC1=O 27019434 MKFWQIIISIYZDN-GFCCVEGCSA-N 453.838 5.012 5 20 JKBD CCn1c(SCc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)nc2scc(-c3cccs3)c2c1=O 29813254 USGCGNXQBYJLIA-UHFFFAOYSA-N 497.583 5.457 5 20 JKBD COCCOc1cc([N+](=O)[O-])c(C(=O)Nc2nc(-c3cccc(C(F)(F)F)c3)cs2)cc1OC 69569667 ADYRFXDKANXIHX-UHFFFAOYSA-N 497.451 5.023 5 20 JKBD C[C@H](Nc1ccc(C(=O)N2CCN(Cc3cccc4ccccc34)CC2)cc1[N+](=O)[O-])c1ccccn1 108790492 GWLSEVHPJXNTRJ-NRFANRHFSA-N 495.583 5.274 5 20 JKBD O=C(Nc1ncc(Cc2ccc(F)c(F)c2)s1)c1csc(-c2cccc([N+](=O)[O-])c2)n1 303031402 ODKDZIRTSHAATR-UHFFFAOYSA-N 458.471 5.296 5 20 JKBD O=C(NC[C@H]1CCN(CCc2ccccc2)C1)c1cc([N+](=O)[O-])ccc1Sc1ccccc1 487016174 ZNJXGEXOXLRPFO-OAQYLSRUSA-N 461.587 5.040 5 20 JKBD O=C(Nc1cc(Cl)ccc1OCC(F)(F)F)c1csc(-c2cccc([N+](=O)[O-])c2)n1 496364234 RJJRXVLRASRXGJ-UHFFFAOYSA-N 457.817 5.565 5 20 JKBD O=C(Nc1ccc(CNCc2ccc(Oc3ccccc3Cl)c([N+](=O)[O-])c2)cc1)c1ccncc1 507943062 XCECVQKSNDFSRT-UHFFFAOYSA-N 488.931 5.978 5 20 JKBD COc1ccccc1Oc1ccc(NC(=O)c2ccc(N3CCCC3)c([N+](=O)[O-])c2)cc1F 510230702 UTNBVJNUWQWDAA-UHFFFAOYSA-N 451.454 5.387 5 20 JKBD Cc1nc(-c2ccc(F)cc2)sc1[C@H](C)Nc1ccc([N+](=O)[O-])c(C(=O)N2CCCC2)c1 511425953 BBBBEMDQJQFTCF-AWEZNQCLSA-N 454.527 5.575 5 20 JKBD COc1ccc2[nH]cc(C3=CCN(C(=O)c4ccc(N5CCC[C@@H](C)C5)c([N+](=O)[O-])c4)CC3)c2c1 515826307 FTZIUEMXFQZAGB-GOSISDBHSA-N 474.561 5.251 5 20 JKBD O=C(CSc1ccc(C(F)(F)F)cc1[N+](=O)[O-])Nc1ccc2nc([C@@H]3CCCO3)[nH]c2c1 516771635 XHXRPTNXVGFLPG-INIZCTEOSA-N 466.441 5.072 5 20 JKBD COc1ccccc1NC(=O)C1CCN(C(=O)c2cc([N+](=O)[O-])ccc2Sc2ccccc2)CC1 603620279 OXNFJSZYOXTQKQ-UHFFFAOYSA-N 491.569 5.246 5 20 JKBD CCCN(Cc1nnc(-c2ccccc2Cl)o1)C(=O)c1cc2cc([N+](=O)[O-])ccc2s1 603820984 MTXXFOGQQQVJGP-UHFFFAOYSA-N 456.911 5.565 5 20 JKBD O=C(Nc1ccc(NS(=O)(=O)c2c(Cl)cccc2Cl)cc1)c1ccc([N+](=O)[O-])cc1F 603933149 HFSYPRGATSGPGV-UHFFFAOYSA-N 484.292 5.094 5 20 JKBD C[C@H](Nc1ccc(NC(=O)c2ccco2)c(Cl)c1)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl 604126643 GOLCHZCHWWBIKW-NSHDSACASA-N 463.277 5.186 5 20 JKBD C[C@H](Nc1ccc(C(=O)N2CCC[C@H](c3cc4ccccc4[nH]3)C2)cc1[N+](=O)[O-])c1ccccn1 604336880 KBQNKAXPEQTRNZ-RXVVDRJESA-N 469.545 5.664 5 20 JKBD Cc1cccc(COc2ccc([C@@H](C)NC(=O)CCCn3c(=O)oc4cc([N+](=O)[O-])ccc43)cc2)c1 609032776 GQMXXTNKLXAEEB-LJQANCHMSA-N 489.528 5.048 5 20 JKBD CCOc1cc(NC(=O)Cc2sc(C)nc2-c2ccc(C)cc2)c([N+](=O)[O-])cc1OCC 619212727 GKIIALCPFGRAHT-UHFFFAOYSA-N 455.536 5.314 5 20 JKBD Cc1ccc[n+](/C(C(=S)Nc2ccc(OC(C)C)cc2)=C(/O)c2cccc([N+](=O)[O-])c2)c1 726574235 OWYPMXHANDBKFP-UHFFFAOYSA-O 450.540 5.301 5 20 JKBD CSc1ccc(NC(=O)COC(=O)c2ccccc2C(=O)c2ccc(SC)c([N+](=O)[O-])c2)cc1 800788480 SDMNTQWOCMXKMH-UHFFFAOYSA-N 496.566 5.065 5 20 JKBD Cc1nn(Cc2ccc(F)cc2)c(Cl)c1C(=O)Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1 821735782 DFQIDGLRNWSPIJ-UHFFFAOYSA-N 471.901 5.316 5 20 JKBD Cc1cc(C(=O)N2CCC[C@H]2c2nc(-c3ccc(Oc4ccccc4)nc3)no2)ccc1[N+](=O)[O-] 904455395 XQZQUKCSQBENHK-NRFANRHFSA-N 471.473 5.118 5 20 JKBD COc1cccc([C@@H](CNC(=O)c2cc(Cl)ccc2[N+](=O)[O-])c2c[nH]c3ccccc23)c1OC 912663953 DACSBIDMMJYKAN-HXUWFJFHSA-N 479.920 5.309 5 20 JKBD COC(=O)N(C)c1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2Sc2ccc(Cl)cc2)cc1 919892737 NFJPESNKXFGVHK-UHFFFAOYSA-N 471.922 5.854 5 20 JKBD C[C@H](Nc1ccc(C(=O)OCC(=O)Nc2ccccc2-c2ccccc2)cc1[N+](=O)[O-])c1ccccn1 920546944 LUNSPHODKMYIFA-IBGZPJMESA-N 496.523 5.625 5 20 JKBD CC(C)=CCCC(=O)Nc1ccc(C2(NC(=O)Cn3ccc4ccc([N+](=O)[O-])cc43)CCC2)cc1 1790450093 DOJRHXIJFSFLDT-UHFFFAOYSA-N 474.561 5.430 5 20 JKBD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(Oc2ccccc2)cc1)c1ccc([N+](=O)[O-])cc1F 1800348579 PRCFZBZGPVGUQZ-ACDBMABISA-N 489.503 5.092 5 20 JKBD Cc1cc(CCCC(=O)N2CCC3(CCCN(C(=O)C4CCCCC4)C3)CC2)c([N+](=O)[O-])cc1F 1808970237 RRHIORCKJRHPSK-UHFFFAOYSA-N 487.616 5.177 5 20 JKBD Cc1oc(C(C)(C)C)cc1C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cccc(F)c2[N+](=O)[O-])n[nH]1 1821168737 FEDRNYBWJYIYFL-LJQANCHMSA-N 497.527 5.276 5 20 JKBD O=C(c1cccc2ccccc12)N1CCC([C@@H]2CCCCN2C(=O)Cc2cccc([N+](=O)[O-])c2)CC1 1823679895 UYYCIEONKBSRCL-MHZLTWQESA-N 485.584 5.224 5 20 JKBD Cc1c(C(=O)N2CCC([C@H]3CCCCN3C(=O)c3cccc(F)c3[N+](=O)[O-])CC2)oc2ccccc12 1830621835 NPLWVXUUPVOKBC-JOCHJYFZSA-N 493.535 5.336 5 20 JKBD Cc1ccoc1C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cc(Cl)cc([N+](=O)[O-])c2C)CC1 1830735338 JFMACSMVNNPOHG-HXUWFJFHSA-N 473.957 5.005 5 20 JKBD O=C(c1ccc([N+](=O)[O-])cc1F)N1CCC([C@@H]2CCCCN2C(=O)C2(c3ccccc3)CCC2)CC1 1831782806 XFYJLJUXTJOYQY-VWLOTQADSA-N 493.579 5.089 5 20 JKBD CC(C)=CCCC(=O)N1CCC(OC2CCN(C(=O)c3cc4cc([N+](=O)[O-])ccc4s3)CC2)CC1 1838630879 XETSIAXPTZOSOI-UHFFFAOYSA-N 499.633 5.168 5 20 JKBD CCn1c(S[C@@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2)nc2scc(-c3cccs3)c2c1=O 9751440 AOSVRDBZZUXFML-LBPRGKRZSA-N 486.600 5.234 5 20 JKBD CCc1cccc(C)c1NC(=O)COC(=O)c1ccccc1C(=O)c1ccc(SC)c([N+](=O)[O-])c1 10154771 WWHFYKZNOIGZHU-UHFFFAOYSA-N 492.553 5.214 5 20 JKBD O=C(CSc1nc2ccc([N+](=O)[O-])cc2s1)N1N=C(c2cccs2)C[C@H]1c1ccco1 10592500 JTMGCNWCMYDXTJ-HNNXBMFYSA-N 470.557 5.329 5 20 JKBD COc1cc(C(=O)Nc2cc(C(F)(F)F)ccc2N2CCCC2)c([N+](=O)[O-])cc1OC(F)F 10810018 LUZBARGLUOANQY-UHFFFAOYSA-N 475.370 5.076 5 20 JKBD Cc1ccc(C(=O)c2ccccc2C(=O)O[C@@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)cc1 17528479 BRVHMXFAABKMFB-INIZCTEOSA-N 457.442 5.102 5 20 JKBD C[C@@H](OC(=O)c1oc2ccccc2c1COc1ccccc1)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 17710816 WJOFWQZBRBERET-MRXNPFEDSA-N 485.452 5.888 5 20 JKBD CCN(CC)Cc1cccc(NC(=O)c2ccccc2NC(=O)c2ccc([N+](=O)[O-])cc2Cl)c1 24926528 BYVYLDDKXIJVHO-UHFFFAOYSA-N 480.952 5.595 5 20 JKBD C[C@H]1CCCN(Cc2ccccc2CNC(=O)c2ccc(N[C@@H](C)c3ccccn3)c([N+](=O)[O-])c2)C1 108829255 PFKHRIJOGHHWEE-SFTDATJTSA-N 487.604 5.325 5 20 JKBD Cc1nc(-c2cccc(NC(=O)c3ccc(N[C@@H](C)c4ccccn4)c([N+](=O)[O-])c3)c2)oc1C 108854007 BEHIZGHTXGXGAQ-INIZCTEOSA-N 457.490 5.687 5 20 JKBD Cc1ccc(NC(=O)c2ccc(N[C@@H](C)c3ccccn3)c([N+](=O)[O-])c2)c(OC[C@H]2CCCO2)c1 108891227 VQDMKPRJCPVBLQ-AZUAARDMSA-N 476.533 5.281 5 20 JKBD O=C(Nc1ccc(NCc2nc(-c3cccc([N+](=O)[O-])c3)no2)c(C(F)(F)F)c1)c1ccoc1 109097719 WPYIWOYJNDRGKM-UHFFFAOYSA-N 473.367 5.121 5 20 JKBD C[C@H](Nc1ccc(C(=O)Nc2cccc(C(=O)Nc3cccc(F)c3)c2)cc1[N+](=O)[O-])c1ccccn1 410088552 QOZQMYOSDHGKRG-KRWDZBQOSA-N 499.502 5.807 5 20 JKBD COc1cc(CN(C)C(=O)CSc2ccc(C(F)(F)F)cc2[N+](=O)[O-])ccc1SC 477853111 XSCSEWIJEBKOMG-UHFFFAOYSA-N 460.499 5.095 5 20 JKBD CN(CCCCCc1cc(-c2ccccc2)n[nH]1)C(=O)c1csc(-c2cccc([N+](=O)[O-])c2)n1 478402069 SDJNHXBKAZVARZ-UHFFFAOYSA-N 475.574 5.593 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)N(c2cccc(C(F)(F)F)c2)[C@H](C)C2CC2)cc1SC 482963017 XNNGHTJCDKUWLH-GFCCVEGCSA-N 454.470 5.789 5 20 JKBD CN(CC(F)(F)F)C(=O)c1c2c(nc3ccccc13)/C(=C\c1ccc([N+](=O)[O-])cc1)CCC2 485319258 MIWJDGXOIRHSQY-SSZFMOIBSA-N 455.436 5.654 5 20 JKBD Cc1ccc(NC(=O)c2ccc(N[C@H](C)c3ccccn3)c([N+](=O)[O-])c2)c(Br)c1 506230305 BNBFHUQTSNOBID-CQSZACIVSA-N 455.312 5.486 5 20 JKBD CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccc(Oc2ccc(S(C)(=O)=O)cc2)cc1 509955623 BAMFYMSOMAYADC-UHFFFAOYSA-N 483.546 5.233 5 20 JKBD CCCOc1ccccc1Oc1ncccc1CNc1ccc([N+](=O)[O-])c(C(=O)N2CCCC2)c1 510727647 STQHFGDZHQPYDK-UHFFFAOYSA-N 476.533 5.419 5 20 JKBD COc1ccc(NC(=O)N[C@H](C)c2cccc([N+](=O)[O-])c2)cc1NC(=O)c1ccc(Cl)cc1F 511475314 NPKIBCQLUMLYIX-CYBMUJFWSA-N 486.887 5.531 5 20 JKBD COc1cc(C(=O)N(Cc2cccnc2)c2ccc(F)cc2)c([N+](=O)[O-])cc1OCc1cscn1 512325071 VFKUFNQBNPSOGQ-UHFFFAOYSA-N 494.504 5.020 5 20 JKBD CCc1ccc(OCc2nnc(Sc3ncccc3[N+](=O)[O-])n2[C@@H](C)c2ccccc2)cc1 514652856 KTVRVEGZOBWXED-KRWDZBQOSA-N 461.547 5.483 5 20 JKBD O=C(Nc1ccc(NCc2nc(-c3ccc([N+](=O)[O-])cc3)no2)c(C(F)(F)F)c1)c1ccco1 516818613 DOOUVDJAUXUHIF-UHFFFAOYSA-N 473.367 5.121 5 20 JKBD CC[C@H](NCc1ccc(-c2ccc([N+](=O)[O-])cc2)s1)c1ccccc1OCC(=O)N(C)C 517534185 NGZZDBZZXSIJIS-NRFANRHFSA-N 453.564 5.031 5 20 JKBD COCCN(C(=O)[C@@H](C)Oc1cccc(Cl)c1Cl)c1nc(-c2ccc([N+](=O)[O-])cc2)cs1 518171376 RNJYMTRHCKNQLB-CYBMUJFWSA-N 496.372 5.472 5 20 JKBD CC(C)CC(=O)Nc1cccc(CN[C@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2ccccc2)c1 518853656 ZYZWCZXWRNXOEZ-VWLOTQADSA-N 494.979 5.702 5 20 JKBD COc1cc(C(=O)Nc2ccc(Oc3ccccc3)cc2C(F)(F)F)c([N+](=O)[O-])cc1OC 519097817 SWVQXMHABWSLMC-UHFFFAOYSA-N 462.380 5.675 5 20 JKBD Cc1ccc(NC(=O)NC[C@@H]2CCCN(C(=O)c3ccc(Nc4ccccc4)c([N+](=O)[O-])c3)C2)cc1 524273312 JKSVWKKLUUPZRQ-FQEVSTJZSA-N 487.560 5.321 5 20 JKBD CN(C(=O)c1cccc(C(=O)Nc2ccc([N+](=O)[O-])cc2C(=O)c2ccccc2)c1)c1ccccc1 552377472 FLLOPQIOLMUKBL-UHFFFAOYSA-N 479.492 5.355 5 20 JKBD COc1ccc(CSCC(=O)Nc2ccc(NC(=O)Nc3ccccc3)cc2)cc1[N+](=O)[O-] 603574713 GJYAMDOCHPKFMA-UHFFFAOYSA-N 466.519 5.119 5 20 JKBD Cc1ccc(NC(=O)Cc2ccc(NC(=O)c3ccc(Br)cc3)cc2)cc1[N+](=O)[O-] 603750412 PJSVDOPZAFRYFH-UHFFFAOYSA-N 468.307 5.099 5 20 JKBD COc1cc(C(=O)Nc2cc(-c3ccccc3)nn2-c2ccccc2C)c([N+](=O)[O-])cc1OC(F)F 603760783 UJIIRMRJELOHQO-UHFFFAOYSA-N 494.454 5.618 5 20 JKBD O=C(Nc1ccc(NC(=O)c2cc3cc([N+](=O)[O-])ccc3o2)c(C(F)(F)F)c1)c1ccoc1 603762112 VGUJZTJMFAPCNT-UHFFFAOYSA-N 459.336 5.457 5 20 JKBD Cc1csc(Sc2ccc(C(=O)Nc3ccc(C(=O)NC4CCCC4)cc3)cc2[N+](=O)[O-])n1 603976810 XTWBCXUMMJFRSX-UHFFFAOYSA-N 482.587 5.436 5 20 JKBD C[C@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)Nc1ccc(NC(=O)c2ccc(Cl)cc2)cc1 604445501 LTWTYVOYHGFDNL-ZDUSSCGKSA-N 474.300 5.560 5 20 JKBD C[C@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)N1CCC[C@@H]1c1cccc(Br)c1 604446949 LGNQZUISGVJMHU-BLLLJJGKSA-N 453.720 5.142 5 20 JKBD O=C1CCCN1C[C@@H](NCc1ccc(-c2ccccc2[N+](=O)[O-])s1)c1cccc(C(F)(F)F)c1 608835980 DTNCTQUHUOVFOP-HXUWFJFHSA-N 489.519 5.795 5 20 JKBD COc1ccccc1N1CCC(NCc2cn(-c3ccccc3)nc2-c2ccc([N+](=O)[O-])cc2)CC1 608836887 OYJOGNAZFCQUCW-UHFFFAOYSA-N 483.572 5.215 5 20 JKBD C[C@@H](OC(=O)/C=C\c1cccc(OC2CCCC2)c1)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 727887185 QCCYQMMLNJQXPA-HMVFGEFZSA-N 492.450 5.519 5 20 JKBD CCn1c(COC(=O)c2ccc(N[C@@H](C)c3ccccn3)c([N+](=O)[O-])c2)nc2c(F)cccc21 728625243 ZAQCYOJFIZFAKV-HNNXBMFYSA-N 463.469 5.029 5 20 JKBD C[C@@H](OC(=O)c1csc(-c2ccc([N+](=O)[O-])cc2)n1)c1cccc(NC(=O)c2ccccc2)c1 747954937 OUGYIQJPTBXGQR-MRXNPFEDSA-N 473.510 5.889 5 20 JKBD COc1cc(C(=O)Nc2sc(C)c(-c3ccccc3)c2C(=O)OC(C)C)c([N+](=O)[O-])cc1OC 913193379 KPLBZLWNVXEXIP-UHFFFAOYSA-N 484.530 5.466 5 20 JKBD COc1cc([C@@H](C)Nc2cc([N+](=O)[O-])c(OC)c(Br)c2[N+](=O)[O-])ccc1OC(C)C 915210987 JSSUEGQIWGJPRJ-LLVKDONJSA-N 484.303 5.243 5 20 JKBD CCOc1ccc(C(=O)Nc2cc(Cl)c([N+](=O)[O-])cc2OCc2ccccc2)cc1[N+](=O)[O-] 916827662 PTUOKUMNXDWYLL-UHFFFAOYSA-N 471.853 5.386 5 20 JKBD C[C@@H](Nc1ccc(C(=O)OCc2csc(-c3cccs3)n2)cc1[N+](=O)[O-])c1ccccn1 920548775 SKFCVAWGCLIFBN-CQSZACIVSA-N 466.544 5.705 5 20 JKBD Cc1ccc(NC(=O)c2cccc(C(F)(F)F)c2)cc1NC(=O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1 920845397 TVVMNEMZMJHJMH-UHFFFAOYSA-N 488.378 5.335 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)[C@H]3C[C@H]3c3ccc(F)c(F)c3)CCC2)cc1)c1ccc([N+](=O)[O-])o1 1785748802 RUMZMDUKPGMIPW-ROUUACIJSA-N 481.455 5.017 5 20 JKBD O=C(CCc1cccc([N+](=O)[O-])c1)Nc1ccc(C2(NC(=O)[C@@]3(F)CCCC=C3F)CCC2)cc1 1786601589 ZPHMYGHAIWQNPN-AREMUKBSSA-N 483.515 5.407 5 20 JKBD COc1cc(C(=O)NC2(c3ccc(NC(=O)C4(C(F)(F)F)CCC4)cc3)CCC2)ccc1[N+](=O)[O-] 1787938747 BVJNQBUNUOWFDR-UHFFFAOYSA-N 491.466 5.084 5 20 JKBD O=C(Cc1ccc([N+](=O)[O-])cc1F)NC1(c2ccc(NC(=O)c3cc4ccccc4o3)cc2)CCC1 1789006156 ZLOOXHBEVLLTGC-UHFFFAOYSA-N 487.487 5.471 5 20 JKBD CN(C)c1ccc([N+](=O)[O-])c(C(=O)NC2(c3ccc(NC(=O)c4cccc5cc[nH]c45)cc3)CCC2)c1 1789093647 BGDJGTCSCYGRFB-UHFFFAOYSA-N 497.555 5.204 5 20 JKBD Cc1c(C(=O)Nc2ccc(C3(NC(=O)CN4CCC(C)CC4)CCC3)cc2)cc(Cl)cc1[N+](=O)[O-] 1790773417 FZOXQYRIDJWQIL-UHFFFAOYSA-N 499.011 5.036 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc2occ(Cl)c2c1 1799330370 BCJMWIAHLPROOQ-MUJYYYPQSA-N 485.899 5.008 5 20 JKBD Cc1cc(CCCC(=O)Nc2cc([C@H]3CCCCN3C(=O)CC(C)(C)C)[nH]n2)c([N+](=O)[O-])cc1F 1815071507 VMICZXJVIJSMLU-HXUWFJFHSA-N 487.576 5.217 5 20 JKBD CCCCC[C@@H](C)C(=O)N1CCCC[C@H]1c1cc(NC(=O)CSc2ccccc2[N+](=O)[O-])n[nH]1 1822313050 KAWZMDOYUHAFEZ-MJGOQNOKSA-N 487.626 5.319 5 20 JKBD O=C(CC1CCCC1)N1CCCC[C@@H]1C1CCN(C(=O)C2(c3cccc([N+](=O)[O-])c3)CCC2)CC1 1826264906 YDBXRHMRNVBKAP-RUZDIDTESA-N 481.637 5.217 5 20 JKBD O=C(c1ccoc1Cl)N1CCCC[C@@H]1C1CCN(C(=O)C2(c3cccc([N+](=O)[O-])c3)CCC2)CC1 1829863170 SPZWGZOVIRISMT-JOCHJYFZSA-N 499.995 5.196 5 20 JKBD CC1=CC[C@@H](C(=O)N2CCC([C@H]3CCCCN3C(=O)C3(c4cccc([N+](=O)[O-])c4)CCC3)CC2)CC1 1830293152 SVLXQVTUAVMDIP-ZEQKJWHPSA-N 493.648 5.383 5 20 JKBD O=C([C@@H]1CCC[C@@H]2CCCC[C@@H]21)N1CC2(CCCN2C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)C1 1845739028 FAXIXCMLUNMZIG-DZFGPLHGSA-N 481.618 5.233 5 20 JKBD C[C@@H](OC(=O)c1ccccc1COc1ccccc1)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl 10852586 HGEWLNIXOSHMKI-OAHLLOKOSA-N 454.866 5.011 5 20 JKBD C[C@@H](OC(=O)c1sccc1-c1ccccc1)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 10986230 HGECILZVONDSAB-GFCCVEGCSA-N 464.421 5.526 5 20 JKBD C[C@H](Sc1nnc(-c2cccs2)n1C1CC1)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 17271050 LGERCIVLVZTSPE-JTQLQIEISA-N 483.497 5.388 5 20 JKBD COCCOc1cc([N+](=O)[O-])c(C(=O)Nc2ccc(Oc3ccccc3Cl)cc2)cc1OC 22023610 JMQDCBRQOBUZAK-UHFFFAOYSA-N 472.881 5.327 5 20 JKBD CCn1c(S[C@H](C)c2nc(=O)c3c(C)c(C)sc3[nH]2)nc2cc3ccccc3cc2c1=O 24891854 BHZJICPEPUKZIO-CQSZACIVSA-N 462.600 5.338 5 20 JKBD CCOc1cc(C(=O)Nc2nc(-c3cc(Cl)sc3Cl)cs2)c([N+](=O)[O-])cc1OC 26793289 ZQUSDSIOOZQMDD-UHFFFAOYSA-N 474.347 5.746 5 20 JKBD CC(=O)Nc1ccc(Cl)c(NC(=O)c2ccc(N[C@H](C)c3ccccn3)c([N+](=O)[O-])c2)c1 108886694 ZXJAUFMHXZPZML-CYBMUJFWSA-N 453.886 5.027 5 20 JKBD O=C(Cn1nc(-c2cccc([N+](=O)[O-])c2)ccc1=O)Nc1ccccc1Sc1ccc(Cl)cc1 195741501 NPFAKBUPVUIXID-UHFFFAOYSA-N 492.944 5.262 5 20 JKBD O=C(CSc1nnc2c(Cl)cc(C(F)(F)F)cn12)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 255940744 YPFQPICXZHLJCR-UHFFFAOYSA-N 499.780 5.059 5 20 JKBD Cc1ccc(NC(=O)Cc2nc(COc3ccc(-c4ccccc4)cc3[N+](=O)[O-])cs2)cc1 476633817 KDOVNYCOVKPEJO-UHFFFAOYSA-N 459.527 5.787 5 20 JKBD O=C(NCC1CCOCC1)c1c2c(nc3ccccc13)/C(=C/c1cccc([N+](=O)[O-])c1)CCC2 501717961 PKLLSPUJJCDVAX-HMMYKYKNSA-N 457.530 5.176 5 20 JKBD O=C(Nc1ccn(CCc2ccncc2)n1)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1 503317248 SSEGPAIPUYMBIV-UHFFFAOYSA-N 463.881 5.127 5 20 JKBD O=C(C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)N1CCC(OC2CCCC2)CC1 503364979 DCLCHMBUIGDXSZ-JZJYNLBNSA-N 491.613 6.085 5 20 JKBD COc1ccc(Br)cc1[C@@H]1CCCN1C(=O)c1csc(-c2cccc([N+](=O)[O-])c2)n1 504970558 IJDNFTCBRWIEKS-SFHVURJKSA-N 488.363 5.467 5 20 JKBD Cc1cc(NC(=O)c2ccc(N[C@@H](C)c3ccccn3)c([N+](=O)[O-])c2)ccc1Br 506008344 BAYAXNZXYQOCTQ-AWEZNQCLSA-N 455.312 5.486 5 20 JKBD Cc1nc(NC(=O)c2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)sc1Cc1ccccc1Cl 507424239 OFULRCUOQZKBSE-UHFFFAOYSA-N 467.938 5.257 5 20 JKBD CCOc1cc(C(=O)Nc2cc3c(cc2Sc2ccccc2)OCCO3)c([N+](=O)[O-])cc1OC 509265669 AOIUYSUWRPIRTE-UHFFFAOYSA-N 482.514 5.177 5 20 JKBD Cc1ccc(NC(=O)C(=O)N(Cc2ccc(-c3ccccc3C(F)(F)F)o2)C2CC2)cc1[N+](=O)[O-] 516301140 SCXDSSGRCJXWDY-UHFFFAOYSA-N 487.434 5.312 5 20 JKBD O=C(N[C@H](CC(F)(F)F)c1ccccc1)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 516542546 AGODDRBXSLJYFO-QGZVFWFLSA-N 489.416 5.640 5 20 JKBD Cc1ccc(NC(=O)c2cccc(C(F)(F)F)c2)cc1NC(=O)N[C@H](C)c1cccc([N+](=O)[O-])c1 520489574 XBOGQJLKKWKYBC-OAHLLOKOSA-N 486.450 6.057 5 20 JKBD O=[N+]([O-])c1ccc(-c2nn(-c3ccccc3)cc2CN[C@@H](c2ccccc2)[C@H]2CCCO2)cc1 520962179 STOMYOIVCVTPHD-VPUSJEBWSA-N 454.530 5.457 5 20 JKBD CS(=O)(=O)Nc1ccc(-c2csc(NC(=O)c3cc4ccccc4c4cccnc34)n2)cc1 591829365 WRUOKFRZVRGMQL-UHFFFAOYSA-N 474.567 5.135 5 20 JKBD Cc1ccc(-n2c(SCc3cc([N+](=O)[O-])cc4c3OCOC4)nnc2-c2ccccn2)c(C)c1 603918441 XIVQCIGFVOZOPS-UHFFFAOYSA-N 475.530 5.013 5 20 JKBD O=C(C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)N1CCC[C@H](c2cc[nH]n2)C1 608813093 AKWFLYXCUNCKJL-OWBBTNHHSA-N 473.558 5.265 5 20 JKBD CC(C)[C@@H](C)N1Cc2cccc(N[C@@H](C)C(=O)Nc3ccc([N+](=O)[O-])cc3C(F)(F)F)c2C1 609041241 GTYXNXLUMLFLIJ-LSDHHAIUSA-N 464.488 5.413 5 20 JKBD COc1cc(C(=O)Nc2nc3ccccc3n2Cc2cccc(C(F)(F)F)c2)ccc1[N+](=O)[O-] 609062890 LXFNOYCLNNCCNF-UHFFFAOYSA-N 470.407 5.273 5 20 JKBD Cc1cc(-c2cc(C(=O)Nc3ccnn3-c3ccc([N+](=O)[O-])cc3)c3cnn(C(C)C)c3n2)c(C)o1 609151356 HKSYAWKRGHQTBS-UHFFFAOYSA-N 485.504 5.235 5 20 JKBD C[C@H](OC(=O)c1cc([N+](=O)[O-])ccc1Br)C(=O)Nc1ccccc1Cc1ccccc1 725984455 CMRHOVJWAUCESQ-HNNXBMFYSA-N 483.318 5.132 5 20 JKBD CNS(=O)(=O)c1ccc2c(c1)CCN2C(=O)CCC(=O)c1ccc2ccc3cccc4ccc1c2c34 728152920 XALARWJMXWKZOE-UHFFFAOYSA-N 496.588 5.044 5 20 JKBD CCOc1cccc(NC(=S)/C(=C(/O)c2ccc([N+](=O)[O-])cc2)[n+]2ccc(CC)cc2)c1 743053245 YBSJWMBPFQOFIC-UHFFFAOYSA-O 450.540 5.167 5 20 JKBD C[C@H](OC(=O)c1cn(Cc2ccccc2)nc1-c1ccccc1)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 746155145 YSJNJLYSSOOJIN-SFHVURJKSA-N 495.495 5.475 5 20 JKBD CC1CCN(c2ccc([N+](=O)[O-])cc2C(=O)N2CCC[C@@H](c3nc(-c4cccc(F)c4)no3)C2)CC1 750658851 LSNGOGBWLOMFAV-LJQANCHMSA-N 493.539 5.040 5 20 JKBD CC(C)c1noc2ncc(C(=O)Nc3cc(Cl)c([N+](=O)[O-])cc3OCc3ccccc3)cc12 822219960 YCFVANKQPHPTGQ-UHFFFAOYSA-N 466.881 5.739 5 20 JKBD CSCC[C@H](NC(=O)c1cccc([N+](=O)[O-])c1)C(=O)O[C@H](C)c1ccc(Cl)c(Cl)c1 917963380 VLLFDPLWIGGCPK-XIKOKIGWSA-N 471.362 5.058 5 20 JKBD CN(C)C(=O)c1cccc(COC(=O)c2ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])cc2)c1 918882198 RFRHBFWMEDYXKZ-UHFFFAOYSA-N 454.866 5.099 5 20 JKBD C[C@H](Nc1ccc(C(=O)Oc2ccccc2C(=O)N2CCCCC2)cc1[N+](=O)[O-])c1ccccn1 920109232 ZCKMTKQLVYPMNS-SFHVURJKSA-N 474.517 5.008 5 20 JKBD O=C(OCC[C@H]1CCCCN1C(=O)c1csc(-c2ccccc2F)n1)c1cccc([N+](=O)[O-])c1 920455395 BNMHKKUWZDMJQB-QGZVFWFLSA-N 483.521 5.099 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)c3cc(F)ccc3C(F)(F)F)CCC2)cc1)c1ccc([N+](=O)[O-])o1 1785752262 CILQPWKHUKGRIB-UHFFFAOYSA-N 491.397 5.407 5 20 JKBD CCC[C@H]1CC[C@H](C(=O)N2CC[C@H](CNC(=O)c3cc(F)cc([N+](=O)[O-])c3)[C@H]2c2cccnc2)CC1 1811306491 DZYXUDPYDBDKGK-JJPBMRITSA-N 496.583 5.055 5 20 JKBD Cc1c(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)c3ccc(F)cc3)[nH]n2)cc(Cl)cc1[N+](=O)[O-] 1821293975 MPVAXBJMHVIUHW-IBGZPJMESA-N 485.903 5.039 5 20 JKBD CC(=O)N(c1cccc(C(F)(F)F)c1)c1nc(COC(=O)c2cccc([N+](=O)[O-])c2)cs1 11025693 GFQQWUQRRQHLBF-UHFFFAOYSA-N 465.409 5.112 5 20 JKBD Cc1ccc(-n2c(SCc3nnc(-c4ccc([N+](=O)[O-])cc4)o3)nc3ccccc3c2=O)cc1C 104564798 OJKPSOSRYBMODY-UHFFFAOYSA-N 485.525 5.253 5 20 JKBD Cc1c(C(C)(C)C)nn(-c2ccccc2)c1NC(=O)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-] 410003366 YMPCYQHCIBSUIG-UHFFFAOYSA-N 476.455 5.580 5 20 JKBD O=C(N[C@@H](c1ccccc1)c1ccc2c(c1)CCCO2)C1CCN(c2ccccc2[N+](=O)[O-])CC1 410049410 OHPHSLNOBRTLKB-MHZLTWQESA-N 471.557 5.042 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)Nc2cc(C(=O)N3C[C@@H](C)C[C@H](C)C3)ccc2C)cc1SC 482785241 YWRIRCVMQQGYHR-GJZGRUSLSA-N 471.579 5.004 5 20 JKBD O=[N+]([O-])c1cc(Cl)ccc1S(=O)(=O)N1CCC(c2nc3cc(Cl)ccc3s2)CC1 490164734 PSZBBQGUKOAREP-UHFFFAOYSA-N 472.375 5.080 5 20 JKBD CCOc1cc(C(=O)Nc2ccc(Oc3ncc(Cl)cc3Cl)cc2)c([N+](=O)[O-])cc1OC 500334889 RDUDTHWSPUJYFT-UHFFFAOYSA-N 478.288 5.749 5 20 JKBD CCOc1cc([N+](=O)[O-])c(C(=O)N(C2CC2)[C@H](C)c2cccc(C(F)(F)F)c2)cc1OC 502878252 UNOSYDQHTNIFHX-CYBMUJFWSA-N 452.429 5.387 5 20 JKBD O=C(Nc1ccc(OC2CCCC2)c(Cl)c1)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-] 508224626 QTAIJCUXTWCFOY-UHFFFAOYSA-N 458.820 5.763 5 20 JKBD CC(=O)Nc1cccc(Nc2nnc(SCc3cc([N+](=O)[O-])ccc3OC(C)C)s2)c1 511048823 ZDZJFTJDMUGQDT-UHFFFAOYSA-N 459.553 5.228 5 20 JKBD COc1ccc(CCCNC(=O)C/C(=C\c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)cc1 511640193 ONCHAZPGQWDANJ-HEHNFIMWSA-N 487.581 5.893 5 20 JKBD O=C(C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)NC[C@@H]1CCN(c2ccccc2)C1 512959085 SYDSRNYCVPRUDD-IFRHDIGASA-N 498.608 5.778 5 20 JKBD O=C(CSc1ccc([N+](=O)[O-])cc1)Nc1ccc(NC(=O)c2ccoc2)cc1C(F)(F)F 514574705 SFCXTAGFYGBMET-UHFFFAOYSA-N 465.409 5.190 5 20 JKBD CCOc1cccc([C@H](C)N[C@@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2ccccc2)c1 520140178 FATDXKJMRDZIOT-QMHKHESXSA-N 453.926 5.678 5 20 JKBD CCOC(=O)c1c(NC(=O)c2ccc(OCC)c([N+](=O)[O-])c2)sc(C(=O)Nc2ccccc2)c1C 603825302 OMNLNAQCZHCLBV-UHFFFAOYSA-N 497.529 5.045 5 20 JKBD Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)Cc1csc(-c2cc(Br)cs2)n1 603949817 FRXGRKNHBFGSHC-UHFFFAOYSA-N 452.355 5.340 5 20 JKBD CCn1c(SCC(=O)Nc2nc(-c3cccc([N+](=O)[O-])c3)c(C)s2)nnc1-c1cccs1 603996834 HMZBFVJHTGDDFM-UHFFFAOYSA-N 486.604 5.097 5 20 JKBD Cc1nc(-c2ccccc2)c(NC(=O)c2ccc(N[C@H](C)c3ccccn3)c([N+](=O)[O-])c2)s1 604538764 ULINYILTTGGWDD-OAHLLOKOSA-N 459.531 5.847 5 20 JKBD O=C(C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)N1CCC[C@@H](c2cc[nH]n2)C1 608813089 AKWFLYXCUNCKJL-GXYBQNOFSA-N 473.558 5.265 5 20 JKBD COc1cc(C(=O)N(C)Cc2nccn2CC(F)(F)F)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 609026658 XLEYFCYDBRZPEH-UHFFFAOYSA-N 498.845 5.080 5 20 JKBD CCOc1ccc(OC)cc1NC(=O)c1ccccc1C(=O)c1ccc(SC)c([N+](=O)[O-])c1 609218611 WZBRBHWQHBANLL-UHFFFAOYSA-N 466.515 5.207 5 20 JKBD Cc1cccc(-c2nnc(S[C@H](C)C(=O)Nc3ccc([N+](=O)[O-])cc3C(F)(F)F)o2)c1 614785604 BNFOBIMRQLMDSJ-LLVKDONJSA-N 452.414 5.091 5 20 JKBD COc1ccc(C)cc1NC(=O)[C@@H](OC(=O)c1cc([N+](=O)[O-])ccc1Br)c1ccccc1 725985544 MHKZALLKWHPNFD-NRFANRHFSA-N 499.317 5.211 5 20 JKBD CCC(CC)c1cc[n+](/C(C(=S)Nc2ccc(OC)c(F)c2)=C(/O)c2cccc([N+](=O)[O-])c2)cc1 726576461 UZFKVTKYQBCYBR-UHFFFAOYSA-O 496.584 6.257 5 20 JKBD CCCOc1cc(NC(=O)c2sc(N3CCCC3)nc2Cl)c([N+](=O)[O-])cc1OCCC 728163525 SOOSLALRQZSHIH-UHFFFAOYSA-N 468.963 5.135 5 20 JKBD O=C(c1c2c(nc3ccccc13)/C(=C/c1ccc([N+](=O)[O-])cc1)CCC2)N1CCC[C@@H](C2OCCO2)C1 729361623 YJQOLIONYMALSF-DHUDHEQZSA-N 499.567 5.245 5 20 JKBD O=C(O[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1)c1sccc1OC(F)F 729775190 QNQBGKZIMSSDMD-MRXNPFEDSA-N 482.848 5.448 5 20 JKBD Cc1oc(-c2ccco2)nc1CC(=O)O[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1 750188952 BDEJMGIZOOLVAK-JOCHJYFZSA-N 495.875 5.270 5 20 JKBD O=C(Nc1cccc(COCCOc2ccccc2)c1)c1cc([N+](=O)[O-])ccc1Br 751093489 AWKUHIBFNOFJFN-UHFFFAOYSA-N 471.307 5.205 5 20 JKBD CC(C)N(Cc1nnc(-c2cccc([N+](=O)[O-])c2)o1)C(=O)CN(Cc1ccccc1)c1ccccc1 769207714 GKTHWVSFKSSSDR-UHFFFAOYSA-N 485.544 5.089 5 20 JKBD C[C@H](OC(=O)c1cc2c(Cl)cccc2s1)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 825217982 FFJJZKSYNMMLSN-VIFPVBQESA-N 472.828 5.666 5 20 JKBD Cc1ccc(C)c(C(=O)c2ccccc2C(=O)O[C@@H](C)C(=O)Nc2cc([N+](=O)[O-])ccc2Cl)c1 844151039 NURUFQKZDDIJAA-INIZCTEOSA-N 480.904 5.280 5 20 JKBD Cc1cccc([N+](=O)[O-])c1NC(=O)COC(=O)c1sc2cc(C(F)(F)F)ccc2c1Cl 914963484 AOVJIGNWWWLMFQ-UHFFFAOYSA-N 472.828 5.586 5 20 JKBD CC(C)c1noc2nc(C3CC3)cc(C(=O)O[C@@H](C)c3nnc(-c4ccc([N+](=O)[O-])cc4)o3)c12 915577715 LIONSTWFCONQDM-LBPRGKRZSA-N 463.450 5.100 5 20 JKBD O=C(Oc1ccc(NC(=O)c2ccccc2Br)cc1)c1cc2cc([N+](=O)[O-])ccc2o1 915810686 IKDKJEGQZMRCMK-UHFFFAOYSA-N 481.258 5.575 5 20 JKBD O=C(NC1(c2ccc(NC(=O)c3nc[nH]c3[N+](=O)[O-])cc2)CCC1)c1ccccc1Oc1ccccc1 1788612406 PINSUIKFOOAMHL-UHFFFAOYSA-N 497.511 5.172 5 20 JKBD Cc1c(C(=O)Nc2ccc(C3(NC(=O)CCN4CCCCC4)CCC3)cc2)cc(Cl)cc1[N+](=O)[O-] 1790773601 CNZKKOJKWJLWCX-UHFFFAOYSA-N 499.011 5.180 5 20 JKBD Cc1cccc(C(=O)NC2(c3ccc(NC(=O)c4cc5cc([N+](=O)[O-])ccc5s4)cc3)CCC2)n1 1791011292 WDINVUAWSYCARA-UHFFFAOYSA-N 486.553 5.574 5 20 JKBD Cc1cc(CCCC(=O)N2CCC3(CCCN(C(=O)CC4CCCC4)C3)CC2)c([N+](=O)[O-])cc1F 1808929972 OVOKVSGAOOFEEV-UHFFFAOYSA-N 487.616 5.177 5 20 JKBD Cc1c(Cl)cccc1C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cccc(F)c2[N+](=O)[O-])[nH]n1 1814599380 HBXAQDVEMCWYDD-LJQANCHMSA-N 485.903 5.039 5 20 JKBD CC[C@H](C)CC(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cc(Cl)cc([N+](=O)[O-])c2C)[nH]n1 1815045522 REZJLFMFCXCMCB-SCLBCKFNSA-N 461.950 5.022 5 20 JKBD O=C(Nc1cc([C@H]2CCCCN2C(=O)/C=C/c2ccc([N+](=O)[O-])o2)[nH]n1)c1cccc2ccccc12 1818450709 KQABMFCHRIOXGH-UFSNDUKISA-N 485.500 5.083 5 20 JKBD Cc1c(C(=O)Nc2ccc(Cl)c(S(=O)(=O)Nc3ccccc3Cl)c2)cccc1[N+](=O)[O-] 15501271 CKFJQGWRYNMKAB-UHFFFAOYSA-N 480.329 5.263 5 20 JKBD COc1cc2c(cc1OC)CN([C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1)CC2 16554165 DRYKEJKIAQWAKG-XMMPIXPASA-N 481.936 5.004 5 20 JKBD CCCCn1c(S[C@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2C(F)(F)F)nc2ccccc2c1=O 21352531 WFCTXFTZRAXMSM-CYBMUJFWSA-N 494.495 5.243 5 20 JKBD CC(=O)N(c1cccc(C(F)(F)F)c1)c1nc(COc2ccc([N+](=O)[O-])cc2Cl)cs1 23943056 WPESPJVREUHBMQ-UHFFFAOYSA-N 471.844 5.987 5 20 JKBD CCOc1cc([N+](=O)[O-])c(C(=O)Nc2nc(-c3cc(Cl)sc3Cl)cs2)cc1OC 28254880 HSXBQKJKQDVUHW-UHFFFAOYSA-N 474.347 5.746 5 20 JKBD O=[N+]([O-])c1ccc(-c2nnc(CSc3nnc(-c4ccccc4)n3-c3ccc(Cl)cc3)o2)cc1 29829406 VRPUNFQBLBMUHO-UHFFFAOYSA-N 490.932 5.838 5 20 JKBD COc1ccc(CN[C@@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2ccccc2)cc1OC(F)F 30495983 HZFVXXJPNVWHOJ-OAQYLSRUSA-N 491.878 5.328 5 20 JKBD Cc1ccc([N+](=O)[O-])cc1NC(=O)CSc1nnc(-c2cccnc2)n1-c1ccccc1C(C)C 39589870 YKUACQOYZNTBPY-UHFFFAOYSA-N 488.573 5.400 5 20 JKBD C[C@@H](Nc1ccc(C(=O)Nc2cc(C(F)(F)F)ccc2N(C)C)cc1[N+](=O)[O-])c1ccccn1 108754798 QNTKKRSRWGBLQA-CQSZACIVSA-N 473.455 5.500 5 20 JKBD CCCN(C(=O)c1ccc(C(C)(C)C)c([N+](=O)[O-])c1)C1CCN(C(=O)c2ccccc2)CC1 303120066 MBZNZMPUFQYADG-UHFFFAOYSA-N 451.567 5.049 5 20 JKBD Cc1ccc(-c2nc(C)c([C@H](C)NC(=O)Cn3c4ccccc4c(=O)c4ccccc43)s2)cc1 303312716 RKQFYEBMEFDKJU-SFHVURJKSA-N 467.594 5.772 5 20 JKBD O=C(Cc1cccs1)Nc1ccccc1NC(=O)Cn1c2ccccc2c(=O)c2ccccc21 409977687 PUELSZKURVNEJA-UHFFFAOYSA-N 467.550 5.036 5 20 JKBD Cc1ccccc1-c1ccc(CN(C(=O)c2cc([N+](=O)[O-])cc(S(C)(=O)=O)c2)C(C)C)s1 498398596 UTXHKQAUCXMCMQ-UHFFFAOYSA-N 472.588 5.086 5 20 JKBD C[C@H](Sc1nc(O)c2c(-c3ccc(F)cc3)csc2n1)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 501670909 IPBRCULRDDHCOH-NSHDSACASA-N 495.517 6.015 5 20 JKBD CSc1ccc(C(=O)c2ccccc2C(=O)Nc2ccc(OC[C@@H]3CCCO3)cc2)cc1[N+](=O)[O-] 502079951 PSYAAPAWUKIWIA-FQEVSTJZSA-N 492.553 5.358 5 20 JKBD Cc1ccc([N+](=O)[O-])cc1NC(=O)c1cnn(-c2ncc(C(F)(F)F)cc2Cl)c1C(F)(F)F 503146555 ZBQSRWDBRRWRNG-UHFFFAOYSA-N 493.751 5.427 5 20 JKBD C[C@@H](Nc1ccc(C(=O)N[C@H](c2ccc(Cl)cc2)c2nccn2C)cc1[N+](=O)[O-])c1ccccn1 506084501 ANEOINISEMKLPH-WAIKUNEKSA-N 490.951 5.069 5 20 JKBD CCCN(C(=O)CCCn1c(=O)oc2cc([N+](=O)[O-])ccc21)[C@H](C)c1cc2ccccc2o1 507488357 AREMPZKOSLKXGR-MRXNPFEDSA-N 451.479 5.029 5 20 JKBD O=C1CCc2cc(-c3csc(NC(=O)c4cc5ccccc5c5cccnc45)n3)ccc2N1 507740115 IEXRJTSDDCVFTH-UHFFFAOYSA-N 450.523 5.649 5 20 JKBD Cc1ccc(C(C)C)c(Oc2ccc(CNC3CCN(Cc4ccncc4)CC3)cc2[N+](=O)[O-])c1 513092225 JZCGHPWDZSIPJG-UHFFFAOYSA-N 474.605 5.968 5 20 JKBD COc1cc(C(=O)Nc2ccccc2Oc2ncc(Cl)cc2Cl)c([N+](=O)[O-])cc1OC 514442567 AGHDRXXSNHRLCO-UHFFFAOYSA-N 464.261 5.358 5 20 JKBD C[C@@H](NC(=O)CCCn1c(=O)oc2cc([N+](=O)[O-])ccc21)c1ccc(Oc2ccccc2)c(F)c1 515626154 QBSJWTPVWKONNU-MRXNPFEDSA-N 479.464 5.092 5 20 JKBD Cn1cc(/C=C(\CC(=O)O)c2nc3cc(C(F)(F)F)ccc3s2)c(-c2ccc([N+](=O)[O-])cc2)n1 518602727 JGSPKGQJHKBHNP-MDWZMJQESA-N 488.447 5.639 5 20 JKBD CCCN1CCC(N(C)C(=O)C/C(=C/c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)CC1 518807403 NCCKRXLREKALGQ-JZJYNLBNSA-N 478.618 5.468 5 20 JKBD COc1ccc([C@H](NC(=O)[C@@H](C)Oc2ccc(Cl)cc2[N+](=O)[O-])c2ccc(F)cc2)cc1 520408819 SIBROFCVQVTGRU-JLCFBVMHSA-N 458.873 5.069 5 20 JKBD O=C(Cc1ccccc1[N+](=O)[O-])Nc1nc(-c2ccc(OC(F)F)cc2OC(F)F)cs1 604511022 PDHSEIVQLZKUKR-UHFFFAOYSA-N 471.388 5.102 5 20 JKBD C[C@H](Nc1ccc(C(=O)Nc2cccc(-c3n[nH]c(C4CC4)n3)c2)cc1[N+](=O)[O-])c1ccccn1 608851224 VUCSFWILXUONPP-HNNXBMFYSA-N 469.505 5.078 5 20 JKBD COc1cccc(C2(CN[C@@H](C)C(=O)Nc3ccc([N+](=O)[O-])cc3C(F)(F)F)CCCC2)c1 609387706 HZAQCKNNOKHUFF-HNNXBMFYSA-N 465.472 5.051 5 20 JKBD COCCOc1cc([N+](=O)[O-])c(C(=O)Nc2ccc(-c3nc4ccccc4s3)cc2)cc1OC 619564644 DXBSDUMIFHQZCA-UHFFFAOYSA-N 479.514 5.158 5 20 JKBD CC(C)N(Cc1nnc(-c2cccc([N+](=O)[O-])c2)o1)C(=O)[C@@H](C)Oc1cc(Cl)cc(Cl)c1 727064288 TUZWKHMZCLMAIF-CYBMUJFWSA-N 479.320 5.156 5 20 JKBD C[C@@H](OC(=O)c1csc(-c2cccc([N+](=O)[O-])c2)n1)c1ccccc1NC(=O)c1ccccc1 748021013 IUXPTTLQUUPDHG-MRXNPFEDSA-N 473.510 5.889 5 20 JKBD C[C@H](OC(=O)c1cc(-c2ccco2)nn1-c1ccccc1)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 811762021 MMGXFNZIXFMAFZ-HNNXBMFYSA-N 471.429 5.009 5 20 JKBD O=C(Nc1ccc(NCc2c(Br)cccc2[N+](=O)[O-])c(C(F)(F)F)c1)c1ccoc1 863996738 AAILGVGULGLHKH-UHFFFAOYSA-N 484.228 5.834 5 20 JKBD COc1ccc(Cc2noc(Cc3cn(-c4ccccc4)nc3-c3ccc([N+](=O)[O-])cc3)n2)cc1 904392352 XGZJPNCOCHBQHN-UHFFFAOYSA-N 467.485 5.021 5 20 JKBD COc1ccccc1Nc1nn(CN(Cc2ccccc2[N+](=O)[O-])CC(F)(F)F)c(=S)s1 917450905 PAKKXODVTOQAOJ-UHFFFAOYSA-N 485.513 5.356 5 20 JKBD Cc1sc(NC(=O)COc2ccc(C3SCCCS3)cc2)nc1-c1cccc([N+](=O)[O-])c1 917792290 ZLVXTRWSBYKQRP-UHFFFAOYSA-N 487.628 5.913 5 20 JKBD O=C(Nc1cc([N+](=O)[O-])ccc1Nc1cccc(C(F)(F)F)c1)c1cccc(N2CCOC2=O)c1 918553377 AAYFHVWRGWMFAT-UHFFFAOYSA-N 486.406 5.566 5 20 JKBD C[C@H](Nc1ccc(C(=O)OCc2coc(-c3ccc(F)cc3)n2)cc1[N+](=O)[O-])c1ccccn1 920547405 NZLANYPRMRZEHR-HNNXBMFYSA-N 462.437 5.314 5 20 JKBD Cc1ccc(NC(=O)[C@@H](C)OC(=O)c2ccc(N[C@@H](C)c3ccccn3)c([N+](=O)[O-])c2)c(Cl)c1 920548116 PTVXOKAGRDEDTN-JKSUJKDBSA-N 482.924 5.309 5 20 JKBD O=C(C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)NCc1ccc(-n2ccnc2)cc1 921148357 FVOBAVHBYXFAND-QNGOZBTKSA-N 495.564 5.637 5 20 JKBD CC(F)(F)C(C)(C)C(=O)Nc1ccc(C2(NC(=O)c3cccc(F)c3[N+](=O)[O-])CCC2)cc1 1786454943 OGSJPUUBIYXZNH-UHFFFAOYSA-N 463.456 5.163 5 20 JKBD C/C(=C\c1cccnc1)C(=O)NC1(c2ccc(NC(=O)CCc3cccc([N+](=O)[O-])c3)cc2)CCC1 1786601431 NQMUSTKFJDZPNT-LVZFUZTISA-N 484.556 5.160 5 20 JKBD O=C(Cc1cc([N+](=O)[O-])ccc1F)Nc1ccc(C2(NC(=O)c3cccc4cc[nH]c34)CCC2)cc1 1786671076 DOFPSIFAXKORFF-UHFFFAOYSA-N 486.503 5.206 5 20 JKBD O=C(Cc1cccc([N+](=O)[O-])c1)NC1(c2ccc(NC(=O)c3ccnc4ccccc34)cc2)CCC1 1788888497 SVKMZJFNKIGMGI-UHFFFAOYSA-N 480.524 5.133 5 20 JKBD O=C(/C=C/c1ccc([N+](=O)[O-])o1)NC1(c2ccc(NC(=O)c3ccccc3Cl)cc2)CCC1 1790223105 ZOXIYUXAPOZEFQ-ZRDIBKRKSA-N 465.893 5.302 5 20 JKBD O=C(NC1(c2ccc(NC(=O)c3cc4cc([N+](=O)[O-])ccc4s3)cc2)CCC1)c1ccns1 1791010831 GGZMJLLZKCNPMY-UHFFFAOYSA-N 478.555 5.328 5 20 JKBD O=C(CSc1ccccc1[N+](=O)[O-])NC1(c2ccc(NC(=O)C3CC4(CCC4)C3)cc2)CCC1 1792040142 ZSIBXLYTSWTJJJ-UHFFFAOYSA-N 479.602 5.401 5 20 JKBD COc1ccc(CC(=O)NC2(c3ccc(NC(=O)[C@]4(F)CCCC=C4F)cc3)CCC2)c([N+](=O)[O-])c1 1792379617 LPJLFXNSJVLUQU-SANMLTNESA-N 499.514 5.026 5 20 JKBD Cc1c(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2ccc3sccc3c2O)cc(Cl)cc1[N+](=O)[O-] 1801054890 JNLHSPXJCXBWPO-MUJYYYPQSA-N 499.976 5.043 5 20 JKBD Cc1cc(Cl)ccc1C(=O)N1CCCC2(CCN(C(=O)CCc3cccc([N+](=O)[O-])c3)CC2)C1 1805082319 GIFBXTHTMAXAJI-UHFFFAOYSA-N 483.996 5.034 5 20 JKBD O=C(CCc1cccc([N+](=O)[O-])c1)Nc1cc([C@@H]2CCCCN2C(=O)c2ccc(C3CC3)cc2)[nH]n1 1815538821 YRHHJRXMGMHENQ-DEOSSOPVSA-N 487.560 5.134 5 20 JKBD O=C(Nc1cc([C@H]2CCCCN2C(=O)/C=C/c2ccc([N+](=O)[O-])o2)[nH]n1)c1cc2sccc2s1 1819026634 MOAVTMZLVKUMRF-CSPWOOARSA-N 497.558 5.206 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2ccc3ccoc3c2)[nH]n1 1821285435 DQEASPVLFLEXSY-FQEVSTJZSA-N 491.479 5.131 5 20 JKBD O=C(c1cc2cc([N+](=O)[O-])ccc2s1)N1CCC([C@@H]2CCCCN2C(=O)[C@H]2C[C@H]2C2CC2)CC1 1824073349 GKTIQHNINOMBNC-FKBYEOEOSA-N 481.618 5.089 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cccc3cc[nH]c23)CC1 1830733933 SAQJEUBPTCQSGF-QHCPKHFHSA-N 492.551 5.071 5 20 JKBD O=C(CSc1nnc(Nc2ccc(SC(F)F)cc2)s1)Nc1cc([N+](=O)[O-])ccc1F 2659077 QIGFKWSPHOPDMG-UHFFFAOYSA-N 487.510 5.375 5 20 JKBD Cc1nc(S[C@@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2C(F)(F)F)c2c(C)c(C)sc2n1 9788730 JUIWEIBQZGMRJX-JTQLQIEISA-N 470.498 5.663 5 20 JKBD Cc1c(Cl)cccc1-n1c(S[C@@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2)nnc1-c1ccncc1 10318044 PWPGBVVHKZSTTD-HNNXBMFYSA-N 494.964 5.319 5 20 JKBD O=C(CCC(=O)c1cccs1)O[C@H](C(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1)c1ccccc1 10531346 GGCPPXCVUGWXHK-NRFANRHFSA-N 472.906 5.196 5 20 JKBD C[C@H](Sc1nnc(-c2ccc(F)cc2)o1)C(=O)Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1 12678011 WOAQRSNQFAUBHD-NSHDSACASA-N 471.495 5.027 5 20 JKBD O=C(CSc1nc2ccc([N+](=O)[O-])cc2s1)N[C@@H](c1ccc(F)cc1)c1cccs1 18275320 WWJGZROSMCANNC-IBGZPJMESA-N 459.549 5.403 5 20 JKBD c1csc(-c2nnc(SCc3nc4ccccc4c4ccccc34)n2C[C@@H]2CCCO2)c1 20052986 FUYSLEYBYYOXCF-KRWDZBQOSA-N 458.612 6.179 5 20 JKBD COc1ccc(OCc2csc(N(C(C)=O)c3cccc(C(F)(F)F)c3)n2)c([N+](=O)[O-])c1 22044362 YFJNZHGGGQKTPE-UHFFFAOYSA-N 467.425 5.342 5 20 JKBD CSc1ccccc1NC(=O)[C@H](C)OC(=O)c1ccc(Sc2nc(C)cs2)c([N+](=O)[O-])c1 22089226 YKUMUGCZUSBFCV-ZDUSSCGKSA-N 489.600 5.417 5 20 JKBD CC(C)=CC(=O)Nc1scc(-c2ccccc2)c1C(=O)OCC(=O)Nc1ccccc1[N+](=O)[O-] 22721094 AQCBNXRXWNVILT-UHFFFAOYSA-N 479.514 5.024 5 20 JKBD O=C(/C=C/c1cnc2ccccc2n1)O[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1 23647907 DGAIXJKQJUIYKU-MURVUTHMSA-N 488.887 5.128 5 20 JKBD Cn1c(SCC(=O)Nc2ccc(Cl)cc2[N+](=O)[O-])nc2scc(-c3cccs3)c2c1=O 28607648 MCFHYCNKUQBLMN-UHFFFAOYSA-N 492.991 5.016 5 20 JKBD C[C@H](OC(=O)c1ccc(Cl)cc1[N+](=O)[O-])C(=O)Nc1c(Cl)cc(Cl)cc1Cl 28631686 SDHCLPBSRWBDRT-ZETCQYMHSA-N 452.077 5.392 5 20 JKBD C[C@@H]1CCCN(c2ccc(C(=O)Nc3ccc(N(C)C)cc3C(F)(F)F)cc2[N+](=O)[O-])C1 116996424 XVUHKBCQCQOROZ-CQSZACIVSA-N 450.461 5.168 5 20 JKBD C[C@H]1[C@H](C)CCC[C@H]1n1c(SCc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)nc2ccccc2c1=O 248148060 IKBVEMRYEKQUAO-VWKPWSFCSA-N 491.573 5.644 5 20 JKBD CN(Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1)Cc1cn(-c2ccccc2)nc1-c1ccccc1 485313730 KPGXJKHOXQWGFN-UHFFFAOYSA-N 466.501 5.130 5 20 JKBD CC(C)(CNC(=O)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1)c1ccc(F)cc1 485816375 JQGRUNJEFPAHFI-UHFFFAOYSA-N 467.463 5.063 5 20 JKBD CCN(C(=O)c1ccc(NS(=O)(=O)c2ccc(C)c([N+](=O)[O-])c2)cc1)c1cccc(Cl)c1 505529509 ZIEPKVCUJPVQON-UHFFFAOYSA-N 473.938 5.024 5 20 JKBD Cc1nnc(Sc2ccc(NC(=O)c3ccc(N4CCC(C)CC4)c([N+](=O)[O-])c3)c(C)c2)s1 505871026 GJIDUWSXDPPBDD-UHFFFAOYSA-N 483.619 5.703 5 20 JKBD Cc1csc(Sc2ccc(C(=O)Nc3ccccc3OC[C@@H]3CCCCO3)cc2[N+](=O)[O-])n1 510028573 JJHPNIOVDTYHQX-KRWDZBQOSA-N 485.587 5.711 5 20 JKBD COc1ccccc1Oc1ccc(NC(=O)C2CCN(c3ccccc3[N+](=O)[O-])CC2)cc1F 510250438 DXFVHXCKFUZAQR-UHFFFAOYSA-N 465.481 5.390 5 20 JKBD CC[C@@H](C)c1ccc([C@H](NC(=O)C(=O)Nc2cc([N+](=O)[O-])ccc2OC)c2cccs2)cc1 515140877 APCUQJMFWFLENO-QRQCRPRQSA-N 467.547 5.023 5 20 JKBD Cc1csc(Sc2ccc(NC(=O)N3CCN(c4cccc([N+](=O)[O-])c4)CC3)c(C)c2)n1 518722004 DKBZDNOJPOGGQX-UHFFFAOYSA-N 469.592 5.173 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Cl)[C@H](NCc1ccccc1C(F)(F)F)c1ccccc1 521768612 TXTKFPYNCHQJFL-HXUWFJFHSA-N 463.843 5.737 5 20 JKBD CC(C)[C@H](NC(=O)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1)c1nnc2ccccn12 523557371 LMSWHVIBXWHETM-NRFANRHFSA-N 465.897 5.210 5 20 JKBD O=C(C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)NCc1cc(-c2ccccc2)on1 555296785 UPAAOJVQCXEBDY-XSFVSMFZSA-N 496.548 6.107 5 20 JKBD C[C@H](Nc1cccc(CO[C@H]2CCC[C@@H](C)C2)c1)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 582351542 BMRBJOQYDXFOIK-GUXCAODWSA-N 479.499 6.148 5 20 JKBD COc1cc(OC)c(C2CCN(C(=O)c3ccc(Nc4ccccc4)c([N+](=O)[O-])c3)CC2)c(OC)c1 591564802 CHLNJDJAXJGEFN-UHFFFAOYSA-N 491.544 5.384 5 20 JKBD O=C(Nc1nc(-c2ccncc2)cs1)c1cc([N+](=O)[O-])ccc1Sc1ccc(Cl)cc1 603454818 RJALZQHFXINIRN-UHFFFAOYSA-N 468.947 6.170 5 20 JKBD CN(C(=O)c1ccc(NC(=O)CSc2ccc(C(F)(F)F)cc2[N+](=O)[O-])cc1)C1CCCCC1 604118625 ROUHSXRKNSCGKB-UHFFFAOYSA-N 495.523 5.749 5 20 JKBD Cc1ccc(NC(=O)c2cccc(C(F)(F)F)c2)cc1NC(=O)c1cc([N+](=O)[O-])c(C)s1 604449422 ZNGZBVIDGXZIPV-UHFFFAOYSA-N 463.437 5.797 5 20 JKBD O=C(Nc1nc(-c2ccc(OC(F)F)cc2OC(F)F)cs1)c1ccc([N+](=O)[O-])s1 604510998 BPIXQTGEHRBYEC-UHFFFAOYSA-N 463.390 5.235 5 20 JKBD COc1ccc(CC(=O)N(c2nc3ccccc3s2)c2ccccc2C(C)C)cc1[N+](=O)[O-] 609009490 WBMHJOHPLCLDLT-UHFFFAOYSA-N 461.543 6.244 5 20 JKBD O=C(Nc1ccc(OCc2cccc(C(F)(F)F)c2)cc1)c1ccc(-n2cncn2)c([N+](=O)[O-])c1 609066159 KOUNAXGQVZEBSG-UHFFFAOYSA-N 483.406 5.026 5 20 JKBD C[C@@H](Nc1ccc(OCc2cccnc2)cc1)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 728592269 BEBAVHSTBYHDRU-CQSZACIVSA-N 460.412 5.027 5 20 JKBD CC(=O)N(c1ccc(C)cc1)c1nc(COC(=O)c2csc(-c3ccc([N+](=O)[O-])cc3)n2)cs1 747955789 XVYAOWNLVLCKEF-UHFFFAOYSA-N 494.554 5.525 5 20 JKBD C[C@H](OC(=O)c1csc(-c2ccc([N+](=O)[O-])cc2)n1)C(=O)N[C@@H](C)c1ccc2ccccc2c1 747956541 HJBDMCGGVOUTKW-HOTGVXAUSA-N 475.526 5.294 5 20 JKBD CCOc1ccc(-c2nc(COC(=O)c3cc([N+](=O)[O-])c(C)c([N+](=O)[O-])c3C)cs2)cc1OC 748947498 MCHNZNOOCBYTKG-UHFFFAOYSA-N 487.490 5.008 5 20 JKBD CC[C@H](C(=O)Oc1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2Cl)cc1)c1c(C)noc1C 751305953 MSOXOIDBFOEPFF-KRWDZBQOSA-N 457.870 5.205 5 20 JKBD COCc1nc(OC)c2c(C)c(C(=O)OCc3nc4ccccc4c4ccccc34)sc2n1 761174494 MBTHKKACGVLYDL-UHFFFAOYSA-N 459.527 5.213 5 20 JKBD COc1ccccc1[C@@H](C)NC(=O)[C@@H](C)Oc1ccc2c(-c3ccc([N+](=O)[O-])cc3)cc(=O)oc2c1 851960070 YUDBXCVJKNDSPI-IAGOWNOFSA-N 488.496 5.022 5 20 JKBD O=C(c1cccc(NCc2ccc(Oc3ccccc3Cl)c([N+](=O)[O-])c2)c1)N1CCC(CO)CC1 864027022 BXMYNIBRCBNRNE-UHFFFAOYSA-N 495.963 5.497 5 20 JKBD CC1=C(C(=O)Nc2ccc(F)cc2)[C@@H](c2ccc([N+](=O)[O-])o2)NC(=S)N1c1cccc(Cl)c1 901385439 XOBUVSFCWWEUDP-HXUWFJFHSA-N 486.912 5.329 5 20 JKBD O=C(Nc1ccc(NC(=O)c2cc(Cl)ccc2[N+](=O)[O-])c(C(F)(F)F)c1)c1ccc(F)cc1 915355840 DDXCUPGIDNAQGB-UHFFFAOYSA-N 481.789 5.911 5 20 JKBD Cc1nc(-c2cccc(NC(=O)c3ccccc3NC(=O)c3ccc([N+](=O)[O-])cc3Cl)c2)oc1C 917407989 IVALJHSLVYYSFG-UHFFFAOYSA-N 490.903 6.025 5 20 JKBD C[C@H](NC(=S)/C(=C(/O)c1cccc([N+](=O)[O-])c1)[n+]1ccc2c(c1)CCCC2)c1ccccc1 917611403 CKZCHOMZNGRBHU-SFHVURJKSA-O 460.579 5.323 5 20 JKBD COC(=O)Nc1cccc(N[C@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2ccccc2)c1 917938077 DJZMKROIQGTSJD-FQEVSTJZSA-N 454.870 5.218 5 20 JKBD CC1=C(C(=O)Nc2ccccc2C)[C@@H](c2ccc(Br)c([N+](=O)[O-])c2)NC(=O)N1CC1CC1 918075208 GBULPBPXZSDWRN-OAQYLSRUSA-N 499.365 5.055 5 20 JKBD C[C@H](Nc1ccc(C(=O)Nc2nc(COc3ccccc3)cs2)cc1[N+](=O)[O-])c1ccccn1 919680661 DWKJHOAISHQZBV-INIZCTEOSA-N 475.530 5.451 5 20 JKBD O=C(Oc1ccc(-c2ccccc2)cc1[N+](=O)[O-])[C@H]1CCCN(C(=O)Nc2ccccc2F)C1 920329190 APKWILZZYZHGFJ-IBGZPJMESA-N 463.465 5.250 5 20 JKBD O=C(Cc1ccc(Cl)cc1[N+](=O)[O-])Nc1ccc(C2(NC(=O)c3ccncc3Cl)CCC2)cc1 1786116076 SNMFKOBQXWIFME-UHFFFAOYSA-N 499.354 5.287 5 20 JKBD O=C(/C=C/c1ccc([N+](=O)[O-])o1)Nc1ccc(C2(NC(=O)c3cc4sccc4[nH]3)CCC2)cc1 1786207475 QHXZRUOOYKMXNU-SOFGYWHQSA-N 476.514 5.192 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)c3ccc([N+](=O)[O-])cc3F)CCC2)cc1)c1cc2ccccc2o1 1789004691 QRFXVMGTMCOVQN-UHFFFAOYSA-N 473.460 5.542 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)c3ccc([N+](=O)[O-])cc3F)CCC2)cc1)c1ccc2ccoc2c1 1790892767 SDHORXJOUHNRDE-UHFFFAOYSA-N 473.460 5.542 5 20 JKBD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc2cc([N+](=O)[O-])ccc2s1)[C@@H]1CCC[C@@H]2CCCC[C@@H]21 1801207370 MECSINWLJLZJTL-CZVSCRFZSA-N 495.645 5.668 5 20 JKBD Cc1ccc(F)cc1C(=O)N1CCCC2(CCN(C(=O)c3cc4cc([N+](=O)[O-])ccc4s3)CC2)C1 1805064489 MEQBYGJBBIIMRY-UHFFFAOYSA-N 495.576 5.416 5 20 JKBD COc1cc(C(=O)N2CCC([C@@H]3CCCCN3C(=O)CC3CCC(C)(C)CC3)CC2)ccc1[N+](=O)[O-] 1830426424 NPDSNYDHPGYAGU-QHCPKHFHSA-N 499.652 5.443 5 20 JKBD Cc1cc(Cl)c(Cl)cc1C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2ccc([N+](=O)[O-])[nH]2)CC1 1830784768 UTUFHIRIBNWYTF-HXUWFJFHSA-N 493.391 5.085 5 20 JKBD O=C(/C=C/c1ccccc1)N1CCC([C@@H]2CCCCN2C(=O)CSc2ccccc2[N+](=O)[O-])CC1 1831776059 ILBPCODMYKKPRN-ZVQQDINOSA-N 493.629 5.020 5 20 JKBD C[C@H](Sc1nnc(-c2ccccc2F)n1C1CC1)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl 9637459 RLXWCOFWFNBGLS-NSHDSACASA-N 461.906 5.100 5 20 JKBD C[C@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)N1CCC(c2nc3cc(Cl)ccc3s2)CC1 10235750 DVRAJDMAKWJVRN-ZDUSSCGKSA-N 461.996 5.745 5 20 JKBD CCc1ccc(-c2nc(COC(=O)Cn3c4ccccc4c(=O)c4ccccc43)cs2)cc1 10723058 JFUSTXTUVPLYED-UHFFFAOYSA-N 454.551 5.584 5 20 JKBD CC(=O)N(c1nc(COC(=O)/C=C/c2ccc([N+](=O)[O-])cc2)cs1)c1cccc(C)c1C 10757852 DFUAUVFXNFPZJC-FMIVXFBMSA-N 451.504 5.109 5 20 JKBD CCn1c(SCc2cc(OC)c(OC(F)F)cc2[N+](=O)[O-])nnc1-c1ccc(Cl)cc1 11322365 NJEMTDIFXKSEQX-UHFFFAOYSA-N 470.885 5.429 5 20 JKBD CCCCn1c(S[C@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)nc2ccccc2c1=O 17536606 ODEFCVITAHYBTB-CQSZACIVSA-N 451.508 5.008 5 20 JKBD COc1cccc(N[C@@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Br)c2ccccc2)c1 21818479 KCQNGZMLOGJNOV-HXUWFJFHSA-N 456.296 5.158 5 20 JKBD CCn1c(SCC(=O)N[C@@H](C)c2ccccc2Cl)nc2cc3ccccc3cc2c1=O 22178693 ZSBPAKJTGRBJCC-HNNXBMFYSA-N 451.979 5.193 5 20 JKBD Cc1cccc([N+](=O)[O-])c1NC(=O)CSc1nnc(-c2ccc(F)cc2)n1-c1ccccc1 28797757 RNVUEGJCGRPSJR-UHFFFAOYSA-N 463.494 5.021 5 20 JKBD Cc1c(NC(=O)[C@@H](C)OC(=O)Cc2csc(-c3ccc(C(F)(F)F)cc3)n2)cccc1[N+](=O)[O-] 28961496 ZEKROFMQZLFVFH-CYBMUJFWSA-N 493.463 5.158 5 20 JKBD COc1ccccc1-c1nn(-c2ccccc2)cc1C(=O)Nc1cc(-c2cccc([N+](=O)[O-])c2)n[nH]1 248249768 OLSUVUFOQGCQDF-UHFFFAOYSA-N 480.484 5.099 5 20 JKBD CCN(C(=O)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1)[C@H](C)Cc1ccc(OC)cc1 303294567 BRXAKALDVNURRT-QGZVFWFLSA-N 493.526 5.318 5 20 JKBD Cc1ccc(Sc2ccc(C(=O)N3CC=C(c4c[nH]c5ncccc45)CC3)cc2[N+](=O)[O-])cc1 485329373 FNLJCZWCGUSSPO-UHFFFAOYSA-N 470.554 5.860 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)N2CCC[C@@H](c3nc(-c4ccc(Cl)cc4)no3)C2)cc1SC 486655503 UKXZEWHRMCRQQX-CQSZACIVSA-N 488.953 5.049 5 20 JKBD CC[C@@H](C)NC(=O)c1cccc(CNC(=O)c2cc([N+](=O)[O-])ccc2Sc2ccccc2)c1 500031607 WGSQBAITFRRNBW-QGZVFWFLSA-N 463.559 5.204 5 20 JKBD CCc1oc2ccccc2c1CN(C)C(=O)c1ccc(N[C@H](C)c2ccccn2)c([N+](=O)[O-])c1 506071089 OPEPNHNKIWYRAX-QGZVFWFLSA-N 458.518 5.744 5 20 JKBD O=C(Nc1ccc(-n2cncn2)c(F)c1)c1ccc(Sc2nc3ccccc3s2)c([N+](=O)[O-])c1 509466409 AZHILPLOFZUZRI-UHFFFAOYSA-N 492.517 5.328 5 20 JKBD C[C@H](SCc1ncc(-c2ccc(Cl)cc2)o1)C(=O)Nc1cc([N+](=O)[O-])ccc1OC(F)F 512983535 SSBIIBQHZWSUAL-NSHDSACASA-N 483.880 5.765 5 20 JKBD Cc1nnc(-c2ccccc2NC(=O)c2ccc(Sc3nc4ccccc4s3)c([N+](=O)[O-])c2)o1 514448738 QOTNUOWYNGHBPF-UHFFFAOYSA-N 489.538 5.966 5 20 JKBD CN(Cc1ccccc1[N+](=O)[O-])C(=O)Nc1ccc(NC(=O)c2ccco2)cc1C(F)(F)F 515170674 RBBGPRKEAFBEGA-UHFFFAOYSA-N 462.384 5.123 5 20 JKBD CCN(C(=O)Cc1ccc(NC(=O)c2cc(OC)c(OC(F)F)cc2[N+](=O)[O-])cc1)c1ccccc1 515683824 OBSQPLQRUGJTTB-UHFFFAOYSA-N 499.470 5.053 5 20 JKBD CCN(CC)CC1CCN(C(=O)C/C(=C\c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)CC1 521184852 XXSOFIPTERNYNE-OQKWZONESA-N 492.645 5.716 5 20 JKBD O=C(Cn1c2ccccc2c(=O)c2ccccc21)N1CCCC[C@@H]1c1ccccc1C(F)(F)F 589369604 GSSBBOMXHMHSEJ-JOCHJYFZSA-N 464.487 5.927 5 20 JKBD CN(C[C@H]1CCCO[C@H]1c1ccccc1)C(=O)CCNc1ccc(C(F)(F)F)cc1[N+](=O)[O-] 604519047 GHVBAXRETVGENR-VGSWGCGISA-N 465.472 5.042 5 20 JKBD C[C@@H]1CCCN(c2ccc(C(=O)N(C)CCCc3cc(-c4ccc(F)cc4)no3)cc2[N+](=O)[O-])C1 604570281 NMGAYVXKLXUDPX-GOSISDBHSA-N 480.540 5.330 5 20 JKBD Cn1cc(C(=O)Nc2ccc(Sc3nc4ccccc4[nH]3)cc2)c(-c2ccc([N+](=O)[O-])cc2)n1 609094844 ZYRPIGZSJRZJJR-UHFFFAOYSA-N 470.514 5.275 5 20 JKBD O=C(c1ccc(NCc2ccccc2Cl)c([N+](=O)[O-])c1)N1CC[C@H](Nc2ccccc2)C1 609113750 XZCQBLDHHPYNGX-FQEVSTJZSA-N 450.926 5.187 5 20 JKBD COc1ccc(-c2nnc(Sc3ccc([N+](=O)[O-])c4cnccc34)n2Cc2ccco2)cc1 619683812 LQSATAQMEDNMJE-UHFFFAOYSA-N 459.487 5.203 5 20 JKBD O=[N+]([O-])c1cc(F)ccc1Sc1nnc(CN2CCCCC2)n1-c1ccc(OC(F)F)cc1 619714992 VUUGXDQYEVXCAI-UHFFFAOYSA-N 479.484 5.053 5 20 JKBD COc1ccc(Oc2ccc([N+](=O)[O-])cc2C(=O)OC[C@H]2CCCN(C(=O)c3ccc(C)o3)C2)cc1 726359333 VLXNUAWNSGIMFB-SFHVURJKSA-N 494.500 5.006 5 20 JKBD C[C@@H](OC(=O)c1ccccc1NCc1ccccc1)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 726830982 MTJTXMVGQAXYQM-OAHLLOKOSA-N 487.434 5.410 5 20 JKBD CC(C)c1nnc(COC(=O)c2ccc(Sc3nc4ccccc4s3)c([N+](=O)[O-])c2)o1 726989472 CGYZBEXQOSYPSJ-UHFFFAOYSA-N 456.505 5.219 5 20 JKBD CN(CCNC(=O)C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)C(=O)OC(C)(C)C 728865792 DGIVMJWRSIUUEE-OBGWFSINSA-N 496.589 5.118 5 20 JKBD CS(=O)(=O)c1ccc(OCCCCC(=O)OCc2nc3ccccc3c3ccccc23)cc1 742979799 DDDGZRCCPZHCOR-UHFFFAOYSA-N 463.555 5.084 5 20 JKBD C[C@H](OC(=O)c1csc(-c2ccc([N+](=O)[O-])cc2)n1)C(=O)N[C@H](C)c1ccc2c(c1)CCCC2 747958175 UUJWXSBHKVGBRC-CVEARBPZSA-N 479.558 5.020 5 20 JKBD CN(C(=O)c1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2Br)cc1)C1CCCCC1 751097366 XDWRBSJACMEROA-UHFFFAOYSA-N 460.328 5.014 5 20 JKBD CCOC(=O)Nc1ccc(Br)cc1NCc1c(Br)cccc1[N+](=O)[O-] 864010052 IVQKXQIGNPWGHJ-UHFFFAOYSA-N 473.121 5.300 5 20 JKBD O=C(Nc1ccc(NC(=O)c2ccccc2F)cc1C(F)(F)F)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1 915869475 FWBAEESIGGWZFK-UHFFFAOYSA-N 492.341 5.166 5 20 JKBD O=C(Nc1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2Cl)c(C(F)(F)F)c1)c1ccccc1 915870760 PWCSLUKXBKVFLA-UHFFFAOYSA-N 463.799 5.772 5 20 JKBD CC(C)c1cc(C(=O)Nc2ccc(C3(NC(=O)/C=C/c4ccccc4[N+](=O)[O-])CCC3)cc2)on1 1790165355 RKDPIGIAXQIQDS-MDWZMJQESA-N 474.517 5.167 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)c3cccc4cccnc34)CCC2)cc1)c1ccc([N+](=O)[O-])cc1F 1790622250 OPIYZMGMEHXCBV-UHFFFAOYSA-N 484.487 5.344 5 20 JKBD CC(C)CC(=O)NC1(c2ccc(NC(=O)c3ccc(Br)c([N+](=O)[O-])c3)cc2)CCC1 1790641725 GHSAYGGREFVNCM-UHFFFAOYSA-N 474.355 5.151 5 20 JKBD COc1ccc(CC(=O)NC2(c3ccc(NC(=O)c4cccc5ccoc45)cc3)CCC2)c([N+](=O)[O-])c1 1790956871 MYTXCJFNMIZSKP-UHFFFAOYSA-N 499.523 5.340 5 20 JKBD COc1cc(C(=O)Nc2ccc(C3(NC(=O)c4cc(F)cc(F)c4F)CCC3)cc2)ccc1[N+](=O)[O-] 1792165179 ABSZXMRYMXIHBR-UHFFFAOYSA-N 499.445 5.082 5 20 JKBD CC1=CC[C@H](C(=O)NC2(c3ccc(NC(=O)Cc4cc(F)ccc4[N+](=O)[O-])cc3)CCC2)CC1 1792308751 IGHCTHOFWYQCMQ-SFHVURJKSA-N 465.525 5.157 5 20 JKBD O=C(Nc1cc([C@H]2CCCCN2C(=O)CCc2cccc([N+](=O)[O-])c2)[nH]n1)c1cc2ccoc2s1 1817822563 ADGUENIRZRQUMS-LJQANCHMSA-N 493.545 5.064 5 20 JKBD CC1(C)CCC(CC(=O)N2CCC([C@H]3CCCCN3C(=O)c3ccc([N+](=O)[O-])cc3F)CC2)CC1 1830499144 PMJNJWSWVJUPHP-XMMPIXPASA-N 487.616 5.574 5 20 JKBD O=C(c1ccc([N+](=O)[O-])cc1F)N1CCC([C@@H]2CCCCN2C(=O)c2cccc(F)c2Cl)CC1 1830571721 AEYOJWPHPVQVGA-NRFANRHFSA-N 491.922 5.074 5 20 JKBD O=C(C1=CCCC1)N1CCC([C@H]2CCCCN2C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)CC1 1831061414 SFMIHGKJAKVSOK-OAQYLSRUSA-N 467.591 5.153 5 20 JKBD COC1(CC(=O)N2CCCC[C@H]2C2CCN(C(=O)c3cc4cc([N+](=O)[O-])ccc4s3)CC2)CCC1 1832497577 NSEMYHRATDBNAZ-NRFANRHFSA-N 499.633 5.002 5 20 JKBD CSc1ccc(C(=O)O[C@H](C)C(=O)Nc2c(Cl)cc(Cl)cc2Cl)cc1[N+](=O)[O-] 9621321 DHXXSGGZRIBVFA-MRVPVSSYSA-N 463.726 5.461 5 20 JKBD COc1cc(NC(=O)c2ccc(NCc3ccccc3Cl)c([N+](=O)[O-])c2)cc(OC)c1OC 14472835 FHPANGGIUQLYQJ-UHFFFAOYSA-N 471.897 5.138 5 20 JKBD COc1ccccc1C(=O)Nc1ccc(OC(=O)Cn2c3ccccc3c(=O)c3ccccc32)cc1 14808184 DKKOLHGQYQSHDU-UHFFFAOYSA-N 478.504 5.021 5 20 JKBD O=C(CSc1nnc(-c2c[nH]c3ccccc23)n1C1CC1)Nc1ccc(Cl)cc1[N+](=O)[O-] 17881749 NNQOPCXOILNFSG-UHFFFAOYSA-N 468.926 5.054 5 20 JKBD C[C@@H](OC(=O)c1cc2sc3ccccc3c2s1)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 18655932 PCCYGVAPTKOAIG-LLVKDONJSA-N 451.485 5.992 5 20 JKBD Cc1c(NC(=O)c2ccc(Cl)cc2[N+](=O)[O-])cccc1C(=O)N1CCc2sccc2C1 26046046 IXHNEVKEDCIQPR-UHFFFAOYSA-N 455.923 5.069 5 20 JKBD O=C(Nc1ccccc1C(=O)Nc1ccc(-n2cccn2)c(F)c1)c1ccc([N+](=O)[O-])cc1Cl 108048277 KHLWDCOBHKNSKO-UHFFFAOYSA-N 479.855 5.078 5 20 JKBD Cc1cc(Cc2cnc(NC(=O)c3ccc([N+](=O)[O-])cc3F)s2)ccc1Br 302947207 JHJWUBIDGCHGEP-UHFFFAOYSA-N 450.289 5.104 5 20 JKBD Cc1cc(OCc2cccc(F)c2)ccc1NC(=O)Cn1c2ccccc2c(=O)c2ccccc21 303205556 PJJBGPMBGSCTLP-UHFFFAOYSA-N 466.512 5.820 5 20 JKBD O=C(Nc1ccc(OCc2ccccc2)cc1)c1cc([N+](=O)[O-])ccc1I 312095231 PUPSJUHARUDJHB-UHFFFAOYSA-N 474.254 5.031 5 20 JKBD O=C(C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)N1CC[C@H](c2ccccc2)C1 476172692 UZQDXPMESMCZAH-YVUGPFRESA-N 469.566 6.151 5 20 JKBD CC(=O)c1oc2ccccc2c1NC(=O)[C@H](C)Sc1nc2cc3ccccc3cc2c(=O)n1C 498102532 RGUKUVJOKBRGKG-HNNXBMFYSA-N 471.538 5.155 5 20 JKBD COc1cc(C(=O)Nc2cccc(C(=O)N3CCCC3)c2)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 502684212 ZZOPXQZOJQREQR-UHFFFAOYSA-N 495.919 5.537 5 20 JKBD CN(CCCc1cc(-c2ccccc2)no1)C(=O)c1ccc(NCc2ccccc2)c([N+](=O)[O-])c1 505430400 BBXVXNKQHICMBW-UHFFFAOYSA-N 470.529 5.567 5 20 JKBD CCn1c([C@H]2CCCN2C(=O)c2ccc(N[C@H](C)c3ccccn3)c([N+](=O)[O-])c2)nc2ccccc21 506137351 DSHOZNFHVQPJCB-HOYKHHGWSA-N 484.560 5.510 5 20 JKBD CCN(C(=O)NCCc1ccc([N+](=O)[O-])cc1)[C@@H]1CCSc2ccc(Br)cc21 507334991 SPMCKGGSOBSILN-GOSISDBHSA-N 464.385 5.168 5 20 JKBD O=C(c1ccc(Nc2ccccc2)c([N+](=O)[O-])c1)N1CCC[C@@H](c2nc(-c3ccc(F)cc3)no2)C1 507988744 HTOCHNUQHWPDKC-LJQANCHMSA-N 487.491 5.547 5 20 JKBD CCOc1cc(NC(=O)N2CCc3[nH]c4ccc(Cl)cc4c3C2)c([N+](=O)[O-])cc1OCC 509753327 YDOYGQZTXGPCHM-UHFFFAOYSA-N 458.902 5.117 5 20 JKBD CC[C@@H](c1ccc(F)cc1)N(Cc1cccc(F)c1)C(=O)CSc1ccc(C(N)=O)cc1[N+](=O)[O-] 512334309 PMKSDVNELZOXSJ-NRFANRHFSA-N 499.539 5.244 5 20 JKBD CC1CCN(c2ccc(C(=O)N(C[C@@H]3CCCO3)c3nc4ccccc4s3)cc2[N+](=O)[O-])CC1 514471835 ANOSTLWYKREQHQ-IBGZPJMESA-N 480.590 5.267 5 20 JKBD Cn1c(C(=O)N(C[C@@H]2CCCO2)c2nc(-c3ccc(Cl)cc3Cl)cs2)ccc1[N+](=O)[O-] 514708810 DDBDLEBCYGFHOH-ZDUSSCGKSA-N 481.361 5.189 5 20 JKBD O=[N+]([O-])c1cccc(Cl)c1S(=O)(=O)Nc1ccc(Oc2ccc(C(F)(F)F)cc2)nc1 517158522 JCJSYHUBSNGXBB-UHFFFAOYSA-N 473.816 5.255 5 20 JKBD CC(C)(C)c1ccc(Cn2nccc2NC(=O)c2cc(OCC(F)(F)F)ccc2[N+](=O)[O-])cc1 518228227 YCBHMWFQUJTXMZ-UHFFFAOYSA-N 476.455 5.331 5 20 JKBD COCCc1ccc(Oc2ccc(N[C@H](C)C(=O)Nc3ccc([N+](=O)[O-])cc3Cl)cc2)cc1 521732994 ATDVYALLINNCAO-MRXNPFEDSA-N 469.925 5.669 5 20 JKBD CCc1ccc(N(C(=O)C2CCN(c3ccccc3[N+](=O)[O-])CC2)c2nc3ccccc3s2)cc1 601710494 AEKHPSCNEPWFSB-UHFFFAOYSA-N 486.597 6.348 5 20 JKBD COc1ccc(Oc2ccc(Cl)cc2NC(=O)c2nnn(-c3cccc([N+](=O)[O-])c3)c2C)cc1 603563556 UDYOTIPFGGYPKH-UHFFFAOYSA-N 479.880 5.191 5 20 JKBD Cc1ccc(Sc2ccc(C(=O)NCc3cccc(CN4CCCC4=O)c3)cc2[N+](=O)[O-])cc1 603613220 GZBIPULHGJRALW-UHFFFAOYSA-N 475.570 5.107 5 20 JKBD COc1ccc(CSCC(=O)Nc2ccc(F)c(NC(=O)C3CCCCC3)c2)cc1[N+](=O)[O-] 603758457 YSXIJBOIYIRQAA-UHFFFAOYSA-N 475.542 5.133 5 20 JKBD C[C@H]1CCCN(c2ccc(C(=O)Nc3ccc(C(=O)N4CCCCCC4)cc3)cc2[N+](=O)[O-])C1 603991014 SOFRESHOJHBZGG-IBGZPJMESA-N 464.566 5.100 5 20 JKBD C[C@H](Nc1ccc(C(=O)Nc2ccccc2SCC(F)(F)F)cc1[N+](=O)[O-])c1ccccn1 604300323 MUQUSVZGVSDDTN-AWEZNQCLSA-N 476.480 6.070 5 20 JKBD COc1cc2nc(C)sc2cc1NC(=O)c1ccc(N[C@@H](C)c2ccccn2)c([N+](=O)[O-])c1 608850617 VYECAWNOLKZXCY-ZDUSSCGKSA-N 463.519 5.342 5 20 JKBD Cc1nc(C)c(CCNC(=O)c2ccccc2Sc2ccc(C(F)(F)F)cc2[N+](=O)[O-])s1 609382487 GVJLXJDRXIXUJT-UHFFFAOYSA-N 481.521 5.811 5 20 JKBD CN(C(=O)CSc1nc(-c2cccs2)c(-c2cccs2)[nH]1)c1ccc([N+](=O)[O-])cc1 619750664 UPVBTVRADKFSHT-UHFFFAOYSA-N 456.574 5.530 5 20 JKBD Cn1cc(C(=O)Nc2cccc(OC(=O)c3ccc(Oc4ccc(Cl)cc4[N+](=O)[O-])cc3)c2)cn1 727668458 CFHMOLDRVQFOAE-UHFFFAOYSA-N 492.875 5.246 5 20 JKBD O=C(C[C@H](c1ccccc1)N1CCOC1=O)Nc1cc(Cl)c([N+](=O)[O-])cc1OCc1ccccc1 728233438 YXVUVFDLPPUXMV-OAQYLSRUSA-N 495.919 5.349 5 20 JKBD Cc1nc(CSc2ccccc2C(=O)OCC2CCN(c3ncccc3[N+](=O)[O-])CC2)cs1 749358204 IYYLXXVXQWLHEF-UHFFFAOYSA-N 484.603 5.120 5 20 JKBD O=C(/C=C\c1ccc([N+](=O)[O-])cc1)N[C@H](C(=O)Nc1ccc(Br)cc1F)c1ccccc1 751231017 NVZCOFKXBUTWJP-NSDWXSQCSA-N 498.308 5.006 5 20 JKBD CCOc1ccc(NC(=O)COC(=O)c2csc(-c3ccc(C(C)C)cc3)n2)c([N+](=O)[O-])c1 900224998 NDMBCRGFIBHBPF-UHFFFAOYSA-N 469.519 5.036 5 20 JKBD O=[N+]([O-])c1ccc(-c2ccc(/C=C(\c3nc4ccccc4[nH]3)S(=O)(=O)c3ccccc3)o2)cc1 915852476 ZBMQNAAECRPKGH-LFVJCYFKSA-N 471.494 5.703 5 20 JKBD CC1=C(C(=O)Nc2cccc(F)c2)[C@H](c2cc([N+](=O)[O-])c(F)cc2F)NC(=S)N1c1ccccc1 916723874 PSNQGUUJFRNAIB-QFIPXVFZSA-N 498.486 5.361 5 20 JKBD CCc1cc[n+](/C(C(=S)Nc2c(C(C)C)cccc2C(C)C)=C(/O)c2cccc([N+](=O)[O-])c2)cc1 917611235 XZZICLUTCBUACJ-UHFFFAOYSA-O 490.649 7.015 5 20 JKBD Cn1c(COC(=O)C2CCN(c3ccc(C(F)(F)F)cc3[N+](=O)[O-])CC2)nc2cc(Cl)ccc21 918974971 XBTBHMFFWLZRSW-UHFFFAOYSA-N 496.873 5.114 5 20 JKBD C[C@@H](OC(=O)c1ccc(Cl)c2cccnc12)C(=O)Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1 919261073 DFUUUQGQBDVAOR-GFCCVEGCSA-N 482.905 5.104 5 20 JKBD C[C@H](Nc1ccc(C(=O)Oc2ccc(NC(=O)c3ccco3)cc2)cc1[N+](=O)[O-])c1ccccn1 920111607 OMEONTPLRZKYGF-INIZCTEOSA-N 472.457 5.227 5 20 JKBD O=C(/C=C/c1ccccc1[N+](=O)[O-])NC1(c2ccc(NC(=O)c3n[nH]c4ccc(F)cc34)cc2)CCC1 1789332902 BSTDZARZLCVKCP-AWNIVKPZSA-N 499.502 5.071 5 20 JKBD O=C(CSC1CCCC1)NC1(c2ccc(NC(=O)c3cccc(F)c3[N+](=O)[O-])cc2)CCC1 1790699792 MFUDSINOFXEICX-UHFFFAOYSA-N 471.554 5.157 5 20 JKBD CSc1ccc(CC(=O)NC2(c3ccc(NC(=O)c4cc(O)cc([N+](=O)[O-])c4)cc3)CCC2)cc1 1790758296 YMMIAMITFDRUDO-UHFFFAOYSA-N 491.569 5.013 5 20 JKBD Cc1c(C(=O)Nc2ccc(C3(NC(=O)C4=CCCS4)CCC3)cc2)cc(Cl)cc1[N+](=O)[O-] 1790774373 MNORJGFEHWOBTB-UHFFFAOYSA-N 471.966 5.325 5 20 JKBD Cc1ccn2c(C(=O)Nc3ccc(C4(NC(=O)/C=C/c5ccccc5[N+](=O)[O-])CCC4)cc3)cnc2c1 1790974733 WLJPNDQGLPQRKS-KPKJPENVSA-N 495.539 5.012 5 20 JKBD O=C(CSc1ccccc1[N+](=O)[O-])Nc1ccc(C2(NC(=O)CCCn3cccc3)CCC2)cc1 1791523183 LNPHEEUTMRPTAZ-UHFFFAOYSA-N 492.601 5.103 5 20 JKBD O=C(NC1(c2ccc(NC(=O)c3cc(F)ccc3C(F)(F)F)cc2)CCC1)c1ccc([N+](=O)[O-])o1 1792173829 JCRIGABLPNTUFL-UHFFFAOYSA-N 491.397 5.407 5 20 JKBD Cc1cc(O)c([N+](=O)[O-])cc1C(=O)NC1(c2ccc(NC(=O)[C@@]3(F)CCCC=C3F)cc2)CCC1 1792377605 GBJKBNRVXSNSMX-RUZDIDTESA-N 485.487 5.102 5 20 JKBD CC[C@H](C)[C@H](C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)Cc1ccc(Cl)cc1[N+](=O)[O-])C2)c1ccccc1 1795568503 RECCKPURUAGHIR-IRVQMQQFSA-N 498.023 5.259 5 20 JKBD O=C(c1cc(F)cc([N+](=O)[O-])c1)N1CCC([C@@H]2CCCCN2C(=O)c2cccc3ccccc23)CC1 1828009567 FOQSCTRPSFZDCQ-SANMLTNESA-N 489.547 5.434 5 20 JKBD C[C@@H](CC(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cccc(F)c2[N+](=O)[O-])CC1)c1ccccc1 1831508734 DZIVXPKMXUKPST-YADARESESA-N 481.568 5.161 5 20 JKBD C[C@H](OC(=O)c1cc([N+](=O)[O-])ccc1Cl)C(=O)Nc1ccc(OCc2ccccc2)cc1 10666474 JTUPLLOSVIJIMM-HNNXBMFYSA-N 454.866 5.011 5 20 JKBD COc1ccc(-c2cc(C(=O)O[C@H](C)c3nnc(-c4ccc([N+](=O)[O-])cc4)o3)c3ccccc3n2)cc1 17529480 AENJGGRVZGADLA-MRXNPFEDSA-N 496.479 5.787 5 20 JKBD Cc1ccc(C(C)C)c(Oc2ccc([C@H]3NC(N)=Nc4nc5ccccc5n43)cc2[N+](=O)[O-])c1 18053541 IAWYKHTYLKSRHR-QHCPKHFHSA-N 456.506 5.265 5 20 JKBD O=C(c1cc(Br)ccc1Cl)N(Cc1ccccc1[N+](=O)[O-])CC(F)(F)F 106189490 QEUZCFMFLQBPEV-UHFFFAOYSA-N 451.626 5.215 5 20 JKBD CC(C)[C@@H](NC(=O)c1ccc(N[C@@H](C)c2ccccn2)c([N+](=O)[O-])c1)c1ccc2c(c1)OCCO2 108787326 QQAITVJJONCDMY-SSOJOUAXSA-N 476.533 5.061 5 20 JKBD CC[C@H](C)Sc1ccc(NC(=O)c2ccn(-c3cccc([N+](=O)[O-])c3)n2)c(C(F)(F)F)c1 499556594 SGZZEBQRLGVTKW-ZDUSSCGKSA-N 464.469 5.942 5 20 JKBD COCCN(CC(C)C)C(=O)C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1 500184136 VGXPGCYLJMBFMX-XMHGGMMESA-N 453.564 5.266 5 20 JKBD CC(C)Oc1ccc(NC(=O)c2ccc(N[C@@H](C)c3ccccn3)c([N+](=O)[O-])c2)cc1Cl 506176741 AZHQNHIHQVTHDH-HNNXBMFYSA-N 454.914 5.856 5 20 JKBD C[C@H](NC(=O)c1cn(C)nc1-c1ccc([N+](=O)[O-])cc1)c1ccc(NC(=O)Nc2ccccc2)cc1 508856365 AEMTYXFEEAACRE-KRWDZBQOSA-N 484.516 5.130 5 20 JKBD Cc1ccc2c(c1)CC[C@@H]2NC(=O)c1ccc(C(=O)N[C@@H]2CCc3cc(C)ccc32)c([N+](=O)[O-])c1 524353945 SUDRPVWOLFCNIU-LOSJGSFVSA-N 469.541 5.046 5 20 JKBD O=C(C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)NCc1ncc(-c2ccccc2)o1 524644700 RRQMIDOKEDSRIP-ZHZULCJRSA-N 496.548 6.107 5 20 JKBD O=C(C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)NCc1nc2ccccc2s1 603446002 PTTYOFWDLBPWTK-LGMDPLHJSA-N 486.578 6.061 5 20 JKBD C[C@H]1C[C@H]1c1ccc(CN(C(=O)C2CCN(c3ccc(C(F)(F)F)cc3[N+](=O)[O-])CC2)C2CC2)o1 603877453 JJVKKVAHMFALLN-MGPUTAFESA-N 491.510 5.738 5 20 JKBD COc1cc(C(=O)N[C@H](CC(C)C)c2cccs2)c([N+](=O)[O-])cc1OCc1cscn1 604390621 IPBXJCKEEFSZPU-MRXNPFEDSA-N 461.565 5.218 5 20 JKBD Cc1ccc([N+](=O)[O-])cc1C(=O)Nc1cc(OCC(F)(F)F)cc(OCC(F)(F)F)c1 604469288 PCOBURPGPCAPDC-UHFFFAOYSA-N 452.307 5.038 5 20 JKBD COc1cc(C(=O)Nc2c(-c3ccccc3)ncn2C2CC2)c([N+](=O)[O-])cc1OCc1cscn1 604567740 VQLJXXAHMLDTSD-UHFFFAOYSA-N 491.529 5.090 5 20 JKBD O=C1Nc2cc(Cl)ccc2[C@H]1C1CCN(C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)CC1 608972107 TYDRVKMCCJRLNF-HXUWFJFHSA-N 455.923 5.051 5 20 JKBD CN(Cc1ccccc1)C(=O)N1CCC(C(=O)Oc2ccc(-c3ccccc3)cc2[N+](=O)[O-])CC1 727631898 NLWAKFOFBRJJHW-UHFFFAOYSA-N 473.529 5.131 5 20 JKBD CC(=O)N(C)c1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2N2CCC(Cc3ccccc3)CC2)cc1 743713536 HXMJYLJFAXNYEX-UHFFFAOYSA-N 486.572 5.289 5 20 JKBD COc1ccccc1/C=C(\C(=O)O[C@@H](C)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)c1ccccc1 745941641 DLWHZJKQUSARCD-DBZAVIBRSA-N 471.469 5.498 5 20 JKBD C[C@H](OC(=O)c1csc(-c2ccc([N+](=O)[O-])cc2)n1)C(=O)Nc1ccc(Cl)c(C(F)(F)F)c1 747958419 LRGISVCXRSGIKO-JTQLQIEISA-N 499.854 5.575 5 20 JKBD O=[N+]([O-])c1cc(C(F)(F)F)c(Cl)cc1Sc1nnc(COc2ccc(Cl)cc2)o1 800329845 MWXHCHDXMXJGIA-UHFFFAOYSA-N 466.224 6.034 5 20 JKBD CC(C)N(C)Cc1cc(O[C@H]2CCN(c3cc(Cl)c(C(F)(F)F)cc3[N+](=O)[O-])C2)ccn1 856535776 HGKRLVZGZYDXDP-INIZCTEOSA-N 472.895 5.160 5 20 JKBD COCCN(C(=O)c1cc2c(F)cccc2s1)c1nc(-c2ccc([N+](=O)[O-])cc2)cs1 900792216 HVFTZJZBRXLMLT-UHFFFAOYSA-N 457.508 5.365 5 20 JKBD COc1cc([N+](=O)[O-])ccc1NC(=O)COC(=O)c1sc2cc(C(F)(F)F)ccc2c1Cl 914963450 HYQANKNLTBECJS-UHFFFAOYSA-N 488.827 5.286 5 20 JKBD Cc1cc(C(N)=O)ccc1NC(=O)c1c2c(nc3ccccc13)/C(=C\c1cccc([N+](=O)[O-])c1)CCC2 915177440 WVZICLNMJWVWCG-CYVLTUHYSA-N 492.535 5.680 5 20 JKBD CC(C)Cc1ccc(C(=O)C2CCN(C(=O)c3cc([N+](=O)[O-])ccc3N3CCCC3)CC2)cc1 918578111 STIBNVKMILZCJE-UHFFFAOYSA-N 463.578 5.129 5 20 JKBD COc1cc(C(=O)O[C@H](C)c2nc(C3CC3)no2)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 918953868 ZNAPRGWRGUMBOS-LLVKDONJSA-N 459.842 5.228 5 20 JKBD O=C(O[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1)c1nc(-c2ccccc2)cs1 919121206 MQJFLOJHCWSLHM-OAQYLSRUSA-N 493.928 5.909 5 20 JKBD O=C(COC(=O)CCn1c2ccccc2c2ccccc21)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 919302295 LUQVAWKEGLCWJM-UHFFFAOYSA-N 485.418 5.294 5 20 JKBD Cc1ccc(C(C)C)cc1O[C@@H](C)C(=O)O[C@@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 919408920 WPYFQIDJTBUYSQ-GJZGRUSLSA-N 482.455 5.383 5 20 JKBD C[C@H](OC(=O)CCc1ccc(-c2ccccc2)[nH]1)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 919598571 YDAGTYQRQWKIAT-AWEZNQCLSA-N 475.423 5.112 5 20 JKBD CCc1nc(C(=O)Nc2ccc(C3(NC(=O)c4cc5cc([N+](=O)[O-])ccc5s4)CCC3)cc2)co1 1789851453 NFRGSSNLIZVSDJ-UHFFFAOYSA-N 490.541 5.421 5 20 JKBD C[C@H](C(=O)N1CCCC2(CCN(C(=O)CCc3cccc([N+](=O)[O-])c3)CC2)C1)c1ccc(Cl)cc1 1805193085 ZAFWEJOSWIYHEL-FQEVSTJZSA-N 498.023 5.216 5 20 JKBD O=C(Nc1cc([C@@H]2CCCCN2C(=O)CCc2cccc([N+](=O)[O-])c2)[nH]n1)c1cc2ccccc2o1 1818628622 YQXVIPFEXCAKKH-NRFANRHFSA-N 487.516 5.003 5 20 JKBD CCCCC[C@H](C)C(=O)N1CCCC[C@H]1C1CCN(C(=O)/C=C/c2ccc([N+](=O)[O-])o2)CC1 1831462138 JMHJVMKBMCLQFY-LBGHRLISSA-N 459.587 5.037 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Cl)[C@@H](NCc1ccc(OC(F)(F)F)cc1)c1ccccc1 11722494 VGRZHMAQHASLCX-FQEVSTJZSA-N 479.842 5.616 5 20 JKBD COc1cc(C(=O)Nc2ccc3c(c2)OCCCO3)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 14386186 AMHGUNOALMQEGE-UHFFFAOYSA-N 470.865 5.463 5 20 JKBD C[C@H](OC(=O)c1ccc(Cl)c([N+](=O)[O-])c1)C(=O)Nc1ccc(Cl)cc1C(F)(F)F 15644145 GXGLNLDUFASLLX-QMMMGPOBSA-N 451.184 5.104 5 20 JKBD Cc1nc(-c2ccc(F)cc2)sc1C(=O)O[C@H](C)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 18018398 QBXFKJXWOYZZSM-GFCCVEGCSA-N 454.439 5.134 5 20 JKBD CC(C)CC(=O)Nc1ccc(N[C@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2C(F)(F)F)cc1 25496193 KHZYHMYSISJKIP-CYBMUJFWSA-N 452.433 5.037 5 20 JKBD COc1ccc(Oc2ccc([N+](=O)[O-])cc2C(=O)N2CCC(C(=O)c3ccccc3)CC2)cc1 30892691 RFOBQKLZHUEZTA-UHFFFAOYSA-N 460.486 5.131 5 20 JKBD CCOc1ccc([C@@H](CNC(=O)c2ccc([N+](=O)[O-])cc2C)c2c[nH]c3ccccc23)cc1OC 72068637 NQKBDNRTUHPSOG-JOCHJYFZSA-N 473.529 5.354 5 20 JKBD C[C@H](Nc1ccc(C(=O)N2CCn3cccc3[C@H]2c2ccccc2)cc1[N+](=O)[O-])c1ccccn1 108940257 RXOWPBYOBAZRCN-AFMDSPMNSA-N 467.529 5.210 5 20 JKBD Cc1cnn([C@@H]2CCCc3ccccc32)c1NC(=O)c1ccc(Cn2nc(C)c([N+](=O)[O-])c2C)cc1 110764595 SFZCNXWIJQMNEG-XMMPIXPASA-N 484.560 5.139 5 20 JKBD O=C(NCC1CCOCC1)c1c2c(nc3ccccc13)/C(=C/c1ccc([N+](=O)[O-])cc1)CCC2 501722306 XSRNNNKNQFBFOD-CAPFRKAQSA-N 457.530 5.176 5 20 JKBD CCOc1cc([N+](=O)[O-])c(C(=O)Nc2cc(C(C)(C)C)nn2-c2cccc(C)c2)cc1OC 508382288 LCGCUTHTMOKTRH-UHFFFAOYSA-N 452.511 5.046 5 20 JKBD COc1ccc(CN[C@@H](c2ccccc2)c2ccncc2)cc1OCc1ccc([N+](=O)[O-])cc1 511525035 YSMQBKNBWWIKOR-MHZLTWQESA-N 455.514 5.457 5 20 JKBD Cc1ccc(S(=O)(=O)Nc2ccc(NC(=O)c3oc4ccccc4c3C)cc2)cc1[N+](=O)[O-] 514312860 XVXOBAIQBIHZDI-UHFFFAOYSA-N 465.487 5.011 5 20 JKBD CN(Cc1cscn1)C(=O)C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1 517936689 XHSZQWFKOSAYFD-MHWRWJLKSA-N 450.545 5.250 5 20 JKBD C[C@H](Nc1ccc(C(=O)N2CCC[C@H](c3nc4ccccc4s3)C2)cc1[N+](=O)[O-])c1ccccn1 518421820 XMTPNLWMLHIVTF-HKUYNNGSSA-N 487.585 5.792 5 20 JKBD COc1cc(OC)cc([C@H](NCc2ccc(Oc3ccc(F)cc3)c([N+](=O)[O-])c2)c2nccn2C)c1 520208717 CHKNPLSSXRXOFX-VWLOTQADSA-N 492.507 5.156 5 20 JKBD O=C(c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1)N(Cc1ccccc1)Cc1cc[nH]n1 521448217 GFEOSZQEJYZMSX-UHFFFAOYSA-N 462.893 5.606 5 20 JKBD O=C(c1cc([N+](=O)[O-])ccc1Oc1ccccc1)N1CCC(c2n[nH]c(-c3ccccc3)n2)CC1 523700166 IKJHLGIKBWNMFW-UHFFFAOYSA-N 469.501 5.192 5 20 JKBD Cn1c([C@H](NCc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)c2ccccc2)nc2ccccc21 549549761 BHYFQQYAPDIYSK-RUZDIDTESA-N 454.555 6.089 5 20 JKBD CS(=O)(=O)c1ccc(Oc2ccc(NC(=O)Nc3ccc([N+](=O)[O-])cc3Cl)cc2)cc1 608837376 FYZCRGVDOJSIGX-UHFFFAOYSA-N 461.883 5.088 5 20 JKBD CC(C)(CNC(=O)c1ccc(C(=O)NCC(C)(C)c2ccccc2)c([N+](=O)[O-])c1)c1ccccc1 609044143 XRYPSKJRMSQXAA-UHFFFAOYSA-N 473.573 5.010 5 20 JKBD O=C(C1CCN(c2nc3ccccc3o2)CC1)N(CC1CC1)c1ccc(Cl)c([N+](=O)[O-])c1 728165630 MNDBUAVKGPGJLL-UHFFFAOYSA-N 454.914 5.049 5 20 JKBD COc1cc(C(=O)O[C@@H](C)c2cccc(NC(=O)Cc3ccc(C)cc3)c2)c([N+](=O)[O-])cc1OC 731299598 DEUXNFOVPCELIH-KRWDZBQOSA-N 478.501 5.020 5 20 JKBD COc1cccc(NC(=O)[C@H](OC(=O)c2csc(-c3cccc([N+](=O)[O-])c3)n2)c2ccccc2)c1 747962739 JOQPBVYMJQDKRV-JOCHJYFZSA-N 489.509 5.264 5 20 JKBD CS(=O)(=O)c1cc(Br)cc(C(=O)OCc2nc3ccccc3c3ccccc23)c1F 748977274 MPOOZPINTCXWBC-UHFFFAOYSA-N 488.334 5.050 5 20 JKBD CCCCN1C(=O)N[C@H](c2ccc([N+](=O)[O-])cc2)C(C(=O)Nc2ccccc2C(F)(F)F)=C1C 916165690 IXDPZVWUILPVMY-HXUWFJFHSA-N 476.455 5.393 5 20 JKBD O=C(Cn1ncc2ccc([N+](=O)[O-])cc21)N(Cc1ccsc1)c1ccc(Br)cc1 917761931 RPGGMFWYUBMDHO-UHFFFAOYSA-N 471.336 5.002 5 20 JKBD O=C(O[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Br)c1ccccc1)c1scnc1Cl 919415391 PNASTNKIGLHCGG-AWEZNQCLSA-N 496.726 5.004 5 20 JKBD C[C@@H](OC(=O)Cc1csc(-c2cc(Br)cs2)n1)c1cccc([N+](=O)[O-])c1 919556913 RTYVYVVDEVRZCK-SNVBAGLBSA-N 453.339 5.389 5 20 JKBD CCc1ccccc1OCC(=O)Oc1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2Cl)cc1 923514058 KWJKFXFURWCYKP-UHFFFAOYSA-N 454.866 5.047 5 20 JKBD O=C(CSc1ccc(F)cc1F)Nc1ccc(C2(NC(=O)c3ccc([N+](=O)[O-])o3)CCC2)cc1 1786323170 IUQFRNJJFNTIAG-UHFFFAOYSA-N 487.484 5.006 5 20 JKBD O=C(/C=C/c1ccco1)Nc1ccc(C2(NC(=O)/C=C/c3ccccc3[N+](=O)[O-])CCC2)cc1 1786915883 OQKLDSUSWTZRQH-XBXUPPNFSA-N 457.486 5.049 5 20 JKBD O=C(CSc1ccccc1)NC1(c2ccc(NC(=O)c3ccc([N+](=O)[O-])cc3F)cc2)CCC1 1790623071 LMKHMEJTZYJLRG-UHFFFAOYSA-N 479.533 5.274 5 20 JKBD O=C(CCc1cccc([N+](=O)[O-])c1)NC1(c2ccc(NC(=O)c3ccc4occc4c3O)cc2)CCC1 1790929112 HIWPPKOVBUMFTB-UHFFFAOYSA-N 499.523 5.427 5 20 JKBD Cc1ccc(C(=O)N2CCC3(CCCN(C(=O)CCc4cccc([N+](=O)[O-])c4)C3)CC2)c(Cl)c1 1806495529 ADGLTBJRCROJKE-UHFFFAOYSA-N 483.996 5.034 5 20 JKBD C[C@@H](CC(=O)N1CCCC[C@H]1c1cc(NC(=O)CCc2cccc([N+](=O)[O-])c2)n[nH]1)c1ccccc1 1815538437 JRLKKDRYUPPXLY-CYFREDJKSA-N 489.576 5.137 5 20 JKBD Cc1ccc(CC(=O)N2CCCC[C@H]2C2CCN(C(=O)c3cccc(Cl)c3)CC2)cc1[N+](=O)[O-] 1830365097 MRMNNESXUWFZHD-QHCPKHFHSA-N 483.996 5.033 5 20 JKBD O=C(c1ccc(Cl)c(F)c1)N1CCC([C@@H]2CCCCN2C(=O)c2ccc([N+](=O)[O-])cc2F)CC1 1830499081 NEXMJNRFYFIAHF-QFIPXVFZSA-N 491.922 5.074 5 20 JKBD Cc1cc(C)c(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)/C=C/c3ccc([N+](=O)[O-])o3)CC2)c(C)c1 1832574354 YBGFPYPDMACJQF-ISGGHPHESA-N 479.577 5.060 5 20 JKBD CCOc1ccc(NC(=O)CSc2nnc(-c3cccs3)n2-c2ccccc2)c([N+](=O)[O-])c1 11210508 MUNGNTJUGLZNDD-UHFFFAOYSA-N 481.559 5.034 5 20 JKBD Cc1c(NC(=O)[C@H](C)OC(=O)c2nc(Cl)c(Cl)c(Cl)c2Cl)cccc1[N+](=O)[O-] 21371419 GHSQRWHWAJEZGK-ZETCQYMHSA-N 467.092 5.096 5 20 JKBD O=C(C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1)N1CCC[C@H]1c1ccc(F)cc1 25325831 KVOPLDMOPDWQSH-IBGZPJMESA-N 465.447 5.333 5 20 JKBD CC(C)N(Cc1ccc(Cl)c(Cl)c1)C(=O)CCCn1c(=O)oc2cc([N+](=O)[O-])ccc21 59781963 IBCHJBNMHPPZGR-UHFFFAOYSA-N 466.321 5.027 5 20 JKBD C[C@H](Nc1ccc(C(=O)Nc2cccc(C(=O)Nc3ccccn3)c2)cc1[N+](=O)[O-])c1ccccn1 116586977 ARMYOYCMHVRFEU-KRWDZBQOSA-N 482.500 5.063 5 20 JKBD COc1cc(C(=O)Nc2cc(C(C)(C)C)nn2-c2ccc(F)cc2)c([N+](=O)[O-])cc1OC(F)F 116999001 JBRYAMSFCIXGAM-UHFFFAOYSA-N 478.427 5.079 5 20 JKBD C[C@H](Nc1ccc(C(=O)N2CCC(Oc3ccc(F)cc3F)CC2)cc1[N+](=O)[O-])c1ccccn1 195609577 VIWGFLJWTNCFDX-INIZCTEOSA-N 482.487 5.125 5 20 JKBD COc1ccc([N+](=O)[O-])cc1NC(=O)c1oc2ccccc2c1CSc1ccccc1F 195709434 FUFCHPPWWLEWNE-UHFFFAOYSA-N 452.463 6.033 5 20 JKBD Cc1ccc(NC(=O)c2cc3cc([N+](=O)[O-])ccc3s2)cc1S(=O)(=O)Nc1ccccc1 480488145 FOLUPZSTPFIFFK-UHFFFAOYSA-N 467.528 5.171 5 20 JKBD O=C(C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)Nc1ccc2c(c1)CCC(=O)N2 482557793 RPZVSQJBCNUSBI-QGOAFFKASA-N 484.537 5.659 5 20 JKBD COCCCn1c(Sc2cc(C)nc(-c3ccc([N+](=O)[O-])cc3)n2)nnc1-c1ccccc1Cl 489176926 PFKKYFJODNWUEI-UHFFFAOYSA-N 496.980 5.460 5 20 JKBD O=C(C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)Nc1ccn(Cc2ccncc2)n1 499513474 VYSCOVYDGZZORI-HMMYKYKNSA-N 496.552 5.414 5 20 JKBD C[C@@H]1Cc2cc([N+](=O)[O-])ccc2N1C(=O)c1cccc(NC(=O)c2ccc(Br)cc2)c1 504300894 YWMOBKKNGZWEKB-CQSZACIVSA-N 480.318 5.201 5 20 JKBD Cc1sc(NC(=O)c2ccc(N3CCCC3)c([N+](=O)[O-])c2)nc1-c1c(F)cc(F)cc1F 504704178 UDYNKEDHGCEKOP-UHFFFAOYSA-N 462.453 5.297 5 20 JKBD C[C@H]1C[C@@H](C)CN(c2ccc(C(=O)Nc3cccc(OCc4cscn4)c3)cc2[N+](=O)[O-])C1 504983455 QSDHYVFCDQGOCG-CALCHBBNSA-N 466.563 5.365 5 20 JKBD O=C(Nc1ccc(F)cc1)[C@H]1CCc2ccccc2N1C(=O)c1cc2cc([N+](=O)[O-])ccc2o1 524017678 OAYPBDZRVBEGJD-OAQYLSRUSA-N 459.433 5.080 5 20 JKBD Cn1ccnc1[C@@H](NCc1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1)c1ccc(Cl)cc1 558940932 GLPFMCSNHBTNLR-SANMLTNESA-N 498.974 5.714 5 20 JKBD C[C@@H]1CCCN(c2ccc(C(=O)N3CCC[C@H](c4nc5ccccc5s4)C3)cc2[N+](=O)[O-])C1 603437193 BZRQOZAWBLKXPP-MJGOQNOKSA-N 464.591 5.461 5 20 JKBD CNc1ccc(C(=O)C(c2nc3ccccc3s2)c2nc3ccccc3s2)cc1[N+](=O)[O-] 603835294 YCVDGSRADFBEST-UHFFFAOYSA-N 460.540 5.871 5 20 JKBD Cc1ccc(C(=O)N2C[C@@H](C)C[C@H](C)C2)cc1NC(=O)c1cc2cc([N+](=O)[O-])ccc2s1 603977212 XQSJPQKLDQUYPX-GJZGRUSLSA-N 451.548 5.488 5 20 JKBD O=C(NC[C@@H]1CCN(c2ccc(F)c(F)c2)C1)c1cc([N+](=O)[O-])ccc1Sc1ccccc1 604459114 NVKSXXDLYFADNT-INIZCTEOSA-N 469.513 5.281 5 20 JKBD C[C@H](Nc1ccc(C(=O)Nc2ccc3nc([C@H]4CCCO4)[nH]c3c2)cc1[N+](=O)[O-])c1ccccn1 604480921 BASTYZLGJHFIQQ-NPMXOYFQSA-N 472.505 5.143 5 20 JKBD O=C(NC1C[C@@H](C(F)(F)F)C[C@H](C(F)(F)F)C1)c1csc(-c2ccc([N+](=O)[O-])cc2)n1 604517446 CZKLOUZPOKIADG-QWRGUYRKSA-N 467.391 5.358 5 20 JKBD COc1cccc(/C=C(\CC(=O)Nc2ccc([N+](=O)[O-])cc2F)c2nc3ccccc3s2)c1 608870816 OFPMVVWPDDWGGE-LFIBNONCSA-N 463.490 5.922 5 20 JKBD O=C(Nc1cc(C(=O)N2CCCCC2)ccc1Cl)c1csc(-c2ccc([N+](=O)[O-])cc2)n1 608872720 HIIBFCAHLPJTON-UHFFFAOYSA-N 470.938 5.250 5 20 JKBD O=C(Nc1cccc(/C=C\c2ncc([N+](=O)[O-])cc2C(=O)O)c1)c1ccc(Cl)cc1Cl 609336774 AXSCAJZDCDKVBU-DAXSKMNVSA-N 458.257 5.418 5 20 JKBD CSCC[C@@H](NC(=O)c1cccc([N+](=O)[O-])c1)C(=O)Nc1cccc(Sc2ccccc2)c1 609382296 OGVJCJQXJNSGEZ-JOCHJYFZSA-N 481.599 5.236 5 20 JKBD CN(C)C1CCN(C(=O)c2c3c(nc4ccccc24)/C(=C/c2ccc([N+](=O)[O-])cc2)CCC3)CC1 609417145 JDQMCOCJHUQQLX-CZIZESTLSA-N 470.573 5.186 5 20 JKBD COCCOc1cc([N+](=O)[O-])c(C(=O)Nc2cc(Cl)ccc2Oc2cccc(C)c2)cc1OC 619564601 CHMBQRJCCWCBFY-UHFFFAOYSA-N 486.908 5.635 5 20 JKBD CCn1c(S[C@H](C)C(=O)N(c2nccs2)C2CCCCC2)nc2cc3ccccc3cc2c1=O 648454325 BZXRVXLQVUWFSR-QGZVFWFLSA-N 492.670 5.873 5 20 JKBD C[C@@H](NCc1ccc(Oc2ccccc2Cl)c([N+](=O)[O-])c1)c1ccc2c(c1)CCC(=O)N2 725845639 HKVZNUTYLHMRFK-OAHLLOKOSA-N 451.910 5.776 5 20 JKBD O=C(Cc1ccc(NC(=O)c2cccc(Br)c2)cc1)OCc1c(F)cccc1[N+](=O)[O-] 728993320 DZYJPOCKGKAFJD-UHFFFAOYSA-N 487.281 5.035 5 20 JKBD Cc1ccc(CN(Cc2ccco2)C(=O)c2ccc(I)c([N+](=O)[O-])c2)s1 730486679 PZCWCRJSLRCGFJ-UHFFFAOYSA-N 482.299 5.005 5 20 JKBD C[C@H](OC(=O)c1cc(-c2ccc(C(F)(F)F)cc2)no1)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl 730858590 SBIQDKPEJVVKTJ-JTQLQIEISA-N 483.786 5.106 5 20 JKBD O=C(CCc1nc(-c2ccc(Cl)cc2)no1)N(CC1CC1)c1ccc(Cl)c([N+](=O)[O-])c1 745344759 NBZQZDXCCLLMPA-UHFFFAOYSA-N 461.305 5.327 5 20 JKBD O=C(OCc1nnc(-c2ccc(Cl)cc2Cl)o1)c1csc(-c2ccc([N+](=O)[O-])cc2)n1 747955576 UBVHDICLNYZPNN-UHFFFAOYSA-N 477.285 5.432 5 20 JKBD CC(C)Cn1cc([C@H]2N(c3ccc(C(=O)c4ccccc4)cc3[N+](=O)[O-])CC23CCOCC3)cn1 849477780 ATQXWYWNWZWLLM-AREMUKBSSA-N 474.561 5.036 5 20 JKBD Cc1ccc(-c2nnc(-c3ccc(C(=O)O[C@@H](C)C(=O)Nc4cccc([N+](=O)[O-])c4C)cc3)o2)cc1 857835456 QERSLNPWMGMWET-KRWDZBQOSA-N 486.484 5.113 5 20 JKBD Cn1cc(-c2nc(-c3ccc(Oc4ccc(F)cc4)nc3)no2)c(-c2ccc([N+](=O)[O-])cc2)n1 904508192 RGYFDVXMYIOANQ-UHFFFAOYSA-N 458.409 5.039 5 20 JKBD C[C@@H](OC(=O)/C=C/c1ccc2ccc(Cl)cc2n1)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 912874657 YNSMKVLOLXKETC-UVMWJGKXSA-N 493.825 5.399 5 20 JKBD Cc1cccc(NC(=O)Nc2cccc(CNc3ccc([N+](=O)[O-])cc3C(=O)NC3CC3)c2)c1 917088733 KEEURUAVVBHJMF-UHFFFAOYSA-N 459.506 5.052 5 20 JKBD Cc1c(COC(=O)[C@H]2CCC(=O)N(Cc3ccccc3)[C@H]2c2ccccc2)cccc1[N+](=O)[O-] 919531771 DZDAPPJLTSCWMR-OZXSUGGESA-N 458.514 5.127 5 20 JKBD O=C(CCc1cc(F)ccc1F)Oc1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2Cl)cc1 919679516 UHKVFADQHNELTO-UHFFFAOYSA-N 460.820 5.317 5 20 JKBD O=C(Cn1ccc2ccc([N+](=O)[O-])cc21)NC1(c2ccc(NC(=O)c3cccs3)cc2)CCC1 1787272782 AYGFYPUDAAEVHK-UHFFFAOYSA-N 474.542 5.059 5 20 JKBD Cc1cc(C(=O)NC2(c3ccc(NC(=O)/C=C/c4cc5ccccc5o4)cc3)CCC2)ncc1[N+](=O)[O-] 1789116908 USIISUSGHHEBAM-VAWYXSNFSA-N 496.523 5.506 5 20 JKBD Cc1c(Cl)ccc(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)c3ccc([N+](=O)[O-])o3)[nH]n2)c1Cl 1823139003 JKXNBCAMBUDLTK-HNNXBMFYSA-N 492.319 5.146 5 20 JKBD O=C(c1ccccc1C1CC1)N1CCC([C@H]2CCCCN2C(=O)Cc2cc([N+](=O)[O-])ccc2F)CC1 1824948084 QNTWYDKMLPSOEO-AREMUKBSSA-N 493.579 5.087 5 20 JKBD Cc1cc(C(=O)N2CCC([C@@H]3CCCCN3C(=O)c3cc(Cl)cc([N+](=O)[O-])c3C)CC2)c(C)o1 1830734595 PCIPEFYBDHXWPV-QFIPXVFZSA-N 487.984 5.314 5 20 JKBD CC(C)c1ccc(CC(=O)N2CCCC[C@H]2C2CCN(C(=O)/C=C/c3ccc([N+](=O)[O-])o3)CC2)cc1 1831595082 YBHMMHKUIAQTLK-DWOOMVRVSA-N 493.604 5.187 5 20 JKBD COc1cc(C(=O)N2CCCC[C@H]2C2CCN(C(=O)c3ccccc3C3CC3)CC2)ccc1[N+](=O)[O-] 1832697847 RUBXHTDIVXCGAK-DEOSSOPVSA-N 491.588 5.028 5 20 JKBD O=[N+]([O-])c1cc2c(c(CSc3nnc(-c4cccs4)n3-c3ccccc3)c1)OCOC2 3536666 CTMVKWQGEWCNBW-UHFFFAOYSA-N 452.517 5.063 5 20 JKBD COc1ccc(-c2[nH]c3ccccc3c2CCC(=O)OCC(=O)Nc2c(C)cccc2[N+](=O)[O-])cc1 12700943 SSHCZHSLEPOGAT-UHFFFAOYSA-N 487.512 5.175 5 20 JKBD Cc1c(NC(=O)c2cccc(NS(=O)(=O)c3cc(Cl)ccc3Cl)c2)cccc1[N+](=O)[O-] 15790914 ZFJDABYKKZNWPF-UHFFFAOYSA-N 480.329 5.263 5 20 JKBD C[C@H](OC(=O)c1c(-n2cccc2)sc2c1CCSC2)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl 16412618 KXKBDDIQKMFZJE-LBPRGKRZSA-N 491.978 5.074 5 20 JKBD C[C@H](c1nc2ccccc2s1)N(C)C(=O)CCNc1ccc(C(F)(F)F)cc1[N+](=O)[O-] 16498877 NGKRGMDYHGOSQR-GFCCVEGCSA-N 452.458 5.245 5 20 JKBD Cc1ccc(NC(=O)[C@H](Sc2nnc(-c3ccccc3F)n2C)c2ccccc2)c([N+](=O)[O-])c1 22006735 KDHORBGLZNOHCD-OAQYLSRUSA-N 477.521 5.310 5 20 JKBD CC[C@H](C)Cc1c(C)sc2[nH]c(SCc3nnc(-c4ccc([N+](=O)[O-])cc4)o3)nc(=O)c12 23007044 LPVOHUXSVCLZNZ-NSHDSACASA-N 471.564 5.132 5 20 JKBD Cc1c(-c2ccccc2)sc(NC(=O)c2cc([N+](=O)[O-])ccc2Cl)c1C(=O)N1CCCCC1 24648514 UCJZXQHOQWLYBR-UHFFFAOYSA-N 483.977 6.164 5 20 JKBD O=C(CCc1ncc(-c2ccc(Cl)cc2)o1)N(Cc1ccccc1[N+](=O)[O-])CC(F)(F)F 106187788 YCRPVSAEDKQOBT-UHFFFAOYSA-N 467.831 5.427 5 20 JKBD O=C(NCc1ccccc1[N+](=O)[O-])c1ccc(-n2nc(SCc3ccccc3)sc2=S)cc1 107959534 OOVLVTQXTBBRGD-UHFFFAOYSA-N 494.623 5.794 5 20 JKBD O=C(Nc1ccccc1NCC(F)(F)F)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 302960075 DSDHHAUYBJDEQW-UHFFFAOYSA-N 490.404 5.443 5 20 JKBD CSc1ccc(C(=O)c2ccccc2C(=O)N2CCC(OC3CCCCC3)CC2)cc1[N+](=O)[O-] 495609045 NNXKNOQBAPUDHN-UHFFFAOYSA-N 482.602 5.502 5 20 JKBD Cc1csc(Sc2ccc(C(=O)N3CCC(OC4CCCCC4)CC3)cc2[N+](=O)[O-])n1 495656001 KMQDAMCBXAHBSS-UHFFFAOYSA-N 461.609 5.465 5 20 JKBD CC1CCN(c2ccc(C(=O)Nc3ccc(NC(=O)N4CCCCCC4)cc3)cc2[N+](=O)[O-])CC1 498531729 LBHZWRNHENAITP-UHFFFAOYSA-N 479.581 5.491 5 20 JKBD CCc1cc(O)nc(-c2cccc(NC(=O)c3cc([N+](=O)[O-])ccc3NCc3ccccc3)c2)n1 500337834 BEIHHGBEHPAUPN-UHFFFAOYSA-N 469.501 5.184 5 20 JKBD O=C(Cn1c2ccccc2c(=O)c2ccccc21)N[C@@H]1CCOc2c(-c3ccccc3)cccc21 505091115 QMQULQGDXJOXFQ-RUZDIDTESA-N 460.533 5.462 5 20 JKBD COc1ccc(Oc2ccc([N+](=O)[O-])cc2C(=O)N2CCO[C@H](c3ccccc3Cl)C2)cc1 505125572 OMGLYRDRBOPEEM-QHCPKHFHSA-N 468.893 5.263 5 20 JKBD C[C@@H](NC(=O)Nc1cccc(NC(=O)c2cccc(C(F)(F)F)c2)c1)c1cccc([N+](=O)[O-])c1 509876171 BMMOVOMGCAIIKR-CQSZACIVSA-N 472.423 5.749 5 20 JKBD COCCN(C(=O)c1csc(Cc2ccccc2)n1)c1nc(-c2ccc([N+](=O)[O-])cc2)cs1 512167788 YITAJJBVBFYROD-UHFFFAOYSA-N 480.571 5.059 5 20 JKBD CC(C)OCc1ccc(N[C@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Br)c2ccccc2)cc1 513210172 NRPYOHOGWMUAHR-QHCPKHFHSA-N 498.377 6.074 5 20 JKBD CCOc1cc(C(=O)Nc2cc(C(C)(C)C)nn2-c2ccccc2C)c([N+](=O)[O-])cc1OC 514501543 ITJOWXUKUZUSNX-UHFFFAOYSA-N 452.511 5.046 5 20 JKBD COc1cc(C(=O)Nc2ccc(-c3cn4ccc(C)cc4n3)cc2)c([N+](=O)[O-])cc1OC(F)F 589278368 DLFPMEOSCTUUJZ-UHFFFAOYSA-N 468.416 5.080 5 20 JKBD CCCCc1ccc([C@H](NC(=O)C(=O)Nc2cc([N+](=O)[O-])ccc2C)c2cccs2)cc1 603706272 VKLWNWBBVYPCAV-QFIPXVFZSA-N 451.548 5.152 5 20 JKBD COCCN(C(=O)[C@@H](C)SCc1ccccc1)c1nc(-c2ccc([N+](=O)[O-])cc2)cs1 603750648 ZYEJZAZDMAPRDR-MRXNPFEDSA-N 457.577 5.020 5 20 JKBD O=[N+]([O-])c1ccc(CS(=O)(=O)N[C@@H](c2ccccc2)c2ccc(Cl)c(Cl)c2)cc1 604042055 KAZUQPXCKQMSJL-FQEVSTJZSA-N 451.331 5.111 5 20 JKBD COc1cc(C(=O)Nc2nc3c(C)ccc(C)c3s2)c([N+](=O)[O-])cc1OCc1cscn1 604383021 BBJIOWYTGZOESE-UHFFFAOYSA-N 470.532 5.118 5 20 JKBD Cc1nn(Cc2ccc(C(=O)Nc3cccc(COCCc4ccccc4)c3)cc2)c(C)c1[N+](=O)[O-] 604450815 HVWXHLHMOCGGEA-UHFFFAOYSA-N 484.556 5.468 5 20 JKBD C[C@@H](Nc1ccc(C(=O)NC[C@H]2CCN(c3ccc(Cl)cc3)C2)cc1[N+](=O)[O-])c1ccccn1 604466671 VGTOZHXWLAYZOU-QZTJIDSGSA-N 479.968 5.073 5 20 JKBD Cc1cc(C(=O)N2CCC[C@@H]2C(=O)Nc2nc3ccc(SC(F)F)cc3s2)ccc1[N+](=O)[O-] 726496467 ZDDBBRKJIQXHPN-MRXNPFEDSA-N 492.529 5.071 5 20 JKBD O=C(Oc1ccc2c(-c3ccc([N+](=O)[O-])cc3)cc(=O)oc2c1)c1cc(F)c(Cl)nc1Cl 728802236 RGANQEZYUCGOJS-UHFFFAOYSA-N 475.215 5.428 5 20 JKBD COc1cc(C(=O)O[C@@H](C)c2ccc(NC(=O)c3ccccc3)cc2)c([N+](=O)[O-])cc1OC(F)F 748016190 STSSLACBHTWANC-AWEZNQCLSA-N 486.427 5.375 5 20 JKBD C[C@H]1C[C@H]1c1ccc(CCC(=O)Oc2ccc(NC(=O)c3cc([N+](=O)[O-])ccc3Cl)cc2)o1 783505103 DWJIAZNMZFXGNY-IFXJQAMLSA-N 468.893 5.755 5 20 JKBD CCOc1cc(/C=C(/C(=O)OCc2nc(-c3cccc([N+](=O)[O-])c3)no2)c2ccccc2)ccc1O 914892717 HGBAAFJDNUZFBU-FYJGNVAPSA-N 487.468 5.033 5 20 JKBD COc1cccc2sc(NC(=O)c3ccccc3NC(=O)c3ccc([N+](=O)[O-])cc3Cl)nc12 917352695 RTFWREHTZCBHMB-UHFFFAOYSA-N 482.905 5.371 5 20 JKBD C[C@H](OC(=O)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-])C(=O)Nc1ccccc1-c1ccccc1 919195590 IHRSCUUMKJWBQW-HNNXBMFYSA-N 488.418 5.387 5 20 JKBD O=C(Oc1ccc(-c2ccccc2)cc1[N+](=O)[O-])c1nccnc1-c1nc2ccccc2s1 920330257 WKBUMDDPUUKZLY-UHFFFAOYSA-N 454.467 5.548 5 20 JKBD C[C@@H](Nc1ccc(C(=O)OCc2cc(-c3ccc(F)cc3)no2)cc1[N+](=O)[O-])c1ccccn1 920543685 HPKWFZAYESXLHA-OAHLLOKOSA-N 462.437 5.314 5 20 JKBD Cn1cc(CC(=O)O[C@@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2ccccc2)c2ccccc21 920706242 JATYLFYOUGSOLN-XMMPIXPASA-N 477.904 5.206 5 20 JKBD O=C(NC1(c2ccc(NC(=O)c3ccc([N+](=O)[O-])c4c3OCO4)cc2)CCC1)c1ccc2occc2c1 1790095033 WNGTYCSHBZNHFW-UHFFFAOYSA-N 499.479 5.131 5 20 JKBD CC1=CC[C@@H](C(=O)NC2(c3ccc(NC(=O)c4ccc([N+](=O)[O-])cc4F)cc3)CCC2)CC1 1790622314 UMBJJQZIKNLQTJ-QGZVFWFLSA-N 451.498 5.228 5 20 JKBD CC(C)[C@H](C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C1(c2cccc([N+](=O)[O-])c2)CCC1)c1ccccc1 1800038522 FKICNOXCGACXJO-UHCVVMIDSA-N 489.616 5.095 5 20 JKBD CC1=CC[C@H](C(=O)N2CC[C@H](CNC(=O)c3cc(Cl)cc([N+](=O)[O-])c3C)[C@@H]2c2cccnc2)CC1 1811794813 UQQZYTISZJEKEJ-NRYAXDJKSA-N 496.995 5.018 5 20 JKBD Cc1c(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)/C=C/c3ccsc3)n[nH]2)cc(Cl)cc1[N+](=O)[O-] 1815984054 OFNBFGAUAZODMB-ZMBJWTFHSA-N 499.980 5.361 5 20 JKBD CC1(C(=O)N2CCCC[C@H]2c2cc(NC(=O)CSc3ccccc3[N+](=O)[O-])n[nH]2)CCCCC1 1822313520 SCPOFDJUKMLJNQ-SFHVURJKSA-N 485.610 5.073 5 20 JKBD O=C(/C=C/c1ccccc1[N+](=O)[O-])Nc1cc([C@H]2CCCCN2C(=O)c2ccc(Cl)c(F)c2)[nH]n1 1823503142 KEIVRGHMDMHWGO-FKVRIVCVSA-N 497.914 5.130 5 20 JKBD O=C([C@@H]1CCC[C@@H]2CCCC[C@H]21)N1CCC([C@@H]2CCCCN2C(=O)/C=C/c2ccc([N+](=O)[O-])o2)CC1 1824277100 PWOVFIIZVSYCNB-QUONSSANSA-N 497.636 5.427 5 20 JKBD Cc1cncc(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3cc4cc([N+](=O)[O-])ccc4s3)CC2)c1 1826009597 VBLDTBBSLFYLRN-JOCHJYFZSA-N 492.601 5.060 5 20 JKBD COc1cc(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3cccc(Cl)c3C)CC2)ccc1[N+](=O)[O-] 1832694839 UYNKVFMZBILBST-JOCHJYFZSA-N 499.995 5.112 5 20 JKBD Cc1ccc2nc(-c3ccc(NC(=O)COC(=O)c4ccc([N+](=O)[O-])s4)cc3)sc2c1 3284270 LKNRMIGRTKACEG-UHFFFAOYSA-N 453.501 5.037 5 20 JKBD CCCn1c(S[C@@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)nc2sc3c(c2c1=O)CCC3 20789690 NWUQXUYKYBXUAL-NSHDSACASA-N 493.010 5.038 5 20 JKBD O=C(OCc1nc2ccccc2c2ccccc12)c1ccccc1-n1ncc(Cl)c(Cl)c1=O 21761881 JJDOVAKTVUFOPR-UHFFFAOYSA-N 476.319 5.598 5 20 JKBD Cc1cccc([N+](=O)[O-])c1NC(=O)CSc1nnc(-c2ccc(F)cc2)n1Cc1ccccc1 23599550 WMGFLXWTZOXDAD-UHFFFAOYSA-N 477.521 5.080 5 20 JKBD O=C(Nc1ccc(Oc2ccc(Br)cc2)cc1)c1cc2c(cc1[N+](=O)[O-])OCO2 25387026 RZFGUBOOIFAJGH-UHFFFAOYSA-N 457.236 5.131 5 20 JKBD COc1ccc([C@@H](C)N[C@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2C(F)(F)F)cc1Br 30510222 NEKVYEOFJHIOFB-GHMZBOCLSA-N 490.276 5.063 5 20 JKBD C[C@@H](OC(=O)c1[nH]c2ccccc2c1Cl)C(=O)Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1 46767436 ZSWOEAIFFKWTBD-LLVKDONJSA-N 470.894 5.037 5 20 JKBD Cc1occc1C(=O)Nc1cc(NC(=O)c2ccc(N3CCC[C@@H](C)C3)c([N+](=O)[O-])c2)ccc1F 46840258 DFPBRZTXROHMLK-OAHLLOKOSA-N 480.496 5.376 5 20 JKBD C[C@H](NC(=O)c1ccc(Sc2nc3ccccc3s2)c([N+](=O)[O-])c1)c1ccc(NC(N)=O)cc1 480351564 SDEUECYFJYGZLU-ZDUSSCGKSA-N 493.570 5.337 5 20 JKBD C[C@@H](Nc1ccc([N+](=O)[O-])c(C(=O)N2CCCC2)c1)c1ccc(OCc2ccc(F)cc2)cc1 487992602 KSDUGRGYFLXQJX-GOSISDBHSA-N 463.509 5.722 5 20 JKBD Cc1cc(C(=O)NC2CCCCC2)ccc1NC(=O)c1csc(-c2cccc([N+](=O)[O-])c2)n1 496607731 AKCAMSLSPNENQY-UHFFFAOYSA-N 464.547 5.342 5 20 JKBD COCCN(C(=O)[C@@H]1C[C@H]1c1cccc2ccccc12)c1nc(-c2ccc([N+](=O)[O-])cc2)cs1 503087462 RWNBQZNKSJLJLJ-XZOQPEGZSA-N 473.554 5.655 5 20 JKBD COc1ccc(Oc2ccc([N+](=O)[O-])cc2C(=O)N2CCC(C(=O)Nc3cccc(F)c3)CC2)cc1 505261830 NFCYOGHAZSXHDZ-UHFFFAOYSA-N 493.491 5.026 5 20 JKBD COc1ccc(OCc2csc(N(C(C)=O)c3ccc(C(F)(F)F)cc3)n2)c([N+](=O)[O-])c1 505887011 QCRXHIIQQXWEKJ-UHFFFAOYSA-N 467.425 5.342 5 20 JKBD C[C@@H](Nc1ccc(C(=O)Nc2ccccc2Cc2ccccc2)cc1[N+](=O)[O-])c1ccccn1 506085488 HVWATEBACXHGSK-LJQANCHMSA-N 452.514 6.006 5 20 JKBD Cc1csc(Sc2ccc(C(=O)N(C)Cc3ccccc3N3CCCC3)cc2[N+](=O)[O-])n1 512496895 OPXWGBPWOZVBBX-UHFFFAOYSA-N 468.604 5.383 5 20 JKBD Cc1ccc(-n2c(S[C@@H](C)c3nnc(-c4ccc([N+](=O)[O-])cc4)o3)nnc2-c2ccncc2)cc1 515339453 QTILOVRCBCHSTR-INIZCTEOSA-N 485.529 5.449 5 20 JKBD CS(=O)(=O)c1cc(C(=O)Nc2cc(Cl)ccc2Oc2ccc(Cl)cc2)cc([N+](=O)[O-])c1 516754403 USOAOOXNGUSPDG-UHFFFAOYSA-N 481.313 5.350 5 20 JKBD CCSc1ccc(Cl)cc1NC(=O)c1ccc(N[C@@H](C)c2ccccn2)c([N+](=O)[O-])c1 520542567 IMSSYSIQRWRRFR-AWEZNQCLSA-N 456.955 6.181 5 20 JKBD COc1ccc(CNC(=O)Nc2ccc3c(c2)CCC(=O)N3Cc2ccc(Cl)cc2)cc1[N+](=O)[O-] 521679936 YNNRLRKAUXWRFR-UHFFFAOYSA-N 494.935 5.058 5 20 JKBD CCOCCOc1c(Cl)cccc1NC(=O)c1ccc(N2CCC[C@H](C)C2)c([N+](=O)[O-])c1 521729268 NZTSRQQXOVJZPF-INIZCTEOSA-N 461.946 5.152 5 20 JKBD Cc1ccc(C(C)C)c(Oc2ccc(CNCc3ccc(S(=O)(=O)N(C)C)cc3)cc2[N+](=O)[O-])c1 521818485 SQLFCNOSIOGJQO-UHFFFAOYSA-N 497.617 5.359 5 20 JKBD C[C@H]1CCCN(c2ccc(C(=O)N3CCC[C@H](c4nc5ccccc5s4)C3)cc2[N+](=O)[O-])C1 603437191 BZRQOZAWBLKXPP-HKUYNNGSSA-N 464.591 5.461 5 20 JKBD O=C(c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-])N1CCC[C@@H]1c1nc2ccccc2s1 603729623 JMHOXPOTFUKAEB-MRXNPFEDSA-N 451.426 5.123 5 20 JKBD Cc1nc(-c2ccc([C@@H](C)NC(=O)c3cc(OCC(F)(F)F)ccc3[N+](=O)[O-])cc2)cs1 603737641 UBDZLMOURNWNBU-GFCCVEGCSA-N 465.453 5.459 5 20 JKBD Cc1ccc(C(=O)Nc2cccc(C(F)(F)F)c2)cc1NC(=O)COc1cccc([N+](=O)[O-])c1 604449337 AHXXPCDGDICGPD-UHFFFAOYSA-N 473.407 5.192 5 20 JKBD CCc1cccc[n+]1/C(C(=S)NC12CC3CC(CC(C3)C1)C2)=C(/O)c1cccc([N+](=O)[O-])c1 725762100 OCDPDVXCZYRRJI-UHFFFAOYSA-O 464.611 5.214 5 20 JKBD C[C@H](OC(=O)[C@H](C)Oc1cc(Cl)cc(Cl)c1)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 727217531 DVKPIPJLYGAPED-UWVGGRQHSA-N 495.237 5.258 5 20 JKBD CC(C)N(Cc1nnc(-c2cccc([N+](=O)[O-])c2)o1)C(=O)c1csc(-c2ccccc2Cl)n1 727294655 GGWNKLWDAYBRIR-UHFFFAOYSA-N 483.937 5.473 5 20 JKBD CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccc(NC(=O)OC(C)(C)C)cc1C(F)(F)F 729571112 HLSCJBNNMDKVQM-UHFFFAOYSA-N 496.486 6.403 5 20 JKBD CN(Cc1ccccc1[N+](=O)[O-])C(=O)Nc1ccc(NC(=O)OC(C)(C)C)cc1C(F)(F)F 729572152 XKRNAFZBMGJBTB-UHFFFAOYSA-N 468.432 5.625 5 20 JKBD O=C(CSc1nnc(-c2ccc(F)cc2)c2ccccc12)Nc1cc([N+](=O)[O-])ccc1F 779460297 NPALYXDJVIRZBP-UHFFFAOYSA-N 452.442 5.214 5 20 JKBD O=C(Cc1cccc2cccnc12)O[C@H](C(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1)c1ccccc1 817040115 JZPQKJJTOIXQMT-DEOSSOPVSA-N 475.888 5.262 5 20 JKBD CC1=C(C(=O)Nc2cccc([N+](=O)[O-])c2)[C@H](c2ccc3ncccc3c2)NC(=S)N1c1ccccc1 839448665 JEJFIJMWBNAOKQ-VWLOTQADSA-N 495.564 5.492 5 20 JKBD O=C1/C(=C/c2ccc(Oc3ccc(F)cc3)c([N+](=O)[O-])c2)c2ccccc2C(=O)N1Cc1ccccn1 915852874 PPXQYULTMNLQQH-BUVRLJJBSA-N 495.466 5.644 5 20 JKBD C[C@H](Oc1ccc(C(=O)O[C@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)cn1)c1ccccc1 919214993 OLDLSYFZCDZTNK-JKSUJKDBSA-N 460.446 5.098 5 20 JKBD O=C(O[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Br)c1ccccc1)c1scnc1Cl 919415392 PNASTNKIGLHCGG-CQSZACIVSA-N 496.726 5.004 5 20 JKBD C[C@H](Sc1cc(Cl)ccc1Cl)C(=O)OCC(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 919509472 PUBIWYMAIOZNDA-VIFPVBQESA-N 497.278 5.583 5 20 JKBD COc1ccc([C@@H]2C[C@@H]2C(=O)NC2(c3ccc(NC(=O)Cc4cccc([N+](=O)[O-])c4)cc3)CCC2)cc1 1785791489 DQLJJQYNEQCHBO-UIOOFZCWSA-N 499.567 5.084 5 20 JKBD Cc1cccc(C(=O)NC2(c3ccc(NC(=O)/C=C/c4ccc([N+](=O)[O-])o4)cc3)CCC2)c1F 1786205518 AIGUFBAJOPVQKR-ZRDIBKRKSA-N 463.465 5.096 5 20 JKBD CO/C=C(\C)C(=O)Nc1ccc(C2(NC(=O)c3cc4cc([N+](=O)[O-])ccc4s3)CCC2)cc1 1789432824 NSSHPSNQDFOCLB-CCEZHUSRSA-N 465.531 5.107 5 20 JKBD O=C(NC1(c2ccc(NC(=O)C3(c4ccccc4)CCC3)cc2)CCC1)c1ccc([N+](=O)[O-])o1 1791524002 NPVXNOWMRWGDBQ-UHFFFAOYSA-N 459.502 5.057 5 20 JKBD O=C(NC1(c2ccc(NC(=O)[C@H]3CCCS3)cc2)CCC1)c1cc2cc([N+](=O)[O-])ccc2s1 1792012576 FOAZQOSOHCWQKZ-HXUWFJFHSA-N 481.599 5.453 5 20 JKBD CC[C@@H](C(=O)N1CCCC[C@H]1C1CCN(C(=O)Cc2cc([N+](=O)[O-])ccc2F)CC1)c1ccccc1 1826309451 BYWJSMGWUGDFHD-RSXGOPAZSA-N 495.595 5.090 5 20 JKBD O=C(c1ccc([N+](=O)[O-])cc1F)N1CCC([C@@H]2CCCCN2C(=O)c2c(F)cccc2Cl)CC1 1829898659 BFOUOOSLMSIXFO-NRFANRHFSA-N 491.922 5.074 5 20 JKBD CC(C)=CCCC(=O)N1CCCC[C@@H]1C1CCN(C(=O)C2(c3cccc([N+](=O)[O-])c3)CCC2)CC1 1830257552 STKAJDGYKPTEAL-RUZDIDTESA-N 481.637 5.383 5 20 JKBD O=C(/C=C/c1ccccc1[N+](=O)[O-])N1CCC([C@H]2CCCCN2C(=O)c2cc(F)ccc2Cl)CC1 1830578478 VXDCINIHTYZQMO-OXHGWOFKSA-N 499.970 5.334 5 20 JKBD Cc1cccc(F)c1C(=O)N1CCC([C@@H]2CCCCN2C(=O)CSc2ccccc2[N+](=O)[O-])CC1 1831777477 RIEPGEKAYMPYMG-NRFANRHFSA-N 499.608 5.068 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)N1CCC([C@H]2CCCCN2C(=O)C23CCC(CC2)CC3)CC1 1832390130 LXJWOOIOZHTEQJ-AHKKLNPASA-N 485.600 5.246 5 20 JKBD CC(C)Cn1c(SCC(=O)Nc2ccc([N+](=O)[O-])cc2Cl)nnc1-c1ccccc1F 8651064 QKEMPMQHAISPMV-UHFFFAOYSA-N 463.922 5.033 5 20 JKBD Cc1nn(Cc2ccccc2)c2sc(C(=O)O[C@@H](C)c3nnc(-c4ccc([N+](=O)[O-])cc4)o3)cc12 17660455 CSOJCZBTKXEKTP-HNNXBMFYSA-N 489.513 5.331 5 20 JKBD O=C(Cc1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1)Nc1cccc(Cl)c1F 20933472 GTIWNNUZNPNIIU-UHFFFAOYSA-N 450.857 5.421 5 20 JKBD COc1ccccc1-c1nnc(S[C@H](C)C(=O)Nc2ccccc2[N+](=O)[O-])n1-c1ccc(C)cc1 21752484 STXHNPPYMHTTJZ-QGZVFWFLSA-N 489.557 5.279 5 20 JKBD CCn1c(S[C@H](C)C(=O)Nc2cc([N+](=O)[O-])ccc2Cl)nc2sc3c(c2c1=O)CCCC3 23597267 JQBWYACPFYLJBW-LLVKDONJSA-N 493.010 5.038 5 20 JKBD COc1ccc(NC(=O)c2cc(SC)ccc2[N+](=O)[O-])cc1NC(=O)c1ccc(Cl)cc1F 68734461 FYNOPADICPZCML-UHFFFAOYSA-N 489.912 5.622 5 20 JKBD Cc1cccc(-c2nc(C(C)C)no2)c1NC(=O)Cn1c2ccccc2c(=O)c2ccccc21 110637310 YVDUQLKYOAUKGJ-UHFFFAOYSA-N 452.514 5.275 5 20 JKBD O=C(NCCC(=O)N1CCCCCC1)c1ccccc1Sc1ccc(C(F)(F)F)cc1[N+](=O)[O-] 498541371 RZRSRIWTYNHHCI-UHFFFAOYSA-N 495.523 5.287 5 20 JKBD O=C(Nc1ccc(C(=O)N2CCOCC2)cc1)c1cc([N+](=O)[O-])ccc1Sc1ccc(Cl)cc1 500263368 RKUUMSSQBMXHOH-UHFFFAOYSA-N 497.960 5.124 5 20 JKBD CCN(C(=O)Nc1cc([N+](=O)[O-])ccc1C)[C@@H]1CCSc2ccc(Br)cc21 509072000 WJJVKORSFMITFA-QGZVFWFLSA-N 450.358 5.757 5 20 JKBD O=C(C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)N1CCOc2ccccc21 512323867 NUIHNISHHFHETG-OBGWFSINSA-N 457.511 5.561 5 20 JKBD CC(C)c1ccc([C@H](NC(=O)C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2cccs2)cc1 515143967 WRTDTXMWZLNSFB-FQEVSTJZSA-N 457.939 5.277 5 20 JKBD Cc1cc(COc2ccc(C(=O)Nc3cc([N+](=O)[O-])ccc3OC(F)F)cc2Br)on1 520012112 ABYDRKPIQSRBMC-UHFFFAOYSA-N 498.236 5.086 5 20 JKBD Cc1occc1-c1cc(NCc2ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])cc2)n(CCO)n1 520219539 BZCGWLUJPKPGHW-UHFFFAOYSA-N 468.897 5.410 5 20 JKBD Cn1ccnc1[C@H](NCc1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1)c1ccc(Cl)cc1 558940931 GLPFMCSNHBTNLR-AREMUKBSSA-N 498.974 5.714 5 20 JKBD Cc1c(NC(=O)[C@H](C)Sc2nnc(-c3ccc(Cl)cc3Cl)n2C(C)C)cccc1[N+](=O)[O-] 596378646 YVIQVAZKQBHEKT-ZDUSSCGKSA-N 494.404 6.169 5 20 JKBD O=C(CSc1ccccc1C(=O)Nc1cc([N+](=O)[O-])ccc1OC(F)F)Nc1ccc(F)cc1 603638737 SGSIWGJLJYJFHE-UHFFFAOYSA-N 491.447 5.318 5 20 JKBD O=C(NCc1cccs1)c1ccc(-n2ccnc2SCc2ccccc2[N+](=O)[O-])cc1 603725976 SRQFVRDGDRTGRF-UHFFFAOYSA-N 450.545 5.064 5 20 JKBD Cc1occc1C(=O)Nc1cc(NC(=O)c2cc([N+](=O)[O-])ccc2NCc2ccccc2)ccc1F 603757192 WIPYOQCZCNBFGV-UHFFFAOYSA-N 488.475 5.752 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Cl)[C@H](NCc1csc2ccccc12)c1ccccc1 604044782 BJFQRTLTTCFTQQ-JOCHJYFZSA-N 451.935 5.933 5 20 JKBD CSc1ccc([N+](=O)[O-])c(C(=O)N2CCC[C@H](c3nc(-c4ccc(Cl)cc4)no3)C2)c1 608800493 MXFTUEMDDFOFAX-AWEZNQCLSA-N 458.927 5.040 5 20 JKBD CO[C@H](C)c1cccc(N[C@@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Br)c2ccccc2)c1 608889098 IASZWNZSQPFKQC-IVZQSRNASA-N 484.350 5.857 5 20 JKBD CC[C@@H](NC(=O)C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)c1nc2ccccc2[nH]1 608950329 QMVNYEPZOODVML-XLEPWJDSSA-N 497.580 6.279 5 20 JKBD CC1CCN(c2ccc(C(=O)Nc3ccc(CC(=O)Nc4ccccc4F)cc3)cc2[N+](=O)[O-])CC1 609065322 ULYDOCVMVFAEGU-UHFFFAOYSA-N 490.535 5.404 5 20 JKBD CC1CCC(OC2CCN(C(=O)c3ccc(N4C[C@@H](C)C[C@H](C)C4)c([N+](=O)[O-])c3)CC2)CC1 609374194 IVMRAZIKWFKDNR-KBNVZVJVSA-N 457.615 5.277 5 20 JKBD C[C@H](NCc1ccc(Oc2ccc(F)cc2)c([N+](=O)[O-])c1)c1ccc(N2CCOC2=O)cc1 725847992 LZIDSUBJKIRDJR-INIZCTEOSA-N 451.454 5.334 5 20 JKBD CSc1ccc(C(=O)c2ccccc2C(=O)Nc2cccc(C(F)(F)F)n2)cc1[N+](=O)[O-] 726148847 WZXLNRKKYVLXFR-UHFFFAOYSA-N 461.421 5.214 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Cl)[C@@H](Nc1cccc(SC(F)F)c1)c1ccccc1 727465278 YQADGRUQGYKJIG-IBGZPJMESA-N 463.893 6.355 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])c(Cl)c1)C1CCN(c2ncc(C(F)(F)F)cc2Cl)CC1 727711634 LQVKTCFBGBIVIK-UHFFFAOYSA-N 463.243 5.171 5 20 JKBD O=C(OCC1CCN(c2ncccc2[N+](=O)[O-])CC1)[C@@H](Sc1ccccc1)c1ccccc1 749359229 PXCNJMBDJWTBMJ-QHCPKHFHSA-N 463.559 5.283 5 20 JKBD O=C(Nc1cc([N+](=O)[O-])ccc1F)[C@@H]1C[C@@H]2CCCC[C@H]2N1C(=O)c1ccc2ccccc2c1 751065049 QXKFENXZOQZFEA-GLYQVZKVSA-N 461.493 5.299 5 20 JKBD C[C@H](NC(=S)/C(=C(/O)c1ccc([N+](=O)[O-])cc1)[n+]1ccc(Cc2ccccc2)cc1)c1ccccc1 917614691 YBNDAIWSNNJQCT-NRFANRHFSA-O 496.612 6.035 5 20 JKBD O=C(CCc1cccc([N+](=O)[O-])c1)Nc1ccc(C2(NC(=O)[C@@H]3CCC(F)(F)C3)CCC2)cc1 1786598829 ARYAPCHBBFFSLX-GOSISDBHSA-N 471.504 5.097 5 20 JKBD O=C(CCCC(F)(F)F)Nc1ccc(C2(NC(=O)CSc3ccccc3[N+](=O)[O-])CCC2)cc1 1786620983 DYEDHFFQBHJXMS-UHFFFAOYSA-N 495.523 5.554 5 20 JKBD CC(F)(F)C(C)(C)C(=O)NC1(c2ccc(NC(=O)c3cc(F)cc([N+](=O)[O-])c3)cc2)CCC1 1790695741 NJPAPKFMNUWJLY-UHFFFAOYSA-N 463.456 5.163 5 20 JKBD CCCCCc1ncc(C(=O)Nc2ccc(C3(NC(=O)c4ccc([N+](=O)[O-])[nH]4)CCC3)cc2)s1 1791078477 UPTUYQDGHYBTHX-UHFFFAOYSA-N 481.578 5.174 5 20 JKBD O=C(/C=C/c1ccccc1[N+](=O)[O-])Nc1ccc(C2(NC(=O)[C@@H]3CCC(F)(F)C3)CCC2)cc1 1792315348 FROFPKIVIIIHKD-PMQIGOLDSA-N 469.488 5.178 5 20 JKBD Cc1cc(Cl)cc(C(=O)N2CCC3(CCCN(C(=O)CCc4cccc([N+](=O)[O-])c4)C3)CC2)c1 1806496084 VKBTVQPJNPHZJH-UHFFFAOYSA-N 483.996 5.034 5 20 JKBD CCC1(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)c3cc4cc([N+](=O)[O-])ccc4s3)[nH]n2)CCC1 1818950689 FEQVBGPOULUAAZ-SFHVURJKSA-N 481.578 5.419 5 20 JKBD CC1=CC[C@H](C(=O)N2CCC([C@@H]3CCCCN3C(=O)Cc3ccc(Cl)cc3[N+](=O)[O-])CC2)CC1 1824160293 BPCINOACDDHRFB-REWPJTCUSA-N 488.028 5.157 5 20 JKBD Cc1cscc1C(=O)N1CCCC[C@@H]1C1CCN(C(=O)Cc2ccc(Cl)cc2[N+](=O)[O-])CC1 1827801678 OLSIWTXGIXBNDF-OAQYLSRUSA-N 490.025 5.094 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)N1CCCC[C@@H]1C1CCN(C(=O)[C@H](C)c2cccs2)CC1 1830728493 DLGWHVQHJROYNH-DYESRHJHSA-N 487.597 5.141 5 20 JKBD C[C@H](CC(=O)N1CCCC[C@H]1C1CCN(C(=O)c2ccc([N+](=O)[O-])cc2F)CC1)c1ccccc1 1831507507 QMYYMTMKWJGBOO-CLOONOSVSA-N 481.568 5.161 5 20 JKBD O=C(c1ccc(C2CC2)cc1)N1CCC([C@H]2CCCCN2C(=O)Cc2cc(F)ccc2[N+](=O)[O-])CC1 1832888448 JTWSQECLBCSBHG-RUZDIDTESA-N 493.579 5.087 5 20 JKBD O=C(c1ccccc1Cl)N1CCC([C@H]2CCCCN2C(=O)/C=C/c2ccccc2[N+](=O)[O-])CC1 1832903912 IDXVRIFJGFRDJZ-MDRMPYQZSA-N 481.980 5.195 5 20 JKBD COc1cc(C(=O)N[C@H](C)c2cc(F)c(Cl)cc2Cl)c([N+](=O)[O-])cc1OC(F)F 10966181 NWGYJGBKHGUENT-SSDOTTSWSA-N 453.200 5.142 5 20 JKBD O=C(N[C@@H]1CCSc2c(F)cccc21)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 12621825 USTSJFBZTBPLCB-QGZVFWFLSA-N 483.487 5.322 5 20 JKBD O=C(COc1ccc([N+](=O)[O-])cc1Cc1ccccc1)Nc1c(Cl)cccc1C(F)(F)F 16458775 SGDJXJIEMYWERT-UHFFFAOYSA-N 464.827 5.875 5 20 JKBD C[C@@H](OC(=O)c1ccc(NCc2ccccc2Cl)c([N+](=O)[O-])c1)C(=O)Nc1c(F)cccc1F 16868760 HSGJSPRNCWTYBN-CYBMUJFWSA-N 489.862 5.323 5 20 JKBD C[C@@H](Sc1nn(-c2ccc(Cl)cc2)c(=S)s1)C(=O)Nc1ccc(F)c([N+](=O)[O-])c1 21683186 QLOFYJDCQSDEIA-SECBINFHSA-N 470.960 5.483 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Cl)[C@@H](NCc1cccc(CN2CCCC2)c1)c1ccccc1 27024443 ATPBFOBEJCDURN-VWLOTQADSA-N 478.980 5.314 5 20 JKBD C[C@@H](c1nnc(Sc2ccc(C(F)(F)F)cc2[N+](=O)[O-])n1-c1ccc(F)cc1)N(C)C 29001425 UBDABANSVDHQQS-NSHDSACASA-N 455.437 5.107 5 20 JKBD COc1cc(C(=O)NCc2ccc(Cn3ccnc3)cc2)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 30219870 HTFSJJOGCMCTJN-UHFFFAOYSA-N 492.919 5.224 5 20 JKBD COc1ccccc1-c1nnc(Sc2ccc(C(C)=O)cc2[N+](=O)[O-])n1CCc1ccccc1 105331623 QQMPWIWFMJVJBP-UHFFFAOYSA-N 474.542 5.458 5 20 JKBD CCN(c1ccc(NC(=O)c2cc(OC)c(OCc3cscn3)cc2[N+](=O)[O-])cc1)C(C)C 108906115 LPPCRXUMCCZJCS-UHFFFAOYSA-N 470.551 5.126 5 20 JKBD COc1cc(C(=O)Nc2c(F)cc(F)cc2-c2ccccc2)c([N+](=O)[O-])cc1OC(F)F 115824947 NIHPPDQWABIIKX-UHFFFAOYSA-N 450.344 5.402 5 20 JKBD O=C(Nc1ccncc1)c1cccc(NC(=O)c2ccc(NCc3ccccc3)c([N+](=O)[O-])c2)c1 116588511 KMIXMNIJLYVNRC-UHFFFAOYSA-N 467.485 5.107 5 20 JKBD CCN(CC)C(=O)C1CCN(C(=O)c2cc([N+](=O)[O-])ccc2Sc2ccc(Cl)cc2)CC1 476138408 GFVRDLJUPNQYNK-UHFFFAOYSA-N 475.998 5.120 5 20 JKBD COc1cc(C(=O)N2CC[C@@H](c3ccccc3)C2)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 476177444 ZBDMGICCCAMOEE-GOSISDBHSA-N 452.894 5.679 5 20 JKBD COc1ccc(CN[C@@H](c2ccccc2)c2cccnc2)cc1OCc1ccc([N+](=O)[O-])cc1 488615382 DLARKRKAPACFTG-MHZLTWQESA-N 455.514 5.457 5 20 JKBD O=C(c1csc(-c2cnn(-c3ccccc3)c2)n1)N(Cc1ccccc1[N+](=O)[O-])CC(F)(F)F 503300921 GTNQDCRQVICXPA-UHFFFAOYSA-N 487.463 5.109 5 20 JKBD COc1ccc(CSCC(=O)Nc2cc(C(=O)Nc3ccccc3)ccc2Cl)cc1[N+](=O)[O-] 512331312 XJBOKBKQFVRZBJ-UHFFFAOYSA-N 485.949 5.381 5 20 JKBD C[C@H]1CCC[C@@H](C)N1C(=O)c1cc(Cl)ccc1NC(=O)c1ccn(-c2cccc([N+](=O)[O-])c2)n1 512346998 MNZDAVTUNHBCRC-IYBDPMFKSA-N 481.940 5.089 5 20 JKBD CC(C)[C@H](NC(=O)c1ccc(N[C@H](C)c2ccccn2)c([N+](=O)[O-])c1)c1nc2ccccc2[nH]1 516178553 JHPYDPUNGWQYMK-MWTRTKDXSA-N 458.522 5.166 5 20 JKBD COc1ccc(-c2ccc(CN[C@@H](C)c3ccc(OC)c(Br)c3)o2)c([N+](=O)[O-])c1 520207351 STLQRICUJVUKDP-ZDUSSCGKSA-N 461.312 5.485 5 20 JKBD C[C@@H](NC(=O)NCc1ccccc1-c1ccc(CN2CCCC2)cc1)c1cccc([N+](=O)[O-])c1 604130479 KTZDOXWESPOMCW-HXUWFJFHSA-N 458.562 5.418 5 20 JKBD Cc1nc([N+](=O)[O-])cn1CCC(=O)Nc1ccc(Sc2ccc(Br)cc2)cc1 604454123 PIYRLRNYMPRXAN-UHFFFAOYSA-N 461.341 5.042 5 20 JKBD C[C@@H]1CN(Cc2ccc(CNCc3ccc(-c4ccccc4[N+](=O)[O-])s3)cc2)C[C@@H](C)O1 608835820 WOMXJJUBTXRASG-RTBURBONSA-N 451.592 5.222 5 20 JKBD NC(=O)c1ccc(CSCc2csc(-c3ccc(Br)cc3)n2)c([N+](=O)[O-])c1 609235861 IBQWGWBKFDFOTG-UHFFFAOYSA-N 464.366 5.013 5 20 JKBD C[C@@H](NCc1ccc(Oc2ccc(F)cc2)c([N+](=O)[O-])c1)C(=O)Nc1cccc(N2CCCC2)c1 725850950 HLHKDRCCUIVMML-GOSISDBHSA-N 478.524 5.243 5 20 JKBD O=C(Nc1ccccc1N1CCOC1=O)c1ccc(Sc2nc3ccccc3s2)c([N+](=O)[O-])c1 726506415 BWBLTECBIFKGEP-UHFFFAOYSA-N 492.538 5.565 5 20 JKBD Cc1cc(-c2cccc(Cl)c2)ccc1NC(=O)c1cc([N+](=O)[O-])ccc1N1CCOCC1 726765862 FLVBHCBJPWMIJQ-UHFFFAOYSA-N 451.910 5.313 5 20 JKBD C[C@@H]1CN(c2ccc(CNC(=O)CCC(=O)c3ccc4ccc5cccc6ccc3c4c56)cn2)CCO1 727766525 BHYWFMXPUUGDGE-HXUWFJFHSA-N 491.591 5.483 5 20 JKBD O=C(CSCc1cc(-c2cccs2)on1)N(CC1CC1)c1ccc(Cl)c([N+](=O)[O-])c1 728165978 TXTLUTMKLNDYST-UHFFFAOYSA-N 463.968 5.641 5 20 JKBD Cc1csc(Sc2ccc(C(=O)O[C@@H](C)C(=O)c3ccc(F)cc3F)cc2[N+](=O)[O-])n1 760256949 QECSGECTRBMGJF-NSHDSACASA-N 464.471 5.217 5 20 JKBD Cc1nc2cc(C(=O)N(Cc3nnc(-c4cccc([N+](=O)[O-])c4)o3)C(C)C)ccc2n1-c1ccccc1 864242795 RIYMHZLLFKOZSW-UHFFFAOYSA-N 496.527 5.343 5 20 JKBD O=C(Nc1ccccc1)c1nnc(/C(Cl)=C/c2ccc(-c3cccc([N+](=O)[O-])c3)s2)s1 912858810 FFSYSEHAQGYJDK-ATVHPVEESA-N 468.947 6.164 5 20 JKBD C[C@@H](Nc1ccc(N(C)Cc2ccccc2)cc1)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 917940827 OWAFZPYDIDSWQY-MRXNPFEDSA-N 472.467 5.689 5 20 JKBD O=C(OCc1nc(-c2ccc([N+](=O)[O-])cc2)no1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 918865702 FMZFMXPLMODBDH-UHFFFAOYSA-N 461.274 5.039 5 20 JKBD CC(C)(C)c1nc(COC(=O)C/C(=C/c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)no1 919012767 MMDHRARXBAPSOW-VBKFSLOCSA-N 478.530 5.559 5 20 JKBD C[C@H](Nc1ccc(C(=O)Nc2ccccc2C(=O)NCc2ccccc2)cc1[N+](=O)[O-])c1ccccn1 919699927 QDQJOTPQCQUMGP-IBGZPJMESA-N 495.539 5.345 5 20 JKBD CCOC(=O)N(C)c1ccc(NC(=O)c2ccc(N[C@H](C)c3ccccn3)c([N+](=O)[O-])c2)cc1 919769950 LLSDMCBHGDEXIJ-MRXNPFEDSA-N 463.494 5.008 5 20 JKBD CC(=O)Nc1cccc(-n2c(C3CC3)nn(CN(Cc3ccc([N+](=O)[O-])cc3)C(C)C)c2=S)c1 919950455 OALKFLZCQJMKCB-UHFFFAOYSA-N 480.594 5.015 5 20 JKBD CCc1cccc[n+]1/C(C(=S)Nc1ccc2c(c1)CCC2)=C(/O)c1ccc(C)c([N+](=O)[O-])c1 920396209 WJRVFDPNEOCWAV-UHFFFAOYSA-O 460.579 5.565 5 20 JKBD O=C(Cc1cc2ccccc2o1)O[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1 920657040 QKRMENGMBFFGJZ-HSZRJFAPSA-N 464.861 5.460 5 20 JKBD CCCc1onc(C)c1C(=O)Nc1ccc(C2(NC(=O)CCc3cccc([N+](=O)[O-])c3)CCC2)cc1 1788777265 CCLCBPNDVSKPGH-UHFFFAOYSA-N 490.560 5.224 5 20 JKBD CSc1cccc(C(=O)Nc2ccc(C3(NC(=O)/C=C/c4ccc([N+](=O)[O-])o4)CCC3)cc2)c1O 1790065791 VKGBEPLIPZRFBY-ZRDIBKRKSA-N 493.541 5.076 5 20 JKBD COc1ccc(C(=O)NC2(c3ccc(NC(=O)c4ccc(O)c([N+](=O)[O-])c4)cc3)CCC2)cc1Cl 1790620837 NKICWGOVSFTUBC-UHFFFAOYSA-N 495.919 5.024 5 20 JKBD Cc1c(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2ccccc2C(F)(F)F)C3)cc(Cl)cc1[N+](=O)[O-] 1800711750 TVBUAPOKZATAOS-MUJYYYPQSA-N 495.885 5.141 5 20 JKBD O=C(Nc1cc([C@H]2CCCCN2C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)[nH]n1)C1CCCC1 1816680380 BODRNPJLDHQNGJ-GOSISDBHSA-N 467.551 5.029 5 20 JKBD Cc1cscc1C(=O)Nc1cc([C@H]2CCCCN2C(=O)C2(c3cccc([N+](=O)[O-])c3)CCC2)[nH]n1 1818241270 RUZPMZBBJGQSPM-OAQYLSRUSA-N 493.589 5.116 5 20 JKBD CC1(C)CCC(CC(=O)N2CCCC[C@H]2c2cc(NC(=O)Cc3ccc([N+](=O)[O-])cc3F)n[nH]2)CC1 1821843651 CZYBFIQUEMCOAR-QFIPXVFZSA-N 499.587 5.298 5 20 JKBD Cc1ccc([C@@H](C)C(=O)N2CCCC[C@H]2C2CCN(C(=O)c3ccc([N+](=O)[O-])cc3F)CC2)cc1 1831530268 PRMRJMVMSWSWTL-CLOONOSVSA-N 481.568 5.079 5 20 JKBD Cc1ccc(C)c(NC(=O)[C@H](OC(=O)CSc2ccc([N+](=O)[O-])cc2)c2ccccc2)c1 9352077 NOQGFXBNPDRMMZ-HSZRJFAPSA-N 450.516 5.227 5 20 JKBD O=C(Nc1ccccc1C(=O)OCc1cccc2cccnc12)c1ccc([N+](=O)[O-])cc1Cl 11390408 UOKBNISHTMCAPG-UHFFFAOYSA-N 461.861 5.406 5 20 JKBD COc1ccc2cc(CNc3cc([N+](=O)[O-])c(OC)c(Br)c3[N+](=O)[O-])ccc2c1 14307245 HUHLKZPBYGYVQV-UHFFFAOYSA-N 462.256 5.048 5 20 JKBD O=C(Cn1c2ccccc2c(=O)c2ccccc21)Nc1nc(-c2cc(Cl)sc2Cl)cs1 14729763 DOJONRNCJAHKKM-UHFFFAOYSA-N 486.405 6.285 5 20 JKBD O=C(Nc1cc2c(cc1Br)OCCO2)c1cc([N+](=O)[O-])ccc1Sc1ccccc1 16008699 OQVDQGGVVNWOAQ-UHFFFAOYSA-N 487.331 5.532 5 20 JKBD CC[C@H](C)c1ccccc1NC(=O)[C@@H](C)OC(=O)c1ccc(Cn2nc(C)c([N+](=O)[O-])c2C)cc1 26160848 ASUXKWUCCMTFIN-QFBILLFUSA-N 478.549 5.154 5 20 JKBD C[C@@H]1c2cccn2CCN1C(=O)C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1 30260902 SHDAZOYFAPRCRF-JFPYRBRCSA-N 458.543 5.540 5 20 JKBD O=C(Cn1c2ccccc2c(=O)c2ccccc21)N1CCCc2cc(OC(F)(F)F)ccc21 71895115 MHWKVFFZZARCNY-UHFFFAOYSA-N 452.432 5.033 5 20 JKBD C[C@H](OC(=O)/C(=C\c1ccc(F)cc1)c1cccs1)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 96887693 GPCCBBMZMYXYAT-QIQQCEGHSA-N 465.462 5.690 5 20 JKBD Cc1csc(Sc2ccc(NC(=O)c3ccc(N4CCCC4)c([N+](=O)[O-])c3)c(C)c2)n1 110136946 DNVOHOFGCUCUJZ-UHFFFAOYSA-N 454.577 5.672 5 20 JKBD Cc1cc(Sc2nnc(NCc3ccc(F)cc3)s2)nc(-c2ccc([N+](=O)[O-])cc2)n1 489204901 KKTOBJCNAUHCPD-UHFFFAOYSA-N 454.512 5.114 5 20 JKBD C[C@@H](c1ccccc1)N(C)C(=O)C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1 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O=C(c1cc2cc([N+](=O)[O-])ccc2o1)C(c1nc2ccccc2s1)c1nc2ccccc2s1 513695697 KIMGFDTYXDNFQB-UHFFFAOYSA-N 471.519 6.575 5 20 JKBD COC1CCN(C(=O)c2c3c(nc4ccccc24)/C(=C/c2cccc([N+](=O)[O-])c2)CCC3)CC1 514491797 MQOCLHQCXXSDFD-KNTRCKAVSA-N 457.530 5.271 5 20 JKBD C[C@H](Sc1nc2cc3ccccc3cc2c(=O)n1C)C(=O)N(C)Cc1c(F)cccc1Cl 514960984 FEMLDPWCQJSYLZ-AWEZNQCLSA-N 469.969 5.018 5 20 JKBD CSc1ccc([N+](=O)[O-])c(C(=O)Nc2ncc(Cc3ccc(C(F)(F)F)cc3)s2)c1 515181191 DJFJPOYPBOOAOL-UHFFFAOYSA-N 453.467 5.635 5 20 JKBD C[C@H](NC(=O)c1ccc(N[C@@H](C)c2ccccn2)c([N+](=O)[O-])c1)c1ccc(OCC(F)(F)F)cc1 516322279 DHHVWSMDPTWFQC-HOTGVXAUSA-N 488.466 5.595 5 20 JKBD O=C(NCCn1cnc2ccccc21)c1ccccc1Sc1ccc(C(F)(F)F)cc1[N+](=O)[O-] 519902923 CDTRICVJZQOFCS-UHFFFAOYSA-N 486.475 5.545 5 20 JKBD O=C(Nc1nc(-c2ccc(OC(F)F)cc2OC(F)F)cs1)c1csc([N+](=O)[O-])c1 520319820 RKDIPJMSHKFXSY-UHFFFAOYSA-N 463.390 5.235 5 20 JKBD Cc1ccccc1CN(Cc1cccnc1)C(=O)c1ccc(N[C@H](C)c2ccccn2)c([N+](=O)[O-])c1 521532870 ALOJWIOCPDMHRN-OAQYLSRUSA-N 481.556 5.709 5 20 JKBD O=C(C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)NCc1cc2ccccc2[nH]1 562210428 CEKISYHHDJOABC-UYRXBGFRSA-N 468.538 5.933 5 20 JKBD COC(=O)c1ccccc1N(C)C(=O)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])c(OC)c1 590574723 AHMQOKKHXQWQAZ-UHFFFAOYSA-N 470.865 5.112 5 20 JKBD O=C(Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1)c1ccc(Cl)c(NC(=O)c2cccs2)c1 601905262 WKRXZVGLZDWKRE-UHFFFAOYSA-N 484.946 5.938 5 20 JKBD CCOc1cc(C(=O)Nc2cc(C(C)(C)C)nn2-c2cccc(C)c2)c([N+](=O)[O-])cc1OC 603601372 WNZXVRBEBGVDMQ-UHFFFAOYSA-N 452.511 5.046 5 20 JKBD COc1cc2c(cc1OC)[C@@H](c1cccs1)N(C(=O)Nc1ccc(C)c([N+](=O)[O-])c1)CC2 603643416 HRCFYDZYIBJULU-QFIPXVFZSA-N 453.520 5.162 5 20 JKBD CCOC(=O)C[C@@H](c1ccccc1)C1CCN(C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)CC1 603927866 KCDRMWJNXQMTTQ-NRFANRHFSA-N 466.559 5.399 5 20 JKBD COc1ccc(Oc2ccc([N+](=O)[O-])cc2C(=O)N(C)C[C@@H]2CCCO[C@H]2c2ccccc2)cc1 604519595 HBNRRPXZYMYFHV-FNZWTVRRSA-N 476.529 5.636 5 20 JKBD Cc1nc([N+](=O)[O-])cn1CCC(=O)Nc1ccccc1OCc1ncc(-c2cccc(Cl)c2)o1 608849873 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O=[N+]([O-])c1cc(Br)ccc1-c1nc(-c2ccc(OCc3cccnc3)cc2)no1 904465818 IWCLDQAKGLGDQI-UHFFFAOYSA-N 453.252 5.048 5 20 JKBD COc1cc(-c2nc([C@H]3CCCN3C(=O)OC(C)(C)C)no2)c([N+](=O)[O-])cc1OCc1ccccc1 904706459 POJGMNYHTGIBMW-GOSISDBHSA-N 496.520 5.304 5 20 JKBD CC(C)(C)c1cc[n+](/C(C(=S)N[C@H]2C[C@H]3CC[C@H]2C3)=C(/O)c2ccc([N+](=O)[O-])cc2)cc1 912845944 YAWWLTFNEIEYSZ-MDKPJZGXSA-O 452.600 5.169 5 20 JKBD Cc1ccc([N+](=O)[O-])c(OCCC(=O)OCC(=O)Nc2c(Cl)c(Cl)cc(Cl)c2Cl)c1 915443015 SSNIGKOUGREEJF-UHFFFAOYSA-N 496.130 5.468 5 20 JKBD O=[N+]([O-])c1cccc(-c2nccc(/C=C/c3csc(-c4ccc(C(F)(F)F)cc4)n3)[n+]2[O-])c1 918712313 JENMCXPNYRFKKR-CMDGGOBGSA-N 470.432 5.603 5 20 JKBD O=C(Cc1ccc(Cl)cc1[N+](=O)[O-])NC1(c2ccc(NC(=O)[C@H]3CCC(F)(F)C3)cc2)CCC1 1785799576 FRORTHSPTZOVIN-INIZCTEOSA-N 491.922 5.360 5 20 JKBD Cc1c[nH]c(C)c1CCC(=O)Nc1ccc(C2(NC(=O)c3cc(F)cc([N+](=O)[O-])c3)CCC2)cc1 1786205926 ZLLAUFFOFSFSPV-UHFFFAOYSA-N 478.524 5.059 5 20 JKBD Cc1c[nH]cc1C(=O)Nc1ccc(C2(NC(=O)c3ccc(Br)c([N+](=O)[O-])c3)CCC2)cc1 1788732485 IYZBAHUYIODYIP-UHFFFAOYSA-N 497.349 5.055 5 20 JKBD C[C@@H](CC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc2cc([N+](=O)[O-])ccc2s1)c1ccccc1 1801206649 BLBCWBSQLJLMCU-DVWBAYGPSA-N 477.586 5.255 5 20 JKBD CC(C)(C)CCCCCC(=O)NC[C@H]1CCN(C(=O)c2ccc(O)c([N+](=O)[O-])c2)[C@H]1c1cccnc1 1812809411 QINYRTZIPZVWAP-BWKNWUBXSA-N 496.608 5.012 5 20 JKBD Cc1c(C(=O)N2CCC([C@@H]3CCCCN3C(=O)c3ccc([N+](=O)[O-])o3)CC2)[nH]c2c(Cl)cccc12 1823612239 PJJKLXCTAUSSLC-IBGZPJMESA-N 498.967 5.178 5 20 JKBD Cc1c(C(=O)N2CCC([C@@H]3CCCCN3C(=O)[C@H]3CC=CCC3)CC2)cc(Cl)cc1[N+](=O)[O-] 1830281003 WQNVNSQYRIZJDU-UGKGYDQZSA-N 474.001 5.146 5 20 JKBD Cc1ccc(C)c(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)CSc3ccccc3[N+](=O)[O-])CC2)c1 1832568065 JEPKQDUVQSGDHD-HSZRJFAPSA-N 495.645 5.237 5 20 JKBD O=C(c1cc2cc([N+](=O)[O-])ccc2s1)N1CCC([C@H]2CCCCN2C(=O)CC2CCC2)CC1 1832835890 FRSYMAWHQHHBGP-OAQYLSRUSA-N 469.607 5.233 5 20 JKBD CC(C)[C@H](C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)c1cc2cc([N+](=O)[O-])ccc2s1)c1ccccc1 1847619551 RZGAKWPBOZWHSJ-HFMPRLQTSA-N 477.586 5.065 5 20 JKBD CC(C)CCn1c(SCc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)nc2cc(Cl)ccc2c1=O 21164676 HSWHTNLRCWCNRD-UHFFFAOYSA-N 485.953 5.347 5 20 JKBD C[C@H](Sc1nnc(-c2ccc(C(C)(C)C)cc2)o1)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl 22249697 BEWOHRVOOGRSJK-LBPRGKRZSA-N 460.943 5.715 5 20 JKBD Cc1csc(Sc2ccc([N+](=O)[O-])cc2C(=O)OCC(=O)Nc2ccc(F)cc2Cl)n1 28832347 YWLRDQGYRXFSNG-UHFFFAOYSA-N 481.914 5.099 5 20 JKBD CN(C(=O)c1cc(-c2ccccc2)nc2c1cnn2Cc1ccccc1)c1ccc([N+](=O)[O-])cc1 58530895 KUSHWLNKSZBCSH-UHFFFAOYSA-N 463.497 5.331 5 20 JKBD CCCCOc1ccccc1NC(=O)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 59827990 PAAHHXSTEDIEMZ-UHFFFAOYSA-N 465.472 5.648 5 20 JKBD C[C@H](Nc1ccc(C(=O)N(C)[C@H](c2ccccc2)C(F)(F)F)cc1[N+](=O)[O-])c1ccccn1 485353127 RHJBCNCPTMTFAR-YCRPNKLZSA-N 458.440 5.539 5 20 JKBD COc1cc(C(=O)Nc2c(C)cccc2OC(F)F)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 486629646 QDHKLRVYTNDYIR-UHFFFAOYSA-N 478.835 6.211 5 20 JKBD C[C@@H](Nc1ccc(C(=O)Nc2ccc(Oc3ccccc3)cn2)cc1[N+](=O)[O-])c1ccccn1 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O=C(c1cc([N+](=O)[O-])ccc1Sc1ccc(Cl)cc1)N1CCC(C(=O)N2CCCCC2)CC1 603451458 YCVGAEFOFJHQPS-UHFFFAOYSA-N 488.009 5.264 5 20 JKBD CCCOc1cc(NC(=O)N2CCC[C@@H](c3nc4ccccc4o3)C2)c([N+](=O)[O-])cc1OCCC 603652497 FLYGFIVJWUKSTD-QGZVFWFLSA-N 482.537 5.725 5 20 JKBD CCCC(=O)Nc1cccc(CNCc2ccc(-c3ccc([N+](=O)[O-])cc3Br)o2)c1 608836017 HBFUQVFMOPMOLC-UHFFFAOYSA-N 472.339 5.646 5 20 JKBD CCOc1cc([N+](=O)[O-])c(C(=O)N[C@H]2CCCc3nc(-c4ccc(F)cc4)sc32)cc1OC 609186788 QIIBAZOCYICQSH-INIZCTEOSA-N 471.510 5.072 5 20 JKBD CC1CCC(OC2CCN(C(=O)c3ccc(N[C@H](C)c4ccccn4)c([N+](=O)[O-])c3)CC2)CC1 609374412 WJCQSXFWUDCKDP-OBXNSHGQSA-N 466.582 5.363 5 20 JKBD C[C@H](Nc1ccc(C(=O)Nc2ccnn2Cc2ccc(Cl)c(F)c2)cc1[N+](=O)[O-])c1ccccn1 609428105 KZEKMMPPJHEUOE-HNNXBMFYSA-N 494.914 5.453 5 20 JKBD Cc1cc(O[C@H](C)c2ccccc2)ccc1NC(=O)[C@H]1CC(=O)N(c2ccc(F)c([N+](=O)[O-])c2)C1 728010800 JQJMJZRPKMALHL-MJGOQNOKSA-N 477.492 5.174 5 20 JKBD O=C(Nc1ccc(F)cc1-c1ccc(F)cc1)c1cc([N+](=O)[O-])ccc1I 728483686 KPSLFUMPGUZDAE-UHFFFAOYSA-N 480.208 5.397 5 20 JKBD Cn1cnnc1Sc1ccc(-c2nc(-c3ccc(-c4ccccc4)cc3)no2)cc1[N+](=O)[O-] 904550804 AUBGBKDJKFVTNW-UHFFFAOYSA-N 456.487 5.259 5 20 JKBD CC(C)(C)OC(=O)NC1(c2noc(-c3ccc(Oc4ccc(Cl)cc4[N+](=O)[O-])cc3)n2)CC1 904996305 ILCKECFXJWXLJD-UHFFFAOYSA-N 472.885 5.604 5 20 JKBD Cc1c(COC(=O)Cc2csc(-c3cc(Br)cs3)n2)cccc1[N+](=O)[O-] 917975375 FHZJFJLSLRTYRY-UHFFFAOYSA-N 453.339 5.137 5 20 JKBD C[C@@H](SCC(=O)Nc1ccc(F)cc1)C(=O)Oc1ccc(-c2ccccc2)cc1[N+](=O)[O-] 920331155 VVNFFKBHGZCUNJ-OAHLLOKOSA-N 454.479 5.067 5 20 JKBD Cc1cc(C)c(NC(=O)[C@@H](C)OC(=O)c2ccc(N[C@@H](C)c3ccccn3)c([N+](=O)[O-])c2)c(Cl)c1 920548190 QLFPPNXRYSBIQE-DLBZAZTESA-N 496.951 5.617 5 20 JKBD Cc1nc(-c2ccc(NC(=O)C3CCN(c4ccc(C(F)(F)F)cc4[N+](=O)[O-])CC3)cc2)co1 933358749 GYSMCRAFOFEZIR-UHFFFAOYSA-N 474.439 5.432 5 20 JKBD O=C(Cc1cccc([N+](=O)[O-])c1)Nc1ccc(C2(NC(=O)c3c(Cl)cncc3Cl)CCC2)cc1 1785791797 JNKUCYIPBYAUTB-UHFFFAOYSA-N 499.354 5.287 5 20 JKBD CCSc1ncccc1C(=O)NC1(c2ccc(NC(=O)/C=C/c3ccc([N+](=O)[O-])o3)cc2)CCC1 1786206642 XYZHMFRZPIDXPR-ZRDIBKRKSA-N 492.557 5.156 5 20 JKBD CC(C)(C)c1cc(C(=O)Nc2ccc(C3(NC(=O)/C=C/c4ccc([N+](=O)[O-])o4)CCC3)cc2)c[nH]1 1787039079 AYINGSSUBXFWDV-PKNBQFBNSA-N 476.533 5.275 5 20 JKBD Cc1c(C(=O)NC2(c3ccc(NC(=O)c4nccs4)cc3)CCC2)cc(Cl)cc1[N+](=O)[O-] 1787516942 GRPHHTOKUBNVGJ-UHFFFAOYSA-N 470.938 5.075 5 20 JKBD O=C(CSc1ccccc1[N+](=O)[O-])Nc1ccc(C2(NC(=O)CCC(F)(F)F)CCC2)cc1 1791522187 JBZXVSDHCDVBEZ-UHFFFAOYSA-N 481.496 5.164 5 20 JKBD O=C(NC1(c2ccc(NC(=O)[C@@]3(F)CCCC=C3F)cc2)CCC1)c1cc([N+](=O)[O-])cc2c1OCC2 1792379900 NLAQIGCBQBNMOH-AREMUKBSSA-N 497.498 5.023 5 20 JKBD O=C(Nc1cc([C@@H]2CCCCN2C(=O)CC2CCCC2)[nH]n1)c1cc2cc([N+](=O)[O-])ccc2s1 1821610003 RSOIPCGBXBBIDK-IBGZPJMESA-N 481.578 5.419 5 20 JKBD O=C(CCC1CCC1)N1CCC([C@@H]2CCCCN2C(=O)C2(c3cccc([N+](=O)[O-])c3)CCC2)CC1 1830291488 OFAFJXJSQZLNMG-VWLOTQADSA-N 481.637 5.217 5 20 JKBD C[C@@H](Sc1nnc(-c2ccccc2F)n1Cc1ccccc1)C(=O)Nc1ccc(F)c([N+](=O)[O-])c1 9331047 BXTWQXJXFNYSQX-OAHLLOKOSA-N 495.511 5.299 5 20 JKBD COc1cc(C(=O)NCc2ccc(N3CCCC3=O)cc2)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 10454214 AZAOCQJRNZYFQF-UHFFFAOYSA-N 495.919 5.106 5 20 JKBD O=C(O[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Br)c1ccccc1)c1c(F)cccc1F 11125009 ZGCBAZJEVNYTAX-IBGZPJMESA-N 491.244 5.172 5 20 JKBD CC(C)N(Cc1nnc(-c2ccccc2Cl)o1)C(=O)c1ccc(Br)c([N+](=O)[O-])c1 16011273 OWCUAOILQAFAHG-UHFFFAOYSA-N 479.718 5.112 5 20 JKBD Cc1nc(S[C@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2C(F)(F)F)n(C2CCCCC2)c1C 22216310 SZZIEDTUGIOLFP-CQSZACIVSA-N 470.517 6.051 5 20 JKBD Cc1ccc(C)c(OCc2nnc(SCC(=O)Nc3nc(-c4cccc([N+](=O)[O-])c4)cs3)o2)c1 23646335 XJNUAPZRILXEOF-UHFFFAOYSA-N 497.558 5.028 5 20 JKBD CCn1cnnc1-c1cccc(NC(=O)c2ccc(Sc3nc(C)cs3)c([N+](=O)[O-])c2)c1 25278564 YMVUXKOBQQOVBF-UHFFFAOYSA-N 466.548 5.042 5 20 JKBD CSc1nnc(CCCNC(=O)c2cc([N+](=O)[O-])ccc2Oc2ccccc2)n1C1CCCC1 108411682 IBMROOUGEVVRFK-UHFFFAOYSA-N 481.578 5.178 5 20 JKBD COc1cc2c(cc1NC(=O)c1ccc(N[C@H](C)c3ccccn3)c([N+](=O)[O-])c1)oc1ccccc12 108753890 RGLPMHKGCXGOPS-MRXNPFEDSA-N 482.496 6.323 5 20 JKBD C[C@@H]1CCCN(c2ccc(C(=O)Nc3ccc(Cl)cc3NC(=O)c3ccco3)cc2[N+](=O)[O-])C1 117329612 YMMFWIJYSGDVRU-OAHLLOKOSA-N 482.924 5.582 5 20 JKBD CSc1ccc(C(=O)c2ccccc2C(=O)Nc2cnn(Cc3ccccc3)c2)cc1[N+](=O)[O-] 117684971 HQXYNOLTHNHDLF-UHFFFAOYSA-N 472.526 5.045 5 20 JKBD CCOc1cc(C(=O)N(C2CC2)[C@H](C)c2cccc(C(F)(F)F)c2)c([N+](=O)[O-])cc1OC 220027055 WEQMALBNRFTCHT-CYBMUJFWSA-N 452.429 5.387 5 20 JKBD O=C(Cc1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1)N1CCC(c2ccc(O)cc2)CC1 247351962 WMGQHNSZDACIRU-UHFFFAOYSA-N 482.540 5.102 5 20 JKBD O=C(Cc1cccs1)Nc1ccccc1NC(=O)c1csc(-c2cccc([N+](=O)[O-])c2)n1 409980721 AHMCJLJBGCWBIG-UHFFFAOYSA-N 464.528 5.213 5 20 JKBD Cc1cc(NC(=O)c2ccc(N[C@H](C)c3ccccn3)c([N+](=O)[O-])c2)n(-c2ccccc2C)n1 482126247 RSSYFEQVVUPJOK-GOSISDBHSA-N 456.506 5.218 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)Nc2nnc(SCc3ccc(Cl)cc3)s2)cc1SC 482129905 GDTSWZOZCUHFOO-UHFFFAOYSA-N 482.996 5.375 5 20 JKBD CC(C)Cn1nccc1NC(=O)C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1 486425109 HXRFKDGUFSXNLM-QGOAFFKASA-N 461.547 5.626 5 20 JKBD O=C(NC1CCN(c2ccc(C(F)(F)F)cn2)CC1)c1cc([N+](=O)[O-])ccc1NCc1ccccc1 486772395 QTXAIUYEZMQFLN-UHFFFAOYSA-N 499.493 5.020 5 20 JKBD O=C(CCOc1ccccc1[N+](=O)[O-])Nc1cccc(NC(=O)c2cccc(C(F)(F)F)c2)c1 504782726 UMOLRZLXJKHUFD-UHFFFAOYSA-N 473.407 5.274 5 20 JKBD CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)N[C@H](C)c1cccc(NC(=O)Cc2ccccc2F)c1 509331096 KQSUKNFKIIMDKV-LJQANCHMSA-N 492.551 5.596 5 20 JKBD CC(=O)N1CCc2cc(C(=O)Nc3cc([N+](=O)[O-])ccc3Nc3cccc(C(F)(F)F)c3)ccc21 517300050 OBGSBWQYSUNRNF-UHFFFAOYSA-N 484.434 5.519 5 20 JKBD CN(C[C@@H]1CCCOC1)C(=O)C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1 517409405 YBIBQCIHAKJRIF-DYGKOUCMSA-N 451.548 5.020 5 20 JKBD O=C(Nc1nc2c(s1)C[C@@H](c1ccccc1)CC2)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-] 520643562 QSPCUWXEMBBMFN-AWEZNQCLSA-N 477.464 5.517 5 20 JKBD CC[C@@H](C)C(=O)Nc1cccc(CNC(=O)c2ccc(NCc3ccccc3)c([N+](=O)[O-])c2)c1 603910933 DBPUCUHRLCCZAQ-GOSISDBHSA-N 460.534 5.122 5 20 JKBD COc1cc(C(=O)N(c2ccccc2)C2CCCCC2)c([N+](=O)[O-])cc1OCc1cscn1 604469978 OXQMOTMGMHZCOK-UHFFFAOYSA-N 467.547 5.618 5 20 JKBD CCN(Cc1ccncc1)C(=O)C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1 608960706 WIMXSMLQACQSDM-HKWRFOASSA-N 458.543 5.579 5 20 JKBD CSc1nc(C)c(CCC(=O)Oc2ccc3c(-c4ccc([N+](=O)[O-])cc4)cc(=O)oc3c2)c(C)n1 743918996 RAKGPVPWKYDXQC-UHFFFAOYSA-N 491.525 5.035 5 20 JKBD CC(C)c1ccc(-c2noc(COC(=O)c3csc(-c4cccc([N+](=O)[O-])c4)n3)n2)cc1 747961612 GHDGBBANARAJJM-UHFFFAOYSA-N 450.476 5.249 5 20 JKBD C[C@@H](Nc1ccc(C(=O)OCc2cccc(NC(=O)c3ccccc3)c2)cc1[N+](=O)[O-])c1ccccn1 750428282 ZFUMNEAHMOEGDR-LJQANCHMSA-N 496.523 5.772 5 20 JKBD O=C(Nc1ccccc1C(=O)OCc1ccc2ccccc2n1)c1ccc([N+](=O)[O-])cc1Cl 750900384 LFKANISCQGWBEE-UHFFFAOYSA-N 461.861 5.406 5 20 JKBD CSc1ccc([N+](=O)[O-])c(C(=O)Nc2cc(Cl)c([N+](=O)[O-])cc2OCc2ccccc2)c1 756296663 BSCYAONNJCFYIL-UHFFFAOYSA-N 473.894 5.710 5 20 JKBD Cc1ccc(C)c(C(=O)c2ccccc2C(=O)O[C@H](C)C(=O)Nc2cc([N+](=O)[O-])ccc2Cl)c1 844151040 NURUFQKZDDIJAA-MRXNPFEDSA-N 480.904 5.280 5 20 JKBD O=C(CCCOc1ccc(F)cc1)Oc1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2Cl)cc1 871596638 XIFAWIGQFGGPSM-UHFFFAOYSA-N 472.856 5.404 5 20 JKBD O=[N+]([O-])c1cc(C(F)(F)F)c(Cl)cc1Sc1nnc(-c2cccs2)n1C[C@H]1CCCO1 912728620 YTKDXGKBMLWFKQ-SNVBAGLBSA-N 490.916 5.917 5 20 JKBD O=C(OCc1nc(-c2cccc([N+](=O)[O-])c2)no1)c1nc(Cl)c(Cl)c(Cl)c1Cl 914796728 VXCCKCKHQWKRBD-UHFFFAOYSA-N 464.048 5.010 5 20 JKBD Cc1c(C(=O)O[C@H](C(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)c2ccccc2)oc2c1C(=O)CCC2 915453447 SMBQNZRNFWAVLE-QFIPXVFZSA-N 482.876 5.205 5 20 JKBD COCCNC(=O)/C(=C\c1ccc(Oc2ccccc2Cl)c([N+](=O)[O-])c1)c1nc2ccccc2[nH]1 916155214 OKDYBRMFQUMDRA-VKAVYKQESA-N 492.919 5.220 5 20 JKBD O=C(Nc1cc([N+](=O)[O-])ccc1F)c1nc(-c2cccs2)n(-c2cccc(C(F)(F)F)c2)n1 917608669 AYFSUUCQYIWMNH-UHFFFAOYSA-N 477.399 5.314 5 20 JKBD COc1ccc(CNC(=O)c2oc3ccccc3c2CSc2nc(C)cs2)cc1[N+](=O)[O-] 917845828 CQLKRWHYNVIWPN-UHFFFAOYSA-N 469.544 5.337 5 20 JKBD C[C@H](OC(=O)c1ccc(NC(=O)Nc2ccccc2)cc1)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl 918047119 NYUXOOZJBQLCFK-AWEZNQCLSA-N 482.880 5.076 5 20 JKBD O=C(Nc1cc([N+](=O)[O-])ccc1F)c1cc(-c2ccncc2)nc2ccc(Br)cc12 919985691 SRJGTPBLJPPSFY-UHFFFAOYSA-N 467.254 5.359 5 20 JKBD O=C(Nc1ccc(OC(=O)c2cnc(-c3ccccc3F)s2)cc1)c1cccc([N+](=O)[O-])c1 920275975 VWXBRLFJGAUGDQ-UHFFFAOYSA-N 463.446 5.329 5 20 JKBD Cc1ccc(-c2nc(COC(=O)c3ccc(N[C@@H](C)c4ccccn4)c([N+](=O)[O-])c3)co2)cc1 920545119 FVQUKUVZUUAHSZ-KRWDZBQOSA-N 458.474 5.483 5 20 JKBD C[C@H](OC(=O)Cc1csc(-c2ccc(Cl)s2)n1)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl 920676964 RRESATZMVWVOAK-VIFPVBQESA-N 486.358 5.200 5 20 JKBD C[C@H]1CN(C(=O)C/C(=C/c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)Cc2ccccc21 922310753 UNGWFYMBXAWEPA-SBGXLDQMSA-N 469.566 6.281 5 20 JKBD O=C(Cc1cc([N+](=O)[O-])ccc1F)Nc1ccc(C2(NC(=O)CSC3CCCC3)CCC2)cc1 1786670103 UJXMOXJZFPNVJF-UHFFFAOYSA-N 485.581 5.086 5 20 JKBD O=C(NC1(c2ccc(NC(=O)c3cc4ccoc4s3)cc2)CCC1)c1cc(O)cc([N+](=O)[O-])c1 1788415450 CWXAIMSYMQLNMY-UHFFFAOYSA-N 477.498 5.170 5 20 JKBD O=C(NC1(c2ccc(NC(=O)C3(c4cccc([N+](=O)[O-])c4)CCC3)cc2)CCC1)C12CC(F)(C1)C2 1790477379 RKHPFUTZPXPNPX-UHFFFAOYSA-N 477.536 5.043 5 20 JKBD CC1(C)CCC(CC(=O)Nc2ccc(C3(NC(=O)c4ccc([N+](=O)[O-])o4)CCC3)cc2)CC1 1790569479 OBINIPKHPJMYMQ-UHFFFAOYSA-N 453.539 5.542 5 20 JKBD Cc1c(C(=O)Nc2ccc(C3(NC(=O)[C@@H]4[C@H]5C=CS[C@H]54)CCC3)cc2)cc(Cl)cc1[N+](=O)[O-] 1790774671 OIBRDYGNLPMZQP-DUXKGJEZSA-N 483.977 5.179 5 20 JKBD O=C(NC1(c2ccc(NC(=O)C34CC(c5ccccc5)(C3)C4)cc2)CCC1)c1ccc([N+](=O)[O-])o1 1792378176 OPXSXTWCSDURRP-UHFFFAOYSA-N 471.513 5.057 5 20 JKBD O=C(Cc1cccc([N+](=O)[O-])c1)N1CCCC2(CCN(C(=O)c3cc4cc(F)ccc4s3)CC2)C1 1804751657 DESBOUKUDTYTTD-UHFFFAOYSA-N 495.576 5.036 5 20 JKBD Cc1cccc(C(=O)N2CCC3(CCCN(C(=O)CCc4cccc([N+](=O)[O-])c4)C3)CC2)c1Cl 1806495697 IGQGIAVUAKRKCC-UHFFFAOYSA-N 483.996 5.034 5 20 JKBD O=C(NC[C@@H]1CCN(C(=O)C2CCCCC2)[C@@H]1c1cccnc1)c1cc2cc([N+](=O)[O-])ccc2s1 1812304767 SDHVHDCNBGGPRD-YADARESESA-N 492.601 5.104 5 20 JKBD CC(C)c1ccc(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)/C=C/c3ccc([N+](=O)[O-])o3)[nH]n2)cc1 1820590521 WIGHFTUOJYPULU-ACUNGTFPSA-N 477.521 5.054 5 20 JKBD Cc1cc(Cl)cc(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)c3cc(F)cc([N+](=O)[O-])c3)[nH]n2)c1 1823192353 VRSBNZMBTIMAQU-FQEVSTJZSA-N 485.903 5.039 5 20 JKBD O=C(c1cc(F)cc([N+](=O)[O-])c1)N1CCC([C@@H]2CCCCN2C(=O)c2ccc3ccoc3c2)CC1 1830911520 CXPJKOFAFMYQEY-QHCPKHFHSA-N 479.508 5.027 5 20 JKBD O=C(COC(=O)[C@H](Sc1ccccc1)c1ccccc1)Nc1cc([N+](=O)[O-])ccc1Cl 10589868 HEFOWNJQNLDUNJ-OAQYLSRUSA-N 456.907 5.264 5 20 JKBD C[C@H](Sc1nnc(-c2ccc(Br)cc2)[nH]1)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 17673521 UZSRMRSBBGBDRI-JTQLQIEISA-N 473.312 5.046 5 20 JKBD C[C@@H](OC(=O)c1cc([N+](=O)[O-])ccc1NCc1ccccc1)c1nnc(-c2cccs2)o1 17892511 IHPSEGBDZWSGFK-CQSZACIVSA-N 450.476 5.236 5 20 JKBD Cc1cc(Cl)ccc1NC(=O)CN(c1ccccc1)S(=O)(=O)c1ccc(Cl)c([N+](=O)[O-])c1 20923830 VXDWYHYSSLPXGY-UHFFFAOYSA-N 494.356 5.044 5 20 JKBD CC(=O)Nc1cccc([C@@H](C)N(Cc2ccccc2)C(=O)[C@H](C)Sc2ccc([N+](=O)[O-])cc2)c1 23193204 JUSXVABBXQVDIT-MOPGFXCFSA-N 477.586 5.824 5 20 JKBD Cc1ccc(-n2c(S[C@@H](C)C(=O)Nc3ccc(F)c([N+](=O)[O-])c3)nnc2-c2ccncc2)cc1C 24298788 UIZVIPJCXFJKPW-INIZCTEOSA-N 492.536 5.113 5 20 JKBD CC(=O)Nc1ccc2nc(NC(=O)c3ccc(Sc4nc(C)cs4)c([N+](=O)[O-])c3)sc2c1 25038661 WTMKMUXDVHAPPG-UHFFFAOYSA-N 485.572 5.331 5 20 JKBD Cc1ccccc1NC(=O)c1cc2ccccc2cc1OC[C@H](O)COc1cccc([N+](=O)[O-])c1 30533302 DETTUYDFVQMSIN-JOCHJYFZSA-N 472.497 5.127 5 20 JKBD O=C(Cn1c2ccccc2c(=O)c2ccccc21)Nc1ccnn1Cc1c(Cl)cccc1Cl 31772375 VGRAPUWEWRGLES-UHFFFAOYSA-N 477.351 5.345 5 20 JKBD COc1cc(C(=O)NC[C@H]2CCN(c3ccccc3)C2)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 106138045 MZDSZLZDBZSDRT-QGZVFWFLSA-N 481.936 5.305 5 20 JKBD COc1ccc2[nH]cc(C3CCN(C(=O)c4cc([N+](=O)[O-])ccc4N4CCCCC4)CC3)c2c1 108892209 FDJPCPBLBOHMNC-UHFFFAOYSA-N 462.550 5.095 5 20 JKBD O=C(N[C@H](c1ccccc1)c1nccs1)c1ccc(NCc2ccccc2Cl)c([N+](=O)[O-])c1 303182123 IJUXBKKLRGFGKX-JOCHJYFZSA-N 478.961 5.836 5 20 JKBD CN(Cc1cccc(C(F)(F)F)c1)C1CCN(C(=O)c2cc3cc([N+](=O)[O-])ccc3o2)CC1 490111154 HAXGFSPDRADNAR-UHFFFAOYSA-N 461.440 5.096 5 20 JKBD C[C@@H]1CCCN(c2ccc(C(=O)Nc3ccc(Sc4nncn4C)c(Cl)c3)cc2[N+](=O)[O-])C1 502091911 VYBQIDSAXZOIRH-CQSZACIVSA-N 486.985 5.017 5 20 JKBD CCOc1cc(C(=O)N[C@@H](c2ccc(F)cc2)c2ccccc2Cl)c([N+](=O)[O-])cc1OC 502407024 QCFBOOAXRMNDEE-QFIPXVFZSA-N 458.873 5.314 5 20 JKBD COc1cc(C(=O)N2CCCC[C@@H](N3CCCC3)C2)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 502878107 YHHJGEZILLAYOR-LJQANCHMSA-N 473.957 5.140 5 20 JKBD CCCN(Cc1nnc(-c2ccccc2Cl)o1)C(=O)Nc1cc([N+](=O)[O-])ccc1OC(F)F 510836849 YDVGFAOADWYPFI-UHFFFAOYSA-N 481.843 5.344 5 20 JKBD COc1cc(C(=O)Nc2nc(-c3ccc(F)cc3)cs2)c([N+](=O)[O-])cc1OCc1cscn1 512365512 ZWLOIFWEXHVOEG-UHFFFAOYSA-N 486.506 5.154 5 20 JKBD Cc1ccc(NC(=O)c2cccc(C(F)(F)F)c2)cc1NC(=O)c1n[nH]c2ccc([N+](=O)[O-])cc12 520446867 JPEYFQSGWVOKCL-UHFFFAOYSA-N 483.406 5.303 5 20 JKBD COc1cc(CCNC(=O)Nc2ccc(O[C@H](C)c3ccccc3)cc2C)c([N+](=O)[O-])cc1OC 556510845 ACBDVPJMMLVRQC-GOSISDBHSA-N 479.533 5.425 5 20 JKBD O=C(Nc1cccc(-c2n[nH]c3c2CCCC3)c1)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-] 604240601 BYPKNXRDMMGOCS-UHFFFAOYSA-N 460.412 5.057 5 20 JKBD O=C(C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)Nc1cnn(C[C@@H]2CCCO2)c1 604243794 HVBUIBKNILOQQV-QFTJCQGQSA-N 489.557 5.149 5 20 JKBD Cc1cc(NC(=O)N(Cc2ccc([N+](=O)[O-])cc2)C(C)C)n(-c2cccc(C(F)(F)F)c2)n1 604455167 FXXRUDCEYRKYGK-UHFFFAOYSA-N 461.444 5.550 5 20 JKBD CCOc1ccc([C@@H](C)NCc2cn(-c3ccccc3)nc2-c2ccc([N+](=O)[O-])cc2)cc1OC 608836473 JIVTYQJYSRCEBO-LJQANCHMSA-N 472.545 5.706 5 20 JKBD Cc1c(NC(=O)CSc2ccc(C(F)(F)F)cc2[N+](=O)[O-])cccc1OCC(F)(F)F 609022672 XPSHQMMPZPSBBA-UHFFFAOYSA-N 468.375 5.594 5 20 JKBD C[C@@H](OC(=O)c1ccc(-c2ccccc2Br)n1C)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 726021930 XCPYKMRJVUOJEN-CYBMUJFWSA-N 497.305 5.331 5 20 JKBD O=C(Nc1ccc(OCc2cccc(C(F)(F)F)c2)cc1)c1cc(F)c(F)cc1[N+](=O)[O-] 728008586 AQDXNOWJWUPRRS-UHFFFAOYSA-N 452.335 5.723 5 20 JKBD O=c1cc(-c2ccc([N+](=O)[O-])cc2)c2ccc(Oc3nc(C(F)F)nc4ccccc34)cc2o1 731205790 IULVYGPPOXXDDP-UHFFFAOYSA-N 461.380 6.041 5 20 JKBD O=C(Nc1ncc(Cc2cccc(C(F)(F)F)c2)s1)c1cc([N+](=O)[O-])ccc1Br 751077759 ZMNYKCKQWASDEO-UHFFFAOYSA-N 486.269 5.676 5 20 JKBD C[C@H](OC(=O)C1(c2cccc(C(F)(F)F)c2)CCCC1)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 792714275 AZIXKFOZJXOEIX-AWEZNQCLSA-N 475.423 5.780 5 20 JKBD COc1ccccc1[C@@H]1[C@@H](C(=O)N(C)Cc2ccccc2[N+](=O)[O-])CCC(=O)N1c1ccc(C)cc1 914728685 GZKDIJNQHVIJHY-WNCULLNHSA-N 487.556 5.055 5 20 JKBD Cc1oc(-c2cccs2)nc1C(=O)O[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1 915565283 OTIJOLJZGLHWKR-FQEVSTJZSA-N 497.916 5.810 5 20 JKBD C[C@H](OC(=O)[C@@H](C)Oc1ccc(C(C)(C)C)cc1)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 916535686 HVRCFYABSUTAFY-UONOGXRCSA-N 482.455 5.249 5 20 JKBD Cc1cnn(-c2ccc(C(=O)O[C@H](C(=O)Nc3ccc([N+](=O)[O-])cc3Cl)c3ccccc3)cc2)c1 917288027 MUJNRVUGTDROAV-QHCPKHFHSA-N 490.903 5.279 5 20 JKBD O=C(Nc1ccc(N2C(=O)CCCC2=O)cc1)c1cc([N+](=O)[O-])ccc1Sc1ccccc1 918569177 VXZWVQFMVWBBFL-UHFFFAOYSA-N 461.499 5.042 5 20 JKBD Cc1ccc(NC(=O)[C@@H](OC(=O)c2cc(C3CC3)n(C(C)(C)C)n2)c2ccccc2)c([N+](=O)[O-])c1 919375600 RXUUVPWMLUYOOZ-QHCPKHFHSA-N 476.533 5.269 5 20 JKBD CC(=O)N(c1ccc(Cl)cc1)c1nc(COC(=O)c2cc3cc([N+](=O)[O-])ccc3[nH]2)cs1 919514714 WOSHWXUHGXBKRJ-UHFFFAOYSA-N 470.894 5.228 5 20 JKBD C[C@@H](OC(=O)CCc1ccc(-c2ccccc2)[nH]1)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 919598572 YDAGTYQRQWKIAT-CQSZACIVSA-N 475.423 5.112 5 20 JKBD O=C(CSc1ccccc1[N+](=O)[O-])NC1(c2ccc(NC(=O)c3ccc(F)s3)cc2)CCC1 1786979297 VTOWSWAREIPDBF-UHFFFAOYSA-N 485.562 5.335 5 20 JKBD O=C(CCc1c[nH]c2ccccc12)Nc1ccc(C2(NC(=O)c3ccc(O)c([N+](=O)[O-])c3)CCC2)cc1 1788244542 QYNBCBCSAZCAOI-UHFFFAOYSA-N 498.539 5.162 5 20 JKBD O=C(NC1(c2ccc(NC(=O)c3cccc4ncccc34)cc2)CCC1)c1cccc(F)c1[N+](=O)[O-] 1788906532 RFPCTBDPPJKMTJ-UHFFFAOYSA-N 484.487 5.344 5 20 JKBD COc1cc(CC(=O)Nc2ccc(C3(NC(=O)c4ccc5occc5c4)CCC3)cc2)ccc1[N+](=O)[O-] 1790477796 AFDINGZPUFTUMH-UHFFFAOYSA-N 499.523 5.340 5 20 JKBD Cc1c[nH]cc1C(=O)NC1(c2ccc(NC(=O)c3cc(Br)ccc3[N+](=O)[O-])cc2)CCC1 1790663935 MXYXLWMVFXQYMN-UHFFFAOYSA-N 497.349 5.055 5 20 JKBD CCC[C@H]1CC[C@H](C(=O)N2CC[C@H](CNC(=O)c3cccc(F)c3[N+](=O)[O-])[C@H]2c2cccnc2)CC1 1811322503 FOSXPTDPAXHTJU-ISQLDUATSA-N 496.583 5.055 5 20 JKBD CC[C@H](C)[C@H](C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2ccc([N+](=O)[O-])o2)n[nH]1)c1ccccc1 1814310236 SYQGYXHVEFMRIR-QUZZAMIASA-N 479.537 5.047 5 20 JKBD O=C(Nc1cc([C@H]2CCCCN2C(=O)CCc2ccccc2Cl)[nH]n1)c1ccc([N+](=O)[O-])cc1F 1821052039 SGTAHCGTNXPGKF-OAQYLSRUSA-N 499.930 5.049 5 20 JKBD O=C(Nc1cc([C@@H]2CCCCN2C(=O)CCc2cccc([N+](=O)[O-])c2)[nH]n1)c1cc(F)ccc1Cl 1821123368 VLZSMJRDELDFES-NRFANRHFSA-N 499.930 5.049 5 20 JKBD CC[C@H](C)[C@@H](C(=O)N1CCC([C@H]2CCCCN2C(=O)c2ccc([N+](=O)[O-])o2)CC1)c1ccccc1 1823611628 MORZDZIFYGBDBD-UWUFEASWSA-N 481.593 5.251 5 20 JKBD CC1=CC[C@@H](C(=O)N2CCC([C@@H]3CCCCN3C(=O)Cc3ccc(Cl)cc3[N+](=O)[O-])CC2)CC1 1824160292 BPCINOACDDHRFB-OFNKIYASSA-N 488.028 5.157 5 20 JKBD CC[C@H](C(=O)N1CCCC[C@H]1C1CCN(C(=O)Cc2cc(F)ccc2[N+](=O)[O-])CC1)c1ccccc1 1826317019 OQYGNXCAJDHOGK-DQEYMECFSA-N 495.595 5.090 5 20 JKBD CC1(C)CC(C(=O)N2CCC([C@@H]3CCCCN3C(=O)C3(c4cccc([N+](=O)[O-])c4)CCC3)CC2)C1 1830295086 IPKGXZWHJLNIJP-DEOSSOPVSA-N 481.637 5.072 5 20 JKBD CCC[C@H]1CC[C@H](C(=O)N2CCC([C@H]3CCCCN3C(=O)c3ccc([N+](=O)[O-])c(OC)c3)CC2)CC1 1832698128 UJHIJEQBECBROP-KIFXHHALSA-N 499.652 5.443 5 20 JKBD O=C(/C=C/c1ccccc1[N+](=O)[O-])N1CC2(CCCN2C(=O)c2cccc3c2oc2ccccc23)C1 1845737014 IQUFTQBYNVWWFL-BUHFOSPRSA-N 481.508 5.025 5 20 JKBD Cc1cccc([N+](=O)[O-])c1NC(=O)COC(=O)c1cc2c(C)nn(Cc3ccccc3Cl)c2s1 11070009 RBQHKXNVSUYDAZ-UHFFFAOYSA-N 498.948 5.120 5 20 JKBD Cc1ccc(-c2cnc(CCC(=O)O[C@@H](C)C(=O)Nc3ccc([N+](=O)[O-])cc3C(F)(F)F)o2)cc1 11644858 DUSWZMFUIMMCES-AWEZNQCLSA-N 491.422 5.080 5 20 JKBD Cn1cnnc1Sc1ccc(C(=O)Nc2nc(-c3cccc4ccccc34)cs2)cc1[N+](=O)[O-] 14586471 GPVZJPXSLQYWDU-UHFFFAOYSA-N 488.554 5.404 5 20 JKBD O=C(c1ccccc1[N+](=O)[O-])N(C[C@H]1CCCO1)c1nc(-c2ccc(Cl)cc2Cl)cs1 14819615 GIIZZHFJLXUROZ-CQSZACIVSA-N 478.357 5.851 5 20 JKBD Cc1cccc(NC(=O)CN(C)C(=O)c2ccc(NCc3ccccc3Cl)c([N+](=O)[O-])c2)c1C 18040905 JBKSKWAPTXZPRS-UHFFFAOYSA-N 480.952 5.188 5 20 JKBD O=C(Cn1c2ccccc2c(=O)c2ccccc21)Nc1ccc(N2CCc3sccc3C2)cc1 60304370 RGVSPOAPDSEFLT-UHFFFAOYSA-N 465.578 5.418 5 20 JKBD O=C(Nc1cc(Br)ccc1Br)c1cc2cc([N+](=O)[O-])ccc2s1 116881174 QTPSTWOTXPQYAB-UHFFFAOYSA-N 456.115 5.587 5 20 JKBD COc1cc(C(=O)N2CCC[C@@H]2CN2CCCCC2)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 303205796 PVJONSSETCHLIL-LJQANCHMSA-N 473.957 5.140 5 20 JKBD C[C@H](NC(=O)c1cc([N+](=O)[O-])ccc1Oc1ccccc1)c1ccc(NC(=O)NC2CC2)cc1 483291476 DIWBBEPPRYVKMI-INIZCTEOSA-N 460.490 5.162 5 20 JKBD CCOc1cc(NC(=O)c2oc3ccccc3c2CSc2ncccn2)c([N+](=O)[O-])cc1OCC 499293833 UICYDZZEIZJONE-UHFFFAOYSA-N 494.529 5.473 5 20 JKBD Cc1ccccc1-c1nnc(S[C@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)n1Cc1ccco1 501314974 FAKHJRROZWYITM-MRXNPFEDSA-N 488.529 5.706 5 20 JKBD CC[C@@H](C)n1c(SCC(=O)Nc2nc(-c3cccc([N+](=O)[O-])c3)cs2)nnc1-c1ccccc1 504287209 ATIZEKHOALREHP-OAHLLOKOSA-N 494.602 5.679 5 20 JKBD C[C@H]1Cc2cc([N+](=O)[O-])ccc2N1C(=O)c1ccc(Oc2ccc(Br)cc2)nc1 504303704 IMJPBVKLBYLCCX-ZDUSSCGKSA-N 454.280 5.136 5 20 JKBD Cc1c(Cl)cc(NC(=O)c2ccc([N+](=O)[O-])cc2I)cc1Cl 508578158 NYTCNVTZHNKSDG-UHFFFAOYSA-N 451.047 5.067 5 20 JKBD CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccc(CC(=O)N2CCCc3ccccc32)cc1 509991834 JBZAQSQMMBYLJJ-UHFFFAOYSA-N 486.572 5.559 5 20 JKBD CC[C@@H](C)NC(=O)c1ccc(NC(=O)c2ccc(N[C@H](C)c3ccccn3)c([N+](=O)[O-])c2)c(C)c1 519027626 WVGXDOPTOHVQTR-QZTJIDSGSA-N 475.549 5.252 5 20 JKBD COc1ccc(-c2ccc(CNCc3ccc(Cn4cnc5ccccc54)cc3)o2)c([N+](=O)[O-])c1 520965743 YIGBWZNYXBNPJM-UHFFFAOYSA-N 468.513 5.551 5 20 JKBD Cc1ccc(NS(=O)(=O)c2ccc(NCc3ccc(NC(=O)C(C)C)cc3)c([N+](=O)[O-])c2)c(C)c1 591652618 BYZDTTHJGCPSPJ-UHFFFAOYSA-N 496.589 5.219 5 20 JKBD COc1ccccc1NC(=O)c1ccc(NC(=O)c2ccc(NCc3ccccc3)c([N+](=O)[O-])c2)cc1 598583490 JPSDGIZGZRHWGQ-UHFFFAOYSA-N 496.523 5.720 5 20 JKBD COc1cc(C(=O)Nc2ccc(N3CCCC3)cc2C)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 602093743 OVQCNTKXRQXBHB-UHFFFAOYSA-N 481.936 6.210 5 20 JKBD C[C@H](NC(=O)CSc1nnc(-c2ccc(Cl)cc2)n1Cc1ccco1)c1cccc([N+](=O)[O-])c1 603902243 WYNHVEDEIJOXPE-HNNXBMFYSA-N 497.964 5.118 5 20 JKBD Cc1ccc([N+](=O)[O-])cc1NC(=O)CNc1ccccc1NC(=O)c1ccc(C(C)(C)C)cc1 604007302 GVXQMTARBWUXGI-UHFFFAOYSA-N 460.534 5.504 5 20 JKBD CCCC(=O)Nc1cccc(N[C@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2ccccc2)c1 604044324 IBOCLFVABDOIGV-QHCPKHFHSA-N 466.925 5.779 5 20 JKBD COc1ccc(CCCN(C)C(=O)c2ccc(Sc3nc(C)cs3)c([N+](=O)[O-])c2)cc1 604199025 ZDBGPLCUBJKSJM-UHFFFAOYSA-N 457.577 5.224 5 20 JKBD O=C(c1ccc(C(=O)N2CCC[C@@H]2c2ccsc2)c([N+](=O)[O-])c1)N1CCC[C@@H]1c1ccsc1 609044538 KKTIWPUOYUFMEA-NHCUHLMSSA-N 481.599 5.672 5 20 JKBD O=C(Cn1ccc2cc([N+](=O)[O-])ccc21)N[C@@H]1CCCc2nc(-c3ccc(F)cc3)sc21 609187519 OTGVDBHEGPXDEH-GOSISDBHSA-N 450.495 5.006 5 20 JKBD CCn1c(SCC(=O)Nc2nc(-c3ccco3)cs2)nc2cc3ccccc3cc2c1=O 613972832 GILHEWKUVPQGLB-UHFFFAOYSA-N 462.556 5.017 5 20 JKBD C[C@H](NC(=O)CCC(=O)c1ccc2ccc3cccc4ccc1c2c34)c1ccc(NC(N)=O)cc1 727755582 AXUXFBBLKNRHPJ-KRWDZBQOSA-N 463.537 5.915 5 20 JKBD CC(C)N(Cc1nnc(-c2cccc([N+](=O)[O-])c2)o1)C(=O)c1ccc(SC(F)(F)F)cc1 728083928 ZBIJQWMXEQTUPG-UHFFFAOYSA-N 466.441 5.308 5 20 JKBD C[C@@H](OC(=O)c1c(Cl)cccc1[N+](=O)[O-])C(=O)N(Cc1ccccc1)Cc1ccccc1 730645432 LWEDTTSAZGGVPX-QGZVFWFLSA-N 452.894 5.023 5 20 JKBD O=C(OCc1nnc(-c2ccc([N+](=O)[O-])cc2)o1)c1cn(Cc2ccccc2)c2ccccc12 756780770 UGGATWVVCNTVNX-UHFFFAOYSA-N 454.442 5.005 5 20 JKBD CC(C)(C)c1cc[n+](/C(C(=S)NCc2cccs2)=C(/O)c2cccc([N+](=O)[O-])c2)cc1 839412946 MFECELOIIDLDFO-UHFFFAOYSA-O 454.597 5.242 5 20 JKBD CS(=O)(=O)c1cccc(Oc2ccc(NCc3c(Br)cccc3[N+](=O)[O-])cc2)c1 864006108 FPPWVMOMQGQQLH-UHFFFAOYSA-N 477.336 5.165 5 20 JKBD C[C@H](Nc1ccc(-c2nc(C3(NC(=O)OC(C)(C)C)CCCC3)no2)cc1[N+](=O)[O-])c1ccccn1 904416816 WGLIYODXCXAKER-INIZCTEOSA-N 494.552 5.507 5 20 JKBD CCCc1cc[n+](/C(C(=S)Nc2ccc(Cl)cc2)=C(/O)c2ccc(C)c([N+](=O)[O-])c2)cc1 916204141 QVWIHVCIXWQNIA-UHFFFAOYSA-O 468.986 6.120 5 20 JKBD Cc1c(COC(=O)[C@@H](C)SCc2nc(O)c3c(-c4ccccc4)csc3n2)cccc1[N+](=O)[O-] 918899121 BGHCQKJGNNDWPM-OAHLLOKOSA-N 495.582 5.646 5 20 JKBD C[C@H](OC(=O)c1cc2cccc([N+](=O)[O-])c2[nH]1)C(=O)N1c2ccccc2Sc2ccccc21 919526112 DQXYMCCKXQNDHV-AWEZNQCLSA-N 459.483 5.451 5 20 JKBD CNc1ccc(C(=O)OCc2csc(N(C(C)=O)c3ccc(C(F)(F)F)cc3)n2)cc1[N+](=O)[O-] 920495352 ZWTDPXWVKUIBQT-UHFFFAOYSA-N 494.451 5.153 5 20 JKBD O=C(/C=C/c1ccccc1[N+](=O)[O-])NC1(c2ccc(NC(=O)[C@H]3CCC(F)(F)C3)cc2)CCC1 1785803686 UILXITCFCZFJFJ-QKIXSCASSA-N 469.488 5.178 5 20 JKBD CN(C)c1ccc([N+](=O)[O-])cc1C(=O)NC1(c2ccc(NC(=O)CCc3ccsc3)cc2)CCC1 1788187314 QRPGTYDQYRHDQF-UHFFFAOYSA-N 492.601 5.103 5 20 JKBD Cc1cc(C(=O)NC2(c3ccc(NC(=O)c4ccc5ccoc5c4)cc3)CCC2)ncc1[N+](=O)[O-] 1790891486 CFJCEGHWEGMOCR-UHFFFAOYSA-N 470.485 5.106 5 20 JKBD COC1(CC(=O)Nc2ccc(C3(NC(=O)c4cc(Cl)cc([N+](=O)[O-])c4C)CCC3)cc2)CCC1 1792053093 GYLDAZQHKHBFQP-UHFFFAOYSA-N 485.968 5.264 5 20 JKBD O=C(/C=C/c1ccccc1[N+](=O)[O-])Nc1ccc(C2(NC(=O)c3cc(Cl)ccn3)CCC2)cc1 1792317501 WWBUYHIKVJCSPQ-IZZDOVSWSA-N 476.920 5.104 5 20 JKBD O=C(CCCCCCCCc1ccccc1)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc([N+](=O)[O-])o1 1792399231 MMUJKYQIMUGACZ-NUNAXRQHSA-N 481.593 5.413 5 20 JKBD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(F)cc([N+](=O)[O-])c1)c1ccc(-c2ccccc2)c(F)c1 1800524596 IRRNOESUGNFOHE-KOUNCHBCSA-N 491.494 5.106 5 20 JKBD CC[C@H](C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2ccc([N+](=O)[O-])c(OC)c2)CC1)c1ccccc1 1826316638 CQWLCABVZLZVDB-BJKOFHAPSA-N 493.604 5.031 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)N1CCCC[C@@H]1C1CCN(C(=O)[C@H]2C[C@@H]2c2ccccc2)CC1 1830728404 CAUKUVHXNKSWKA-OTNCWRBYSA-N 493.579 5.079 5 20 JKBD Cc1ccn(C)c1C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)CC1 1831060832 HGGBIUUJUNXKJJ-OAQYLSRUSA-N 494.617 5.004 5 20 JKBD O=C(OCc1cc([N+](=O)[O-])cc2c1OCOC2)c1c2c(nc3ccccc13)/C(=C/c1ccco1)CC2 8620705 DXHAOHAGCFQKSS-FOWTUZBSSA-N 484.464 5.446 5 20 JKBD C[C@H](OC(=O)Cn1c2ccccc2c(=O)c2ccccc21)C(=O)N[C@H](C)c1ccc(Cl)cc1Cl 10722924 RGMZHLQTSCSZMI-CVEARBPZSA-N 497.378 5.271 5 20 JKBD O=C(O[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Br)c1ccccc1)c1ccccc1Cl 11026564 RWKJSHRXMASQLV-IBGZPJMESA-N 489.709 5.548 5 20 JKBD CCCc1ccc(-c2nc(NC(=O)c3ccc(Sc4nncn4C)c([N+](=O)[O-])c3)sc2C)cc1 14913975 SGULETDQWHDDLS-UHFFFAOYSA-N 494.602 5.511 5 20 JKBD Cn1c(SCC(=O)c2ccc(NC(=O)c3ccccc3)cc2)nc2cc3ccccc3cc2c1=O 17595574 MWMUVVOUGHNOCX-UHFFFAOYSA-N 479.561 5.314 5 20 JKBD O=C(Cc1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1)Nc1ccc(OC(F)F)cc1 19200248 ZCIYJOSNQQXEQE-UHFFFAOYSA-N 464.428 5.230 5 20 JKBD O=C(Cc1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1)Nc1cccc(-c2ccn[nH]2)c1 24886790 DSLLZFUHVURDHD-UHFFFAOYSA-N 464.485 5.019 5 20 JKBD CN(C)C(=O)c1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2Sc2ccc(Cl)cc2)cc1 27223848 XGCKVEPVDIQAQN-UHFFFAOYSA-N 455.923 5.354 5 20 JKBD COc1ccccc1C[C@@H]1CCCN1C(=O)c1ccc(Sc2nc(C)cs2)c([N+](=O)[O-])c1 302989714 MGQZUVXURUVSJX-SFHVURJKSA-N 469.588 5.367 5 20 JKBD COc1cc(CCNC(=O)N(Cc2ccccc2)[C@H](C)c2cccs2)c([N+](=O)[O-])cc1OC 480571577 KYQNCDWVSRJCNS-QGZVFWFLSA-N 469.563 5.189 5 20 JKBD CN(C(=O)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1)[C@H](c1ccccc1)C(F)(F)F 485389476 YFQUKZONAGGABS-LJQANCHMSA-N 489.416 5.592 5 20 JKBD Cc1cccc(-c2nnc(-c3ccc(C(=O)Nc4cc(-c5cccc([N+](=O)[O-])c5)[nH]n4)cc3)o2)c1 499058860 SRJIKHILLYUKKH-UHFFFAOYSA-N 466.457 5.263 5 20 JKBD CCOc1cc([N+](=O)[O-])c(C(=O)N(C2CC2)[C@@H](C)c2cccc(C(F)(F)F)c2)cc1OC 502878253 UNOSYDQHTNIFHX-ZDUSSCGKSA-N 452.429 5.387 5 20 JKBD C[C@@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)N(C)[C@H]1CCSc2ccc(Br)cc21 504567166 ZILOENQWSBAVBM-PXAZEXFGSA-N 467.410 5.533 5 20 JKBD C[C@H](Nc1ccc(C(=O)Nc2ccc(Cc3ccncc3)cc2)cc1[N+](=O)[O-])c1ccccn1 506112311 JYRBVBRFPWEKND-SFHVURJKSA-N 453.502 5.401 5 20 JKBD C[C@H](Nc1ccc(C(=O)Nc2ccccc2CN(C)C2CCCCC2)cc1[N+](=O)[O-])c1ccccn1 506138653 TYJVVHBLDJPMSF-FQEVSTJZSA-N 487.604 6.180 5 20 JKBD C[C@H](Nc1ccc(C(=O)N(Cc2ccc([C@H]3C[C@H]3C)o2)C2CC2)cc1[N+](=O)[O-])c1ccccn1 506217654 KUVIDYOJANHQFU-WWMYMODYSA-N 460.534 5.684 5 20 JKBD CN(Cc1ccccc1)c1ccccc1NC(=O)c1ccc([N+](=O)[O-])cc1I 508582330 WLLMBOIXXIAFJS-UHFFFAOYSA-N 487.297 5.088 5 20 JKBD CN(CCCc1cc(-c2ccccc2)no1)C(=O)c1cc([N+](=O)[O-])ccc1NCc1ccccc1 509179590 AHHQQJDWPFTUIG-UHFFFAOYSA-N 470.529 5.567 5 20 JKBD O=[N+]([O-])c1cc(CNC2CCN(Cc3ccncc3)CC2)ccc1Oc1ccccc1Cl 509620566 RBJCONUYSZBOCG-UHFFFAOYSA-N 452.942 5.190 5 20 JKBD CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccc(CC(=O)N2CCc3ccccc32)cc1 509967626 DXVSSFARPRBPOB-UHFFFAOYSA-N 472.545 5.169 5 20 JKBD C[C@H](Nc1ccc(C(=O)N2CCCc3cccc(OC(F)F)c32)cc1[N+](=O)[O-])c1ccccn1 511525889 XBYSCHXMTJLJMV-HNNXBMFYSA-N 468.460 5.357 5 20 JKBD O=C(COc1ccc(-c2ccccc2)cc1[N+](=O)[O-])Nc1c(Cl)cccc1C(F)(F)F 516785971 IMDAOEKODBGNKF-UHFFFAOYSA-N 450.800 5.952 5 20 JKBD Cc1cc(C(=O)N2CCC[C@@H](C)C2)ccc1NC(=O)c1ccc(N2CCC[C@@H](C)C2)c([N+](=O)[O-])c1 519023873 MHHFIURXNKGTMY-RTBURBONSA-N 478.593 5.264 5 20 JKBD O=C(NCC(F)(F)F)c1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2Sc2ccccc2)cc1 603495120 RENRBDUQDDWPDV-UHFFFAOYSA-N 475.448 5.290 5 20 JKBD O=C(NC1C[C@@H](C(F)(F)F)C[C@H](C(F)(F)F)C1)c1ccc(NCc2ccccc2)c([N+](=O)[O-])c1 603576263 FGHFNUJJFKDZFF-HOTGVXAUSA-N 489.416 5.846 5 20 JKBD COc1ccc(Oc2ccc([N+](=O)[O-])cc2C(=O)Nc2cc(NC(=O)C(C)C)ccc2C)cc1 603744582 UFOTVBAEGUIOEU-UHFFFAOYSA-N 463.490 5.551 5 20 JKBD O=C(NC[C@@H]1CCCOC1)c1c2c(nc3ccccc13)/C(=C\c1cccc([N+](=O)[O-])c1)CCC2 604013658 CNCMJWGGLGACOB-QIYXJHPLSA-N 457.530 5.176 5 20 JKBD C[C@H](Nc1ccc(Oc2cccc(F)c2)cc1)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 604046344 AIMNVJBQOWZNJW-ZDUSSCGKSA-N 463.387 5.984 5 20 JKBD O=C(C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)NCc1ccccc1N1CCCC1 604385351 RDGBMWDDSDUWNL-XLNRJJMWSA-N 498.608 6.052 5 20 JKBD COc1cc([C@@H](C)NC(=O)[C@H](C)Oc2ccc(Cl)cc2[N+](=O)[O-])ccc1OC1CCCC1 604442619 MFSGLJKFRXGWCE-CABCVRRESA-N 462.930 5.223 5 20 JKBD CC(C)n1ncc2ccc(NC(=O)c3ccccc3NC(=O)c3ccc([N+](=O)[O-])cc3Cl)cc21 725718288 IBSFIWUGHZMYRF-UHFFFAOYSA-N 477.908 5.683 5 20 JKBD O=C(Nc1cc(-c2cccc([N+](=O)[O-])c2)[nH]n1)c1[nH]c2ccc(Br)cc2c1Cl 726194783 YFSWDAPHEWMTPH-UHFFFAOYSA-N 460.675 5.134 5 20 JKBD Cc1cccc([N+](=O)[O-])c1NC(=O)COC(=O)c1ccccc1C(=O)c1ccc(Cl)c(Cl)c1 729727192 NFPJHWZVCSFWAY-UHFFFAOYSA-N 487.295 5.237 5 20 JKBD CC(C)[C@H](OC(=O)c1csc(-c2ccc([N+](=O)[O-])cc2)n1)C(=O)Nc1ccccc1Cl 747954791 LDBAVQBJFCLJKZ-SFHVURJKSA-N 459.911 5.192 5 20 JKBD C[C@@H](OC(=O)c1csc(-c2cccc([N+](=O)[O-])c2)n1)C(=O)Nc1ccccc1-c1ccccc1 747962038 FDLHGFHWPXWDTR-MRXNPFEDSA-N 473.510 5.569 5 20 JKBD Cc1cc(-c2cc(C(=O)O[C@@H](C)c3nnc(-c4ccc([N+](=O)[O-])cc4)o3)c3c(C)noc3n2)c(C)o1 813320332 RVPRNIQHWFDCBM-AWEZNQCLSA-N 489.444 5.284 5 20 JKBD Cc1cccc([N+](=O)[O-])c1NC(=O)COC(=O)c1cc(-c2nc3ccccc3s2)nc2ccccc12 899902033 BZNYWBCDCLRXHU-UHFFFAOYSA-N 498.520 5.524 5 20 JKBD C[C@H](Sc1ccc([N+](=O)[O-])cc1)c1nc(-c2ccc(Cn3cnc4ccccc43)cc2)no1 904471356 DRJDTSGFZICTHS-INIZCTEOSA-N 457.515 5.896 5 20 JKBD COc1ccc(NC(=O)c2c(NC(=O)c3csc([N+](=O)[O-])c3)sc3c2CCCC3)cc1 916035185 ZVXIFOILEGZHLN-UHFFFAOYSA-N 457.533 5.110 5 20 JKBD C[C@@H](OC(=O)CCCc1ccc(Cl)cc1)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 919387940 WXZQIDPMOICHBK-GFCCVEGCSA-N 458.820 5.160 5 20 JKBD C[C@H](Nc1ccc(C(=O)Nc2nc3ccc(Br)cc3s2)cc1[N+](=O)[O-])c1ccccn1 919678751 HZLLGLYVGHZBAF-LBPRGKRZSA-N 498.362 5.787 5 20 JKBD O=C(Cc1ccc(Cl)cc1[N+](=O)[O-])Nc1ccc(C2(NC(=O)c3ccc(Cl)nc3)CCC2)cc1 1786115135 XDJMXAHYHDHARS-UHFFFAOYSA-N 499.354 5.287 5 20 JKBD O=C(NC1(c2ccc(NC(=O)c3cnc(-c4ccccc4)s3)cc2)CCC1)c1ccc([N+](=O)[O-])o1 1789881268 ZDVXUSQGCJSUKE-UHFFFAOYSA-N 488.525 5.373 5 20 JKBD Cc1ccc(C(=O)Nc2ccc(C3(NC(=O)CSc4ccccc4[N+](=O)[O-])CCC3)cc2)c(C)n1 1789967728 FLWIZJVJHKNWPI-UHFFFAOYSA-N 490.585 5.147 5 20 JKBD COc1ccc(CC(=O)Nc2ccc(C3(NC(=O)[C@@H](C)c4cccs4)CCC3)cc2)c([N+](=O)[O-])c1 1790574107 SHWGOAGXVRORGK-KRWDZBQOSA-N 493.585 5.145 5 20 JKBD Cc1nc(C)c(C(=O)NC2(c3ccc(NC(=O)c4cc(Cl)cc([N+](=O)[O-])c4C)cc3)CCC2)o1 1790773616 DYEMUSLIYFDVDN-UHFFFAOYSA-N 482.924 5.223 5 20 JKBD Cc1ccc(CC(=O)NC2(c3ccc(NC(=O)c4cc5cc([N+](=O)[O-])ccc5s4)cc3)CCC2)o1 1791009877 BQCVVIXCFXURHD-UHFFFAOYSA-N 489.553 5.701 5 20 JKBD COc1ccc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)cc1Cl 1801208825 QJDXHRDDYAXLHO-BJWYYQGGSA-N 499.976 5.037 5 20 JKBD O=C(CSc1ccccc1[N+](=O)[O-])Nc1cc([C@H]2CCCCN2C(=O)/C=C/C2CCCCC2)[nH]n1 1822313232 LAWDMZNIKFVSJD-FBRRREGBSA-N 497.621 5.239 5 20 JKBD CC1(C)CCC(CC(=O)N2CCCC[C@H]2C2CCN(C(=O)c3cccc(F)c3[N+](=O)[O-])CC2)CC1 1830423081 FQBLPFWVVIDIJU-QHCPKHFHSA-N 487.616 5.574 5 20 JKBD Cc1cc(F)c(C(=O)N2CCCC[C@H]2C2CCN(C(=O)/C=C/c3ccccc3[N+](=O)[O-])CC2)cc1F 1832623251 GUIFITZEHULIKL-GTCGAKFVSA-N 497.542 5.128 5 20 JKBD O=C(Nc1ccc(OC(=O)[C@H]2Cc3cc(Cl)ccc3O2)cc1)c1cc([N+](=O)[O-])ccc1Cl 15516113 PHULAPOYAMDLIK-HXUWFJFHSA-N 473.268 5.063 5 20 JKBD CC(C)c1ccccc1NC(=O)[C@@H](C)OC(=O)c1ccccc1C(=O)c1ccc(Cl)c([N+](=O)[O-])c1 15710235 RXFGSOYDTAIUBP-MRXNPFEDSA-N 494.931 5.787 5 20 JKBD Cc1ccc(N[C@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Br)c2ccccc2)cc1C 21818505 GKZPTXRWABFFFO-NRFANRHFSA-N 454.324 5.766 5 20 JKBD O=C(Nc1ccc(Cl)c([N+](=O)[O-])c1)[C@H](Sc1nnc(NC2CC2)s1)c1ccccc1 22173044 IXQWACLAFVPGOZ-MRXNPFEDSA-N 461.956 5.146 5 20 JKBD COc1cccc(NC(=O)[C@@H](Sc2nc3cc4ccccc4cc3c(=O)n2C)c2ccccc2)c1 22253152 AAEZTJLHNQNSBE-VWLOTQADSA-N 481.577 5.567 5 20 JKBD Cc1cccc([N+](=O)[O-])c1NC(=O)CSc1nnc(-c2ccc(Cl)cc2)n1Cc1ccco1 23600646 HMVOKRNSLRVWSJ-UHFFFAOYSA-N 483.937 5.187 5 20 JKBD Cc1ccc(NC(=O)c2cnn(-c3cccc(C(F)(F)F)c3)c2C(F)(F)F)cc1[N+](=O)[O-] 24371664 VFLCSBRAQZZILC-UHFFFAOYSA-N 458.318 5.379 5 20 JKBD Cc1ccc(Sc2ccc(C(=O)N3CCC([C@H](O)c4ccccc4)CC3)cc2[N+](=O)[O-])cc1 29193559 YUZKYWWPIYDKFF-RUZDIDTESA-N 462.571 5.640 5 20 JKBD Cc1ccc(-n2c(SCC(=O)Nc3ccc([N+](=O)[O-])cc3Cl)nnc2-c2ccncc2)cc1C 36850078 JLURVSQHZZMFPJ-UHFFFAOYSA-N 494.964 5.239 5 20 JKBD C[C@H](Nc1ccc(C(=O)Nc2cccc(-c3nc4ccccc4[nH]3)c2)cc1[N+](=O)[O-])c1ccccn1 72016717 ABJMFBRLTDAJCW-KRWDZBQOSA-N 478.512 5.959 5 20 JKBD O=[N+]([O-])c1cc(C(F)(F)F)c(Cl)cc1Sc1nnc(Cc2cccs2)n1C1CC1 105324335 RCPXFNYKDVTHTF-UHFFFAOYSA-N 460.890 5.997 5 20 JKBD C[C@@H](Nc1ccc(C(=O)Nc2ccc3c(c2)OC2(CCCCC2)O3)cc1[N+](=O)[O-])c1ccccn1 108785377 SUCARCGEDDXJAV-QGZVFWFLSA-N 474.517 5.847 5 20 JKBD O=C(COc1ccc([N+](=O)[O-])cc1C(F)(F)F)N[C@@H](c1ccc(F)cc1)c1cccs1 109002228 GXIOYYITTBZDBU-IBGZPJMESA-N 454.401 5.099 5 20 JKBD O=C(N[C@H](c1ccccc1)c1ccc2c(c1)CCCO2)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-] 410037287 GSAWJODIPPMHMW-HSZRJFAPSA-N 486.446 5.380 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)Nc2ccc(Sc3nc(C)cs3)cc2C)cc1SC 483553105 IGNNDGNPWAQRNV-UHFFFAOYSA-N 461.590 5.802 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)Nc2ccc(O[C@@H](C)c3ccccc3)cc2C)cc1SC 484417745 WYONZAZNEARXFV-INIZCTEOSA-N 452.532 6.026 5 20 JKBD CCOc1cc(NC(=O)NCc2ccc(Oc3ccc(F)cc3)nc2)c([N+](=O)[O-])cc1OCC 500121493 FKWDJWIYNUILSW-UHFFFAOYSA-N 470.457 5.040 5 20 JKBD CC[C@H](C)C(=O)Nc1cccc(CNC(=O)c2ccc(N[C@H](C)c3ccccn3)c([N+](=O)[O-])c2)c1 507367885 MTGXFXPBQYPMAV-ZWKOTPCHSA-N 475.549 5.078 5 20 JKBD CC(C)Oc1ccc([N+](=O)[O-])cc1CSc1nnc(-c2cccnc2)n1Cc1ccccc1 511057076 GVQHXQGORZSTCE-UHFFFAOYSA-N 461.547 5.376 5 20 JKBD CC(C)Oc1ccc([N+](=O)[O-])cc1CN1C(=O)[C@@H](c2cccs2)N(Cc2ccccc2)C1=O 511082986 WGOXZXXAORCXQC-JOCHJYFZSA-N 465.531 5.149 5 20 JKBD COc1cc(C(=O)Nc2nc(C)c(-c3nc4ccccc4n3C(F)F)s2)ccc1[N+](=O)[O-] 521310440 IKVSEWJTONTNEA-UHFFFAOYSA-N 459.434 5.032 5 20 JKBD CC[C@@H](C)NC(=O)c1cccc(CNCc2ccc(-c3ccc([N+](=O)[O-])cc3Br)o2)c1 521818480 SCGQKYITDNZADW-OAHLLOKOSA-N 486.366 5.435 5 20 JKBD C[C@@H]1CCCN(c2ccc(C(=O)Nc3ccccc3NC(=O)c3cccs3)cc2[N+](=O)[O-])C1 522557444 NWVANCHKBJAPIY-MRXNPFEDSA-N 464.547 5.397 5 20 JKBD Cc1csc(Sc2ccc(C(=O)Nc3cc(-c4ccncc4)ccc3C)cc2[N+](=O)[O-])n1 523861047 SIYZRGWKYZZCAR-UHFFFAOYSA-N 462.556 6.134 5 20 JKBD C[C@H]1C[C@@H](C)CN(c2ccc(C(=O)Nc3ccc(NC(=O)c4ccco4)cc3)cc2[N+](=O)[O-])C1 591338654 WZYKLYBVNCEDKC-CALCHBBNSA-N 462.506 5.175 5 20 JKBD C[C@@H](NC(=O)c1cccnc1Oc1ccc(F)cc1Br)c1cccc([N+](=O)[O-])c1 603966975 SIWCGVDSMHSDAC-GFCCVEGCSA-N 460.259 5.175 5 20 JKBD CC1CCN(c2ccc(C(=O)N(C)C[C@@H]3CCCO[C@H]3c3ccccc3)cc2[N+](=O)[O-])CC1 604519160 PJHUSSMDFKMUMM-DHLKQENFSA-N 451.567 5.071 5 20 JKBD C[C@@H](Nc1ccc(C(=O)Nc2ccnc(Sc3ccccn3)c2)cc1[N+](=O)[O-])c1ccccn1 608807095 PNNXEXWOCORMPP-MRXNPFEDSA-N 472.530 5.356 5 20 JKBD C[C@@H](C[C@@H]1CCCO1)NC(=O)c1ccccc1Sc1ccc(C(F)(F)F)cc1[N+](=O)[O-] 608820653 ZFWPVQQHRLHVRG-ZFWWWQNUSA-N 454.470 5.452 5 20 JKBD CSc1ccc([N+](=O)[O-])c(C(=O)NC2CCN(Cc3ccc(Cl)c(Cl)c3)CC2)c1 609430111 PEMWJVLUPBXVTQ-UHFFFAOYSA-N 454.379 5.018 5 20 JKBD CCc1cc[n+](/C(C(=S)NC23CC4CC(CC(C4)C2)C3)=C(/O)c2cccc([N+](=O)[O-])c2)cc1 725761469 HWFIQJIEBFDDLT-UHFFFAOYSA-O 464.611 5.214 5 20 JKBD Cc1nn(CCC(=O)O[C@H](C)c2nc3cc(Cl)ccc3n2Cc2ccccc2)c(C)c1[N+](=O)[O-] 726647140 IIRJZNDAZPNCGU-QGZVFWFLSA-N 481.940 5.154 5 20 JKBD CC(=O)c1cccc(O[C@H](C)C(=O)O[C@@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2ccccc2)c1 745231460 YFDQUYJYPFUTAB-WAIKUNEKSA-N 496.903 5.141 5 20 JKBD C[C@H](OC(=O)c1cc(-c2ccccn2)nc2ccccc12)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 813388872 ICZYXADWCHJUMZ-HNNXBMFYSA-N 467.441 5.173 5 20 JKBD CCn1c(SCC(=O)Nc2cc([N+](=O)[O-])c(F)cc2F)nnc1-c1ccc(Cl)cc1Cl 897489186 CNGOUJIQLRLHRQ-UHFFFAOYSA-N 488.303 5.189 5 20 JKBD Cc1cc(C(=O)N2CCC[C@@H]2c2nc(-c3ccc(COc4ccccc4)cc3)no2)ccc1[N+](=O)[O-] 904445305 DPYHMVISVOJUAE-XMMPIXPASA-N 484.512 5.510 5 20 JKBD CCCN1C(=S)N[C@@H](c2ccc([N+](=O)[O-])cc2)C(C(=O)Nc2ccccc2C(F)(F)F)=C1C 916167699 BPFBYSNRJDMKOB-IBGZPJMESA-N 478.496 5.168 5 20 JKBD Cc1ccc([N+](=O)[O-])cc1OC(=O)[C@@H](C)SCc1nc(O)c2c(-c3ccccc3)csc2n1 916403114 SIOJFQBYRJIEPK-CQSZACIVSA-N 481.555 5.508 5 20 JKBD COc1c([N+](=O)[O-])cc(NCc2ccc(F)cc2C(F)(F)F)c([N+](=O)[O-])c1Br 917066759 QYYWBOUVMVCJMR-UHFFFAOYSA-N 468.157 5.044 5 20 JKBD CCc1cccc[n+]1/C(C(=S)Nc1ccc2ccccc2c1)=C(/O)c1ccc([N+](=O)[O-])cc1 917610104 LDFLZILOYYBTLN-UHFFFAOYSA-O 456.547 5.921 5 20 JKBD O=[N+]([O-])c1ccc(F)cc1S(=O)(=O)Nc1ccc(Oc2ncc(Cl)cc2Cl)cc1 917745863 AHAWCTYOEODBMQ-UHFFFAOYSA-N 458.254 5.029 5 20 JKBD CCOc1ccc(N[C@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Br)c2ccccc2)cc1F 917941804 XMCFIWXGMOYBRY-NRFANRHFSA-N 488.313 5.687 5 20 JKBD O=C(CCN1c2ccccc2Sc2ccccc21)OCc1nc(-c2ccc([N+](=O)[O-])cc2)no1 918832685 LEAJCICMSLACDU-UHFFFAOYSA-N 474.498 5.381 5 20 JKBD COc1ccccc1-c1nc(COC(=O)c2cc(OCC(F)(F)F)ccc2[N+](=O)[O-])cs1 919195673 KKLYDHPBQCFTKZ-UHFFFAOYSA-N 468.409 5.025 5 20 JKBD CSc1ccccc1NC(=O)[C@@H](C)OC(=O)c1ccc(N[C@@H](C)c2ccccn2)c([N+](=O)[O-])c1 920544977 ORLKLRDLBWKBNO-JKSUJKDBSA-N 480.546 5.069 5 20 JKBD Cc1cccc(C(C)C)c1NC(=O)COC(=O)c1ccc(N[C@@H](C)c2ccccn2)c([N+](=O)[O-])c1 920545800 JLCSEEMZNLMZRF-SFHVURJKSA-N 476.533 5.390 5 20 JKBD C[C@@H](OC(=O)c1csc(-c2ccccc2F)n1)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 920732446 AXHKLPLXWIXVKY-SNVBAGLBSA-N 483.399 5.060 5 20 JKBD Cc1ncc(C(=O)Nc2ccc(C3(NC(=O)c4cc(Cl)cc([N+](=O)[O-])c4C)CCC3)cc2)s1 1788866382 OGQUDRFWUDKUNM-UHFFFAOYSA-N 484.965 5.383 5 20 JKBD O=C(NC1(c2ccc(NC(=O)c3cccnc3-c3ccc(F)cc3)cc2)CCC1)c1ccc([N+](=O)[O-])[nH]1 1790152462 YGAPASTYMFOJGS-UHFFFAOYSA-N 499.502 5.186 5 20 JKBD C[C@@H](Cc1ccco1)C(=O)Nc1ccc(C2(NC(=O)CSc3ccccc3[N+](=O)[O-])CCC2)cc1 1791914920 YXMNBVWGCYGAMV-SFHVURJKSA-N 493.585 5.293 5 20 JKBD Cc1c(C(=O)NC[C@@H]2CCN(C(=O)C3(C(C)C)CCC3)[C@@H]2c2cccnc2)cc(Cl)cc1[N+](=O)[O-] 1811796232 FPXQKALOCOJXEA-WMZHIEFXSA-N 499.011 5.098 5 20 JKBD O=C(NC[C@H]1CCN(C(=O)C2CCCCC2)[C@@H]1c1cccnc1)c1cc2cc([N+](=O)[O-])ccc2s1 1812304766 SDHVHDCNBGGPRD-NTKDMRAZSA-N 492.601 5.104 5 20 JKBD O=C(Nc1cc([C@@H]2CCCCN2C(=O)/C=C/c2ccccc2[N+](=O)[O-])[nH]n1)c1ccc2occc2c1 1818709100 BXZJOKXCPUQJBB-CRWWQRIJSA-N 485.500 5.083 5 20 JKBD Cc1cc(C)cc(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)CSc3ccccc3[N+](=O)[O-])n[nH]2)c1 1822313288 OGHHXAYTNZSLKQ-HXUWFJFHSA-N 493.589 5.033 5 20 JKBD Cc1cc(C(=O)N2CCCC[C@H]2C2CCN(C(=O)c3cc(Cl)cc([N+](=O)[O-])c3C)CC2)cnc1C 1825393363 ANHRINNQALUQEU-QHCPKHFHSA-N 499.011 5.116 5 20 JKBD Cc1ccc([C@H](C)C(=O)N2CCCC[C@H]2C2CCN(C(=O)c3cccc(F)c3[N+](=O)[O-])CC2)cc1 1831530672 VIAOTJJONSZORB-CYFREDJKSA-N 481.568 5.079 5 20 JKBD CC[C@H]1CC[C@H](C(=O)N2CCCC[C@H]2C2CCN(C(=O)c3ccc([N+](=O)[O-])cc3F)CC2)CC1 1831695541 BLONEBZSCAEOLP-WXVUKLJWSA-N 473.589 5.184 5 20 JKBD CC(=O)N(c1nc(COC(=O)c2ccc(Cl)c([N+](=O)[O-])c2)cs1)c1cccc(C)c1C 11025219 GFSOCCPLYPHAEU-UHFFFAOYSA-N 459.911 5.363 5 20 JKBD Cc1ccccc1-c1noc(COC(=O)c2ccccc2C(=O)c2ccc(Cl)c([N+](=O)[O-])c2)n1 11029172 IZEMZBWWHXCMBB-UHFFFAOYSA-N 477.860 5.195 5 20 JKBD CC(C)CCSc1ccc(C(=O)Nc2cc(S(C)(=O)=O)ccc2Cl)cc1[N+](=O)[O-] 15910823 HSLVJTDVQNRSIF-UHFFFAOYSA-N 456.973 5.042 5 20 JKBD COc1cc(C(=O)NCC(=O)Nc2c(C)cccc2C)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 17854959 WWEMQNXTJTZCNI-UHFFFAOYSA-N 483.908 5.034 5 20 JKBD Cc1ccccc1OCc1nnc(SCC(=O)Nc2c(C)cccc2[N+](=O)[O-])n1-c1ccccc1 21242941 QLQAWYUVUQZJBG-UHFFFAOYSA-N 489.557 5.102 5 20 JKBD Cc1cccc(-c2nnc(SCC(=O)Nc3ccc(Cl)cc3[N+](=O)[O-])n2Cc2ccco2)c1 22045394 YIUDCFTWLGHSPW-UHFFFAOYSA-N 483.937 5.187 5 20 JKBD C[C@H](C1CC1)N(Cc1ccccc1)C(=O)CSc1nc2cc3ccccc3cc2c(=O)n1C 27948333 BMTBCLAKDISISS-GOSISDBHSA-N 457.599 5.006 5 20 JKBD Cc1ccc(-c2nnc(SCc3nnc(-c4ccc([N+](=O)[O-])cc4)o3)n2-c2ccc(C)cc2)cc1 29814284 YTZNMCYKTRUJOS-UHFFFAOYSA-N 484.541 5.802 5 20 JKBD COc1cc(C(=O)Nc2cc(Cl)ccc2NC(C)=O)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 68797098 PDRWWEPDYAGZSP-UHFFFAOYSA-N 490.299 5.913 5 20 JKBD Cc1csc(Sc2ccc(C(=O)N3C[C@H](C)O[C@@H](c4ccccc4)C3)cc2[N+](=O)[O-])n1 109044824 REYZKKYYXRLTKI-HNAYVOBHSA-N 455.561 5.113 5 20 JKBD CSc1ccc([N+](=O)[O-])c(C(=O)Nc2ccc(Cl)cc2C(=O)N2[C@H](C)CCC[C@H]2C)c1 302996908 YNRNCIFVEJHOOO-ZIAGYGMSSA-N 461.971 5.626 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)NC2(c3ccc(Br)cc3)CCCC2)cc1SC 483030904 UVAXRWSOBTUZFU-UHFFFAOYSA-N 465.369 5.287 5 20 JKBD O=[N+]([O-])c1ccc(-c2nn(-c3ccccc3)cc2CN[C@H](c2ccccc2)c2ccncc2)cc1 488493570 MYTQLPGSZNMNLP-HHHXNRCGSA-N 461.525 5.722 5 20 JKBD CCCCCC(=O)NC1CCN(C(=O)c2ccc(Sc3ccc(C)cc3)c([N+](=O)[O-])c2)CC1 498433213 LGDIBZMOAKXGQF-UHFFFAOYSA-N 469.607 5.356 5 20 JKBD CC[C@@H](C)Sc1ccc(NC(=O)C(=O)N[C@H](C)c2cccc([N+](=O)[O-])c2)c(C(F)(F)F)c1 501442855 UREXANNUXAHROT-CHWSQXEVSA-N 469.485 5.320 5 20 JKBD CC(C)Oc1ccc(CN[C@@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Br)c2ccccc2)cc1 502386146 NPLZQGBHGYMZGR-HSZRJFAPSA-N 498.377 5.614 5 20 JKBD O=C(Nc1ccc(CNCc2ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])cc2)cc1)c1cccnc1 507897668 UNHLASCBEYHXMM-UHFFFAOYSA-N 488.931 5.978 5 20 JKBD COC(=O)[C@@H](NC(=O)C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)c1cccs1 509170141 QWCZNANNEBNFMI-XEZIEYNOSA-N 493.566 5.227 5 20 JKBD CCOC(=O)[C@H]1CCCCN1C(=O)C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1 509858777 WHNAOQZXAJTKAA-WOBAJENOSA-N 479.558 5.079 5 20 JKBD CCOC(=O)c1sc(N(Cc2ccccc2)C(=O)[C@H](C)Sc2ccc([N+](=O)[O-])cc2)nc1C 514383252 HPFAOUBXNTWRKK-INIZCTEOSA-N 485.587 5.250 5 20 JKBD CC[C@@H](NCc1ccc(OC)c(OCc2ccc([N+](=O)[O-])cc2)c1)c1ccc2c(c1)OCCO2 517537170 HNVHIPBECMLJFB-JOCHJYFZSA-N 464.518 5.195 5 20 JKBD CN(C)[C@H](CNC(=O)C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)c1ccco1 518748634 KFEFCCFIMVVKBH-IYYMRFBLSA-N 476.558 5.147 5 20 JKBD O=C(C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)NCc1cn2ccsc2n1 518976924 SVCUSNKOQOJQKR-WJDWOHSUSA-N 475.555 5.161 5 20 JKBD COc1cc(CNC[C@@H]2CCCO[C@@H]2c2ccccc2)ccc1OCc1ccc([N+](=O)[O-])cc1 524680559 GATUSBNBWTZRJG-WNCULLNHSA-N 462.546 5.440 5 20 JKBD COc1cc([N+](=O)[O-])ccc1NC(=O)CSc1nnc(-c2ccco2)n1[C@@H](C)[C@@H]1C[C@H]2CC[C@H]1C2 594534382 FPQFLUATHWVWIE-OVWQWFNUSA-N 497.577 5.183 5 20 JKBD COc1ccc(Cn2nccc2NC(=O)c2ccc(Sc3nc(C)cs3)c([N+](=O)[O-])c2)cc1 603621758 SDPMFWBZRKPZCK-UHFFFAOYSA-N 481.559 5.017 5 20 JKBD O=C(CSc1ccc(C(F)(F)F)cc1[N+](=O)[O-])NCc1ccnc(Oc2ccccc2)c1 603666151 SRDRLJFTAOKELE-UHFFFAOYSA-N 463.437 5.209 5 20 JKBD COc1ccccc1-c1nnc(SCc2ccc(OC)c([N+](=O)[O-])c2)n1CCc1ccccc1 603721946 HIDWFJGEUJCEEE-UHFFFAOYSA-N 476.558 5.406 5 20 JKBD CCOc1cc(NC(=O)c2cc3cc([N+](=O)[O-])ccc3o2)c(OCC)cc1NC(=O)c1ccccc1 603728543 CFALGNAFGYWVBO-UHFFFAOYSA-N 489.484 5.643 5 20 JKBD Cc1ccccc1NC(=O)[C@@H]1CCc2ccccc2N1C(=O)c1cc2cc([N+](=O)[O-])ccc2o1 608871980 IMTVVDDKRRJOJR-QFIPXVFZSA-N 455.470 5.250 5 20 JKBD O=C(Nc1ccc(N2CCOCC2)c(F)c1)c1cc([N+](=O)[O-])ccc1Sc1ccc(Cl)cc1 727998066 LGRZQZLXHUVEMM-UHFFFAOYSA-N 487.940 5.627 5 20 JKBD Cc1ccsc1C(=O)Nc1ccc(OC(=O)c2csc(-c3cccc([N+](=O)[O-])c3)n2)cc1 729216565 KNVNBQRAEWAWJS-UHFFFAOYSA-N 465.512 5.560 5 20 JKBD CC(=O)N[C@@H](CC(=O)OCc1nc2ccccc2c2ccccc12)c1ccc(Br)cc1 742467132 PRGUPCJNMKFHKN-QHCPKHFHSA-N 477.358 5.461 5 20 JKBD C[C@H](Oc1ccc(F)c(F)c1)C(=O)O[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1 744595998 DXEPQEINYPGRQZ-ZSEKCTLFSA-N 490.846 5.217 5 20 JKBD O=C(O[C@@H](C(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1)c1ccccc1)c1ccc(Cl)nc1Cl 747937093 YUPYKUYODYGXRX-QGZVFWFLSA-N 480.691 5.487 5 20 JKBD O=C(c1ccc(Cl)c([N+](=O)[O-])c1)N(Cc1ccc(Cl)c(Cl)c1)Cc1ccccn1 748641224 SGDBQWAXWJRCIR-UHFFFAOYSA-N 450.709 5.793 5 20 JKBD COc1ccc(NC(=O)[C@@H]2CCCN2C(=O)c2ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])cc2)cc1 918568333 CZCLGVZMAILBPB-NRFANRHFSA-N 495.919 5.292 5 20 JKBD C[C@H](OC(=O)CCOc1cccc(Cl)c1Cl)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 919412622 CXOXBYVUDJZXSQ-NSHDSACASA-N 452.250 5.025 5 20 JKBD CSc1nc2ccc(NC(=O)c3ccc(N[C@@H](C)c4ccccn4)c([N+](=O)[O-])c3)cc2s1 919679891 OFMSCQXPRMFRHR-ZDUSSCGKSA-N 465.560 5.747 5 20 JKBD CC(C)(C)NC(=O)c1ccccc1NC(=O)Cc1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1 919858748 MKPNVNKSDYRXGL-UHFFFAOYSA-N 497.555 5.157 5 20 JKBD Cc1ccc(NC(=O)[C@H](C)OC(=O)c2ccc(N[C@@H](C)c3ccccn3)c([N+](=O)[O-])c2)c(Cl)c1 920548110 PTVXOKAGRDEDTN-HOTGVXAUSA-N 482.924 5.309 5 20 JKBD COc1ccc(OC)c(CC(=O)Nc2cc(Cl)c([N+](=O)[O-])cc2OCc2ccccc2)c1 921191193 VGBSXQBGWVHTMH-UHFFFAOYSA-N 456.882 5.026 5 20 JKBD O=C(/C=C/c1ccc([N+](=O)[O-])o1)Nc1ccc(C2(NC(=O)c3ccc4cc[nH]c4c3)CCC2)cc1 1786204677 LPZFXFGKOXMZJZ-CSKARUKUSA-N 470.485 5.130 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)NC1(c2ccc(NC(=O)c3ccc4cnccc4n3)cc2)CCC1 1788963164 RNHQQGLCIIPPHU-UHFFFAOYSA-N 499.502 5.047 5 20 JKBD CCn1nc(C(C)C)cc1C(=O)Nc1ccc(C2(NC(=O)c3cc(F)cc([N+](=O)[O-])c3)CCC2)cc1 1790179735 KUJSFSSVQFKXFF-UHFFFAOYSA-N 493.539 5.135 5 20 JKBD Cc1cccc(C)c1SCC(=O)NC1(c2ccc(NC(=O)c3ccc([N+](=O)[O-])[nH]3)cc2)CCC1 1790185645 JFUATKZFPXWCFI-UHFFFAOYSA-N 478.574 5.080 5 20 JKBD CN(C)c1ccc([N+](=O)[O-])cc1C(=O)Nc1ccc(C2(NC(=O)c3ccc4cc[nH]c4c3)CCC2)cc1 1790794474 VLTQHISTYAJCMU-UHFFFAOYSA-N 497.555 5.204 5 20 JKBD O=C(/C=C/c1ccc(F)cc1F)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc2cc([N+](=O)[O-])ccc2s1 1801205923 HJAILNPDIMEDAN-POVUVCFGSA-N 497.523 5.053 5 20 JKBD Cc1ccc(CCC(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cc(F)cc([N+](=O)[O-])c2)C3)c2ccccc12 1804621512 QXRHQHOGCLBQEC-NUNAXRQHSA-N 489.547 5.080 5 20 JKBD O=C(CCc1cccc([N+](=O)[O-])c1)Nc1cc([C@H]2CCCCN2C(=O)c2cc(F)cc(Cl)c2)[nH]n1 1815539140 TXJYREICEWOJRE-OAQYLSRUSA-N 499.930 5.049 5 20 JKBD Cc1csc(CCC(=O)Nc2cc([C@H]3CCCCN3C(=O)/C=C/c3ccccc3[N+](=O)[O-])[nH]n2)c1 1815897083 JECAEZPCYHPAOR-RUCTVCJSSA-N 493.589 5.026 5 20 JKBD O=C(Nc1cc([C@H]2CCCCN2C(=O)C2(F)CCCCC2)[nH]n1)c1cc2cc([N+](=O)[O-])ccc2s1 1821610479 ZYZVDOOMSFMBDH-GOSISDBHSA-N 499.568 5.511 5 20 JKBD CC[C@H](C)[C@H](C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2ccc([N+](=O)[O-])o2)CC1)c1ccccc1 1823611624 MORZDZIFYGBDBD-JTJYXVOQSA-N 481.593 5.251 5 20 JKBD CCc1ncccc1C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cc(Cl)cc([N+](=O)[O-])c2C)CC1 1825517926 RIKSEHMQRIILQF-HSZRJFAPSA-N 499.011 5.061 5 20 JKBD COc1cc(-c2nnc(SCc3cccc([N+](=O)[O-])c3)n2C2CCCCC2)cc(OC)c1OC 8645577 KKTHEAZVAWXOTI-UHFFFAOYSA-N 484.578 5.677 5 20 JKBD O=C(COC(=O)CCc1ncc(-c2ccccc2Cl)o1)Nc1ccc(C(F)(F)F)cc1[N+](=O)[O-] 12252389 BAKDRUNRSFRRBB-UHFFFAOYSA-N 497.813 5.037 5 20 JKBD Cn1cnnc1Sc1ccc(C(=O)Nc2nc(-c3ccco3)c(-c3ccco3)s2)cc1[N+](=O)[O-] 14506167 OOROIUUBCFMVJG-UHFFFAOYSA-N 494.514 5.103 5 20 JKBD Cc1c(NC(=O)c2ccc3c(c2)C(=O)N(c2ccc(Cl)c(Cl)c2)C3=O)cccc1[N+](=O)[O-] 15661221 SECBDZJBRWZEST-UHFFFAOYSA-N 470.268 5.263 5 20 JKBD CCn1c(S[C@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)nc2sc3c(c2c1=O)CCCC3 20862058 KQYJVSNEHLKEIA-LLVKDONJSA-N 493.010 5.038 5 20 JKBD Cc1occc1-c1nnc(S[C@@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)n1-c1ccccc1 21138669 ATGHQZKCTUNRJV-AWEZNQCLSA-N 483.937 5.517 5 20 JKBD COc1cc([N+](=O)[O-])ccc1NC(=O)CCSc1nnc(-c2ccco2)n1C1CCCCC1 26352684 SXFWDFIFHZAEEN-UHFFFAOYSA-N 471.539 5.081 5 20 JKBD O=C(CCSc1nnc(-c2cccs2)n1-c1ccccc1)Nc1ccc([N+](=O)[O-])cc1 26363018 RPMKQUWZBTXSTI-UHFFFAOYSA-N 451.533 5.025 5 20 JKBD Cc1c(NC(=O)c2ccc(N[C@H](C)c3ccccn3)c([N+](=O)[O-])c2)cccc1C(=O)Nc1ccccc1 68804449 YPCZAUOEGQIDPQ-LJQANCHMSA-N 495.539 5.976 5 20 JKBD CC(=O)c1ccc(Sc2nnc(-c3cccnc3)n2-c2ccc(Cl)c(Cl)c2)c([N+](=O)[O-])c1 69492327 BPBYUCJZKYDVQK-UHFFFAOYSA-N 486.340 5.898 5 20 JKBD CC(C)Cc1ccc(C(=O)C2CCN(C(=O)Cn3c4ccccc4c(=O)c4ccccc43)CC2)cc1 107628244 MKSMYSLCNHRLGV-UHFFFAOYSA-N 480.608 5.475 5 20 JKBD O=C(Nc1ccc(Cl)cc1Cl)[C@@H]1CCCCN1C(=O)c1ccc([N+](=O)[O-])cc1Cl 302936424 JLECYZORBTWDBG-KRWDZBQOSA-N 456.713 5.188 5 20 JKBD CSc1ccc([N+](=O)[O-])c(C(=O)N2CCC(N(C)Cc3cccc(C(F)(F)F)c3)CC2)c1 303073095 XXTHDQXSPRNKFQ-UHFFFAOYSA-N 467.513 5.072 5 20 JKBD CCCn1c(C)cc(-c2csc(NC(=O)c3cc(SC)c(OC)cc3[N+](=O)[O-])n2)c1C 482357010 MVXFREGOHBZTGV-UHFFFAOYSA-N 460.581 5.529 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)Nc2ccc(O[C@H](C)c3ccccc3)cc2C)cc1SC 484417746 WYONZAZNEARXFV-MRXNPFEDSA-N 452.532 6.026 5 20 JKBD CCOc1cc(NC(=O)N[C@H](C)c2nc(-c3ccccc3)cs2)c([N+](=O)[O-])cc1OCC 503719166 TUXHHNKVKVTAOY-CQSZACIVSA-N 456.524 5.398 5 20 JKBD C[C@@H](Nc1ccc(C(=O)Nc2cccc(COCc3ccco3)c2)cc1[N+](=O)[O-])c1ccccn1 507393226 TXEXKMSUNURHDX-GOSISDBHSA-N 472.501 5.725 5 20 JKBD O=C(Nc1ccccc1Oc1ccccc1)c1ccc([N+](=O)[O-])cc1I 508904676 IPAPWUKYTFCTHC-UHFFFAOYSA-N 460.227 5.244 5 20 JKBD CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)N[C@H](Cn1cnc2ccccc21)c1ccc(F)cc1 509276726 LZZCSRZRVRLRLG-XMMPIXPASA-N 475.524 5.445 5 20 JKBD COc1cc(CNC2CCN(Cc3ccc(F)c(F)c3)CC2)c([N+](=O)[O-])cc1OCc1ccccc1 509622021 VLXCXUNRFJTLSO-UHFFFAOYSA-N 497.542 5.215 5 20 JKBD O=C(c1ccc(NCc2ccccc2)c([N+](=O)[O-])c1)N1CCO[C@@H](c2ccc(Br)cc2)C1 516322960 MNYLPDRBIYBBLZ-HSZRJFAPSA-N 496.361 5.183 5 20 JKBD O=[N+]([O-])c1ccc(-c2ccc(CNCc3cn4cc(Cl)ccc4n3)o2)c(Br)c1 518767423 AANYEZAKMFERGZ-UHFFFAOYSA-N 461.703 5.208 5 20 JKBD CC(=O)Nc1cccc([C@H](C)N(Cc2ccccc2)C(=O)[C@@H](C)Oc2ccc(Cl)cc2[N+](=O)[O-])c1 518878501 GXMGQTVAMUYTKD-ZWKOTPCHSA-N 495.963 5.764 5 20 JKBD Cc1csc(Sc2ccc(C(=O)Nc3ccc(C)c(C(=O)NC(C)C)c3)cc2[N+](=O)[O-])n1 520868995 IJBNEYAOXCMBHK-UHFFFAOYSA-N 470.576 5.210 5 20 JKBD COCCN(Cc1cccnc1)C(=O)c1ccc(Sc2nc3ccccc3s2)c([N+](=O)[O-])c1 524340781 WPCIAEUIKIQIBP-UHFFFAOYSA-N 480.571 5.040 5 20 JKBD C[C@@H]1CN(Cc2csc(NC(=O)c3cc([N+](=O)[O-])ccc3Sc3ccccc3)n2)C[C@@H](C)O1 590766915 AXYUKOCSVYCZDJ-HZPDHXFCSA-N 484.603 5.064 5 20 JKBD CN(CC(=O)NC(C)(C)C)C(=O)c1c2c(nc3ccccc13)/C(=C/c1cccc([N+](=O)[O-])c1)CCC2 600840404 KMTQGJNEJGZMFW-XDJHFCHBSA-N 486.572 5.007 5 20 JKBD COC(=O)c1ccccc1C(=O)c1ccc(NCc2c(C)nn(-c3ccccc3)c2C)c([N+](=O)[O-])c1 603840481 HLHILUSXHHTRTR-UHFFFAOYSA-N 484.512 5.027 5 20 JKBD COc1cc(C(=O)N[C@H](C)c2ccc3nc(O)[nH]c3c2)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 603919017 OGBSOIPYCOQFMO-GFCCVEGCSA-N 482.880 5.122 5 20 JKBD COc1ccc(C2(CNCc3ccc(Oc4ccc(F)cc4)c([N+](=O)[O-])c3)CCOCC2)cc1 604419115 KOXWIGYZRYTGCS-UHFFFAOYSA-N 466.509 5.373 5 20 JKBD CCOc1cc([N+](=O)[O-])c(C(=O)N[C@@H](C)c2sc(-c3ccc(F)cc3)nc2C)cc1OC 609186653 YBIOKOAOPHNUAR-LBPRGKRZSA-N 459.499 5.064 5 20 JKBD CCCOc1cc(NC(=O)c2ccc(Cl)c(N3CCCC3=O)c2)c([N+](=O)[O-])cc1OCCC 619206705 MQZBXMFVRJJPHU-UHFFFAOYSA-N 475.929 5.205 5 20 JKBD CCOc1cc(NC(=O)c2cc(-c3ccc(OC)cc3)c(C)s2)c([N+](=O)[O-])cc1OCC 619213092 NCKVCRIIVOJYSE-UHFFFAOYSA-N 456.520 5.690 5 20 JKBD COc1ccc(COC(=O)Cc2csc(-c3cccc(C(F)(F)F)c3)n2)cc1[N+](=O)[O-] 725968395 BHWQJCWZGVJVPW-UHFFFAOYSA-N 452.410 5.032 5 20 JKBD CC(=O)N(c1nc(COC(=O)CCOc2cc(C)ccc2[N+](=O)[O-])cs1)c1cccc(C)c1C 728324830 GVZVWBOLIGSLGJ-UHFFFAOYSA-N 483.546 5.173 5 20 JKBD C[C@@H](OC(=O)c1occc1CN1c2ccccc2C[C@H]1C)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 728688309 OKABTLUGNBNWDW-HZPDHXFCSA-N 474.473 5.107 5 20 JKBD CC(=O)Nc1cccc([C@H](C)N(Cc2ccccc2)C(=O)c2cc(Cl)ccc2[N+](=O)[O-])c1 841837217 AXXFVGDKSJVYMU-INIZCTEOSA-N 451.910 5.610 5 20 JKBD CC(C)c1noc([C@@H](C)OC(=O)C/C(=C\c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)n1 914897249 GHMPINJDCAQQFL-YHZJOHHESA-N 478.530 5.946 5 20 JKBD CCC(CC)c1cc[n+](/C(C(=S)N[C@H](C)c2ccccc2)=C(/O)c2ccc(C)c([N+](=O)[O-])c2)cc1 917611878 GXWYHUDSTCXLNK-HXUWFJFHSA-O 490.649 6.656 5 20 JKBD Cc1nc(-c2cccs2)c(CC(=O)N2CCCC[C@H]2CCOC(=O)c2cccc([N+](=O)[O-])c2)s1 918636549 XFPMOGJHANBIBU-SFHVURJKSA-N 499.614 5.259 5 20 JKBD O=C(OCc1csc([N+](=O)[O-])c1)c1nc(-c2cccs2)n(-c2cccc(C(F)(F)F)c2)n1 918933352 WNMPPDVOJIYWRC-UHFFFAOYSA-N 480.449 5.341 5 20 JKBD Cc1nc(-c2ccc(Cl)s2)sc1C(=O)O[C@@H](C)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 921103767 PNKRPUSUNDRFHY-JTQLQIEISA-N 476.923 5.710 5 20 JKBD Cc1cc(C(=O)NC2(c3ccc(NC(=O)c4cc5ccccc5o4)cc3)CCC2)ncc1[N+](=O)[O-] 1789004836 UYCOKYQRBPLIGZ-UHFFFAOYSA-N 470.485 5.106 5 20 JKBD Cc1ccc(SCC(=O)Nc2ccc(C3(NC(=O)c4cc(O)cc([N+](=O)[O-])c4)CCC3)cc2)cc1 1789109361 UCPBGYWNTXSVCH-UHFFFAOYSA-N 491.569 5.149 5 20 JKBD COc1ccc(CC(=O)Nc2ccc(C3(NC(=O)C[C@H]4C[C@@H]5CC[C@H]4C5)CCC3)cc2)c([N+](=O)[O-])c1 1790571559 AKVFOSGAQULBSP-SVFBPWRDSA-N 491.588 5.106 5 20 JKBD Cc1cc(F)cc(CC(=O)Nc2ccc(C3(NC(=O)/C=C/c4ccc([N+](=O)[O-])o4)CCC3)cc2)c1 1791664304 PEGGKTUZZZYTGO-VQHVLOKHSA-N 477.492 5.025 5 20 JKBD CC1(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)CCCCC1 1801208412 CGQGNXAAIORMLP-BCDXTJNWSA-N 455.580 5.032 5 20 JKBD Cc1ccc(CCC(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2ccc([N+](=O)[O-])cc2F)C3)c2ccccc12 1804621537 TWLQZQOPDWFAPA-WKCHPHFGSA-N 489.547 5.080 5 20 JKBD CC[C@H](C)[C@H](C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2ccc([N+](=O)[O-])o2)[nH]n1)c1ccccc1 1816848408 VAOJCPPYCNXFRU-QUZZAMIASA-N 479.537 5.047 5 20 JKBD Cc1cc(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)CCCCCC(C)(C)C)[nH]n2)ncc1[N+](=O)[O-] 1818265466 MRZXDPLAEYEKFB-FQEVSTJZSA-N 484.601 5.324 5 20 JKBD COc1cc(C(=O)N2CCCC[C@H]2c2cc(NC(=O)c3ccc(C(C)C)cc3)n[nH]2)ccc1[N+](=O)[O-] 1820594349 QJOHUMZIHWZVHN-NRFANRHFSA-N 491.548 5.070 5 20 JKBD Cc1ccc(C(=O)N2CCCC[C@H]2c2cc(NC(=O)c3cc(F)cc([N+](=O)[O-])c3)n[nH]2)cc1Cl 1821163342 LHKNOHTVLJEFQJ-FQEVSTJZSA-N 485.903 5.039 5 20 JKBD O=C(CSc1ccccc1[N+](=O)[O-])Nc1cc([C@@H]2CCCCN2C(=O)c2ccccc2Cl)[nH]n1 1822313564 UAUWNKPYGKPHDW-SFHVURJKSA-N 499.980 5.070 5 20 JKBD O=C(c1cc2cc([N+](=O)[O-])ccc2s1)N1CCC([C@@H]2CCCCN2C(=O)Cc2ccsc2)CC1 1827166469 HECXDRJTTXQMMJ-NRFANRHFSA-N 497.642 5.347 5 20 JKBD Cc1ccn(C)c1C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)CC1 1829833033 IDQHHVGVEUNVCI-OAQYLSRUSA-N 494.617 5.004 5 20 JKBD C[C@@H]1CCC[C@H]1C(=O)N1CCC([C@H]2CCCCN2C(=O)C2(c3cccc([N+](=O)[O-])c3)CCC2)CC1 1830293230 WVVBIWGOGLJLQV-NIJXNBFTSA-N 481.637 5.072 5 20 JKBD CC[C@@H](C(=O)N1CCC([C@@H]2CCCCN2C(=O)Cc2ccc([N+](=O)[O-])cc2F)CC1)c1ccccc1 1831290793 HKDPTULKHATOKF-RSXGOPAZSA-N 495.595 5.090 5 20 JKBD CC[C@H]1CC[C@H](C(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3cc([N+](=O)[O-])c(O)cc3C)CC2)CC1 1831694649 JBJGTYVHZWWYDS-KJXAQDMKSA-N 485.625 5.059 5 20 JKBD O=C(c1ccc([N+](=O)[O-])cc1F)N1CCC([C@@H]2CCCCN2C(=O)c2cc(F)cc(Cl)c2)CC1 1832628715 DVKWCVNEBQVPPM-QFIPXVFZSA-N 491.922 5.074 5 20 JKBD CC(C)=CC(=O)Nc1scc(-c2ccccc2)c1C(=O)OCC(=O)Nc1c(C)cccc1[N+](=O)[O-] 9746900 FYYAFIDXLGNLOA-UHFFFAOYSA-N 493.541 5.332 5 20 JKBD C[C@@H](Sc1nnc(-c2ccco2)n1C1CCCCC1)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl 10014914 FFWYXLVUHNGIRK-CYBMUJFWSA-N 475.958 5.724 5 20 JKBD Cc1ccc(NC(=O)[C@H](Sc2nnc(NCc3ccco3)s2)c2ccccc2)c([N+](=O)[O-])c1 11541386 KFLJYZFOPPWVJV-LJQANCHMSA-N 481.559 5.432 5 20 JKBD CCOc1cc(NC(=O)c2ccc(SC)c([N+](=O)[O-])c2)c(OCC)cc1NC(=O)c1ccccc1 14717100 ZHTYKKVCBGTYHU-UHFFFAOYSA-N 495.557 5.619 5 20 JKBD CC(C)n1c(S[C@@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)nc2cc(Cl)ccc2c1=O 17667975 INCLIVWDTTXYKO-LBPRGKRZSA-N 471.926 5.442 5 20 JKBD COc1ccc([N+](=O)[O-])cc1NC(=O)[C@H](C)Sc1nnc(-c2ccccc2)c2ccccc12 21607331 UBPLNYMWGNCOIB-HNNXBMFYSA-N 460.515 5.333 5 20 JKBD Cc1csc(Sc2ccc([N+](=O)[O-])cc2C(=O)OCC(=O)Nc2c(C)cccc2C(C)C)n1 28832368 ONNFNYNVVQPIMM-UHFFFAOYSA-N 485.587 5.738 5 20 JKBD O=C(Cn1c2ccccc2c(=O)c2ccccc21)Nc1cccc(COc2cccc(F)c2)c1 31397371 PNWUUDASJUNKEH-UHFFFAOYSA-N 452.485 5.512 5 20 JKBD Cc1ccc(NC(=O)N2CCN(C(=O)c3cc4ccccc4c4cccnc34)CC2)cc1Cl 108641532 IEKNEKLWNWONLU-UHFFFAOYSA-N 458.949 5.340 5 20 JKBD O=C(NCc1ccccn1)c1cccc(NC(=O)c2cc([N+](=O)[O-])ccc2Sc2ccccc2)c1 482691530 KPVDGKUEHPWBBU-UHFFFAOYSA-N 484.537 5.323 5 20 JKBD O=C(C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)NCCOC1CCCCC1 490817568 IJVNDXOLNVWCMH-MNDPQUGUSA-N 465.575 5.601 5 20 JKBD CN(C(=O)c1csc(-c2ccc([N+](=O)[O-])cc2)n1)[C@@H]1CCSc2ccc(Br)cc21 504611943 FGUZWKWPKGMPRD-QGZVFWFLSA-N 490.404 5.790 5 20 JKBD CN(Cc1ccccc1[N+](=O)[O-])C(=O)Nc1ccc(Oc2cccc(Br)c2)nc1 506487182 NTOFLNRNZCFGRN-UHFFFAOYSA-N 457.284 5.209 5 20 JKBD O=C(Nc1cccc(CNCc2ccc(Oc3ccccc3Cl)c([N+](=O)[O-])c2)c1)c1ccncc1 509582474 GWAWTMNUJZHCGA-UHFFFAOYSA-N 488.931 5.978 5 20 JKBD C[C@H]1CN(Cc2cccc(CNCc3ccc(Oc4ccc(F)cc4)c([N+](=O)[O-])c3)c2)CCO1 517549414 PSWILMZGNRJNNA-IBGZPJMESA-N 465.525 5.037 5 20 JKBD C[C@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)Nc1ccc(Sc2nncs2)c(Cl)c1 524490804 ZCDYQBDHXIKYJD-VIFPVBQESA-N 471.347 5.310 5 20 JKBD Cc1nc(CSc2ccc(C(=O)Nc3nc(-c4cccc([N+](=O)[O-])c4)cs3)cc2)cs1 591587884 XGMXXLLLPGEXGU-UHFFFAOYSA-N 468.585 6.028 5 20 JKBD COCCOc1ccc(C(F)(F)F)cc1NC(=O)c1ccc(N2CCC(C)CC2)c([N+](=O)[O-])c1 603444552 FNXADPJMRPVLOW-UHFFFAOYSA-N 481.471 5.127 5 20 JKBD Cc1ccc([N+](=O)[O-])cc1NC(=O)Cc1ccc(NC(=O)c2ccc(Br)cc2)cc1 603750608 SPKMWGQRZMZMBB-UHFFFAOYSA-N 468.307 5.099 5 20 JKBD C[C@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)N[C@H](C)c1cccc(NC(=O)c2ccccc2)c1 604442729 QOOMEGVWTXROAN-CVEARBPZSA-N 467.909 5.145 5 20 JKBD COC(=O)C[C@@H]1CCCCN1C(=O)C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1 604479143 QLWQFPKCDMGVOX-BXWQOUMASA-N 479.558 5.079 5 20 JKBD O=[N+]([O-])c1ccc(-c2ccc(CNCc3ccc(OCC(F)(F)F)nc3)o2)c(Br)c1 608836453 YOJVBSDGXNJYBT-UHFFFAOYSA-N 486.244 5.243 5 20 JKBD O=[N+]([O-])c1ccc(S(=O)(=O)Nc2nc3nc(-c4cccs4)cc(C(F)(F)F)c3s2)s1 608929360 XFPICNOMKRHTPY-UHFFFAOYSA-N 492.507 5.209 5 20 JKBD O=C(c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1)N1CCC(n2c(O)nc3ccccc32)CC1 610252063 NXMVARSAAZGWQV-UHFFFAOYSA-N 492.919 5.573 5 20 JKBD Cc1ccc(NC(=O)[C@H](OC(=O)Cc2c[nH]c3cc(C)ccc23)c2ccccc2)c([N+](=O)[O-])c1 726222916 HNWWRHVJKSALKZ-RUZDIDTESA-N 457.486 5.159 5 20 JKBD O=C(OCC(=O)N1c2ccccc2Sc2ccc(Cl)cc21)c1cc([N+](=O)[O-])cc2c1OCCO2 727565848 NERRWSUQJNVIGC-UHFFFAOYSA-N 498.900 5.006 5 20 JKBD Cc1cccc(-c2nnc([C@@H](C)OC(=O)c3cc([N+](=O)[O-])ccc3N3CCC(C)CC3)o2)c1 746145849 SNQWDJGCKMWJON-QGZVFWFLSA-N 450.495 5.108 5 20 JKBD Cc1ccc(/C=C\C(=O)O[C@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)c(Br)c1 746170690 YYPLBNHFDFMMSE-PGJNLMOESA-N 458.268 5.033 5 20 JKBD C[C@H](Sc1nc2ccc([N+](=O)[O-])cc2s1)c1nc(O)c2c(-c3cccs3)csc2n1 788010337 VJCNQQDKFVUCKQ-VIFPVBQESA-N 472.598 6.497 5 20 JKBD COC1CCN(Cn2c(=S)n(-c3cccc(C(F)(F)F)c3)c3ccc([N+](=O)[O-])cc32)CC1 813092414 NWSKOEGHTZJQIA-UHFFFAOYSA-N 466.485 5.157 5 20 JKBD CSCC[C@H](NC(=O)c1ccc(Cl)c([N+](=O)[O-])c1)C(=O)O[C@H](C)c1ccccc1Cl 847431685 VYEOZJICQJCEAM-PXAZEXFGSA-N 471.362 5.058 5 20 JKBD C[C@@H](OC(=O)c1cc([N+](=O)[O-])ccc1Oc1ccccc1)C(=O)N(C)Cc1nc2ccccc2s1 919193490 SGLOUNIJYUIFSR-MRXNPFEDSA-N 491.525 5.201 5 20 JKBD Cc1ccc(C)n1-c1sccc1C(=O)O[C@@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 920061167 MTAWWYCXSRMVIK-ZDUSSCGKSA-N 481.452 5.267 5 20 JKBD C[C@@H](OC(=O)c1cnc(-c2ccccc2F)s1)C(=O)Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1 920700928 CEFQLAGACRACAY-GFCCVEGCSA-N 498.517 5.165 5 20 JKBD O=C(Cc1cccc([N+](=O)[O-])c1)Nc1ccc(C2(NC(=O)c3ccc4c(c3)CCCC4=O)CCC2)cc1 1785792438 YPJIPJWUEYMPAW-UHFFFAOYSA-N 497.551 5.104 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)Nc1ccc(C2(NC(=O)c3ccc4ncoc4c3)CCC2)cc1 1790770490 FCIJIJSRWWFCDG-UHFFFAOYSA-N 488.475 5.245 5 20 JKBD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CCc1ccccc1Cl)c1cc2cc([N+](=O)[O-])ccc2s1 1795741099 WNQCOOIOYNWQNY-REPLKXPHSA-N 498.004 5.348 5 20 JKBD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)/C=C/c1ccccc1[N+](=O)[O-])c1cc2c(Cl)cccc2s1 1804344720 NUNUCBAGBLOSFB-CTSJQTPZSA-N 495.988 5.428 5 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O=C(Nc1ccc(NC(=O)c2ccco2)cc1C(F)(F)F)c1ccc(Cl)c([N+](=O)[O-])c1 14366995 VGFDHMJXCMSEJC-UHFFFAOYSA-N 453.760 5.365 5 20 JKBD CSc1ccc([N+](=O)[O-])c(C(=O)O[C@@H](C(=O)Nc2cc(C)ccc2C)c2ccccc2)c1 16196136 ADYDPBYQJZGBAH-JOCHJYFZSA-N 450.516 5.470 5 20 JKBD CCN(CC)c1ccc(-c2nnc(SCC(=O)Nc3ccc([N+](=O)[O-])cc3C(F)(F)F)o2)cc1 22002714 SREBQJCCIUXCJB-UHFFFAOYSA-N 495.483 5.241 5 20 JKBD CSc1ccc(C(=O)c2ccccc2C(=O)NCCc2c[nH]c3ccccc23)cc1[N+](=O)[O-] 24603770 AUQZTXKLXHXEOJ-UHFFFAOYSA-N 459.527 5.002 5 20 JKBD CCOc1cc(C(=O)Nc2ncc(Cc3cccc(C)c3Cl)s2)c([N+](=O)[O-])cc1OC 26038630 FLNPJELUOGYVDC-UHFFFAOYSA-N 461.927 5.264 5 20 JKBD C[C@H](Cc1cccs1)NC(=O)C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1 33206225 OYFQYLPDKUQUGE-VVZNPABPSA-N 463.584 5.944 5 20 JKBD Cc1ccccc1SCC(=O)Nc1c(Br)cc([N+](=O)[O-])cc1Br 33697017 UWPCDUGBVUPXGF-UHFFFAOYSA-N 460.147 5.159 5 20 JKBD CCNC(=O)c1ccc(NC(=O)c2ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])c(OC)c2)cc1 107974078 GCPRNJRXSKMDTJ-UHFFFAOYSA-N 469.881 5.051 5 20 JKBD COc1cc(C(=O)Nc2ccnn2[C@@H](C)C2CC2)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 195608735 RALSGIJKSIBWQI-ZDUSSCGKSA-N 456.886 5.469 5 20 JKBD Cc1cc(Br)cc(C)c1NC(=O)CSc1ccc(C(F)(F)F)cc1[N+](=O)[O-] 195636646 GVHAMBMYFIQLDN-UHFFFAOYSA-N 463.275 5.724 5 20 JKBD COc1ccc(/C=C\C(=O)O[C@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2ccccc2)cc1 214746522 DOWTWKVFMYNRAV-RFMKRLFESA-N 466.877 5.193 5 20 JKBD Cc1csc(Sc2ccc(C(=O)N[C@@H](c3ccccc3)c3nccs3)cc2[N+](=O)[O-])n1 303155188 DFONDDJCIOYYRI-SFHVURJKSA-N 468.585 5.487 5 20 JKBD Cc1csc(Sc2ccc(NC(=O)c3ccc(-n4ccnc4)c([N+](=O)[O-])c3)c(C)c2)n1 303208121 ZMHOEPDHGAQJKU-UHFFFAOYSA-N 451.533 5.257 5 20 JKBD O=C(C[C@H]1C=CCC1)Nc1ccccc1NC(=O)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-] 409983896 ZAEMCNQKZWYYSX-AWEZNQCLSA-N 463.412 5.083 5 20 JKBD O=C(C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)NCc1ccc(-n2cncn2)cc1 410401839 XXDZIKZXEYMVJT-MOSHPQCFSA-N 496.552 5.032 5 20 JKBD Cc1ccc2c(c1C)OC[C@@H]2N[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1 477031245 HCLPTUIYTGZSLK-FCHUYYIVSA-N 451.910 5.268 5 20 JKBD Cc1ccc(NC(=O)C(C)C)cc1NC(=O)Cc1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1 479363309 LPCBTXHNULNFGG-UHFFFAOYSA-N 497.555 5.532 5 20 JKBD Cc1ccc(-n2nc(C)c(CC(=O)N(Cc3ccccc3[N+](=O)[O-])CC(F)(F)F)c2C)cc1Cl 486066547 FEUVYASZJMCLTA-UHFFFAOYSA-N 494.901 5.493 5 20 JKBD O=C(c1csc(-c2cccc([N+](=O)[O-])c2)n1)N1CCC(c2nc3ccccc3s2)CC1 496446966 KIHSYACLLGPSKH-UHFFFAOYSA-N 450.545 5.348 5 20 JKBD O=C(C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1)N1CCC(Cc2ccc(F)cc2)CC1 504938086 ZMMDIKSXPIQVJH-UHFFFAOYSA-N 493.501 5.450 5 20 JKBD C[C@H](Nc1ccc(C(=O)Nc2nc(-c3cccs3)cs2)cc1[N+](=O)[O-])c1ccccn1 507154062 GZXYOCNSITYTEU-ZDUSSCGKSA-N 451.533 5.600 5 20 JKBD Cc1c(NC(=O)c2cc([N+](=O)[O-])ccc2Sc2ccccc2)cccc1-c1nnc2n1CCCCC2 511161954 OXHAZSHUTVNDDE-UHFFFAOYSA-N 499.596 6.292 5 20 JKBD O=C(c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1)N(C[C@@H]1CCCO1)[C@@H]1CCSC1 514493136 JSAMAZORQXXNAX-MJGOQNOKSA-N 462.955 5.167 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Cl)[C@H](Nc1cccc(COCC2CC2)c1)c1ccccc1 520468633 AYNNGQYPWFXOCX-XMMPIXPASA-N 465.937 5.967 5 20 JKBD Cc1nn(Cc2ccc(C(=O)Nc3ccc(Cn4cnc5ccccc54)cc3)cc2)c(C)c1[N+](=O)[O-] 521796357 CQMVGYJPMPDUCV-UHFFFAOYSA-N 480.528 5.107 5 20 JKBD Cc1cc(-c2cc(C(=O)Nc3cc4c(cc3[N+](=O)[O-])OCCCO4)c3c(C)noc3n2)c(C)s1 590851906 TYJFRTXLUHFIAR-UHFFFAOYSA-N 480.502 5.198 5 20 JKBD COc1ccc(CSCC(=O)Nc2nnc(SCc3ccc(Cl)cc3)s2)cc1[N+](=O)[O-] 603564534 NXFFJMLWAFMFKJ-UHFFFAOYSA-N 497.023 5.273 5 20 JKBD CN(C(=O)c1c2c(nc3ccccc13)/C(=C\c1ccc([N+](=O)[O-])cc1)CCC2)c1nccs1 603619411 YEJZUVHHXTYJRA-ICFOKQHNSA-N 456.527 5.753 5 20 JKBD O=C(c1cc(NCc2cn(Cc3ccccc3)nc2-c2ccccc2)ccc1[N+](=O)[O-])N1CCCC1 603943260 JLTFXJLRGBBIHM-UHFFFAOYSA-N 481.556 5.355 5 20 JKBD Cc1nc(CNC(=O)C/C(=C/c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)cs1 604248601 XSBQOPAVYNQZEC-YBEGLDIGSA-N 450.545 5.217 5 20 JKBD C[C@@H](Nc1ccc(C(=O)N2CCC[C@@H](c3cc4ccccc4[nH]3)C2)cc1[N+](=O)[O-])c1ccccn1 604336881 KBQNKAXPEQTRNZ-WIYYLYMNSA-N 469.545 5.664 5 20 JKBD COc1ccc(CC(=O)Nc2ccc(NC(=O)c3ccc(F)cc3)cc2C(F)(F)F)cc1[N+](=O)[O-] 609011285 MZNDKWDEAUAHJG-UHFFFAOYSA-N 491.397 5.195 5 20 JKBD O=C(C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)N1CCC[C@H](n2ccnc2)C1 609131694 VGVBXVPPILTXEK-CURYZJDOSA-N 473.558 5.195 5 20 JKBD O=C(CCC(=O)c1ccc2ccc3cccc4ccc1c2c34)NCCc1nnc2n1CCCCC2 727754031 BGCOATGKFYIGOH-UHFFFAOYSA-N 464.569 5.224 5 20 JKBD Cc1ccc(Cl)c(NC(=S)/C(=C(/O)c2cccc([N+](=O)[O-])c2)[n+]2cccc(O)c2)c1Cl 728558328 KJPBQLJZPMOTAP-UHFFFAOYSA-O 477.349 5.526 5 20 JKBD CCCN(C(=O)c1ccc(N[C@H](C)c2ccccn2)c([N+](=O)[O-])c1)[C@@H]1CCN(C(=O)OC(C)(C)C)C1 729428149 XLROQGNVEUONTD-UYAOXDASSA-N 497.596 5.025 5 20 JKBD CC(C)(C)OC(=O)Nc1ccccc1NC(=O)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-] 730962520 KTGJYMRKAHJZEK-UHFFFAOYSA-N 455.389 5.135 5 20 JKBD O=C(OCC1CCN(c2ccc([N+](=O)[O-])cn2)CC1)c1csc(-c2ccc(Cl)c(Cl)c2)n1 750434197 GHKLRNGOQJDZSQ-UHFFFAOYSA-N 493.372 5.494 5 20 JKBD NC(=O)[C@@H](OC(=O)C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)c1ccc(F)cc1 824255260 WLYHTBSBSSYGON-ILAWTMEDSA-N 491.500 5.044 5 20 JKBD CC(C)N(Cc1nnc(-c2cccc([N+](=O)[O-])c2)o1)C(=O)c1sc2cc(F)ccc2c1Cl 864244960 WKOJRYYFOBYNEO-UHFFFAOYSA-N 474.901 5.703 5 20 JKBD CC(=O)Nc1ccc(NC(=O)c2ccccc2NC(=O)c2ccc([N+](=O)[O-])cc2Cl)cc1C 903091155 OIMMAFORAHSWJP-UHFFFAOYSA-N 466.881 5.020 5 20 JKBD CC(C)c1c(C(=O)N(C)Cc2cc([N+](=O)[O-])ccc2Cl)cnn1-c1ccc(C(F)(F)F)cn1 915068196 SXSYMNBNGGYEMC-UHFFFAOYSA-N 481.862 5.243 5 20 JKBD O=C(O)c1ccc2c(=O)nc(/C(Cl)=C\c3ccc(Oc4ccccc4Cl)c([N+](=O)[O-])c3)[nH]c2c1 916127481 YGVCFKYDRSYERW-CXUHLZMHSA-N 498.278 5.712 5 20 JKBD CCOC(=O)c1c(NC(=O)c2cc(OCC(F)(F)F)ccc2[N+](=O)[O-])sc2ccccc12 918597955 NHJLHSWNIDXMLY-UHFFFAOYSA-N 468.409 5.180 5 20 JKBD CC(C)(C)c1ccc([C@@H]2CCCN2C(=O)COC(=O)Cn2c3ccccc3c(=O)c3ccccc32)cc1 919055764 PHBYDCGSPMSNBR-VWLOTQADSA-N 496.607 5.359 5 20 JKBD O=C(OCc1csc(-c2ccc(C(F)(F)F)cc2)n1)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1 919220781 UPNKLZRKEHBPAO-UHFFFAOYSA-N 453.354 5.002 5 20 JKBD C[C@H](OC(=O)Cc1ccc(NC(=O)c2ccc(Br)o2)cc1)c1cccc([N+](=O)[O-])c1 919394902 GFCFVNUXSVUPEV-ZDUSSCGKSA-N 473.279 5.050 5 20 JKBD COc1ccc([N+](=O)[O-])c(C(=O)OCc2csc(N(C(C)=O)c3c(C)cc(C)cc3C)n2)c1 920704774 IONQDAUWOVRFFY-UHFFFAOYSA-N 469.519 5.027 5 20 JKBD Cc1occc1C(=O)Nc1ccc(C2(NC(=O)c3cccc(Br)c3[N+](=O)[O-])CCC2)cc1 1787364596 QJRGUIAKXWQGIF-UHFFFAOYSA-N 498.333 5.320 5 20 JKBD Cc1cscc1C(=O)Nc1ccc(C2(NC(=O)/C=C/c3ccc([N+](=O)[O-])o3)CCC2)cc1 1788748024 HANZVRGROBLEKE-VQHVLOKHSA-N 451.504 5.019 5 20 JKBD O=C(Cc1ccc(Cl)cc1[N+](=O)[O-])NC1(c2ccc(NC(=O)c3ccoc3Cl)cc2)CCC1 1790205042 SLFKOIVCYMFATN-UHFFFAOYSA-N 488.327 5.485 5 20 JKBD COc1cc(F)c(C(=O)Nc2ccc(C3(NC(=O)c4ccc([N+](=O)[O-])cc4F)CCC3)cc2)c(F)c1 1790675963 AEVPEAGPMUXZET-UHFFFAOYSA-N 499.445 5.082 5 20 JKBD Cc1scc(C(=O)N2CCCC[C@H]2c2cc(NC(=O)CSc3ccccc3[N+](=O)[O-])n[nH]2)c1C 1822312780 QHKDTMGUPZKDER-SFHVURJKSA-N 499.618 5.094 5 20 JKBD O=C(Cc1cccc([N+](=O)[O-])c1)N1CCC([C@H]2CCCCN2C(=O)Cc2ccc3ccccc3c2)CC1 1826396210 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O=C(CCOc1ccccc1)O[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Br)c1ccccc1 28303755 NCZMKYQMHSGTFL-JOCHJYFZSA-N 499.317 5.049 5 20 JKBD COc1ccc([C@H](NC(=O)c2cc(SC)c(OC)cc2[N+](=O)[O-])c2ccc(C)cc2)cc1 483441689 SIMLXPRXEPNDPT-HSZRJFAPSA-N 452.532 5.162 5 20 JKBD C[C@@H](c1c(F)cccc1F)N(C)C(=O)Cc1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1 498512667 UFXCTJFONBUPNZ-KRWDZBQOSA-N 476.483 5.488 5 20 JKBD C[C@H]1c2cccn2CCN1C(=O)C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1 502896948 SHDAZOYFAPRCRF-BYFYWULKSA-N 458.543 5.540 5 20 JKBD C[C@@H]1CCCN(c2ccc(C(=O)Nc3ccccc3OCc3cscn3)cc2[N+](=O)[O-])C1 503509951 VUYRZGINGSTDNM-MRXNPFEDSA-N 452.536 5.119 5 20 JKBD CCOc1ccc(-c2csc(NC(=O)c3ccc(N[C@@H](C)c4ccccn4)c([N+](=O)[O-])c3)n2)cc1 507420458 AOYMSKYICXWXDM-INIZCTEOSA-N 489.557 5.937 5 20 JKBD COc1cc(C(=O)N(Cc2ccc([C@H]3C[C@@H]3C)o2)C2CC2)c([N+](=O)[O-])cc1OCc1cscn1 512343292 NVWCHMJTZCKNDF-KSSFIOAISA-N 483.546 5.160 5 20 JKBD COc1ccc(Cl)c(NC(=O)c2ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])c(OC)c2)c1 520400493 ASOMAPUXPBAZKQ-UHFFFAOYSA-N 463.273 5.963 5 20 JKBD CC(C)Cn1ccnc1NC(=O)C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1 522578586 QBVPQFMAPNIXFK-AQTBWJFISA-N 461.547 5.626 5 20 JKBD CCOc1cc(NC(=O)c2cc(-c3cccs3)nc3c2cnn3C(C)C)c([N+](=O)[O-])cc1OCC 589245029 GOVMVIMUGXCWQN-UHFFFAOYSA-N 495.561 5.699 5 20 JKBD O=C(N[C@@H]1C[C@@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1)c1ccc(NCc2ccccc2)c([N+](=O)[O-])c1 603576262 FGHFNUJJFKDZFF-FVQHAEBGSA-N 489.416 5.846 5 20 JKBD Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)c1cccc(NC(=O)c2cccc(Br)c2)c1 603751581 MGSGBISGDCDXRE-UHFFFAOYSA-N 468.307 5.479 5 20 JKBD CC(C)Oc1ccccc1[C@H](C)NC(=O)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 603906122 TZXZYKSAPOAFQX-INIZCTEOSA-N 479.499 5.495 5 20 JKBD COc1cc(C(=O)Nc2ccc(OCc3ccccc3Cl)cc2)c([N+](=O)[O-])cc1OC(F)F 604185763 LMULLWIGAWEJMD-UHFFFAOYSA-N 478.835 5.690 5 20 JKBD COc1cc(CN[C@@H](c2ccc3c(c2)OCCO3)C(C)C)ccc1OCc1ccc([N+](=O)[O-])cc1 604478222 YTJYFLBJZUDMQZ-HHHXNRCGSA-N 478.545 5.441 5 20 JKBD O=C(c1c2c(nc3ccccc13)/C(=C/c1cccc([N+](=O)[O-])c1)CCC2)N1CCC[C@@H](c2cc[nH]n2)C1 608813473 XEMVNURNRNJHBW-ICFXLVBESA-N 493.567 5.763 5 20 JKBD COc1c(Cl)cc(NC(=O)c2ccccc2NC(=O)c2ccc([N+](=O)[O-])cc2Cl)cc1Cl 725733211 MOBQWBZNHXMYSI-UHFFFAOYSA-N 494.718 6.068 5 20 JKBD C[C@H](OC(=O)c1ccc(N2C[C@H](C)C[C@@H](C)C2)c([N+](=O)[O-])c1)c1nnc(-c2cccs2)o1 745930530 OPBFYERZOZFJKX-KFWWJZLASA-N 456.524 5.107 5 20 JKBD Cc1c(C(=O)Nc2nc(-c3ccc(F)c(Cl)c3)cs2)cc([N+](=O)[O-])c(C)c1[N+](=O)[O-] 748631256 UKIDTRSXHYIKTE-UHFFFAOYSA-N 450.835 5.288 5 20 JKBD O=C(Nc1cc(-c2nnc3n2CCCCC3)ccc1Cl)c1cc([N+](=O)[O-])ccc1Br 751071475 GHKMWLMOQGNKGJ-UHFFFAOYSA-N 490.745 5.248 5 20 JKBD Cc1cc(-c2cc(C(=O)Nc3cc([N+](=O)[O-])c(F)cc3F)c3cnn(C(C)C)c3n2)c(C)s1 825487350 AKYXIHXGUVHXFT-UHFFFAOYSA-N 471.489 5.796 5 20 JKBD Cc1cc([C@H]2CCCN2C(=O)C/C(=C\c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)no1 912930891 IPYIKDCIRWXTRU-OVWUPXBPSA-N 474.542 5.795 5 20 JKBD COc1ccccc1[C@H](NCc1ccc(Oc2ccc(F)cc2)c([N+](=O)[O-])c1)c1nccn1C 915226917 VTYZUVNNFYJEKN-DEOSSOPVSA-N 462.481 5.148 5 20 JKBD O=C(Oc1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2Cl)cc1)c1cc2cc([N+](=O)[O-])ccc2o1 915811412 SUCXRQILUNCMBS-UHFFFAOYSA-N 481.804 5.374 5 20 JKBD CCCc1cc[n+](/C(C(=S)N[C@H](C)c2ccccc2)=C(/O)c2ccc(C)c([N+](=O)[O-])c2)cc1 917611880 HAAMLVIXCVIBDP-LJQANCHMSA-O 462.595 5.705 5 20 JKBD O=C(OCC(=O)N1CCc2sccc2[C@@H]1c1ccccc1)c1cc2cc([N+](=O)[O-])ccc2s1 918990073 DXMRCSPOMRCRIH-QHCPKHFHSA-N 478.551 5.202 5 20 JKBD Cc1ccc(C(=O)OCCOc2ccc([N+](=O)[O-])c(C(F)(F)F)c2)cc1NC(=O)c1ccco1 920146820 KOZVZBZZNIKYJU-UHFFFAOYSA-N 478.379 5.003 5 20 JKBD COC(=O)c1sc(-c2cccc(Br)c2)cc1NC(=O)c1cc(OC)ccc1[N+](=O)[O-] 920816193 JEEXUNIVKBLFNT-UHFFFAOYSA-N 491.319 5.133 5 20 JKBD O=C(/C=C/c1ccc([N+](=O)[O-])o1)Nc1ccc(C2(NC(=O)c3ccc4occc4c3O)CCC2)cc1 1786207685 CTULYYLWUPJWCV-UXBLZVDNSA-N 487.468 5.101 5 20 JKBD Cc1ncsc1C(=O)Nc1ccc(C2(NC(=O)c3cc4cc([N+](=O)[O-])ccc4s3)CCC2)cc1 1787424241 VZDOKZZPSLPDRF-UHFFFAOYSA-N 492.582 5.636 5 20 JKBD CCCc1onc(C)c1C(=O)Nc1ccc(C2(NC(=O)/C=C/c3ccccc3[N+](=O)[O-])CCC2)cc1 1788779389 BKRGRLRUCVNYIW-XNTDXEJSSA-N 488.544 5.305 5 20 JKBD O=C(Cc1ccc([N+](=O)[O-])cc1F)NC1(c2ccc(NC(=O)c3cccc4ncccc34)cc2)CCC1 1788907200 XMQZZUYDYUNRHO-UHFFFAOYSA-N 498.514 5.273 5 20 JKBD O=C(CCc1cccc([N+](=O)[O-])c1)NC1(c2ccc(NC(=O)c3cc4sccc4[nH]3)cc2)CCC1 1789366949 WQFPMXDEFKYETC-UHFFFAOYSA-N 488.569 5.518 5 20 JKBD O=C(NC1(c2ccc(NC(=O)c3ccc([N+](=O)[O-])c4c3OCO4)cc2)CCC1)c1ccc2ccoc2c1 1790096478 OMKLNGSTERGRPH-UHFFFAOYSA-N 499.479 5.131 5 20 JKBD C/C(=C\c1ccc(C)o1)C(=O)NC1(c2ccc(NC(=O)Cc3ccc([N+](=O)[O-])cc3F)cc2)CCC1 1791184227 VZZDPUIDYPEHHQ-SAPNQHFASA-N 491.519 5.415 5 20 JKBD CC1(C)CCC(CC(=O)N2CCCC[C@@H]2c2cc(NC(=O)Cc3cc([N+](=O)[O-])ccc3F)n[nH]2)CC1 1815646092 YORNJPLNOIFZPW-JOCHJYFZSA-N 499.587 5.298 5 20 JKBD CC1(C)CC(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)c3cc4cc([N+](=O)[O-])ccc4s3)n[nH]2)C1 1821611680 WARFZBVRHBIMQD-GOSISDBHSA-N 481.578 5.275 5 20 JKBD CCCCC[C@H](C)C(=O)N1CCC([C@H]2CCCCN2C(=O)/C=C/c2ccc([N+](=O)[O-])o2)CC1 1824279375 VNGOBNBJTJWJQH-CIRHMYPESA-N 459.587 5.037 5 20 JKBD C/C(=C\c1ccc(C)o1)C(=O)N1CCCC[C@H]1C1CCN(C(=O)Cc2ccc(C)c([N+](=O)[O-])c2)CC1 1829009341 HXZSGWGYOUPZMR-XDKREJCVSA-N 493.604 5.070 5 20 JKBD Cc1ccc(F)c(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)CSc3ccccc3[N+](=O)[O-])CC2)c1 1830557628 JRIQNJBBDBPCLE-JOCHJYFZSA-N 499.608 5.068 5 20 JKBD Cc1c(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)CCc3ccco3)CC2)cc(Cl)cc1[N+](=O)[O-] 1830734550 MZUAQOKRQAYVPD-JOCHJYFZSA-N 487.984 5.016 5 20 JKBD CCN1C/C(=C/c2ccc(-c3ccc([N+](=O)[O-])cc3)o2)c2nc3ccccc3c(C(=O)O)c2C1 13339760 ZNVAYROBBYAGLR-LGMDPLHJSA-N 455.470 5.477 5 20 JKBD Cn1ccnc1[C@H](NC(=O)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1)c1ccc(F)cc1 14406765 IXJNMHXPNVOFKJ-JOCHJYFZSA-N 480.883 5.433 5 20 JKBD O=c1c2cc([N+](=O)[O-])ccc2nc2n1CC/C2=C/c1csc(-c2cccc(Br)c2)n1 16387090 SCNJWRDYFZWAKN-XFXZXTDPSA-N 481.331 5.135 5 20 JKBD C[C@@H](Sc1nc(-c2ccccc2Br)n[nH]1)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 17669967 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510655643 BMFKUZKSVSZKIU-HXUWFJFHSA-N 466.494 5.071 5 20 JKBD C[C@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)Nc1cc(C(=O)Nc2ccccc2)ccc1Cl 512321858 HAZCCOFCYLKCRP-AWEZNQCLSA-N 455.923 5.620 5 20 JKBD C[C@@H]1CN(C(=O)C/C(=C/c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)C[C@@H](c2ccccc2)O1 516754656 SOJKROKOLQGXMO-ZMRVYZJESA-N 499.592 6.124 5 20 JKBD CC(C)c1nc(CCNCc2ccc(-c3ccc([N+](=O)[O-])cc3Br)o2)cs1 517550626 HXUBAWFPSMERGW-UHFFFAOYSA-N 450.358 5.530 5 20 JKBD COc1cc(C(=O)Nc2cccc(NC(=O)[C@H](C)OC)c2)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 518887320 JYELSPNPJAWPQX-AWEZNQCLSA-N 499.907 5.275 5 20 JKBD Cc1nc(-c2ccc(F)cc2)sc1[C@@H](C)NC(=O)c1cn(C)nc1-c1ccc([N+](=O)[O-])cc1 521503657 FLOCAEPOXBHAQA-CYBMUJFWSA-N 465.510 5.057 5 20 JKBD COC(=O)c1occc1CN(C(=O)c1ccc(C(C)(C)C)c([N+](=O)[O-])c1)[C@H](C)c1ccccn1 523039997 IUODPAKJJRHWFK-MRXNPFEDSA-N 465.506 5.071 5 20 JKBD COc1ccc(C[C@H](NC(=O)Cn2c3ccccc3c(=O)c3ccccc32)c2ccccc2)cc1OC 589400495 QXUKMGBDZNUJHJ-VWLOTQADSA-N 492.575 5.272 5 20 JKBD COc1cc(C)c(NC(=O)C/C(=C\c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)cc1OC 603457776 HYQHVTVLHXYKCL-QGOAFFKASA-N 489.553 6.100 5 20 JKBD COc1ccc(CSCC(=O)Nc2nc3c(C(F)(F)F)cccc3s2)cc1[N+](=O)[O-] 603564964 WTLOZBZBDVPWME-UHFFFAOYSA-N 457.455 5.104 5 20 JKBD CCOc1cc([N+](=O)[O-])c(C(=O)Nc2ccccc2NC(=O)c2ccc(C(C)(C)C)cc2)cc1OC 603722034 SPRKNKUOZJDZQD-UHFFFAOYSA-N 491.544 5.804 5 20 JKBD C[C@@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)NCc1ccc(COCc2ccccc2)cc1 604442273 DKYVSLBCQROLHU-QGZVFWFLSA-N 454.910 5.049 5 20 JKBD CCOC(=O)C[C@H](c1ccccc1)C1CCN(C(=O)c2csc(-c3cccc([N+](=O)[O-])c3)n2)CC1 604519559 WLYWXLJGJZRZND-JOCHJYFZSA-N 493.585 5.308 5 20 JKBD O=C(c1cc([N+](=O)[O-])cc2c1OCCO2)N(CCc1ccccc1)c1nc(-c2ccccc2)cs1 608932844 ZMDKWXDCIJRJLE-UHFFFAOYSA-N 487.537 5.379 5 20 JKBD COc1ccccc1[C@H](NCc1ccc(-c2ccc([N+](=O)[O-])cc2Br)o1)c1nccn1C 726607280 NSSJNDFRURAGDD-QFIPXVFZSA-N 497.349 5.239 5 20 JKBD CC(C)(C)OC(=O)NC1CCN(C(=O)CCC(=O)c2ccc3ccc4cccc5ccc2c3c45)CC1 727754881 IAHPNPUFUWODDL-UHFFFAOYSA-N 484.596 6.063 5 20 JKBD O=C(Nc1ccccc1C(=O)Nc1cccc(-c2ncc[nH]2)c1)c1ccc([N+](=O)[O-])cc1Cl 729250396 JEHHKTNNFXHAOW-UHFFFAOYSA-N 461.865 5.143 5 20 JKBD O=C(Nc1ccc(CN2C(=O)Cc3ccc(Cl)cc32)cc1)c1cc(Cl)ccc1[N+](=O)[O-] 745079497 PWMLNALCIJBXMG-UHFFFAOYSA-N 456.285 5.243 5 20 JKBD CC(=O)N(c1nc(COC(=O)c2cc(Cl)ccc2[N+](=O)[O-])cs1)c1c(C)cc(C)cc1Cl 754671635 FNHPOGNKTXREAJ-UHFFFAOYSA-N 494.356 6.017 5 20 JKBD COc1ccc([N+](=O)[O-])cc1OC(=O)c1cc(-c2cc(OC)c(OC)c(OC)c2)nc2ccccc12 899637642 TXTUARWKDVFDQS-UHFFFAOYSA-N 490.468 5.064 5 20 JKBD O=C(Oc1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2Cl)cc1)c1cc2cc(F)ccc2[nH]1 913081544 AZWWWFAQIRAAOS-UHFFFAOYSA-N 453.813 5.340 5 20 JKBD Cc1ccc(-c2nnc(COC(=O)Cc3cn(-c4ccccc4)nc3-c3ccc([N+](=O)[O-])cc3)o2)cc1 914898292 PKHHBJZNSCDROY-UHFFFAOYSA-N 495.495 5.092 5 20 JKBD C[C@@H](OC(=O)c1[nH]c2ccc(Cl)cc2c1Cl)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl 915417497 HWGMONQTOUBLIO-MRVPVSSYSA-N 456.669 5.220 5 20 JKBD COc1ccc(N[C@@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)cc1NC(=O)c1cccc(F)c1 917933200 CBFIGKCIUCVKHM-ZDUSSCGKSA-N 486.887 5.087 5 20 JKBD CN(C)c1ccc([N+](=O)[O-])cc1C(=O)NC1(c2ccc(NC(=O)c3cc4ccccc4o3)cc2)CCC1 1789004418 GZSPMYWQZJHGPJ-UHFFFAOYSA-N 498.539 5.469 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)C34CC(C(F)(F)F)(C3)C4)CCC2)cc1)c1cc(F)cc([N+](=O)[O-])c1 1790695900 VFSQFSWVRMHREC-UHFFFAOYSA-N 491.441 5.214 5 20 JKBD Cc1ccc(C(=O)NC2(c3ccc(NC(=O)c4cc(Cl)cc([N+](=O)[O-])c4C)cc3)CCC2)c(O)n1 1790773860 ILJMGEYDPKXMFR-UHFFFAOYSA-N 494.935 5.027 5 20 JKBD COC1(CC(=O)NC2(c3ccc(NC(=O)c4cc5cc([N+](=O)[O-])ccc5s4)cc3)CCC2)CCC1 1791010382 LZGGFOKVQJKXFG-UHFFFAOYSA-N 493.585 5.516 5 20 JKBD CC1=CC[C@@H](C(=O)NC2(c3ccc(NC(=O)CSc4ccccc4[N+](=O)[O-])cc3)CCC2)CC1 1791522488 YAQBYIYPVSTJPE-LJQANCHMSA-N 479.602 5.567 5 20 JKBD Cc1cc(CCCC(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cccc4ccoc24)C3)c([N+](=O)[O-])cc1F 1793405649 VWQSARLPGQHBGT-WKCHPHFGSA-N 493.535 5.063 5 20 JKBD O=C(CCC1CCCC1)N1CCC([C@H]2CCCCN2C(=O)CCc2cccc([N+](=O)[O-])c2)CC1 1824838111 CRCHUDWWIMKFAB-RUZDIDTESA-N 469.626 5.118 5 20 JKBD O=C(c1ccc([N+](=O)[O-])o1)N1CCC([C@H]2CCCCN2C(=O)c2cc3sccc3s2)CC1 1828547138 MTCJPJLFESTYPG-OAHLLOKOSA-N 473.576 5.011 5 20 JKBD Cc1ccc([N+](=O)[O-])cc1NC(=O)CSc1nnc(-c2ccccc2F)n1-c1ccccc1 9146734 QQKFTEBSDDUDRN-UHFFFAOYSA-N 463.494 5.021 5 20 JKBD CCCCn1c(SCC(=O)Nc2cc([N+](=O)[O-])ccc2Cl)nnc1-c1ccc(OC)cc1 9483490 LVYXOOQXMAIRIJ-UHFFFAOYSA-N 475.958 5.046 5 20 JKBD O=[N+]([O-])c1ccccc1CSc1nnc(-c2ccc(Br)o2)n1Cc1ccccc1 11511302 CSFGAMKKZPSMGY-UHFFFAOYSA-N 471.336 5.549 5 20 JKBD CC(=O)Nc1c(C)cccc1C(=O)O[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1 11811533 HRBBHENTVFTPDV-JOCHJYFZSA-N 481.892 5.052 5 20 JKBD C[C@H](OC(=O)CCc1ncc(-c2ccccc2Cl)o1)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 12255529 LERIDGJHUMCKPL-ZDUSSCGKSA-N 468.853 5.190 5 20 JKBD O=C(CSc1ncnc2scc(-c3ccc(F)cc3)c12)Nc1cc([N+](=O)[O-])ccc1F 21672023 VGCITDUTRCXHSJ-UHFFFAOYSA-N 458.471 5.276 5 20 JKBD C[C@@H](OC(=O)c1ccc(Br)c([N+](=O)[O-])c1)C(=O)Nc1ccccc1Cc1ccccc1 22184105 YJOIVZGBJBJHNT-OAHLLOKOSA-N 483.318 5.132 5 20 JKBD O=C(OCC(=O)N1c2ccccc2Sc2ccccc21)c1ccc(Br)c([N+](=O)[O-])c1 22879805 BVLUUDVXBBGHEX-UHFFFAOYSA-N 485.315 5.344 5 20 JKBD Cc1nnc([C@H](C)OC(=O)c2c3c(nc4ccccc24)/C(=C\c2cccc([N+](=O)[O-])c2)CCC3)o1 109022521 JSPAEXKZMUUDLQ-LUJRCDHRSA-N 470.485 5.629 5 20 JKBD COc1ccccc1-c1nc(C(=O)Nc2nc(-c3ccc(C)c([N+](=O)[O-])c3)cs2)cs1 109452981 ODHPMTILESRSFF-UHFFFAOYSA-N 452.517 5.411 5 20 JKBD CCOc1ccc([C@H](CNC(=O)c2cc(OC)ccc2[N+](=O)[O-])c2c[nH]c3ccccc23)cc1OC 410093934 LDVNJUSNZFOPOO-NRFANRHFSA-N 489.528 5.054 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)N(c2cccc(C(F)(F)F)c2)[C@@H](C)C2CC2)cc1SC 482963019 XNNGHTJCDKUWLH-LBPRGKRZSA-N 454.470 5.789 5 20 JKBD COc1cccc(-c2nc(CSc3nc4cc5ccccc5cc4c(=O)n3C)cs2)c1OC 495355978 ZJQOTZKLJNNXQA-UHFFFAOYSA-N 475.595 5.520 5 20 JKBD CC(C)CCSc1ccc(C(=O)Nc2ccccc2NC2CCN(C)CC2)cc1[N+](=O)[O-] 502623428 MVYDCFDWAFWEIH-UHFFFAOYSA-N 456.612 5.491 5 20 JKBD C[C@H](Nc1ccc(C(=O)N2CCC(c3nc4ccccc4[nH]3)CC2)cc1[N+](=O)[O-])c1ccccn1 506161415 WKPJHWXEDQKWRG-KRWDZBQOSA-N 470.533 5.059 5 20 JKBD COc1cc(C(=O)Nc2ccccc2N2CCC(O)CC2)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 517467845 XEQBFDOAIXUHIP-UHFFFAOYSA-N 497.935 5.263 5 20 JKBD C[C@H](NCc1ccc(-c2cccc([N+](=O)[O-])c2)o1)c1ccc(NC(=O)c2ccc(F)cc2)cc1 558931665 HZLRWQKBJPNKNK-KRWDZBQOSA-N 459.477 6.097 5 20 JKBD Cc1ccc(C(=O)Nc2ccc([N+](=O)[O-])cc2C(=O)c2ccccc2)cc1NC(=O)c1ccco1 589251631 VFNIDDHVXAZYES-UHFFFAOYSA-N 469.453 5.232 5 20 JKBD O=C(C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)NCc1ccccc1OC(F)F 590767598 DHNTXZKZSNVEBF-AQTBWJFISA-N 495.507 6.053 5 20 JKBD C[C@@H]1CCCN(c2ccc(C(=O)Nc3ccc(NC(=O)C4CC4)cc3C(F)(F)F)cc2[N+](=O)[O-])C1 590873013 HOTAOSAZLNZZKM-CQSZACIVSA-N 490.482 5.451 5 20 JKBD C[C@@H](c1cccs1)N(Cc1ccccc1)C(=O)c1ccc(Sc2nncn2C)c([N+](=O)[O-])c1 603531151 HFFADWGQBNUHPL-INIZCTEOSA-N 479.587 5.340 5 20 JKBD Cc1cc(NC(=O)c2ccc(F)cc2Cl)sc1C(=O)Nc1ccc([N+](=O)[O-])cc1F 608870557 HLIHLAPAJQLLSN-UHFFFAOYSA-N 451.838 5.401 5 20 JKBD O=C(Nc1nc2cc(C(F)(F)F)ccc2n1Cc1ccco1)c1c[nH]c2cc([N+](=O)[O-])ccc12 608880047 PWNKHXPNGMHLOB-UHFFFAOYSA-N 469.379 5.338 5 20 JKBD O=C(N[C@H](c1ccccc1)C1CC1)c1ccc(C(=O)N[C@H](c2ccccc2)C2CC2)c([N+](=O)[O-])c1 609043631 FXGOZQVVSASPEU-CLJLJLNGSA-N 469.541 5.357 5 20 JKBD CC(C)Oc1ccc(NC(=O)c2ccc(N3CCC[C@@H](C)C3)c([N+](=O)[O-])c2)c(C(F)(F)F)c1 609188973 RCFAAAGBWRVKJV-OAHLLOKOSA-N 465.472 5.889 5 20 JKBD Cc1ccc(NC(=O)[C@@H](OC(=O)c2cc([N+](=O)[O-])ccc2Br)c2ccccc2)cc1 725984558 JTCREOXBCQAAAZ-FQEVSTJZSA-N 469.291 5.203 5 20 JKBD CO[C@@H](C)c1cccc(NC(=O)c2ccccc2NC(=O)c2ccc([N+](=O)[O-])cc2Cl)c1 726956677 DBSGCQVOJBMUOS-AWEZNQCLSA-N 453.882 5.460 5 20 JKBD C[C@H](NC(C)(C)CNC(=O)c1ccccc1NC(=O)c1ccc([N+](=O)[O-])cc1Cl)c1ccccc1 729250773 VFZSSZPCCJGKKB-KRWDZBQOSA-N 494.979 5.360 5 20 JKBD CCc1cccc(NC(=S)Nc2ccc(NS(=O)(=O)c3ccc(C)c([N+](=O)[O-])c3)cc2)c1 730592499 FESOFKLRGLIDOI-UHFFFAOYSA-N 470.576 5.075 5 20 JKBD Cc1cc(-c2csc(NC(=O)CCn3cc([N+](=O)[O-])cn3)n2)c(C)n1Cc1ccccc1Cl 744313392 IWDRHDFXDNCKDG-UHFFFAOYSA-N 484.969 5.064 5 20 JKBD C[C@H](Nc1ccc(C(=O)OCc2csc(C3CCCC3)n2)cc1[N+](=O)[O-])c1ccccn1 746584257 WKOHSPUSKNXVEB-HNNXBMFYSA-N 452.536 5.634 5 20 JKBD Cc1c([N+](=O)[O-])cc(C(=O)Nc2ncc(Cc3ccc(C(F)(F)F)cc3)s2)cc1[N+](=O)[O-] 875009054 NRPRWLKXSKIKJT-UHFFFAOYSA-N 466.397 5.130 5 20 JKBD C[C@@H](Oc1ccc(Cl)cc1[N+](=O)[O-])c1nc(-c2ccc(Oc3ccc(F)cc3)nc2)no1 904509570 IDXIUUOYHBQOFK-GFCCVEGCSA-N 456.817 5.765 5 20 JKBD O=C(NCCNc1ccc([N+](=O)[O-])cc1)Nc1ccccc1SC[C@H]1CC1(Cl)Cl 916696169 QNRDIFJCSRWXIM-CYBMUJFWSA-N 455.367 5.114 5 20 JKBD O=C(Nc1cc(Cl)c([N+](=O)[O-])cc1OCc1ccccc1)c1cc2ccccc2oc1=O 916827224 CCENKEJSVYEOPC-UHFFFAOYSA-N 450.834 5.186 5 20 JKBD COc1ccc(CCCN(C)C(=O)c2ccccc2NC(=O)c2ccc([N+](=O)[O-])cc2Cl)cc1 918686683 KWITVBDGJGCUBS-UHFFFAOYSA-N 481.936 5.214 5 20 JKBD C[C@H](Nc1ccc(C(=O)Nc2ccc(N3CCCC3=O)c(Cl)c2)cc1[N+](=O)[O-])c1ccccn1 919698378 HSRGLSJJVAFGHA-HNNXBMFYSA-N 479.924 5.195 5 20 JKBD CCC(CC)c1cc[n+](/C(C(=S)Nc2ccc3c(c2)CCC3)=C(/O)c2ccc([N+](=O)[O-])cc2)cc1 920395051 DFTVOGSQKLISHQ-UHFFFAOYSA-O 488.633 6.598 5 20 JKBD O=C(NC1(c2ccc(NC(=O)c3ccccc3Cl)cc2)CCC1)c1cc(O)cc([N+](=O)[O-])c1 1790225617 GFNITURGGZFPOV-UHFFFAOYSA-N 465.893 5.015 5 20 JKBD O=C(NC1(c2ccc(NC(=O)[C@@H]3CCc4cccc(Cl)c43)cc2)CCC1)c1ccc([N+](=O)[O-])o1 1791138679 NIKYIDAUJTUZSD-GOSISDBHSA-N 479.920 5.319 5 20 JKBD O=C(/C=C/c1ccccc1[N+](=O)[O-])Nc1ccc(C2(NC(=O)CS[C@H]3CCCCO3)CCC2)cc1 1792317653 AUSYWZOMXFNMHO-SXAZAVRTSA-N 495.601 5.002 5 20 JKBD Cc1ccc(CC(=O)N2CCC3(CCCN(C(=O)[C@@H](c4ccccc4)C(C)C)C3)CC2)cc1[N+](=O)[O-] 1805622797 BFJBXZICVKJECP-HHHXNRCGSA-N 491.632 5.117 5 20 JKBD CC(C)c1ccc(C(=O)NC[C@H]2CCN(C(=O)/C=C/c3ccccc3[N+](=O)[O-])[C@@H]2c2cccnc2)cc1 1811957356 MBABFESDBZRFOF-XRVJWVRBSA-N 498.583 5.146 5 20 JKBD O=C(Cc1cccc([N+](=O)[O-])c1)Nc1cc([C@@H]2CCCCN2C(=O)[C@@H]2CCC[C@H]3CCCC[C@H]32)[nH]n1 1814375059 IOGHMYUSPISFBN-YJRNTSOCSA-N 493.608 5.159 5 20 JKBD C[C@@H](C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2ccc([N+](=O)[O-])cc2F)n[nH]1)c1ccc(Cl)cc1 1821049308 JMDXTGZJJFFQJH-SPLOXXLWSA-N 499.930 5.220 5 20 JKBD Cc1c(C(=O)Nc2cc([C@H]3CCCCN3C(=O)[C@@H](F)c3ccccc3)[nH]n2)cc(Cl)cc1[N+](=O)[O-] 1821289760 KPIZQYMKHPDTOO-KNQAVFIVSA-N 499.930 5.296 5 20 JKBD C[C@@H]1CCC[C@H]1C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)CC1 1828485975 DZGRXZSJROHZCA-ZPMCFJSWSA-N 483.634 5.479 5 20 JKBD Cc1nn(Cc2ccc(C(=O)Nc3ccc(-n4cnc5ccccc54)cc3)cc2)c(C)c1[N+](=O)[O-] 10428204 ZRVXNBANYRMYIV-UHFFFAOYSA-N 466.501 5.048 5 20 JKBD CCNc1ccc(C(=O)O[C@H](C)C(=O)Nc2c(Cl)cc(Cl)cc2Cl)cc1[N+](=O)[O-] 10530958 QLWUYYHCAKVTQQ-SECBINFHSA-N 460.701 5.171 5 20 JKBD Cc1nc(CSc2ccccc2C(=O)OCC(=O)Nc2cc([N+](=O)[O-])ccc2Cl)cs1 11595861 RIZHFEYWYRAXKL-UHFFFAOYSA-N 477.951 5.101 5 20 JKBD COc1ccc([N+](=O)[O-])cc1NC(=O)c1cc2c(C)nn(Cc3ccccc3Cl)c2s1 14877015 JDVFDWASYNZLPB-UHFFFAOYSA-N 456.911 5.277 5 20 JKBD O=C(NCc1ccccc1)C1CCN(C(=O)c2ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])cc2)CC1 15175247 OYQWDMZENYANMG-UHFFFAOYSA-N 493.947 5.209 5 20 JKBD Cc1cccc(C)c1NC(=O)[C@@H](C)Oc1ccc2c(-c3ccc([N+](=O)[O-])cc3)cc(=O)oc2c1 15370887 SLMMERUBNNHKKW-QGZVFWFLSA-N 458.470 5.391 5 20 JKBD C[C@@H](OC(=O)c1ccccc1OCc1ccc(F)cc1)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 17537946 LPRPQUCFYAGXDP-OAHLLOKOSA-N 463.421 5.281 5 20 JKBD O=C(COC(=O)Cc1csc(-c2ccccc2Cl)n1)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 26674228 XOKYABFINKLHID-UHFFFAOYSA-N 499.854 5.115 5 20 JKBD Cc1nc(-c2c[nH]c(C(=O)Oc3ccc(NC(=O)c4cc([N+](=O)[O-])ccc4Cl)cc3)c2)cs1 29474585 JHINGLHKDMNQHV-UHFFFAOYSA-N 482.905 5.480 5 20 JKBD COc1ccc(NC(=O)c2ccc([N+](=O)[O-])cc2F)cc1NC(=O)c1ccc(Cl)cc1F 302931219 DBVAZAYJXJLCHA-UHFFFAOYSA-N 461.808 5.040 5 20 JKBD COc1cc([C@H](C)NC(=O)c2ccc(Sc3nc(C)cs3)c([N+](=O)[O-])c2)cc(OC)c1OC 482464046 NGSFKKLMFWVULI-ZDUSSCGKSA-N 489.575 5.028 5 20 JKBD NC(=O)Nc1ccc(NC(=O)C/C(=C/c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)cc1 485263484 WOUXZIQMTGHHNX-SSZFMOIBSA-N 473.514 5.265 5 20 JKBD O=C(N[C@@H](c1ccc(F)cc1)c1ccccc1Cl)C1CCN(c2ccccc2[N+](=O)[O-])CC1 486605629 MXYDWFYEOAGZML-DEOSSOPVSA-N 467.928 5.510 5 20 JKBD O=C(Cn1c2ccccc2c(=O)c2ccccc21)N[C@@H](c1ccc(F)cc1)c1ccccc1Cl 502371845 XVWOWBSZZBVCQY-MHZLTWQESA-N 470.931 5.853 5 20 JKBD CCOc1ccc(C(=O)Nc2ccc(Cl)cc2C(=O)N2[C@H](C)CCC[C@H]2C)cc1[N+](=O)[O-] 512352461 MSSNPLJXLZQZHU-HUUCEWRRSA-N 459.930 5.302 5 20 JKBD Cc1csc(Sc2ccc(C(=O)Nc3nc(-c4sc(C)nc4C)cs3)cc2[N+](=O)[O-])n1 514830264 YUSWOYOFZQSRKA-UHFFFAOYSA-N 489.629 5.960 5 20 JKBD CC[C@@H](C)NC(=O)c1cccc(CN[C@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2ccccc2)c1 515759730 WNJVQIOPNLDLPH-OSPHWJPCSA-N 494.979 5.246 5 20 JKBD O=C(C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)NCc1ccc2c(c1)CCO2 522278834 JISVKIVQZHJDDF-DEDYPNTBSA-N 471.538 5.387 5 20 JKBD O=C(Cn1c2ccccc2c(=O)c2ccccc21)N(Cc1ccccc1F)c1ccc(F)cc1 591795046 QCHRZSHBHICTAN-UHFFFAOYSA-N 454.476 5.666 5 20 JKBD CCOC(=O)c1sc(N(C(=O)[C@H](C)Sc2ccc([N+](=O)[O-])cc2)c2ccccc2)nc1C 603739507 RZUQGMVGAZZMNW-HNNXBMFYSA-N 471.560 5.382 5 20 JKBD O=C(Cc1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1)Nc1ccc(OC(F)F)c(F)c1 603970845 KOFYAJDTTIKUTA-UHFFFAOYSA-N 482.418 5.369 5 20 JKBD O=c1c(Cl)c(NC2C[C@H](C(F)(F)F)C[C@@H](C(F)(F)F)C2)cnn1-c1ccc([N+](=O)[O-])cc1 608830583 GNAZAMGZBPCPNK-NXEZZACHSA-N 484.784 5.116 5 20 JKBD Cn1cc(C(=O)Nc2ccc(Oc3ccc(F)cc3)c3ccncc23)c(-c2ccc([N+](=O)[O-])cc2)n1 609032756 GDQWXMTUXRPBMZ-UHFFFAOYSA-N 483.459 5.727 5 20 JKBD O=C(Cn1c2ccccc2c(=O)c2ccccc21)Oc1ccc(NC(=O)c2ccc(F)cc2)cc1 728244862 OJSUCUQIZHSKNV-UHFFFAOYSA-N 466.468 5.152 5 20 JKBD COc1cc(C(=O)O[C@@H](C)c2nc(-c3cccnc3)no2)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 825130668 CTRNOAAJRLIWGH-ZDUSSCGKSA-N 496.863 5.412 5 20 JKBD O=C(Nc1cc([N+](=O)[O-])c(F)cc1F)c1cccnc1Sc1ccc(Br)cc1 897492573 AZDSAEBMLFCZFX-UHFFFAOYSA-N 466.263 5.434 5 20 JKBD O=C1CCCc2cc(C(=O)O[C@@H](C(=O)Nc3ccc([N+](=O)[O-])cc3Cl)c3ccccc3)ccc2N1 915436646 MNTBMKPDWVYYJM-HSZRJFAPSA-N 493.903 5.060 5 20 JKBD CCC(C)(C)NC(=O)c1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2N2CCCC2)cc1Cl 918645154 BYPYWVOSYFZZSP-UHFFFAOYSA-N 458.946 5.019 5 20 JKBD Cc1cc(C(=O)NC2CCCC2)ccc1NC(=O)c1cc([N+](=O)[O-])ccc1N1CCC(C)CC1 920882357 MUJLPRDAPHZAIE-UHFFFAOYSA-N 464.566 5.064 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)[C@@H]3C[C@@H]3c3ccc(F)c(F)c3)CCC2)cc1)c1ccc([N+](=O)[O-])o1 1785748800 RUMZMDUKPGMIPW-QZTJIDSGSA-N 481.455 5.017 5 20 JKBD Cc1cc(CCCC(=O)NC2(c3ccc(NC(=O)c4oncc4C)cc3)CCC2)c([N+](=O)[O-])cc1F 1789977544 XUYYZMXJDCHCFI-UHFFFAOYSA-N 494.523 5.109 5 20 JKBD Cc1ccoc1C(=O)NC1(c2ccc(NC(=O)c3c(F)ccc([N+](=O)[O-])c3C)cc2)CCC1 1790771157 SEVMIKUTYIZUKH-UHFFFAOYSA-N 451.454 5.005 5 20 JKBD Cc1ccc(C(=O)N2CCCC3(CCN(C(=O)c4cc5cc([N+](=O)[O-])ccc5s4)CC3)C2)s1 1808095187 JINBIXQAOIZXGM-UHFFFAOYSA-N 483.615 5.338 5 20 JKBD CC(C)(C)CCCCCC(=O)NC[C@H]1CCN(C(=O)/C=C/c2ccc([N+](=O)[O-])o2)[C@H]1c1cccnc1 1812804569 OXAXNDWNVPBPIL-FOVHPINOSA-N 496.608 5.299 5 20 JKBD O=C(/C=C/c1ccccc1[N+](=O)[O-])Nc1cc([C@H]2CCCCN2C(=O)c2ccccc2C2CC2)[nH]n1 1823503193 OGWLMCPHSGMUOU-DKUDOZJNSA-N 485.544 5.215 5 20 JKBD O=C(c1cc(F)ccc1Cl)N1CCC([C@H]2CCCCN2C(=O)c2cc(F)cc([N+](=O)[O-])c2)CC1 1830618221 OKOCNECXLWRIFF-JOCHJYFZSA-N 491.922 5.074 5 20 JKBD O=C(CSc1ccccc1[N+](=O)[O-])N1CCC([C@@H]2CCCCN2C(=O)C[C@H]2C[C@@H]3CC[C@H]2C3)CC1 1831484129 VQMSSSBBQMDXRB-PNJWGLBASA-N 499.677 5.133 5 20 JKBD Cc1cccc([N+](=O)[O-])c1NC(=O)COC(=O)CCc1c(-c2ccccc2)[nH]c2ccc(F)cc12 10636304 QOBLRFYQOAUXRQ-UHFFFAOYSA-N 475.476 5.305 5 20 JKBD Cc1ccc(NC(=O)[C@@H](OC(=O)Cn2c3ccccc3c(=O)c3ccccc32)c2ccccc2)cc1 11277025 PBODYQDXVIAFMG-LJAQVGFWSA-N 476.532 5.386 5 20 JKBD Cc1nn(Cc2ccc(C(=O)N[C@H]3CCSc4ccc(Cl)cc43)cc2)c(C)c1[N+](=O)[O-] 12620415 RMPYIELHRALZBT-IBGZPJMESA-N 456.955 5.077 5 20 JKBD C[C@@H](OC(=O)c1ccc(-c2ccccc2)cc1)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 20989064 CNEFPOJUIVACKG-CQSZACIVSA-N 458.392 5.465 5 20 JKBD Cc1sc2nc(S[C@H](C)C(=O)Nc3cccc([N+](=O)[O-])c3C)n(C3CCCC3)c(=O)c2c1C 24018394 JXDDSLLBJZAOIK-OAHLLOKOSA-N 486.619 5.526 5 20 JKBD CN(Cc1cc([N+](=O)[O-])ccc1Cl)Cn1nc(-c2ccncc2)n(-c2ccccc2)c1=S 27532911 ASEQGNDYKJPRKQ-UHFFFAOYSA-N 466.954 5.116 5 20 JKBD Cc1ccc(NC(=O)Cc2nc(COc3ccc([N+](=O)[O-])cc3C(F)(F)F)cs2)cc1 72048597 JGHLGIURNAZILK-UHFFFAOYSA-N 451.426 5.139 5 20 JKBD Cc1noc(C)c1CSc1ncccc1C(=O)Nc1nc(-c2cccc([N+](=O)[O-])c2)c(C)s1 195703947 NMVRPOOBGHFJGK-UHFFFAOYSA-N 481.559 5.571 5 20 JKBD O=C(Nc1ccccc1)c1nnc(/C(Cl)=C\c2ccc(-c3cccc([N+](=O)[O-])c3)o2)s1 210160814 AUAKFGNNHLSLAK-SFQUDFHCSA-N 452.879 5.696 5 20 JKBD Cc1c(C(=O)N[C@H](c2ccccc2)c2ccc3nc(C(F)(F)F)[nH]c3c2)cc([N+](=O)[O-])cc1[N+](=O)[O-] 247987990 KPOSWBVIIFDJFZ-HXUWFJFHSA-N 499.405 5.226 5 20 JKBD O=C(Cc1cccs1)Nc1ccccc1NC(=O)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-] 409982226 DAADACPMXIEXPR-UHFFFAOYSA-N 479.436 5.031 5 20 JKBD O=C(C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)Nc1ccc2c(c1)CCCC(=O)N2 483866221 LHNVOHAXOQAYAZ-RGEXLXHISA-N 498.564 6.049 5 20 JKBD COc1cc(C(=O)N[C@H](C)c2ccc(OCc3ccc(F)cc3)cc2)c([N+](=O)[O-])cc1OC(F)F 485621409 ABUWASOCSBIUGB-CQSZACIVSA-N 490.434 5.414 5 20 JKBD COc1ccc([C@@H](NC(=O)N[C@H](C)c2cccc([N+](=O)[O-])c2)c2ccccc2)cc1Br 490268208 CNWFIMMUJPACRS-QRQCRPRQSA-N 484.350 5.516 5 20 JKBD O=C(c1csc(-c2ccc([N+](=O)[O-])cc2)n1)N(Cc1cccnc1)c1ccc(Br)cc1 496591067 IJWNJRAUNJQPQF-UHFFFAOYSA-N 495.358 5.723 5 20 JKBD CCC(=O)Nc1ccc(Cl)c(NC(=O)c2cc([N+](=O)[O-])ccc2Oc2ccc(OC)cc2)c1 500930388 YCHDNLIZZIDMSW-UHFFFAOYSA-N 469.881 5.650 5 20 JKBD C[C@@H](Nc1ccc(C(=O)Nc2cc(Cl)ccc2OC[C@H]2CCCO2)cc1[N+](=O)[O-])c1ccccn1 509814314 SZFVEZXRXMJPJC-VQIMIIECSA-N 496.951 5.626 5 20 JKBD CC(C)Oc1ccc([N+](=O)[O-])cc1CSc1nnc(-c2cccs2)n1C[C@H]1CCCO1 511059068 WWUMRZFEPVWNOM-QGZVFWFLSA-N 460.581 5.173 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Cl)[C@H](NC[C@H]1CCCO[C@H]1c1ccccc1)c1ccccc1 518002900 JWCILCHCWZTIAV-ZPZUNKDASA-N 479.964 5.686 5 20 JKBD CCCCc1ccc([C@@H](NC(=O)CNC(=O)c2c(Cl)cccc2[N+](=O)[O-])c2cccs2)cc1 518654624 KRCKXOOHCUUZDM-HSZRJFAPSA-N 485.993 5.288 5 20 JKBD C[C@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)Nc1cc(-c2nnc3n2CCCCC3)ccc1Cl 591557678 GHCCCRKDVMIJOY-AWEZNQCLSA-N 471.970 5.352 5 20 JKBD COc1ccc([C@@H](CNC(=O)[C@@H](C)Sc2ccc([N+](=O)[O-])cc2)c2c[nH]c3ccccc23)cc1 603819593 NIWKDUCRBXXPOM-UZUQRXQVSA-N 475.570 5.514 5 20 JKBD Cc1cccc(OC(F)F)c1NC(=O)C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1 608808152 SLKVNLBUYXIDKB-GHRIWEEISA-N 495.507 6.684 5 20 JKBD COc1ccc(NC(=O)c2ccc(N3C[C@@H](C)C[C@H](C)C3)c([N+](=O)[O-])c2)c(Br)c1 608901023 QXEPZWPTJJMBGH-KBPBESRZSA-N 462.344 5.101 5 20 JKBD Cc1ccc(-c2noc(CCC(=O)N(CC3CC3)c3ccc(Cl)c([N+](=O)[O-])c3)n2)cc1F 728167234 UOHVUCHCSUZJLF-UHFFFAOYSA-N 458.877 5.122 5 20 JKBD CC(C(=O)OCC(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F)(c1ccccc1)c1ccccc1 729757535 PSKAHRJUFGTMPX-UHFFFAOYSA-N 472.419 5.102 5 20 JKBD CCOC(=O)Nc1ccc(OC(=O)c2ccccc2C(=O)c2ccc(SC)c([N+](=O)[O-])c2)cc1 730754027 GWUADVKELXGXMC-UHFFFAOYSA-N 480.498 5.335 5 20 JKBD COc1ccc([N+](=O)[O-])cc1NC(=O)[C@@H](C)OC(=O)c1csc(-c2ccc(Cl)c(Cl)c2)n1 744604842 LIPRUGWMAKCXFI-SNVBAGLBSA-N 496.328 5.218 5 20 JKBD Cc1cc(NC(=O)CSc2ccc(C(F)(F)F)cc2[N+](=O)[O-])ccc1N1CCSCC1 749820962 PSXYKNJHBYSUHS-UHFFFAOYSA-N 471.526 5.206 5 20 JKBD COc1cc2c(cc1OC)[C@@H](c1cccs1)N(C(=O)c1cc(Cl)ccc1[N+](=O)[O-])CC2 863935602 QZNULHKGAICAFW-NRFANRHFSA-N 458.923 5.115 5 20 JKBD Cc1cccc(-c2nnc(-c3ccc(C(=O)OCc4nc(-c5cccc([N+](=O)[O-])c5)no4)cc3)o2)c1 914900131 DHPWBPLYBGZCFY-UHFFFAOYSA-N 483.440 5.027 5 20 JKBD O=c1c2cc([N+](=O)[O-])ccc2nc2n1CC/C2=C/c1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1 916127404 SHTRRLHUXHPINH-XFXZXTDPSA-N 464.821 5.071 5 20 JKBD CC(C)Oc1cccc(CNC(=O)c2ccccc2NC(=O)c2ccc([N+](=O)[O-])cc2Cl)c1 918621663 NVYBKTTZAHTFMU-UHFFFAOYSA-N 467.909 5.218 5 20 JKBD Cn1cc(C(=O)Nc2nc3ccc(SC(F)F)cc3s2)c(-c2ccc([N+](=O)[O-])cc2)n1 919679127 SLPJIQOHASZMAC-UHFFFAOYSA-N 461.475 5.172 5 20 JKBD CCn1c(SCC(=O)Oc2ccc(-c3ccccc3)cc2[N+](=O)[O-])nnc1-c1cccs1 920331013 STDSSFFSAZXNHE-UHFFFAOYSA-N 466.544 5.299 5 20 JKBD Cc1cc(O)c([N+](=O)[O-])cc1C(=O)NC1(c2ccc(NC(=O)c3cc4sccc4[nH]3)cc2)CCC1 1789371272 VPYRCNVVOVMJLK-UHFFFAOYSA-N 490.541 5.213 5 20 JKBD COc1ccc(Cl)cc1C(=O)Nc1ccc(C2(NC(=O)c3cc(O)cc([N+](=O)[O-])c3)CCC2)cc1 1790345531 VNNDKKNWEPUFFY-UHFFFAOYSA-N 495.919 5.024 5 20 JKBD CC(C)/C=C/C(=O)NC1(c2ccc(NC(=O)CSc3ccccc3[N+](=O)[O-])cc2)CCC1 1791523364 PFXWZGWPOUWAAI-MDWZMJQESA-N 453.564 5.033 5 20 JKBD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1sc2ccccc2c1Cl)c1cccc(F)c1[N+](=O)[O-] 1797462632 BIEPWGNQMDZZBA-BTTYYORXSA-N 487.940 5.168 5 20 JKBD Cc1occc1C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)CC1 1825911101 GPBASNFDDFWVPF-NRFANRHFSA-N 481.574 5.258 5 20 JKBD Cc1cncc(C(=O)N2CCCC[C@H]2C2CCN(C(=O)c3cc4cc([N+](=O)[O-])ccc4s3)CC2)c1 1826009599 VBLDTBBSLFYLRN-QFIPXVFZSA-N 492.601 5.060 5 20 JKBD O=C(/C=C/c1ccccc1[N+](=O)[O-])N1CCC([C@H]2CCCCN2C(=O)c2ccccc2Cl)CC1 1829896123 HVRQTMWLTFAGTF-MDRMPYQZSA-N 481.980 5.195 5 20 JKBD Cc1ccnc(C(=O)N2CCC([C@@H]3CCCCN3C(=O)c3cc4cc([N+](=O)[O-])ccc4s3)CC2)c1 1831060826 HBLIEQPCBWUDJL-QFIPXVFZSA-N 492.601 5.060 5 20 JKBD C[C@H](Sc1nnc(-c2ccc(Br)cc2)o1)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl 8758826 DCWZDYFJOUHIMF-VIFPVBQESA-N 483.731 5.180 5 20 JKBD Cc1ccc(-c2cc(C(=O)O[C@H](C)c3nnc(-c4ccc([N+](=O)[O-])cc4)o3)c3c(C)noc3n2)cc1 12178034 QDSLSDGCEMVQSB-OAHLLOKOSA-N 485.456 5.383 5 20 JKBD COc1cc(CSc2nn(-c3ccccc3)c(=S)s2)c([N+](=O)[O-])cc1OC(F)F 12723460 BYLWOFJGMPQJFJ-UHFFFAOYSA-N 457.505 5.474 5 20 JKBD COc1ccc(C(=O)Nc2cccc(C(=O)Nc3cccc(C(F)(F)F)c3)c2)cc1[N+](=O)[O-] 14907690 LTDJXASQXAMQSN-UHFFFAOYSA-N 459.380 5.127 5 20 JKBD CCn1c(S[C@H](C)C(=O)Nc2ccc(OC)cc2[N+](=O)[O-])nnc1-c1ccc(C(C)(C)C)cc1 16866131 XMKJRDQFBWWLTP-OAHLLOKOSA-N 483.594 5.299 5 20 JKBD Cc1csc(Sc2ccc(C(=O)N3CCC[C@H](c4nc5ccccc5s4)C3)cc2[N+](=O)[O-])n1 18017187 WVASVOHXPLXSEK-INIZCTEOSA-N 496.639 6.140 5 20 JKBD CCOc1cc([N+](=O)[O-])c(C(=O)O[C@H](C)C(=O)Nc2c(Cl)cc(Cl)cc2Cl)cc1OC 18969306 SRFLWBSEFIJLRN-SECBINFHSA-N 491.711 5.146 5 20 JKBD C[C@@H](Sc1nc2cc3ccccc3cc2c(=O)n1C)C(=O)Nc1ccccc1-c1ccccc1 22253585 PZATYGUSSSXTQR-GOSISDBHSA-N 465.578 5.873 5 20 JKBD CCn1c(SCC(=O)Nc2cc([N+](=O)[O-])ccc2C)nnc1-c1ccc(C(C)(C)C)cc1 23554476 QUIMEOPASWRVDW-UHFFFAOYSA-N 453.568 5.210 5 20 JKBD Cc1cc(CN(C)C(=O)c2c3c(nc4ccccc24)/C(=C/c2ccc([N+](=O)[O-])cc2)CCC3)no1 25138172 RQDNHTUTQPYQHM-XDJHFCHBSA-N 468.513 5.589 5 20 JKBD COc1cc(CN2CCc3sccc3[C@@H]2c2cccs2)c([N+](=O)[O-])cc1OC(F)F 29594579 SGWSLVZPLSUHQZ-LJQANCHMSA-N 452.504 5.476 5 20 JKBD Cn1c(SCc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)nnc1-c1ccc(C(C)(C)C)cc1 29833490 ICWAPNVGLILSGP-UHFFFAOYSA-N 450.524 5.030 5 20 JKBD O=[N+]([O-])c1ccc(-c2nnc(CSc3nnc(Nc4cccc(Br)c4)s3)o2)cc1 31692915 LWYWDUUQNJSNNP-UHFFFAOYSA-N 491.352 5.295 5 20 JKBD COc1ccc(Oc2ccc([N+](=O)[O-])cc2C(=O)Nc2cc(OC)ccc2Br)cc1 503467636 IYJXUHAXBVCUHC-UHFFFAOYSA-N 473.279 5.419 5 20 JKBD Cn1ccnc1[C@H](NCc1ccc(Oc2ccccc2Cl)c([N+](=O)[O-])c1)c1ccc(F)cc1 509597504 BATFPMBTTSOPNT-HSZRJFAPSA-N 466.900 5.792 5 20 JKBD C[C@@H]1CN(c2ccc(CNCc3ccc(Oc4ccccc4Cl)c([N+](=O)[O-])c3)cn2)C[C@@H](C)O1 509598620 CLOODRFBQPLPHP-QZTJIDSGSA-N 482.968 5.339 5 20 JKBD C[C@H](NCc1ccc(Oc2ccccc2Cl)c([N+](=O)[O-])c1)c1cccc(S(=O)(=O)N(C)C)c1 520963651 WFYMQMSNTWYRMW-INIZCTEOSA-N 489.981 5.142 5 20 JKBD Cc1nn(CCC(=O)N(Cc2ccc(Br)cc2)c2ccc(F)cc2F)c(C)c1[N+](=O)[O-] 522571502 ZIHXLCKOLGFPKE-UHFFFAOYSA-N 493.308 5.072 5 20 JKBD O=C(c1csc(-c2cccc([N+](=O)[O-])c2)n1)N1CCC[C@H](c2nc3ccccc3s2)C1 522639737 LVJDPNQMJDTESV-HNNXBMFYSA-N 450.545 5.348 5 20 JKBD O=C(Cn1c2ccccc2c(=O)c2ccccc21)N1CCCC[C@@H]1c1ccc(C(F)(F)F)cc1 588376723 QXTBGTGPLSPMPL-JOCHJYFZSA-N 464.487 5.927 5 20 JKBD CN(Cc1cccnc1)C(=O)c1c2c(nc3ccccc13)/C(=C/c1cccc([N+](=O)[O-])c1)CCC2 600814204 AQEHZBHZSJYYTD-RCCKNPSSSA-N 464.525 5.687 5 20 JKBD O=C(C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)Nc1ccc2c(c1)NC(=O)CO2 603452775 ARRKQUNKPBZJQD-LFIBNONCSA-N 486.509 5.105 5 20 JKBD CCCN(CC(=O)Nc1ccc(Cl)cc1Cl)C(=O)c1cc2cc([N+](=O)[O-])ccc2o1 603731595 ZKDDXINLNCKHOO-UHFFFAOYSA-N 450.278 5.139 5 20 JKBD Cc1ccc(S(=O)(=O)Cc2ccc(C(=O)Nc3nc(-c4cccc([N+](=O)[O-])c4)cs3)cc2)cc1 603749945 LUCXREWPBTZZTK-UHFFFAOYSA-N 493.566 5.253 5 20 JKBD COc1cccc(/C=C(\CC(=O)N[C@H](C)c2cccc([N+](=O)[O-])c2)c2nc3ccccc3s2)c1 603966491 AMJSHDNUJMWXIM-UOBPLZBXSA-N 473.554 6.021 5 20 JKBD O=C(c1ccc(NCc2ccccc2)c([N+](=O)[O-])c1)N1C[C@@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1 604262523 NAUJQDXUAVEGDV-IYBDPMFKSA-N 475.389 5.410 5 20 JKBD O=C(c1csc(-c2cccc([N+](=O)[O-])c2)n1)N1CCc2[nH]c3c(Br)cccc3c2C1 604519478 SIABFQNXUIOIIE-UHFFFAOYSA-N 483.347 5.161 5 20 JKBD C[C@H](Nc1ccc(C(=O)Nc2cc(-c3cccc(Cl)c3)[nH]n2)cc1[N+](=O)[O-])c1ccccn1 604521995 BWIGUHMQPANSIT-AWEZNQCLSA-N 462.897 5.459 5 20 JKBD Cc1ccc(OCCCC(=O)Nc2ccc(CNC(=O)c3c[nH]c4ccc([N+](=O)[O-])cc34)cc2)cc1 604546064 OICUPBGVJRUQKA-UHFFFAOYSA-N 486.528 5.112 5 20 JKBD COC(=O)c1ccc2c(O)nc(/C=C/c3ccc(-c4ccc([N+](=O)[O-])cc4Br)o3)nc2c1 608801348 XPHURDNRNHVZHX-WEVVVXLNSA-N 496.273 5.223 5 20 JKBD C[C@H](Nc1ccc(C(=O)Nc2ccc(-n3cnc4ccccc43)nc2)cc1[N+](=O)[O-])c1ccccn1 729246305 CJYZAAGXGKJLTK-KRWDZBQOSA-N 479.500 5.149 5 20 JKBD CC(C)(C)OC(=O)N1CCC[C@H]1[C@@H]1CCCN(C(=O)c2cc3ccccc3c3cccnc23)C1 749648346 NUIMNSAHGZSMCN-YKSBVNFPSA-N 459.590 5.640 5 20 JKBD O=C(COC(=O)/C(=C\c1ccc(F)cc1)c1cccs1)Nc1cc([N+](=O)[O-])ccc1Cl 772145684 JTWMOSGFPGJUOR-YBEGLDIGSA-N 460.870 5.171 5 20 JKBD CC(=O)N(c1cccc(C(F)(F)F)c1)c1nc(CN(C)Cc2cc([N+](=O)[O-])ccc2Cl)cs1 788465172 ZGQHUAFICNRVOU-UHFFFAOYSA-N 498.914 6.040 5 20 JKBD O=[N+]([O-])c1cc(CNc2ccc(S(=O)(=O)NC3CC3)cc2)ccc1Oc1ccccc1Cl 863995368 RLEVCIIAWQWTJA-UHFFFAOYSA-N 473.938 5.093 5 20 JKBD COC(=O)c1ccc2c(=O)nc(/C(Cl)=C\c3ccc(N(C)c4ccccc4)c([N+](=O)[O-])c3)[nH]c2c1 916127118 DRHBHPHZZDBAGJ-XDHOZWIPSA-N 490.903 5.123 5 20 JKBD COC(=O)Nc1ccc(N[C@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2ccccc2)cc1 917938971 RKGXZNSCGPWMEG-FQEVSTJZSA-N 454.870 5.218 5 20 JKBD Cc1ccc(-c2cnc(CCC(=O)N3CCCC[C@@H]3CCOC(=O)c3cccc([N+](=O)[O-])c3)o2)cc1 918634178 QYCKGRIABQJHMQ-JOCHJYFZSA-N 491.544 5.119 5 20 JKBD C[C@H](Nc1ccc(C(=O)N2CCC[C@H]2COc2ccc(Cl)cc2)cc1[N+](=O)[O-])c1ccccn1 919711736 YOJFZDKAWRNOQX-PXNSSMCTSA-N 480.952 5.500 5 20 JKBD O=C(CCOc1ccc(F)cc1)Nc1ccc(C2(NC(=O)c3cccc(F)c3[N+](=O)[O-])CCC2)cc1 1785986940 CUXDYUQJKUWXAT-UHFFFAOYSA-N 495.482 5.090 5 20 JKBD C[C@H](Sc1cccs1)C(=O)Nc1ccc(C2(NC(=O)/C=C/c3ccc([N+](=O)[O-])o3)CCC2)cc1 1789414160 VIRDWGSKRVEVNW-SOGBHIHOSA-N 497.598 5.577 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)c3ccc([N+](=O)[O-])o3)CCC2)cc1)c1cccc(C(F)(F)F)c1 1790278433 YHCQYQGZIVHDQX-UHFFFAOYSA-N 473.407 5.268 5 20 JKBD Cc1ccc2[nH]c(C(=O)NC3(c4ccc(NC(=O)c5ccc(O)c([N+](=O)[O-])c5)cc4)CCC3)cc2c1 1790619622 HUDIFEQABFXZMX-UHFFFAOYSA-N 484.512 5.152 5 20 JKBD O=C(C[C@H]1C[C@@H]2CC[C@H]1C2)NC1(c2ccc(NC(=O)c3nc4cc([N+](=O)[O-])ccc4[nH]3)cc2)CCC1 1790827673 PHKVNPCSFVZVEC-FGTMMUONSA-N 487.560 5.045 5 20 JKBD O=C(NC1(c2ccc(NC(=O)c3cccc4ccoc34)cc2)CCC1)c1ccc(O)c([N+](=O)[O-])c1 1790956385 GLQNQTFJZVANGK-UHFFFAOYSA-N 471.469 5.108 5 20 JKBD O=C(/C=C/c1ccc([N+](=O)[O-])o1)N1CCCC2(CCN(C(=O)[C@@H]3CCC[C@@H]4CCCC[C@@H]43)CC2)C1 1805684160 FQGOVSGHTAFORD-LGEAGFSGSA-N 483.609 5.039 5 20 JKBD C[C@@H](C(=O)Nc1cc([C@H]2CCCCN2C(=O)Cc2cccc([N+](=O)[O-])c2)[nH]n1)c1ccc(Cl)cc1 1814656224 RNYWVFFMDPGQOP-OPAMFIHVSA-N 495.967 5.010 5 20 JKBD Cc1oc(C(C)(C)C)cc1C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cccc(F)c2[N+](=O)[O-])CC1 1830615855 HHEIYVXLAWOYEW-JOCHJYFZSA-N 499.583 5.480 5 20 JKBD O=C(c1cc(F)cc([N+](=O)[O-])c1)N1CCC([C@@H]2CCCCN2C(=O)c2cc(F)cc(Cl)c2)CC1 1832630226 ZPRJWFAPLAOWBG-QFIPXVFZSA-N 491.922 5.074 5 20 JKBD CC(C)C1(C(=O)N2CCC([C@@H]3CCCCN3C(=O)/C=C/c3ccccc3[N+](=O)[O-])CC2)CCC1 1832904430 SBADSTZSJHPJRU-RGPPVUSESA-N 467.610 5.054 5 20 JKBD O=C(/C=C/c1cc2ccccc2o1)N1CC2(CCCN2C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)C1 1845739004 ATCGHPVXYHVPGT-VQHVLOKHSA-N 487.537 5.086 5 20 JKBD O=C(c1cc2cc([N+](=O)[O-])ccc2s1)N1CCCC12CN(C(=O)C1(c3cccc(Cl)c3)CC1)C2 1845739015 CRPQTLQZBYDWRK-UHFFFAOYSA-N 495.988 5.012 5 20 JKBD Cc1cccc(C)c1SCC(=O)N1CC2(CCCN2C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)C1 1845739131 NXMYRUCPEQIBCY-UHFFFAOYSA-N 495.626 5.036 5 20 JKBD CC(=O)N(c1ccccc1)c1nc(COC(=O)c2cc([N+](=O)[O-])ccc2N2CCC(C)CC2)cs1 9719871 VBOVAQJSUHVYNL-UHFFFAOYSA-N 494.573 5.329 5 20 JKBD C[C@@H](OC(=O)c1cc([N+](=O)[O-])ccc1NCc1ccccc1)C(=O)Nc1ccccc1C(F)(F)F 18521250 LKFMXTZVWWYBMA-OAHLLOKOSA-N 487.434 5.410 5 20 JKBD COc1cc(-c2nnc(S[C@@H](C)c3cccc([N+](=O)[O-])c3)n2C2CCCCC2)cc(OC)c1OC 21602897 NUNWZFPDWYBEBL-INIZCTEOSA-N 498.605 6.238 5 20 JKBD O=C(OCc1cc([N+](=O)[O-])cc2c1OCOC2)c1ccccc1Cc1nc2ccccc2s1 25827413 QWULBJXEAYXIPC-UHFFFAOYSA-N 462.483 5.019 5 20 JKBD COc1cc(CN2CCc3sccc3[C@H]2c2cccs2)c([N+](=O)[O-])cc1OC(F)F 29594580 SGWSLVZPLSUHQZ-IBGZPJMESA-N 452.504 5.476 5 20 JKBD C[C@@H](Nc1ccc(C(=O)NCc2cccc(NC(=O)C3CCCC3)c2)cc1[N+](=O)[O-])c1ccccn1 108855827 MJAWDOKQJNVHSN-GOSISDBHSA-N 487.560 5.222 5 20 JKBD O=C(Nc1cccc(C(F)(F)F)c1)c1ccc(C(=O)Nc2cccc(C(F)(F)F)c2)c([N+](=O)[O-])c1 481857534 QXESJLQCJPLSPV-UHFFFAOYSA-N 497.351 6.137 5 20 JKBD CCS(=O)(=O)Nc1ccc(NC(=O)c2ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])cc2)cc1 488934294 CTTYIAPILPZALO-UHFFFAOYSA-N 475.910 5.054 5 20 JKBD Cc1c(CN2CCSCC2)cccc1NC(=O)CSc1ccc(C(F)(F)F)cc1[N+](=O)[O-] 490041951 TZLMIFZEBASEIL-UHFFFAOYSA-N 485.553 5.202 5 20 JKBD CN(Cc1ccc2c(c1)OCO2)C(=O)C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1 493579548 OOJVACFFTLHCMD-XDHOZWIPSA-N 487.537 5.523 5 20 JKBD Cc1ccc(Sc2ccc(C(=O)Nc3ccc(NC(=O)[C@@H]4CCCO4)cc3)cc2[N+](=O)[O-])cc1 502861359 JVVDUIFAYWTTTA-QFIPXVFZSA-N 477.542 5.424 5 20 JKBD COc1cccc([C@@H](CNC(=O)Nc2cc([N+](=O)[O-])ccc2C)c2c[nH]c3ccccc23)c1OC 503697225 PFYZQCKLIITONW-OAQYLSRUSA-N 474.517 5.355 5 20 JKBD COc1ccc([C@@H]2CCN(C(=O)c3ccccc3C(=O)c3ccc(SC)c([N+](=O)[O-])c3)C2)cc1 504884537 BKQVZVUCDPDPCA-LJQANCHMSA-N 476.554 5.186 5 20 JKBD C[C@@H](Nc1ccc(C(=O)N[C@H](c2ccc(Cl)cc2)C2CC2)cc1[N+](=O)[O-])c1ccccn1 505996337 NRHBSQBAUBOVCR-CMJOXMDJSA-N 450.926 5.697 5 20 JKBD C[C@H](Nc1ccc(C(=O)N(Cc2ccc(Cl)cc2)C2CC2)cc1[N+](=O)[O-])c1ccccn1 506174859 NZXRUZHTZXIZAK-INIZCTEOSA-N 450.926 5.621 5 20 JKBD O=C(c1c2c(nc3ccccc13)/C(=C/c1cccc([N+](=O)[O-])c1)CCC2)N1CCCn2nccc21 509203455 QATAUFBYNWUTDK-KNTRCKAVSA-N 465.513 5.267 5 20 JKBD Cn1ccnc1[C@H](NCc1ccc(Oc2ccccc2Cl)c([N+](=O)[O-])c1)c1ccccc1F 509599004 DSKWRMUWOFLCGX-HSZRJFAPSA-N 466.900 5.792 5 20 JKBD C[C@@H]1CN(Cc2cccc(CNCc3ccc(Oc4ccccc4Cl)c([N+](=O)[O-])c3)c2)CCO1 509618428 MSSASJYXCAURIE-LJQANCHMSA-N 481.980 5.551 5 20 JKBD CC(C)(C)c1ccc(C(=O)Nc2ccccc2NCc2nc(-c3ccc([N+](=O)[O-])cc3)no2)cc1 515665079 FCEULZDJQVVSSG-UHFFFAOYSA-N 471.517 5.807 5 20 JKBD Cc1ccc2c(c1)CC[C@H]2NC(=O)c1ccc(C(=O)N[C@@H]2CCc3cc(C)ccc32)c([N+](=O)[O-])c1 524353944 SUDRPVWOLFCNIU-JWQCQUIFSA-N 469.541 5.046 5 20 JKBD COc1cc(CNc2ccc(N=S3(=O)CCCC3)cc2)ccc1OCc1ccc([N+](=O)[O-])cc1 600852889 ZZOIVCLLRYBHKE-UHFFFAOYSA-N 481.574 5.688 5 20 JKBD O=C(c1cccnc1SCc1cccc(Br)c1)N1CCc2ccc([N+](=O)[O-])cc21 603638962 GYLXTBSUMAZNSV-UHFFFAOYSA-N 470.348 5.248 5 20 JKBD Cc1ccc(Sc2ccc(C(=O)N3CCC(CN4C[C@H](C)O[C@H](C)C4)CC3)cc2[N+](=O)[O-])cc1 608855199 ZPHWPGMRIIWZEJ-BGYRXZFFSA-N 483.634 5.016 5 20 JKBD Cc1cc(Sc2ncccn2)ccc1NC(=O)c1ccc(N2CCC[C@H](C)C2)c([N+](=O)[O-])c1 608895540 RORWBIJVRCVDPZ-INIZCTEOSA-N 463.563 5.333 5 20 JKBD Cc1ccc[n+](/C(C(=S)NC23CC4CC(CC(C4)C2)C3)=C(/O)c2ccc(C)c([N+](=O)[O-])c2)c1 725762838 VUQQDRVKIICUNU-UHFFFAOYSA-O 464.611 5.269 5 20 JKBD C[C@H](OC(=O)CCc1nc2cc(Cl)ccc2s1)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl 730607808 ACPRGFCVGLHEQB-JTQLQIEISA-N 468.318 5.014 5 20 JKBD C[C@@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccccc1C(=O)Nc1ccc(Cl)cn1 745407154 MNEXRVSYTLBJLJ-CYBMUJFWSA-N 456.911 5.015 5 20 JKBD C[C@H](Sc1nnc(-c2ccc(F)cc2)c2ccccc12)C(=O)Nc1ccc(F)c([N+](=O)[O-])c1 779458963 LRDZPRZSDVTBMK-ZDUSSCGKSA-N 466.469 5.603 5 20 JKBD CC(C)N(Cc1nnc(-c2cccc([N+](=O)[O-])c2)o1)C(=O)CCc1ncc(-c2ccccc2Cl)o1 822054409 PESOJXQFBLJLGM-UHFFFAOYSA-N 495.923 5.323 5 20 JKBD COc1ccc(-c2nc(Cc3noc(-c4ccc(N[C@H](C)c5ccccn5)c([N+](=O)[O-])c4)n3)co2)cc1 904331912 JZMCQSMHWUKSEH-MRXNPFEDSA-N 498.499 5.467 5 20 JKBD O=[N+]([O-])c1ccc(/C=C(\Cc2nc(CCC(F)(F)F)no2)c2nc3ccccc3s2)cc1 904868934 RVFQACQWERUYHZ-SDNWHVSQSA-N 460.437 5.866 5 20 JKBD CC1=C(C(=O)Nc2ccccc2C(F)(F)F)[C@@H](c2ccc([N+](=O)[O-])cc2)NC(=O)N1CC(C)C 916167660 FFVRLDRZUUKNMU-HXUWFJFHSA-N 476.455 5.249 5 20 JKBD Cc1nc(CSc2ccc(C(=O)OCc3nc(-c4ccc([N+](=O)[O-])cc4)no3)cc2)cs1 919054365 WSZKKQPTNUXCEW-UHFFFAOYSA-N 468.516 5.059 5 20 JKBD COc1nc(C(=O)O[C@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2ccccc2)cc2ccccc12 920736653 TWYBADCSZPDJTI-QFIPXVFZSA-N 491.887 5.342 5 20 JKBD CCn1nc(C(=O)NC2(c3ccc(NC(=O)/C=C/c4ccc([N+](=O)[O-])o4)cc3)CCC2)c2ccccc21 1786204471 LLUHNRUWSXDZRQ-WYMLVPIESA-N 499.527 5.019 5 20 JKBD O=C(/C=C/c1ccccc1[N+](=O)[O-])NC1(c2ccc(NC(=O)c3cnc(Cl)s3)cc2)CCC1 1789862746 BZZOPVCBYNDKEB-IZZDOVSWSA-N 482.949 5.166 5 20 JKBD Cc1cc(C(=O)Nc2ccc(C3(NC(=O)CSc4ccccc4[N+](=O)[O-])CCC3)cc2)ccc1O 1790657203 SRYHDVLGKVVJEU-UHFFFAOYSA-N 491.569 5.149 5 20 JKBD O=C(CSc1ccccc1)NC1(c2ccc(NC(=O)c3cccc(F)c3[N+](=O)[O-])cc2)CCC1 1790698480 VSBBYOPSTGKMCI-UHFFFAOYSA-N 479.533 5.274 5 20 JKBD Cc1cccnc1CCC(=O)NC1(c2ccc(NC(=O)c3c(F)ccc([N+](=O)[O-])c3C)cc2)CCC1 1790770441 DOVSEDDYRSEGKG-UHFFFAOYSA-N 490.535 5.126 5 20 JKBD COc1ccc(CC(=O)NC2(c3ccc(NC(=O)[C@@H](C)c4ccccc4)cc3)CCC2)c([N+](=O)[O-])c1 1792312858 CXERVXHANGLTEH-IBGZPJMESA-N 487.556 5.084 5 20 JKBD CCC[C@H]1CC[C@H](C(=O)NC[C@H]2CCN(C(=O)c3cccc(F)c3[N+](=O)[O-])[C@@H]2c2cccnc2)CC1 1812789698 MTTFXTWLGBTDGY-ISQLDUATSA-N 496.583 5.055 5 20 JKBD CC[C@H](C(=O)Nc1cc([C@H]2CCCCN2C(=O)CCc2cccc([N+](=O)[O-])c2)[nH]n1)c1ccccc1 1816735893 GFFIRXPCKHOPMP-LADGPHEKSA-N 489.576 5.137 5 20 JKBD Cc1ccc(CC(=O)N2CCCC[C@@H]2c2cc(NC(=O)C[C@H](C)c3ccccc3)n[nH]2)cc1[N+](=O)[O-] 1822045153 NSJBGRHVWDNECX-WMZHIEFXSA-N 489.576 5.055 5 20 JKBD C[C@H](CC(=O)N1CCCC[C@H]1c1cc(NC(=O)/C=C/c2ccccc2[N+](=O)[O-])n[nH]1)c1ccccc1 1823503409 LDUKJVZVSBKIDC-OMNNQXLOSA-N 487.560 5.217 5 20 JKBD CC(C)(C)c1ccc(C(=O)N2CCCC[C@H]2C2CCN(C(=O)/C=C/c3ccc([N+](=O)[O-])o3)CC2)s1 1827903603 ALDFPIIHJUNMBW-OEMHODTASA-N 499.633 5.494 5 20 JKBD COc1ccc(C(=O)N2CCCC[C@H]2C2CCN(C(=O)c3cc(Cl)cc([N+](=O)[O-])c3C)CC2)cc1 1830037684 UNGIOYJHVCSNDN-QHCPKHFHSA-N 499.995 5.112 5 20 JKBD C[C@@H](C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)CC1)n1cccc1 1831062634 WJPSQOZDAKHVKT-PGRDOPGGSA-N 494.617 5.106 5 20 JKBD CCCCC[C@@H](C)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)/C=C/c2ccc([N+](=O)[O-])o2)CC1 1831462136 JMHJVMKBMCLQFY-BKVXWFHVSA-N 459.587 5.037 5 20 JKBD O=C(c1ccc(Cl)cc1F)N1CCC([C@H]2CCCCN2C(=O)/C=C/c2ccccc2[N+](=O)[O-])CC1 1832899947 FXMAFUSUEGXWPB-OXHGWOFKSA-N 499.970 5.334 5 20 JKBD CCc1ccc(N(C(C)=O)c2nc(COC(=O)c3cc([N+](=O)[O-])ccc3Cl)cs2)cc1 10665499 AHNDVNRMUDAXEB-UHFFFAOYSA-N 459.911 5.309 5 20 JKBD O=C1c2ccccc2N[C@H](c2ccc(-c3ccc([N+](=O)[O-])cc3Br)o2)N1C[C@@H]1CCCO1 15503670 HFIAFUHIUQWFMA-NYHFZMIOSA-N 498.333 5.363 5 20 JKBD CCN(CC(=O)Nc1ccccc1C(F)(F)F)C(=O)c1ccc(C(C)(C)C)c([N+](=O)[O-])c1 28016820 AJABKLUANYVOEK-UHFFFAOYSA-N 451.445 5.012 5 20 JKBD C[C@H](c1cccs1)N(C)C(=O)C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1 30049910 YJZZQZACQJKGOF-VVZNPABPSA-N 463.584 6.416 5 20 JKBD C[C@H](Sc1nnc(-c2ccccc2)c(-c2ccccc2)n1)C(=O)Nc1cccc([N+](=O)[O-])c1 33941079 MAMMOIKRTUPITB-INIZCTEOSA-N 457.515 5.233 5 20 JKBD COc1ccc([C@H](C)N(C)C(=O)C2CCN(c3ccc(C(F)(F)F)cc3[N+](=O)[O-])CC2)cc1 105773826 WSMWFHIRIOTJKJ-HNNXBMFYSA-N 465.472 5.058 5 20 JKBD C[C@H](Nc1ccc(C(=O)Nc2ccccc2I)cc1[N+](=O)[O-])c1ccccn1 409654837 WZQBIKKJWWRMBY-ZDUSSCGKSA-N 488.285 5.020 5 20 JKBD Cc1csc(Sc2ccc(C(=O)Nc3nnc(Cc4cccc(F)c4)s3)cc2[N+](=O)[O-])n1 410027109 BXJDQOPNYRNHEK-UHFFFAOYSA-N 487.563 5.345 5 20 JKBD C[C@H](N[C@@H](Cc1cccc(F)c1)c1cccc(F)c1)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 488009028 SVGOUNLBAKYAQU-NYHFZMIOSA-N 450.445 5.558 5 20 JKBD O=C(Cn1ccc2cc([N+](=O)[O-])ccc21)Nc1cccc(NC(=O)c2cccc(C(F)(F)F)c2)c1 504776197 PXUQJVPSAJCREJ-UHFFFAOYSA-N 482.418 5.459 5 20 JKBD COc1cc(C(=O)N[C@@H](C)Cc2ccc(Cl)cc2Cl)c([N+](=O)[O-])cc1OCc1cscn1 504917139 CDYPPQKVSGZXRG-LBPRGKRZSA-N 496.372 5.307 5 20 JKBD Cc1ccc([N+](=O)[O-])cc1NC(=O)c1cc(-c2ccccc2)nc2c1cnn2Cc1ccco1 514338277 BNEUTHKKHJHIAP-UHFFFAOYSA-N 453.458 5.209 5 20 JKBD O=C(C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)N[C@H]1CCN(Cc2ccccc2)C1 515360167 HJDKHAYJRWHYTM-GTRUEHEQSA-N 498.608 5.526 5 20 JKBD COc1ccc(CNC[C@@H]2CCCO[C@@H]2c2ccccc2)cc1OCc1ccc([N+](=O)[O-])cc1 517549452 URVZDNZVOGEURP-WNCULLNHSA-N 462.546 5.440 5 20 JKBD Cc1ccc([N+](=O)[O-])cc1NC(=O)CNc1ccc(NC(=O)c2ccccc2F)cc1C(F)(F)F 518701412 SAEHBMAYNWYRLC-UHFFFAOYSA-N 490.413 5.364 5 20 JKBD CC1(N(Cc2ccc3c(c2)OCO3)C(=O)Cn2c3ccccc3c(=O)c3ccccc32)CCCC1 521456403 FOFGCGUZDVCPDN-UHFFFAOYSA-N 468.553 5.245 5 20 JKBD Cc1nn(C(C)(C)C)c2nc(C(C)C)cc(C(=O)Nc3cc([N+](=O)[O-])ccc3OC(F)F)c12 603742799 PVVNUVOTVUWVHZ-UHFFFAOYSA-N 461.469 5.380 5 20 JKBD C[C@H]1C[C@@H](C)CN(c2nnc(Sc3ccc([N+](=O)[O-])c4cnccc34)n2Cc2ccco2)C1 603846953 MANPUGUBSJMKBS-IYBDPMFKSA-N 464.551 5.009 5 20 JKBD COc1cc(C(=O)Nc2cccnc2Oc2cccc(C)c2C)c([N+](=O)[O-])cc1OC(F)F 604004028 FRRHISLQHVGGKW-UHFFFAOYSA-N 459.405 5.261 5 20 JKBD COc1ccccc1-c1cc(NC(=O)c2ccc(Sc3nc(C)cs3)c([N+](=O)[O-])c2)n[nH]1 604497161 CKNLIDBBOCHMBW-UHFFFAOYSA-N 467.532 5.162 5 20 JKBD O=[N+]([O-])c1ccc(-c2nn(-c3ccccc3)cc2CNCc2coc(-c3cccs3)n2)cc1 608836852 UBEHKVZTPHDYPT-UHFFFAOYSA-N 457.515 5.454 5 20 JKBD O=C(c1ccc([N+](=O)[O-])o1)N1CCN(C(c2ccc(Cl)cc2)c2ccc(Cl)cc2)CC1 608904481 AFFMWAAASKYLOT-UHFFFAOYSA-N 460.317 5.042 5 20 JKBD O=C(c1ccccc1Sc1ccc(C(F)(F)F)cc1[N+](=O)[O-])N1CC[C@@H](N2CCCC2)C1 608905605 GVVFDVTVXYFFLJ-MRXNPFEDSA-N 465.497 5.075 5 20 JKBD COc1cc(CN[C@@H](C)c2nc3ccccc3n2C(F)F)ccc1OCc1ccc([N+](=O)[O-])cc1 609006671 PTBSENCLSIJIGD-INIZCTEOSA-N 482.487 5.778 5 20 JKBD CC(C)CCSc1ccc(C(=O)Nc2ccccc2CS(=O)(=O)c2ccccc2)cc1[N+](=O)[O-] 609375829 MWGGFGMPYFDTEI-UHFFFAOYSA-N 498.626 5.959 5 20 JKBD Cc1nnc(SCc2c(C(=O)OCc3c(F)cccc3[N+](=O)[O-])oc3ccccc23)s1 729001496 YZNDRBSCTNCRIN-UHFFFAOYSA-N 459.480 5.289 5 20 JKBD CC(C)Oc1ccc([N+](=O)[O-])cc1COC(=O)CCc1ncc(-c2ccccc2Br)o1 729119113 JZFGSRWGLHEGDI-UHFFFAOYSA-N 489.322 5.476 5 20 JKBD Cc1ccsc1C(=O)Nc1ccc(OC(=O)C2CCN(c3ccccc3[N+](=O)[O-])CC2)cc1 729219173 TWNAWGQUWASFHT-UHFFFAOYSA-N 465.531 5.039 5 20 JKBD O=C(CCc1nc2cc(C(F)(F)F)ccc2s1)OCC1CCN(c2ncccc2[N+](=O)[O-])CC1 730692252 FKVLROSMPOWYSX-UHFFFAOYSA-N 494.495 5.011 5 20 JKBD Cc1cc(C)n([C@@H](C)C(=O)Nc2ccc(NC(=O)c3cc(Cl)ccc3[N+](=O)[O-])cc2Cl)n1 743838516 NXSZNJDPBRUZPB-ZDUSSCGKSA-N 476.320 5.167 5 20 JKBD O=C(Nc1nc(-c2ccc(OC(F)F)cc2OC(F)F)cs1)c1cc([N+](=O)[O-])ccc1Cl 747386378 LDHXSZXNMKJDBD-UHFFFAOYSA-N 491.806 5.827 5 20 JKBD CCOC(=O)c1c(COC(=O)c2csc(-c3ccc([N+](=O)[O-])cc3)n2)nc2ccccc2c1C 747957326 NSWRMKZZSZVASU-UHFFFAOYSA-N 477.498 5.109 5 20 JKBD C[C@H](OC(=O)c1csc(-c2ccc([N+](=O)[O-])cc2)n1)C(=O)NC(c1ccccc1)c1ccccc1 747958639 QPUCVJLIAJQVEQ-KRWDZBQOSA-N 487.537 5.169 5 20 JKBD O=C(Nc1ccc(-c2nc3ccccc3s2)cc1)c1cc([N+](=O)[O-])ccc1Br 751059493 IRISOJZFPUVOIK-UHFFFAOYSA-N 454.305 5.886 5 20 JKBD Cc1ccc(NC(=O)[C@H](OC(=O)c2cnc3onc(C(C)C)c3c2)c2ccccc2)c([N+](=O)[O-])c1 752938670 YMSHZPHOKDAJJT-JOCHJYFZSA-N 474.473 5.100 5 20 JKBD Cc1ccc(C(=O)Nc2ccccc2)cc1NC(=O)c1cc([N+](=O)[O-])ccc1N1CCC(C)CC1 918627367 QGWITHLDPXESNL-UHFFFAOYSA-N 472.545 5.644 5 20 JKBD CCN(CC)C(=O)c1ccccc1NC(=O)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])c(OC)c1 919873947 BHWKBRIPPCCWDF-UHFFFAOYSA-N 497.935 5.783 5 20 JKBD Cc1c[nH]c(C)c1CCC(=O)Nc1ccc(C2(NC(=O)c3ccc([N+](=O)[O-])cc3F)CCC2)cc1 1786205661 OWBKPQBOYKMANF-UHFFFAOYSA-N 478.524 5.059 5 20 JKBD COc1c(Cl)cccc1C(=O)NC1(c2ccc(NC(=O)/C=C/c3ccc([N+](=O)[O-])o3)cc2)CCC1 1786208012 DSZNKUAKTDGRGY-ZRDIBKRKSA-N 495.919 5.311 5 20 JKBD Cc1c(C(=O)N2CC[C@H](CNC(=O)[C@]3(C)CC=CCC3)[C@@H]2c2cccnc2)cc(Cl)cc1[N+](=O)[O-] 1813585357 HOWFZNVZQUBFGJ-FRPAHBMMSA-N 496.995 5.018 5 20 JKBD O=C(CSc1ccccc1[N+](=O)[O-])Nc1cc([C@H]2CCCCN2C(=O)CCC2CCCC2)[nH]n1 1822312712 OZYGEVUJLHTXKI-LJQANCHMSA-N 485.610 5.073 5 20 JKBD Cc1oc(C(C)(C)C)cc1C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2ccc([N+](=O)[O-])cc2F)CC1 1825951629 UVKUXGGJIPEKRS-QHCPKHFHSA-N 499.583 5.480 5 20 JKBD C[C@H](CC(=O)N1CCCC[C@@H]1C1CCN(C(=O)Cc2ccc([N+](=O)[O-])cc2F)CC1)c1ccccc1 1831510410 SWZPETLNHHUSQO-FQRUVTKNSA-N 495.595 5.090 5 20 JKBD C[C@H](Sc1nnc(-c2ccc(C(C)(C)C)cc2)n1C)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 9463118 AAOJQYWQMKDIFG-AWEZNQCLSA-N 464.551 5.591 5 20 JKBD Cc1cccc([N+](=O)[O-])c1NC(=O)COC(=O)c1cc2sc(Nc3ccccc3)nc2s1 10712154 JAIAYLRGTSTGEZ-UHFFFAOYSA-N 468.516 5.114 5 20 JKBD Cc1ccccc1NC(=O)COC(=O)C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1 18493967 KYUBGNABKQLJQA-RGEXLXHISA-N 487.537 5.626 5 20 JKBD CSc1ccc([N+](=O)[O-])c(C(=O)Nc2ccc(NC(=O)c3ccco3)cc2C(F)(F)F)c1 22182289 HEMKSGANINXSDO-UHFFFAOYSA-N 465.409 5.433 5 20 JKBD COc1cc(C(=O)Nc2cc3c(cc2Cl)OCCO3)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 24708328 KMFUXBBUBJMVBK-UHFFFAOYSA-N 491.283 5.726 5 20 JKBD Cc1ccc(NC(=O)c2nnc(/C(Cl)=C/c3ccc(-c4ccccc4[N+](=O)[O-])o3)s2)cc1 26228939 NOFPBXIMOLEQQN-ATVHPVEESA-N 466.906 6.004 5 20 JKBD O=C(NC[C@@H]1CCCO1)Nc1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2Sc2ccccc2)cc1 26834644 SFTOLPDFUDVRAV-FQEVSTJZSA-N 492.557 5.299 5 20 JKBD CSc1ccc(C(=O)c2ccccc2C(=O)NCc2ccc(NC(=O)C(C)C)cc2)cc1[N+](=O)[O-] 33092582 ZGSANPFBDCLOOR-UHFFFAOYSA-N 491.569 5.072 5 20 JKBD COc1ccc(NC(=O)c2ccc([N+](=O)[O-])cc2Cl)cc1NC(=O)c1ccc(Cl)cc1F 68734430 UYEQXXNMTMXLDY-UHFFFAOYSA-N 478.263 5.554 5 20 JKBD C[C@H](NC(=O)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1)c1ccc(OC(F)F)cc1 490590003 NDKGQRZHBXZPIP-ZDUSSCGKSA-N 487.425 5.309 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Cl)[C@@H](NC[C@@H]1CCCN(Cc2cccs2)C1)c1ccccc1 493886917 YWGNFASUSDFYPL-UUOWRZLLSA-N 499.036 5.491 5 20 JKBD Cc1nn(Cc2ccc(C(=O)Nc3cc(C(F)(F)F)ccc3Cl)cc2)c(C)c1[N+](=O)[O-] 499077279 OXZJBHKSHXPBRQ-UHFFFAOYSA-N 452.820 5.381 5 20 JKBD CC[C@@H](C)Sc1ccc(NC(=O)c2nnn(-c3cccc([N+](=O)[O-])c3)c2C)c(C(F)(F)F)c1 499595627 SZBAMFMFBXDUHM-GFCCVEGCSA-N 479.484 5.646 5 20 JKBD CCCCc1oc2ccccc2c1CN(C)C(=O)CCCn1c(=O)oc2cc([N+](=O)[O-])ccc21 503118694 LLKPROINTHJXEY-UHFFFAOYSA-N 465.506 5.030 5 20 JKBD C[C@H]1Cc2cc([N+](=O)[O-])ccc2N1C(=O)C[C@@H](NC(=O)c1ccccc1Cl)c1ccccc1 504265360 CNOZNANBFLMBOH-KSFYIVLOSA-N 463.921 5.087 5 20 JKBD O=C(CSc1ccc(C(F)(F)F)cc1[N+](=O)[O-])NCC1(c2ccc(Cl)cc2)CCOCC1 508796027 OXZCMJBKKXPYGZ-UHFFFAOYSA-N 488.915 5.224 5 20 JKBD COc1cc(C(=O)Nc2nc3c(s2)C[C@@H](c2ccccc2)CC3)c([N+](=O)[O-])cc1OC(F)F 519075145 PRCUUHPQWARYCE-ZDUSSCGKSA-N 475.473 5.186 5 20 JKBD Cc1cc(NC(=O)[C@@H](C)SCc2ncc(-c3ccc(Cl)cc3)o2)n(-c2ccc([N+](=O)[O-])cc2)n1 521198076 DMXYGFZSLGKKKT-OAHLLOKOSA-N 497.964 5.658 5 20 JKBD COc1cc(C(=O)Nc2nc(-c3cccc(Cl)c3)c(C)s2)c([N+](=O)[O-])cc1OC(F)F 552801641 MMFRSBDCHURMIX-UHFFFAOYSA-N 469.853 5.542 5 20 JKBD C[C@@H](CCc1ccco1)NC(=O)C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1 592465289 VGUPPJXYIOJACP-STZPCZCHSA-N 461.543 5.866 5 20 JKBD COc1cc([C@@H]2Nc3ccccc3C(=O)N2Cc2ccccc2)c([N+](=O)[O-])cc1OCC(F)F 602756528 ACSCBPWKROCIHI-HSZRJFAPSA-N 469.444 5.014 5 20 JKBD CN(C[C@H]1CCCO[C@@H]1c1ccccc1)C(=O)c1ccc(NCc2ccccc2)c([N+](=O)[O-])c1 604519004 DHEHJGYLGPBEAY-ZEQKJWHPSA-N 459.546 5.447 5 20 JKBD O=C(Nc1ccc(-c2ncon2)cc1)c1ccccc1Sc1ccc(C(F)(F)F)cc1[N+](=O)[O-] 608874891 LWFQCILTRXCGEW-UHFFFAOYSA-N 486.431 6.067 5 20 JKBD CC(C)NC(=O)c1ccc(Cl)c(NC(=O)c2ccc(N[C@H](C)c3ccccn3)c([N+](=O)[O-])c2)c1 608938663 QGFCSKHUNZNGMZ-OAHLLOKOSA-N 481.940 5.207 5 20 JKBD Cc1cc(Br)cc2c1N(C(=O)c1ccc(Cn3nc(C)c([N+](=O)[O-])c3C)cc1)CCC2 609102685 QCRHRIULSUWILR-UHFFFAOYSA-N 483.366 5.120 5 20 JKBD COc1cc(C(=O)N[C@H](c2ccc(C)cc2)c2ccc(F)cc2Cl)c([N+](=O)[O-])cc1OC 609374139 IIDHBNNAGAXRTK-JOCHJYFZSA-N 458.873 5.232 5 20 JKBD CCOc1ccc([C@H]2CCCN2C(=O)CSc2nc3cc4ccccc4cc3c(=O)n2CC)cc1 613973473 ZIJQOCWDVCFZPB-RUZDIDTESA-N 487.625 5.424 5 20 JKBD CC(=O)c1ccc(Sc2nnc(-c3ccc(Cl)cc3)n2Cc2ccco2)c([N+](=O)[O-])c1 619680466 PYNTVUPWHJSROU-UHFFFAOYSA-N 454.895 5.502 5 20 JKBD COc1ccc(CC(=O)Nc2ccccc2C(=O)Nc2cccc(C(F)(F)F)c2)cc1[N+](=O)[O-] 727668162 ZXZNOWMSBMBNOU-UHFFFAOYSA-N 473.407 5.056 5 20 JKBD CC(C)(C)[C@@H](Cn1ccnc1)NC(=O)C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1 729340405 GACAKDFGNKMWSI-SCFJIEIRSA-N 489.601 5.563 5 20 JKBD Cc1ccc(NC(=O)[C@@H](C)OC(=O)C2CCN(c3ccc(C(F)(F)F)cc3[N+](=O)[O-])CC2)c(C)c1 729628496 ZEVTZQHWUMSCEV-MRXNPFEDSA-N 493.482 5.017 5 20 JKBD Cc1csc(SCc2ccc(C(=O)OC[C@@H]3CCCN3C(=O)c3ccccc3[N+](=O)[O-])cc2)n1 730702609 CRBQBQWLXHUNFY-IBGZPJMESA-N 497.598 5.114 5 20 JKBD CC1=C(C(=O)Nc2ccccc2C)[C@H](c2ccc(Cl)c([N+](=O)[O-])c2)NC(=O)N1Cc1cccs1 732041932 XGJCQNZAMIZOJP-QFIPXVFZSA-N 496.976 5.797 5 20 JKBD CC(C)Cc1nc(C(=O)O[C@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2ccccc2)cs1 746607489 XCWZSPWFFFFSMO-FQEVSTJZSA-N 473.938 5.440 5 20 JKBD COc1cc(C2SCCS2)ccc1OC(=O)c1csc(-c2ccc([N+](=O)[O-])cc2)n1 747628312 YVYRVFYUYRIHOF-UHFFFAOYSA-N 460.558 5.425 5 20 JKBD O=C(OCc1nnc(-c2ccc(Cl)cc2Cl)o1)c1csc(-c2cccc([N+](=O)[O-])c2)n1 747954690 CXLLILVHTSTLFZ-UHFFFAOYSA-N 477.285 5.432 5 20 JKBD Cc1ccc(C)c(NC(=O)[C@@H](OC(=O)c2csc(-c3cccc([N+](=O)[O-])c3)n2)c2ccccc2)c1 747961947 CLEXXICWWNXWJG-QHCPKHFHSA-N 487.537 5.872 5 20 JKBD CC(C)[C@H](OC(=O)c1csc(-c2cccc([N+](=O)[O-])c2)n1)C(=O)Nc1ccccc1C(F)(F)F 747962728 STFHXXHRVVMKOZ-SFHVURJKSA-N 493.463 5.557 5 20 JKBD C[C@@H](NC(=O)COC(=O)c1csc(-c2cccc([N+](=O)[O-])c2)n1)c1ccc(Cl)cc1Cl 747964196 TVWLEGIYBUDRCN-LLVKDONJSA-N 480.329 5.059 5 20 JKBD CN(C(=O)COC(=O)C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)c1ccccc1 748579752 VHLYBZOUSPUFEX-XDJHFCHBSA-N 487.537 5.341 5 20 JKBD CC(C)(C)OC(=O)N1CCC[C@@H]1[C@H]1CCCN(C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)C1 749658424 DBEUWHFGMSGKHQ-MAUKXSAKSA-N 459.568 5.061 5 20 JKBD Cc1c(NC(=O)c2ccccc2)cccc1NC(=O)c1cc([N+](=O)[O-])ccc1Br 751101166 UZWDIIXRSDWMOV-UHFFFAOYSA-N 454.280 5.170 5 20 JKBD CC(C)[C@@H](OC(=O)[C@@H](C)Sc1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccccc1C(F)(F)F 915371054 MWFJLRNJWDSPTC-FZKQIMNGSA-N 470.469 5.301 5 20 JKBD CC[C@@H](C)c1ccc([C@H](NC(=O)C(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)c2cccs2)cc1 915743850 WQKKLACLMQODES-SZNDQCEHSA-N 471.966 5.668 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Cl)[C@@H](Nc1ccc(N2CCCCC2)cc1)c1ccccc1 915877396 WHACNPMPDRGPIK-DEOSSOPVSA-N 464.953 6.030 5 20 JKBD O=C(Nc1ccccc1C(=O)NCCc1csc2ccccc12)c1ccc([N+](=O)[O-])cc1Cl 918613591 WEEZYBTXAGVYGE-UHFFFAOYSA-N 479.945 5.688 5 20 JKBD Cn1cc(-c2nc(COC(=O)c3ccc(NCc4ccccc4Cl)c([N+](=O)[O-])c3)cs2)cn1 918879024 KXBJEJOUINHZRU-UHFFFAOYSA-N 483.937 5.074 5 20 JKBD COc1cc(C(=O)N[C@@H](c2ccccc2)C2CCCCC2)c([N+](=O)[O-])cc1OCc1cscn1 920002557 LHVPRVAXGFBNGK-DEOSSOPVSA-N 481.574 5.690 5 20 JKBD C[C@@H](OC(=O)c1ccc(N[C@H](C)c2ccccn2)c([N+](=O)[O-])c1)C(=O)Nc1ccc(F)cc1Cl 920544571 CVHQYVLLXYFGNK-ZIAGYGMSSA-N 486.887 5.139 5 20 JKBD COc1cc(COC(=O)[C@@H](C)Oc2ccc(Cl)cc2[N+](=O)[O-])cc(Cl)c1OC(F)F 920791457 ZTMHAVUAMLMENO-SECBINFHSA-N 466.220 5.022 5 20 JKBD O=C(NC1(c2ccc(NC(=O)c3cc(Cl)ccc3F)cc2)CCC1)c1ccc([N+](=O)[O-])o1 1785963303 VIXUKRYNXXCGNC-UHFFFAOYSA-N 457.845 5.042 5 20 JKBD O=C(CC[C@@H]1CNc2ccccc2C1)Nc1ccc(C2(NC(=O)c3ccc([N+](=O)[O-])o3)CCC2)cc1 1788066732 WDWSUMMJBXILOF-SFHVURJKSA-N 488.544 5.000 5 20 JKBD O=C(Cc1ccc2ccccc2c1)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C1(c2cccc([N+](=O)[O-])c2)CCC1 1800040160 KZYAPZNBXHOQOP-OOSCYNTBSA-N 497.595 5.051 5 20 JKBD CC(C)(C)CCCCCC(=O)N1CC[C@H](CNC(=O)c2cccc(F)c2[N+](=O)[O-])[C@H]1c1cccnc1 1811323504 PKTJXSCYFATDQP-HYBUGGRVSA-N 498.599 5.445 5 20 JKBD Cc1ccoc1C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)[nH]n1 1818172953 TZYORTIGUXRDOH-QGZVFWFLSA-N 479.518 5.054 5 20 JKBD CC1=CC[C@@H](C(=O)Nc2cc([C@H]3CCCCN3C(=O)C3(c4cccc([N+](=O)[O-])c4)CCC3)[nH]n2)CC1 1818807471 BSGNUCLOWSHDKG-AUSIDOKSSA-N 491.592 5.178 5 20 JKBD Cc1cccc(Cl)c1C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cc(F)cc([N+](=O)[O-])c2)n[nH]1 1821167309 NWTGPEVBBBLXJR-IBGZPJMESA-N 485.903 5.039 5 20 JKBD CC(C)[C@H]1CC[C@H](C(=O)N2CCCC[C@H]2c2cc(NC(=O)Cc3cc(F)ccc3[N+](=O)[O-])n[nH]2)CC1 1823488259 SHLUSWJYWUXXNG-BSRJHKFKSA-N 499.587 5.154 5 20 JKBD CC(C)CC(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)CC1 1826345230 FKIBYZCOWMICFS-HXUWFJFHSA-N 457.596 5.089 5 20 JKBD O=C(/C=C/c1ccccc1[N+](=O)[O-])N1CCC([C@@H]2CCCCN2C(=O)CSc2ccccc2)CC1 1826523842 HQWWWVKZKYPVFU-XXFRDUSWSA-N 493.629 5.020 5 20 JKBD Cc1nc(-c2ccc(Cl)cc2)sc1C(=O)OCC(=O)Nc1cc([N+](=O)[O-])ccc1Cl 10696647 QYWQFBVGEXWLAC-UHFFFAOYSA-N 466.302 5.129 5 20 JKBD CCc1cccc(C)c1Nc1nnc(SCc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)s1 16328091 PNHKDFXTZVMVMB-UHFFFAOYSA-N 454.537 5.403 5 20 JKBD Cc1cccc(-c2nnc(S[C@@H](C)c3nnc(-c4ccc([N+](=O)[O-])cc4)o3)n2Cc2ccco2)c1 17708704 CKBLFMSCPSETHU-INIZCTEOSA-N 488.529 5.706 5 20 JKBD CC(C)c1ccc(-c2nc(CC(=O)O[C@@H](C)c3nnc(-c4ccc([N+](=O)[O-])cc4)o3)cs2)cc1 17726177 PDHMNZVMXLVIOM-HNNXBMFYSA-N 478.530 5.739 5 20 JKBD C[C@H](OC(=O)[C@H](C)Sc1ccc(Cl)cc1)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 21457614 PJOBHQAZLMVHJD-QWRGUYRKSA-N 476.860 5.318 5 20 JKBD O=C(NCc1ccc(C(=O)N2CCCC2)cc1)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1 25549426 STCMKNYCLLAQPG-UHFFFAOYSA-N 479.920 5.207 5 20 JKBD C[C@@H](CN1CCCCC1)NC(=O)C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1 27764337 AVMMSDAYYJIGQR-BAOGPQIGSA-N 464.591 5.126 5 20 JKBD C[C@H](OC(=O)Cn1c2ccccc2c(=O)c2ccccc21)C(=O)Nc1ccc(Cl)c(Cl)c1 28774874 RUOFCNDLBWCVBQ-AWEZNQCLSA-N 469.324 5.032 5 20 JKBD CCOc1cc([N+](=O)[O-])c(C(=O)NC[C@H]2CC3c4ccccc4C2c2ccccc23)cc1OC 45452536 BKDAUQKZKUIRNW-SIMYWZFQSA-N 458.514 5.029 5 20 JKBD C[C@H]1CN(c2ccc(NC(=O)c3cc([N+](=O)[O-])ccc3Sc3ccccc3)cn2)C[C@@H](C)O1 483433529 BKAZUCXRVCFKJJ-CALCHBBNSA-N 464.547 5.007 5 20 JKBD Cc1ccc(Sc2ccc(C(=O)Nc3cc(C(=O)NC4CC4)ccc3C)cc2[N+](=O)[O-])cc1 483699662 NWSKAZJRTDCESU-UHFFFAOYSA-N 461.543 5.507 5 20 JKBD O=C(Nc1nc2ccccc2n1-c1ccccc1)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-] 488567053 JYSHMUXTCDGXDD-UHFFFAOYSA-N 456.380 5.127 5 20 JKBD CCC(C)(C)NC(=O)c1ccc(NC(=O)CSCc2ccc(OC)c([N+](=O)[O-])c2)cc1Cl 489632689 IAXOQVWOTXNTCD-UHFFFAOYSA-N 479.986 5.047 5 20 JKBD COc1cc(C(=O)N(C)[C@H](C)c2ccc(C)cc2C)c([N+](=O)[O-])cc1OCc1cscn1 503301571 JJUDCUYUFMAPLF-MRXNPFEDSA-N 455.536 5.089 5 20 JKBD COc1ccc(CN[C@@H]2CCCOc3ccc(F)cc32)cc1OCc1ccc([N+](=O)[O-])cc1 507895147 KECXSUNOVBESEJ-JOCHJYFZSA-N 452.482 5.325 5 20 JKBD COc1ccc(CN[C@H]2CCCOc3ccc(F)cc32)cc1OCc1ccc([N+](=O)[O-])cc1 507895149 KECXSUNOVBESEJ-QFIPXVFZSA-N 452.482 5.325 5 20 JKBD Cc1ccc(C(C)C)c(Oc2ccc(CNCc3ccc(N4CCO[C@@H](C)C4)nc3)cc2[N+](=O)[O-])c1 509599818 KBLNSBYXFKKSNS-NRFANRHFSA-N 490.604 5.729 5 20 JKBD O=C(Cn1c2ccccc2c(=O)c2ccccc21)Nc1ccccc1-c1n[nH]c(-c2ccccc2)n1 510945832 MUIPGALZSWPOIN-UHFFFAOYSA-N 471.520 5.246 5 20 JKBD CCc1ccc([C@@H](NC(=O)c2cc(OC)c(OCc3cscn3)cc2[N+](=O)[O-])C(C)C)cc1 512305382 DLDFZJOEYZLNBO-QHCPKHFHSA-N 469.563 5.328 5 20 JKBD O=C(Nc1ccc(NC2CCOCC2)cc1)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 513054598 PHSDOZHEXIGQQV-UHFFFAOYSA-N 492.498 5.060 5 20 JKBD CCn1c(SCc2nc(-c3ccc([N+](=O)[O-])cc3)no2)nnc1-c1ccc(C(C)(C)C)cc1 515244156 FTKMYTNACXQNIH-UHFFFAOYSA-N 464.551 5.513 5 20 JKBD CC(C)N(C(=O)c1ccc(N2C[C@@H](C)C[C@@H](C)C2)c([N+](=O)[O-])c1)c1ccc(Br)cn1 515624507 FWHXOLMFEDKVRD-IYBDPMFKSA-N 475.387 5.290 5 20 JKBD Cc1[nH]nc2ncc(NC(=O)C/C(=C/c3ccc([N+](=O)[O-])cc3)c3nc4ccccc4s3)cc12 518531591 KZDZVHDSFNXNLH-YBEGLDIGSA-N 470.514 5.354 5 20 JKBD Cc1ccc(NC(=O)c2ccc(N3CCC[C@H](C)C3)c([N+](=O)[O-])c2)cc1NC(=O)c1ccncc1 520745398 FOVSHTAGTUDUSG-KRWDZBQOSA-N 473.533 5.039 5 20 JKBD COc1ccc(CC[C@@H]2CCCCN2C(=O)[C@H](C)Sc2ccc([N+](=O)[O-])cc2)cc1OC 522368761 DEMUVMXBSWXGCR-HKUYNNGSSA-N 458.580 5.107 5 20 JKBD Cc1ccc(C(=O)Nc2nc3ccc(NC(=O)c4ccc([N+](=O)[O-])cc4F)cc3s2)s1 522577489 ORCHWTXPFFBZEL-UHFFFAOYSA-N 456.480 5.218 5 20 JKBD C[C@@H](SCc1nc(O)c2c(-c3ccccc3)csc2n1)C(=O)N1CCc2cc([N+](=O)[O-])ccc21 591602085 OMDULJBUKSBUBZ-CQSZACIVSA-N 492.582 5.183 5 20 JKBD C[C@H](c1ccccc1Cl)N(C)C(=O)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 603511617 NIMKJJURCOAKEP-CQSZACIVSA-N 469.891 5.703 5 20 JKBD Cc1ccc(OCc2nc(CC(=O)N(Cc3ccccc3[N+](=O)[O-])CC(F)(F)F)cs2)cc1 603614420 XSOWIJBCPWBDSN-UHFFFAOYSA-N 479.480 5.072 5 20 JKBD COc1ccc([N+](=O)[O-])cc1C(=O)Nc1ccc(NC(=O)c2ccccc2)cc1C(F)(F)F 603742998 PSVPDYIIXHEKHV-UHFFFAOYSA-N 459.380 5.127 5 20 JKBD COc1cccc(/C=C(/CC(=O)NCc2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)c1 603999212 QVCDBFUMEBVRIN-UYRXBGFRSA-N 459.527 5.460 5 20 JKBD C[C@H](Sc1nc(-c2cccs2)nc2ccccc12)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 612745203 QVJQRMUPFKBZAP-ZDUSSCGKSA-N 461.528 6.170 5 20 JKBD Cc1ccc(NC(=O)[C@H](OC(=O)c2csc(-c3ccccc3C)n2)c2ccccc2)c([N+](=O)[O-])c1 727562291 WNAPWMMPHMHCCU-HSZRJFAPSA-N 487.537 5.872 5 20 JKBD CC1CCN(C(=O)C2CCN(C(=O)CCC(=O)c3ccc4ccc5cccc6ccc3c4c56)CC2)CC1 727768222 WMUZDQQQEUXTRM-UHFFFAOYSA-N 494.635 6.044 5 20 JKBD O=C(COC(=O)c1sc2cc(Br)ccc2c1Cl)Nc1cc([N+](=O)[O-])ccc1F 729870786 JICBDEQQRVZUEB-UHFFFAOYSA-N 487.690 5.160 5 20 JKBD Cc1ccc(F)c(NC(=S)/C(=C(/O)c2ccc([N+](=O)[O-])cc2)[n+]2ccc(C(C)(C)C)cc2)c1 744115779 HKZZVVSTSQCYND-UHFFFAOYSA-O 466.558 5.951 5 20 JKBD Cc1c(C(=O)Nc2nc3c(s2)C[C@@H](c2ccccc2)CC3)cc([N+](=O)[O-])c(C)c1[N+](=O)[O-] 748634209 VNNQXARJYIHMAA-HNNXBMFYSA-N 452.492 5.101 5 20 JKBD O=C(Cn1c2ccccc2c(=O)c2ccccc21)Nc1ccccc1C(=O)Nc1cccc(Cl)c1 836182952 LMROWNFEOIJKFB-UHFFFAOYSA-N 481.939 5.699 5 20 JKBD O=[N+]([O-])c1ccc(/C(O)=C(/C(=S)NCc2cccs2)[n+]2ccc(Cc3ccccc3)cc2)cc1 839412500 VDSGZEYYKKUUMS-UHFFFAOYSA-O 488.614 5.536 5 20 JKBD CC(=O)Nc1cccc(OC(=O)C/C(=C/c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)c1 904792485 MWEPLCKAADTBTC-AQTBWJFISA-N 473.510 5.699 5 20 JKBD CC(=O)N[C@H](CC(=O)Nc1cc(Cl)c([N+](=O)[O-])cc1OCc1ccccc1)c1ccccc1 916827392 GMGYOBDGQBQESW-HXUWFJFHSA-N 467.909 5.033 5 20 JKBD CC(C)(C)n1nc(C(=O)O[C@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2ccccc2)cc1C1CC1 919375359 QVWOHDBMHDMNCE-QFIPXVFZSA-N 496.951 5.614 5 20 JKBD C[C@@H](NC(=O)c1cc([N+](=O)[O-])ccc1Sc1ccccc1)c1ccc(N2CCCC2=O)cc1 920944822 FOSNWGDHIVJSJF-QGZVFWFLSA-N 461.543 5.364 5 20 JKBD COc1cc(C2SCCS2)ccc1OC(=O)CSc1ccc(C(F)(F)F)cc1[N+](=O)[O-] 921194731 NXGLSMFBMDYEOB-UHFFFAOYSA-N 491.534 5.799 5 20 JKBD CC(C)c1csc(C(=O)Nc2ccc(C3(NC(=O)/C=C/c4ccc([N+](=O)[O-])o4)CCC3)cc2)n1 1787003516 HUHSWQIGBIXXSI-CSKARUKUSA-N 480.546 5.229 5 20 JKBD Cc1cc(C)nc(C(=O)NC2(c3ccc(NC(=O)CSc4ccccc4[N+](=O)[O-])cc3)CCC2)c1 1791522149 GULVBIMSTOACLK-UHFFFAOYSA-N 490.585 5.147 5 20 JKBD O=C(Cc1cc(F)ccc1[N+](=O)[O-])Nc1ccc(C2(NC(=O)[C@@]3(F)CCCC=C3F)CCC2)cc1 1792309116 AESKFHPMVFBREU-RUZDIDTESA-N 487.478 5.156 5 20 JKBD Cc1cccc(C(=O)N2CCCC[C@H]2c2cc(NC(=O)c3cc(F)cc([N+](=O)[O-])c3)n[nH]2)c1Cl 1821168110 ISBWLEFCICMYPE-IBGZPJMESA-N 485.903 5.039 5 20 JKBD Cc1c(Cl)cccc1C(=O)N1CCCC[C@@H]1C1CCN(C(=O)Cc2cccc([N+](=O)[O-])c2)CC1 1823914242 KRELZYLAEWJSDR-XMMPIXPASA-N 483.996 5.033 5 20 JKBD CCCCC[C@H](C)C(=O)N1CCC([C@@H]2CCCCN2C(=O)/C=C/c2ccc([N+](=O)[O-])o2)CC1 1824279376 VNGOBNBJTJWJQH-LBGHRLISSA-N 459.587 5.037 5 20 JKBD CCc1ccnc(C(=O)N2CCCC[C@H]2C2CCN(C(=O)c3cc(Cl)cc([N+](=O)[O-])c3C)CC2)c1 1827360479 XXDKWROLYVOJJP-QHCPKHFHSA-N 499.011 5.061 5 20 JKBD O=C(c1cccc2ccccc12)N1CCC([C@@H]2CCCCN2C(=O)c2cc(F)cc([N+](=O)[O-])c2)CC1 1830616993 JHLCEBNBNKWHNY-SANMLTNESA-N 489.547 5.434 5 20 JKBD Cc1noc2nc(C3CC3)cc(C(=O)Oc3ccc(NC(=O)c4cc([N+](=O)[O-])ccc4Cl)cc3)c12 9675124 BFXDBANYKHWZDQ-UHFFFAOYSA-N 492.875 5.442 5 20 JKBD Cc1cc(C)c(NC(=O)COC(=O)Cc2cn(-c3ccccc3)nc2-c2ccc([N+](=O)[O-])cc2)c(C)c1 18961448 NXRBQBHCQPRYCW-UHFFFAOYSA-N 498.539 5.097 5 20 JKBD COc1ccccc1/C=C(/C(=O)O[C@H](C)C(=O)Nc1cccc([N+](=O)[O-])c1C)c1ccccc1 23278407 VBCKPJFTYVDTMS-WKSXIXGESA-N 460.486 5.023 5 20 JKBD CCCOc1c(Cl)cc(/C=C2\CCn3c2nc2ccc([N+](=O)[O-])cc2c3=O)cc1OCC 23379603 FXOMQTPEUXXOPI-XNTDXEJSSA-N 455.898 5.090 5 20 JKBD C[C@@H](c1cccc(NC(=O)c2ccccc2)c1)N(C)C(=O)COc1ccc(Cl)cc1[N+](=O)[O-] 24123014 BPARRRQSHAVCEO-INIZCTEOSA-N 467.909 5.099 5 20 JKBD Cc1c(NC(=O)[C@@H](C)Sc2nnc(SCc3ccc(C(C)C)cc3)s2)cccc1[N+](=O)[O-] 24160950 BRNINAOPUDDMHB-OAHLLOKOSA-N 488.660 6.290 5 20 JKBD C[C@@H](NC(=O)c1ccc(N2CCCC2)c([N+](=O)[O-])c1)c1ccc(NC(=O)Nc2ccccc2)cc1 71958897 XTMXTDKQLMDNAS-GOSISDBHSA-N 473.533 5.330 5 20 JKBD O=[N+]([O-])c1cccc(F)c1CSc1nnc(SCc2c(F)cccc2[N+](=O)[O-])s1 97549856 YIVZHRQZLZINMD-UHFFFAOYSA-N 456.477 5.217 5 20 JKBD Cc1nc(COc2ccc(NC(=O)c3ccc(NCc4ccccc4Cl)c([N+](=O)[O-])c3)cc2)no1 303270905 HGZJFORRKPCJAR-UHFFFAOYSA-N 493.907 5.383 5 20 JKBD O=C(NCc1nnc2n1CCCCC2)c1ccccc1Sc1ccc(C(F)(F)F)cc1[N+](=O)[O-] 489487128 SRSMNUCMZGXYKA-UHFFFAOYSA-N 491.495 5.013 5 20 JKBD O=C(NCc1cn2cc(Br)ccc2n1)c1cc([N+](=O)[O-])ccc1Sc1ccccc1 492210492 XOVFWIVIABNSBH-UHFFFAOYSA-N 483.347 5.086 5 20 JKBD C[C@@H](Sc1nc(O)c2c(-c3ccc(F)cc3)csc2n1)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 501670908 IPBRCULRDDHCOH-LLVKDONJSA-N 495.517 6.015 5 20 JKBD CCn1c([C@@H]2CCCN2C(=O)c2ccc(N[C@H](C)c3ccccn3)c([N+](=O)[O-])c2)nc2ccccc21 506137352 DSHOZNFHVQPJCB-KOSHJBKYSA-N 484.560 5.510 5 20 JKBD C[C@H](Nc1ccc(C(=O)N(C)[C@H](C)c2ccc(C(F)(F)F)cc2)cc1[N+](=O)[O-])c1ccccn1 506188065 GOHHUSIZJIDBPC-JKSUJKDBSA-N 472.467 6.015 5 20 JKBD COc1cc(C(=O)Nc2ccccc2Oc2cccc(C)c2)c([N+](=O)[O-])cc1OCc1cscn1 512275047 GIKAAEWMGGDFIP-UHFFFAOYSA-N 491.525 5.992 5 20 JKBD Cc1cccc(C(=O)NC[C@@H](c2ccc(Cl)cc2)N2CCc3sccc3C2)c1[N+](=O)[O-] 514160344 NRJHMOVSPAUJCQ-FQEVSTJZSA-N 455.967 5.148 5 20 JKBD O=C(CCn1cc([N+](=O)[O-])cn1)N(c1ccc(Cl)c(Cl)c1)c1nc2ccccc2s1 520079501 WAUSDNRSKQFMRO-UHFFFAOYSA-N 462.318 5.463 5 20 JKBD Cc1ccccc1NC(=O)[C@H]1CCc2ccccc2N1C(=O)c1ccc(NC2CC2)c([N+](=O)[O-])c1 524164144 NRAWQDVZMBHWDD-XMMPIXPASA-N 470.529 5.078 5 20 JKBD O=C(c1cc([N+](=O)[O-])ccc1NCc1ccccc1)N1C[C@H]2CC[C@H]1[C@H]1CN(Cc3ccccc3)C[C@@H]21 594657578 HBHALSFEFPWVFU-CDDNLWLVSA-N 496.611 5.190 5 20 JKBD C[C@H](Nc1nc(CN2CCOCC2)nc2scc(-c3ccccc3)c12)c1cccc([N+](=O)[O-])c1 603867237 GJKCHIXVQJTZSE-KRWDZBQOSA-N 475.574 5.272 5 20 JKBD C[C@H]1CCCN(c2ccc(C(=O)NCc3cccc(COCc4ccco4)c3)cc2[N+](=O)[O-])C1 603882375 AYSJWRHEHXGHNK-IBGZPJMESA-N 463.534 5.071 5 20 JKBD Cc1ccc(-n2c(S[C@@H](C)C(=O)Nc3cccc([N+](=O)[O-])c3C)nnc2-c2ccccn2)c(C)c1 603917926 NOQGYRYDQHAMBN-SFHVURJKSA-N 488.573 5.282 5 20 JKBD Cc1ncc([N+](=O)[O-])cc1C(=O)NCc1ccc(Oc2ccc(Oc3ccccc3)cc2)nc1 603988087 ZGTSYBDDGKMGFQ-UHFFFAOYSA-N 456.458 5.208 5 20 JKBD COc1ccc(Oc2ccc([N+](=O)[O-])cc2C(=O)N2CCC[C@H](CN(C)C(=O)OC(C)(C)C)C2)cc1 744340943 CZLJTAOKZWQGHJ-GOSISDBHSA-N 499.564 5.115 5 20 JKBD CCN(CCc1ccccn1)C(=O)C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1 746834763 VVKWULGJYPITSN-LVZFUZTISA-N 472.570 5.621 5 20 JKBD O=C(Nc1ccn(Cc2ccccn2)n1)c1ccccc1Sc1ccc(C(F)(F)F)cc1[N+](=O)[O-] 748675168 KPXSIWGQLVHHTB-UHFFFAOYSA-N 499.474 5.657 5 20 JKBD Cc1ccc(C)c(NC(=O)[C@@H](OC(=O)C2CCN(c3ccccc3[N+](=O)[O-])CC2)c2ccccc2)c1 844239971 RADMYQJDBLNKGZ-SANMLTNESA-N 487.556 5.351 5 20 JKBD COc1ccc(NC(=O)[C@@H](C)OC(=O)c2csc(-c3ccc(C(C)C)cc3)n2)c([N+](=O)[O-])c1 900259009 WOSPPNGUCWMKPK-CQSZACIVSA-N 469.519 5.034 5 20 JKBD C[C@@H](OC(=O)/C=C\c1ccc2ccc(Cl)cc2n1)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 912873971 RKNTZFJOXQFYRF-BIRHUZIMSA-N 450.838 5.164 5 20 JKBD O=C(COC(=O)c1sc2cccc(Cl)c2c1Cl)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 913330812 DYJOEKYKNAEZIJ-UHFFFAOYSA-N 493.246 5.931 5 20 JKBD CCCN1C(=S)N[C@H](c2cccc([N+](=O)[O-])c2)C(C(=O)Nc2ccccc2C(F)(F)F)=C1C 916168828 QTGRHZROZUTDFO-LJQANCHMSA-N 478.496 5.168 5 20 JKBD Cc1cccc(C(=O)N(C)Cc2cc([N+](=O)[O-])ccc2Cl)c1NC(=O)c1ccccc1F 918320831 TZDHOANNKQPWHE-UHFFFAOYSA-N 455.873 5.220 5 20 JKBD C[C@H](c1ccccc1)N1CC[C@H](NC(=O)c2ccccc2NC(=O)c2ccc([N+](=O)[O-])cc2Cl)C1 919857431 PWONIAHFIZYGDQ-MJGOQNOKSA-N 492.963 5.066 5 20 JKBD Cn1cc(CC(=O)O[C@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2ccccc2)c2ccccc21 920706240 JATYLFYOUGSOLN-DEOSSOPVSA-N 477.904 5.206 5 20 JKBD CCN(Cc1ccccc1NC(=O)[C@@H](C)Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)OC(C)(C)C 920822667 DAHSGJOCKOLAPR-OAHLLOKOSA-N 477.945 5.411 5 20 JKBD Cc1ccc(C(=O)Nc2cccc(C(F)(F)F)c2)cc1NC(=O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1 920844532 FGLIYYMWNLVGPM-UHFFFAOYSA-N 488.378 5.335 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)NC1(c2ccc(NC(=O)c3scnc3C3CC3)cc2)CCC1 1787186242 DHCMFCWBLMTEQD-UHFFFAOYSA-N 494.548 5.438 5 20 JKBD COc1cc(C(=O)NC2(c3ccc(NC(=O)CCC4CCCC4)cc3)CCC2)c([N+](=O)[O-])cc1O 1787618263 HEIFNTGBBHOFFH-UHFFFAOYSA-N 481.549 5.027 5 20 JKBD Cc1ccc2oc(C(=O)NC3(c4ccc(NC(=O)c5ccc([N+](=O)[O-])cc5F)cc4)CCC3)cc2n1 1790624052 XEJFJILGLXIZNF-UHFFFAOYSA-N 488.475 5.245 5 20 JKBD CCOc1ccsc1C(=O)NC1(c2ccc(NC(=O)c3cccc(F)c3[N+](=O)[O-])cc2)CCC1 1790700309 ZGNUYJXKJQTUJG-UHFFFAOYSA-N 483.521 5.256 5 20 JKBD Cc1c(C(=O)Nc2ccc(C3(NC(=O)c4cnoc4C4CC4)CCC3)cc2)cc(Cl)cc1[N+](=O)[O-] 1790773887 JROLHLKPZVBKGC-UHFFFAOYSA-N 494.935 5.484 5 20 JKBD O=C(CCc1cccc([N+](=O)[O-])c1)NC1(c2ccc(NC(=O)C(F)(F)c3ccco3)cc2)CCC1 1791076570 HDSBDVLFLLEPFK-UHFFFAOYSA-N 483.471 5.047 5 20 JKBD O=C(Nc1cc([C@@H]2CCCCN2C(=O)CCc2cccc([N+](=O)[O-])c2)[nH]n1)c1cccc2ccccc12 1818451070 SKTLPPSMTYUIGS-VWLOTQADSA-N 497.555 5.410 5 20 JKBD O=C(/C=C/c1ccccc1)N1CCC([C@H]2CCCCN2C(=O)Cc2ccc(Cl)cc2[N+](=O)[O-])CC1 1824162345 VFONNPISPGZABY-XJCKULRNSA-N 496.007 5.124 5 20 JKBD CC[C@H](C(=O)N1CCC([C@@H]2CCCCN2C(=O)/C=C/c2ccc([N+](=O)[O-])o2)CC1)c1ccccc1 1824274302 DVYBNZUIJLBQHO-QAYVAONCSA-N 479.577 5.015 5 20 JKBD Cc1cc2[nH]c(C(=O)N3CCC([C@@H]4CCCCN4C(=O)c4cccc(F)c4[N+](=O)[O-])CC3)cc2s1 1830621713 RMPLXAPUCWDRRD-NRFANRHFSA-N 498.580 5.132 5 20 JKBD O=C(c1ccc([N+](=O)[O-])cc1F)N1CC[C@H]2[C@@H]1CCN2C(=O)C1CCC(c2ccc(Cl)cc2)CC1 1847619758 XBKDJGSHKIMKNK-HPCWMKLOSA-N 499.970 5.177 5 20 JKBD CC[C@H](C)[C@H](C(=O)O[C@@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F)c1ccccc1 9097922 MGTGJSUMDKKQEX-NJSLBKSFSA-N 452.429 5.314 5 20 JKBD C[C@@H](Sc1nnc(Nc2ccccc2F)s1)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 10316395 ANHYPNBCPDUIBL-SECBINFHSA-N 487.460 5.467 5 20 JKBD CC(C)n1ncc2c(C(=O)OCC(=O)Nc3ccc([N+](=O)[O-])cc3Cl)cc(-c3cccs3)nc21 11049545 VPQVWUKDZNWBOA-UHFFFAOYSA-N 499.936 5.098 5 20 JKBD Cc1csc(Sc2ccc(C(=O)N3CC=C(c4c[nH]c5ccccc45)CC3)cc2[N+](=O)[O-])n1 14348852 ANWZYBGKCOAEBM-UHFFFAOYSA-N 476.583 5.922 5 20 JKBD Cc1c(-c2ccccc2)sc(NC(=O)c2ccc([N+](=O)[O-])cc2Cl)c1C(=O)N1CCOCC1 14389812 IMMAUYOGJIGOMM-UHFFFAOYSA-N 485.949 5.010 5 20 JKBD Cc1occc1-c1nnc(SCC(=O)Nc2ccc([N+](=O)[O-])cc2Cl)n1Cc1ccccc1 21622038 XWCIBGQLHQUGHW-UHFFFAOYSA-N 483.937 5.187 5 20 JKBD O=C(C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)NC[C@@H]1CCN(c2ccccc2)C1 27839203 SYDSRNYCVPRUDD-YVUGPFRESA-N 498.608 5.778 5 20 JKBD COc1cc(C(=O)Nc2cc(C(=O)N(C)C)ccc2C)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 481542244 HYOOGUFWZWGYKA-UHFFFAOYSA-N 483.908 5.312 5 20 JKBD Cc1ccc(C(=O)Nc2ccccc2)cc1NC(=O)c1ccc(N2CCC[C@H](C)C2)c([N+](=O)[O-])c1 483300882 UJWAHYJDBDMCSM-SFHVURJKSA-N 472.545 5.644 5 20 JKBD COc1ccc(/C=C2/CCn3c2nc2cc(Cl)ccc2c3=O)cc1OCc1ccc([N+](=O)[O-])cc1 483377635 PGFQUQMTEMVUDI-PDGQHHTCSA-N 489.915 5.490 5 20 JKBD CCN(Cc1ccccc1)C(=O)c1cc(NC(=O)c2ccc(Cl)cc2[N+](=O)[O-])ccc1Cl 489170121 KFEUICZCOWFKPR-UHFFFAOYSA-N 472.328 5.816 5 20 JKBD COc1cc(C(=O)Nc2ccc(C(=O)NC(C)C)cc2C)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 490006632 BQAJGAAQJFQQEE-UHFFFAOYSA-N 497.935 5.748 5 20 JKBD O=C(Nc1ccc(CNC(=O)c2cc([N+](=O)[O-])ccc2Sc2ccccc2)cc1)c1cccnc1 499626364 NMHAQNHYJNFUBS-UHFFFAOYSA-N 484.537 5.323 5 20 JKBD CC(C)CCOC1CCN(C(=O)c2ccc(NCc3ccccc3Cl)c([N+](=O)[O-])c2)CC1 500488423 NVFZLNHHQVYTMI-UHFFFAOYSA-N 459.974 5.528 5 20 JKBD COc1cc([C@@H](C)NC(=O)N(Cc2ccc([N+](=O)[O-])cc2)C(C)C)ccc1OC1CCCC1 509279598 QCIOUWQNSSHMRJ-GOSISDBHSA-N 455.555 5.606 5 20 JKBD CCN(Cc1ccccc1)C(=O)c1cc(NC(=O)N(C)Cc2ccccc2[N+](=O)[O-])ccc1Cl 510881872 JZSCKNKAZSZPDL-UHFFFAOYSA-N 480.952 5.574 5 20 JKBD CSc1ccc(C(=O)c2ccccc2C(=O)N2CCC(OCc3ccccc3)CC2)cc1[N+](=O)[O-] 514540681 MPEAHKHGDRXIFC-UHFFFAOYSA-N 490.581 5.369 5 20 JKBD O=C(c1ccc([N+](=O)[O-])s1)N(C[C@@H]1CCCO1)c1nc(-c2cccc(C(F)(F)F)c2)cs1 514935538 NPFAEYWCIVRNCM-AWEZNQCLSA-N 483.493 5.624 5 20 JKBD C[C@H](Nc1cccc(OCc2cccc(F)c2)c1)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 515735390 BUGUMKDDPWBIFH-AWEZNQCLSA-N 477.414 5.771 5 20 JKBD CN(C[C@H]1CCCOC1)C(=O)c1c2c(nc3ccccc13)/C(=C\c1cccc([N+](=O)[O-])c1)CCC2 518083089 KXJAVGJNWYBYNW-YLCCHKQJSA-N 471.557 5.519 5 20 JKBD O=C(Nc1cc(C(F)(F)F)ccc1N1CCCC1)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-] 518228203 VBJPYLYVISIYEA-UHFFFAOYSA-N 477.361 5.407 5 20 JKBD CC(=O)Nc1ccc(C(F)(F)F)cc1NC(=O)c1ccc(N2CCC[C@@H](C)C2)c([N+](=O)[O-])c1 521239298 IRYDCLGSRZDIAT-CYBMUJFWSA-N 464.444 5.061 5 20 JKBD Cc1nn(Cc2ccc(C(=O)Nc3ccc(NC(=O)c4cccs4)cc3)cc2)c(C)c1[N+](=O)[O-] 522177672 SVOMKUOVFLRYSA-UHFFFAOYSA-N 475.530 5.023 5 20 JKBD COc1cccc([C@@H](CNc2ccc([N+](=O)[O-])c(C(=O)O)c2)c2c[nH]c3ccccc23)c1OC 579139721 BXSPJPWYGBHJFH-HXUWFJFHSA-N 461.474 5.036 5 20 JKBD COc1cc(C(=O)Nc2nc(-c3ccc(-c4ccccc4)cc3)cs2)c([N+](=O)[O-])cc1OC(F)F 585691736 SPMVUHIBOFNCCE-UHFFFAOYSA-N 497.479 6.248 5 20 JKBD O=[N+]([O-])c1ccc(-c2noc(CSc3nnc(COc4ccc(Cl)cc4Cl)o3)n2)cc1 603749661 SQAOKFLJBJJMNB-UHFFFAOYSA-N 480.289 5.206 5 20 JKBD O=[N+]([O-])c1ccc(-c2ccc(CN[C@@H]3CCOc4c(Cl)cccc43)o2)c(Br)c1 608836607 XWYSWJFWYZNYJU-GOSISDBHSA-N 463.715 5.884 5 20 JKBD Cc1ccc([C@H](C)NC(=O)c2ccc(C(=O)N[C@@H](C)c3ccc(C)s3)c([N+](=O)[O-])c2)s1 727851830 OGENIDXTELEXSJ-GJZGRUSLSA-N 457.577 5.317 5 20 JKBD Cc1ccc(-c2nnc(-c3ccc(C(=O)OCC4CCN(c5ccc([N+](=O)[O-])cn5)CC4)cc3)o2)cc1 750434807 ZQFPKYRXCGFRSV-UHFFFAOYSA-N 499.527 5.089 5 20 JKBD Cc1cc(N2CCCC2)ccc1NC(=O)c1ccccc1NC(=O)c1ccc([N+](=O)[O-])cc1Cl 874434839 CIKYQEVBKOQBJD-UHFFFAOYSA-N 478.936 5.661 5 20 JKBD Cc1nc(-c2cccc(Cl)c2)sc1C(=O)OCc1nc(-c2ccc([N+](=O)[O-])cc2)no1 919007723 VQKYVJQKRJMVRX-UHFFFAOYSA-N 456.867 5.087 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Cl)[C@H](c1ccccc1)N1CCc2c(ncn2-c2ccccc2)C1 929072335 LWNJTYBYGGVTFU-VWLOTQADSA-N 487.947 5.172 5 20 JKBD O=C(CCc1ccccc1Cl)NC1(c2ccc(NC(=O)c3ccc([N+](=O)[O-])o3)cc2)CCC1 1785747585 BMPGOABVLHDFJM-UHFFFAOYSA-N 467.909 5.222 5 20 JKBD O=C(Cc1cc([N+](=O)[O-])ccc1F)NC1(c2ccc(NC(=O)c3cc4ccccc4o3)cc2)CCC1 1789003772 AFIUKPACOOINGJ-UHFFFAOYSA-N 487.487 5.471 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)NC1(c2ccc(NC(=O)c3ccc4nccnc4c3)cc2)CCC1 1789065735 CTMZCRMQAZJKQH-UHFFFAOYSA-N 499.502 5.047 5 20 JKBD COc1cc(CC(=O)Nc2ccc(C3(NC(=O)[C@]4(C)CC=CCC4)CCC3)cc2)ccc1[N+](=O)[O-] 1790480271 OSUHAYALFGTHAB-AREMUKBSSA-N 477.561 5.026 5 20 JKBD COc1ccc(CC(=O)Nc2ccc(C3(NC(=O)[C@@H](C)c4ccccc4)CCC3)cc2)c([N+](=O)[O-])c1 1790573995 QJOZGSOICPQEQD-IBGZPJMESA-N 487.556 5.084 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)c3cccc4cc[nH]c34)CCC2)cc1)c1ccc([N+](=O)[O-])cc1F 1790622271 PUURBNKOTDWZMB-UHFFFAOYSA-N 472.476 5.277 5 20 JKBD Cc1c(C(=O)Nc2ccc(C3(NC(=O)c4cncc(F)c4)CCC3)cc2)cc(Cl)cc1[N+](=O)[O-] 1790774332 LKMGNMCEVDDXGE-UHFFFAOYSA-N 482.899 5.152 5 20 JKBD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2ccoc2Cl)[nH]n1)c1cc2cc([N+](=O)[O-])ccc2s1 1821609301 BHIIZWDABGBFPD-INIZCTEOSA-N 499.936 5.399 5 20 JKBD CC(C)[C@@H](C(=O)N1CCCC[C@@H]1C1CCN(C(=O)Cc2cccc([N+](=O)[O-])c2)CC1)c1ccccc1 1824236887 YEJZPVOLVHLDRG-IXCJQBJRSA-N 491.632 5.197 5 20 JKBD O=C(/C=C/c1ccc([N+](=O)[O-])o1)N1CCC([C@@H]2CCCCN2C(=O)c2cc3sccc3s2)CC1 1828547623 YQEGANJBGUXULG-JXTAAOLFSA-N 499.614 5.411 5 20 JKBD Cc1ccc(CC(=O)N2CCC([C@H]3CCCCN3C(=O)c3cc4cc([N+](=O)[O-])ccc4s3)CC2)o1 1831061169 BTZZPVJRYUPLJY-JOCHJYFZSA-N 495.601 5.187 5 20 JKBD Cc1ccc(/C=C/C(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3ccc([N+](=O)[O-])cc3F)CC2)s1 1832173198 CXGNBWIVTACABY-YIEPXFBBSA-N 485.581 5.051 5 20 JKBD Cc1c(C(=O)N2CCCC23CN(C(=O)c2cc(Cl)sc2Cl)C3)cc(Cl)cc1[N+](=O)[O-] 1845499688 WXDCHLIZEQVMHR-UHFFFAOYSA-N 488.780 5.056 5 20 JKBD C[C@H](Sc1nnc(-c2cccnc2)n1Cc1ccccc1)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 17664548 ZWOCKTQKBMLGDE-INIZCTEOSA-N 485.529 5.200 5 20 JKBD Cc1csc(Sc2ccc(C(=O)Nc3nnc(Cc4ccccc4)s3)cc2[N+](=O)[O-])n1 21564208 SMTZYPPHAJLOGN-UHFFFAOYSA-N 469.573 5.206 5 20 JKBD COc1ccccc1N(Cc1cccc2cccnc12)S(=O)(=O)c1cc([N+](=O)[O-])ccc1Cl 25806426 QSENIBWRBBZYSX-UHFFFAOYSA-N 483.933 5.201 5 20 JKBD O=C(CSc1nnc(-c2ccc(Cl)cc2)n1Cc1ccccc1)Nc1ccccc1[N+](=O)[O-] 28609072 LGSKQYREFPPVKF-UHFFFAOYSA-N 479.949 5.286 5 20 JKBD C[C@@H](NC(=O)C1CCN(c2ccccc2[N+](=O)[O-])CC1)c1ccc(NC(=O)c2ccc(F)cc2)cc1 68737195 ZIJFEJGNQRFPGV-GOSISDBHSA-N 490.535 5.080 5 20 JKBD COc1ccc(-c2nc(C)c(C(=O)N(Cc3ccccc3[N+](=O)[O-])CC(F)(F)F)s2)cc1OC 69643608 CVINOKPKKIGFMQ-UHFFFAOYSA-N 495.479 5.249 5 20 JKBD COc1ccccc1-c1csc(NC(=O)c2ccc(N3CCC(C)CC3)c([N+](=O)[O-])c2)n1 71892263 FHYGKKFCOSFCDK-UHFFFAOYSA-N 452.536 5.216 5 20 JKBD CC(C)(C)OC(=O)Nc1ccc(F)c(NC(=O)c2ccc(Br)c([N+](=O)[O-])c2)c1 71895050 UCSHDPKNAJUFKZ-UHFFFAOYSA-N 454.252 5.096 5 20 JKBD C[C@@H](Nc1ccc(C(=O)N(C)CCCOc2ccc(Cl)cc2)cc1[N+](=O)[O-])c1ccccn1 108850096 SKAPYOSHSKZXSY-QGZVFWFLSA-N 468.941 5.357 5 20 JKBD Cc1nc(-c2ccc(F)cc2)sc1[C@H](C)NC(=O)c1ccc(N2CCCC2)c([N+](=O)[O-])c1 303189292 FGDYPAUDFHBUND-AWEZNQCLSA-N 454.527 5.257 5 20 JKBD C[C@H](NC(=O)C1CCN(c2ccccc2[N+](=O)[O-])CC1)c1ccc(NC(=O)Nc2ccccc2)cc1 480803339 GBWOMOLMMZDKPD-IBGZPJMESA-N 487.560 5.333 5 20 JKBD CCOc1cc(NC(=O)NCc2ccnc(Oc3ccc(F)cc3)c2)c([N+](=O)[O-])cc1OCC 502926636 STTRZNLYNKZMRT-UHFFFAOYSA-N 470.457 5.040 5 20 JKBD C[C@H](Nc1ccc(C(=O)Nc2c(-c3ccccc3)nc3ccccn23)cc1[N+](=O)[O-])c1ccccn1 505992449 QMCKOWJFKLHBED-SFHVURJKSA-N 478.512 5.730 5 20 JKBD CN(CCCCCc1cc(-c2ccccc2)no1)C(=O)c1csc(-c2ccc([N+](=O)[O-])cc2)n1 506524756 NZWJJONWUGNNNX-UHFFFAOYSA-N 476.558 5.858 5 20 JKBD Cc1ccc(NC(=O)c2ccc(Sc3nc(C)cs3)c([N+](=O)[O-])c2)c(OC[C@H]2CCCO2)c1 508006991 BUQJBWCSTVIQRJ-QGZVFWFLSA-N 485.587 5.629 5 20 JKBD C[C@H](Nc1cccc(NC(=O)c2ccccc2)c1)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 511022091 LLICRFYXOMJJMX-AWEZNQCLSA-N 472.423 5.305 5 20 JKBD O=C(CCNC(=O)c1ccc([N+](=O)[O-])cc1)Nc1ccc(Oc2ccccc2)cc1C(F)(F)F 521377091 FTDKQOURNIIQHS-UHFFFAOYSA-N 473.407 5.165 5 20 JKBD O=C(C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)N1CCC[C@@H](c2ncc[nH]2)C1 524340007 KTAFLZSOZDNARG-XWALVKJWSA-N 473.558 5.265 5 20 JKBD CC(C)C(=O)N1CCCN(C(=O)c2ccccc2Sc2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 551402572 NANREDSNCLCNRO-UHFFFAOYSA-N 495.523 5.095 5 20 JKBD COc1cc(C(=O)Nc2cc(C3CCCC3)nn2-c2ccccc2)c([N+](=O)[O-])cc1OC(F)F 585714152 APJXEJJAPPMUHX-UHFFFAOYSA-N 472.448 5.300 5 20 JKBD O=C(c1cc([N+](=O)[O-])ccc1NCc1ccccc1)N1C[C@@H](C(F)(F)F)C[C@H](C(F)(F)F)C1 604258310 YFXIYRVKDSXGSC-GJZGRUSLSA-N 475.389 5.410 5 20 JKBD Cc1ccc(C(=O)Nc2nc3ccc(NC(=O)c4ccc(Cl)cc4[N+](=O)[O-])cc3s2)s1 608817959 OFKXEZWKFGHPQR-UHFFFAOYSA-N 472.935 5.732 5 20 JKBD CC[C@@H](N[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Br)c1ccccc1)c1nc(C)cs1 609221515 JLZCZUZYVIXRFL-IEBWSBKVSA-N 489.395 5.543 5 20 JKBD CC[C@H](N[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Br)c1ccccc1)c1nc(C)cs1 609221517 JLZCZUZYVIXRFL-PKOBYXMFSA-N 489.395 5.543 5 20 JKBD CC(C)(C)c1ccc(C(=O)Nc2ccccc2CS(=O)(=O)c2ccccc2)cc1[N+](=O)[O-] 609375960 UZHQAPQVIKCPDJ-UHFFFAOYSA-N 452.532 5.119 5 20 JKBD Cc1ccccc1[C@@H](OC[C@H](O)Cn1cnc2cc3ccccc3cc2c1=O)c1ccccc1 636935167 SWZDBHTWZJKJEE-YWEHKCAJSA-N 450.538 5.025 5 20 JKBD COc1ccc(S(=O)(=O)N2CCCCCC2)cc1NC(=O)c1cc2ccccc2c2cccnc12 642518000 FADVZHXQMXUQPJ-UHFFFAOYSA-N 489.597 5.214 5 20 JKBD O=C(c1cccc(N2C(=O)c3ccccc3C2=O)c1)N(CC1CC1)c1ccc(Cl)c([N+](=O)[O-])c1 728167658 XCFXGLLOWOTMLA-UHFFFAOYSA-N 475.888 5.106 5 20 JKBD Cn1cnnc1C1CCN(C(=O)CCC(=O)c2ccc3ccc4cccc5ccc2c3c45)CC1 729263022 UXAASINMLVGVNH-UHFFFAOYSA-N 450.542 5.082 5 20 JKBD CCc1ccc(N(C(C)=O)c2nc(COC(=O)c3c[nH]c4ccc([N+](=O)[O-])cc34)cs2)cc1 749315918 NOQOPQBDWABHGS-UHFFFAOYSA-N 464.503 5.137 5 20 JKBD O=C(Nc1cc(N2CCCC2=O)ccc1F)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1 917797125 BPDSUQBZGJACPP-UHFFFAOYSA-N 469.856 5.559 5 20 JKBD CC(=O)N(c1nc(COC(=O)c2cc(F)cc([N+](=O)[O-])c2N)cs1)c1c(C)cc(C)cc1Cl 919505273 PONXCABYMQXDPC-UHFFFAOYSA-N 492.916 5.084 5 20 JKBD O=C(Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1)c1ccc2c(c1)C[C@@H](c1ccccc1)OC2=O 919655848 YKYBBQGNVDZZHI-QFIPXVFZSA-N 471.494 5.425 5 20 JKBD O=C(/C=C/c1ccc([N+](=O)[O-])o1)Nc1ccc(C2(NC(=O)[C@@H]3C[C@@H]3c3ccc(F)cc3)CCC2)cc1 1786205610 LABNZMHQONSDFZ-GVMLUBPESA-N 489.503 5.278 5 20 JKBD O=C(/C=C/c1ccc([N+](=O)[O-])o1)NC1(c2ccc(NC(=O)Cc3cccc4ncccc34)cc2)CCC1 1786345382 WESZIUPZSZQUAV-ACCUITESSA-N 496.523 5.126 5 20 JKBD CC(C)(C)CC(=O)Nc1ccc(C2(NC(=O)Cn3ccc4ccc([N+](=O)[O-])cc43)CCC2)cc1 1787655606 GMUQHEMLJICJRQ-UHFFFAOYSA-N 462.550 5.120 5 20 JKBD O=C(Cc1cccc([N+](=O)[O-])c1)NC1(c2ccc(NC(=O)[C@@]3(F)CCCCC3(F)F)cc2)CCC1 1789163869 RHDCVWOMARYTIH-DEOSSOPVSA-N 489.494 5.189 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)[C@@H]3CCc4cccc(Cl)c43)CCC2)cc1)c1ccc([N+](=O)[O-])[nH]1 1790185982 AZGXLIIUXBAPEO-GOSISDBHSA-N 478.936 5.054 5 20 JKBD O=C(CCc1cccc([N+](=O)[O-])c1)N1CCCC2(CCN(C(=O)c3cc4sccc4s3)CC2)C1 1806490146 IVIACWIFLKZQHM-UHFFFAOYSA-N 497.642 5.349 5 20 JKBD O=C(CCc1cccc([N+](=O)[O-])c1)Nc1cc([C@H]2CCCCN2C(=O)c2cc(F)ccc2Cl)[nH]n1 1815538836 ZFFSWYOOXREBOL-OAQYLSRUSA-N 499.930 5.049 5 20 JKBD Cc1c(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)CC3CCCC3)n[nH]2)cc(Cl)cc1[N+](=O)[O-] 1816689541 LYHKCDCAJKFEQA-LJQANCHMSA-N 473.961 5.166 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cc3[nH]ccc3s2)CC1 1830733727 RDOYRAISENKRHS-FQEVSTJZSA-N 498.580 5.132 5 20 JKBD CC(C)[C@H](C(=O)N1CCCC12CN(C(=O)c1cc3cc([N+](=O)[O-])ccc3s1)C2)c1ccccc1 1841407477 GDCYGRHPLPFWCX-QHCPKHFHSA-N 477.586 5.066 5 20 JKBD Cc1ccc(NC(=O)[C@H](Sc2nnc(-c3cccs3)o2)c2ccccc2)c([N+](=O)[O-])c1 11389784 SLAPJQDJEOQEKZ-GOSISDBHSA-N 452.517 5.487 5 20 JKBD CCOc1ccc([C@@H]2CCCN2C(=O)C2CCN(c3ccc(C(F)(F)F)cc3[N+](=O)[O-])CC2)cc1 16141835 AGVQZKRPKUVNNR-NRFANRHFSA-N 491.510 5.592 5 20 JKBD C[C@@H](OC(=O)c1ccccc1SCc1ccco1)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 16155906 WDDMIVFJOOHMFO-CQSZACIVSA-N 451.460 5.448 5 20 JKBD CCOc1ccc(NC(=O)c2ccc(NC(=O)[C@@H](C)Sc3ccc([N+](=O)[O-])cc3)cc2)cc1 22596401 LYVFHTTYSNBISE-MRXNPFEDSA-N 465.531 5.365 5 20 JKBD O=C1c2ccccc2N[C@@H](c2cn(-c3ccccc3)nc2-c2ccc([N+](=O)[O-])cc2)N1C1CC1 24099186 USBZQDVFWPNSBY-RUZDIDTESA-N 451.486 5.176 5 20 JKBD O=C(OCCCc1nc(-c2ccccc2)no1)c1ccccc1C(=O)c1ccc(Cl)c([N+](=O)[O-])c1 26903426 UAHZRVCBVXBLEI-UHFFFAOYSA-N 491.887 5.319 5 20 JKBD C[C@H]1CCC[C@H](OCc2cccc(NC(=O)Cn3c4ccccc4c(=O)c4ccccc43)c2)C1 72046318 DOVKSVGTSUSCSL-REWPJTCUSA-N 454.570 5.889 5 20 JKBD COc1ccc(-n2c(S/C=C\c3ccc([N+](=O)[O-])o3)nnc2-c2ccccc2OC)cc1 205677882 PSJFYHNAKWDRDO-YPKPFQOOSA-N 450.476 5.216 5 20 JKBD Cc1ccc(CN(C(=O)C2CCN(c3ccc(C(F)(F)F)cc3[N+](=O)[O-])CC2)C(C)C)s1 303019641 OJNQFZRQLHBQJX-UHFFFAOYSA-N 469.529 5.637 5 20 JKBD O=C(C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1)N1CCC(OC2CCCCC2)CC1 495605767 BXFAWZDUELQIMB-UHFFFAOYSA-N 483.531 5.170 5 20 JKBD Cc1ccc([N+](=O)[O-])cc1NC(=O)c1cnn(-c2ncc(Cl)cc2Cl)c1C(F)(F)F 503141906 OIQVXXFLFHOUFB-UHFFFAOYSA-N 460.199 5.062 5 20 JKBD O=C(Nc1cccc(F)c1)C1CCN(C(=O)c2cc([N+](=O)[O-])ccc2Sc2ccccc2)CC1 505245719 BPNUHPCDHGNHPD-UHFFFAOYSA-N 479.533 5.376 5 20 JKBD O=[N+]([O-])c1cc(CNCc2ccc(OCc3ccccn3)cc2)ccc1Oc1ccccc1Cl 509590015 BWPKDWROEJGWJZ-UHFFFAOYSA-N 475.932 6.304 5 20 JKBD C[C@@H]1CN(c2ccc(CNCc3ccc(Oc4ccc(Cl)cc4[N+](=O)[O-])cc3)cn2)C[C@@H](C)O1 509600732 JXVUXCGFYRRLDH-QZTJIDSGSA-N 482.968 5.339 5 20 JKBD C[C@@H](NCc1ccc(Oc2ccccc2Cl)c([N+](=O)[O-])c1)c1ccc(S(=O)(=O)N(C)C)cc1 509604036 XOOPBSFISRKWDY-MRXNPFEDSA-N 489.981 5.142 5 20 JKBD C[C@H](Nc1ccc(C(=O)NCC2(c3ccc(Cl)cc3)CCOCC2)cc1[N+](=O)[O-])c1ccccn1 510122487 XMTZNXDLFVZSOR-SFHVURJKSA-N 494.979 5.295 5 20 JKBD Cc1ncc([N+](=O)[O-])cc1C(=O)N(C[C@@H]1CCCO1)c1nc(-c2cccc(C(F)(F)F)c2)cs1 514935464 GFAQRXMEVJJXOH-KRWDZBQOSA-N 492.479 5.266 5 20 JKBD CSc1ccc(C(=O)c2ccccc2C(=O)N2C[C@H](C)O[C@@H](c3ccccc3)C2)cc1[N+](=O)[O-] 516322342 JDHWXNLPXWLFEW-GAJHUEQPSA-N 476.554 5.150 5 20 JKBD COc1cc2c(cc1CNCc1ccc(-c3ccc([N+](=O)[O-])cc3Br)o1)O[C@@H](C)C2 517538988 VOHXPFHBOQDBSM-ZDUSSCGKSA-N 473.323 5.239 5 20 JKBD CC(=O)Nc1cccc([C@@H](C)N(Cc2ccccc2)C(=O)[C@H](C)Oc2ccc(Cl)cc2[N+](=O)[O-])c1 518878498 GXMGQTVAMUYTKD-MSOLQXFVSA-N 495.963 5.764 5 20 JKBD O=C(Cc1ccc(NC(=O)c2ccc(NCc3ccccc3)c([N+](=O)[O-])c2)cc1)Nc1ccccc1F 524412024 CLVYWKNWBLMZRA-UHFFFAOYSA-N 498.514 5.780 5 20 JKBD CSc1ccc(C(=O)c2ccccc2C(=O)N2CCC[C@H](N3[C@@H](C)CC[C@H]3C)C2)cc1[N+](=O)[O-] 550895715 SFEQLYVJZCXTTJ-NSHGMRRFSA-N 481.618 5.025 5 20 JKBD CC(C)NS(=O)(=O)c1cccc(CNCc2ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])cc2)c1 556206275 LUMFPKHBFSTEQU-UHFFFAOYSA-N 489.981 5.017 5 20 JKBD O=C(Nc1cc(Cl)ccc1N1CCCCC1)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-] 556639568 NCPABZUYLFYSLL-UHFFFAOYSA-N 457.836 5.432 5 20 JKBD COc1cc(C(=O)NC[C@@H]2CC3c4ccccc4C2c2ccccc23)c([N+](=O)[O-])cc1OC(F)F 585704183 NBMLJXPLYKQSKE-ZLRLJRRKSA-N 480.467 5.232 5 20 JKBD CS(=O)(=O)c1ccc(-c2csc(NC(=O)c3cc([N+](=O)[O-])ccc3Oc3ccccc3)n2)cc1 603733090 PWVLORBUFNLOIT-UHFFFAOYSA-N 495.538 5.166 5 20 JKBD O=C(Nc1cccc(C(=O)N2CCCCC2)c1)c1cc([N+](=O)[O-])ccc1NCc1ccccc1 603990418 BRLKSXDZVQKVAU-UHFFFAOYSA-N 458.518 5.085 5 20 JKBD Cc1ccc([C@@H](C)N[C@@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Br)c2ccccc2)cc1 604047599 KLNDJLPDYRTALK-OPAMFIHVSA-N 468.351 5.696 5 20 JKBD O=C(c1cc2cc([N+](=O)[O-])ccc2s1)N1CCC[C@H](c2nc(-c3ccc(Cl)cc3)no2)C1 608818043 VCTIVOZJICUKIM-AWEZNQCLSA-N 468.922 5.533 5 20 JKBD COc1cc(C(=O)Nc2ccc(SC(C)(C)C)cc2)c([N+](=O)[O-])cc1OCc1cscn1 726756876 HYUACVCIWQBCLZ-UHFFFAOYSA-N 473.576 5.782 5 20 JKBD Cn1c(=O)n(C)c2cc(NC(=O)CCC(=O)c3ccc4ccc5cccc6ccc3c4c56)ccc21 727767998 SLIWWMFDCMGTEM-UHFFFAOYSA-N 461.521 5.376 5 20 JKBD C[C@H](Sc1nc2cc(C(F)(F)F)ccc2s1)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 753854987 UHWAOPMPTPVIGD-QMMMGPOBSA-N 495.426 6.361 5 20 JKBD CCn1c(Sc2cc(Cl)c(C(F)(F)F)cc2[N+](=O)[O-])nnc1-c1ccccc1OC 799832042 XBYUTVNKCNLWPE-UHFFFAOYSA-N 458.849 5.705 5 20 JKBD Cc1c(C(=O)O[C@@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)sc2nc(C(F)(F)F)ccc12 914679971 VOPODXOWMZVNLK-JTQLQIEISA-N 478.408 5.500 5 20 JKBD COc1cc(C(=O)N(Cc2nnc(-c3cccc([N+](=O)[O-])c3)o2)C(C)C)ccc1OC1CCCC1 916369243 BFHXZZCGFMVZCE-UHFFFAOYSA-N 480.521 5.026 5 20 JKBD C[C@@H](Nc1ccc(OC2CCCC2)c(Cl)c1)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 920061785 IBTWNXWBGIMOLD-GFCCVEGCSA-N 471.863 6.028 5 20 JKBD CC(C)[C@H](OC(=O)c1ccc(N[C@H](C)c2ccccn2)c([N+](=O)[O-])c1)C(=O)Nc1ccccc1Cl 920545331 PXISNOLGCNSMGA-MWTRTKDXSA-N 496.951 5.636 5 20 JKBD Cc1ccc(NC(=O)[C@H](OC(=O)c2csc(-c3ccccc3F)n2)c2ccccc2)c([N+](=O)[O-])c1 920730039 WPDRGAUMHWKUPB-JOCHJYFZSA-N 491.500 5.703 5 20 JKBD Cc1cccc([N+](=O)[O-])c1NC(=O)COC(=O)c1cccnc1Oc1ccc(Cl)cc1Cl 920911185 CGMZHKVXFUGCLK-UHFFFAOYSA-N 476.272 5.193 5 20 JKBD O=C(/C=C/c1ccc([N+](=O)[O-])o1)Nc1ccc(C2(NC(=O)CCCCn3cccc3)CCC2)cc1 1786207536 WYRWXIQKQXCPCV-ACCUITESSA-N 476.533 5.007 5 20 JKBD Cc1c(C(=O)NC2(c3ccc(NC(=O)c4cncs4)cc3)CCC2)cc(Cl)cc1[N+](=O)[O-] 1787534504 WBXINJSBBPXQBF-UHFFFAOYSA-N 470.938 5.075 5 20 JKBD O=C(NC1(c2ccc(NC(=O)c3cccc(F)c3[N+](=O)[O-])cc2)CCC1)c1cc2ccsc2[nH]1 1790699205 WWHNXOCQRSJVQL-UHFFFAOYSA-N 478.505 5.338 5 20 JKBD O=C(CCC1CCCC1)NC1(c2ccc(NC(=O)c3cc(O)cc([N+](=O)[O-])c3)cc2)CCC1 1790754895 KXJAIVIHSPIDAM-UHFFFAOYSA-N 451.523 5.019 5 20 JKBD CC(C)(C)c1cc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2ccc([N+](=O)[O-])[nH]2)C3)cc(C(C)(C)C)c1 1800556106 MCKRPHXQGDUJNS-WKCHPHFGSA-N 480.609 5.084 5 20 JKBD O=C(Nc1cc([C@@H]2CCCCN2C(=O)CCc2ccco2)[nH]n1)c1cc2cc([N+](=O)[O-])ccc2s1 1821612062 QMNPXNXLEZGTPN-IBGZPJMESA-N 493.545 5.064 5 20 JKBD CC(C)CCC(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)[nH]n1 1821933433 YCRPQFNMCSBYPK-GOSISDBHSA-N 469.567 5.275 5 20 JKBD C[C@@H]1CCC[C@@H]1C(=O)N1CCC([C@@H]2CCCCN2C(=O)C2(c3cccc([N+](=O)[O-])c3)CCC2)CC1 1830293231 WVVBIWGOGLJLQV-YNJKOYDBSA-N 481.637 5.072 5 20 JKBD Cc1c(Cl)ccc(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3ccc([N+](=O)[O-])[nH]3)CC2)c1Cl 1832563500 BIQVVRKZIGIURW-LJQANCHMSA-N 493.391 5.085 5 20 JKBD O=C(c1ccnc2ccccc12)N1CCC([C@@H]2CCCCN2C(=O)/C=C/c2ccccc2[N+](=O)[O-])CC1 1832906864 GUEBXZGSNPDRSB-JYSHFMIGSA-N 498.583 5.090 5 20 JKBD Cc1cccc([N+](=O)[O-])c1NC(=O)CSc1nnc(-c2ccccc2)n1-c1ccc(F)cc1 10212545 KOUZHRLEOLWBGF-UHFFFAOYSA-N 463.494 5.021 5 20 JKBD Cc1csc(Sc2ccc(C(=O)OCc3csc(-c4ccccn4)n3)cc2[N+](=O)[O-])n1 12476023 NJAQEJXPIAKLCA-UHFFFAOYSA-N 470.557 5.386 5 20 JKBD O=C(Nc1cccc(-c2nnc3n2CCCCC3)c1)c1cc([N+](=O)[O-])ccc1Sc1ccccc1 14867278 WYAYNHJGMNVLQF-UHFFFAOYSA-N 485.569 5.983 5 20 JKBD O=C(N[C@@H](c1ccccc1)c1ccc2nc(C(F)(F)F)[nH]c2c1)c1cc([N+](=O)[O-])ccc1Cl 23359637 XDXXZYDPTJGECB-IBGZPJMESA-N 474.826 5.663 5 20 JKBD CC(=O)Nc1cccc(NC(=O)[C@@H](C)OC(=O)c2ccc(Sc3ccc(C)cc3)c([N+](=O)[O-])c2)c1 23501721 SKPTXBSUDJCKBI-MRXNPFEDSA-N 493.541 5.197 5 20 JKBD O=C(c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1)N1CCC[C@H](c2nc3ccccc3o2)C1 27374822 GPPBGNAMXJIYQQ-KRWDZBQOSA-N 477.904 6.202 5 20 JKBD COc1ccccc1-c1nnc(SCC(=O)Nc2ccccc2[N+](=O)[O-])n1-c1ccc(Cl)cc1 36803516 BMGPUASLGDTZCT-UHFFFAOYSA-N 495.948 5.235 5 20 JKBD CC(C)Oc1ccc(NC(=O)C2CCN(c3ccc(C(F)(F)F)cc3[N+](=O)[O-])CC2)cc1 71930502 IRFPDBBISXQORN-UHFFFAOYSA-N 451.445 5.256 5 20 JKBD C[C@@H](Nc1ccc(C(=O)N[C@@H](c2ccccc2)c2ccncc2)cc1[N+](=O)[O-])c1ccccn1 72016895 KCDVDGZQKVRXRY-CJAUYULYSA-N 453.502 5.077 5 20 JKBD C[C@H](Nc1ccc(C(=O)N2CCn3cccc3[C@@H]2c2ccccc2)cc1[N+](=O)[O-])c1ccccn1 108940255 RXOWPBYOBAZRCN-SIBVEZHUSA-N 467.529 5.210 5 20 JKBD CCOc1c(Br)cc(Cl)cc1NC(=O)CSCc1ccc(OC)c([N+](=O)[O-])c1 116876419 VCGYVPOCIGBOTH-UHFFFAOYSA-N 489.775 5.290 5 20 JKBD O=C(Nc1ccccc1)NC1CCN(C(=O)c2cc([N+](=O)[O-])ccc2Sc2ccccc2)CC1 509682894 GWDGNEWWSCSIJA-UHFFFAOYSA-N 476.558 5.172 5 20 JKBD C[C@@H](c1ccccc1Cl)N(C(=O)c1ccc(N[C@H](C)c2ccccn2)c([N+](=O)[O-])c1)C1CC1 512099768 NHZBOCNGVHHGOT-SJORKVTESA-N 464.953 6.182 5 20 JKBD COc1cc(C(=O)N[C@@H](Cc2ccccc2)c2ccccc2)c([N+](=O)[O-])cc1OCc1cscn1 512594915 GMUWWRSUANUACA-QFIPXVFZSA-N 489.553 5.353 5 20 JKBD O=[N+]([O-])c1ccc(-c2ccc(CN[C@@H](c3ccc(F)cc3)[C@H]3CCCO3)o2)c(Br)c1 517553192 UOHXVDAKZDVCFZ-YADHBBJMSA-N 475.314 5.766 5 20 JKBD COc1ccc([C@H](Cc2ccc(F)cc2)NC(=O)C2CCN(c3ccccc3[N+](=O)[O-])CC2)cc1 520557882 RWRWXRLFQXSFNG-DEOSSOPVSA-N 477.536 5.059 5 20 JKBD O=C(Nc1cccc(C(F)(F)F)c1)c1ccccc1NCc1nc(-c2ccc([N+](=O)[O-])cc2)no1 521098120 LVXHDVKWBWUBCL-UHFFFAOYSA-N 483.406 5.528 5 20 JKBD C[C@@H](CC(=O)Nc1cccc(N2CCCC2)c1)NC(=O)c1cc([N+](=O)[O-])ccc1Oc1ccccc1 523553879 SATUTPHGZBRNGK-IBGZPJMESA-N 488.544 5.134 5 20 JKBD C[C@H](NC(=O)C(=O)Nc1ccc(Sc2ccccc2)c(Cl)c1)c1cccc([N+](=O)[O-])c1 523636284 NGQUUZHAIRPPRX-AWEZNQCLSA-N 455.923 5.215 5 20 JKBD O=[N+]([O-])c1ccc(N2CCC[C@H]2c2ccc(F)c(C(F)(F)F)c2)c(F)c1N1CCOCC1 600853320 USFZQVCOAHBLPS-INIZCTEOSA-N 457.399 5.070 5 20 JKBD O=C(Nc1nc(-c2ccc(OC(F)F)cc2)cs1)C1CCN(c2ccccc2[N+](=O)[O-])CC1 603876431 SBZVFZFRXPLMOH-UHFFFAOYSA-N 474.489 5.175 5 20 JKBD Cc1csc(Sc2ccc(C(=O)Nc3cc(-c4nc(C)no4)ccc3C)cc2[N+](=O)[O-])n1 603988215 YWDQPYFZCNLILO-UHFFFAOYSA-N 467.532 5.430 5 20 JKBD O=[N+]([O-])c1ccc(-c2noc(CN[C@@H](c3ccccc3)c3ccc(Br)cc3F)n2)cc1 604009778 YMCSXCKBEOFCLT-NRFANRHFSA-N 483.297 5.426 5 20 JKBD O=C(Nc1nc(-c2ccc(Cl)cc2)cs1)c1ccc([N+](=O)[O-])cc1I 604565646 LOSKUWZZDQFHNB-UHFFFAOYSA-N 485.690 5.229 5 20 JKBD Cc1nn(Cc2ccccc2)c(C)c1CNCc1ccc(-c2ccc([N+](=O)[O-])cc2Br)o1 608835627 GFMHZLQFYBAZDB-UHFFFAOYSA-N 495.377 5.769 5 20 JKBD CCOc1cc([N+](=O)[O-])c(C(=O)N[C@H](c2cccc(C(F)(F)F)c2)C(C)(C)C)cc1OC 608899122 PSJABBNYLIBRQM-LJQANCHMSA-N 454.445 5.538 5 20 JKBD COc1ccc(CN(Cc2ccc(OC)cc2)C(=O)c2cc(SC)ccc2[N+](=O)[O-])cc1 609219398 QJJOEJVNRJRNDB-UHFFFAOYSA-N 452.532 5.177 5 20 JKBD Cc1ncsc1CN(C)C(=O)c1ccc(Sc2nc3ccccc3s2)c([N+](=O)[O-])c1 609409218 VYYUTZSOKGCNDC-UHFFFAOYSA-N 456.574 5.393 5 20 JKBD CC(C)n1c(SCC(=O)N(C)c2ccc([N+](=O)[O-])cc2)nnc1-c1ccc(Cl)cc1Cl 619741261 MZMPNOBJMLRGGW-UHFFFAOYSA-N 480.377 5.496 5 20 JKBD Cc1ccc(O)c[n+]1/C(C(=S)Nc1ccccc1-c1ccccc1)=C(/O)c1cccc([N+](=O)[O-])c1 725763145 GKIAPYAMPDAILP-UHFFFAOYSA-O 484.557 5.887 5 20 JKBD CC(C)c1nnc(COC(=O)c2c3c(nc4ccccc24)/C(=C/c2cccc([N+](=O)[O-])c2)CCC3)o1 726993224 UIOHNORKFUJCOQ-QGOAFFKASA-N 484.512 5.883 5 20 JKBD Cc1ccc(NC(=O)[C@@H](OC(=O)Cc2c[nH]c3cccc(C)c23)c2ccccc2)c([N+](=O)[O-])c1 729013477 YUOIIOVXEPMKEG-VWLOTQADSA-N 457.486 5.159 5 20 JKBD Cc1ccc(NC(=O)[C@H](OC(=O)c2cnc(-c3ccco3)s2)c2ccccc2)c([N+](=O)[O-])c1 729023350 FXFXPEBGQGMYMQ-HXUWFJFHSA-N 463.471 5.157 5 20 JKBD O=C(OCC1CCN(c2ncccc2[N+](=O)[O-])CC1)/C(=C\c1ccc(F)cc1)c1cccs1 729193554 UPJJLBDNFAAVLM-HKWRFOASSA-N 467.522 5.191 5 20 JKBD CCN(c1ccccc1)S(=O)(=O)c1ccc(Cl)c(C(=O)Nc2cccc([N+](=O)[O-])c2C)c1 913413010 JLDQECYEZPSXHH-UHFFFAOYSA-N 473.938 5.024 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Cl)[C@@H](OC(=O)[C@@H]1CCC[C@H](C(F)(F)F)C1)c1ccccc1 917286058 RWNDVEZRIVSEHX-VCBZYWHSSA-N 484.858 5.840 5 20 JKBD CCOc1ccccc1NC(=O)[C@@H](OC(=O)c1cc2cc([N+](=O)[O-])ccc2[nH]1)c1ccccc1 917330458 SXNPOMZUWDGEHU-QHCPKHFHSA-N 459.458 5.012 5 20 JKBD Cc1ccc(NC(=O)CS[C@H](C)C(=O)Oc2ccc(-c3ccccc3)cc2[N+](=O)[O-])cc1 920330381 BICNDWPLQMRNHA-QGZVFWFLSA-N 450.516 5.236 5 20 JKBD C[C@H](SCC(=O)Nc1ccc(F)cc1)C(=O)Oc1ccc(-c2ccccc2)cc1[N+](=O)[O-] 920331154 VVNFFKBHGZCUNJ-HNNXBMFYSA-N 454.479 5.067 5 20 JKBD C[C@H](OC(=O)c1ccc(N[C@@H](C)c2ccccn2)c([N+](=O)[O-])c1)C(=O)c1ccc(Cl)cc1 920548151 QDEFPQPTJHAOMZ-GJZGRUSLSA-N 453.882 5.245 5 20 JKBD O=C(CCc1cccc([N+](=O)[O-])c1)Nc1ccc(C2(NC(=O)C3CCC(F)(F)CC3)CCC2)cc1 1786599145 OAHSNHADRDEPLO-UHFFFAOYSA-N 485.531 5.487 5 20 JKBD CCc1oncc1C(=O)Nc1ccc(C2(NC(=O)c3cc(Cl)cc([N+](=O)[O-])c3C)CCC2)cc1 1787557632 ZLQBVSLNHGAHKZ-UHFFFAOYSA-N 482.924 5.169 5 20 JKBD COc1cc(C(=O)NC2(c3ccc(NC(=O)c4cc5ccoc5s4)cc3)CCC2)ccc1[N+](=O)[O-] 1788417122 ZFEUQAWFLABSBU-UHFFFAOYSA-N 491.525 5.473 5 20 JKBD O=C(CSc1ccccc1[N+](=O)[O-])NC1(c2ccc(NC(=O)[C@H]3CC=CCC3)cc2)CCC1 1790468315 WHYBAGDLAHLZLU-SFHVURJKSA-N 465.575 5.177 5 20 JKBD Cc1cccc(Cl)c1C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cccc(F)c2[N+](=O)[O-])[nH]n1 1821144371 AUGRYZKQOASWGQ-SFHVURJKSA-N 485.903 5.039 5 20 JKBD Cc1c(C(=O)N2CCCC[C@H]2c2cc(NC(=O)[C@H](C)Cc3ccco3)n[nH]2)cc(Cl)cc1[N+](=O)[O-] 1822846935 MBKVIPIEWZKFLK-VLIAUNLRSA-N 499.955 5.057 5 20 JKBD O=C(Cc1ccc([N+](=O)[O-])cc1F)N1CCC([C@@H]2CCCCN2C(=O)c2ccc(C3CC3)cc2)CC1 1830750893 LKRBHANXDMBXKZ-SANMLTNESA-N 493.579 5.087 5 20 JKBD CC(C)[C@H]1CC[C@H](C(=O)N2CCCC[C@@H]2C2CCN(C(=O)Cc3cccc([N+](=O)[O-])c3)CC2)CC1 1831562253 LVLNXNALHMBLRH-QIGHUWCUSA-N 483.653 5.219 5 20 JKBD O=C(Cc1ccc([N+](=O)[O-])cc1F)N1CCC([C@@H]2CCCCN2C(=O)c2ccccc2C2CC2)CC1 1832555749 GGWBKWASAFIGBR-SANMLTNESA-N 493.579 5.087 5 20 JKBD COc1ccc(C(=O)OCc2csc(N(C(C)=O)c3c(C)cc(C)cc3Cl)n2)cc1[N+](=O)[O-] 11341903 HXPYXYUMDWAYPS-UHFFFAOYSA-N 489.937 5.372 5 20 JKBD O=C(COC(=O)c1ccc(Oc2ccc(F)cc2)cc1)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 16577927 HLMISLYWSZOCTK-UHFFFAOYSA-N 478.354 5.341 5 20 JKBD O=c1nc(/C(Cl)=C/c2ccc(Cl)c([N+](=O)[O-])c2)[nH]c2scc(-c3cccs3)c12 21191011 CUVSLYMHBGKFHM-SDQBBNPISA-N 450.328 6.012 5 20 JKBD C[C@H](c1nnc(SCc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)n1-c1ccccc1)N1CCCCC1 23223590 VKBARWIEDZJAGT-QGZVFWFLSA-N 491.577 5.065 5 20 JKBD COc1ccc(NC(=O)CCSc2nnc(-c3ccccc3)n2-c2ccc(F)cc2)c([N+](=O)[O-])c1 26361558 KCKHVLXQJHOLHW-UHFFFAOYSA-N 493.520 5.111 5 20 JKBD C[C@H](Sc1nnc(-c2ccncc2)n1-c1ccccc1)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl 28682601 QQVWVJHIBLKRCH-AWEZNQCLSA-N 480.937 5.010 5 20 JKBD COc1ccc(CSCC(=O)Nc2ccccc2-c2nc3ccccc3s2)cc1[N+](=O)[O-] 45714457 RZWYDFAEWBFMOR-UHFFFAOYSA-N 465.556 5.752 5 20 JKBD Cc1ccc(CN(C(=O)CCCn2c(=O)oc3cc([N+](=O)[O-])ccc32)[C@H]2CCc3ccccc32)cc1 68710750 RZXIFYFQHNYORZ-DEOSSOPVSA-N 485.540 5.308 5 20 JKBD CCCN(Cc1nnc(-c2ccccc2Cl)o1)C(=O)c1ccc(Br)c([N+](=O)[O-])c1 104791880 LXWWONJITKPFCH-UHFFFAOYSA-N 479.718 5.113 5 20 JKBD Cc1cc(NC(=O)Cc2csc(-c3ccc(C(F)(F)F)cc3)n2)n(-c2ccc([N+](=O)[O-])cc2)n1 105563002 TUGOYCRLGXDQEN-UHFFFAOYSA-N 487.463 5.412 5 20 JKBD COc1ccccc1OCc1ccc(C(=O)Nc2nc(-c3ccc(C)c([N+](=O)[O-])c3)cs2)o1 107785653 PYTJVTAPPSSQAO-UHFFFAOYSA-N 465.487 5.460 5 20 JKBD CC(=O)Nc1cc(NC(=O)c2ccc(Sc3nc4ccccc4s3)c([N+](=O)[O-])c2)ccc1C 484281623 PFRYBPNKCBIVGB-UHFFFAOYSA-N 478.555 5.875 5 20 JKBD CC(C)(C)N1CCC(NC(=O)C/C(=C/c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)CC1 489835407 IVPINWWMVBUEHA-MNDPQUGUSA-N 478.618 5.514 5 20 JKBD COc1cc(C(=O)Nc2nc(-c3ccc(OC(C)C)cc3)cs2)c([N+](=O)[O-])cc1OC(F)F 490159727 YVGLRUPGSPLLCU-UHFFFAOYSA-N 479.461 5.368 5 20 JKBD CN(C(=O)c1csc(-c2ccc([N+](=O)[O-])cc2)n1)c1ccc(Br)cc1Cl 500757692 IQAKFQINZSVGNH-UHFFFAOYSA-N 452.717 5.411 5 20 JKBD CCOc1ccc(C(=O)Nc2nc(-c3ccc(Br)s3)cs2)cc1[N+](=O)[O-] 503217356 FPQFQQDVJWCANT-UHFFFAOYSA-N 454.327 5.193 5 20 JKBD COc1cc(OCC(=O)Nc2ccc(Oc3ncc(Cl)cc3Cl)cc2)ccc1[N+](=O)[O-] 520552302 ITTBFEMYGMWFQT-UHFFFAOYSA-N 464.261 5.115 5 20 JKBD C[C@@H](Nc1ccc(C(=O)NCc2ccc(OC3CCCCC3)nc2)cc1[N+](=O)[O-])c1ccccn1 522221307 UBCWTKVXRQMZPT-GOSISDBHSA-N 475.549 5.199 5 20 JKBD O=C(Nc1cc([N+](=O)[O-])ccc1OC(F)F)c1cccnc1Oc1cccc(Br)c1 603742790 MXHRWTAEAHCSGM-UHFFFAOYSA-N 480.221 5.398 5 20 JKBD O=C(Nc1cc([N+](=O)[O-])ccc1OC(F)F)N1CCO[C@@H](c2ccc(Cl)c(Cl)c2)C1 608994634 ONGGFTOLDYAWDJ-MRXNPFEDSA-N 462.236 5.108 5 20 JKBD CN(C(=O)c1cc2cc(Br)cc(Br)c2o1)c1ccc([N+](=O)[O-])cc1 609093747 JPNCDXYDLOEGKC-UHFFFAOYSA-N 454.074 5.143 5 20 JKBD O=C(COC(=O)/C=C/c1cccc(OC2CCCC2)c1)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 727885206 ISQIGEAEZXQVQB-DHZHZOJOSA-N 478.423 5.130 5 20 JKBD CC(=O)N(c1cccc(C(F)(F)F)c1)c1nc(COC(=O)c2ccc([N+](=O)[O-])c(F)c2)cs1 728154244 ATUBCWNXJIYVJH-UHFFFAOYSA-N 483.399 5.251 5 20 JKBD CC(C)N(Cc1nnc(-c2cccc([N+](=O)[O-])c2)o1)C(=O)c1ccc(Oc2cccc(Cl)c2)cc1 749784505 AJXLHQBXIILMBY-UHFFFAOYSA-N 492.919 6.141 5 20 JKBD COc1ccc(N2C(=O)/C(=C/c3cccs3)N=C2SCc2ccccc2[N+](=O)[O-])cc1Cl 776041586 MJEKUZBSRDLMHK-PDGQHHTCSA-N 485.974 5.995 5 20 JKBD Cc1cc(-c2cc(C(=O)OCc3nnc(-c4ccc([N+](=O)[O-])cc4)o3)c3c(C)noc3n2)c(C)s1 813305392 BWBBJYQOAGGHPK-UHFFFAOYSA-N 491.485 5.192 5 20 JKBD Cc1ccc(NC(=O)[C@@H](OC(=O)C2CCN(c3ccccc3[N+](=O)[O-])CC2)c2ccccc2)cc1 844239737 MYAPJHIAWLYZKX-VWLOTQADSA-N 473.529 5.043 5 20 JKBD C[C@@H](OC(=O)Cn1c2ccccc2c(=O)c2ccccc21)C(=O)N[C@H](C)c1ccc2ccccc2c1 858085444 SNLXLVJRJPVWGM-WOJBJXKFSA-N 478.548 5.117 5 20 JKBD Cc1ccc([N+](=O)[O-])c(OCCC(=O)O[C@@H](C)c2nc(-c3cccc(C(F)(F)F)c3)no2)c1 915439923 IWIWOZRGJLGJGB-ZDUSSCGKSA-N 465.384 5.045 5 20 JKBD CC1=C(C(=O)N(C)C)[C@@H](c2ccc(Cl)c([N+](=O)[O-])c2)NC(=S)N1c1ccccc1C(F)(F)F 916166714 FBLFZMUUUTZZNW-GOSISDBHSA-N 498.914 5.065 5 20 JKBD CC1=C(C(=O)Nc2ccccc2C(F)(F)F)[C@@H](c2ccc(Cl)c([N+](=O)[O-])c2)NC(=S)N1C 916169358 XGIQGVBQUSOAOT-QGZVFWFLSA-N 484.887 5.041 5 20 JKBD CSCC[C@@H](NC(=O)c1cccc([N+](=O)[O-])c1)C(=O)O[C@@H](C)c1ccc(Cl)c(Cl)c1 917963377 VLLFDPLWIGGCPK-KPZWWZAWSA-N 471.362 5.058 5 20 JKBD C[C@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)N1CCC(C(O)(c2ccccc2)c2ccccc2)CC1 920276811 PJCFVKPHOWQNII-FQEVSTJZSA-N 476.598 5.250 5 20 JKBD Cc1cc(C)c(NC(=O)[C@H](C)OC(=O)c2ccc(N[C@H](C)c3ccccn3)c([N+](=O)[O-])c2)c(C)c1 920545591 UEMUEZHVSVFPGN-MOPGFXCFSA-N 476.533 5.272 5 20 JKBD C[C@H](OC(=O)c1ccc(N[C@H](C)c2ccccn2)c([N+](=O)[O-])c1)C(=O)N1c2ccccc2CC[C@@H]1C 920546469 YLDTWYSIISYCPT-OTWHNJEPSA-N 488.544 5.076 5 20 JKBD Cc1nn(Cc2ccc(C(=O)Nc3ccccc3SCc3ccccc3)cc2)c(C)c1[N+](=O)[O-] 921241765 CEKYBIUFWNMJKP-UHFFFAOYSA-N 472.570 6.001 5 20 JKBD Cc1cc(CCCC(=O)Nc2ccc(C3(NC(=O)[C@H]4CC4(F)F)CCC3)cc2)c([N+](=O)[O-])cc1F 1786274646 JTAHDIDFWFCRLO-LJQANCHMSA-N 489.494 5.154 5 20 JKBD Cc1ccc2nc(C(=O)Nc3ccc(C4(NC(=O)c5ccc([N+](=O)[O-])o5)CCC4)cc3)sc2c1 1787572104 JQZYBKQHHJEXHR-UHFFFAOYSA-N 476.514 5.167 5 20 JKBD CCCc1onc(C)c1C(=O)Nc1ccc(C2(NC(=O)c3ccc([N+](=O)[O-])cc3F)CCC2)cc1 1788778462 IUUSQCGFANOQRV-UHFFFAOYSA-N 480.496 5.044 5 20 JKBD O=C(NC1(c2ccc(NC(=O)c3ccc([N+](=O)[O-])cc3F)cc2)CCC1)c1ccc(Cl)o1 1790622195 MUGANKFHCQFCQK-UHFFFAOYSA-N 457.845 5.042 5 20 JKBD O=C(CC1CCC1)NC1(c2ccc(NC(=O)c3cc(Br)ccc3[N+](=O)[O-])cc2)CCC1 1790665514 UXVZMICOESCCLF-UHFFFAOYSA-N 486.366 5.295 5 20 JKBD Cc1cc(CCCC(=O)N2CCCC[C@H]2c2cc(NC(=O)c3ccsc3)n[nH]2)c([N+](=O)[O-])cc1F 1816357198 ZZCQHNFKUDLAFA-FQEVSTJZSA-N 499.568 5.156 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)N1CCCC12CN(C(=O)c1cccc3c1oc1ccccc13)C2 1845493818 IKWLGGFVVROBQL-UHFFFAOYSA-N 487.487 5.073 5 20 JKBD O=C(CSc1nnc(-c2ccco2)n1C1CCCCC1)Nc1ccc([N+](=O)[O-])cc1Cl 10014898 YOKOIXRKKGCJDH-UHFFFAOYSA-N 461.931 5.336 5 20 JKBD C[C@H](OC(=O)Cn1c2ccccc2c(=O)c2ccccc21)C(=O)Nc1ccccc1Cc1ccccc1 28775133 XKFBVUFDSKJKPP-NRFANRHFSA-N 490.559 5.316 5 20 JKBD CN(Cc1cccc(Cl)c1)C(=O)c1ccccc1NC(=O)c1ccc([N+](=O)[O-])cc1Cl 36716957 KKIOWYNNGPBZMK-UHFFFAOYSA-N 458.301 5.426 5 20 JKBD Cc1cccc(NC(=O)Nc2cccc(CNC(=O)c3ccc(N4CCCC4)c([N+](=O)[O-])c3)c2)c1 72004896 QGZSPUJOVZCFLW-UHFFFAOYSA-N 473.533 5.077 5 20 JKBD O=C(Nc1ccc(Nc2ccccc2)cc1)c1ccc([N+](=O)[O-])cc1I 72071510 LACTWXXZXJSXSO-UHFFFAOYSA-N 459.243 5.195 5 20 JKBD C[C@H](Nc1ccc(C(=O)N(Cc2cccc(F)c2)C[C@H]2CCCO2)cc1[N+](=O)[O-])c1ccccn1 109589171 AQLUSWIYUOIMGQ-PGRDOPGGSA-N 478.524 5.123 5 20 JKBD Cc1csc(Sc2ccc(C(=O)NC[C@H]3CCCO[C@H]3c3ccccc3)cc2[N+](=O)[O-])n1 409556759 YFYXSOVKWXSHLZ-NQIIRXRSSA-N 469.588 5.409 5 20 JKBD Cc1ccc(-n2c(SCC(=O)Nc3ccccc3[N+](=O)[O-])nnc2-c2ccc(F)cc2)cc1 479834042 UZUHQXMGJWMOCF-UHFFFAOYSA-N 463.494 5.021 5 20 JKBD COc1ccc(CN(C)C(=O)c2cc([N+](=O)[O-])ccc2NCc2ccccc2)cc1OC(F)F 482571255 AAOPEKBAIBVTTR-UHFFFAOYSA-N 471.460 5.089 5 20 JKBD COCCOc1cc(NC(=O)c2cc([N+](=O)[O-])ccc2Sc2ccc(Cl)cc2)ccc1OC 505982775 SXMCPDAZCXMLPX-UHFFFAOYSA-N 488.949 5.686 5 20 JKBD C[C@@H](Nc1ccc(C(=O)N[C@@H](c2ccc(Cl)cc2)C2CC2)cc1[N+](=O)[O-])c1ccccn1 505996339 NRHBSQBAUBOVCR-IQMFZBJNSA-N 450.926 5.697 5 20 JKBD O=C(Cn1c2ccccc2c(=O)c2ccccc21)Nc1cc2c(cc1Sc1ccccc1)OCCO2 506185215 YVFXFIAZTJDECR-UHFFFAOYSA-N 494.572 5.716 5 20 JKBD CN(C(=O)c1ccc(NC(=O)c2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)cc1Cl)C1CCCCC1 509517180 QIEDCMPCPSTVTD-UHFFFAOYSA-N 495.967 5.306 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Cl)[C@H](Nc1cccc(OCc2cccnc2)c1)c1ccccc1 511021674 FYSJHTGGNTYICS-RUZDIDTESA-N 488.931 6.014 5 20 JKBD Cc1ccc(NC(=O)[C@@H](Sc2nc3cc(Br)cnc3[nH]2)c2ccccc2)c([N+](=O)[O-])c1 511881388 IFFVAUIHGRDWKD-SFHVURJKSA-N 498.362 5.409 5 20 JKBD CC[C@@H](C)Oc1cccc(NC(=O)c2cc(OC)c(OCc3cscn3)cc2[N+](=O)[O-])c1 512123176 NLMCMBIEQCJGCR-CQSZACIVSA-N 457.508 5.069 5 20 JKBD O=C(Nc1cccc(COCCOc2ccccc2)c1)C1CCN(c2ccccc2[N+](=O)[O-])CC1 515824394 MOASITBEFGYHLQ-UHFFFAOYSA-N 475.545 5.046 5 20 JKBD COc1cc(C(=O)Nc2nccn2Cc2ccccc2)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 520040691 ZRRJSAAFBPGCJD-UHFFFAOYSA-N 478.892 5.546 5 20 JKBD O=[N+]([O-])c1ccc(-c2ccc(CNCc3ccc4c(c3)OCCCO4)o2)c(Br)c1 520218858 YEJSPRUZIZQNJG-UHFFFAOYSA-N 459.296 5.068 5 20 JKBD Cc1cc(C(=O)N2CCCC[C@H]2C)ccc1NC(=O)c1ccc(N2CCC[C@@H](C)C2)c([N+](=O)[O-])c1 520680759 GQZKBBMMOCJEHE-UYAOXDASSA-N 478.593 5.406 5 20 JKBD Cc1cc(=O)nc(-c2ccc(NC(=O)c3cc([N+](=O)[O-])ccc3Sc3ccccc3)cc2)[nH]1 523418666 QREDLTFDEWWRNX-UHFFFAOYSA-N 458.499 5.057 5 20 JKBD COc1cc2nc(C)sc2cc1NC(=O)CSc1ccc(C(F)(F)F)cc1[N+](=O)[O-] 524204221 DTVZBVYJLKTVHA-UHFFFAOYSA-N 457.455 5.271 5 20 JKBD COc1ccccc1-c1cc(NC(=O)c2ccc([N+](=O)[O-])c(OC)c2)n(-c2ccc(C)cc2)n1 556026447 ZPOISLDTAYREKM-UHFFFAOYSA-N 458.474 5.025 5 20 JKBD COc1ccc(NC(=O)c2cc3cc([N+](=O)[O-])ccc3o2)cc1NC(=O)c1ccc(Cl)cc1F 603997742 JNVYTVGFFHONOS-UHFFFAOYSA-N 483.839 5.647 5 20 JKBD O=C(C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)NC[C@H]1Cc2ccccc21 604249163 XFZSZMNJNKCAJC-UMSHPIDHSA-N 455.539 5.591 5 20 JKBD COc1cc(C(=O)N2CCC(C(=O)OC(C)(C)C)CC2)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 608989271 GBPOWGVOMGWURS-UHFFFAOYSA-N 490.940 5.243 5 20 JKBD COc1ccc(CC(=O)Nc2ccc(NC(=O)c3ccccc3F)cc2C(F)(F)F)cc1[N+](=O)[O-] 609011220 IYPZPDPHPWHOLI-UHFFFAOYSA-N 491.397 5.195 5 20 JKBD C[C@H](NC(=O)C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)c1nnc2ccccn12 610428541 ZTHFKZOWOJRSIG-KXGFGANYSA-N 484.541 5.055 5 20 JKBD Cc1ccc(S(=O)(=O)N2CCCCC2)cc1NC(=O)c1cc2ccccc2c2cccnc12 642517949 LGHWMLMHTPPTQA-UHFFFAOYSA-N 459.571 5.123 5 20 JKBD CC(C)Cn1cc([C@H]2N(Cc3ccc(-c4ccc([N+](=O)[O-])cc4)s3)CC23CCOCC3)cn1 849479444 QYDPELSHMAZPCZ-XMMPIXPASA-N 466.607 5.530 5 20 JKBD Cc1ccc(-c2csc(NC(=O)Cc3ccc(NC(=O)OC(C)(C)C)cc3)n2)cc1[N+](=O)[O-] 912518266 NJDBEXZXKQIGPT-UHFFFAOYSA-N 468.535 5.555 5 20 JKBD Cc1cc(NC(=O)c2ccc(F)cc2Cl)sc1C(=O)N(C)Cc1cc([N+](=O)[O-])ccc1Cl 917069239 NBGILVFLBJHQPV-UHFFFAOYSA-N 496.347 5.935 5 20 JKBD C[C@@H](OC(=O)[C@@H](C)Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)Nc1ccccc1-c1ccccc1 920777331 CHORTCDJJKOIRE-HZPDHXFCSA-N 468.893 5.253 5 20 JKBD Cc1ccc(C(=O)Nc2cccc(C(F)(F)F)c2)cc1NC(=O)c1cc(Cl)ccc1[N+](=O)[O-] 920845523 UDTGVRPRWOEGEE-UHFFFAOYSA-N 477.826 6.080 5 20 JKBD C[C@@H](Sc1cccs1)C(=O)Nc1ccc(C2(NC(=O)c3cc(O)cc([N+](=O)[O-])c3)CCC2)cc1 1789415693 DYVJWXBASMJONU-OAHLLOKOSA-N 497.598 5.290 5 20 JKBD O=C(Nc1cc([C@H]2CCCCN2C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)[nH]n1)c1cccc(F)c1 1820492343 KSJFHKKKKDEAAD-LJQANCHMSA-N 493.520 5.291 5 20 JKBD Cc1ccc(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3cc4cc([N+](=O)[O-])ccc4s3)CC2)cn1 1825817805 GHZIZAUIARDVGJ-JOCHJYFZSA-N 492.601 5.060 5 20 JKBD CC1=CC[C@H](C(=O)N2CCCC[C@H]2C2CCN(C(=O)C3(c4cccc([N+](=O)[O-])c4)CCC3)CC2)CC1 1828348993 HZJSOIYDQQRMKT-OZXSUGGESA-N 493.648 5.383 5 20 JKBD O=C(COC(=O)c1sccc1-c1ccccc1)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 10986769 JXUSAJIPHJIEJQ-UHFFFAOYSA-N 450.394 5.138 5 20 JKBD O=C(Nc1ccc(N2CCCC2=O)c(Cl)c1)c1cc([N+](=O)[O-])ccc1Sc1ccccc1 11140795 YUJFDWVSGOUUAS-UHFFFAOYSA-N 467.934 5.779 5 20 JKBD O=C(Cn1c2ccccc2c(=O)c2ccccc21)Nc1ccc(-c2nc3ccccc3s2)cc1 14808787 HGEOWCBJHFFSPX-UHFFFAOYSA-N 461.546 6.070 5 20 JKBD COc1cc(CNC(=O)c2cc([N+](=O)[O-])ccc2Sc2ccc(Cl)cc2)cc(OC)c1OC 15137160 FCIBRJKCMZVBEZ-UHFFFAOYSA-N 488.949 5.355 5 20 JKBD CSc1ccc([N+](=O)[O-])c(C(=O)Nc2ncc(Cc3cc(Cl)ccc3Cl)s2)c1 18182989 WXJOJQRVQNPOBZ-UHFFFAOYSA-N 454.360 5.923 5 20 JKBD C[C@@H]1CCCCN1C(=O)COC(=O)C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1 18494160 XUQBTFYRCYDPRV-SQFNAUOLSA-N 479.558 5.079 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Cl)[C@H](NC1CCN(Cc2ccccc2)CC1)c1ccccc1 21819395 FYYTUCCDRXKWHY-RUZDIDTESA-N 478.980 5.182 5 20 JKBD Cn1c(SCC(=O)Nc2ccccc2Cc2ccccc2)nc2cc3ccccc3cc2c1=O 22253346 SBHCLTVVZJMEFJ-UHFFFAOYSA-N 465.578 5.408 5 20 JKBD O=C(Nc1ccc(Oc2nc(-c3ccncc3)nc3ccccc23)cc1)c1cccc([N+](=O)[O-])c1 24040766 LGTCXXOVBILRMU-UHFFFAOYSA-N 463.453 5.645 5 20 JKBD O=C1COc2ccc(NC(=O)c3ccccc3Sc3ccc(C(F)(F)F)cc3[N+](=O)[O-])cc2N1 25702089 LGLPRKANVJJHSX-UHFFFAOYSA-N 489.431 5.348 5 20 JKBD COc1cc(C(=O)Nc2cccc(COc3cccc(F)c3)c2)c([N+](=O)[O-])cc1OC(F)F 26010641 ANGSQVMRTIIPPO-UHFFFAOYSA-N 462.380 5.175 5 20 JKBD COc1ccc(-c2nnc(SCC(=O)Nc3ccc([N+](=O)[O-])cc3C)n2C2CCCCC2)cc1 28789220 ORBUUMNNVVTLGJ-UHFFFAOYSA-N 481.578 5.406 5 20 JKBD CC(C)c1sc(NC(=O)CCCn2c(=O)oc3cc([N+](=O)[O-])ccc32)nc1-c1ccccc1 31777547 ZUFCWZYFWRVVHQ-UHFFFAOYSA-N 466.519 5.169 5 20 JKBD Cc1cc(C)c2nc(N(Cc3ccccc3)C(=O)c3cc([N+](=O)[O-])cc(S(C)(=O)=O)c3)sc2c1 109024331 WZHIIRWFHSUKAC-UHFFFAOYSA-N 495.582 5.072 5 20 JKBD Cc1sc(NC(=O)c2cccnc2SCc2ccc(F)cc2)nc1-c1cccc([N+](=O)[O-])c1 195704352 DEPMDEMBZNGFJN-UHFFFAOYSA-N 480.546 6.105 5 20 JKBD COCCN(C(=O)c1csc(-c2cccc([N+](=O)[O-])c2)n1)[C@@H](C)c1cccc(C(F)(F)F)c1 500298418 JSEJIBNCTMOISO-AWEZNQCLSA-N 479.480 5.587 5 20 JKBD CCC[C@@H](NC(=O)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])c(OC)c1)c1nnc2ccccn12 504698352 PJEXQHBULAGZDV-QGZVFWFLSA-N 495.923 5.363 5 20 JKBD COc1ccc(CNCc2ccccc2Br)cc1OCc1ccc([N+](=O)[O-])cc1 507892059 BKPDFRBXXYPFFO-UHFFFAOYSA-N 457.324 5.235 5 20 JKBD Cc1ccc(Sc2ccc(CNC3CCN(C(=O)CCc4ccccc4)CC3)cc2[N+](=O)[O-])cc1 507926268 WZURDUDJRQQHEG-UHFFFAOYSA-N 489.641 5.768 5 20 JKBD COc1cc2c(cc1OC)CCN(C(=O)c1cc([N+](=O)[O-])ccc1Sc1ccccc1)CC2 510230627 TUXLEBGFXFYPFG-UHFFFAOYSA-N 464.543 5.004 5 20 JKBD CC(C)OC(=O)C[C@H](NC(=O)Nc1ccccc1OC1CCCC1)c1ccccc1[N+](=O)[O-] 510410488 CFUQMVZRAFXBHB-FQEVSTJZSA-N 455.511 5.121 5 20 JKBD O=[N+]([O-])c1cc(CNCc2ccc(N3CCc4ccccc4C3)nc2)ccc1Oc1ccc(F)cc1 512832688 ILIJHKXQFIJOPE-UHFFFAOYSA-N 484.531 5.774 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Br)[C@H](N[C@H]1CCc2cc(F)ccc21)c1ccccc1 513182571 HDVNXOBRTUSOEA-RBBKRZOGSA-N 484.325 5.453 5 20 JKBD CC1CCN(c2ccc(C(=O)N3CCC(c4nc5ccccc5s4)CC3)cc2[N+](=O)[O-])CC1 515321041 DMLAJCSGSUVGCC-UHFFFAOYSA-N 464.591 5.461 5 20 JKBD CC(C)(C)c1ccc(Oc2ccc(CNC3CCN(C(=O)c4ccco4)CC3)cc2[N+](=O)[O-])cc1 518271751 LNZNEEJXNPSWNS-UHFFFAOYSA-N 477.561 5.672 5 20 JKBD O=C(Nc1ccc(Cl)cc1Cl)[C@H]1CCCCN1C(=O)c1c[nH]c2cc([N+](=O)[O-])ccc12 519127846 RTAHXJDROHGUPT-LJQANCHMSA-N 461.305 5.016 5 20 JKBD Cc1cc(C)nc(NC(=O)c2c3c(nc4ccccc24)/C(=C/c2ccc([N+](=O)[O-])cc2)CCC3)n1 602217087 KSYBYWQKVXPFOH-XDJHFCHBSA-N 465.513 5.679 5 20 JKBD O=C(NC1CCN(c2ccc(C(F)(F)F)cn2)CC1)c1cc([N+](=O)[O-])ccc1Oc1ccccc1 603895578 UYFRPYLVULMHOH-UHFFFAOYSA-N 486.450 5.200 5 20 JKBD COc1cc(C(=O)N2CCOc3ccccc3C2)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 604187210 OXWZCDLJFSJECB-UHFFFAOYSA-N 454.866 5.084 5 20 JKBD Cc1ccc(Sc2ccc(CN[C@@H](C)c3cccc(S(=O)(=O)N(C)C)c3)cc2[N+](=O)[O-])cc1 608983118 IPUNVLPLZGAOGV-SFHVURJKSA-N 485.631 5.156 5 20 JKBD COc1cc(C(=O)Nc2ccc(OCc3cccc(Cl)c3)cc2C)c([N+](=O)[O-])cc1OC(F)F 609062605 WFHTXPUIHMUGBH-UHFFFAOYSA-N 492.862 5.998 5 20 JKBD CCCS(=O)(=O)Nc1cc(NC(=O)c2ccc(Nc3ccccc3)c([N+](=O)[O-])c2)c(F)cc1F 609153318 NAXJYBNDWJATRI-UHFFFAOYSA-N 490.488 5.021 5 20 JKBD Cc1nn(Cc2ccc(C(=O)NC3c4ccccc4Oc4ccccc43)cc2)c(C)c1[N+](=O)[O-] 609170539 RPONNTVPLOJJAH-UHFFFAOYSA-N 454.486 5.082 5 20 JKBD Cc1ccc(/C(O)=C(/C(=S)Nc2ccc(OC(C)C)cc2)[n+]2cccc(O)c2)cc1[N+](=O)[O-] 726575926 YQWBIRFSDCEZRX-UHFFFAOYSA-O 466.539 5.007 5 20 JKBD O=C(OCc1nnc(-c2c(Cl)cccc2Cl)o1)c1cc([N+](=O)[O-])ccc1N1CCCCC1 726634515 KTMBZVVHQUJGGC-UHFFFAOYSA-N 477.304 5.299 5 20 JKBD CC(C)[C@@H](Sc1ccccc1)C(=O)O[C@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 727212929 SGVMUKSENIAQRU-FZKQIMNGSA-N 470.469 5.301 5 20 JKBD C[C@@H](Nc1ccc(C(=O)Nc2ccccc2NC(=O)OC(C)(C)C)cc1[N+](=O)[O-])c1ccccn1 727803705 QNPCJSUMWVXDCH-MRXNPFEDSA-N 477.521 5.762 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)OCC(=O)Nc2ccccc2Sc2ccccc2)cc1SC 728656430 JIHIKBCIEZBIGG-UHFFFAOYSA-N 484.555 5.272 5 20 JKBD CC(C)(C)OC(=O)Nc1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2Cl)c(C(F)(F)F)c1 729656447 CJFNPSUNBQFDIA-UHFFFAOYSA-N 459.808 5.866 5 20 JKBD O=C(c1csc(-c2cccc([N+](=O)[O-])c2)n1)N1CCC[C@H]1Cc1ccc(Br)cc1 747715620 LCOOKUBHUROKLZ-KRWDZBQOSA-N 472.364 5.328 5 20 JKBD C[C@H](OC(=O)c1csc(-c2cccc([N+](=O)[O-])c2)n1)C(=O)N[C@@H](C)c1ccc(Cl)cc1Cl 747962891 VXOTZWYXLYBHPP-RYUDHWBXSA-N 494.356 5.448 5 20 JKBD Cc1noc(C)c1COc1cc2ccccc2cc1C(=O)O[C@H](C)C(=O)Nc1cccc([N+](=O)[O-])c1 775378094 SMAUWFRGOMJYLU-QGZVFWFLSA-N 489.484 5.116 5 20 JKBD C[C@@H](OC(=O)CCNc1ccccc1[N+](=O)[O-])C(=O)N1c2ccccc2Sc2ccccc21 858085713 CGSHHLFVWHSSQS-MRXNPFEDSA-N 463.515 5.158 5 20 JKBD COC(=O)c1ccc(-c2ccc(C(=O)O[C@H](C)c3nnc(-c4ccc([N+](=O)[O-])cc4)o3)cc2)cc1 919586119 TUERBVIUMOFQSK-OAHLLOKOSA-N 473.441 5.016 5 20 JKBD O=C(CC(F)(F)F)Nc1ccc(C2(NC(=O)c3cc4cc([N+](=O)[O-])ccc4s3)CCC2)cc1 1787875197 KEPOOPBVDXTXKV-UHFFFAOYSA-N 477.464 5.510 5 20 JKBD Cc1ccccc1NCC(=O)Nc1ccc(C2(NC(=O)CCc3cccc([N+](=O)[O-])c3)CCC2)cc1 1788108289 NRCLJPUQKVFZQN-UHFFFAOYSA-N 486.572 5.082 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)c3cc4cc([N+](=O)[O-])ccc4s3)CCC2)cc1)c1ccc(F)nc1 1789716465 SOUFPDJAYAFQLL-UHFFFAOYSA-N 490.516 5.405 5 20 JKBD O=C(NC1(c2ccc(NC(=O)c3c(F)cccc3Cl)cc2)CCC1)c1ccc([N+](=O)[O-])o1 1790224885 FCNNNRNZHCZFHY-UHFFFAOYSA-N 457.845 5.042 5 20 JKBD COc1ccc(CC(=O)NC2(c3ccc(NC(=O)C[C@@H]4C[C@@H]5CC[C@H]4C5)cc3)CCC2)c([N+](=O)[O-])c1 1791324298 VMLNVGZNDQPQDP-DYXWJJEUSA-N 491.588 5.106 5 20 JKBD O=C(CSc1ccccc1[N+](=O)[O-])Nc1ccc(C2(NC(=O)Cc3ccccc3)CCC2)cc1 1791522104 DDSJAEZGCMHMBD-UHFFFAOYSA-N 475.570 5.064 5 20 JKBD CC(C)(C)CCCCCC(=O)NC[C@@H]1CCN(C(=O)Cc2cccc([N+](=O)[O-])c2)[C@@H]1c1cccnc1 1812804686 SEAZHXIRIAUQCR-WNCULLNHSA-N 494.636 5.235 5 20 JKBD O=C(Nc1cc([C@H]2CCCCN2C(=O)CCc2cccc([N+](=O)[O-])c2)[nH]n1)c1ccc(Cl)cc1F 1814579873 OMNHSGDXWMJVPX-OAQYLSRUSA-N 499.930 5.049 5 20 JKBD Cc1cc(Cl)ccc1C(=O)N1CCC([C@@H]2CCCCN2C(=O)/C=C/c2ccc([N+](=O)[O-])o2)CC1 1824276079 OLAVAFXSYUFGCF-OUZREKFBSA-N 485.968 5.096 5 20 JKBD O=C(/C=C/c1ccccc1[N+](=O)[O-])N1CCC([C@H]2CCCCN2C(=O)CSc2ccccc2)CC1 1826523841 HQWWWVKZKYPVFU-XIQMRYHBSA-N 493.629 5.020 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)N1CCCC[C@@H]1C1CCN(C(=O)CCc2ccc(F)cc2)CC1 1830729421 OBMDDGSIAOZVHB-XMMPIXPASA-N 499.558 5.048 5 20 JKBD O=C(c1cc2ccc(Cl)cc2[nH]1)N1CC2(CCCN2C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)C1 1845738293 SOKZDYDFEVRRRP-UHFFFAOYSA-N 494.960 5.075 5 20 JKBD O=C(O[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1)c1ccc(Cn2cccn2)cc1 14149646 LSZMDEVADRGRFP-HSZRJFAPSA-N 490.903 5.030 5 20 JKBD COc1ccc(NC(=O)c2ccc(N3CCC(C)CC3)c([N+](=O)[O-])c2)cc1OCc1ccncc1 25853759 SHPFUCWAVDDTQR-UHFFFAOYSA-N 476.533 5.066 5 20 JKBD Cc1csc(Sc2ccc(C(=O)OCC(=O)Nc3c(C)cccc3C(C)C)cc2[N+](=O)[O-])n1 28831688 MHXBJYMOGGZFMC-UHFFFAOYSA-N 485.587 5.738 5 20 JKBD CSc1ccc(Cl)c(C(=O)O[C@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2C(F)(F)F)c1 104545105 JJBZOTVGSXOIIK-SECBINFHSA-N 462.833 5.173 5 20 JKBD COc1cc(C(=O)Nc2cccc(-n3ccnc3)c2)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 195598433 GDERXDJPHNGVLL-UHFFFAOYSA-N 464.865 5.487 5 20 JKBD CN(Cc1ccc(F)cc1Cl)C(=O)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 303302097 MSTUAFKYQBLPQE-UHFFFAOYSA-N 473.854 5.281 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)NCC2(c3cccc(C(F)(F)F)c3)CCCC2)cc1SC 483344100 BJWWUKPZJHPKNO-UHFFFAOYSA-N 468.497 5.586 5 20 JKBD CCC(=O)Nc1ccc(NC(=O)C/C(=C/c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)cc1 484114884 QYCWBGJIWXIIFC-SDXDJHTJSA-N 486.553 6.122 5 20 JKBD COc1ccc(Oc2ccc([N+](=O)[O-])cc2C(=O)Nc2ccc(NC(=O)c3ccco3)c(C)c2)cc1 490186684 FAQWQMQWOINWRP-UHFFFAOYSA-N 487.468 5.802 5 20 JKBD CCn1c(SCC(=O)Nc2c(C)nn(-c3ccc(C)cc3)c2C)nc2cc3ccccc3cc2c1=O 495284760 ABYYMZBNDUBKIO-UHFFFAOYSA-N 497.624 5.411 5 20 JKBD CNc1ccc(C(=O)Nc2cc(C(=O)Nc3cccc(C(F)(F)F)c3)ccc2C)cc1[N+](=O)[O-] 518891554 ZXMZFQJWZBQENI-UHFFFAOYSA-N 472.423 5.468 5 20 JKBD O=C(CNC(=O)c1c(Cl)cccc1[N+](=O)[O-])Nc1ccc(Oc2cccc(F)c2)c2ccncc12 520821843 XYUOTJGWQDPMLS-UHFFFAOYSA-N 494.866 5.096 5 20 JKBD Cc1nc(-c2ccccc2)c(NC(=O)C2CCN(c3ccc(C(F)(F)F)cc3[N+](=O)[O-])CC2)s1 522198854 URSHBNOYBRYZPI-UHFFFAOYSA-N 490.507 5.901 5 20 JKBD CN1CCC(N(C)C(=O)c2c3c(nc4ccccc24)/C(=C\c2ccc([N+](=O)[O-])cc2)CCC3)CC1 590780428 ZQYSLFGIJCUPPW-ZZEZOPTASA-N 470.573 5.186 5 20 JKBD O=C(N[C@@H](c1ccccc1)c1ccccn1)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1 603449026 JNYNUFXOBRXYHL-DEOSSOPVSA-N 459.889 5.955 5 20 JKBD CCN(Cc1ccc(OCc2cccs2)c(OC)c1)C(=O)Nc1ccc(C)c([N+](=O)[O-])c1 603643435 LRSMNTOLFVDBPQ-UHFFFAOYSA-N 455.536 5.606 5 20 JKBD CC(=O)Nc1ccc(-c2csc(NC(=O)c3cc(OCC(F)(F)F)ccc3[N+](=O)[O-])n2)c(F)c1 603733331 LQHARCJPLUCKND-UHFFFAOYSA-N 498.414 5.009 5 20 JKBD Cc1ccc(S(=O)(=O)Nc2ccc(NC(=O)Cc3csc4ccccc34)cc2)cc1[N+](=O)[O-] 603780514 OKQYPQIFVNYGLI-UHFFFAOYSA-N 481.555 5.100 5 20 JKBD Cc1ccc(N(C(=O)[C@H](C)Sc2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)c(C)c1 604440880 LQPFLEBNXOXUQA-KRWDZBQOSA-N 463.584 6.667 5 20 JKBD C[C@@H](Nc1ccc(C(=O)N2CCO[C@H](c3ccc(F)c(Cl)c3)C2)cc1[N+](=O)[O-])c1ccccn1 608963056 OPOISHSSGSBTGI-CMJOXMDJSA-N 484.915 5.169 5 20 JKBD C[C@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)N1CCCc2cc(CNC(=O)OC(C)(C)C)ccc21 731022375 GWALNBBUBULOAJ-INIZCTEOSA-N 471.579 5.080 5 20 JKBD COc1ccccc1/C=C(\C(=O)O[C@H](C)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)c1ccccc1 745941642 DLWHZJKQUSARCD-VULIGXMUSA-N 471.469 5.498 5 20 JKBD Cc1sc(NC(=O)c2csc(-c3cccc([N+](=O)[O-])c3)n2)c(C(N)=O)c1-c1ccccc1 747634812 MDSACMKDPOTOQC-UHFFFAOYSA-N 464.528 5.106 5 20 JKBD O=C(COC(=O)c1csc(-c2ccc([N+](=O)[O-])cc2)n1)Nc1cc(C(F)(F)F)ccc1Cl 747956758 ZTGAEXAZTMVSIK-UHFFFAOYSA-N 485.827 5.186 5 20 JKBD O=C(COc1cc(Cl)ccc1Cl)Oc1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2Cl)cc1 798110461 KNVPCPOJFRWFHT-UHFFFAOYSA-N 495.702 5.792 5 20 JKBD CCN(CC)Cc1csc(NC(=O)c2ccc(Sc3nc(C)cs3)c([N+](=O)[O-])c2)n1 833695410 CSYLWYCIDHCICB-UHFFFAOYSA-N 463.610 5.062 5 20 JKBD CC(C)CCOc1ccc(C(=O)N(Cc2nnc(-c3cccc([N+](=O)[O-])c3)o2)C(C)C)cc1 864244614 FYQHZMGNCAZJIE-UHFFFAOYSA-N 452.511 5.121 5 20 JKBD C[C@H](NC(=O)COC(=O)c1ccc(N[C@@H](C)c2ccccn2)c([N+](=O)[O-])c1)c1ccc2ccccc2c1 920543891 AYGBVYOMXKXTKF-OALUTQOASA-N 498.539 5.350 5 20 JKBD C[C@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)OCc1ccc(C(=O)Nc2ccccc2)cc1 920779474 XPXOVUGXSHZYAX-HNNXBMFYSA-N 454.866 5.011 5 20 JKBD C/C(=C\c1ccc(C)o1)C(=O)NC1(c2ccc(NC(=O)Cc3cccc([N+](=O)[O-])c3)cc2)CCC1 1785793702 WJCBFXPSHHKPQT-OBGWFSINSA-N 473.529 5.276 5 20 JKBD O=C(CCc1cccc([N+](=O)[O-])c1)Nc1ccc(C2(NC(=O)COC3CCCCC3)CCC2)cc1 1786599295 WGDMSADGORMZBD-UHFFFAOYSA-N 479.577 5.011 5 20 JKBD O=C(CC(F)(F)F)Nc1ccc(C2(NC(=O)C3(c4cccc([N+](=O)[O-])c4)CCC3)CCC2)cc1 1787876454 IZWBNBBGMTTXAU-UHFFFAOYSA-N 475.467 5.103 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)c3ccc([N+](=O)[O-])cc3F)CCC2)cc1)c1ccc(-c2ncc[nH]2)cc1 1792154835 SHEJARQICIUFNR-UHFFFAOYSA-N 499.502 5.186 5 20 JKBD O=C(/C=C/c1ccccc1[N+](=O)[O-])Nc1ccc(C2(NC(=O)C3CCC(F)(F)CC3)CCC2)cc1 1792315326 BZSPGHIZMYRSGP-IZZDOVSWSA-N 483.515 5.568 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(Cl)c(F)c(Cl)c1 1800709337 MDCFDJQFXKOYRD-BTTYYORXSA-N 498.313 5.054 5 20 JKBD CCCCC[C@H](C)C(=O)NC[C@@H]1CCN(C(=O)CSc2ccccc2[N+](=O)[O-])[C@H]1c1cccnc1 1812699622 BDOOEWRZVCNIMC-OWHZGTRUSA-N 498.649 5.004 5 20 JKBD CC1(C)CCC(CC(=O)N2CCCC[C@@H]2c2cc(NC(=O)/C=C/c3ccc([N+](=O)[O-])o3)n[nH]2)CC1 1814970102 RCYQQAHPQPPFGH-CPSHHHPTSA-N 483.569 5.223 5 20 JKBD Cc1cc(CCCC(=O)Nc2cc([C@H]3CCCCN3C(=O)[C@@H]3CC=CCC3)[nH]n2)c([N+](=O)[O-])cc1F 1815071495 UUFXMJDCQRLGSQ-XMSQKQJNSA-N 497.571 5.137 5 20 JKBD C[C@@H](CC(=O)N1CCC([C@H]2CCCCN2C(=O)CCc2cccc([N+](=O)[O-])c2)CC1)c1ccccc1 1824843645 QXPMTNBNQBDQOD-WXVAWEFUSA-N 491.632 5.341 5 20 JKBD O=C(CCc1cccc([N+](=O)[O-])c1)N1CCC([C@@H]2CCCCN2C(=O)c2cc3ccccc3o2)CC1 1828186266 ASOMNGGZBQQBAM-DEOSSOPVSA-N 489.572 5.207 5 20 JKBD O=C(c1cc(F)cc([N+](=O)[O-])c1)N1CCC([C@H]2CCCCN2C(=O)c2cccc(F)c2Cl)CC1 1830572535 RZSHILZDYRWGRU-OAQYLSRUSA-N 491.922 5.074 5 20 JKBD C[C@H](C(=O)N1CCC([C@@H]2CCCCN2C(=O)CSc2ccccc2[N+](=O)[O-])CC1)c1ccccc1 1831777097 CWPKWNTXTZLADN-REWPJTCUSA-N 495.645 5.110 5 20 JKBD O=C(CCCCCCCCCc1ccccc1)N1CC[C@H]2[C@@H]1CCN2C(=O)c1ccc([N+](=O)[O-])o1 1847169956 LIXZGEVLLJLGNW-GOTSBHOMSA-N 481.593 5.367 5 20 JKBD Cc1cc2ccccc2c2c1op(N1C[C@H](C)O[C@@H](C)C1)oc1c(C)cc3ccccc3c12 2382215203 JZJCPVUIWMCYHM-PMACEKPBSA-N 457.510 7.958 5 20 JKBD CCCCn1c(SCC(=O)Nc2cc(Cl)ccc2[N+](=O)[O-])nnc1-c1ccc(OC)cc1 9482416 ZJGLDIGRSQFZRR-UHFFFAOYSA-N 475.958 5.046 5 20 JKBD COc1cc(CSc2nnc(-c3ccco3)n2-c2ccccc2)c([N+](=O)[O-])cc1OC(F)F 10396141 XLTYQTNAAFTHRT-UHFFFAOYSA-N 474.445 5.338 5 20 JKBD C[C@@H](Sc1nnc(Cc2cccs2)n1CCc1ccccc1)C(=O)Nc1ccccc1[N+](=O)[O-] 12744179 GGBGGZFKOFPSDH-QGZVFWFLSA-N 493.614 5.201 5 20 JKBD CCN(CC)C(=O)c1cccc(NC(=O)c2ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])c(OC)c2)c1 15618986 IPICSQVYAQWANH-UHFFFAOYSA-N 497.935 5.783 5 20 JKBD O=C(CSc1nn(-c2ccc(Cl)cc2)c(=S)s1)Nc1ccc([N+](=O)[O-])cc1Cl 20852145 YKPBNDHKRSYLKX-UHFFFAOYSA-N 473.388 5.609 5 20 JKBD C[C@H](OC(=O)c1cc(Cl)ccc1[N+](=O)[O-])C(=O)Nc1c(Cl)cc(Cl)cc1Cl 28670257 KNQNUQYDTUECDH-ZETCQYMHSA-N 452.077 5.392 5 20 JKBD Cc1cccc(-c2nc(CC(=O)Nc3nc(-c4cccc([N+](=O)[O-])c4)c(C)s3)cs2)c1 195703994 SOYJSJVBWUZAGY-UHFFFAOYSA-N 450.545 5.640 5 20 JKBD CCOc1cc(NC(=O)c2cnn(-c3ccc(Cl)cc3)c2C(F)(F)F)c([N+](=O)[O-])cc1OCC 302948923 MASCCORUJRSYAI-UHFFFAOYSA-N 498.845 5.502 5 20 JKBD Cc1cnn(Cc2cc(F)ccc2F)c1NC(=O)c1ccc(N2C[C@@H](C)C[C@@H](C)C2)c([N+](=O)[O-])c1 502689152 HMYLJBWDFVLAFN-IYBDPMFKSA-N 483.519 5.161 5 20 JKBD O=C(Nc1cccc(NC(=O)c2ccc([N+](=O)[O-])cc2Cl)c1)c1cccc(C(F)(F)F)c1 504797567 RSWCOFRZCUSMBW-UHFFFAOYSA-N 463.799 5.772 5 20 JKBD COc1cc(CN[C@@H](c2ccc3c(c2)OCCO3)C2CC2)ccc1OCc1ccc([N+](=O)[O-])cc1 507936231 AZNOCYZTMVOFHK-HHHXNRCGSA-N 476.529 5.195 5 20 JKBD COc1ccc(-c2nnc(SCc3cc([N+](=O)[O-])ccc3OC(C)C)n2Cc2ccco2)cc1 511053428 VWESMHVCGKMZCD-UHFFFAOYSA-N 480.546 5.583 5 20 JKBD C[C@@H](Nc1cc(Cl)ccc1OC[C@@H]1CCCO1)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 518012787 CKDLOSRAUALADN-DOMZBBRYSA-N 487.862 5.264 5 20 JKBD O=C(Nc1cccc(COCCc2ccccc2)c1)C1CCN(c2ccccc2[N+](=O)[O-])CC1 520446946 SCRFJFHIPPPTKI-UHFFFAOYSA-N 459.546 5.209 5 20 JKBD CCOc1ccc(N(C(=O)CSc2ccc([N+](=O)[O-])cc2)C2CCN(CC(F)(F)F)CC2)cc1 520490276 GOKDFOZINXVWCX-UHFFFAOYSA-N 497.539 5.146 5 20 JKBD CN(C(=O)c1ccc(NC(=O)c2ccn(-c3ccc([N+](=O)[O-])cc3)n2)cc1Cl)C1CCCCC1 520683960 GVLZZGQXWXNUTE-UHFFFAOYSA-N 481.940 5.091 5 20 JKBD CN(C)c1ncccc1NC(=O)C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1 521389186 KOOATWQDRIVFNI-SAPNQHFASA-N 459.531 5.235 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Cl)[C@@H](NCc1ccccc1C(F)(F)F)c1ccccc1 521768609 TXTKFPYNCHQJFL-FQEVSTJZSA-N 463.843 5.737 5 20 JKBD Cc1ccc(-c2nc(CCNC(=O)c3cc([N+](=O)[O-])ccc3Sc3ccccc3)co2)cc1 522578341 HHKHVZOMGUXWMV-UHFFFAOYSA-N 459.527 5.682 5 20 JKBD COc1cc(C(=O)Nc2ccccc2CN(C)C)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 560317725 PNIFCYGHIWVDCJ-UHFFFAOYSA-N 455.898 5.363 5 20 JKBD Cn1c(-c2ccc(NC(=O)Cn3c4ccccc4c(=O)c4ccccc43)cc2)nc2ccccc21 589427045 RXMKIDFXJLXFOG-UHFFFAOYSA-N 458.521 5.347 5 20 JKBD CC(C)Cc1ccc(C(=O)C2CCN(C(=O)c3ccc(N4CCCC4)c([N+](=O)[O-])c3)CC2)cc1 603897675 YREDFWITZSWASI-UHFFFAOYSA-N 463.578 5.129 5 20 JKBD COC(=O)C[C@@H]1CCCCN1C(=O)C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1 604479144 QLWQFPKCDMGVOX-GJPUVDBCSA-N 479.558 5.079 5 20 JKBD CCN(C(=O)C1CCN(c2ccccc2[N+](=O)[O-])CC1)[C@@H](c1cccnc1)c1ccc(F)c(F)c1 609151724 SFKGUYIAISNBPA-RUZDIDTESA-N 480.515 5.123 5 20 JKBD Cc1cc(Sc2ncccn2)ccc1NC(=O)N[C@@H](CC(=O)OC(C)C)c1ccccc1[N+](=O)[O-] 609207749 SGDRFDOTWWDCQE-FQEVSTJZSA-N 495.561 5.049 5 20 JKBD COc1cc(/C=C/C(=O)Nc2ccc([N+](=O)[O-])c(Cl)c2)ccc1OCc1c(C)noc1C 727712424 WXZADSBGCUOAIG-WEVVVXLNSA-N 457.870 5.093 5 20 JKBD CN(CCOc1cccc(CNCc2c3ccccc3cc3ccccc23)c1)C1CCOCC1 728063255 BXCSFZQSNWIDNZ-UHFFFAOYSA-N 454.614 5.772 5 20 JKBD CC(C)(C)[C@@H](Cn1ccnc1)NC(=O)C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1 729340394 GACAKDFGNKMWSI-CMYVBNMBSA-N 489.601 5.563 5 20 JKBD COc1ccc(-c2ccc(C(=O)O[C@@H](C)C(=O)Nc3cccc([N+](=O)[O-])c3C)c(F)c2)c(F)c1 730634122 NIKKDTVFTMKGNO-AWEZNQCLSA-N 470.428 5.041 5 20 JKBD CC(C)(C)c1ccc(C(=O)Nc2ccccc2NC(=O)COc2ccc([N+](=O)[O-])c(F)c2)cc1 745766257 UZDVGAQGAWLJLC-UHFFFAOYSA-N 465.481 5.301 5 20 JKBD O=C(Nc1sccc1C(=O)NC1CC1)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1 746782158 PEUFIBATKLGMQI-UHFFFAOYSA-N 457.895 5.247 5 20 JKBD Cc1cc(C(=O)COC(=O)c2csc(-c3cccc([N+](=O)[O-])c3)n2)c(C)n1Cc1cccs1 747962415 OSTGZAFIYZXZRR-UHFFFAOYSA-N 481.555 5.286 5 20 JKBD Cc1cc(C(=O)COC(=O)C2CCN(c3ccc(C(F)(F)F)cc3[N+](=O)[O-])CC2)c(C)n1C1CC1 825345659 RIXMZCYMUCCHAU-UHFFFAOYSA-N 493.482 5.009 5 20 JKBD Cc1csc(Sc2ccc([N+](=O)[O-])cc2C(=O)O[C@H](C)C(=O)Nc2ccccc2C)n1 849132711 QUEOYYABMXVUAX-CQSZACIVSA-N 457.533 5.003 5 20 JKBD C[C@@H](NC(=O)c1cc(S(=O)(=O)Nc2ccc(Cl)cc2)ccc1Cl)c1cccc([N+](=O)[O-])c1 918135444 HBSYHYLUCAAIKC-CYBMUJFWSA-N 494.356 5.193 5 20 JKBD O=C(Nc1ccc(NC(=O)c2ccco2)c(Cl)c1)c1ccc(Br)c([N+](=O)[O-])c1 918170765 PYQKCLCGTBUXLY-UHFFFAOYSA-N 464.659 5.108 5 20 JKBD CCCC(=O)Nc1cccc(NC(=O)c2ccccc2NC(=O)c2ccc([N+](=O)[O-])cc2Cl)c1C 920292691 RKSQUOSLIQYIBR-UHFFFAOYSA-N 494.935 5.800 5 20 JKBD Cc1ccc(-c2cc(C(=O)NC3(c4ccc(NC(=O)c5ccc([N+](=O)[O-])[nH]5)cc4)CCC3)c[nH]2)cc1 1790184517 PRZHSUZFZPICMS-UHFFFAOYSA-N 483.528 5.288 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)Nc1ccc(C2(NC(=O)c3cc4ncsc4[nH]3)CCC2)cc1 1790772111 DZCYKLMZEUBLNM-UHFFFAOYSA-N 493.520 5.042 5 20 JKBD Cc1ccc(C(=O)Nc2cc([C@H]3CCCCN3C(=O)c3cccc(F)c3[N+](=O)[O-])[nH]n2)cc1Cl 1814590790 VBQQHPHYCYKZNZ-LJQANCHMSA-N 485.903 5.039 5 20 JKBD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)[nH]n1)c1ccoc1Cl 1820395316 KPOPZFIRQMZGEG-INIZCTEOSA-N 499.936 5.399 5 20 JKBD Cc1c(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)c3ccc(F)s3)[nH]n2)cc(Cl)cc1[N+](=O)[O-] 1821291583 YXIGPTHJPYVBIO-HNNXBMFYSA-N 491.932 5.100 5 20 JKBD Cc1c(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)C3(F)CCCCC3)[nH]n2)cc(Cl)cc1[N+](=O)[O-] 1821293089 GGQZNIWXOICESI-SFHVURJKSA-N 491.951 5.258 5 20 JKBD O=C(Cc1ccc([N+](=O)[O-])cc1F)N1CCC([C@H]2CCCCN2C(=O)c2ccc(C3CC3)cc2)CC1 1830750890 LKRBHANXDMBXKZ-AREMUKBSSA-N 493.579 5.087 5 20 JKBD Cc1ccn(C)c1C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)CC1 1831060831 HGGBIUUJUNXKJJ-NRFANRHFSA-N 494.617 5.004 5 20 JKBD C[C@H](C(=O)N1CCCC[C@H]1C1CCN(C(=O)/C=C/c2ccccc2[N+](=O)[O-])CC1)c1ccccc1 1832900558 OLVAZRFLGJESLR-QVSJGEDXSA-N 475.589 5.031 5 20 JKBD Cc1ccccc1-n1c(C)nnc1S[C@H](C)C(=O)Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1 10245746 UDIRNYPWOIXPEC-CQSZACIVSA-N 480.575 5.035 5 20 JKBD C[C@H](OC(=O)c1ccccc1C(=O)c1ccc(Cl)c([N+](=O)[O-])c1)C(=O)N1CCCc2ccccc21 11029247 FULHASUPHIPKKB-INIZCTEOSA-N 492.915 5.004 5 20 JKBD Cc1cc(C)c(NC(=O)[C@H](C)OC(=O)c2ccccc2C(=O)c2ccc(Cl)c([N+](=O)[O-])c2)c(C)c1 11029305 PICIDZYMQPIOMX-KRWDZBQOSA-N 494.931 5.588 5 20 JKBD COc1ccc(NC(=O)[C@H](C)Sc2nnc(-c3cccs3)n2-c2ccccc2)c([N+](=O)[O-])c1 16711667 RCEWGNGZQZIJSF-AWEZNQCLSA-N 481.559 5.032 5 20 JKBD CCN(C(=O)c1ccc(Sc2nc(C)cs2)c([N+](=O)[O-])c1)c1nc2ccccc2s1 26906774 BYMGHVHZSXHFSR-UHFFFAOYSA-N 456.574 5.787 5 20 JKBD C[C@@H](C1CC1)N(Cc1ccccc1)C(=O)CSc1nc2cc3ccccc3cc2c(=O)n1C 27948329 BMTBCLAKDISISS-SFHVURJKSA-N 457.599 5.006 5 20 JKBD CC(=O)NCc1ccc(-c2csc(NC(=O)c3cc([N+](=O)[O-])ccc3Sc3ccccc3)n2)o1 29186674 SNJPQQYLWDOVFX-UHFFFAOYSA-N 494.554 5.351 5 20 JKBD C[C@@H](Nc1ccc(C(=O)NCC2(c3cccc(Cl)c3)CCOCC2)cc1[N+](=O)[O-])c1ccccn1 108813912 CMONMLAFUSZTKV-GOSISDBHSA-N 494.979 5.295 5 20 JKBD COc1cc(C(=O)Nc2ccc(-c3cnco3)cc2)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 487481677 XDUYAVPYLPPEOI-UHFFFAOYSA-N 465.849 5.956 5 20 JKBD O=C(CSc1ccccc1C(=O)NCc1ccccc1[N+](=O)[O-])Nc1cc(Cl)cc(Cl)c1 500789895 FIAYOVJZDHLNHA-UHFFFAOYSA-N 490.368 5.562 5 20 JKBD O=C(Nc1ccc(CN2CCCC2=O)cc1)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1 500971129 ZKPSDAFOUXXWLI-UHFFFAOYSA-N 465.893 5.415 5 20 JKBD Cc1nc(-c2ccccc2)sc1[C@H](C)NC(=O)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-] 501628773 NYMXJIVVTFWNCL-LBPRGKRZSA-N 465.453 5.459 5 20 JKBD O=C(Nc1ccc(NC(=O)[C@@H]2CCCO2)cc1)c1ccc(NCc2ccccc2Cl)c([N+](=O)[O-])c1 502873144 UOTVBQYYEKMWNT-QHCPKHFHSA-N 494.935 5.230 5 20 JKBD COc1ccc(CC2CCN(C(=O)c3ccc(N[C@H](C)c4ccccn4)c([N+](=O)[O-])c3)CC2)cc1 504939941 WEXJLPKVXVRJNS-LJQANCHMSA-N 474.561 5.266 5 20 JKBD O=[N+]([O-])c1ccc(CN(Cc2ccccc2)S(=O)(=O)c2ccccc2C(F)(F)F)cc1 514592365 PFFSZUXBDRGZNW-UHFFFAOYSA-N 450.438 5.005 5 20 JKBD Cc1nc(COc2ccccc2C(=O)Nc2nc(-c3cccc([N+](=O)[O-])c3)c(C)s2)cs1 515624026 HTBUMSNXZAHPJN-UHFFFAOYSA-N 466.544 5.623 5 20 JKBD Cc1cc([N+](=O)[O-])ccc1NC(=O)CNc1ccccc1NC(=O)c1ccc(C(C)(C)C)cc1 515673595 BOJXWCQLTGEYBS-UHFFFAOYSA-N 460.534 5.504 5 20 JKBD C[C@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)N(Cc1ccccn1)c1ccc(Br)cc1 518857798 AFFKIZZUOIWHRX-AWEZNQCLSA-N 490.741 5.406 5 20 JKBD C[C@H](c1cccc([N+](=O)[O-])c1)S(=O)(=O)Cc1csc(-c2ccc(Br)cc2)n1 520669033 MEGYBPDZBWGXEO-GFCCVEGCSA-N 467.366 5.157 5 20 JKBD O=C(C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)N1CCn2c1nc1ccccc12 520952148 DGIFGLJLAWMTEM-SDXDJHTJSA-N 481.537 5.532 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1C(=O)c1ccccc1)c1cccc(OCc2cscn2)c1 589250983 MKTOVAUYANSPRO-UHFFFAOYSA-N 459.483 5.114 5 20 JKBD Cc1ccc(-c2csc(NC(=O)c3sc(NC(=O)C(C)(C)C)cc3C)n2)cc1[N+](=O)[O-] 589255641 LGPNXZJEQGWSQL-UHFFFAOYSA-N 458.565 5.634 5 20 JKBD Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)Cc1ccc(NC(=O)c2cccc(Br)c2)cc1 603751561 JSKBTJHIXKSWJT-UHFFFAOYSA-N 482.334 5.408 5 20 JKBD O=C(c1ccc(Sc2nc3ccccc3s2)c([N+](=O)[O-])c1)N1CCn2c1nc1ccccc12 603953679 LYKXQISCQSCSMT-UHFFFAOYSA-N 473.539 5.366 5 20 JKBD O=C(CNc1ccccc1[N+](=O)[O-])Nc1ccccc1OCc1ncc(-c2cccc(Cl)c2)o1 608855426 GOZQDTLVHZWGBJ-UHFFFAOYSA-N 478.892 5.533 5 20 JKBD Cc1ccccc1[C@@H]1CCN(C(=O)c2ccc(C(=O)N3CC[C@H](c4ccccc4C)C3)c([N+](=O)[O-])c2)C1 609044649 JWXNEVDVXYRJMY-RPWUZVMVSA-N 497.595 5.471 5 20 JKBD O=C(Cn1c2ccccc2c(=O)c2ccccc21)N[C@@H](c1ccccc1)c1ccc(Br)cc1 620389300 DFSBNLUMCZSIQH-MHZLTWQESA-N 497.392 5.823 5 20 JKBD O=C(OCc1nnc(-c2ccc([N+](=O)[O-])cc2)o1)c1cccc(OCc2ccc(Cl)cc2)c1 728995950 IVWGKLYFTHMELH-UHFFFAOYSA-N 465.849 5.234 5 20 JKBD CN(C)C(=O)Sc1cccc(NC(=O)CSc2ccc(C(F)(F)F)cc2[N+](=O)[O-])c1 729242903 OYZNZCYDXXUNAX-UHFFFAOYSA-N 459.471 5.118 5 20 JKBD Cc1ccc2nc(-c3cccnc3)cc(C(=O)O[C@H](C)C(=O)Nc3cc([N+](=O)[O-])ccc3Cl)c2c1 730442607 XANFLORPSSIFLZ-OAHLLOKOSA-N 490.903 5.351 5 20 JKBD Cc1ccc(NC(=O)c2ccc(N[C@@H](C)c3cc(F)ccc3N3CCC(O)CC3)c([N+](=O)[O-])c2)cc1 730566186 AKUQYOIUKYZWOV-SFHVURJKSA-N 492.551 5.429 5 20 JKBD O=C(Oc1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2Cl)cc1)c1ccn(-c2ccccc2F)n1 915132328 JEYOIZICSRJNLP-UHFFFAOYSA-N 480.839 5.045 5 20 JKBD Cc1oc2cc(OS(=O)(=O)c3cccc(F)c3[N+](=O)[O-])ccc2c(=O)c1-c1ccccc1Cl 918193632 GZWCVQNOAGTJQR-UHFFFAOYSA-N 489.864 5.237 5 20 JKBD O=C(c1cc(-c2ccncc2)nc2ccc(Br)cc12)N1CCc2ccc([N+](=O)[O-])cc21 919992644 GFTFIUHQESHAIK-UHFFFAOYSA-N 475.302 5.170 5 20 JKBD Cc1nc(-c2ccc(Cl)s2)sc1C(=O)O[C@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl 921106465 PHGFNLPXMBATPV-SECBINFHSA-N 486.358 5.579 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)c3cccc4ccccc34)CCC2)cc1)c1ccc([N+](=O)[O-])o1 1785748935 OCVIQKCCUPWPMF-UHFFFAOYSA-N 455.470 5.403 5 20 JKBD C[C@@H](C(=O)NC1(c2ccc(NC(=O)/C=C/c3ccc([N+](=O)[O-])o3)cc2)CCC1)c1cccs1 1786208079 JHTSPCWDVBXNLA-PXUDHTSWSA-N 465.531 5.200 5 20 JKBD Cc1nscc1C(=O)Nc1ccc(C2(NC(=O)C3(c4cccc([N+](=O)[O-])c4)CCC3)CCC2)cc1 1787192589 DJDWFUMDJLUWMP-UHFFFAOYSA-N 490.585 5.229 5 20 JKBD COc1ccc(Cl)cc1C(=O)Nc1ccc(C2(NC(=O)/C=C/c3ccc([N+](=O)[O-])o3)CCC2)cc1 1790341457 DQQOLSSSKLNQGS-DHZHZOJOSA-N 495.919 5.311 5 20 JKBD Cc1ccsc1C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)[nH]n1 1816349604 AXIJVPZRWXGMNV-QGZVFWFLSA-N 495.586 5.522 5 20 JKBD O=C(/C=C/c1ccccc1[N+](=O)[O-])Nc1cc([C@@H]2CCCCN2C(=O)c2cc(Cl)ccc2F)[nH]n1 1823501938 YBICZZKCCSXXAQ-MAIVGLDJSA-N 497.914 5.130 5 20 JKBD O=C(c1sccc1F)N1CCCC[C@@H]1C1CCN(C(=O)C2(c3cccc([N+](=O)[O-])c3)CCC2)CC1 1824729209 IOHXZFLNMYKAPA-JOCHJYFZSA-N 499.608 5.151 5 20 JKBD O=C(/C=C/c1ccccc1[N+](=O)[O-])N1CCC([C@@H]2CCCCN2C(=O)/C=C/c2cccs2)CC1 1827079849 LHNVUQSIPBVBBC-ARVPNPJDSA-N 479.602 5.003 5 20 JKBD O=C(c1cccc(F)c1[N+](=O)[O-])N1CCC([C@H]2CCCCN2C(=O)c2ccc3occc3c2)CC1 1828257355 HIMFAIOGPAUKPM-JOCHJYFZSA-N 479.508 5.027 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)N1CCC([C@H]2CCCCN2C(=O)c2ccccc2Cl)CC1 1829895255 NNSGBOZYABVTHN-JOCHJYFZSA-N 487.959 5.243 5 20 JKBD O=C(c1cc2cc([N+](=O)[O-])ccc2s1)N1CCC([C@H]2CCCCN2C(=O)CCc2ccoc2)CC1 1832349090 GCZCESVDEWXXPG-JOCHJYFZSA-N 495.601 5.269 5 20 JKBD O=C(/C=C/c1ccccc1[N+](=O)[O-])N1CCC([C@@H]2CCCCN2C(=O)C23CCC(CC2)CC3)CC1 1832391301 XTTLPCCKXYAFDC-DTEJCLQWSA-N 479.621 5.198 5 20 JKBD Cc1cccc([N+](=O)[O-])c1NC(=O)CSc1nnc(-c2ccc(Cl)cc2)n1-c1ccccc1 8641473 GAJINCWZGRMUGQ-UHFFFAOYSA-N 479.949 5.535 5 20 JKBD C[C@@H](Sc1nnc(-c2ccc(Br)cc2)o1)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl 8758644 NNDBXEDAKMFZBU-SECBINFHSA-N 483.731 5.180 5 20 JKBD COc1cc(OC)c(NC(=O)CNc2cc([N+](=O)[O-])ccc2Nc2ccccc2)cc1Cl 10173849 OISADZRMKACXGB-UHFFFAOYSA-N 456.886 5.060 5 20 JKBD COCCN(C(=O)c1csc(-c2ccc(C)cc2)n1)c1nc(-c2ccc([N+](=O)[O-])cc2)cs1 17346242 OWZHDOVRNMHYKA-UHFFFAOYSA-N 480.571 5.443 5 20 JKBD CCN(c1ccccc1)S(=O)(=O)c1ccc(Sc2nnc(-c3ccccc3)o2)c([N+](=O)[O-])c1 20667034 AYERHRCLKSSVKQ-UHFFFAOYSA-N 482.543 5.011 5 20 JKBD O=C(OCc1csc(-c2ccsc2)n1)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 104998153 LHGHJZLMXNOSHY-UHFFFAOYSA-N 497.520 5.758 5 20 JKBD CC(=O)Nc1cccc(Nc2nnc(Sc3ccc(Br)cc3[N+](=O)[O-])s2)c1 110450323 HTCWITIZXQBORC-UHFFFAOYSA-N 466.342 5.062 5 20 JKBD Cn1cnnc1Sc1ccc(C(=O)N[C@H](Cc2ccccc2Cl)c2ccccc2)cc1[N+](=O)[O-] 195728221 SIKXOISNPPHXDH-HXUWFJFHSA-N 493.976 5.242 5 20 JKBD CCOc1cc([N+](=O)[O-])c(C(=O)Nc2ccccc2-c2ccc(-c3ccccc3)cc2)cc1OC 410041959 NBOQYNJWNUWHQJ-UHFFFAOYSA-N 468.509 6.588 5 20 JKBD Cc1ccc(Sc2ccc(C(=O)N3CCC(C(=O)N4CCC[C@@H](C)C4)CC3)cc2[N+](=O)[O-])cc1 515197333 MAMXRBZTJPQIDD-LJQANCHMSA-N 481.618 5.165 5 20 JKBD CCCCn1c(SCc2nc(-c3ccc([N+](=O)[O-])cc3)no2)nc2sc(C)c(C)c2c1=O 515409856 NJTXPYAVTZPMIE-UHFFFAOYSA-N 471.564 5.125 5 20 JKBD COc1ccc(CCCN(C)C(=O)c2ccccc2C(=O)c2ccc(SC)c([N+](=O)[O-])c2)cc1 516138836 VFNWLYJHOJGOKN-UHFFFAOYSA-N 478.570 5.261 5 20 JKBD Cc1cccc2c1CC[C@H]2N[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Br)c1ccccc1 517934323 PDBZJHJANVSARV-FYYLOGMGSA-N 480.362 5.623 5 20 JKBD C[C@H]1CN(Cc2ccc(CNCc3ccc(-c4ccc([N+](=O)[O-])cc4)s3)cc2)C[C@H](C)O1 518768041 AKXFXUPJMUKVDG-OALUTQOASA-N 451.592 5.222 5 20 JKBD CN(C)C(=O)c1ccc(NC(=O)C/C(=C/c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)cc1 600864270 AIEINKMQNQQLBB-CYVLTUHYSA-N 486.553 5.476 5 20 JKBD CCn1c(SCc2nc(-c3cccc([N+](=O)[O-])c3)no2)nc2scc(-c3cccs3)c2c1=O 603562446 LAWHBCBEBYAWLJ-UHFFFAOYSA-N 497.583 5.457 5 20 JKBD C[C@@H](C(=O)Nc1cccc(NC(=O)c2cc([N+](=O)[O-])ccc2Oc2ccccc2)c1)n1cccn1 603739477 MTPIIFRIHGLCSP-KRWDZBQOSA-N 471.473 5.036 5 20 JKBD C[C@@H](Nc1ccc([N+](=O)[O-])c(C(=O)N2CCCC2)c1)c1cccc(NC(=O)c2ccccc2)c1 603943915 OQSYVKQVYMMLDV-GOSISDBHSA-N 458.518 5.256 5 20 JKBD CC(C)NC(=O)c1ccc(Cl)c(NC(=O)CSc2ccc(C(F)(F)F)cc2[N+](=O)[O-])c1 603975404 YROIYARPGJOSTK-UHFFFAOYSA-N 475.876 5.136 5 20 JKBD C[C@@H](NC(=O)C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)c1ccc2nc(O)[nH]c2c1 604244096 UHPVXZHOVJPKLP-GYZOOYGHSA-N 499.552 5.595 5 20 JKBD CC(C)(C)OC(=O)Nc1ccccc1NC(=O)CSc1ccc(C(F)(F)F)cc1[N+](=O)[O-] 727805538 QRZIZGSNPWBOGC-UHFFFAOYSA-N 471.457 5.691 5 20 JKBD Cc1ccc(NC(=O)c2nnc(/C(Cl)=C\c3ccc(-c4ccc([N+](=O)[O-])cc4)o3)s2)cc1 844255971 WYIIJSRHLFVJMB-LDADJPATSA-N 466.906 6.004 5 20 JKBD CCOC(=O)c1c(-c2ccc(OC)c(OC)c2)csc1NC(=O)c1ccc([N+](=O)[O-])cc1Cl 863982347 DVHMBKDXJYXHGJ-UHFFFAOYSA-N 490.921 5.423 5 20 JKBD Cc1cc(C)c(-c2csc(NC(=O)c3cc([N+](=O)[O-])ccc3I)n2)c(C)c1 915273787 AZEIXBTWEWCWFM-UHFFFAOYSA-N 493.326 5.500 5 20 JKBD C[C@@H](OC(=O)[C@@H](C)Oc1ccc(C(C)(C)C)cc1)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 916535687 HVRCFYABSUTAFY-ZIAGYGMSSA-N 482.455 5.249 5 20 JKBD Cc1cccc([N+](=O)[O-])c1NC(=O)COC(=O)c1csc(-c2ccc(Cl)cc2Cl)n1 921223772 OPHJEURJNAGLBE-UHFFFAOYSA-N 466.302 5.129 5 20 JKBD O=C(/C=C/c1ccco1)Nc1ccc(C2(NC(=O)Cc3ccc(Cl)cc3[N+](=O)[O-])CCC2)cc1 1786912201 DJNHETJBZDEOEF-ZHACJKMWSA-N 479.920 5.231 5 20 JKBD Cc1cnc(Cl)c(C(=O)Nc2ccc(C3(NC(=O)/C=C/c4ccc([N+](=O)[O-])o4)CCC3)cc2)c1 1787566838 HPFJFUKSTUOUOU-VQHVLOKHSA-N 480.908 5.006 5 20 JKBD COc1ccc(Cl)cc1C(=O)Nc1ccc(C2(NC(=O)c3cc(C)c([N+](=O)[O-])cn3)CCC2)cc1 1790343818 UGFHEIMFZDPGFF-UHFFFAOYSA-N 494.935 5.022 5 20 JKBD CC(C)Oc1ccc(C(=O)Nc2ccc(C3(NC(=O)c4ccc([N+](=O)[O-])[nH]4)CCC3)cc2)cc1Cl 1790611111 CEPZBZMXLFOUFS-UHFFFAOYSA-N 496.951 5.425 5 20 JKBD O=C(CC1CCC1)NC1(c2ccc(NC(=O)c3ccc(Br)c([N+](=O)[O-])c3)cc2)CCC1 1790643126 ZVTPLOQGWWSQMQ-UHFFFAOYSA-N 486.366 5.295 5 20 JKBD Cc1c(C(=O)Nc2ccc(C3(NC(=O)C45CC(F)(C4)C5)CCC3)cc2)cc(Cl)cc1[N+](=O)[O-] 1790773931 KHSNQWWTVXWMGN-UHFFFAOYSA-N 471.916 5.197 5 20 JKBD COc1cc(C(=O)Nc2ccc(C3(NC(=O)[C@H](C)c4cccs4)CCC3)cc2)ccc1[N+](=O)[O-] 1792165965 VAGDGWKQAJVSFS-MRXNPFEDSA-N 479.558 5.216 5 20 JKBD O=C(/C=C/c1ccccc1[N+](=O)[O-])N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1sc2ccccc2c1Cl 1797463800 DQOTUACVEGRXRL-SQSUDPNUSA-N 495.988 5.428 5 20 JKBD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(F)cc([N+](=O)[O-])c1)c1cc2c(Cl)cccc2s1 1800522778 HUEAAFHXUDMYII-MUJYYYPQSA-N 487.940 5.168 5 20 JKBD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(C2CC2)cc1)c1cc2cc([N+](=O)[O-])ccc2s1 1800733470 XAUJVEANVPRJNP-WKCHPHFGSA-N 475.570 5.253 5 20 JKBD C[C@@H](C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cccc(F)c2[N+](=O)[O-])[nH]n1)c1ccc(Cl)cc1 1814662155 ZKBZNMMYDLEWLK-JLTOFOAXSA-N 499.930 5.220 5 20 JKBD O=C(Nc1cc([C@H]2CCCCN2C(=O)CCc2cccc([N+](=O)[O-])c2)[nH]n1)c1cc(F)ccc1Cl 1821123369 VLZSMJRDELDFES-OAQYLSRUSA-N 499.930 5.049 5 20 JKBD Cc1ccc(CC(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3ccc(Cl)s3)CC2)cc1[N+](=O)[O-] 1830363018 LTUHQFGPDSIDID-LJQANCHMSA-N 490.025 5.094 5 20 JKBD O=C(/C=C/c1ccccc1[N+](=O)[O-])N1CCC([C@H]2CCCCN2C(=O)c2ccc(Cl)c(F)c2)CC1 1830486606 HPCSITJDSUYXKG-BDTMADQZSA-N 499.970 5.334 5 20 JKBD Cc1c(C(=O)N2CCCC[C@H]2C2CCN(C(=O)CC3CCCC3)CC2)cc(Cl)cc1[N+](=O)[O-] 1830736731 ZDDABFGZBKOULJ-QFIPXVFZSA-N 476.017 5.370 5 20 JKBD C[C@H](NC(=O)c1ccccc1NC(=O)Cn1c2ccccc2c(=O)c2ccccc21)c1ccccc1 11250109 SANOWJAZXOQFLV-FQEVSTJZSA-N 475.548 5.284 5 20 JKBD CC(=O)N(c1nc(/C=C(\Cl)c2nc3cc([N+](=O)[O-])ccc3[nH]2)cs1)c1ccc(F)cc1F 15188992 KLSQJKDWJCYFOR-AUWJEWJLSA-N 475.864 5.627 5 20 JKBD CC(C)Cn1c(S[C@@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)nc2ccc(Cl)cc2c1=O 17724684 NYPRJQVKILRSEC-ZDUSSCGKSA-N 485.953 5.517 5 20 JKBD CN(Cc1ccc(OC(F)F)cc1)C(=O)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 23601279 YKPJHNWRMGFTKO-UHFFFAOYSA-N 487.425 5.090 5 20 JKBD COc1ccc(CNC(=O)c2ccc(Sc3nc(C)cs3)c([N+](=O)[O-])c2)cc1OC(F)F 27286336 WRJWOYSPUCOLBB-UHFFFAOYSA-N 481.502 5.051 5 20 JKBD COc1ccc(CCC(=O)O[C@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2ccccc2)cc1 28803455 SVKGNIGPANWXFA-QHCPKHFHSA-N 468.893 5.113 5 20 JKBD O=C(C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)NCCc1ccc(F)cc1 29601092 SGCRPFHGGONTCL-CYVLTUHYSA-N 461.518 5.633 5 20 JKBD COc1cc([N+](=O)[O-])ccc1OCc1csc(-c2cc(Br)ccc2OC)n1 72067978 UPNVLPQPRRPXDQ-UHFFFAOYSA-N 451.298 5.077 5 20 JKBD C[C@H]1C[C@H](C)CN(c2ccc(C(=O)Nc3ccc(Cl)cc3C(=O)N3CCCC3)cc2[N+](=O)[O-])C1 302960737 QCYQDMFDWIUOPO-IRXDYDNUSA-N 484.984 5.219 5 20 JKBD CCOc1ccc(Oc2ccc(Cl)cc2NC(=O)CCn2nc(C)c([N+](=O)[O-])c2C)cc1 303181808 TUFAIPSMQMKKKX-UHFFFAOYSA-N 458.902 5.281 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)N[C@H](c2cccc(C(F)(F)F)c2)C(C)(C)C)cc1SC 484417731 WKQPSTNOIQTOFA-GOSISDBHSA-N 456.486 5.861 5 20 JKBD COc1cc(C(=O)N[C@H](C)c2ccc3c(c2)CCC(=O)N3)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 500056717 RJUBFAXHSRSKQK-CQSZACIVSA-N 495.919 5.425 5 20 JKBD CC(C)n1c(SCC(=O)c2ccc([N+](=O)[O-])cc2)nnc1-c1ccc(Cl)cc1Cl 502595297 XGGUTIQSTLALGS-UHFFFAOYSA-N 451.335 5.716 5 20 JKBD C[C@H](c1cccc(C(F)(F)F)c1)N(C(=O)CCCn1c(=O)oc2cc([N+](=O)[O-])ccc21)C1CC1 502864013 YYMLOBDYODNMMG-CQSZACIVSA-N 477.439 5.054 5 20 JKBD Cc1cc(C(=O)N2CCSCC2)ccc1NC(=O)c1ccc(SCCC(C)C)c([N+](=O)[O-])c1 506287286 BBBTWJMMALHQKC-UHFFFAOYSA-N 487.647 5.483 5 20 JKBD O=C(Nc1cc2c(cc1[N+](=O)[O-])OCCCO2)c1csc(-c2cccc(C(F)(F)F)c2)n1 508783231 GYZYTVUWAVLHJQ-UHFFFAOYSA-N 465.409 5.151 5 20 JKBD CN(C(=O)CSc1ccc(C(F)(F)F)cc1[N+](=O)[O-])c1ccc(Br)cc1F 509717148 FRGYMYLYYIAEGQ-UHFFFAOYSA-N 467.238 5.270 5 20 JKBD O=C(Nc1cccc2[nH]ccc12)N1CCN(Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)CC1 509937782 GJFWMIZPCFJXKO-UHFFFAOYSA-N 461.547 5.154 5 20 JKBD O=C(C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)Nc1ccc(-c2nnco2)cc1 511990277 JFHORBPIZBGCPF-AQTBWJFISA-N 483.509 5.824 5 20 JKBD CCN(C(=O)c1cc(OC)c(OCc2cscn2)cc1[N+](=O)[O-])[C@@H](C)c1ccc(F)cc1 512205425 ZAADBWJCJRTFHH-AWEZNQCLSA-N 459.499 5.001 5 20 JKBD O=C(Nc1cc(N2CCCC2=O)ccc1Cl)c1cc([N+](=O)[O-])ccc1Sc1ccccc1 512471745 MYLCERYAFHDNTP-UHFFFAOYSA-N 467.934 5.779 5 20 JKBD COc1ccc([N+](=O)[O-])cc1NC(=O)c1cc(-c2ccc(C)s2)nc2c1cnn2C(C)C 514907278 MUIBDHVFLHXRPS-UHFFFAOYSA-N 451.508 5.218 5 20 JKBD O=[N+]([O-])c1ccccc1-c1ccc(CNCc2ccc(N3CCc4ccccc4C3)nc2)s1 517543220 ZUEGCJYQDJHOFN-UHFFFAOYSA-N 456.571 5.571 5 20 JKBD CC(C)CC(=O)Nc1cccc(CN[C@@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2ccccc2)c1 518853655 ZYZWCZXWRNXOEZ-RUZDIDTESA-N 494.979 5.702 5 20 JKBD O=[N+]([O-])c1ccc(-c2ccc(CNCc3coc(-c4cccs4)n3)o2)c(Br)c1 520217394 ZYIRJJRFZYXEPE-UHFFFAOYSA-N 460.309 5.624 5 20 JKBD Cc1ccc2nc([C@H]3CCCN3C(=O)CSc3ccc(C(F)(F)F)cc3[N+](=O)[O-])[nH]c2c1 522041598 IOPOWBXTSYABKK-MRXNPFEDSA-N 464.469 5.254 5 20 JKBD CCCCn1nccc1NC(=O)C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1 522587452 NWONTKKEONPCLV-OBGWFSINSA-N 461.547 5.771 5 20 JKBD O=C(c1cc2ccccc2c2cccnc12)N1CCC[C@@H](c2nc(-c3cccc(F)c3)no2)C1 588109404 XEJWAZKAAGRSED-LJQANCHMSA-N 452.489 5.597 5 20 JKBD CC(C)(C)c1ccccc1NC(=O)N1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 603645058 HVCGMZFVQOMOHC-UHFFFAOYSA-N 450.461 5.265 5 20 JKBD C[C@@H](c1ccc2ccccc2c1)N(C(=O)CCCn1c(=O)oc2cc([N+](=O)[O-])ccc21)C1CC1 604349832 JBJVNHUUELXPLT-KRWDZBQOSA-N 459.502 5.188 5 20 JKBD C[C@@H](CNC(=O)C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)CN1CCCCC1 604441496 GMZVHHIRKKYNAC-SLOMDMAXSA-N 478.618 5.373 5 20 JKBD COCCN(C(=O)c1cnc(-c2ccc(C)cc2C)s1)c1nc(-c2ccc([N+](=O)[O-])cc2)cs1 604508845 VZMQRQUREZUCNB-UHFFFAOYSA-N 494.598 5.752 5 20 JKBD C[C@@H](Nc1ccc(C(=O)Nc2ccccc2NC(=O)c2cccs2)cc1[N+](=O)[O-])c1ccccn1 608808834 HDDAKIMDIYNCLV-MRXNPFEDSA-N 487.541 5.729 5 20 JKBD CC(C)Oc1ccc(NC(=S)/C(=C(/O)c2cccc([N+](=O)[O-])c2)[n+]2ccc(C(C)(C)C)cc2)cc1 726574248 PETJFFRDIOWFGH-UHFFFAOYSA-O 492.621 6.290 5 20 JKBD O=C(CCC(=O)c1ccc2ccc3cccc4ccc1c2c34)Nc1ccccc1OCCn1ccnc1 729263423 RZTNOOZFCDHIJU-UHFFFAOYSA-N 487.559 6.461 5 20 JKBD O=C(COc1ccc([N+](=O)[O-])c(F)c1)Nc1cccc(NC(=O)Nc2cccc(C(F)(F)F)c2)c1 745773030 FVQFTLXCKCXVCC-UHFFFAOYSA-N 492.385 5.414 5 20 JKBD COc1cccc(-c2nc(COC(=O)c3csc(-c4ccc([N+](=O)[O-])cc4)n3)cs2)c1 747955921 FFFADVCBISCPEI-UHFFFAOYSA-N 453.501 5.207 5 20 JKBD Cc1cc(C(=O)N2CCC(C)CC2)ccc1NC(=O)c1cc([N+](=O)[O-])ccc1N1CCC(C)CC1 917779957 QPMWBCYUHUKWSH-UHFFFAOYSA-N 478.593 5.264 5 20 JKBD Cc1ccc(C(=O)Nc2ccc(C3(NC(=O)C4(c5cccc([N+](=O)[O-])c5)CCC4)CCC3)cc2)o1 1786493456 ISTTVAXHCFGWOI-UHFFFAOYSA-N 473.529 5.366 5 20 JKBD COc1cc(C(=O)NC2(c3ccc(NC(=O)c4cccc5cc[nH]c45)cc3)CCC2)ccc1[N+](=O)[O-] 1789093615 YEZNKBFSXMGHFU-UHFFFAOYSA-N 484.512 5.146 5 20 JKBD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc2cc([N+](=O)[O-])ccc2s1)c1sccc1Cl 1801207407 MTHCGJCHYQTVRR-BTTYYORXSA-N 475.979 5.090 5 20 JKBD C[C@H](C(=O)Nc1cc([C@H]2CCCCN2C(=O)/C=C/c2ccc([N+](=O)[O-])o2)[nH]n1)c1ccc(Cl)cc1 1814656530 XCNOGSGQTKOXHZ-LCGCRYAWSA-N 497.939 5.074 5 20 JKBD O=C(CCC1CCC1)Nc1cc([C@H]2CCCCN2C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)[nH]n1 1815052535 WEWKVJLCERFIID-LJQANCHMSA-N 481.578 5.419 5 20 JKBD O=C(CCc1ccccc1Cl)Nc1cc([C@@H]2CCCCN2C(=O)c2ccc([N+](=O)[O-])cc2F)[nH]n1 1817004616 PXJMFQSXBFLHLG-NRFANRHFSA-N 499.930 5.049 5 20 JKBD O=C(Nc1cc([C@H]2CCCCN2C(=O)c2cc(F)cc([N+](=O)[O-])c2)[nH]n1)c1cccc2ccccc12 1818453796 AGAQPTPUFBQLBT-HSZRJFAPSA-N 487.491 5.230 5 20 JKBD Cc1ccc(C(=O)N2CCCC[C@H]2C2CCN(C(=O)CSc3ccccc3[N+](=O)[O-])CC2)cc1F 1829968384 KCNZYFIEIFCHDS-QFIPXVFZSA-N 499.608 5.068 5 20 JKBD Cc1ccc([C@H](C)C(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3ccc([N+](=O)[O-])cc3F)CC2)cc1 1831530274 PRMRJMVMSWSWTL-UQBPGWFLSA-N 481.568 5.079 5 20 JKBD Cc1nc(-c2ccc(Cl)cc2)sc1C(=O)OCC(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 10696612 COGHROOEKFIOLN-UHFFFAOYSA-N 499.854 5.494 5 20 JKBD C[C@@H](OC(=O)c1ccccc1OCc1ccccc1)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 10863985 BTYWQNWBVLOYQO-OAHLLOKOSA-N 488.418 5.377 5 20 JKBD CCCCCCn1c(S[C@@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)nc2ccccc2c1=O 17654310 FWJAHRURRVGRGI-INIZCTEOSA-N 479.562 5.788 5 20 JKBD COCc1c(C(=O)N2CCN(c3ccc(C(F)(F)F)cc3[N+](=O)[O-])CC2)sc2cccc(F)c12 19295509 QFRRQISXUMENDT-UHFFFAOYSA-N 497.470 5.076 5 20 JKBD Cc1nn(Cc2ccc(C(=O)Nc3ccccc3-c3nc4ccccc4s3)cc2)c(C)c1[N+](=O)[O-] 20012789 WEGNIKPVTQDKKE-UHFFFAOYSA-N 483.553 5.985 5 20 JKBD CC(=O)c1cccc(NC(=O)C/C(=C/c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)c1 29562707 CRSSQCREXDNLPH-UYRXBGFRSA-N 457.511 5.977 5 20 JKBD COc1cc([C@H](C)N[C@@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2ccccc2)ccc1OC(C)C 30454846 NCOFBYUBEVYILZ-SSOJOUAXSA-N 497.979 6.075 5 20 JKBD Cc1ccc(NC(=O)[C@H](Sc2nc3ccccc3c3nc(C)nn23)c2ccccc2)c([N+](=O)[O-])c1 69507125 GFZXRIIWODKZNQ-JOCHJYFZSA-N 484.541 5.275 5 20 JKBD Cc1ccc(CSCCNC(=O)c2ccc(N[C@@H](C)c3ccccn3)c([N+](=O)[O-])c2)cc1 108790315 OAIKMKHCHMODFW-SFHVURJKSA-N 450.564 5.135 5 20 JKBD O=C(CSc1nnc(-c2ccccc2Cl)n1Cc1ccccc1)c1ccc([N+](=O)[O-])cc1 409932632 MEJFFFBNUMQLER-UHFFFAOYSA-N 464.934 5.530 5 20 JKBD C[C@H](NC(=O)c1cc([N+](=O)[O-])ccc1Sc1ccccc1)c1ccc(NC(=O)NC2CC2)cc1 483265952 GXXIBYZTZAXBDZ-INIZCTEOSA-N 476.558 5.521 5 20 JKBD COc1cc(C(=O)Nc2ccc3nc(Cc4ccccc4F)[nH]c3c2)c([N+](=O)[O-])cc1OC(F)F 483378291 QCXHZWUOXJVEAF-UHFFFAOYSA-N 486.406 5.063 5 20 JKBD CCOc1cc([N+](=O)[O-])c(C(=O)Nc2ccc(Oc3ncc(Cl)cc3Cl)cc2)cc1OC 500327030 DTVOIIOLIJPLRC-UHFFFAOYSA-N 478.288 5.749 5 20 JKBD O=C(Nc1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2NCc2ccccc2)cc1)c1cccs1 501766009 BUYHBUJHDAODQU-UHFFFAOYSA-N 472.526 5.773 5 20 JKBD CN(C(=O)c1ccc(NC(=O)NCCc2ccc([N+](=O)[O-])cc2)cc1Cl)C1CCCCC1 506280171 MTNLLFGTSQUYMS-UHFFFAOYSA-N 458.946 5.017 5 20 JKBD O=C(C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)Nc1ccc(-c2csnn2)cc1 512091167 YHMVDKBCFUGIFI-QGOAFFKASA-N 499.577 6.292 5 20 JKBD CCOc1cc(C(=O)N[C@H](C)c2sc(-c3ccc(F)cc3)nc2C)c([N+](=O)[O-])cc1OC 519131418 MTEUHVLJZLBUHZ-GFCCVEGCSA-N 459.499 5.064 5 20 JKBD CC[C@H](C)NC(=O)c1ccc(NC(=O)c2ccc(NCc3ccccc3)c([N+](=O)[O-])c2)c(C)c1 519977764 SRVICJNGQQEHFI-SFHVURJKSA-N 460.534 5.296 5 20 JKBD CCc1nc(CN(C)C(=O)C/C(=C/c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)cs1 520471401 HXRCULSZJMOODD-ATVHPVEESA-N 478.599 5.813 5 20 JKBD O=C(Nc1cccc(NC(=O)c2cc3c(cc2[N+](=O)[O-])OCO3)c1)Nc1cccc2c1CCCC2 520915076 DEHSIJKEJZYUPX-UHFFFAOYSA-N 474.473 5.099 5 20 JKBD CC[C@H](C)C(=O)Nc1cccc(CNCc2ccc(-c3ccc([N+](=O)[O-])cc3Br)o2)c1 520949790 QTGFQKOAZQDAJI-HNNXBMFYSA-N 486.366 5.892 5 20 JKBD Cc1ccc(C(=O)Nc2cccc(C(F)(F)F)c2)cc1NC(=O)Cc1ccc([N+](=O)[O-])cc1 521294838 ULVDVPHTOGUERR-UHFFFAOYSA-N 457.408 5.356 5 20 JKBD COc1cc(C(=O)NCc2cc3ccccc3[nH]2)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 554246650 KRXBGRCHLQYNTL-UHFFFAOYSA-N 451.866 5.460 5 20 JKBD COc1ccc(C(=O)Nc2cc(C)nn2-c2cc(C(F)(F)F)ccc2Cl)cc1[N+](=O)[O-] 585732187 WNWPBSNDYZRIOC-UHFFFAOYSA-N 454.792 5.022 5 20 JKBD CC[C@H](C)c1ccc(N(Cc2nnc(-c3ccccc3)o2)S(=O)(=O)c2cccc([N+](=O)[O-])c2)cc1 596923435 SRPFDRJVKLOOPF-SFHVURJKSA-N 492.557 5.554 5 20 JKBD COc1cc(C(=O)Nc2ccc(Cl)c(C(=O)O)c2)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 603568851 OLSPAPLXWJWLNU-UHFFFAOYSA-N 477.256 5.653 5 20 JKBD Cc1ccc(Cn2c(SCc3nc(-c4ccc([N+](=O)[O-])cc4)no3)nc3ccccc3c2=O)cc1 603748261 JRBNXFOJIAYBOZ-UHFFFAOYSA-N 485.525 5.004 5 20 JKBD CN(C(=O)c1ccc(NS(=O)(=O)c2ccc([N+](=O)[O-])cc2Cl)cc1Cl)C1CCCCC1 603982167 FONCUMVLFIWYMR-UHFFFAOYSA-N 486.377 5.107 5 20 JKBD O=C(C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)Nc1cnn(C[C@H]2CCCO2)c1 604243797 HVBUIBKNILOQQV-SARUNTBLSA-N 489.557 5.149 5 20 JKBD CC(C)(C)Oc1ccc(CNC(=O)C2CCN(c3ccc(C(F)(F)F)cc3[N+](=O)[O-])CC2)cc1 604436617 APEIMEWQBGMCJT-UHFFFAOYSA-N 479.499 5.324 5 20 JKBD O=C(C1CCN(c2ccccc2[N+](=O)[O-])CC1)N(Cc1ccccc1F)c1ccc(F)cc1 609230546 KSISRQJVSPRKGW-UHFFFAOYSA-N 451.473 5.323 5 20 JKBD CCOc1ccc(NC(=O)c2cc3ccccc3c3cccnc23)cc1S(=O)(=O)N(CC)CC 642518117 LZGXYJCDHZTGFC-UHFFFAOYSA-N 477.586 5.070 5 20 JKBD O=[N+]([O-])c1ccc(/C(O)=C(/C(=S)Nc2ccccc2-c2ccccc2)[n+]2ccccc2)cc1 725762258 IJBMNXXYLBZGPX-UHFFFAOYSA-O 454.531 5.873 5 20 JKBD Cc1cc(C(=O)N2CCC[C@@H]2C(=O)OCc2csc(-c3ccc(Cl)cc3)n2)ccc1[N+](=O)[O-] 726675061 PCARMDPJKQHIGT-HXUWFJFHSA-N 485.949 5.028 5 20 JKBD O=C(CCc1ncc(-c2ccccc2Br)o1)Nc1ccc([N+](=O)[O-])c(Cl)c1 727711643 OFGIMJUTGUSSGU-UHFFFAOYSA-N 450.676 5.237 5 20 JKBD COc1ccc([C@@H](NC(=O)c2cc([N+](=O)[O-])ccc2F)c2ccccc2)cc1Br 728497848 FDKNKIIJYLHAHC-FQEVSTJZSA-N 459.271 5.024 5 20 JKBD Cc1ccc(N(C(=O)c2ccc(OS(=O)(=O)c3cccc([N+](=O)[O-])c3)cc2)C2CCCCC2)nc1 730983393 IZHYXSBGUUGZQN-UHFFFAOYSA-N 495.557 5.045 5 20 JKBD Cc1c(C(=O)N(Cc2ccccn2)c2ccc(Br)cc2)cc([N+](=O)[O-])c(C)c1[N+](=O)[O-] 748625657 YMTLXFCQNJKTOA-UHFFFAOYSA-N 485.294 5.124 5 20 JKBD C[C@@H](Sc1nc2ccc([N+](=O)[O-])cc2s1)c1nc(O)c2c(-c3ccccc3)csc2n1 788009340 MTXQKNIZZXHKIP-LLVKDONJSA-N 466.569 6.435 5 20 JKBD CC1=C(C(=O)Nc2ccccc2C)[C@H](c2ccc([N+](=O)[O-])cc2)NC(=S)N1c1cccc(C)c1 916168282 JWPROACLWZEHOD-DEOSSOPVSA-N 472.570 5.560 5 20 JKBD C[C@@H](Nc1ccc(C(=O)Nc2nnc(C3CCCCC3)s2)cc1[N+](=O)[O-])c1ccccn1 919745009 UDWSQRAUMVQBEA-CQSZACIVSA-N 452.540 5.314 5 20 JKBD CC(=O)Nc1cc(NC(=O)c2ccc(NCc3ccccc3Cl)c([N+](=O)[O-])c2)c(F)cc1F 921156750 WFEWTXHQFPWQJW-UHFFFAOYSA-N 474.851 5.349 5 20 JKBD Cc1ncccc1C(=O)NC1(c2ccc(NC(=O)C3(c4cccc([N+](=O)[O-])c4)CCC3)cc2)CCC1 1790475990 QPKBCFQMQOFQGB-UHFFFAOYSA-N 484.556 5.168 5 20 JKBD O=C(/C=C/c1ccccc1[N+](=O)[O-])N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(Cl)c(Cl)cc1F 1803876855 FTGHIZPIUUYVFK-PYNLGSQFSA-N 492.334 5.006 5 20 JKBD Cc1cc(CCCC(=O)N2CCCC[C@@H]2c2cc(NC(=O)[C@@H]3CC=CCC3)n[nH]2)c([N+](=O)[O-])cc1F 1814788600 IECPUYXRLWMKHP-XMSQKQJNSA-N 497.571 5.137 5 20 JKBD O=C(CC1CCCC1)Nc1cc([C@H]2CCCCN2C(=O)C2(c3cccc([N+](=O)[O-])c3)CCC2)[nH]n1 1816688758 BCDFZTREXKHAMP-JOCHJYFZSA-N 479.581 5.012 5 20 JKBD O=C(Nc1cc([C@H]2CCCCN2C(=O)c2cccc3ccccc23)[nH]n1)c1cccc(F)c1[N+](=O)[O-] 1821169484 IRBONUBIBYAYHH-JOCHJYFZSA-N 487.491 5.230 5 20 JKBD C/C(=C\c1ccc(C)o1)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2c(F)ccc([N+](=O)[O-])c2C)n[nH]1 1821286825 IDGBMXZHSCZHMX-ZISLFAKRSA-N 495.511 5.076 5 20 JKBD Cc1oc(C(C)(C)C)cc1C(=O)N1CCCC[C@H]1C1CCN(C(=O)Cc2cccc([N+](=O)[O-])c2)CC1 1825946765 CJYXMFXFFJZDCA-DEOSSOPVSA-N 495.620 5.270 5 20 JKBD COc1cc(C)c(NC(=O)C/C(=C/c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)cc1OC 14712890 HYQHVTVLHXYKCL-AQTBWJFISA-N 489.553 6.100 5 20 JKBD O=C(COC(=O)c1ccc(Oc2ccc(C(F)(F)F)cn2)cc1)Nc1ccc([N+](=O)[O-])cc1Cl 16168972 FXQGQLHNPLIPET-UHFFFAOYSA-N 495.797 5.250 5 20 JKBD c1csc(-c2nnc(SCc3nc4ccccc4c4ccccc34)n2C[C@H]2CCCO2)c1 20052983 FUYSLEYBYYOXCF-QGZVFWFLSA-N 458.612 6.179 5 20 JKBD Cc1c(NC(=O)[C@@H](C)Sc2nc3scc(-c4cccs4)c3c(=O)n2C)cccc1[N+](=O)[O-] 23538401 AAJVORQAKYHCIG-GFCCVEGCSA-N 486.600 5.059 5 20 JKBD Cc1cc([N+](=O)[O-])ccc1NC(=O)CCSc1nnc(Cc2cccs2)n1-c1ccccc1 26411967 KTYZRNYKHWHLFL-UHFFFAOYSA-N 479.587 5.257 5 20 JKBD C[C@@H](Nc1ccc(C(=O)N2CCC(Cc3cccc(F)c3)CC2)cc1[N+](=O)[O-])c1ccccn1 108828932 BGYOGYYKVNYQPQ-GOSISDBHSA-N 462.525 5.397 5 20 JKBD COc1ccc([C@@H](C)NC(=O)c2ccc(N[C@H](C)c3ccccn3)c([N+](=O)[O-])c2)cc1Br 115704255 LFAMHBYASUZBPR-HUUCEWRRSA-N 499.365 5.425 5 20 JKBD Cc1ccc(-c2csc(NC(=O)c3ccc(F)cc3I)n2)cc1[N+](=O)[O-] 302953434 ONHJPECIBZOQHB-UHFFFAOYSA-N 483.262 5.023 5 20 JKBD COc1ccc(Oc2ccc([N+](=O)[O-])cc2C(=O)NC[C@H]2CCCO[C@@H]2c2ccccc2)cc1 409581262 KBUNMIWVKZGDAQ-KBMIEXCESA-N 462.502 5.293 5 20 JKBD CCN(C(=O)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])c(OC)c1)c1cccc(OC)c1 477487938 VQACCHWWZCFCMK-UHFFFAOYSA-N 456.882 5.724 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)Nc2cc(C(C)(C)C)nn2-c2cccc(Cl)c2)cc1SC 482816263 YZSOHUKESUFKHH-UHFFFAOYSA-N 474.970 5.714 5 20 JKBD COc1ccc(Oc2ccc([N+](=O)[O-])cc2C(=O)Nc2cccc(C(=O)NC(C)(C)C)c2)cc1 502169628 JUYFZFPGGVXGQJ-UHFFFAOYSA-N 463.490 5.176 5 20 JKBD C[C@H](Cc1ccc(Cl)cc1Cl)NC(=O)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-] 504913165 BXEDQGJEXAIFOO-SNVBAGLBSA-N 451.228 5.204 5 20 JKBD CCOc1cc(CNC2(c3ccccc3)CCC2)ccc1OCc1cc([N+](=O)[O-])cc2c1OCOC2 507941669 NQENLXPCIFGDDM-UHFFFAOYSA-N 490.556 5.608 5 20 JKBD O=C(NCCc1ccc([N+](=O)[O-])cc1)c1cccnc1SCc1ccc(Br)cc1 509310684 NNTZAZHYOSMXGC-UHFFFAOYSA-N 472.364 5.017 5 20 JKBD C[C@H](Nc1cccc(OCc2cccnc2)c1)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 515715974 ZFNTXTWFZBFRTM-AWEZNQCLSA-N 460.412 5.027 5 20 JKBD C[C@@H]1CCCCN1CCCNC(=O)C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1 518747920 QCSSLUATHFDFNR-OXMAITBSSA-N 478.618 5.516 5 20 JKBD Cc1ccccc1N(C(=O)[C@H](C)Oc1ccc(Cl)cc1[N+](=O)[O-])c1nc2ccccc2s1 520436694 VALOKTCWBQOOON-HNNXBMFYSA-N 467.934 6.299 5 20 JKBD CC(=O)NC1CCC(NC(=O)c2c3c(nc4ccccc24)/C(=C/c2ccc([N+](=O)[O-])cc2)CCC3)CC1 581263532 RTWMTXQSUNXQQS-LVZFUZTISA-N 498.583 5.197 5 20 JKBD COc1cccc(-c2nnc(SCc3nc(-c4ccc([N+](=O)[O-])cc4)no3)n2-c2ccccc2)c1 603680248 PLUALOZXZMKUTC-UHFFFAOYSA-N 486.513 5.193 5 20 JKBD Cc1c(NC(=O)c2cccc(NC(=O)c3ccc(Br)cc3)c2)cccc1[N+](=O)[O-] 603777943 PGRIXXIJVKIRRD-UHFFFAOYSA-N 454.280 5.170 5 20 JKBD COc1ccc(Oc2ccc([N+](=O)[O-])cc2C(=O)N2CCC(Oc3ccc(OC)cc3)CC2)cc1 603816715 WSAUXQJPCJLMAO-UHFFFAOYSA-N 478.501 5.088 5 20 JKBD COc1cc2c(cc1OC)[C@@H](c1ccccc1)N(C(=O)N[C@H](C)c1cccc([N+](=O)[O-])c1)CC2 604126753 VFHXVANGMNQOGZ-CRICUBBOSA-N 461.518 5.030 5 20 JKBD O=C(Nc1nc(-c2ccc(OC(F)F)cc2OC(F)F)cs1)c1ccc([N+](=O)[O-])cc1Cl 604511012 JUAHBJBKXNAXSF-UHFFFAOYSA-N 491.806 5.827 5 20 JKBD CC(=O)Nc1ccc(C)cc1NC(=O)C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1 609022657 MXTWJLJBDXPESJ-XMHGGMMESA-N 486.553 6.041 5 20 JKBD O=C(c1c2c(nc3ccccc13)/C(=C/c1cccc([N+](=O)[O-])c1)CCC2)N1CCC[C@H](n2ccnc2)C1 609131129 ICDZXWZNHYBJOT-HWYOBBEWSA-N 493.567 5.694 5 20 JKBD O=C1CCCN1c1cc(C(=O)N(CC2CC2)c2ccc(Cl)c([N+](=O)[O-])c2)cc(C(F)(F)F)c1 728237360 CKDDBYUVGAYAON-UHFFFAOYSA-N 481.858 5.451 5 20 JKBD CCOC(=O)c1c(-c2ccc(C)s2)csc1NC(=O)c1cc(SC)c(OC)cc1[N+](=O)[O-] 728462950 VMEBQLXKHXIQAM-UHFFFAOYSA-N 492.600 5.853 5 20 JKBD CC(C)N(Cc1nnc(-c2cccc([N+](=O)[O-])c2)o1)C(=O)[C@H]1C[C@@H]1c1ccc2ccccc2c1 731163854 BLOMCWVCTVKNJF-PKTZIBPZSA-N 456.502 5.339 5 20 JKBD COc1cc(CNCc2c3ccccc3c(Cl)c3ccccc23)ccc1OCC(=O)N(C)C 744267300 FMUIQJMALCWBCC-UHFFFAOYSA-N 462.977 5.412 5 20 JKBD Cc1ccc(-c2ncc(C(=O)O[C@H](C)C(=O)Nc3ccc([N+](=O)[O-])cc3C(F)(F)F)s2)c(C)c1 747264300 PIANBZBHYPSJTE-CYBMUJFWSA-N 493.463 5.538 5 20 JKBD CCOc1cc(/C=C(\C(=O)OCC(=O)Nc2cc([N+](=O)[O-])ccc2Cl)c2ccccc2)ccc1O 786214972 YYJHKJGRQDDIIC-UNOMPAQXSA-N 496.903 5.075 5 20 JKBD CC(C)N(Cc1nnc(-c2cccc([N+](=O)[O-])c2)o1)C(=O)c1ccc(COc2ccc(F)cc2)o1 864244709 KDEAAZWIHVDRKG-UHFFFAOYSA-N 480.452 5.007 5 20 JKBD Cc1sc(NC(=O)c2cc3c(cc2[N+](=O)[O-])OCO3)c(C(=O)OC(C)C)c1-c1ccccc1 913193285 HCSMNRIEAXHZPF-UHFFFAOYSA-N 468.487 5.178 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Br)[C@H](Nc1ccc2c(c1)OCCCO2)c1ccccc1 915871320 XWYQXQCLNHCTAM-JOCHJYFZSA-N 498.333 5.311 5 20 JKBD COCCN(C(=O)c1ccc(C(C)(C)C)c([N+](=O)[O-])c1)c1nc(-c2ccc([N+](=O)[O-])cc2)cs1 916958358 MNNZTTDJJYZNPJ-UHFFFAOYSA-N 484.534 5.217 5 20 JKBD C[C@H](c1ccccc1)n1c(SCC(=O)Nc2cc([N+](=O)[O-])ccc2Cl)nnc1-c1ccccc1 917254432 PXKMWIWXPUOXAC-MRXNPFEDSA-N 493.976 5.847 5 20 JKBD O=C(Nc1cccc(C(=O)Nc2cc([N+](=O)[O-])ccc2F)c1)c1ccc(Br)cc1 917611644 NCVLQMOPGFPUIH-UHFFFAOYSA-N 458.243 5.001 5 20 JKBD O=C(C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)NCc1ccc(Cl)nc1 917724683 JYEZNJJTZPYPND-BOPFTXTBSA-N 464.934 5.500 5 20 JKBD Cc1nc(-c2ccc(NC(=O)c3ccccc3NC(=O)c3ccc([N+](=O)[O-])cc3Cl)cc2)co1 918013951 IFDWAQGERNSRNM-UHFFFAOYSA-N 476.876 5.716 5 20 JKBD COc1ccccc1-c1nc(COC(=O)c2ccc(N[C@@H](C)c3ccccn3)c([N+](=O)[O-])c2)cs1 920549230 WWPJRZPHSHKUQD-INIZCTEOSA-N 490.541 5.652 5 20 JKBD COc1ccc2oc(C(=O)NC3(c4ccc(NC(=O)c5ccc([N+](=O)[O-])o5)cc4)CCC3)cc2c1 1785750300 CELCKIGSLIWRQS-UHFFFAOYSA-N 475.457 5.004 5 20 JKBD O=C(Cc1ccc(Cl)cc1[N+](=O)[O-])Nc1ccc(C2(NC(=O)[C@@H]3CCC(F)(F)C3)CCC2)cc1 1786114942 PVGAADBFVQMTFA-MRXNPFEDSA-N 491.922 5.360 5 20 JKBD CC(F)(F)C(C)(C)C(=O)Nc1ccc(C2(NC(=O)c3cc(F)cc([N+](=O)[O-])c3)CCC2)cc1 1786454976 SDDHSUXSRSPZAA-UHFFFAOYSA-N 463.456 5.163 5 20 JKBD Cc1cccc(CCC(=O)Nc2ccc(C3(NC(=O)/C=C/c4ccccc4[N+](=O)[O-])CCC3)cc2)n1 1786737232 GSKZCSSSYQMWEO-MHWRWJLKSA-N 484.556 5.078 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)c3cc(-c4ccco4)no3)CCC2)cc1)c1cc(F)cc([N+](=O)[O-])c1 1790696628 PKMUYMCFHSXUJR-UHFFFAOYSA-N 490.447 5.043 5 20 JKBD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2cc3c(Cl)cccc3s2)[nH]n1)c1ccc([N+](=O)[O-])o1 1814309536 NAKAGXHZBPXQEX-HNNXBMFYSA-N 499.936 5.399 5 20 JKBD CC(C)[C@H]1CC[C@H](C(=O)Nc2cc([C@@H]3CCCCN3C(=O)c3cccc(F)c3[N+](=O)[O-])[nH]n2)CC1 1822104178 KMRAUOUHPRLZDP-FIKGOQFSSA-N 485.560 5.225 5 20 JKBD O=C(/C=C/c1ccccc1[N+](=O)[O-])N1CCC([C@H]2CCCCN2C(=O)c2ccc(Cl)s2)CC1 1825856307 AWCLMAMDZIZYMR-UFUQCMIWSA-N 488.009 5.256 5 20 JKBD O=C(c1ccc([N+](=O)[O-])o1)N1CC2(CCCN2C(=O)c2ccccc2Oc2cccc3ccccc23)C1 1845546495 QJUCWMSXSNXZAC-UHFFFAOYSA-N 497.507 5.264 5 20 JKBD COc1cc(C(=O)N2CCC(C(=O)c3ccccc3)CC2)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 9987397 UJPPPWUJWPVBMH-UHFFFAOYSA-N 494.931 5.784 5 20 JKBD O=C1/C(=C/c2ccc(-c3ccc([N+](=O)[O-])cc3Br)o2)NC(=S)N1c1ccccc1F 15256651 UTQXXJQHFMQOEY-YBEGLDIGSA-N 488.294 5.019 5 20 JKBD Cc1ccc([N+](=O)[O-])cc1NC(=O)CSc1nnc(-c2ccc(F)cc2)n1-c1ccc(F)cc1 15410473 NVUMJWMXKJEEIX-UHFFFAOYSA-N 481.484 5.160 5 20 JKBD C[C@H](Sc1nn(-c2ccc(Cl)cc2)c(=S)s1)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl 20852177 ZVBBKWJGIPLCII-VIFPVBQESA-N 487.415 5.998 5 20 JKBD Cc1cc(C)cc(-n2ccnc2SCC(=O)Nc2ccc([N+](=O)[O-])cc2C(F)(F)F)c1 23052403 LRJZMGCJOIREMF-UHFFFAOYSA-N 450.442 5.147 5 20 JKBD CCOc1ccccc1Nc1nn(CN(C)Cc2cc([N+](=O)[O-])ccc2Cl)c(=S)s1 27532905 OKQRGNGPLXQCET-UHFFFAOYSA-N 465.988 5.467 5 20 JKBD COc1ccccc1Oc1ccc(NC(=O)c2cc(OC)c(OC(F)F)cc2[N+](=O)[O-])cc1 29790674 DEPZXKDPZLLIBT-UHFFFAOYSA-N 460.389 5.258 5 20 JKBD COc1c(C)ccc(NC(=O)c2ccccc2C(=O)c2ccc(SC)c([N+](=O)[O-])c2)c1C 482443547 DKXZKSOBDNYNCX-UHFFFAOYSA-N 450.516 5.425 5 20 JKBD COc1cc(C(=O)Nc2ccc([N+](=O)[O-])cc2C(=O)c2ccccc2)ccc1OCc1cscn1 498426048 OIJNADOUPMFZDC-UHFFFAOYSA-N 489.509 5.122 5 20 JKBD O=C(c1cccc(Cl)c1Cl)N1CCN(C(=O)c2cc3ccccc3c3cccnc23)CC1 500336809 XOEUYLPYWSTTMX-UHFFFAOYSA-N 464.352 5.293 5 20 JKBD CCOc1ccc([C@H]2CCCN2C(=O)c2ccc(N[C@@H](C)c3ccccn3)c([N+](=O)[O-])c2)cc1 506071227 PIWNNMNSCCAMFO-MHECFPHRSA-N 460.534 5.539 5 20 JKBD Cc1nc(-c2ccc([C@H](C)NC(=O)c3ccc(N[C@@H](C)c4ccccn4)c([N+](=O)[O-])c3)cc2)cs1 506163486 KJBNUAPVNMBSIN-IRXDYDNUSA-N 487.585 6.086 5 20 JKBD C[C@H](Nc1ccc(C(=O)Nc2nc(-c3cc(F)ccc3F)cs2)cc1[N+](=O)[O-])c1ccccn1 506233809 OLBFOCOLJVMYEP-ZDUSSCGKSA-N 481.484 5.817 5 20 JKBD C[C@@H](NC(=O)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1)c1cccc(OC(F)F)c1 515127608 DSNCQPFEDFFMOZ-CYBMUJFWSA-N 487.425 5.309 5 20 JKBD O=[N+]([O-])c1ccc(-c2ccc(CN[C@@H](CC(F)(F)F)c3ccccc3)o2)c(Br)c1 517534192 NJDAHKFDKIFWDL-SFHVURJKSA-N 469.257 6.401 5 20 JKBD CN(Cc1cscn1)C(=O)c1ccccc1Sc1ccc(C(F)(F)F)cc1[N+](=O)[O-] 517869195 WIVRDQOLPDJLKE-UHFFFAOYSA-N 453.467 5.494 5 20 JKBD Cc1[nH]c2ccc(CNC(=O)C3CCN(c4ccc(C(F)(F)F)cc4[N+](=O)[O-])CC3)cc2c1C 519942497 FDHYYJPSFLQBEC-UHFFFAOYSA-N 474.483 5.245 5 20 JKBD O=C(Nc1cc(-c2nnc3n2CCCCC3)ccc1F)c1csc(-c2ccc([N+](=O)[O-])cc2)n1 523301340 LIUYPMKUKIBPLC-UHFFFAOYSA-N 478.509 5.095 5 20 JKBD O=C(NCCc1csc2ccccc12)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 603928464 PDKDBPRRRKKQHZ-UHFFFAOYSA-N 477.508 5.404 5 20 JKBD Cc1ccc([C@H](OC[C@@H](O)Cn2cnc3cc4ccccc4cc3c2=O)c2ccccc2)cc1 636934040 DVNVHCMOYIKHDZ-LBNVMWSVSA-N 450.538 5.025 5 20 JKBD CC(C)c1ncc(Cl)c(C(=O)Oc2ccc(NC(=O)c3cc([N+](=O)[O-])ccc3Cl)cc2)n1 743606936 AAYVVCSFHZBUQZ-UHFFFAOYSA-N 475.288 5.287 5 20 JKBD C[C@@H](OC(=O)c1ccc(-c2ccc3c(c2)OCCO3)s1)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 746165944 OKOLJSJDJNNLMB-CYBMUJFWSA-N 479.470 5.063 5 20 JKBD CCNc1ccc(C(=O)OCc2csc(N(C(C)=O)c3ccccc3CC)n2)cc1[N+](=O)[O-] 795846315 JZHIGPMJGDMPDB-UHFFFAOYSA-N 468.535 5.087 5 20 JKBD O=C1CC[C@H](c2noc(-c3ccc(Oc4ccc(Cl)cc4[N+](=O)[O-])cc3)n2)CN1CC1CCC1 856565784 MILGPKJTULZEPE-KRWDZBQOSA-N 482.924 5.597 5 20 JKBD Cc1cc(CCCC(=O)Nc2ccc(C3(NC(=O)c4conc4C)CCC3)cc2)c([N+](=O)[O-])cc1F 1786274957 SBSTXZARGBBIGI-UHFFFAOYSA-N 494.523 5.109 5 20 JKBD Cc1ccc(C(=O)Nc2ccc(C3(NC(=O)c4cc(Cl)cc([N+](=O)[O-])c4C)CCC3)cc2)cn1 1787303287 UWBBGIXQSKKQPS-UHFFFAOYSA-N 478.936 5.322 5 20 JKBD CN(C)c1ccc([N+](=O)[O-])c(C(=O)NC2(c3ccc(NC(=O)c4cc5ccccc5o4)cc3)CCC2)c1 1789004711 SSKFIBQPTTZLRA-UHFFFAOYSA-N 498.539 5.469 5 20 JKBD Cc1ccc2cc(C(=O)Nc3ccc(C4(NC(=O)c5cc(O)cc([N+](=O)[O-])c5)CCC4)cc3)ccc2n1 1789034258 BGDVBSTYCLNWCS-UHFFFAOYSA-N 496.523 5.219 5 20 JKBD Cc1ccc(CC(=O)Nc2ccc(C3(NC(=O)c4cc(C(C)C)on4)CCC3)cc2)cc1[N+](=O)[O-] 1790526004 HTKVJHPILGJTQU-UHFFFAOYSA-N 476.533 5.005 5 20 JKBD COc1c(Cl)cccc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cc3cc([N+](=O)[O-])ccc3s1)C2 1803760116 MXUYBYHJLFVZMA-MUJYYYPQSA-N 499.976 5.037 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)N1CCC2(CCCN(C(=O)[C@@H](C)Sc3ccccc3)C2)CC1 1805858428 PFGCROODRVHAKK-LJQANCHMSA-N 499.608 5.068 5 20 JKBD CC(C)(C)CCCCCC(=O)NC[C@H]1CCN(C(=O)Cc2cccc([N+](=O)[O-])c2)[C@@H]1c1cccnc1 1812804687 SEAZHXIRIAUQCR-YIXXDRMTSA-N 494.636 5.235 5 20 JKBD CC[C@H](C)CC(=O)N1CCCC[C@H]1C1CCN(C(=O)c2ccc(Br)c([N+](=O)[O-])c2)CC1 1824346062 ADRUSEMGFSFEGS-JXFKEZNVSA-N 494.430 5.027 5 20 JKBD Cc1ccc(C(=O)N2CCCC[C@H]2C2CCN(C(=O)Cc3ccc(Cl)cc3[N+](=O)[O-])CC2)cc1 1830058912 WTARIBNUUZXLNW-QHCPKHFHSA-N 483.996 5.033 5 20 JKBD Cc1cc(C(=O)N2CCC([C@H]3CCCCN3C(=O)c3cc4cc([N+](=O)[O-])ccc4s3)CC2)ccn1 1831061137 NEUDIZCOSXYJDO-JOCHJYFZSA-N 492.601 5.060 5 20 JKBD CCCn1c(S[C@H](C)C(=O)Nc2cc([N+](=O)[O-])ccc2Cl)nc2cc(Cl)ccc2c1=O 3370515 GJLKROBEFKPMAH-LLVKDONJSA-N 481.361 5.141 5 20 JKBD CC(C)c1ccc(-c2nc(CC(=O)OCC(=O)Nc3cc([N+](=O)[O-])ccc3Cl)cs2)cc1 9555155 NQTBLPFUZZDSRJ-UHFFFAOYSA-N 473.938 5.220 5 20 JKBD CSc1ccc(C(=O)OCc2csc(N(C(C)=O)c3ccc(C)c(C)c3)n2)cc1[N+](=O)[O-] 9620388 HWEYIEBSNWIAAM-UHFFFAOYSA-N 471.560 5.432 5 20 JKBD C[C@@H](Sc1nnc(-c2ccco2)n1C1CCCCC1)C(=O)Nc1ccc(F)c([N+](=O)[O-])c1 10015126 HYFVBQQVCUFLSN-CYBMUJFWSA-N 459.503 5.210 5 20 JKBD O=C(COc1ccc([N+](=O)[O-])cc1Cc1ccccc1)Nc1cc2c(cc1Cl)OCCCO2 11273815 OHSLNGRXDBUTIG-UHFFFAOYSA-N 468.893 5.018 5 20 JKBD O=[N+]([O-])c1cc(S(=O)(=O)N(Cc2ncc(-c3ccc(F)cc3)o2)c2ccccc2)ccc1Cl 15551563 GFQHKHXPTDSVPF-UHFFFAOYSA-N 487.896 5.438 5 20 JKBD CCn1c(S[C@@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2C(F)(F)F)nnc1-c1ccccc1OC 21957474 GMLFXMRZTQREJX-LBPRGKRZSA-N 495.483 5.020 5 20 JKBD COc1ccc(-c2nnc(SCC(=O)N3CCc4ccc([N+](=O)[O-])cc43)n2C2CCCCC2)cc1 23417697 UXQHYZWGAJPUNY-UHFFFAOYSA-N 493.589 5.049 5 20 JKBD O=C(/C=C/c1cc(C(F)(F)F)ccc1Cl)OCc1nnc(-c2ccc([N+](=O)[O-])cc2)o1 25204614 YHXAWRJJBQBONW-FPYGCLRLSA-N 453.760 5.074 5 20 JKBD O=C(CCCn1c(=O)oc2cc([N+](=O)[O-])ccc21)N[C@H](Cc1ccc(Cl)cc1)c1ccccc1 68740245 YXUZLEMDKDRSOW-OAQYLSRUSA-N 479.920 5.037 5 20 JKBD COc1cc(C(=O)Nc2nc(-c3ccc(C)c([N+](=O)[O-])c3)cs2)cc(OC)c1Br 69492441 PQPKDXFJMXLHFO-UHFFFAOYSA-N 478.324 5.059 5 20 JKBD C[C@H](Nc1ccc(C(=O)N(Cc2ccc([C@H]3C[C@@H]3C)o2)C2CC2)cc1[N+](=O)[O-])c1ccccn1 506217652 KUVIDYOJANHQFU-FIKGOQFSSA-N 460.534 5.684 5 20 JKBD CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)NCC1(c2ccc(Br)cc2)CCOCC1 509704949 SDIMIUDXLFECGT-UHFFFAOYSA-N 490.398 5.026 5 20 JKBD CSc1ccc(C(=O)c2ccccc2C(=O)Nc2ccc(C(=O)N(C)C)c(Cl)c2)cc1[N+](=O)[O-] 510144752 PFQRSLBEIQSEBF-UHFFFAOYSA-N 497.960 5.155 5 20 JKBD Cc1ccnc(NC(=O)c2c3c(nc4ccccc24)/C(=C/c2cccc([N+](=O)[O-])c2)CCC3)n1 514981835 HTBVLTSWGRTSKC-NBVRZTHBSA-N 451.486 5.371 5 20 JKBD CCOc1cc(C(=O)Nc2cc(C(C)(C)C)nn2-c2ccc(C)cc2)c([N+](=O)[O-])cc1OC 515096704 URRCCCLRIRADEJ-UHFFFAOYSA-N 452.511 5.046 5 20 JKBD COc1cc(C(=O)N[C@@H](C)c2ccc3c(c2)CC(=O)N3)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 517398181 TVSUKAYLHPRGEK-ZDUSSCGKSA-N 481.892 5.035 5 20 JKBD CC(=O)Nc1ccc(C(F)(F)F)cc1NC(=O)c1ccc(N2C[C@H](C)C[C@@H](C)C2)c([N+](=O)[O-])c1 521239567 WRSOBBUEAHUQSF-ZIAGYGMSSA-N 478.471 5.307 5 20 JKBD O=C(Nc1ccc(-c2cc(O)n[nH]2)cc1)c1ccc(NCc2ccccc2Cl)c([N+](=O)[O-])c1 603879200 CXVVZIDXHFJEKU-UHFFFAOYSA-N 463.881 5.208 5 20 JKBD C[C@@H](Nc1ccc([N+](=O)[O-])c(C(=O)N2CCCC2)c1)c1ccc(NC(=O)c2ccc(F)cc2)cc1 603942604 PGPXZRXXWQJAHQ-QGZVFWFLSA-N 476.508 5.395 5 20 JKBD COc1ccc(CSCC(=O)Nc2ccc(C)cc2OCc2ccccc2)cc1[N+](=O)[O-] 603997417 ITPSDVXVWONNGF-UHFFFAOYSA-N 452.532 5.363 5 20 JKBD C[C@@H](Nc1ccc(C(=O)Nc2nnc(-c3cccc(Cl)c3)s2)cc1[N+](=O)[O-])c1ccccn1 609021151 DNHVMTHYWJZORU-CYBMUJFWSA-N 480.937 5.587 5 20 JKBD CC(C)N(Cc1cc(Br)ccc1F)C(=O)Cn1c2ccccc2c(=O)c2ccccc21 642062600 RFXMZQIDIDBPRD-UHFFFAOYSA-N 481.365 5.494 5 20 JKBD Cc1csc(Sc2ccc(NC(=O)c3cc([N+](=O)[O-])ccc3Br)c(C)c2)n1 726757421 UQLDKQSNFRRDIR-UHFFFAOYSA-N 464.366 5.834 5 20 JKBD Cc1c([N+](=O)[O-])cc(C(=O)Nc2cc(C(F)(F)F)ccc2NC(=O)OC(C)(C)C)cc1[N+](=O)[O-] 727790448 IXWQYVJTQNVGRM-UHFFFAOYSA-N 484.387 5.430 5 20 JKBD O=C(c1csc(-c2cnn(-c3ccccc3)c2)n1)N(CC1CC1)c1ccc(Cl)c([N+](=O)[O-])c1 728165445 KFLYONAETJMNFA-UHFFFAOYSA-N 479.949 5.614 5 20 JKBD O=C(Nc1ccc(OC(=O)c2sccc2OC(F)F)cc1)c1cc([N+](=O)[O-])ccc1Cl 729304388 DLJOFYBPPWSJPB-UHFFFAOYSA-N 468.821 5.383 5 20 JKBD O=C(C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)OCC(=O)c1ccc(F)cc1F 748578974 CPXRJALWVPVCMY-WJDWOHSUSA-N 494.475 5.840 5 20 JKBD Cc1oc(-c2ccccc2)nc1CC(=O)Oc1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2Cl)cc1 818828639 VYTYJGIMJAHYET-UHFFFAOYSA-N 491.887 5.612 5 20 JKBD CS(=O)(=O)c1ccc(C(=O)Oc2ccc(-c3nc4ccccc4s3)cc2Cl)cc1[N+](=O)[O-] 858118950 KSKOXJBLYXLKGB-UHFFFAOYSA-N 488.930 5.148 5 20 JKBD CSc1ccc(C(=O)c2ccccc2C(=O)OCc2nnc(-c3ccc(C)cc3)o2)cc1[N+](=O)[O-] 914884409 DOLNVUUHXFYNNY-UHFFFAOYSA-N 489.509 5.263 5 20 JKBD O=C(Oc1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2Cl)cc1)c1cc(-c2ccccc2)no1 915132887 PNTOTVHWVDISAB-UHFFFAOYSA-N 463.833 5.375 5 20 JKBD O=C(NC[C@H](c1ccccc1Cl)c1c[nH]c2ccccc12)C(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1 915719730 RBYPEWLWWBLETD-QGZVFWFLSA-N 497.338 5.270 5 20 JKBD Cc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)N[C@H](c1ccc(CC(C)C)cc1)c1cccs1 915740906 UICKFANUHBAODS-JOCHJYFZSA-N 451.548 5.008 5 20 JKBD CCCc1cc[n+](/C(C(=S)Nc2cccc(C(F)(F)F)c2)=C(/O)c2ccc([N+](=O)[O-])cc2)cc1 916202128 CQLPAZAFBLSWCN-UHFFFAOYSA-O 488.511 6.177 5 20 JKBD Cc1c([N+](=O)[O-])cc(C(=O)O[C@@H](C)C(=O)N2c3ccccc3Sc3ccccc32)cc1[N+](=O)[O-] 919228369 PHIMVUIUVBAWJY-AWEZNQCLSA-N 479.470 5.186 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)NC1(c2ccc(NC(=O)c3cccnc3Cl)cc2)CCC1 1785754021 LMEOVNOGNONMHK-UHFFFAOYSA-N 482.899 5.152 5 20 JKBD Cc1ccc(CC(=O)NC2(c3ccc(NC(=O)c4ccnc(C(F)F)c4)cc3)CCC2)cc1[N+](=O)[O-] 1787018862 WTDPFINDDIPXAJ-UHFFFAOYSA-N 494.498 5.226 5 20 JKBD Cc1ccc2oc(C(=O)Nc3ccc(C4(NC(=O)c5cccc(F)c5[N+](=O)[O-])CCC4)cc3)cc2n1 1788322898 VXEFEOZRIWAZFJ-UHFFFAOYSA-N 488.475 5.245 5 20 JKBD Cc1cccc2cc(C(=O)NC3(c4ccc(NC(=O)c5ccc(O)c([N+](=O)[O-])c5)cc4)CCC3)[nH]c12 1790619643 IQUZLXCSZSSYLE-UHFFFAOYSA-N 484.512 5.152 5 20 JKBD Cc1c(C(=O)Nc2ccc(C3(NC(=O)C4CCC(CO)CC4)CCC3)cc2)cc(Cl)cc1[N+](=O)[O-] 1790774746 XEWUQMSUQDKKCD-UHFFFAOYSA-N 499.995 5.103 5 20 JKBD Cc1ncc(CC(=O)NC2(c3ccc(NC(=O)c4cc(Cl)cc([N+](=O)[O-])c4C)cc3)CCC2)s1 1790774932 XDSXGHYHBCUGDF-UHFFFAOYSA-N 498.992 5.312 5 20 JKBD Cc1c(C(=O)N2CCC([C@@H]3CCCCN3C(=O)CC3CCCC3)CC2)cc(Cl)cc1[N+](=O)[O-] 1826264212 NMFFGEZIQDCFQO-QFIPXVFZSA-N 476.017 5.370 5 20 JKBD Cc1ccc(Nc2nnc(SCC(=O)Nc3ccc([N+](=O)[O-])cc3C(F)(F)F)s2)cc1C 10212382 LHSBALRFLLKFLO-UHFFFAOYSA-N 483.497 5.556 5 20 JKBD O=C(CSc1ccc(C(F)(F)F)cc1[N+](=O)[O-])Nc1ccc(-c2nnc3n2CCCCC3)cc1 15995751 SZUVYPZWGXERRT-UHFFFAOYSA-N 491.495 5.329 5 20 JKBD CCn1c(S[C@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)nnc1-c1cccc(Cl)c1 17725324 RBRHRJKEJUFENI-GFCCVEGCSA-N 456.915 5.430 5 20 JKBD Cc1cccc(-n2ccnc2SCC(=O)Nc2ccc([N+](=O)[O-])cc2C(F)(F)F)c1C 21609310 FJJOACYVVFAZCA-UHFFFAOYSA-N 450.442 5.147 5 20 JKBD O=C(CSc1nc2ccccc2c(=O)n1CCC1=CCCCC1)Nc1cc([N+](=O)[O-])ccc1F 21670668 KKBJBBITDLILIM-UHFFFAOYSA-N 482.537 5.065 5 20 JKBD CN(CC(=O)Nc1ccccc1Cl)C(=O)c1cc([N+](=O)[O-])ccc1Sc1ccccc1 24647575 URPYWJOQVZTJNA-UHFFFAOYSA-N 455.923 5.110 5 20 JKBD Cc1ccc(-c2csc3ncnc(SCC(=O)Nc4c(C)cccc4[N+](=O)[O-])c23)cc1 25032741 XRNKAZVENKLNJI-UHFFFAOYSA-N 450.545 5.614 5 20 JKBD NC(=O)c1cc(NC(=O)C/C(=C/c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)ccc1Cl 29341393 HPCNLHCKQOKFKE-PTNGSMBKSA-N 492.944 5.526 5 20 JKBD O=[N+]([O-])c1cccc(-c2noc(CSc3nnc(-c4ccco4)n3C3CCCCC3)n2)c1 31839849 KDKOZIJIPYHMSX-UHFFFAOYSA-N 452.496 5.294 5 20 JKBD C[C@H](Nc1ccc(C(=O)Nc2ccc(Oc3ccncc3)cc2)cc1[N+](=O)[O-])c1ccccn1 60265442 OUFRKJFYQTUXEB-KRWDZBQOSA-N 455.474 5.603 5 20 JKBD CCCN(C(=O)c1ccc(N[C@H](C)c2ccccn2)c([N+](=O)[O-])c1)[C@H](C)C(=O)Nc1ccccc1 109891220 AKUGTTUTOPEOCC-RTBURBONSA-N 475.549 5.042 5 20 JKBD C[C@@H](Nc1ccc(C(=O)NCCOc2cccc3ccccc23)cc1[N+](=O)[O-])c1ccccn1 410089172 RRNKWRGCKRGAFQ-GOSISDBHSA-N 456.502 5.125 5 20 JKBD Cc1ccc(NC(=O)Nc2ccccc2)cc1NC(=O)[C@H](C)Sc1ccc([N+](=O)[O-])cc1 480346516 INBGAMNXAPVWMR-INIZCTEOSA-N 450.520 5.667 5 20 JKBD Cc1ccc(C(=O)C2CCN(C(=O)c3ccc(Oc4ccc(Cl)cc4[N+](=O)[O-])cc3)CC2)cc1 490724469 VVBTVAZATGXACK-UHFFFAOYSA-N 478.932 6.084 5 20 JKBD C[C@H](Nc1ccc(C(=O)N2CCC(OC3CCCCC3)CC2)cc1[N+](=O)[O-])c1ccccn1 495682081 FPGTWSZPSCWQEA-SFHVURJKSA-N 452.555 5.117 5 20 JKBD CC(=O)N(c1ccc(C(F)(F)F)cc1)c1nc(COc2ccc([N+](=O)[O-])cc2F)cs1 505868959 SIMWDQFKDYAERV-UHFFFAOYSA-N 455.389 5.473 5 20 JKBD O=C(Nc1cc(Cl)ccc1Cl)[C@@H]1CCCCN1C(=O)c1cc2cccc([N+](=O)[O-])c2[nH]1 507347157 DVVGNDYBHXUCDG-SFHVURJKSA-N 461.305 5.016 5 20 JKBD CCCSc1ccc([N+](=O)[O-])cc1C(=O)Nc1nc(-c2ccc3c(c2)CCC(=O)N3)cs1 507759558 HLYCEUNVYCTFJY-UHFFFAOYSA-N 468.560 5.357 5 20 JKBD CSc1ccc(C(=O)N(Cc2ccccc2)[C@H](C)c2cccc(NC(C)=O)c2)cc1[N+](=O)[O-] 514904037 WJPMNLWLVMKFNA-QGZVFWFLSA-N 463.559 5.679 5 20 JKBD COc1ccc(CNC(=O)c2cc(-c3cc(C)sc3C)nc3c2cnn3C(C)C)cc1[N+](=O)[O-] 515728934 LYBYMUFFBFXEDL-UHFFFAOYSA-N 479.562 5.204 5 20 JKBD Cc1noc(C)c1CNC(=O)c1c2c(nc3ccccc13)/C(=C/c1cccc([N+](=O)[O-])c1)CCC2 516337881 XGSNHLKWWQUZQC-CPNJWEJPSA-N 468.513 5.555 5 20 JKBD O=C1CCCN1C[C@H](NCc1ccc(-c2cccc([N+](=O)[O-])c2)o1)c1cccc(C(F)(F)F)c1 517536567 RTOWVENBUBYYTB-NRFANRHFSA-N 473.451 5.327 5 20 JKBD O=C(Cc1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1)N1C[C@@H]2CCCN2c2ccccc21 518287463 HCVNNAYZGJGXQS-DEOSSOPVSA-N 479.540 5.006 5 20 JKBD CSc1ccc(C(=O)Nc2ccc(NC(=O)[C@H](C)n3nc(C)cc3C)c(Cl)c2)cc1[N+](=O)[O-] 520107994 GBJOTTWNSSAWFA-AWEZNQCLSA-N 487.969 5.235 5 20 JKBD CCOc1c(OC)cc(CNCc2ccc(-c3ccc([N+](=O)[O-])cc3Br)o2)cc1OC 520213277 SHGLUSGPVZINSK-UHFFFAOYSA-N 491.338 5.323 5 20 JKBD CC(C)N1CCC[C@H](CNC(=O)C/C(=C/c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)C1 521143242 RXQKWHQRWFAFKQ-PLDFPGSMSA-N 478.618 5.372 5 20 JKBD C[C@@H](NCc1ccc(-c2ccccc2[N+](=O)[O-])o1)c1ccc(NC(=O)c2ccc(F)cc2)cc1 549551251 UDHXOLHTUWOALS-QGZVFWFLSA-N 459.477 6.097 5 20 JKBD COc1c(C)ccc(NC(=O)c2ccc(C(=O)Nc3ccc(C)c(OC)c3C)c([N+](=O)[O-])c2)c1C 551126018 RFYKRGXNJNOFQZ-UHFFFAOYSA-N 477.517 5.350 5 20 JKBD CCCOc1c(Br)cc(C(=O)Nc2cc([N+](=O)[O-])ccc2OC(F)F)cc1OC 603639074 LYIRFMRTMVRHQC-UHFFFAOYSA-N 475.242 5.008 5 20 JKBD C[C@@H]1CCCN(c2ccc(C(=O)Nc3cccc(NC(=O)c4ccccc4)c3)cc2[N+](=O)[O-])C1 603913559 IPUQDKJHPPQBFI-GOSISDBHSA-N 458.518 5.336 5 20 JKBD O=C(NCC1(c2cccc(Br)c2)CCOCC1)c1cc2cc([N+](=O)[O-])ccc2s1 603937452 VSTLZJYYTHDIHD-UHFFFAOYSA-N 475.364 5.050 5 20 JKBD O=C(N[C@@H](c1ccccc1)c1ccc2nc(C(F)(F)F)[nH]c2c1)c1ccc([N+](=O)[O-])cc1F 603951698 YZQKBCRRJFWQBF-IBGZPJMESA-N 458.371 5.148 5 20 JKBD Cc1ccc(C(=O)N2C[C@@H](C)C[C@H](C)C2)cc1NC(=O)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-] 603977130 SFIAJSMOXMEBIT-GJZGRUSLSA-N 493.482 5.215 5 20 JKBD CCNC(=O)c1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2Sc2ccc(Cl)cc2)c(C)c1 603993285 LATCRALUNSUPMS-UHFFFAOYSA-N 469.950 5.710 5 20 JKBD C[C@H](NC(=O)[C@@H](C)Oc1ccc(Cl)cc1[N+](=O)[O-])c1cccc(NC(=O)Cc2ccccc2F)c1 604442239 BWHUFRSXIMGAES-JKSUJKDBSA-N 499.926 5.213 5 20 JKBD COCCOc1cc([N+](=O)[O-])c(C(=O)N2CCCC[C@H]2c2ccc(C(F)(F)F)cc2)cc1OC 608851453 VBGJMKIBKIHKAI-SFHVURJKSA-N 482.455 5.015 5 20 JKBD Cc1ccc(Sc2ccc(C(=O)N3CCC(NC(=O)c4cc(C)oc4C)CC3)cc2[N+](=O)[O-])cc1 608949658 YLARMBHPSVFNKU-UHFFFAOYSA-N 493.585 5.299 5 20 JKBD C[C@H](OC(=O)c1c[nH]c2cc([N+](=O)[O-])ccc12)C(=O)Nc1c(Cl)cc(Cl)cc1Cl 756764687 BCMPVRPGPZROAY-QMMMGPOBSA-N 456.669 5.220 5 20 JKBD Cc1cc(-c2cc(C(=O)OCC(=O)Nc3cccc([N+](=O)[O-])c3)c3cnn(C(C)C)c3n2)c(C)s1 836609790 SEZMCPPLRYLGAH-UHFFFAOYSA-N 493.545 5.061 5 20 JKBD CC(C)Cn1cc([C@@H]2N(Cc3ccc(-c4ccc([N+](=O)[O-])cc4Cl)o3)CC23CCOCC3)cn1 849479557 RQYCGKZBROAZLF-DEOSSOPVSA-N 484.984 5.714 5 20 JKBD O=C1CC[C@H](c2noc(-c3ccccc3Sc3ccccc3[N+](=O)[O-])n2)CN1CC1CCCC1 856573379 SZBBTNZKNWUNBE-SFHVURJKSA-N 478.574 5.692 5 20 JKBD COc1ccc(NC(=O)OC(C)(C)C)c(NC(=O)c2ccc(Cn3nc(C)c([N+](=O)[O-])c3C)cc2)c1 915874253 QXJGBKHZSJIZJI-UHFFFAOYSA-N 495.536 5.064 5 20 JKBD O=C(O[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1)c1cc(F)c(F)c(F)c1F 919220011 UFHBFJLCWXLXNN-IBGZPJMESA-N 482.773 5.341 5 20 JKBD CCOC(=O)c1c(NC(=O)c2cc(OC)ccc2[N+](=O)[O-])sc(C)c1-c1ccc(C)cc1 920277766 FTWKXRMGMDFVTR-UHFFFAOYSA-N 454.504 5.378 5 20 JKBD Cc1c(Cl)cc(NC(=O)c2cc([N+](=O)[O-])ccc2I)cc1Cl 921014358 RTGMLOPDSTYZAT-UHFFFAOYSA-N 451.047 5.067 5 20 JKBD O=C(Cc1ccc([N+](=O)[O-])cc1F)Nc1ccc(C2(NC(=O)c3ccnc4ccccc34)CCC2)cc1 1791184052 MZJWJBLKPGQWHW-UHFFFAOYSA-N 498.514 5.273 5 20 JKBD CC1(C)CC(C(=O)Nc2ccc(C3(NC(=O)Cn4ccc5ccc([N+](=O)[O-])cc54)CCC3)cc2)C1 1791647643 XREODORKWRELRR-UHFFFAOYSA-N 474.561 5.120 5 20 JKBD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CCc1cccc([N+](=O)[O-])c1)c1sc2ccccc2c1Cl 1793938905 CDJBAOHRNNGHIM-BCDXTJNWSA-N 498.004 5.348 5 20 JKBD CC1(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)C3(c4cccc([N+](=O)[O-])c4)CCC3)n[nH]2)CCCC1 1820841977 ZJTRKMJLQSEVGD-OAQYLSRUSA-N 479.581 5.012 5 20 JKBD CC[C@H](C(=O)N1CCC([C@H]2CCCCN2C(=O)/C=C/c2ccc([N+](=O)[O-])o2)CC1)c1ccccc1 1824274299 DVYBNZUIJLBQHO-KVKMCETFSA-N 479.577 5.015 5 20 JKBD CC[C@@H](C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cccc(F)c2[N+](=O)[O-])CC1)c1ccccc1 1826316433 GGEIKNFUDCLSAI-ZJSXRUAMSA-N 481.568 5.161 5 20 JKBD CC(C)(C)CC(=O)N1CCCC[C@@H]1C1CCN(C(=O)C2(c3cccc([N+](=O)[O-])c3)CCC2)CC1 1826334821 MALSGESUGBNXLP-HSZRJFAPSA-N 469.626 5.072 5 20 JKBD O=C(c1ccc(F)s1)N1CCC([C@H]2CCCCN2C(=O)C2(c3cccc([N+](=O)[O-])c3)CCC2)CC1 1830291220 IZBJZLJTQSOIHK-OAQYLSRUSA-N 499.608 5.151 5 20 JKBD O=C(Cc1ccccc1Cl)N1CCC([C@@H]2CCCCN2C(=O)/C=C/c2ccccc2[N+](=O)[O-])CC1 1832903293 YWRGMDITMZZRHL-BYUVYSIJSA-N 496.007 5.124 5 20 JKBD C[C@@H](Sc1nnc(-c2ccccc2Cl)n1C1CCCC1)C(=O)Nc1ccc([N+](=O)[O-])cc1 8988890 QNMROTZVSMDGTR-CQSZACIVSA-N 471.970 5.741 5 20 JKBD CCc1cccc(C)c1NC(=O)COC(=O)c1cc([N+](=O)[O-])ccc1Sc1ccccc1 9066664 LEUDSVLVPLHWGD-UHFFFAOYSA-N 450.516 5.412 5 20 JKBD COc1ccc(S(=O)(=O)Oc2cc3ccccc3cc2C(=O)Nc2ccccc2C)cc1[N+](=O)[O-] 15331365 GBBJBAQDWVAPKC-UHFFFAOYSA-N 492.509 5.085 5 20 JKBD Cc1csc(Sc2ccc(C(=O)O[C@@H](C)C(=O)Nc3ccccc3C)cc2[N+](=O)[O-])n1 23973453 JSGATSIDBZFELI-AWEZNQCLSA-N 457.533 5.003 5 20 JKBD COc1ccc([N+](=O)[O-])cc1CSc1nnc(-c2cccnc2)n1-c1ccc(Br)cc1 32570910 IMZIRIXFRSEPST-UHFFFAOYSA-N 498.362 5.301 5 20 JKBD Cc1ccc(-c2nc(C)c([C@H](C)NC(=O)[C@@H]3CCCN3C(=O)c3ccc([N+](=O)[O-])c(C)c3)s2)cc1 78661111 SCAIPHARFMOHGG-JTSKRJEESA-N 492.601 5.126 5 20 JKBD C[C@H](Nc1ccc(C(=O)NCc2ccccc2CN2CCCC[C@H]2C)cc1[N+](=O)[O-])c1ccccn1 108834267 KXSDHFHINYTUPS-RTWAWAEBSA-N 487.604 5.467 5 20 JKBD CC(C)[C@H](NC(=O)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1)c1nc(C2CC2)no1 110697938 SHGXLFGKFDCXJN-IBGZPJMESA-N 456.886 5.428 5 20 JKBD Cc1ccc([N+](=O)[O-])cc1NC(=O)COC(=O)c1c2c(nc3ccccc13)/C(=C\c1ccco1)CC2 206725956 LEJJLXPOGGCFAV-LGMDPLHJSA-N 483.480 5.327 5 20 JKBD CC1CCN(C(=O)c2ccccc2NC(=O)CSc2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 302985771 QSLPMPSTERUVPZ-UHFFFAOYSA-N 481.496 5.217 5 20 JKBD Cc1cc(C(=O)N2CCC(C)CC2)ccc1NC(=O)c1ccc(NCc2ccccc2)c([N+](=O)[O-])c1 489385803 GWOOPOCQZONPGX-UHFFFAOYSA-N 486.572 5.640 5 20 JKBD O=C(Nc1ccc(Cn2cnc3ccccc32)cc1)c1csc(-c2ccc([N+](=O)[O-])cc2)n1 497094550 DZHPKWVAYCHING-UHFFFAOYSA-N 455.499 5.369 5 20 JKBD CN(CC(=O)Nc1ccc(Cl)c(C(F)(F)F)c1)C(=O)c1csc(-c2cccc([N+](=O)[O-])c2)n1 497353794 SMTNGVOGMRYRBN-UHFFFAOYSA-N 498.870 5.101 5 20 JKBD COc1ccc(CN[C@@H](c2ccccc2)c2nccs2)cc1OCc1ccc([N+](=O)[O-])cc1 507915582 UTLPZRKFJHLHKX-DEOSSOPVSA-N 461.543 5.518 5 20 JKBD COc1cc(C(=O)Nc2cc(Cl)cc(Cl)c2)c([N+](=O)[O-])cc1OCc1cscn1 512395118 PEWAXHWQSUBMBB-UHFFFAOYSA-N 454.291 5.198 5 20 JKBD O=C(c1cccc(Cl)c1)N1CCCN(C(=O)c2cc([N+](=O)[O-])ccc2Sc2ccccc2)CC1 512573983 VOMPKVHOPLQFOW-UHFFFAOYSA-N 495.988 5.388 5 20 JKBD O=C(c1c[nH]c2cc([N+](=O)[O-])ccc12)C(c1nc2ccccc2s1)c1nc2ccccc2s1 513670915 DIFXMRYOUMBOKN-UHFFFAOYSA-N 470.535 6.310 5 20 JKBD COc1cc([N+](=O)[O-])ccc1NC(=O)CSc1nnc(-c2ccccc2)n1[C@H](C)c1ccccc1 515487207 VIBDAYRBFWFCGV-QGZVFWFLSA-N 489.557 5.202 5 20 JKBD C[C@@H](Nc1ccc(C(=O)NC[C@H](c2ccccc2Cl)N2CCCC2)cc1[N+](=O)[O-])c1ccccn1 516170030 XNDPLZQWBYIYRH-IQGLISFBSA-N 493.995 5.383 5 20 JKBD COc1ccc(N(C)C(=O)C/C(=C/c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)cn1 521801575 BYXSHRDNTYUQBH-LGMDPLHJSA-N 460.515 5.202 5 20 JKBD COc1ccc(-c2csc(NC(=O)c3csc(-c4cccc([N+](=O)[O-])c4)n3)n2)cc1OC 522093452 AGIMLNAKSLOHKJ-UHFFFAOYSA-N 468.516 5.111 5 20 JKBD O=C(CSc1ccc(C(F)(F)F)cc1[N+](=O)[O-])Nc1ccc(-c2n[nH]c(C3CC3)n2)cc1 522373490 DCJAOJJSCRRAMH-UHFFFAOYSA-N 463.441 5.007 5 20 JKBD CC(=O)NC1CCC(NC(=O)c2c3c(nc4ccccc24)/C(=C\c2ccc([N+](=O)[O-])cc2)CCC3)CC1 581263529 RTWMTXQSUNXQQS-JZJYNLBNSA-N 498.583 5.197 5 20 JKBD Cc1ccc(NC(=O)[C@@H](Sc2nnc(-c3sc(C)nc3C)o2)c2ccccc2)c([N+](=O)[O-])c1 600864653 PYVYPIRYVKAFAJ-IBGZPJMESA-N 481.559 5.499 5 20 JKBD CCCOc1cc(NC(=O)N2CCc3[nH]c4ccccc4c3C2)c([N+](=O)[O-])cc1OCCC 603652966 RLAZLAIZFSAMCH-UHFFFAOYSA-N 452.511 5.244 5 20 JKBD COc1cc(C(=O)Nc2ccnn2Cc2ccc(C)o2)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 603820561 VMCKVWCMHHZDPR-UHFFFAOYSA-N 482.880 5.448 5 20 JKBD CCN(C(=O)Cc1ccc(NC(=O)C2CCN(c3ccccc3[N+](=O)[O-])CC2)cc1)c1ccccc1 603989381 CXNAUXJPWJVCOY-UHFFFAOYSA-N 486.572 5.046 5 20 JKBD C[C@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)Nc1ccc(Cl)c(C(=O)NC2CCCCC2)c1 604446244 GUMHGXYJKWZRBQ-ZDUSSCGKSA-N 480.348 5.370 5 20 JKBD O=C(Nc1ccc(=O)n(Cc2ccc(Cl)c(Cl)c2)c1)c1cc([N+](=O)[O-])ccc1Cl 743695189 AMHJCZCAIZQXKC-UHFFFAOYSA-N 452.681 5.017 5 20 JKBD Cc1cc(/C=C\C(=O)O[C@@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)c(C)n1C1CCCCC1 746212462 XGBKBBHMLJPASD-RMHQSFGDSA-N 464.522 5.886 5 20 JKBD C[C@@H](OC(=O)c1csc(-c2ccc([N+](=O)[O-])cc2)n1)c1nc(-c2cccc(C(F)(F)F)c2)no1 747957703 QEAMPABZXZYMII-LLVKDONJSA-N 490.419 5.705 5 20 JKBD CC(C)[C@@H](OC(=O)c1csc(-c2cccc([N+](=O)[O-])c2)n1)C(=O)Nc1ccccc1C(F)(F)F 747962725 STFHXXHRVVMKOZ-GOSISDBHSA-N 493.463 5.557 5 20 JKBD C/C(=C\C(=O)O[C@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F)c1ccc(C(F)(F)F)cc1 748392848 PMOVGTNLGYJEEQ-LMMOQWNQSA-N 490.356 5.606 5 20 JKBD CCOC(=O)Nc1ccc2c(CSc3nc4cc5ccccc5cc4c(=O)n3C)cc(=O)oc2c1 918054794 UYQMZJFYLNPTDN-UHFFFAOYSA-N 487.537 5.054 5 20 JKBD C[C@H](Nc1ccc(C(=O)O[C@H](C)C(=O)c2cccc(Cl)c2)cc1[N+](=O)[O-])c1ccccn1 920547582 OQNAWZXPKISCIE-LSDHHAIUSA-N 453.882 5.245 5 20 JKBD C[C@@H](CC(=O)NC1(c2ccc(NC(=O)/C=C/c3ccc([N+](=O)[O-])o3)cc2)CCC1)Oc1ccccc1 1786208060 IIJXGHYDEQCTSM-XUDAUXSOSA-N 489.528 5.193 5 20 JKBD Cc1ncc(/C=C/C(=O)NC2(c3ccc(NC(=O)CCc4cccc([N+](=O)[O-])c4)cc3)CCC2)s1 1786601158 IEXLUVIQPXCIKA-ACCUITESSA-N 490.585 5.140 5 20 JKBD Cc1nc(CC(=O)Nc2ccc(C3(NC(=O)c4cc(Cl)cc([N+](=O)[O-])c4C)CCC3)cc2)cs1 1786861525 HKSGXSPTXHPHGC-UHFFFAOYSA-N 498.992 5.312 5 20 JKBD COc1ccc(CC(=O)Nc2ccc(C3(NC(=O)c4ccc5cc[nH]c5c4)CCC3)cc2)c([N+](=O)[O-])c1 1790571358 RPQNLXYYUYNTRX-UHFFFAOYSA-N 498.539 5.075 5 20 JKBD O=C(Cc1ccc([N+](=O)[O-])cc1F)Nc1ccc(C2(NC(=O)c3ccc4occc4c3)CCC2)cc1 1791184078 NZVJYRQHOKBXNA-UHFFFAOYSA-N 487.487 5.471 5 20 JKBD Cc1c(C(=O)N2CCC([C@@H]3CCCCN3C(=O)Cc3cccc([N+](=O)[O-])c3)CC2)oc2ccccc12 1823679543 OMAZEGQSROPQCU-DEOSSOPVSA-N 489.572 5.125 5 20 JKBD CC1(C(=O)N2CCCC[C@H]2C2CCN(C(=O)c3cc4cc([N+](=O)[O-])ccc4s3)CC2)CCC1 1823709679 NLOFOGPRUMVNGR-FQEVSTJZSA-N 469.607 5.233 5 20 JKBD Cc1ccc(NC(=O)[C@@H](Sc2nnc(-c3ccccc3Cl)n2N)c2ccccc2)c([N+](=O)[O-])c1 8646605 KIZHMXNKLNTAQH-FQEVSTJZSA-N 494.964 5.001 5 20 JKBD C[C@H](OC(=O)c1ccccc1NCc1ccco1)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 9023162 KKRWUERLMBHNEC-ZDUSSCGKSA-N 477.395 5.003 5 20 JKBD COc1cc2c(cc1OC)[C@H](c1ccccc1)N(C(=O)c1ccc(Br)c([N+](=O)[O-])c1)CC2 16002206 NIEXVINTHCHTPN-QHCPKHFHSA-N 497.345 5.162 5 20 JKBD NC(=O)c1ccc(CSc2nnc(-c3ccccc3Cl)n2-c2ccccc2F)c([N+](=O)[O-])c1 17230628 HZXIXRGJDQCIMV-UHFFFAOYSA-N 483.912 5.026 5 20 JKBD C[C@@H](OC(=O)c1cc(-c2cccs2)nc2ccccc12)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 17717538 ABXCUVVXBOJKIT-CQSZACIVSA-N 472.482 5.840 5 20 JKBD COCCN(C(=O)c1oc2ccc(Cl)cc2c1C)c1nc(-c2ccc([N+](=O)[O-])cc2)cs1 18119986 RWLPDGNDGFRYSG-UHFFFAOYSA-N 471.922 5.720 5 20 JKBD O=C(/C=C/c1cccs1)O[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Br)c1ccccc1 20752070 APCQUWAPMXTWIA-BQYDLMEBSA-N 487.331 5.355 5 20 JKBD COc1cccc([C@@H](CNc2ccc(C(C)=O)cc2[N+](=O)[O-])c2c[nH]c3ccccc23)c1OC 23381117 VNMMJUFVOOPTOI-OAQYLSRUSA-N 459.502 5.540 5 20 JKBD CC(C)CCSc1ccc(C(=O)N[C@H](c2cccc(F)c2)c2nccn2C)cc1[N+](=O)[O-] 23780338 ZECWEYOEAAAHPC-OAQYLSRUSA-N 456.543 5.125 5 20 JKBD COc1ccccc1NC(=O)C1CCN(C(=O)c2ccc(SCCC(C)C)c([N+](=O)[O-])c2)CC1 26100213 XZVABTFUSGOMPJ-UHFFFAOYSA-N 485.606 5.233 5 20 JKBD CSc1ccc(C(=O)c2ccccc2C(=O)Nc2ccc(-c3csnn3)cc2)cc1[N+](=O)[O-] 115790646 AONYKDRBTFCBDS-UHFFFAOYSA-N 476.539 5.319 5 20 JKBD O=C(CSc1nnc(Cc2cccs2)n1CCc1ccccc1)c1cccc([N+](=O)[O-])c1 216804444 JAINLGYJMXOVTL-UHFFFAOYSA-N 464.572 5.056 5 20 JKBD CN(Cc1cc([N+](=O)[O-])ccc1Cl)C(=O)c1ccc(SCc2cn3ccccc3n2)cc1 248048354 MZFIOOIZPYIXDU-UHFFFAOYSA-N 466.950 5.460 5 20 JKBD O=C(c1csc(-c2cccc([N+](=O)[O-])c2)n1)N(Cc1ccccn1)c1ccc(Cl)cc1 303008551 IYRBHBMJCOTYNJ-UHFFFAOYSA-N 450.907 5.614 5 20 JKBD CCOc1c(Br)cc(CN[C@@H](C)c2cccc([N+](=O)[O-])c2)cc1Br 324401418 SNQUXRJIIZDDJA-NSHDSACASA-N 458.150 5.369 5 20 JKBD CCN(C(=O)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1)[C@@H](C)c1ccc(F)cc1 488695355 KYWANMNHCHDMPX-HNNXBMFYSA-N 467.463 5.579 5 20 JKBD Cc1cc(C(=O)NC(C)C)ccc1NC(=O)c1cc([N+](=O)[O-])ccc1Sc1ccc(Cl)cc1 490006669 GHKKMTACTZONPY-UHFFFAOYSA-N 483.977 6.098 5 20 JKBD CC(C)(C)S(=O)(=O)Cc1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2Sc2ccccc2)cc1 497778167 DZGBVSPVLOTOBV-UHFFFAOYSA-N 484.599 5.712 5 20 JKBD C[C@H]1CCCN(c2ccc(C(=O)Nc3nnc(SCc4cccs4)s3)cc2[N+](=O)[O-])C1 498606325 LGQBQRXGFPCFAN-ZDUSSCGKSA-N 475.621 5.289 5 20 JKBD O=C(CCCOc1ccccc1)Nc1ccc(CNC(=O)Nc2ccc([N+](=O)[O-])cc2Cl)cc1 500909394 XTMFACACFJCHHR-UHFFFAOYSA-N 482.924 5.368 5 20 JKBD COc1ccc(CNC(=O)c2cc([N+](=O)[O-])ccc2Sc2ccc(Cl)cc2)cc1NC(C)=O 501852609 GHSCSYXWCYHOGF-UHFFFAOYSA-N 485.949 5.296 5 20 JKBD C[C@@H](Nc1ccc(C(=O)N2CCCc3cccc(OC(F)F)c32)cc1[N+](=O)[O-])c1ccccn1 511525890 XBYSCHXMTJLJMV-OAHLLOKOSA-N 468.460 5.357 5 20 JKBD C[C@@H](C1CC1)N(C(=O)c1ccc(Sc2nncn2C)c([N+](=O)[O-])c1)c1cccc(C(F)(F)F)c1 515679993 DHQMGPXGGFSISE-ZDUSSCGKSA-N 491.495 5.339 5 20 JKBD C[C@H](NC(=O)Cc1ccc(NC(=O)c2ccc(Br)cc2)cc1)c1cccc([N+](=O)[O-])c1 515681677 CPVFEUKOPOJIEX-HNNXBMFYSA-N 482.334 5.030 5 20 JKBD CC(C)CCSc1ccc(C(=O)Nc2cccc(C(=O)N3CCSCC3)c2)cc1[N+](=O)[O-] 522090907 VDEGEEIBNRVIAH-UHFFFAOYSA-N 473.620 5.174 5 20 JKBD O=C(CCOc1ccccc1[N+](=O)[O-])Nc1ccccc1OCc1ncc(-c2cccc(Cl)c2)o1 524210075 IHBBYJMFKJCGSC-UHFFFAOYSA-N 493.903 5.890 5 20 JKBD O=C(C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)N1CCC[C@H](c2ncc[nH]2)C1 524340006 KTAFLZSOZDNARG-OWBBTNHHSA-N 473.558 5.265 5 20 JKBD COc1ccc(NC(=O)[C@@H](C)SCc2nc(O)c3c(-c4ccccc4)csc3n2)c([N+](=O)[O-])c1 591590079 QHQZLMHABRVVTQ-CYBMUJFWSA-N 496.570 5.241 5 20 JKBD CSc1ccc(C(=O)c2ccccc2C(=O)Nc2ccc(-c3cnc(C)o3)cc2)cc1[N+](=O)[O-] 603495097 OHMIJWQRXCIIHZ-UHFFFAOYSA-N 473.510 5.763 5 20 JKBD COc1cc([N+](=O)[O-])ccc1NC(=O)CNc1ccc(Oc2ncc(Cl)cc2Cl)cc1 604009598 NCEKWYNMGUGQRV-UHFFFAOYSA-N 463.277 5.148 5 20 JKBD O=[N+]([O-])c1ccc(-c2ccc(CNCc3cccnc3OCC(F)(F)F)o2)c(Br)c1 608836470 ZVYWDEUSLHXGLO-UHFFFAOYSA-N 486.244 5.243 5 20 JKBD Cc1csc(Sc2ccc(C(=O)N3CCO[C@@H](c4ccc(F)c(F)c4)C3)cc2[N+](=O)[O-])n1 608965506 YPRFALMXXMNJAH-GOSISDBHSA-N 477.514 5.003 5 20 JKBD Cn1c(SCC(=O)c2ccc([N+](=O)[O-])cc2)nc2scc(-c3ccccc3Cl)c2c1=O 612646157 QYLYBCFLXTUXRQ-UHFFFAOYSA-N 471.947 5.199 5 20 JKBD O=C(Cn1c2ccccc2c(=O)c2ccccc21)Nc1cccc(OCc2cccc(F)c2)c1 614979203 ZUDRBYIXOWTCSF-UHFFFAOYSA-N 452.485 5.512 5 20 JKBD C[C@@H](NCc1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1)c1ccc(N2CCCC2=O)cc1 726607500 XXCLQJGHOPRVPT-HXUWFJFHSA-N 481.556 5.425 5 20 JKBD O=C(Oc1c(Br)cccc1Br)c1csc(-c2ccc([N+](=O)[O-])cc2)n1 747650163 LRNVIQZYGBBWRX-UHFFFAOYSA-N 484.125 5.463 5 20 JKBD O=C(Nc1cccc(COC(=O)c2csc(-c3ccc([N+](=O)[O-])cc3)n2)c1)c1ccccc1 750427327 UUHOTTFQFOBVMA-UHFFFAOYSA-N 459.483 5.328 5 20 JKBD C[C@H](OC(=O)c1cc(-c2cccnc2)nc2ccccc12)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 813319631 MNIWVHSYOFBPQB-HNNXBMFYSA-N 467.441 5.173 5 20 JKBD O=C(Nc1ccccc1C(=O)Nc1ccc(-c2cc[nH]n2)cc1)c1ccc([N+](=O)[O-])cc1Cl 920299307 AXJVDTQFBVKWPH-UHFFFAOYSA-N 461.865 5.143 5 20 JKBD CC1(C(=O)Nc2ccc(C3(NC(=O)CSc4ccccc4[N+](=O)[O-])CCC3)cc2)CCC1 1785814754 QSEUGPONDQQBJN-UHFFFAOYSA-N 453.564 5.011 5 20 JKBD Cc1ccc2[nH]cc(CC(=O)Nc3ccc(C4(NC(=O)c5cc(O)cc([N+](=O)[O-])c5)CCC4)cc3)c2c1 1786781211 ZCEXZKORYHBTMM-UHFFFAOYSA-N 498.539 5.081 5 20 JKBD O=C(CSc1ccccc1)Nc1ccc(C2(NC(=O)c3cccc(F)c3[N+](=O)[O-])CCC2)cc1 1787774834 OORRAFGATQELFG-UHFFFAOYSA-N 479.533 5.274 5 20 JKBD CCc1cc(C(=O)Nc2ccc(C3(NC(=O)c4cccc(F)c4[N+](=O)[O-])CCC3)cc2)cc(C)n1 1788839606 KVXRWPXKMRFPFC-UHFFFAOYSA-N 476.508 5.061 5 20 JKBD CC1=CC[C@@H](C(=O)NC2(c3ccc(NC(=O)c4cc([N+](=O)[O-])c(O)cc4C)cc3)CCC2)CC1 1790809028 AYJYGQKPQGVZLD-GOSISDBHSA-N 463.534 5.103 5 20 JKBD Cc1c(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)[C@@H]2CCC[C@@H]4CCCC[C@H]42)C3)cc(Cl)cc1[N+](=O)[O-] 1800712182 YAKOQGIQMMRCFH-MCAKUDAQSA-N 488.028 5.415 5 20 JKBD CCC[C@H]1CC[C@H](C(=O)N2CCCC[C@H]2c2cc(NC(=O)c3ccc([N+](=O)[O-])c(OC)c3)n[nH]2)CC1 1823286640 DBEHJOXIPSQLML-WFXMLNOXSA-N 497.596 5.239 5 20 JKBD O=C(c1ccccc1C1CC1)N1CCC([C@@H]2CCCCN2C(=O)Cc2ccc([N+](=O)[O-])cc2F)CC1 1831292805 GZNKXJKKHSVOAF-SANMLTNESA-N 493.579 5.087 5 20 JKBD Cc1ccc([C@@H](C)C(=O)N2CCC([C@@H]3CCCCN3C(=O)Cc3ccc([N+](=O)[O-])cc3F)CC2)cc1 1831293747 HLBRDEIVUFXSGV-IBVKSMDESA-N 495.595 5.008 5 20 JKBD CCC(C)(C)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cccc(Br)c2[N+](=O)[O-])CC1 1831389349 QDIJKRZWDYQDLN-LJQANCHMSA-N 494.430 5.027 5 20 JKBD Cc1ccc([C@@H](C)C(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3cc(F)cc([N+](=O)[O-])c3)CC2)cc1 1831529856 NOGLIGLQSJITGW-KBMIEXCESA-N 481.568 5.079 5 20 JKBD C[C@H](C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)c1cc2cc([N+](=O)[O-])ccc2s1)c1ccc(Cl)cc1 1847409795 SIQXFBRKSZQKBH-GKCIPKSASA-N 483.977 5.082 5 20 JKBD Cc1ccc(C(=O)CCC(=O)O[C@H](C(=O)Nc2ccc(C)cc2[N+](=O)[O-])c2ccccc2)cc1 8929512 OEYGZSILNBGKMY-VWLOTQADSA-N 460.486 5.098 5 20 JKBD CCn1c(SCC(=O)Nc2ccc([N+](=O)[O-])cc2C(F)(F)F)nnc1-c1cccc(Cl)c1 9823137 MVYKRIQGRIMALP-UHFFFAOYSA-N 485.875 5.276 5 20 JKBD Cc1ccc(NC(=O)c2ccc([N+](=O)[O-])cc2Cl)cc1S(=O)(=O)Nc1cccc(Cl)c1 15425310 FLCFQEKLQQZKDF-UHFFFAOYSA-N 480.329 5.263 5 20 JKBD C[C@H](Sc1nnc(-c2ccc(F)cc2)n1C[C@H]1CCCO1)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 17715338 VHDQQYXXDWJFPK-IFXJQAMLSA-N 496.524 5.075 5 20 JKBD CCOC(=O)c1cc(C(=O)O[C@H](C)C(=O)N2c3ccccc3Sc3ccccc32)cc([N+](=O)[O-])c1 22437649 AICUKEPVXJQQCZ-OAHLLOKOSA-N 492.509 5.146 5 20 JKBD C[C@H](OC(=O)c1cccnc1Sc1ccccc1)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 22859410 USYVNWOTYXUMJT-ZDUSSCGKSA-N 491.447 5.344 5 20 JKBD C[C@@H](Sc1nnc(-c2cccnc2)n1Cc1ccccc1)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl 36795731 HCDBRQJDVDCTEP-OAHLLOKOSA-N 494.964 5.069 5 20 JKBD Cn1cnnc1Sc1ccc(C(=O)Nc2ccc(Oc3cccc(F)c3)cc2)cc1[N+](=O)[O-] 59814452 WGURUYCUIFTINQ-UHFFFAOYSA-N 465.466 5.058 5 20 JKBD Cc1ccc(C(=O)Nc2nc(-c3ccc(C)c([N+](=O)[O-])c3)cs2)cc1NC(=O)c1ccccc1 302937693 IWSMQNULHCXGGW-UHFFFAOYSA-N 472.526 5.840 5 20 JKBD CCOc1cc(C(=O)Nc2ccc3[nH]c(-c4ccccc4Cl)nc3c2)c([N+](=O)[O-])cc1OC 302937778 GYJMPTPCOPMYDV-UHFFFAOYSA-N 466.881 5.451 5 20 JKBD CCOc1cc([N+](=O)[O-])c(C(=O)Nc2c(C)c(C(C)(C)C)nn2-c2ccccc2)cc1OC 410004428 QDMMYJSPYNEFDK-UHFFFAOYSA-N 452.511 5.046 5 20 JKBD O=C(c1ccc(Nc2ccccc2)c([N+](=O)[O-])c1)N(Cc1nnc(-c2ccc(Cl)cc2)o1)C1CC1 498735598 DNWUTWQJSYDQJW-UHFFFAOYSA-N 489.919 5.847 5 20 JKBD CCC(=O)Nc1ccc(Cl)c(NC(=O)c2ccccc2C(=O)c2ccc(SC)c([N+](=O)[O-])c2)c1 500900440 AZOFKHTUYAHSPM-UHFFFAOYSA-N 497.960 5.802 5 20 JKBD COc1cc(C(=O)N2CC3(CCCC3)c3c(F)cccc32)c([N+](=O)[O-])cc1OCc1cscn1 501790215 CQFITWQMENFFGX-UHFFFAOYSA-N 483.521 5.250 5 20 JKBD CC[C@@H](C)C(=O)Nc1cccc(CNCc2ccc(Oc3ccc(F)cc3)c([N+](=O)[O-])c2)c1 507902648 KYGQUQALXMRZFC-QGZVFWFLSA-N 451.498 5.801 5 20 JKBD COc1cc(CN[C@@H](C)c2cnn(-c3ccc(F)cc3)c2C)ccc1OCc1ccc([N+](=O)[O-])cc1 507954213 JIMLMDSNPPDKFM-SFHVURJKSA-N 490.535 5.666 5 20 JKBD C[C@H](NCc1ccc(Oc2ccccc2Cl)c([N+](=O)[O-])c1)c1ccc(NC(=O)C2CC2)cc1 509572093 VQLDFZUHPSFPNW-INIZCTEOSA-N 465.937 6.240 5 20 JKBD O=C(C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)N1CCCC[C@@H]1c1ncc[nH]1 509974903 ZSCXDTHFWGHAMA-WOBAJENOSA-N 473.558 5.612 5 20 JKBD Cc1nc(-c2ccc([C@H](C)NC(=O)c3ccc([N+](=O)[O-])cc3I)cc2)cs1 511391679 QBPYFWWDLLMVOK-NSHDSACASA-N 493.326 5.122 5 20 JKBD Cc1cc(N[C@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2C(F)(F)F)ccc1NC(=O)c1ccco1 511686189 WVIADMQMTOHTDV-CYBMUJFWSA-N 476.411 5.206 5 20 JKBD COc1cccc([C@@H](CNC(=O)c2ccc(SC)c([N+](=O)[O-])c2)c2c[nH]c3ccccc23)c1OC 514718755 AXVUDPAXDQTBOZ-HXUWFJFHSA-N 491.569 5.377 5 20 JKBD O=C(Cn1c2ccccc2c(=O)c2ccccc21)N(Cc1ccccn1)c1ccc(Cl)cc1 515628562 SWZQGMMGORNPCW-UHFFFAOYSA-N 453.929 5.437 5 20 JKBD CC(C)N(Cc1ccccn1)C(=O)C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1 516534191 XDSQPKZNLOBPTE-HKWRFOASSA-N 472.570 5.967 5 20 JKBD O=C(Cc1ccc(NC(=O)c2cc(OCC(F)(F)F)ccc2[N+](=O)[O-])cc1)Nc1ccccc1F 524390792 CIDPJIKGOFBOQH-UHFFFAOYSA-N 491.397 5.109 5 20 JKBD CC(C)(C)OCc1cccc(CNC(=O)c2ccccc2NC(=O)c2ccc([N+](=O)[O-])cc2Cl)c1 726174481 WNIUCDRORGJBSZ-UHFFFAOYSA-N 495.963 5.746 5 20 JKBD CCOc1ccc(OCC)c(NC(=S)/C(=C(/O)c2ccc(C)c([N+](=O)[O-])c2)[n+]2ccccc2)c1 726963458 PHFYLUVASFGDSS-UHFFFAOYSA-O 480.566 5.311 5 20 JKBD C[C@H](CN(C)C(=O)c1ccccc1NC(=O)c1ccc([N+](=O)[O-])cc1Cl)c1ccccc1 727399859 LLCPQSOZNASCTK-MRXNPFEDSA-N 451.910 5.376 5 20 JKBD O=C(Nc1c(F)cc(F)cc1-c1ccccc1)c1ccc(I)c([N+](=O)[O-])c1 730481441 IBLWMTYUGZQABJ-UHFFFAOYSA-N 480.208 5.397 5 20 JKBD O=C(COC(=O)c1c(Cl)cccc1[N+](=O)[O-])Nc1cc(C(F)(F)F)cc(C(F)(F)F)c1 730644921 PNMZLSQIYWEOMN-UHFFFAOYSA-N 470.709 5.081 5 20 JKBD O=C(OCC(=O)N1Cc2ccccc2[C@@H](c2ccccc2)C1)c1csc(-c2ccc([N+](=O)[O-])cc2)n1 747955344 RKVHRSOCKLZVPK-HSZRJFAPSA-N 499.548 5.049 5 20 JKBD CN(C)C(=O)c1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2N2CCC(Cc3ccccc3)CC2)cc1 864096176 JNQSAVGFXUYKDA-UHFFFAOYSA-N 486.572 5.008 5 20 JKBD Cc1c(C(=O)N(Cc2nnc(-c3cccc([N+](=O)[O-])c3)o2)C(C)C)oc2c1ccc1ccccc12 864242655 PJGBFRSYMGJETI-UHFFFAOYSA-N 470.485 5.903 5 20 JKBD CN(C(=O)c1ccc(-c2nc3ccccc3s2)s1)S(=O)(=O)c1ccc(Cl)c([N+](=O)[O-])c1 916989489 BNEKYXRKRWDPLL-UHFFFAOYSA-N 493.975 5.047 5 20 JKBD CC1=C(C(=O)OCc2ccccc2)[C@H](c2csc([N+](=O)[O-])c2)NC(=O)N1Cc1cccs1 917960819 LTEFXNOEIYDIIK-FQEVSTJZSA-N 469.544 5.002 5 20 JKBD CC(C)c1cccc(O[C@H](C)C(=O)O[C@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2C(F)(F)F)c1 919450906 PTCICFBKGCQEMD-ZIAGYGMSSA-N 468.428 5.075 5 20 JKBD C[C@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)OCc1nnc(-c2ccc(Cl)cc2Cl)o1 920778595 NHVUIZZYONIYQK-VIFPVBQESA-N 472.668 5.116 5 20 JKBD O=C(CCCc1ccccc1F)Nc1ccc(C2(NC(=O)c3ccc([N+](=O)[O-])o3)CCC2)cc1 1786119042 OWGMJFNWSNTBIQ-UHFFFAOYSA-N 465.481 5.098 5 20 JKBD O=C(CCCC(F)(F)F)Nc1ccc(C2(NC(=O)CCc3cccc([N+](=O)[O-])c3)CCC2)cc1 1786619741 FBOTVJDBPJZLJP-UHFFFAOYSA-N 477.483 5.394 5 20 JKBD COc1cc(Cl)cc(C(=O)NC2(c3ccc(NC(=O)c4cc(C)c([N+](=O)[O-])cn4)cc3)CCC2)c1 1788767688 UGXKANWJPOZDLE-UHFFFAOYSA-N 494.935 5.022 5 20 JKBD CN(C)c1ccc([N+](=O)[O-])c(C(=O)Nc2ccc(C3(NC(=O)c4ccc5occc5c4)CCC3)cc2)c1 1790055733 NEFSOCICQHWCCY-UHFFFAOYSA-N 498.539 5.469 5 20 JKBD CCOc1ccsc1C(=O)NC1(c2ccc(NC(=O)c3cc(F)cc([N+](=O)[O-])c3)cc2)CCC1 1790695111 CWKCVSASLSLYNW-UHFFFAOYSA-N 483.521 5.256 5 20 JKBD Cc1scc(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)CSc3ccccc3[N+](=O)[O-])[nH]n2)c1C 1816615171 NUNMFJRXTYTHIR-SFHVURJKSA-N 499.618 5.094 5 20 JKBD Cc1cc(Cl)cc(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)c3ccc([N+](=O)[O-])cc3F)[nH]n2)c1 1823192517 ZUZDTBKVAMLOSX-FQEVSTJZSA-N 485.903 5.039 5 20 JKBD O=C(c1cc(F)cc([N+](=O)[O-])c1)N1CCC([C@H]2CCCCN2C(=O)c2ccc3occc3c2)CC1 1828258407 PLGUQATWBKQLMD-HSZRJFAPSA-N 479.508 5.027 5 20 JKBD CCC[C@H]1CC[C@H](C(=O)N2CCC([C@H]3CCCCN3C(=O)c3ccc(O)c([N+](=O)[O-])c3)CC2)CC1 1830492659 ZQBWLGMMFYIWDO-KJXAQDMKSA-N 485.625 5.140 5 20 JKBD Cc1cccc(Cl)c1C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cc(F)cc([N+](=O)[O-])c2)CC1 1830617993 HZCRHMQCMLOESL-JOCHJYFZSA-N 487.959 5.243 5 20 JKBD Cc1cccc(F)c1C(=O)N1CCCC[C@@H]1C1CCN(C(=O)CSc2ccccc2[N+](=O)[O-])CC1 1832550646 DTGDHBQYAMPWLW-OAQYLSRUSA-N 499.608 5.068 5 20 JKBD C[C@@H](Sc1nnc(-c2ccccc2F)n1C1CC1)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 9637905 TUAUCGDIHOWIFG-LLVKDONJSA-N 495.458 5.465 5 20 JKBD COc1cc(C(=O)Nc2nc(-c3ccccc3Cl)cs2)c([N+](=O)[O-])cc1OC(F)F 10959679 VLQDAWXGKJAAGR-UHFFFAOYSA-N 455.826 5.234 5 20 JKBD CC(=O)N(c1cccc(Cl)c1)c1nc(COC(=O)c2ccc(Cl)c([N+](=O)[O-])c2)cs1 11025229 NARJNVYXTZYHSF-UHFFFAOYSA-N 466.302 5.400 5 20 JKBD Cc1nc(-c2ccccc2)c(C(=O)O[C@@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2C(F)(F)F)s1 18765559 OQHNTCWLBPQRCF-NSHDSACASA-N 479.436 5.230 5 20 JKBD CCOc1cc2c(cc1CN[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1)O[C@@H](C)C2 25704106 WYLGBWNXKRSWSN-LMKMVOKYSA-N 495.963 5.440 5 20 JKBD Cc1noc(CSc2ccccc2C(=O)Oc2ccc(NC(=O)c3cccc([N+](=O)[O-])c3)cc2)n1 26374968 XSNHBZDPTQFZPO-UHFFFAOYSA-N 490.497 5.050 5 20 JKBD Cc1ccc(NC(=O)c2ccc(N[C@@H](C)c3ccccn3)c([N+](=O)[O-])c2)c(OCC(F)(F)F)c1 108913528 UCCJMEQZZAKZPQ-HNNXBMFYSA-N 474.439 5.665 5 20 JKBD COc1ccc([N+](=O)[O-])cc1CSc1nnc(-c2ccncc2)n1-c1ccc(Cl)cc1 255936346 GFRPGRLKHRJSEK-UHFFFAOYSA-N 453.911 5.192 5 20 JKBD O=C(Cc1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1)NC[C@H]1CCCO[C@@H]1c1ccccc1 409559846 XVTPOKNVNISDML-RNWIMVQKSA-N 496.567 5.274 5 20 JKBD Cc1cc(NC(=O)c2cc([N+](=O)[O-])ccc2Sc2ccccc2)ccc1NC(=O)c1ccco1 490174433 PJXWOFMNUPMJGJ-UHFFFAOYSA-N 473.510 6.152 5 20 JKBD Cc1cc(C(=O)N2CCC[C@H](C)C2)ccc1NC(=O)c1csc(-c2ccc([N+](=O)[O-])cc2)n1 495547878 NELHLJZVNSYBFU-HNNXBMFYSA-N 464.547 5.151 5 20 JKBD C[C@H](Nc1ccc(C(=O)N[C@H](C)c2cccc(C(F)(F)F)c2)cc1[N+](=O)[O-])c1ccccn1 505996362 NZPGIZNVORYBCS-CABCVRRESA-N 458.440 5.673 5 20 JKBD CC[C@H](C)NC(=O)c1ccc(NC(=O)Cc2cn(-c3ccccc3)nc2-c2ccc([N+](=O)[O-])cc2)cc1 507857864 BFCQFTZHZORQCV-IBGZPJMESA-N 497.555 5.157 5 20 JKBD CCN(Cc1nc(-c2cccc([N+](=O)[O-])c2)no1)[C@H]1CCSc2ccc(Br)cc21 509065961 BZNSLYFTYZGULQ-KRWDZBQOSA-N 475.368 5.466 5 20 JKBD O=[N+]([O-])c1cccc(-c2noc(CNc3ccccc3Oc3ncc(Cl)cc3Cl)n2)c1 511099729 RQPHPVFSQFXELF-UHFFFAOYSA-N 458.261 5.751 5 20 JKBD Cc1csc(N(CC(F)(F)F)C(=O)c2ccc(N[C@H](C)c3ccccn3)c([N+](=O)[O-])c2)n1 512639142 UXFAYADBISFJNG-CYBMUJFWSA-N 465.457 5.137 5 20 JKBD COc1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2Oc2ccccc2)cc1OCc1cccnc1 515282462 DYZVXUIDYIUOQL-UHFFFAOYSA-N 471.469 5.622 5 20 JKBD COc1cc(Cl)ccc1CN[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1 518619642 DBQLBRJSLNMIAG-OAQYLSRUSA-N 460.317 5.380 5 20 JKBD O=C(Nc1cccc(CNCc2ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])cc2)c1)[C@@H]1CCCO1 518779558 XYZKTHCKYOMQAF-DEOSSOPVSA-N 481.936 5.448 5 20 JKBD O=C(Nc1ccc(Cl)cc1)Nc1ccc(NC(=O)c2ccn(-c3ccc([N+](=O)[O-])cc3)n2)cc1 520063428 PWGXSOBNJLIOQT-UHFFFAOYSA-N 476.880 5.330 5 20 JKBD C[C@@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)Nc1cccc(COCC(F)(F)C(F)F)c1 520390612 DJRKFYYQJVEBOA-LLVKDONJSA-N 464.799 5.071 5 20 JKBD Cc1cc(Sc2ccccc2)ccc1NC(=O)[C@H]1CCCN1C(=O)c1ccc([N+](=O)[O-])c(C)c1 523272628 YVVNNFFIJUMAKB-XMMPIXPASA-N 475.570 5.606 5 20 JKBD COc1cc(C(=O)Nc2cc(-c3ccccc3)nn2-c2ccccc2)c([N+](=O)[O-])cc1OC(F)F 585720081 MCLGWAPUNBMLJV-UHFFFAOYSA-N 480.427 5.310 5 20 JKBD O=C(N[C@H]1CCCc2nc(O)ccc21)c1ccccc1Sc1ccc(C(F)(F)F)cc1[N+](=O)[O-] 603222919 WLLIUHDPCJJMKR-KRWDZBQOSA-N 489.475 5.673 5 20 JKBD COCCN(C(=O)c1cc(SC)ccc1Cl)c1nc(-c2ccc([N+](=O)[O-])cc2)cs1 603461425 QOZQJAHFZPRIEF-UHFFFAOYSA-N 463.968 5.387 5 20 JKBD C[C@@H](NC(=O)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-])c1cccc(OCc2ccccn2)c1 603982668 OWPAQNABRJGCBY-OAHLLOKOSA-N 475.423 5.001 5 20 JKBD CCc1cccc2c1OCC[C@@H]2NC(=O)c1ccccc1NC(=O)c1ccc([N+](=O)[O-])cc1Cl 725758946 UQUNASGNBPDEPJ-QFIPXVFZSA-N 479.920 5.317 5 20 JKBD COc1cc(C(=O)OCc2csc(N(C(C)=O)c3ccc(C(F)(F)F)cc3)n2)ccc1[N+](=O)[O-] 725944378 AZRDKGIMXXVKAN-UHFFFAOYSA-N 495.435 5.120 5 20 JKBD C[C@@H](c1ccc(S(N)(=O)=O)cc1)N(C)C(=O)CCC(=O)c1ccc2ccc3cccc4ccc1c2c34 727753436 UAGCHQOQZYVIAC-SFHVURJKSA-N 498.604 5.414 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)O[C@@H](C)c2nc(-c3cccc(C(F)(F)F)c3)no2)cc1SC 728650264 WZLYEBQZPQNBPP-JTQLQIEISA-N 483.424 5.312 5 20 JKBD C[C@@H](OC(=O)C[C@@H](c1ccccc1)C(F)(F)F)C(=O)Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1 728655019 TXPVOLWFQJWZJN-DYVFJYSZSA-N 493.463 5.325 5 20 JKBD CC(C)[C@@H](OC(=O)c1csc(-c2ccc([N+](=O)[O-])cc2)n1)C(=O)N1CCSc2ccccc21 747957329 NZXRYOFTCCBSQP-HXUWFJFHSA-N 483.571 5.039 5 20 JKBD O=C(Nc1ncc(Cc2cccc(Br)c2)s1)c1cc(Cl)ccc1[N+](=O)[O-] 751150215 XKPLCRXLBBEOCG-UHFFFAOYSA-N 452.717 5.310 5 20 JKBD O=[N+]([O-])c1ccc(Sc2nnc(-c3cccnc3)n2-c2ccc(Br)cc2)c([N+](=O)[O-])c1 799851351 CMKMQDLOLKTNDU-UHFFFAOYSA-N 499.306 5.059 5 20 JKBD CC(C)N(CC(=O)Nc1ccc(Cl)cc1C(F)(F)F)C(=O)/C=C/c1ccc([N+](=O)[O-])cc1 820133068 MRYCJEVRDKTZNL-BJMVGYQFSA-N 469.847 5.156 5 20 JKBD C[C@@H](OC(=O)c1ccc(Cl)cc1[N+](=O)[O-])C(=O)N1c2ccccc2Sc2ccccc21 822336481 HJWQQUDGWDSINI-CYBMUJFWSA-N 454.891 5.623 5 20 JKBD Cc1oc(-c2ccccc2)nc1COC(=O)c1ccccc1C(=O)c1ccc(N(C)C)c([N+](=O)[O-])c1 841390483 FWOJMNQXDXGPDR-UHFFFAOYSA-N 485.496 5.212 5 20 JKBD CC(C)OC(=O)C[C@H](NC(=O)/C=C\c1ccc2ccc(Cl)cc2n1)c1ccccc1[N+](=O)[O-] 912906075 WSMBUELJPPTGSR-GMGKOPGTSA-N 467.909 5.009 5 20 JKBD O=C(Nc1ccc(OC[C@@H](O)CO[C@@H]2CCCc3ccccc32)cc1)c1cc([N+](=O)[O-])ccc1Cl 914794869 CSBMNWOMRYCNQX-CJFMBICVSA-N 496.947 5.334 5 20 JKBD COc1cc(C(=O)Nc2ccc(F)c([N+](=O)[O-])c2)ccc1OCc1ccc(Br)s1 915281801 XNXUIJDRHZIVPF-UHFFFAOYSA-N 481.299 5.398 5 20 JKBD O=C(Oc1ccc(-c2ccccc2)cc1[N+](=O)[O-])c1ccc(CS(=O)(=O)c2ccccc2)o1 920331104 VNGPKLWGDFRPQO-UHFFFAOYSA-N 463.467 5.048 5 20 JKBD O=C(CCC(F)(F)F)Nc1ccc(C2(NC(=O)Cc3ccc(Cl)cc3[N+](=O)[O-])CCC2)cc1 1787868714 CGUKBSSIGNCBEV-UHFFFAOYSA-N 483.874 5.267 5 20 JKBD Cc1cc2cc(C(=O)Nc3ccc(C4(NC(=O)c5ccc([N+](=O)[O-])o5)CCC4)cc3)ccc2[nH]1 1790987546 SEAWQHOEPGLFOJ-UHFFFAOYSA-N 458.474 5.039 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)N1CCC([C@H]2CCCCN2C(=O)C2(c3ccccc3)CC2)CC1 1823783314 PRVODYCSSPAFCM-XMMPIXPASA-N 493.579 5.007 5 20 JKBD O=C(CC1CCCC1)N1CCC([C@H]2CCCCN2C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)CC1 1831061490 SYTGURDGFARYGJ-JOCHJYFZSA-N 483.634 5.623 5 20 JKBD CCCCC[C@@H](C)C(=O)N1CCCC[C@H]1C1CCN(C(=O)Cc2ccc([N+](=O)[O-])cc2F)CC1 1831467723 YIMMRINHZDMNPR-DVECYGJZSA-N 475.605 5.113 5 20 JKBD C[C@@H](CC(=O)N1CCCC[C@@H]1C1CCN(C(=O)/C=C/c2ccc([N+](=O)[O-])o2)CC1)c1ccccc1 1831502606 CKHQWCBUBPSPRU-YHQSXPEXSA-N 479.577 5.015 5 20 JKBD O=C(c1cc2ccoc2s1)N1CCC([C@H]2CCCCN2C(=O)/C=C/c2ccccc2[N+](=O)[O-])CC1 1832907484 VAMZCILHSIDIPF-MHNQQFQPSA-N 493.585 5.349 5 20 JKBD CCCOc1cc(NC(=O)c2cc(C)nc3c2cnn3C(C)C)c([N+](=O)[O-])cc1OCCC 10968556 LZYODBQINFKLAO-UHFFFAOYSA-N 455.515 5.059 5 20 JKBD C[C@H](Sc1nnc(Cc2ccccc2)n1-c1ccccc1)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl 12105393 PNFIZBFFIORJHD-INIZCTEOSA-N 493.976 5.539 5 20 JKBD COc1ccc(NC(=O)[C@H](C)Sc2ncnc3scc(-c4ccc(F)cc4)c23)c([N+](=O)[O-])c1 16864724 AYYYCGCYCHFWHM-LBPRGKRZSA-N 484.534 5.534 5 20 JKBD Cc1nc(COc2ccc(Cl)cc2)sc1C(=O)OCC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-] 17733242 IQTLWRMGTQEWND-UHFFFAOYSA-N 496.328 5.041 5 20 JKBD CCc1cc(N2CCC[C@H](c3nnc4ccc(C(F)(F)F)cn34)C2)nc(-c2ccc([N+](=O)[O-])cc2)n1 68754491 SYNWEAAOPIQALK-INIZCTEOSA-N 497.481 5.060 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)N[C@@H](c2ccc3c(c2)CCCC3)c2cccs2)cc1SC 112529917 JXZYMYVHDLEGHC-QHCPKHFHSA-N 468.600 5.785 5 20 JKBD CSc1ccc(C(=O)c2ccccc2C(=O)Nc2cc(NC(=O)C(C)C)ccc2C)cc1[N+](=O)[O-] 117129931 RKKQYKUZFJEYNU-UHFFFAOYSA-N 491.569 5.703 5 20 JKBD CC(=O)Nc1ccc(-c2csc(NC(=O)c3csc(-c4cccc([N+](=O)[O-])c4)n3)n2)cc1 303058951 UBTSPBHZUZALTL-UHFFFAOYSA-N 465.516 5.053 5 20 JKBD O=C(NC[C@H]1CCCO[C@H]1c1ccccc1)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 409547886 MKOKZYFHLRHELT-XXBNENTESA-N 491.510 5.114 5 20 JKBD COc1ccc(OC)c(CNC(=O)C/C(=C/c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)c1 483080370 FPWKYZZBOIXHCM-AQTBWJFISA-N 489.553 5.469 5 20 JKBD CC(=O)Nc1cc(NC(=O)c2ccccc2Sc2ccc(C(F)(F)F)cc2[N+](=O)[O-])ccc1C 484216607 DUOREBNYMBGBMN-UHFFFAOYSA-N 489.475 6.284 5 20 JKBD COCCOc1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2Sc2ccccc2)cc1Cl 490746891 QYLMFPGNWKJWCH-UHFFFAOYSA-N 458.923 5.677 5 20 JKBD CC(C)S(=O)(=O)Cc1ccc(NC(=O)c2ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])cc2)cc1 497777365 YTSPAPZQOBLAGL-UHFFFAOYSA-N 488.949 5.616 5 20 JKBD C[C@@H](Nc1ccc(C(=O)Nc2c(-c3ccccc3)nc3ccccn23)cc1[N+](=O)[O-])c1ccccn1 505992445 QMCKOWJFKLHBED-GOSISDBHSA-N 478.512 5.730 5 20 JKBD C[C@@H](NC(=O)c1ccc(N[C@H](C)c2ccccn2)c([N+](=O)[O-])c1)c1cccc(C(F)(F)F)c1 505996372 NZPGIZNVORYBCS-HUUCEWRRSA-N 458.440 5.673 5 20 JKBD C[C@@H](Nc1ccc(C(=O)Nc2nc3ccc(Cl)cc3s2)cc1[N+](=O)[O-])c1ccccn1 506236545 RQMNXDRQFKICEN-GFCCVEGCSA-N 453.911 5.678 5 20 JKBD CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)C1CCN(C(=O)c2cccc3ccccc23)CC1 509718585 IIBQFQUMICOCRG-UHFFFAOYSA-N 459.546 5.037 5 20 JKBD COCCN(C(=O)COc1cc(C)ccc1C(C)C)c1nc(-c2ccc([N+](=O)[O-])cc2)cs1 514620467 RNTAAIARZBCYSV-UHFFFAOYSA-N 469.563 5.209 5 20 JKBD COc1ccc(-n2c(S[C@@H](C)C(=O)Nc3cccc([N+](=O)[O-])c3C)nnc2-c2ccccc2)cc1 514955276 ORBHEXZGBQTLMK-KRWDZBQOSA-N 489.557 5.279 5 20 JKBD C[C@@H](NCc1ccc(-c2cccc([N+](=O)[O-])c2)o1)c1cc2c(cc1Br)OCCO2 518266765 DTBHEHRFZBUGIA-CYBMUJFWSA-N 459.296 5.239 5 20 JKBD CCOC(=O)c1c(NC(=O)c2cc(C)cc([N+](=O)[O-])c2)sc(C(=O)Nc2ccc(C)cc2C)c1C 518911773 ZVHMAZSPPNIJHX-UHFFFAOYSA-N 495.557 5.571 5 20 JKBD COc1ccc([N+](=O)[O-])cc1S(=O)(=O)Nc1ccc(Oc2ccccc2)cc1C(F)(F)F 520703213 QBVJVAANGZUOKU-UHFFFAOYSA-N 468.409 5.215 5 20 JKBD CCS(=O)(=O)c1ccccc1NC(=O)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1 603571918 DKUVBXSLJHMKDF-UHFFFAOYSA-N 460.895 5.086 5 20 JKBD C[C@H]1CCCN(c2ccc(C(=O)Nc3ccc(C(=O)N4CCCC[C@@H]4C)cc3)cc2[N+](=O)[O-])C1 603993311 QVVXMQXLQKILQH-OALUTQOASA-N 464.566 5.098 5 20 JKBD COc1ccc(CC(=O)Nc2ccccc2OCc2ncc(-c3cccc(Cl)c3)o2)cc1[N+](=O)[O-] 609011481 CNDPPUCATWQPKL-UHFFFAOYSA-N 493.903 5.672 5 20 JKBD O=C(Cn1c2ccccc2c(=O)c2ccccc21)N(Cc1ccc(Cl)c(Cl)c1)C1CC1 614981700 VFKURWAAWRCFHP-UHFFFAOYSA-N 451.353 5.653 5 20 JKBD O=C(NCc1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2Cl)cc1)c1ccc(Br)cc1 730762481 PKPWIEDQGGRJJF-UHFFFAOYSA-N 488.725 5.193 5 20 JKBD CC(C)N(Cc1nnc(-c2cccc([N+](=O)[O-])c2)o1)C(=O)CCc1ccc(-c2ccccc2F)o1 733198751 TZQTWCMSKZTCGE-UHFFFAOYSA-N 478.480 5.414 5 20 JKBD C[C@@H](OC(=O)c1csc(-c2ccc(Cl)c(Cl)c2)n1)C(=O)Nc1ccccc1[N+](=O)[O-] 744604405 FQJMGWPVEXBMKE-SNVBAGLBSA-N 466.302 5.209 5 20 JKBD O=C(COc1ccc([N+](=O)[O-])c(F)c1)N(Cc1ccc(F)cc1)c1nc2ccccc2s1 749130695 LYAGFOZUOUZBQW-UHFFFAOYSA-N 455.442 5.095 5 20 JKBD O=C(OCC(=O)N1c2ccccc2Sc2ccc(Cl)cc21)c1cc([N+](=O)[O-])ccc1Cl 797701003 YQXLDSWPXFONTC-UHFFFAOYSA-N 475.309 5.888 5 20 JKBD C[C@@H](OC(=O)C1CCN(c2ccccc2[N+](=O)[O-])CC1)C(=O)Nc1ccccc1Oc1ccccc1 856475624 UCYLBONSLWNCNX-LJQANCHMSA-N 489.528 5.174 5 20 JKBD COc1ccc(C)cc1NC(=O)c1cc2ccccc2cc1OS(=O)(=O)c1cccc([N+](=O)[O-])c1 916100676 FUYCAVNDKGZPGM-UHFFFAOYSA-N 492.509 5.085 5 20 JKBD CS(=O)(=O)c1ccc(Sc2nnc(Nc3ccc(SC(F)F)cc3)s2)c([N+](=O)[O-])c1 916568767 VPPKUXLBUXYDNF-UHFFFAOYSA-N 490.560 5.059 5 20 JKBD Cc1ccccc1C[C@H](C)NC(=O)c1ccccc1NC(=O)c1ccc([N+](=O)[O-])cc1Cl 918635239 NTMOVMKNNNUJCR-INIZCTEOSA-N 451.910 5.170 5 20 JKBD CCCC(=O)Nc1c(Cl)cc(Cl)cc1C(=O)OCC(=O)Nc1cc([N+](=O)[O-])ccc1Cl 919557742 IHCUUHJRKHPNIX-UHFFFAOYSA-N 488.711 5.089 5 20 JKBD CC(C)COC(=O)Nc1cccc(NC(=O)c2ccc(N[C@H](C)c3ccccn3)c([N+](=O)[O-])c2)c1 920225614 GRCDCNDKIIAIDF-QGZVFWFLSA-N 477.521 5.620 5 20 JKBD O=C(OCc1nnc(-c2ccc(Cl)cc2Cl)o1)c1cc([N+](=O)[O-])ccc1N1CCCCC1 920509290 ARVUYNPOKFUYFF-UHFFFAOYSA-N 477.304 5.299 5 20 JKBD COc1ccc(CC(=O)Nc2ccc(C3(NC(=O)c4cc5ccccc5o4)CCC3)cc2)c([N+](=O)[O-])c1 1790571291 NXJMISRWMYLHBF-UHFFFAOYSA-N 499.523 5.340 5 20 JKBD C[C@@H](Sc1ccccn1)C(=O)NC1(c2ccc(NC(=O)c3ccc([N+](=O)[O-])cc3F)cc2)CCC1 1790625193 VVXOMVHTJJWYIN-MRXNPFEDSA-N 494.548 5.057 5 20 JKBD O=C(CCc1c[nH]c2ccc(F)cc12)Nc1ccc(C2(NC(=O)c3ccc([N+](=O)[O-])o3)CCC2)cc1 1791487088 MKNNZSVFIWKPMJ-UHFFFAOYSA-N 490.491 5.189 5 20 JKBD CC[C@@H](C(=O)N1CCC2(CCCN(C(=O)Cc3ccc(Cl)cc3[N+](=O)[O-])C2)CC1)c1ccccc1 1805480342 JDMGEGYETREIJV-HSZRJFAPSA-N 498.023 5.216 5 20 JKBD O=C(CCc1cccs1)N1CCCC2(CCN(C(=O)c3cc4cc([N+](=O)[O-])ccc4s3)CC2)C1 1807223512 MSNPHERTXVGLHX-UHFFFAOYSA-N 497.642 5.349 5 20 JKBD CC(C)c1ccc(C(=O)NC[C@@H]2CCN(C(=O)/C=C/c3ccccc3[N+](=O)[O-])[C@H]2c2cccnc2)cc1 1811957354 MBABFESDBZRFOF-OXXBRZMLSA-N 498.583 5.146 5 20 JKBD CC(C)(C)CCCCCC(=O)Nc1cc([C@H]2CCCCN2C(=O)c2ccc([N+](=O)[O-])o2)[nH]n1 1822113519 DHOPJFSHJZDKFI-QGZVFWFLSA-N 459.547 5.213 5 20 JKBD C[C@@H](C(=O)Nc1cc([C@@H]2CCCCN2C(=O)Cc2ccc(Cl)cc2[N+](=O)[O-])[nH]n1)c1ccccc1 1823492493 XLLHWQCEPLWTGB-IERDGZPVSA-N 495.967 5.010 5 20 JKBD Cc1cccc2cc(C(=O)N3CCC([C@H]4CCCCN4C(=O)c4cc(F)cc([N+](=O)[O-])c4)CC3)[nH]c12 1830617493 RHUJVEFCVGQJLT-XMMPIXPASA-N 492.551 5.071 5 20 JKBD O=C(/C=C/c1ccccc1[N+](=O)[O-])N1CCC([C@H]2CCCCN2C(=O)C[C@H]2C[C@@H]3CC[C@H]2C3)CC1 1831484682 ZYYSLLWYIYIRBY-XBLDVUCKSA-N 479.621 5.054 5 20 JKBD COc1cc(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3ccc(C)c(Cl)c3)CC2)ccc1[N+](=O)[O-] 1832694579 LZOAMRJIMSOJFQ-JOCHJYFZSA-N 499.995 5.112 5 20 JKBD O=C(C[C@@H]1C[C@@H]2CC[C@H]1C2)N1CCC([C@H]2CCCCN2C(=O)/C=C/c2ccccc2[N+](=O)[O-])CC1 1832903817 LHYNSIRJXJTKJR-FZXSSXSTSA-N 479.621 5.054 5 20 JKBD O=C(COC(=O)Cn1c2ccccc2c(=O)c2ccccc21)Nc1ccc(Cl)c(C(F)(F)F)c1 11275968 XYTZWIHLNWIIKN-UHFFFAOYSA-N 488.849 5.009 5 20 JKBD O=C(Cc1csc(-c2cccs2)n1)Oc1ccc(NC(=O)c2cccc([N+](=O)[O-])c2)cc1 15515691 KQSWIYZKSOUVEX-UHFFFAOYSA-N 465.512 5.180 5 20 JKBD CCOc1ccc(NC(=O)c2ccc(NC(=O)c3ccc(NC4CC4)c([N+](=O)[O-])c3)cc2)cc1 15737135 JOMGXTKKSYXBFT-UHFFFAOYSA-N 460.490 5.072 5 20 JKBD Cc1cc(C)c(NC(=O)COC(=O)c2ccc(NCc3ccccc3)c([N+](=O)[O-])c2)c(Cl)c1 20867143 UOHDHRULQPLUKX-UHFFFAOYSA-N 467.909 5.273 5 20 JKBD COc1cc(/C=C(\Cl)c2nc3scc(-c4cccs4)c3c(=O)[nH]2)cc([N+](=O)[O-])c1O 21191047 QVTIHVMQGZDLGC-WZUFQYTHSA-N 461.908 5.072 5 20 JKBD O=C(Nc1cccc(NC(=O)C2CC2)c1)c1ccc(NCc2ccccc2Cl)c([N+](=O)[O-])c1 46576849 UURQATVSJQMCNL-UHFFFAOYSA-N 464.909 5.461 5 20 JKBD COc1cc(C(=O)N[C@H](c2ccccc2)c2ccncc2)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 104831350 RHDXVQXMKQBEIP-RUZDIDTESA-N 489.915 5.964 5 20 JKBD Cc1ccccc1-n1ncc(C(=O)Nc2nc(-c3cccc([N+](=O)[O-])c3)c(C)s2)c1C(F)(F)F 195704111 JNICBTPWQCSPIV-UHFFFAOYSA-N 487.463 5.792 5 20 JKBD CCOc1cc(NC(=O)C(C)(C)c2ccc(Br)cc2)c([N+](=O)[O-])cc1OCC 302937169 JVJZVUBFNFBXSO-UHFFFAOYSA-N 451.317 5.071 5 20 JKBD O=C(Cc1ccc(NC(=O)c2cc3ccccc3o2)cc1)Nc1cc(-c2cccc([N+](=O)[O-])c2)n[nH]1 303153064 OAKBZFHZKQVYQG-UHFFFAOYSA-N 481.468 5.165 5 20 JKBD O=C(C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)N1CC[C@H]1c1ccccc1 478840329 ZRYABMJOHFCKQZ-OWFGXHLJSA-N 455.539 6.109 5 20 JKBD CC[C@@H](C)Sc1ccc(NC(=O)c2cc(OC)c(OC(F)F)cc2[N+](=O)[O-])c(C(F)(F)F)c1 499586326 DHYPDISGLPGPMZ-SNVBAGLBSA-N 494.438 6.367 5 20 JKBD COc1cc(C(=O)N[C@@H](c2ccccc2)C(C)(C)C)c([N+](=O)[O-])cc1OCc1cscn1 512337581 IDCDYYSRGHCEBX-NRFANRHFSA-N 455.536 5.156 5 20 JKBD O=[N+]([O-])c1ccccc1CN(Cc1ccco1)S(=O)(=O)c1cc(C(F)(F)F)ccc1Cl 514592123 BMHVOAXQEXEHRB-UHFFFAOYSA-N 474.844 5.251 5 20 JKBD CC(=O)NCc1ccc(-c2nc(NC(=O)c3cc4ccccc4c4cccnc34)sc2C)s1 515283676 JTXARLLJSYLHME-UHFFFAOYSA-N 472.595 5.770 5 20 JKBD Cc1csc(Sc2ccc(C(=O)Nc3cccc(-c4cn5cccnc5n4)c3)cc2[N+](=O)[O-])n1 515621417 HIMYXCZWRJFRNT-UHFFFAOYSA-N 488.554 5.473 5 20 JKBD O=C(COc1ccc(-c2ccccc2)cc1[N+](=O)[O-])N1N=C(c2ccco2)C[C@@H]1c1ccco1 516787874 UUVLYWBKGVWWGY-HXUWFJFHSA-N 457.442 5.205 5 20 JKBD COc1cc2c(cc1OC)CCN([C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1)CC2 518600282 QDJZQDIZUUZXDZ-VWLOTQADSA-N 495.963 5.046 5 20 JKBD COc1cc(CNCc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)ccc1OCC(F)(F)F 521819675 VEGKSMBQNNPDTO-UHFFFAOYSA-N 452.454 5.563 5 20 JKBD C[C@@H](c1ccccc1F)N(C)C(=O)c1ccc(C(=O)N(C)[C@@H](C)c2ccccc2F)c([N+](=O)[O-])c1 524353038 HWCIVJJZMFEDJS-IRXDYDNUSA-N 481.499 5.539 5 20 JKBD NC(=O)c1ccc(CSCc2csc(-c3ccc(C(F)(F)F)cc3)n2)c([N+](=O)[O-])c1 567279817 CMQWZMGCPRRDGE-UHFFFAOYSA-N 453.467 5.269 5 20 JKBD CCCOc1cc(NC(=O)N2CCC[C@H]2c2ccc(OC)cc2)c([N+](=O)[O-])cc1OCCC 603652871 JPKQEPOHGCBCLV-FQEVSTJZSA-N 457.527 5.550 5 20 JKBD Cc1cccc(-c2nnc(S[C@H](C)C(=O)Nc3nc(-c4cccc([N+](=O)[O-])c4)cs3)o2)c1 614785678 MFOUORMLBXGPKH-CYBMUJFWSA-N 467.532 5.196 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)O[C@@H](C(=O)Nc2cc(C)ccc2C)c2ccccc2)cc1SC 728650791 KGNVMKLGNCOUTN-HSZRJFAPSA-N 480.542 5.479 5 20 JKBD CC(C)N(Cc1nnc(-c2cccc([N+](=O)[O-])c2)o1)C(=O)c1cn(Cc2ccccc2)c2ccccc12 733195860 AYZFESDSMOXJEK-UHFFFAOYSA-N 495.539 5.699 5 20 JKBD CCc1cccc(CC)c1NC(=O)[C@H](C)OC(=O)c1csc(-c2cccc([N+](=O)[O-])c2)n1 747962866 VPEXNSVTXWTPGW-AWEZNQCLSA-N 453.520 5.027 5 20 JKBD O=C(C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)OCC(=O)c1ccc(F)cc1F 748578973 CPXRJALWVPVCMY-LFIBNONCSA-N 494.475 5.840 5 20 JKBD COC(=O)c1c(-c2ccccc2Cl)csc1NC(=O)c1cc(SC)ccc1[N+](=O)[O-] 758123585 PDGWBMCNVGZFLD-UHFFFAOYSA-N 462.936 5.738 5 20 JKBD C[C@H](Sc1ncc(-c2ccccc2)n1C[C@@H]1CCCO1)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 828604403 OXNBHJIRAXFENA-JXFKEZNVSA-N 477.546 5.541 5 20 JKBD C[C@@H](Nc1ccc(-c2nc(-c3cccnc3Oc3ccccc3)no2)cc1[N+](=O)[O-])c1ccccn1 904455084 XYCXSWWOEGYKMJ-QGZVFWFLSA-N 480.484 6.067 5 20 JKBD CC(C)OC(=O)C[C@@H](NC(=O)/C=C\c1ccc2ccc(Cl)cc2n1)c1ccccc1[N+](=O)[O-] 912906074 WSMBUELJPPTGSR-AXUYNXDZSA-N 467.909 5.009 5 20 JKBD O=C(OCc1nc2ccccc2c2ccccc12)[C@H]1CCCN1C(=O)c1ccccc1OC(F)F 915531810 DNZCYZNMQCFCPW-HSZRJFAPSA-N 476.479 5.337 5 20 JKBD CC(=O)N(c1ccc(Cl)cc1)c1nc(COC(=O)c2c[nH]c3cc([N+](=O)[O-])ccc23)cs1 919024262 TYFSJAWJCHPQFP-UHFFFAOYSA-N 470.894 5.228 5 20 JKBD CC(C)c1ccc(NC(=O)COC(=O)c2ccc(N[C@@H](C)c3ccccn3)c([N+](=O)[O-])c2)cc1 920545716 IOQGEYIFODVLQL-KRWDZBQOSA-N 462.506 5.082 5 20 JKBD Cc1snc2sc(C(=O)NC3(c4ccc(NC(=O)c5ccc([N+](=O)[O-])o5)cc4)CCC3)cc12 1785748933 OADZYMVKPFHKOA-UHFFFAOYSA-N 482.543 5.229 5 20 JKBD O=C(Cc1ccc([N+](=O)[O-])cc1F)NC1(c2ccc(NC(=O)[C@H]3CCCCC3(F)F)cc2)CCC1 1786464479 CARHFGOPHFBCOX-HXUWFJFHSA-N 489.494 5.236 5 20 JKBD Cc1cnc(Cl)c(C(=O)NC2(c3ccc(NC(=O)Cc4cc([N+](=O)[O-])ccc4F)cc3)CCC2)c1 1786672971 YDRDBHQJYYTDDN-UHFFFAOYSA-N 496.926 5.081 5 20 JKBD O=C(CCc1ccco1)Nc1ccc(C2(NC(=O)CSc3ccccc3[N+](=O)[O-])CCC2)cc1 1786902821 FCVOYLGACMHFSE-UHFFFAOYSA-N 479.558 5.047 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)[C@@H]3CCC[C@@H]4CCCC[C@H]43)CCC2)cc1)c1ccc([N+](=O)[O-])[nH]1 1790185436 AAVQKWXEGPNFPJ-IOMROCGXSA-N 464.566 5.277 5 20 JKBD CC1=CC[C@H](C(=O)NC2(c3ccc(NC(=O)c4ccc([N+](=O)[O-])cc4F)cc3)CCC2)CC1 1790622313 UMBJJQZIKNLQTJ-KRWDZBQOSA-N 451.498 5.228 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)Nc1ccc(C2(NC(=O)c3ccnc4ncccc34)CCC2)cc1 1790772400 MIXAXXMDNNZXLJ-UHFFFAOYSA-N 499.502 5.047 5 20 JKBD Cc1ccncc1C(=O)NC1(c2ccc(NC(=O)c3cc4cc([N+](=O)[O-])ccc4s3)cc2)CCC1 1791010819 FWFXKPRNMNWZRX-UHFFFAOYSA-N 486.553 5.574 5 20 JKBD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CCc1cccc([N+](=O)[O-])c1)c1ccc(Oc2ccccc2)cc1 1793940842 TYZHKHSBROZSHD-BKFWDETESA-N 499.567 5.272 5 20 JKBD O=C(Cc1ccc2ccccc2c1)Nc1cc([C@@H]2CCCCN2C(=O)/C=C/c2ccc([N+](=O)[O-])o2)[nH]n1 1816824728 YSNKFMOUONDDEP-XDQZKXAQSA-N 499.527 5.012 5 20 JKBD Cc1cc(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)CSc3ccccc3[N+](=O)[O-])CC2)ccc1F 1830570188 RAWVMBMXGPGADZ-JOCHJYFZSA-N 499.608 5.068 5 20 JKBD O=C(CCc1cccc([N+](=O)[O-])c1)N1CCC([C@H]2CCCCN2C(=O)c2cccc3ccoc23)CC1 1830987025 HHQXDYLRTKEDKU-RUZDIDTESA-N 489.572 5.207 5 20 JKBD C[C@]1(C(=O)N2CCC([C@@H]3CCCCN3C(=O)CSc3ccccc3[N+](=O)[O-])CC2)CC=CCC1 1831777626 ULEYMCPOLYKZTR-LVXARBLLSA-N 485.650 5.053 5 20 JKBD C[C@@]1(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)CSc3ccccc3[N+](=O)[O-])CC2)CC=CCC1 1832410826 JVMBLUOMNJBARE-QFQXNSOFSA-N 485.650 5.053 5 20 JKBD CC(C)C1(C(=O)N2CCC([C@H]3CCCCN3C(=O)/C=C/c3ccccc3[N+](=O)[O-])CC2)CCC1 1832904429 SBADSTZSJHPJRU-HRBBJJPOSA-N 467.610 5.054 5 20 JKBD CC(C)Cn1c(S[C@H](C)C(=O)Nc2cc([N+](=O)[O-])ccc2Cl)nnc1-c1ccccc1F 3457660 AJQOMBOQIKLQHZ-CYBMUJFWSA-N 477.949 5.421 5 20 JKBD O=C(Cn1c2ccccc2c(=O)c2ccccc21)OCC(=O)N1c2ccccc2Sc2ccccc21 11276276 SIQSJBJQAKBATG-UHFFFAOYSA-N 492.556 5.527 5 20 JKBD CC(=O)Nc1ccc(NC(=O)c2ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])cc2)cc1Cl 14123525 ILZPHIJCHMINME-UHFFFAOYSA-N 460.273 5.905 5 20 JKBD COc1cc2c(cc1OC)[C@H](c1cccs1)N(C(=O)c1ccc(Cl)c([N+](=O)[O-])c1)CC2 16002490 ARHGOCDONLQXNZ-OAQYLSRUSA-N 458.923 5.115 5 20 JKBD Cc1ccc(-n2cnnc2S[C@@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2C(F)(F)F)cc1Cl 25027643 DGTRQGHPMWPDLP-NSHDSACASA-N 485.875 5.275 5 20 JKBD CC(C)(C)CC(=O)N1CCN(C(=O)c2ccc(Sc3nc4ccccc4s3)c([N+](=O)[O-])c2)CC1 25787380 OVQHXPLYCRQGMM-UHFFFAOYSA-N 498.630 5.076 5 20 JKBD C[C@@H](OC(=O)Cc1csc(-c2ccccc2Cl)n1)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl 26674394 WMTKLYGTYGXKNS-LLVKDONJSA-N 480.329 5.138 5 20 JKBD Cc1c(C(=O)Nc2ccc(NC(=O)c3ccc(F)cc3)cc2C(F)(F)F)cccc1[N+](=O)[O-] 59254130 KJVWSBYETUYBEG-UHFFFAOYSA-N 461.371 5.566 5 20 JKBD O=C(Nc1cccc(CNc2ccc(C(=O)c3ccccc3)cc2[N+](=O)[O-])c1)c1ccncc1 59734186 BTDYSVYZDYHDBJ-UHFFFAOYSA-N 452.470 5.085 5 20 JKBD COc1ccc(-c2nc(NC(=O)c3ccc(N[C@@H](C)c4ccccn4)c([N+](=O)[O-])c3)sc2C)cc1 72016527 MZDFWKKDLIOCQK-HNNXBMFYSA-N 489.557 5.856 5 20 JKBD CCC[C@H](NC(=O)Cn1c2ccccc2c(=O)c2ccccc21)c1cccc(C(F)(F)F)c1 72084877 LNWNBWUVZKVPLW-NRFANRHFSA-N 452.476 5.831 5 20 JKBD O=C(Nc1ccccc1-c1nc2ccccc2s1)[C@@H]1CC(=O)N(c2ccc(F)c([N+](=O)[O-])c2)C1 105660111 QDLTVOVOIJXWEU-CQSZACIVSA-N 476.489 5.002 5 20 JKBD C[C@@H](Nc1ccc(C(=O)N2CCC(C(=O)c3cc(F)ccc3F)CC2)cc1[N+](=O)[O-])c1ccccn1 108828502 QKESQPXUUYGTDK-MRXNPFEDSA-N 494.498 5.176 5 20 JKBD CN(C(=O)c1ccc(NC(=O)N2CCN(c3ccccc3[N+](=O)[O-])CC2)cc1Cl)C1CCCCC1 117363573 YIDZOUANXSBQRR-UHFFFAOYSA-N 499.999 5.007 5 20 JKBD C[C@@H](Nc1ccc(C(=O)NCCc2cc(Cl)cc(Cl)c2)cc1[N+](=O)[O-])c1ccccn1 303071788 XJXWNGGZUKLQTK-CQSZACIVSA-N 459.333 5.442 5 20 JKBD Cc1csc(Sc2ccc(C(=O)N3CCC(OCc4ccccc4)CC3)cc2[N+](=O)[O-])n1 477055126 HLDCYTHRFJQMBM-UHFFFAOYSA-N 469.588 5.332 5 20 JKBD Cc1nc(CCNC(=O)C/C(=C\c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)cs1 485405011 BUWCMSXFSHKVFZ-SFQUDFHCSA-N 464.572 5.259 5 20 JKBD COc1ccc(Oc2ccc([N+](=O)[O-])cc2C(=O)N2CCC[C@@H](CN3CCCCCC3)C2)cc1 487944244 JZJLPKMWAJJWOX-FQEVSTJZSA-N 467.566 5.124 5 20 JKBD COCCN(C(=O)c1sc(C(C)(C)C)nc1C)c1nc(-c2ccc([N+](=O)[O-])cc2)cs1 488381324 FLUARSYRGDSEIC-UHFFFAOYSA-N 460.581 5.074 5 20 JKBD CC1CCN(C(=O)C2CCN(C(=O)c3ccc(Oc4ccc(Cl)cc4[N+](=O)[O-])cc3)CC2)CC1 488823531 IYZGWEKNARRLLC-UHFFFAOYSA-N 485.968 5.151 5 20 JKBD CC(=O)Nc1ccc(-c2csc(NC(=O)c3csc(-c4ccc([N+](=O)[O-])cc4)n3)n2)c(F)c1 496393418 HODMDNNSWOIFTA-UHFFFAOYSA-N 483.506 5.192 5 20 JKBD Cc1cc(CNC(=O)c2c3c(nc4ccccc24)/C(=C/c2ccc([N+](=O)[O-])cc2)CCC3)on1 496613866 WTFWEVLORIBAEK-NBVRZTHBSA-N 454.486 5.246 5 20 JKBD CCS(=O)(=O)Nc1ccc(NC(=O)c2ccc(Sc3ccc(C)cc3)c([N+](=O)[O-])c2)cc1C 497331883 RCSBYZSXAIXGJE-UHFFFAOYSA-N 485.587 5.377 5 20 JKBD C[C@H](Nc1ccc(C(=O)Nc2ccc(I)cc2)cc1[N+](=O)[O-])c1ccccn1 505995880 KZUXYRFQXOWLRD-ZDUSSCGKSA-N 488.285 5.020 5 20 JKBD Cc1nc(NC(=O)C/C(=C/c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)sc1C 521330794 FXGAGKRUZBTRJG-WJDWOHSUSA-N 450.545 5.847 5 20 JKBD COc1cc(C(=O)Nc2ccc(N[C@@H](C)c3ccccc3)c(Cl)c2)c([N+](=O)[O-])cc1OC(F)F 524422266 GSMQHVMYGGBALI-ZDUSSCGKSA-N 491.878 6.284 5 20 JKBD COc1cc(C(=O)Nc2cc(Br)ccc2Cl)c([N+](=O)[O-])cc1OCc1cscn1 564459240 RGXSJKKYBDLEPW-UHFFFAOYSA-N 498.742 5.307 5 20 JKBD COc1cc(C(=O)Nc2ccc(F)c(NC(=O)C3CCCCC3)c2)c([N+](=O)[O-])cc1OC(F)F 603757432 NKXFAKHGRZETTQ-UHFFFAOYSA-N 481.427 5.115 5 20 JKBD C[C@@H]1C[C@H]1c1ccc(CN(C(=O)C2CCN(c3ccc(C(F)(F)F)cc3[N+](=O)[O-])CC2)C2CC2)o1 603877452 JJVKKVAHMFALLN-FOIQADDNSA-N 491.510 5.738 5 20 JKBD CCOc1ccc(NC(=O)C2CCN(c3ccc(C(F)(F)F)cc3[N+](=O)[O-])CC2)c(C)c1 604000095 LACKXZROQSTQFY-UHFFFAOYSA-N 451.445 5.176 5 20 JKBD O=C(c1ccc(Nc2ccccc2)c([N+](=O)[O-])c1)N1C[C@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1 604262457 JNOJCQOLKOVXIA-ZIAGYGMSSA-N 461.362 5.541 5 20 JKBD CCOc1cc(C(=O)Nc2ccc(Sc3nc(C)cs3)c(Cl)c2)c([N+](=O)[O-])cc1OC 608875095 YKURZHGWCIBSAX-UHFFFAOYSA-N 479.967 5.824 5 20 JKBD O=C(c1c2c(nc3ccccc13)/C(=C/c1cccc([N+](=O)[O-])c1)CCC2)N1CC[C@@H](N2CCCC2)C1 608905715 IDFWCFOCYKADRC-ZGZCKBCJSA-N 482.584 5.330 5 20 JKBD NC(=O)CCCCCn1c(SCc2nc3ccccc3c3ccccc23)nc2ccccc2c1=O 651007175 FQTQIIQDQASUPQ-UHFFFAOYSA-N 482.609 5.436 5 20 JKBD O=[N+]([O-])c1c(F)cccc1S(=O)(=O)Nc1nc(C2CC2)c(Cc2ccccc2Cl)s1 727252869 RDTKLVWZGPGRIE-UHFFFAOYSA-N 467.931 5.113 5 20 JKBD Cc1cc(O[C@@H](C)c2ccccc2)ccc1NC(=O)c1cc([N+](=O)[O-])ccc1N1CCOCC1 728010393 IHWZDLYQQOCGGP-IBGZPJMESA-N 461.518 5.132 5 20 JKBD CCOC(=O)c1sc(-c2cccc([N+](=O)[O-])c2)cc1NC(=O)c1cc(F)c(Cl)nc1Cl 728801161 NWHXMNDCJAHNRR-UHFFFAOYSA-N 484.292 5.593 5 20 JKBD Cn1cnnc1-c1cccc(NC(=O)CCC(=O)c2ccc3ccc4cccc5ccc2c3c45)c1 729260381 DVUPMGIRNZXHSZ-UHFFFAOYSA-N 458.521 5.981 5 20 JKBD CCc1ccc(N(C(C)=O)c2nc(COC(=O)c3cc([N+](=O)[O-])c(C)c([N+](=O)[O-])c3C)cs2)cc1 748949372 VCUDENAADPWTAV-UHFFFAOYSA-N 498.517 5.180 5 20 JKBD CCCn1c(C)c(C(=O)O[C@@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)c2cc(OC)ccc21 792729210 QUYDTZPMTMJEAB-HNNXBMFYSA-N 464.478 5.245 5 20 JKBD O=C(Cn1c2ccccc2c(=O)c2ccccc21)Oc1ccc2c3c(c(=O)oc2c1)CCCCC3 835767583 VOODQRLICCQRHL-UHFFFAOYSA-N 465.505 5.136 5 20 JKBD CC(C)N(Cc1nnc(-c2cccc([N+](=O)[O-])c2)o1)C(=O)CCSc1ccc(Cl)cc1 864244579 CSNLYJPNHDCKER-UHFFFAOYSA-N 460.943 5.218 5 20 JKBD O=C(Oc1ccc(N2CCOC2=O)cc1)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1 917077119 RGPZYMXZZSHULG-UHFFFAOYSA-N 454.822 5.216 5 20 JKBD O=[N+]([O-])c1ccc2nc(SCc3nc(-c4cc(Br)cs4)no3)sc2c1 918155918 UKNFAIXJUQKQLD-UHFFFAOYSA-N 455.340 5.371 5 20 JKBD C[C@H](Nc1ccc(C(=O)Oc2ccc(OCc3ccncc3)cc2)cc1[N+](=O)[O-])c1ccccn1 920104847 FGUADEBOLQYMGK-SFHVURJKSA-N 470.485 5.356 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)c3ccc([N+](=O)[O-])o3)CCC2)cc1)c1cccc(-c2ccccc2)n1 1788714393 SPWFMVWCEDQNLJ-UHFFFAOYSA-N 482.496 5.311 5 20 JKBD O=C(NC1(c2ccc(NC(=O)c3cc(C(F)(F)F)c[nH]3)cc2)CCC1)c1cc(F)cc([N+](=O)[O-])c1 1788721710 URYLORUHKPFPOT-UHFFFAOYSA-N 490.413 5.142 5 20 JKBD Cc1cc(C(=O)Nc2ccc(C3(NC(=O)c4cc(-c5ccccc5)no4)CCC3)cc2)ncc1[N+](=O)[O-] 1788766895 MCQWELPFLWKZFP-UHFFFAOYSA-N 497.511 5.015 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)c3ccoc3Cl)CCC2)cc1)c1cc(F)cc([N+](=O)[O-])c1 1790697779 RSQXQXMTIQIXHK-UHFFFAOYSA-N 457.845 5.042 5 20 JKBD Cc1c(C(=O)NC[C@H]2CCN(C(=O)/C=C/C3CCCC3)[C@@H]2c2cccnc2)cc(Cl)cc1[N+](=O)[O-] 1811797628 VIJCLTYMBKDPLG-JBGVHOKCSA-N 496.995 5.018 5 20 JKBD O=C(CCc1ccccc1Cl)Nc1cc([C@H]2CCCCN2C(=O)c2cc(F)cc([N+](=O)[O-])c2)[nH]n1 1817005136 VIZRXTGHJSBADJ-OAQYLSRUSA-N 499.930 5.049 5 20 JKBD O=C(c1ccc(-c2ccccc2)cc1)N1CCC([C@H]2CCCCN2C(=O)c2ccc([N+](=O)[O-])o2)CC1 1823616787 UVSJVOGPRDKJMW-XMMPIXPASA-N 487.556 5.402 5 20 JKBD O=C(c1ccc([N+](=O)[O-])cc1F)N1CCC([C@H]2CCCCN2C(=O)c2cc(F)ccc2Cl)CC1 1830577759 YSTUNRGCZAHBMP-JOCHJYFZSA-N 491.922 5.074 5 20 JKBD COc1ccc(C(=O)N2CCC([C@H]3CCCCN3C(=O)c3cc(Cl)cc([N+](=O)[O-])c3C)CC2)cc1 1830736324 WAVLJHMZUBAHES-HSZRJFAPSA-N 499.995 5.112 5 20 JKBD O=C(CSc1nnc(Nc2ccccc2F)s1)Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1 10316229 OUCBLSYABFKVIH-UHFFFAOYSA-N 488.551 5.183 5 20 JKBD C[C@H](Sc1nnc(Cc2ccccc2)n1-c1ccccc1)C(=O)Nc1ccc(F)c([N+](=O)[O-])c1 12105601 ZEQKHGMTFCJKTE-INIZCTEOSA-N 477.521 5.025 5 20 JKBD C[C@H](Sc1nnc(N2CCCC2)n1-c1cccc(Cl)c1)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 17897672 VHJMWZSKVDSUNE-AWEZNQCLSA-N 497.968 5.332 5 20 JKBD COc1cc(C(=O)N(C)CC(=O)Nc2cccc(C)c2C)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 18040944 HNYSTVPXJJBDMM-UHFFFAOYSA-N 497.935 5.377 5 20 JKBD CCOc1c(Br)cc(/C=C(\Cl)c2nc3cc([N+](=O)[O-])ccc3[nH]2)cc1OC 18064333 QIDHBNWOOWXKJW-QPEQYQDCSA-N 452.692 5.378 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Cl)[C@H](NCc1ccc(OC(F)F)cc1)c1ccccc1 21792444 MAUYUBVWPMREHL-HXUWFJFHSA-N 461.852 5.319 5 20 JKBD C[C@@H]1CCC[C@H](n2c(SCc3nnc(-c4ccc([N+](=O)[O-])cc4)o3)nc3ccccc3c2=O)[C@@H]1C 22522920 IKBVEMRYEKQUAO-ZOCZFRKYSA-N 491.573 5.644 5 20 JKBD CCNc1ccc(C(=O)OCc2csc(N(C(C)=O)c3cccc(Cl)c3)n2)cc1[N+](=O)[O-] 26240062 VRJNDHLONUOKDH-UHFFFAOYSA-N 474.926 5.178 5 20 JKBD C[C@H](OC(=O)c1[nH]c2ccccc2c1Cl)C(=O)Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1 46767434 ZSWOEAIFFKWTBD-NSHDSACASA-N 470.894 5.037 5 20 JKBD Cc1ccc(-c2csc(NC(=O)c3cc(Br)ccc3Cl)n2)cc1[N+](=O)[O-] 105352601 WJYUBPKZMTWQLE-UHFFFAOYSA-N 452.717 5.695 5 20 JKBD COc1cc(C)ccc1Oc1ccc(NC(=O)c2ccc(Cn3nc(C)c([N+](=O)[O-])c3C)cc2)cn1 106231842 SYKWHMOHDADQMO-UHFFFAOYSA-N 487.516 5.213 5 20 JKBD C[C@@H]1CN(C(=O)c2ccccc2NC(=O)c2ccc([N+](=O)[O-])cc2Cl)C[C@@H](c2ccccc2)O1 109046428 BYOYAVBTKNTFHZ-MWTRTKDXSA-N 479.920 5.103 5 20 JKBD CCOc1ccc2c(c1)[C@@H](C)CC(C)(C)N2C(=O)c1ccc(Sc2nncn2C)c([N+](=O)[O-])c1 483330488 ABZOTMQEQOSRDL-HNNXBMFYSA-N 481.578 5.206 5 20 JKBD C[C@H](Nc1ccc(C(=O)N(Cc2cccs2)C[C@H]2CCCO2)cc1[N+](=O)[O-])c1ccccn1 506164524 SKKOCUWVDNZJLL-PKOBYXMFSA-N 466.563 5.046 5 20 JKBD C[C@H]1c2[nH]c3ccccc3c2[C@H](c2ccccc2Cl)CN1C(=O)CCn1cc([N+](=O)[O-])cn1 508804635 BVAUOUMKTVVEBQ-KXBFYZLASA-N 463.925 5.051 5 20 JKBD Cc1ccc(C(=O)Nc2ccccc2)cc1NC(=O)c1ccc(N[C@H](C)c2ccccn2)c([N+](=O)[O-])c1 508875824 SRGHEDHCXQIYIR-LJQANCHMSA-N 495.539 5.976 5 20 JKBD Cc1ccc(Sc2ccc(C(=O)Nc3ccc(NC(=O)c4cnoc4C)cc3)cc2[N+](=O)[O-])cc1 512542736 UHENTFHAHOCESB-UHFFFAOYSA-N 488.525 5.855 5 20 JKBD O=C(CCNc1ccccc1[N+](=O)[O-])Nc1ccc(NC(=O)c2ccccc2)cc1C(F)(F)F 514449527 CZHZEUXDMZBYBZ-UHFFFAOYSA-N 472.423 5.307 5 20 JKBD CCN(C(=O)[C@H](C)Sc1ccc([N+](=O)[O-])cc1)[C@@H](c1cccnc1)c1ccc(F)c(F)c1 520502821 WRGAVIUPZFEBQU-OYHNWAKOSA-N 457.502 5.387 5 20 JKBD Cc1cccc(C(=O)Nc2cc(OCC(F)(F)F)cc(OCC(F)(F)F)c2)c1[N+](=O)[O-] 590665410 OBIQHLGNZHPEHH-UHFFFAOYSA-N 452.307 5.038 5 20 JKBD Cc1cc(NC(=O)c2ccc(SCc3csc(C)n3)cc2)n(-c2ccc([N+](=O)[O-])cc2)n1 592945159 DBJYIVUZHLCQCM-UHFFFAOYSA-N 465.560 5.398 5 20 JKBD CC(=O)CCc1ccc2oc(C(=O)N(Cc3ccccc3[N+](=O)[O-])CC(F)(F)F)c(C)c2c1 603742407 UIRDGAMQSHCIFZ-UHFFFAOYSA-N 462.424 5.376 5 20 JKBD CCOc1cc([N+](=O)[O-])c(C(=O)Nc2ccc(NC(=O)c3ccoc3)cc2C(F)(F)F)cc1OC 603761350 FEEJNSQZGLNFFA-UHFFFAOYSA-N 493.394 5.119 5 20 JKBD Cc1ccc(S(=O)(=O)Nc2ccc(N[C@H](C)C(=O)Nc3ccccc3C(C)C)cc2)cc1[N+](=O)[O-] 619639142 MOYIIBPVQZRXIE-GOSISDBHSA-N 496.589 5.267 5 20 JKBD COc1ccc(NC(=S)/C(=C(/O)c2ccc([N+](=O)[O-])cc2)[n+]2ccc(C)cc2)cc1Cl 726961967 NEARJYNUTDVHNY-UHFFFAOYSA-O 456.931 5.176 5 20 JKBD COC(=O)c1cc2ccccc2cc1NC(=O)c1ccc(N[C@@H](C)c2ccccn2)c([N+](=O)[O-])c1 729252358 WSQKLZOBFQUYAD-INIZCTEOSA-N 470.485 5.355 5 20 JKBD O=C(Cc1csc(-c2ccc(Cl)cc2Cl)n1)OCc1nnc(-c2ccc([N+](=O)[O-])cc2)o1 747258833 MQCATHDDVVPVKW-UHFFFAOYSA-N 491.312 5.361 5 20 JKBD O=C(Nc1cccc(NC(=O)c2cc(F)ccc2[N+](=O)[O-])c1)Nc1cccc(C(F)(F)F)c1 751107840 OKCDBZKPWHZVNQ-UHFFFAOYSA-N 462.359 5.649 5 20 JKBD Cc1[nH]c2ccc(Br)cc2c1CC(=O)O[C@@H](C)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 915434007 NGMOSVINSCYKNT-LBPRGKRZSA-N 485.294 5.044 5 20 JKBD Cc1ccc(NC(=O)[C@H](OC(=O)c2csc(-c3ccc(C)o3)n2)c2ccccc2)c([N+](=O)[O-])c1 915467081 DTQGPZLLHINTIX-OAQYLSRUSA-N 477.498 5.465 5 20 JKBD O=[N+]([O-])c1ccc(F)cc1CSc1nnc(SCc2cc(F)ccc2[N+](=O)[O-])s1 915790517 LAGFYHGZCGRULI-UHFFFAOYSA-N 456.477 5.217 5 20 JKBD C[C@H](NC(=O)c1cc([N+](=O)[O-])ccc1N1CCCC1)c1cccc(NC(=O)Cc2ccccc2F)c1 918587012 YUPRYMLNKTWVLA-SFHVURJKSA-N 490.535 5.006 5 20 JKBD O=C(Cn1c2ccccc2c(=O)c2ccccc21)OCc1cc(Cl)ccc1OCc1cccnc1 919056013 RYZCMNXIGVXLEN-UHFFFAOYSA-N 484.939 5.526 5 20 JKBD CC(C)c1ccc(SCC(=O)O[C@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2C(F)(F)F)cc1 919319718 RFVVNANTKYTDFY-CYBMUJFWSA-N 470.469 5.400 5 20 JKBD COc1ccc(NC(=O)c2c(NC(=O)c3ccc([N+](=O)[O-])s3)sc3c2CCCC3)cc1 929063846 HZESZMACZSTFFN-UHFFFAOYSA-N 457.533 5.110 5 20 JKBD Cc1cnc(Cl)c(C(=O)Nc2ccc(C3(NC(=O)Cc4cc([N+](=O)[O-])ccc4F)CCC3)cc2)c1 1787567354 HHXWLODZHDHITQ-UHFFFAOYSA-N 496.926 5.081 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)C3(c4cccc([N+](=O)[O-])c4)CCC3)CCC2)cc1)[C@@H]1C[C@]1(F)Cl 1791675147 QBMZLYRVSGMJOB-NBGIEHNGSA-N 485.943 5.075 5 20 JKBD COc1cc(C(=O)Nc2ccc(C3(NC(=O)[C@H]4C[C@@H]4c4ccccc4)CCC3)cc2)ccc1[N+](=O)[O-] 1792165411 JTABKLBHDZCVFG-PKTZIBPZSA-N 485.540 5.155 5 20 JKBD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1csc2c1CCCC2)c1cc2cc([N+](=O)[O-])ccc2s1 1798050872 WQAJHYNXVPFXTI-BJWYYQGGSA-N 495.626 5.315 5 20 JKBD CC1(C)CCC(CC(=O)NC[C@@H]2CCN(C(=O)c3cccc(F)c3[N+](=O)[O-])[C@H]2c2cccnc2)CC1 1808901692 IEOWCPUOEYWEAM-RDPSFJRHSA-N 496.583 5.055 5 20 JKBD Cc1c(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)[C@@H]3CCC[C@@H]3C)[nH]n2)cc(Cl)cc1[N+](=O)[O-] 1821293963 MMABIMQTQDBUKE-CRFBAAHOSA-N 473.961 5.022 5 20 JKBD CC(F)(F)C(C)(C)C(=O)N1CCCC[C@H]1C1CCN(C(=O)Cc2ccc(Cl)cc2[N+](=O)[O-])CC1 1824628861 MPHQYRUZPJSAGS-IBGZPJMESA-N 499.986 5.092 5 20 JKBD Cc1c(C(=O)N2CCCC[C@H]2C2CCN(C(=O)Cc3ccccc3)CC2)cc(Cl)cc1[N+](=O)[O-] 1830736718 ZAOJHPUKIAXYGR-QHCPKHFHSA-N 483.996 5.033 5 20 JKBD CC(C)(C)C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)CC1 1831061448 SRLOVUNSXMVLFI-IBGZPJMESA-N 457.596 5.089 5 20 JKBD COc1ccc(-c2nnc(SCc3nnc(-c4ccc([N+](=O)[O-])cc4)o3)n2C2CCCCC2)cc1 16050521 HVUXGCZGFNMSEN-UHFFFAOYSA-N 492.561 5.709 5 20 JKBD CC(C)n1c(SCc2ccc(C(N)=O)cc2[N+](=O)[O-])nnc1-c1ccc(Cl)cc1Cl 17230895 OYZQNEXIVQLXSU-UHFFFAOYSA-N 466.350 5.132 5 20 JKBD Cc1ccc(NC(=O)[C@H](OC(=O)c2csc(-c3cccs3)n2)c2ccccc2)c([N+](=O)[O-])c1 19259276 CFTZTCNWQIGWFF-HXUWFJFHSA-N 479.539 5.625 5 20 JKBD Cc1csc(Sc2ccc(C(=O)Nc3cc(NC(=O)C(C)C)ccc3C)cc2[N+](=O)[O-])n1 46881108 BWQNDBJXZADKNK-UHFFFAOYSA-N 470.576 5.666 5 20 JKBD C[C@H](Nc1ccc(C(=O)Nc2ncc(Cc3ccccc3F)s2)cc1[N+](=O)[O-])c1ccccn1 108831914 NMBSUJFRKQMYLO-HNNXBMFYSA-N 477.521 5.602 5 20 JKBD C[C@@H]1C[C@@H](C)CN(c2ccc(C(=O)Nc3ccc(Cl)cc3C(=O)N3CCCC3)cc2[N+](=O)[O-])C1 302960734 QCYQDMFDWIUOPO-IAGOWNOFSA-N 484.984 5.219 5 20 JKBD C[C@H]1C[C@H](C)CN(C(=O)c2ccccc2NC(=O)c2csc(-c3ccc([N+](=O)[O-])cc3)n2)C1 303040717 PSZFSQUNBBHVHK-HOTGVXAUSA-N 464.547 5.089 5 20 JKBD C[C@H](Sc1nc2cc3ccccc3cc2c(=O)n1C)c1nc(O)c2c3c(sc2n1)C[C@H](C)CC3 495383250 BARAIONPMWNFNZ-KGLIPLIRSA-N 488.638 5.775 5 20 JKBD Cn1cnnc1Sc1ccc(C(=O)N(Cc2ccco2)C23CC4CC(CC(C4)C2)C3)cc1[N+](=O)[O-] 498920563 ZVJVEZHFNKVNDF-UHFFFAOYSA-N 493.589 5.079 5 20 JKBD COc1cc(CCNC(=O)[C@@H](Sc2cc(F)ccc2F)c2ccccc2)c([N+](=O)[O-])cc1OC 499675524 LRALJVLOTUNMEW-QHCPKHFHSA-N 488.512 5.083 5 20 JKBD CCOC(=O)C1CCC(NC(=O)C/C(=C/c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)CC1 503104328 MFSGJYMVNRNFHZ-CYVLTUHYSA-N 493.585 5.373 5 20 JKBD Cc1nnc(NC(=O)c2c3c(nc4ccccc24)/C(=C/c2cccc([N+](=O)[O-])c2)CCC3)s1 509141875 UPBAHXWMKSMHGC-FOWTUZBSSA-N 457.515 5.432 5 20 JKBD Cc1cccc(-n2c(SCC(=O)Nc3c(C)cccc3[N+](=O)[O-])nnc2-c2ccccc2)c1 510432026 WYTRJYPTPIPHDX-UHFFFAOYSA-N 459.531 5.190 5 20 JKBD Cc1csc(Sc2ccc(C(=O)Nc3cc(C(=O)N(C)C)ccc3Cl)cc2[N+](=O)[O-])n1 512328977 NXXWPUKBVWULBX-UHFFFAOYSA-N 476.967 5.118 5 20 JKBD Cc1ccc(Sc2ccc(C(=O)Nc3c(C)cccc3C(=O)N3CCCC3)cc2[N+](=O)[O-])cc1 512347993 SEFQJRMDDSKPLG-UHFFFAOYSA-N 475.570 5.851 5 20 JKBD COc1ccc([C@@H](NC(=O)c2ccc(Cn3nc(C)c([N+](=O)[O-])c3C)cc2)c2ccc(F)cc2)cc1 512752950 FYAFWJXFYSCRFN-VWLOTQADSA-N 488.519 5.124 5 20 JKBD C[C@@H]1CCCN(c2ccc(C(=O)Nc3ccccc3NC(=O)c3ccccc3)cc2[N+](=O)[O-])C1 515905132 SZILVVUNHSDZMA-GOSISDBHSA-N 458.518 5.336 5 20 JKBD C[C@H](NC(=O)c1ccc(N[C@H](C)c2ccccn2)c([N+](=O)[O-])c1)c1ccc(OCC(F)(F)F)cc1 516322282 DHHVWSMDPTWFQC-JKSUJKDBSA-N 488.466 5.595 5 20 JKBD Cc1csc(CCCCNCc2ccc(-c3ccc([N+](=O)[O-])cc3Br)o2)n1 518784575 MIYMGOHSZOVGLS-UHFFFAOYSA-N 450.358 5.495 5 20 JKBD Cc1cccc(CN(Cc2ccccn2)C(=O)c2ccc(N[C@@H](C)c3ccccn3)c([N+](=O)[O-])c2)c1 519087957 FACHRDFWDLPKBQ-NRFANRHFSA-N 481.556 5.709 5 20 JKBD CC(C)(C)c1ccc(-c2csc(NC(=O)CNC(=O)c3c(Cl)cccc3[N+](=O)[O-])n2)cc1 520818015 RSGJKSKZDZRJBH-UHFFFAOYSA-N 472.954 5.038 5 20 JKBD COc1cc(CNCC2(c3ccccc3C)CCOCC2)ccc1OCc1ccc([N+](=O)[O-])cc1 520945906 ZCNMDHZXNSGFNO-UHFFFAOYSA-N 476.573 5.329 5 20 JKBD CCOCCOc1c(Cl)cccc1NC(=O)c1ccc(N2CCC[C@@H](C)C2)c([N+](=O)[O-])c1 521729275 NZTSRQQXOVJZPF-MRXNPFEDSA-N 461.946 5.152 5 20 JKBD COc1c(Br)cc(Cl)cc1NC(=O)c1csc(-c2cccc([N+](=O)[O-])c2)n1 522672734 KIRDVWXFWXWLOV-UHFFFAOYSA-N 468.716 5.395 5 20 JKBD O=[N+]([O-])c1cc(CNc2ccc(N=S3(=O)CCCC3)cc2)ccc1Oc1ccccc1Cl 600851511 IADUMENIWKNXEF-UHFFFAOYSA-N 471.966 6.546 5 20 JKBD O=C(Nc1cc(Cl)ccc1-n1cncn1)c1ccc(NCc2ccccc2Cl)c([N+](=O)[O-])c1 603427685 DCHQWOQNTAZTFL-UHFFFAOYSA-N 483.315 5.347 5 20 JKBD O=C(c1cc([N+](=O)[O-])ccc1Sc1ccccc1)N1CCC[C@H](c2nc3ccccc3o2)C1 603626421 QHOVEPRMZJVBNZ-KRWDZBQOSA-N 459.527 5.907 5 20 JKBD COc1cc(C(=O)Nc2ccc3oc4ccccc4c3c2)c([N+](=O)[O-])cc1OCc1cscn1 604350387 DACGCMPHYBNYBT-UHFFFAOYSA-N 475.482 5.791 5 20 JKBD COc1ccc(Br)cc1[C@H]1CCCN1C(=O)c1cc(SC)ccc1[N+](=O)[O-] 604569438 PLMBOSXDLIAYOP-MRXNPFEDSA-N 451.342 5.065 5 20 JKBD CCOc1c(OC)cc(CNc2ccc(C(=O)Nc3ccc(C)cc3)cc2[N+](=O)[O-])cc1OC 608973248 CCHOVHGEXWWUJP-UHFFFAOYSA-N 465.506 5.184 5 20 JKBD COc1cc(CCNC(=O)c2ccccc2-c2ccc(C(F)(F)F)cc2)c([N+](=O)[O-])cc1OC 609603694 LGKQMGXMEJLONE-UHFFFAOYSA-N 474.435 5.270 5 20 JKBD COc1ccc([C@H](NC(=O)C2CCN(c3ccc(C(F)(F)F)cc3[N+](=O)[O-])CC2)C2CC2)cc1 619224926 BODMSFBFRKMIST-JOCHJYFZSA-N 477.483 5.106 5 20 JKBD CC(C)(C)c1cc[n+](/C(C(=S)NC23CC4CC(CC(C4)C2)C3)=C(/O)c2cccc([N+](=O)[O-])c2)cc1 725762347 QGEMLHVMFGRTKM-UHFFFAOYSA-O 492.665 5.949 5 20 JKBD O=[N+]([O-])c1ccc(/C(O)=C(/C(=S)NC23CC4CC(CC(C4)C2)C3)[n+]2ccc3c(c2)CCCC3)cc1 725764509 XXWLETPLLBSSRL-UHFFFAOYSA-O 490.649 5.531 5 20 JKBD O=C(Nc1ccccc1C(=O)Nc1ccc(Cl)cn1)c1csc(-c2ccc([N+](=O)[O-])cc2)n1 726530826 YEVQSILUUPZALF-UHFFFAOYSA-N 479.905 5.271 5 20 JKBD O=C(O[C@@H](C(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1)c1ccccc1)c1cnc(-c2ccccn2)s1 727890227 JMXTUDZRCXEGOU-HXUWFJFHSA-N 494.916 5.304 5 20 JKBD Cc1c(C(=O)Nc2ccccc2SC[C@H]2CC2(Cl)Cl)cc([N+](=O)[O-])c(C)c1[N+](=O)[O-] 748624890 UMCYRIHPUUOQQG-GFCCVEGCSA-N 470.334 5.658 5 20 JKBD Cc1c(C(=O)N2CCC(C(=O)c3ccc(CC(C)C)cc3)CC2)cc([N+](=O)[O-])c(C)c1[N+](=O)[O-] 748712885 JZVKFDHUMOVIDP-UHFFFAOYSA-N 467.522 5.053 5 20 JKBD O=C(Nc1cc([N+](=O)[O-])c(F)cc1F)[C@@H]1C[C@H]2CCCC[C@@H]2N1C(=O)c1ccc2ccccc2c1 751073776 UECDSKIPOGLARC-UWSIMGETSA-N 479.483 5.438 5 20 JKBD Cc1nc2ccccc2c(-c2ccccc2)c1CC(=O)OCC(=O)Nc1cc([N+](=O)[O-])ccc1Cl 800378583 MKRHLNBUNLPSAA-UHFFFAOYSA-N 489.915 5.496 5 20 JKBD CC(C)(C)OC(=O)NC1(c2noc(-c3csc(-c4cccc([N+](=O)[O-])c4)n3)n2)CCCC1 904416114 IZNVQZWZRSVJLN-UHFFFAOYSA-N 457.512 5.062 5 20 JKBD COC(=O)c1coc(-c2noc(C/C(=C/c3ccc([N+](=O)[O-])cc3)c3nc4ccccc4s3)n2)c1 904945157 VDMGBKHPWCCMCS-GDNBJRDFSA-N 488.481 5.417 5 20 JKBD CCOc1ccccc1NC(=O)[C@@H](OC(=O)c1cc2cccc([N+](=O)[O-])c2[nH]1)c1ccccc1 917331160 LYEXXHXLPJKXDC-QHCPKHFHSA-N 459.458 5.012 5 20 JKBD COc1cc(C(=O)Nc2cc(N3CCCC3=O)ccc2F)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 917797548 YPCRSGFMPPYNJY-UHFFFAOYSA-N 499.882 5.567 5 20 JKBD Cc1cccn2cc(-c3ccc(NC(=O)c4cc([N+](=O)[O-])ccc4I)cc3)nc12 918599206 ORQAIHRHICQWHA-UHFFFAOYSA-N 498.280 5.075 5 20 JKBD O=C(OCc1nc(-c2ccc([N+](=O)[O-])cc2)no1)/C(=C/c1ccc(F)cc1)c1cccs1 918833072 JNMHOLLDQWDIDC-LDADJPATSA-N 451.435 5.129 5 20 JKBD C[C@@H](Nc1ccc(C(=O)OCc2csc(-c3ccccn3)n2)cc1[N+](=O)[O-])c1ccccn1 920548819 UFJMLDRHNQSADA-OAHLLOKOSA-N 461.503 5.038 5 20 JKBD O=C(Cc1ccc(Cl)cc1[N+](=O)[O-])Nc1ccc(C2(NC(=O)COC3CCCCC3)CCC2)cc1 1786114967 RWQGBKQZSWVACH-UHFFFAOYSA-N 499.995 5.274 5 20 JKBD O=C(NC1(c2ccc(NC(=O)c3cc4sccc4s3)cc2)CCC1)c1ccc([N+](=O)[O-])o1 1789255402 NQSAITXQXZNNME-UHFFFAOYSA-N 467.528 5.526 5 20 JKBD Cc1nc(C)c(C(=O)NC2(c3ccc(NC(=O)C4(c5cccc([N+](=O)[O-])c5)CCC4)cc3)CCC2)o1 1790476052 XLDXBEVZOSENBM-UHFFFAOYSA-N 488.544 5.069 5 20 JKBD COc1ccc(CC(=O)Nc2ccc(C3(NC(=O)c4sccc4Cl)CCC3)cc2)c([N+](=O)[O-])c1 1790572122 NKLJKARJACGSNI-UHFFFAOYSA-N 499.976 5.309 5 20 JKBD Cc1noc(C)c1C(=O)NC1(c2ccc(NC(=O)c3cc4cc([N+](=O)[O-])ccc4s3)cc2)CCC1 1791011336 XORNJEJIVSJAJE-UHFFFAOYSA-N 490.541 5.476 5 20 JKBD CCc1ccc(C(=O)NC2(c3ccc(NC(=O)/C=C/c4ccccc4[N+](=O)[O-])cc3)CCC2)cn1 1792315709 TXPSGTZXCISXJQ-OQLLNIDSSA-N 470.529 5.013 5 20 JKBD CC1(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)c3cc4cc([N+](=O)[O-])ccc4s3)[nH]n2)CCCC1 1814531875 XOFAWTTYOJSAAA-SFHVURJKSA-N 481.578 5.419 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)N1CCCC[C@@H]1c1cc(NC(=O)C[C@H](C)c2ccccc2)n[nH]1 1822045942 QTIMNLBEFWJCPM-KSFYIVLOSA-N 493.539 5.265 5 20 JKBD Cc1ccccc1C(=O)N1CCC([C@H]2CCCCN2C(=O)Cc2ccc(Cl)cc2[N+](=O)[O-])CC1 1824160991 GUVLMOSTPYUBRX-HSZRJFAPSA-N 483.996 5.033 5 20 JKBD O=C(C[C@@H]1CCCCO1)N1CCC([C@@H]2CCCCN2C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)CC1 1831059032 BCGDUKPUYPHHKK-VXKWHMMOSA-N 499.633 5.002 5 20 JKBD COc1ccc(NC(=O)CSc2nnc(-c3ccccc3Cl)n2C2CCCC2)c([N+](=O)[O-])c1 8989059 FALDWKJUQKPRPS-UHFFFAOYSA-N 487.969 5.361 5 20 JKBD Cc1ccc([N+](=O)[O-])cc1NC(=O)CSc1nnc(-c2ccc(F)cc2)n1Cc1ccccc1 23599544 OLTKTSFJUFGMLM-UHFFFAOYSA-N 477.521 5.080 5 20 JKBD C[C@H](Sc1nc2cc3ccccc3cc2c(=O)n1C)C(=O)N[C@H](C)c1ccc(Cl)cc1 26580945 CHAVXYNLUVCFBA-CABCVRRESA-N 451.979 5.098 5 20 JKBD CSc1ccc([N+](=O)[O-])c(C(=O)O[C@H](C)C(=O)Nc2ccccc2Oc2ccccc2)c1 28400854 XBEGMCZKMNLTNS-OAHLLOKOSA-N 452.488 5.293 5 20 JKBD CCOc1cc([N+](=O)[O-])c(C(=O)Nc2ncc(Cc3cccc(C(F)(F)F)c3)s2)cc1OC 29583359 SDBMINDAXQJPKV-UHFFFAOYSA-N 481.452 5.321 5 20 JKBD Cc1c(C(=O)N[C@@H](CC(=O)OC(C)C)c2ccccc2[N+](=O)[O-])sc2nc(C(F)(F)F)ccc12 29779472 GZYHHEKQCKNUSN-HNNXBMFYSA-N 495.479 5.345 5 20 JKBD CC(=O)Nc1ccc(-c2csc(NC(=O)CCNc3ccc(C(F)(F)F)cc3[N+](=O)[O-])n2)cc1 45633157 UVRMHKNGLISIFY-UHFFFAOYSA-N 493.467 5.136 5 20 JKBD O=C(c1ccc(N2CCCC2)c([N+](=O)[O-])c1)N(Cc1ccccn1)c1ccc(Br)cc1 68734257 XZGIFHAFXAISMZ-UHFFFAOYSA-N 481.350 5.200 5 20 JKBD O=C(CCCn1c(=O)oc2cc([N+](=O)[O-])ccc21)Nc1ccc(OCc2ccccc2Cl)cc1 72005266 KRULXDIUBAMNCM-UHFFFAOYSA-N 481.892 5.154 5 20 JKBD Cc1ccc(-c2csc(NC(=O)c3ccc(NC(=O)c4cccs4)cc3)n2)cc1[N+](=O)[O-] 105353143 SMUJPDUMKABAGW-UHFFFAOYSA-N 464.528 5.593 5 20 JKBD O=C(C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1)N1CCn2cccc2[C@H]1c1ccccc1 115624000 OFVBFBVRGBNCJP-XMMPIXPASA-N 498.505 5.263 5 20 JKBD Cc1cc(C(=O)N2CCC[C@H](C)C2)ccc1NC(=O)c1ccc(N2CCC(C)CC2)c([N+](=O)[O-])c1 195703974 AXUHZNSNZRHCNW-IBGZPJMESA-N 478.593 5.264 5 20 JKBD CCc1cccc2c(C3CCN(C(=O)c4csc(-c5cccc([N+](=O)[O-])c5)n4)CC3)c[nH]c12 215801983 TVCPGIDDFATNOU-UHFFFAOYSA-N 460.559 5.782 5 20 JKBD COc1cc(C(=O)Nc2cc(-c3nnco3)ccc2C)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 483240717 BYURMYYMFVOLAC-UHFFFAOYSA-N 480.864 5.660 5 20 JKBD Cc1cccc(CN[C@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Br)c2ccccc2)c1 493487056 ZBUMGLBVYDJSKK-NRFANRHFSA-N 454.324 5.135 5 20 JKBD COc1cc([C@H](C)NC(=O)c2csc(-c3ccc([N+](=O)[O-])cc3)n2)ccc1OCc1ccncc1 498601428 SHDDLXVGERSHSP-INIZCTEOSA-N 490.541 5.192 5 20 JKBD COc1cc(C(=O)N(Cc2ccc(Br)cc2)C(C)C)c([N+](=O)[O-])cc1OC(F)F 499814308 RDYMNQXQBZDKQW-UHFFFAOYSA-N 473.270 5.018 5 20 JKBD CSc1ccc(C(=O)c2ccccc2C(=O)Nc2cccc(C(=O)NC(C)(C)C)c2)cc1[N+](=O)[O-] 502215247 OZDBIMLGFUYVTF-UHFFFAOYSA-N 491.569 5.328 5 20 JKBD O=C(Cn1c2ccccc2c(=O)c2ccccc21)Nc1ccc(F)c(NC(=O)Cc2ccccc2)c1 502803650 BJFRVEFFADQSSG-UHFFFAOYSA-N 479.511 5.114 5 20 JKBD O=[N+]([O-])c1cccc(F)c1CSc1nnc(-c2ccccc2)n1Cc1ccc2c(c1)OCO2 504520174 XGDUIVLPGXSIGX-UHFFFAOYSA-N 464.478 5.062 5 20 JKBD C[C@H](Nc1ccc(C(=O)N(Cc2ccccc2C(F)(F)F)C2CC2)cc1[N+](=O)[O-])c1ccccn1 506152996 KFPNOJAUDAMJOK-INIZCTEOSA-N 484.478 5.987 5 20 JKBD CCCc1ccccc1NC(=O)CNc1ccc(S(=O)(=O)Nc2ccc(C)cc2C)cc1[N+](=O)[O-] 507287451 ZZWPPVDVHSFPPJ-UHFFFAOYSA-N 496.589 5.016 5 20 JKBD O=C(NCc1ccc(C(F)(F)F)cc1)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 508330040 TVXJGHCBJILOEW-UHFFFAOYSA-N 475.389 5.165 5 20 JKBD C[C@@H](c1ccc(Cl)cc1)N(C(=O)c1ccc(N[C@H](C)c2ccccn2)c([N+](=O)[O-])c1)C1CC1 509245895 HORVXHNMNGNJLD-SJORKVTESA-N 464.953 6.182 5 20 JKBD CC(C)NS(=O)(=O)c1cccc(CNCc2ccc(Oc3ccccc3Cl)c([N+](=O)[O-])c2)c1 509607642 IKQHWHDTSJUHQY-UHFFFAOYSA-N 489.981 5.017 5 20 JKBD CCN(CC)C(=O)c1ccc(NC(=O)CSc2ccc(C(F)(F)F)cc2[N+](=O)[O-])cc1Cl 512432016 MBCVJEOFBWFVQV-UHFFFAOYSA-N 489.903 5.480 5 20 JKBD COc1ccc(-c2[nH]c3ccccc3c2CCC(=O)NCc2ccc(OC)c([N+](=O)[O-])c2)c(OC)c1 512792549 LSXWJNOVMRTFRG-UHFFFAOYSA-N 489.528 5.018 5 20 JKBD O=C(Nc1ccccc1CS(=O)(=O)c1ccccc1)c1cc2cc([N+](=O)[O-])ccc2s1 518661625 COKITQNBIQGAAL-UHFFFAOYSA-N 452.513 5.036 5 20 JKBD CN(CCCCCc1cc(-c2cccc(F)c2)no1)C(=O)c1ccc(N2CCCC2)c([N+](=O)[O-])c1 521597935 PMRVBMXVODDHHH-UHFFFAOYSA-N 480.540 5.474 5 20 JKBD CC(C)Oc1ccc(CNc2ccc([N+](=O)[O-])c(C(=O)N3CCCC3)c2)c(C(F)(F)F)c1 523295859 JTEYLWVQDIJOQE-UHFFFAOYSA-N 451.445 5.249 5 20 JKBD COc1ccc(CC(=O)N(Cc2ccc(F)cc2)c2nc3ccccc3s2)cc1[N+](=O)[O-] 524245318 WXFGVAQSPDSDEC-UHFFFAOYSA-N 451.479 5.128 5 20 JKBD O=[N+]([O-])c1ccc(-c2ccc(CN[C@@H](c3ccccc3)[C@H]3CCCO3)o2)c(Br)c1 555190348 AXEQLTWBEFGIRA-YADHBBJMSA-N 457.324 5.627 5 20 JKBD O=C1Nc2cc(Cl)ccc2[C@@H]1C1CCN(C(=O)c2cc3ccccc3c3cccnc23)CC1 589589833 LDXLBVFIBITLPM-DEOSSOPVSA-N 455.945 5.630 5 20 JKBD C[C@H]1CSc2ccc(Br)cc2[C@H]1NC(=O)Cn1c2ccccc2c(=O)c2ccccc21 591369837 KQZGDVCSKRZMSD-OWJWWREXSA-N 493.426 5.517 5 20 JKBD CSc1ccc(C(=O)c2ccccc2C(=O)NCCCn2c(C)nc3ccccc32)cc1[N+](=O)[O-] 603452982 GYRISACOUWPIGY-UHFFFAOYSA-N 488.569 5.026 5 20 JKBD COc1cc(C(=O)Nc2ccc(CN3CCc4ccccc43)cc2)c([N+](=O)[O-])cc1OC(F)F 608873910 NXZRLJVVWLBQFG-UHFFFAOYSA-N 469.444 5.020 5 20 JKBD COc1cc(C(=O)Nc2cccc([C@H](C)OC)c2)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 608874911 HIAOUAASKBWSPQ-AWEZNQCLSA-N 456.882 6.009 5 20 JKBD O=C(c1ccc(C(=O)N2CCC[C@@H]2Cc2ccccc2)cc1[N+](=O)[O-])N1CCC[C@H]1Cc1ccccc1 609043639 GLHLTNPELKWTIK-FTJBHMTQSA-N 497.595 5.289 5 20 JKBD COc1cc(CS(=O)(=O)Cc2c(C)cc(C(C)(C)C)cc2C)c([N+](=O)[O-])cc1OC(F)F 609225711 WMFODXFKYFXAKU-UHFFFAOYSA-N 471.522 5.234 5 20 JKBD O=C(Nc1ccc(OC(=O)c2csc(-c3ccc([N+](=O)[O-])cc3)n2)cc1)c1ccc(F)cc1 728246373 GJBNEWPDJFRZNR-UHFFFAOYSA-N 463.446 5.329 5 20 JKBD O=C(Nc1ccc(Cl)c([N+](=O)[O-])c1)[C@@H](OC(=O)[C@@H]1CCOc2ccccc21)c1ccccc1 728358995 NIEOTLXYBVEMMN-GCJKJVERSA-N 466.877 5.038 5 20 JKBD COc1ccc([C@H](NC(=O)c2cc(F)ccc2[N+](=O)[O-])c2ccccc2)cc1Br 728498773 OIPBBJABPGXWSO-HXUWFJFHSA-N 459.271 5.024 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)O[C@H](C)c2ccccc2NC(=O)c2ccccc2)cc1SC 728769853 KLUPYXRJQPUOSU-OAHLLOKOSA-N 466.515 5.496 5 20 JKBD Cc1nc(COC(=O)C/C(=C\c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)cs1 748579284 NATAKXNPAMEOSO-MHWRWJLKSA-N 451.529 5.644 5 20 JKBD COc1cc(COC(=O)c2csc(-c3cccc(Cl)c3)n2)c([N+](=O)[O-])cc1OC(F)F 791436690 CJCZTISZCSEWME-UHFFFAOYSA-N 470.837 5.339 5 20 JKBD O=C(Nc1ccccc1C(=O)Nc1ccc2c(c1)OCCO2)c1cc2cc([N+](=O)[O-])ccc2s1 798126060 HAHKRKXXBSBBLK-UHFFFAOYSA-N 475.482 5.085 5 20 JKBD CC(C)(NC(=O)c1cccc(Cl)c1)c1noc(-c2csc(-c3ccc([N+](=O)[O-])cc3)n2)n1 904596167 HNEPRTRYTCFVBT-UHFFFAOYSA-N 469.910 5.087 5 20 JKBD Cc1ccc(/C=C(/Cl)c2nc(=O)c3cc(Br)cc(Br)c3[nH]2)cc1[N+](=O)[O-] 916127309 MBWCDMZFTSJJFN-YIXHJXPBSA-N 499.546 5.402 5 20 JKBD C[C@H](NC(=S)/C(=C(/O)c1ccc([N+](=O)[O-])cc1)[n+]1ccc(C(C)(C)C)cc1)c1ccccc1 917611444 DLTSQZJRDULEPT-SFHVURJKSA-O 462.595 5.742 5 20 JKBD Cc1ccc(C(C)C)c(O[C@@H](C)C(=O)O[C@@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2C(F)(F)F)c1 919446679 HIZSQMXXSYLDEK-GJZGRUSLSA-N 482.455 5.383 5 20 JKBD COc1ccc([N+](=O)[O-])c(C(=O)OCc2csc(N(C(C)=O)c3cccc(C(F)(F)F)c3)n2)c1 920704737 FAHVUORTVJZDIH-UHFFFAOYSA-N 495.435 5.120 5 20 JKBD Cc1occc1C(=O)Nc1ccc(C2(NC(=O)Cc3ccc(Cl)cc3[N+](=O)[O-])CCC2)cc1 1787362590 WPAUOGVNLQIEKM-UHFFFAOYSA-N 467.909 5.140 5 20 JKBD O=C(Cc1ccc([N+](=O)[O-])cc1F)Nc1ccc(C2(NC(=O)c3cccc4cc[nH]c34)CCC2)cc1 1791183316 AUVDKRZTFJSPQS-UHFFFAOYSA-N 486.503 5.206 5 20 JKBD COc1cc(C(=O)NC2(c3ccc(NC(=O)c4cc(F)cc(F)c4F)cc3)CCC2)ccc1[N+](=O)[O-] 1792128217 MVDPXVYBSBDVSG-UHFFFAOYSA-N 499.445 5.082 5 20 JKBD O=C(NC1(c2ccc(NC(=O)[C@@]3(F)CCCC=C3F)cc2)CCC1)c1cccc(F)c1[N+](=O)[O-] 1792378928 FRCXZBYJAWSXQR-XMMPIXPASA-N 473.451 5.227 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(-c2ccccc2)cc1 1803831098 VXFKHJSTJWTEOL-NUNAXRQHSA-N 487.531 5.275 5 20 JKBD Cc1cccc(C(=O)N2CCCC3(CCN(C(=O)c4cc5cc([N+](=O)[O-])ccc5s4)CC3)C2)c1F 1805076069 QFYXUILAGLXCDY-UHFFFAOYSA-N 495.576 5.416 5 20 JKBD CC(C)=CCCC(=O)NC[C@H]1CCN(C(=O)c2cc(Cl)cc([N+](=O)[O-])c2C)[C@H]1c1cccnc1 1807987121 FJRUMVVOONXTPV-DVECYGJZSA-N 484.984 5.018 5 20 JKBD Cc1cccc(Cl)c1C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cccc(F)c2[N+](=O)[O-])n[nH]1 1821171593 FONIUGJBIKASSA-SFHVURJKSA-N 485.903 5.039 5 20 JKBD Cc1c(C(=O)Nc2cc([C@H]3CCCCN3C(=O)[C@@H](C)Cc3ccco3)[nH]n2)cc(Cl)cc1[N+](=O)[O-] 1821294951 YACUTYJXGRCZOY-VBKZILBWSA-N 499.955 5.057 5 20 JKBD CC1(C)CCC(CC(=O)N2CCC([C@@H]3CCCCN3C(=O)c3ccc([N+](=O)[O-])cc3F)CC2)CC1 1830499141 PMJNJWSWVJUPHP-DEOSSOPVSA-N 487.616 5.574 5 20 JKBD O=C(c1ccc(C2CC2)cc1)N1CCC([C@@H]2CCCCN2C(=O)Cc2ccc([N+](=O)[O-])cc2F)CC1 1831295016 VGYHHJNPZMLDOJ-SANMLTNESA-N 493.579 5.087 5 20 JKBD O=C(c1cc(F)cc([N+](=O)[O-])c1)N1CC2(CCCN2C(=O)C2CCC(c3ccc(Cl)cc3)CC2)C1 1841409517 ZTVWZZNQQVIMBC-UHFFFAOYSA-N 499.970 5.178 5 20 JKBD O=C(NCc1ccccc1)c1nnc(/C(Cl)=C/c2ccc(-c3ccc([N+](=O)[O-])cc3)o2)s1 16331413 GKBRXQOXYKGPRK-PDGQHHTCSA-N 466.906 5.373 5 20 JKBD Cc1csc(SCc2ccccc2C(=O)O[C@@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)n1 17717760 SVVZTUFMFBQLHQ-AWEZNQCLSA-N 482.543 5.620 5 20 JKBD COc1ccc2c(CC(=O)O[C@@H](C(=O)Nc3ccc(C)cc3[N+](=O)[O-])c3ccccc3)coc2c1 20974120 DYRATVRYEMJAIM-RUZDIDTESA-N 474.469 5.124 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Cl)[C@@H](Nc1ccc2oc(C3CC3)nc2c1)c1ccccc1 27041637 XGYUGUKPAHLRHX-QFIPXVFZSA-N 462.893 6.059 5 20 JKBD O=C(OCc1nnc(-c2ccc([N+](=O)[O-])cc2)o1)c1sc2cc(Cl)ccc2c1Cl 28614494 LDYNGAIRBRAPHH-UHFFFAOYSA-N 450.259 5.523 5 20 JKBD Cc1csc(Sc2ccc(C(=O)N(C)[C@H](C)c3nc4ccccc4s3)cc2[N+](=O)[O-])n1 32341573 DDWMUHZCUHKMHV-CYBMUJFWSA-N 470.601 5.954 5 20 JKBD Cc1cc(Oc2ncccn2)ccc1NC(=O)c1ccccc1C(=O)c1ccc(N(C)C)c([N+](=O)[O-])c1 110486645 GETAYCLREKCBTR-UHFFFAOYSA-N 497.511 5.035 5 20 JKBD Cc1sc(NC(=O)CSCc2coc(-c3ccccc3)n2)nc1-c1cccc([N+](=O)[O-])c1 195704367 XTIXNFIXKDFZSO-UHFFFAOYSA-N 466.544 5.554 5 20 JKBD O=C(Nc1nc(-c2cccc(C(F)(F)F)c2)cs1)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-] 477933301 IMJRZQNCYLAOLI-UHFFFAOYSA-N 491.369 5.931 5 20 JKBD O=C1COc2cc(NC(=O)c3ccccc3Sc3ccc(C(F)(F)F)cc3[N+](=O)[O-])ccc2N1 490648443 KLCJNMFAFUQGKX-UHFFFAOYSA-N 489.431 5.348 5 20 JKBD Cc1cc(C(=O)N2CCCC2)ccc1NC(=O)c1cc([N+](=O)[O-])ccc1Sc1ccc(Cl)cc1 498477317 MAYGTXPHWUPVBT-UHFFFAOYSA-N 495.988 6.196 5 20 JKBD O=C(Nc1cccc(N[C@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2ccccc2)c1)c1ccoc1 500370542 BBGPITQNLNMECO-QHCPKHFHSA-N 490.903 5.885 5 20 JKBD Cc1csc(Sc2ccc(NC(=O)c3cn(C)nc3-c3ccc([N+](=O)[O-])cc3)cc2)n1 509499515 KTPNWFVOCHERMU-UHFFFAOYSA-N 451.533 5.164 5 20 JKBD C[C@@H](Sc1nnc(-c2ccncc2)n1-c1ccccc1)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 514702545 AGJPVFVVBKCMFI-OAHLLOKOSA-N 471.502 5.141 5 20 JKBD C[C@H](NC(=O)CSc1ncnc2scc(-c3ccccc3)c12)c1cccc([N+](=O)[O-])c1 516126641 JHUHWHSIBFZKOB-AWEZNQCLSA-N 450.545 5.236 5 20 JKBD Cc1cc(C(=O)N2CCC[C@H](C)C2)ccc1NC(=O)c1ccc(NCc2ccccc2)c([N+](=O)[O-])c1 520558906 WXZYVNXKXUITBQ-IBGZPJMESA-N 486.572 5.640 5 20 JKBD O=C(Nc1cccc([N+](=O)[O-])c1)c1cnn(-c2ncc(C(F)(F)F)cc2Cl)c1C(F)F 520794445 VNSVTAJUVSCKLV-UHFFFAOYSA-N 461.734 5.038 5 20 JKBD Cc1ccc(NC(=O)NC[C@@H]2CCCN(C(=O)c3cc([N+](=O)[O-])ccc3Oc3ccccc3)C2)cc1 524273522 WXBKVKYLWIZORA-FQEVSTJZSA-N 488.544 5.369 5 20 JKBD CCN(C(=O)Cn1c2ccccc2c(=O)c2ccccc21)[C@H](c1cccnc1)c1ccc(F)c(F)c1 591039933 QGTPGUCUDWNUGM-NDEPHWFRSA-N 483.518 5.466 5 20 JKBD O=C(NCc1ccc(COc2ccccc2)cc1)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-] 603891692 FTDNBENHEXRQKL-UHFFFAOYSA-N 460.408 5.045 5 20 JKBD Cc1csc(Sc2ccc(C(=O)Nc3cccc(C(=O)N4CCCCC4)c3)cc2[N+](=O)[O-])n1 603939858 MJHDNRPQRLGVCA-UHFFFAOYSA-N 482.587 5.389 5 20 JKBD COc1ccc([N+](=O)[O-])cc1C(=O)Nc1nnc(SCc2c(Cl)cccc2Cl)s1 604514020 YDXNOEPAXYEOFW-UHFFFAOYSA-N 471.347 5.306 5 20 JKBD Cc1csc(-c2cccc(NC(=O)c3ccc(N[C@H](C)c4ccccn4)c([N+](=O)[O-])c3)c2)n1 608808441 JXNAXLUKRZNVJD-MRXNPFEDSA-N 459.531 5.847 5 20 JKBD O=[N+]([O-])c1ccc(-c2nn(-c3ccccc3)cc2CN[C@@H](c2ccccc2)c2nccs2)cc1 608837053 WYAFCRBWRZADGK-VWLOTQADSA-N 467.554 5.783 5 20 JKBD O=C(OCc1nnc(-c2ccc([N+](=O)[O-])cc2)o1)c1sc2cc(Br)ccc2c1Cl 729874254 ZNDSAFZNYWVEEX-UHFFFAOYSA-N 494.710 5.632 5 20 JKBD O=C(Oc1ccc2c(-c3ccc([N+](=O)[O-])cc3)cc(=O)oc2c1)c1ccc(Cl)nc1Cl 747622835 UWNOXEKJXYLDKK-UHFFFAOYSA-N 457.225 5.289 5 20 JKBD C[C@@H](OC(=O)c1csc(-c2ccc([N+](=O)[O-])cc2)n1)C(=O)Nc1ccc(Cl)c(C(F)(F)F)c1 747958420 LRGISVCXRSGIKO-SNVBAGLBSA-N 499.854 5.575 5 20 JKBD CCc1ccccc1N(C(C)=O)c1nc(COC(=O)c2cc([N+](=O)[O-])c(C)c([N+](=O)[O-])c2C)cs1 748946798 IMAKXOKHKBQNJV-UHFFFAOYSA-N 498.517 5.180 5 20 JKBD Cc1noc2nc(-c3ccc(F)cc3)cc(C(=O)O[C@H](C)C(=O)Nc3ccc([N+](=O)[O-])cc3Cl)c12 813337308 XGXJFRUWKLEWPI-GFCCVEGCSA-N 498.854 5.083 5 20 JKBD O=C(O[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1)c1ccc(O)c(Cl)c1 848950442 UCWAOCSGSOWPPE-IBGZPJMESA-N 461.257 5.144 5 20 JKBD C[C@H](OC(=O)c1nc(-c2ccccc2)n2c1CCCCC2)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl 914916818 ZOBBKPXMFVHORH-HNNXBMFYSA-N 482.924 5.022 5 20 JKBD CCCc1cc[n+](/C(C(=S)Nc2ccc3ccccc3c2)=C(/O)c2ccc([N+](=O)[O-])cc2)cc1 917610929 ZNKXTPVJRWXRIA-UHFFFAOYSA-O 470.574 6.311 5 20 JKBD Cc1cc(C(=O)O[C@@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2ccccc2)nn1-c1ccccc1 919303255 XFBGFGFGNXDVRO-HSZRJFAPSA-N 490.903 5.279 5 20 JKBD C[C@H](Nc1ccc(C(=O)O[C@H](C)c2nnc(-c3ccccc3)o2)cc1[N+](=O)[O-])c1ccccn1 920545479 RQSGIESUAVCMQO-JKSUJKDBSA-N 459.462 5.131 5 20 JKBD C[C@@H](OC(=O)c1ccc(NCc2ccccc2Cl)c([N+](=O)[O-])c1)c1nc(-c2cccnc2)no1 922680298 BCISFQYVZILXEU-CQSZACIVSA-N 479.880 5.223 5 20 JKBD O=C(Cc1cccc2ncccc12)Nc1ccc(C2(NC(=O)c3cc(F)cc([N+](=O)[O-])c3)CCC2)cc1 1786345804 PPRDEHTWGLPQTJ-UHFFFAOYSA-N 498.514 5.273 5 20 JKBD O=C(/C=C/c1ccccc1[N+](=O)[O-])NC1(c2ccc(NC(=O)c3nc4ccccc4o3)cc2)CCC1 1790852440 GUXSOYXPZLBFGT-XNTDXEJSSA-N 482.496 5.197 5 20 JKBD CCc1ccc(C(=O)NC2(c3ccc(NC(=O)CSc4ccccc4[N+](=O)[O-])cc3)CCC2)cn1 1791521582 ZWKIPVSYKNQQKN-UHFFFAOYSA-N 490.585 5.092 5 20 JKBD Cc1cc(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)c3cc4cc([N+](=O)[O-])ccc4s3)[nH]n2)c(C)o1 1816416313 HFTXSVWCRBNDAJ-IBGZPJMESA-N 493.545 5.362 5 20 JKBD Cc1oc(C(C)(C)C)cc1C(=O)Nc1cc([C@@H]2CCCCN2C(=O)Cc2cccc([N+](=O)[O-])c2)[nH]n1 1816461956 GMGXFRCQDOSUHE-NRFANRHFSA-N 493.564 5.065 5 20 JKBD Cc1cc(C(=O)N2CCCC[C@H]2c2cc(NC(=O)c3ccc(C(C)(C)C)s3)n[nH]2)ncc1[N+](=O)[O-] 1818343361 ZPBKMCMSEDLEOT-KRWDZBQOSA-N 496.593 5.000 5 20 JKBD Cc1ccoc1C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cc3cc([N+](=O)[O-])ccc3s2)n[nH]1 1821609863 NNNCLCPJRLGZPV-QGZVFWFLSA-N 479.518 5.054 5 20 JKBD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2cccc(F)c2)[nH]n1)c1cc2cc([N+](=O)[O-])ccc2s1 1821610473 ZIRDHPXPYWPQDM-IBGZPJMESA-N 493.520 5.291 5 20 JKBD Cc1ccc2[nH]c(C(=O)N3CCCC[C@H]3c3cc(NC(=O)/C=C/c4ccccc4[N+](=O)[O-])n[nH]3)cc2c1 1823505099 VJFWORCWFRJNHU-YKATVRGKSA-N 498.543 5.127 5 20 JKBD Cc1cc(Cl)c(Cl)cc1C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2ccc([N+](=O)[O-])o2)CC1 1823615314 PDHVGHPFJZXAAW-IBGZPJMESA-N 494.375 5.350 5 20 JKBD Cc1cc(CCCC(=O)N2CCCC[C@@H]2C2CCN(C(=O)[C@H]3C[C@@H]3C3CC3)CC2)c([N+](=O)[O-])cc1F 1824370361 VVVWFSUECPKPIA-GIFXNVAJSA-N 499.627 5.031 5 20 JKBD Cc1c(C(=O)N2CCC([C@H]3CCCCN3C(=O)c3cccs3)CC2)cc(Cl)cc1[N+](=O)[O-] 1825778763 DZKWMRWJCHJGIU-LJQANCHMSA-N 475.998 5.165 5 20 JKBD O=C(c1ccc(F)cc1)N1CCCC[C@H]1C1CCN(C(=O)C2(c3cccc([N+](=O)[O-])c3)CCC2)CC1 1830021136 WDUYLFUPIAFZJN-VWLOTQADSA-N 493.579 5.089 5 20 JKBD O=C(Cc1ccc([N+](=O)[O-])cc1F)N1CCC([C@H]2CCCCN2C(=O)/C=C/C2CCCCC2)CC1 1830355344 FHXZUIAGNBJAJW-QXJBOHEXSA-N 485.600 5.033 5 20 JKBD CC(=O)Nc1cccc([C@H](C)N(Cc2ccccc2)C(=O)c2ccc([N+](=O)[O-])cc2Cl)c1 11261523 IDGGXPRECIYHKE-INIZCTEOSA-N 451.910 5.610 5 20 JKBD O=[N+]([O-])c1cccc(OC[C@@H](O)CSc2nnc(-c3ccccc3Cl)n2C2CCCC2)c1 15237022 CYOVSTAGVSKURO-QGZVFWFLSA-N 474.970 5.154 5 20 JKBD COc1cccc(NC(=O)c2c(-c3cccnc3)nc3ccc([N+](=O)[O-])cc3c2-c2ccccc2)c1 15454033 AWCWNBYGHWZYIB-UHFFFAOYSA-N 476.492 6.133 5 20 JKBD Cc1ccc(Nc2nnc(S[C@@H](C)c3nnc(-c4ccc([N+](=O)[O-])cc4)o3)s2)cc1C 17532270 VAFCEVRWBMZDEG-ZDUSSCGKSA-N 454.537 5.710 5 20 JKBD O=C(CSc1nc2c(n1-c1ccccc1)CCCC2)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 21127133 MUPLKZYQWOJZPD-UHFFFAOYSA-N 476.480 5.409 5 20 JKBD CN(Cc1cc([N+](=O)[O-])ccc1Cl)Cn1nc(-c2ccc(F)cc2)n(C[C@H]2CCCO2)c1=S 27533254 SZBNYWCBDRDREU-LJQANCHMSA-N 491.976 5.050 5 20 JKBD O=C(CSc1ccc(C(F)(F)F)cc1[N+](=O)[O-])NCc1ccccc1CN1CCCCC1 31524446 OBVFHYBXOLCDSE-UHFFFAOYSA-N 467.513 5.008 5 20 JKBD C[C@H](Nc1ccc(C(=O)Nc2cccc(C(=O)c3ccccc3)c2)cc1[N+](=O)[O-])c1ccccn1 60351751 LMDYQSJJMXKWKR-SFHVURJKSA-N 466.497 5.646 5 20 JKBD Cc1sc2ncnc(Sc3ccccc3C(=O)NCc3ccc([N+](=O)[O-])cc3)c2c1C 71981657 VWGCMFSOLZDERB-UHFFFAOYSA-N 450.545 5.298 5 20 JKBD CC1CCN(c2ccc([N+](=O)[O-])cc2C(=O)Nc2cccc(Cn3ccnc3C(C)C)c2)CC1 108212915 YDTFGWWRQWVFEA-UHFFFAOYSA-N 461.566 5.452 5 20 JKBD COc1cc(F)c(NC(=O)c2ccc(Sc3nc4ccccc4s3)c([N+](=O)[O-])c2)cc1OC 410016976 ABICRFQZNSFCQU-UHFFFAOYSA-N 485.518 5.764 5 20 JKBD Cc1cc([N+](=O)[O-])ccc1NC(=O)CCSc1nnc(-c2ccccc2)n1-c1ccccc1 476605170 YFLBWTWLQUATIW-UHFFFAOYSA-N 459.531 5.272 5 20 JKBD COCCn1cc(NC(=O)c2c3c(nc4ccccc24)/C(=C/c2ccc([N+](=O)[O-])cc2)CCC3)cn1 486667512 ZLKXXPXMFSUVDH-XDJHFCHBSA-N 483.528 5.115 5 20 JKBD Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)Cc1ccc(NC(=O)c2ccc(Br)o2)cc1 490823413 FYXPDNYFQMMBDV-UHFFFAOYSA-N 472.295 5.001 5 20 JKBD CN(CC(=O)Nc1c(Cl)cccc1Cl)c1c([N+](=O)[O-])cnc2ccc(Br)cc12 502092756 RWMZFIMRQDWMDC-UHFFFAOYSA-N 484.137 5.287 5 20 JKBD Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)[C@@H]1CCCN(C(=O)c2ccc(Cl)c(Cl)c2)C1 506587805 WJCLLWLHNTYGLS-OAHLLOKOSA-N 450.322 5.009 5 20 JKBD O=C(Nc1cc([N+](=O)[O-])ccc1OC(F)F)N1CCC(c2nc3cc(Cl)ccc3s2)CC1 510811617 CUQQPXLJNHUUSQ-UHFFFAOYSA-N 482.896 5.871 5 20 JKBD CCCOc1ccc(Cl)cc1NC(=O)c1cc(OC)c(OCc2cscn2)cc1[N+](=O)[O-] 512315158 QIBUMXSCZLDWFM-UHFFFAOYSA-N 477.926 5.333 5 20 JKBD COC1CCN(C(=O)c2c3c(nc4ccccc24)/C(=C\c2cccc([N+](=O)[O-])c2)CCC3)CC1 514491798 MQOCLHQCXXSDFD-MNDPQUGUSA-N 457.530 5.271 5 20 JKBD CO[C@@H](CNC(=O)C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)c1ccccc1 518330638 DVKUWLVXWJHRTF-FIWMFUAISA-N 473.554 5.639 5 20 JKBD COc1cc(C(=O)N2CCC[C@H](Cc3ccc(C)cc3)C2)c([N+](=O)[O-])cc1OCc1cscn1 519734513 MEOIKRSYGSWXSX-LJQANCHMSA-N 481.574 5.042 5 20 JKBD O=C(Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1)[C@@H]1C[C@@H]2CCCC[C@H]2N1C(=O)c1ccccc1 524290495 RCIXJFYVQKDOMF-BWAGFHJFSA-N 476.558 5.130 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Cl)[C@@H](NCCc1ccc(Cl)s1)c1ccccc1 551311247 PYQXFFACQLTBBM-IBGZPJMESA-N 450.347 5.475 5 20 JKBD O=C(C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)NCCCc1nc2ccccc2[nH]1 561046834 VFUDVCOZWGMMGK-MNDPQUGUSA-N 497.580 5.761 5 20 JKBD Cc1cc(C(=O)N(C[C@@H]2CCCO2)c2nc(-c3cccc(C(F)(F)F)c3)cs2)ccc1[N+](=O)[O-] 592950400 OLNNTBNKLSGENS-SFHVURJKSA-N 491.491 5.871 5 20 JKBD COCCN(C(=O)CCCc1nc2ccccc2s1)c1nc(-c2ccc([N+](=O)[O-])cc2)cs1 603461424 QHHJNEWNBFOGPB-UHFFFAOYSA-N 482.587 5.330 5 20 JKBD COc1cc(NC(=O)c2cc3cc([N+](=O)[O-])ccc3s2)c(C(=O)N2[C@@H](C)CCC[C@@H]2C)cc1OC 603596705 LYNPORMHDHMSFB-GJZGRUSLSA-N 497.573 5.482 5 20 JKBD O=C(c1cc([N+](=O)[O-])ccc1Oc1ccccc1)N1C[C@@H](C(F)(F)F)C[C@H](C(F)(F)F)C1 604257304 FKFJWZFEJSSAKL-STQMWFEESA-N 462.346 5.590 5 20 JKBD C[C@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)N1CCC(c2nc3cc(Cl)ccc3o2)CC1 604445547 INEZKWAUIKCRON-LBPRGKRZSA-N 464.305 5.216 5 20 JKBD O=[N+]([O-])c1ccc(-c2nn(-c3ccccc3)cc2CNCc2cccnc2OCC(F)(F)F)cc1 608836282 AHZFUCGFYMVZLU-UHFFFAOYSA-N 483.450 5.073 5 20 JKBD O=C(Nc1cc(C(=O)N2CCCCC2)ccc1Cl)c1cc([N+](=O)[O-])ccc1NCc1ccccc1 608873135 RRJSGYNWJDKHML-UHFFFAOYSA-N 492.963 5.739 5 20 JKBD CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)Nc1nnc(SCc2ccc(F)cc2)s1 609147455 MFLDQYCXJUVSQI-UHFFFAOYSA-N 461.544 5.320 5 20 JKBD O=C(Nc1ccc(NC(=O)C2CC2)nc1)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1 609427180 INQJFTMRPFMDTE-UHFFFAOYSA-N 452.854 5.036 5 20 JKBD CSCC[C@@H](NC(=O)c1ccc(Sc2ccc(C)cc2)c([N+](=O)[O-])c1)c1nnc2ccccn12 611197021 SANRZNSLTVUEOJ-LJQANCHMSA-N 493.614 5.321 5 20 JKBD C[C@@H](c1nnc(Sc2ccc([N+](=O)[O-])c3cnccc23)n1-c1ccc(Cl)cc1)N(C)C 619714741 DMLWLCGINACEFU-ZDUSSCGKSA-N 454.943 5.151 5 20 JKBD CC(=O)N(c1nc(COC(=O)c2ccc([N+](=O)[O-])cc2C)cs1)c1c(C)cc(C)cc1C 725986818 DRLPGRXWNDYVTJ-UHFFFAOYSA-N 453.520 5.327 5 20 JKBD CCOC(=O)c1c(-c2ccc(OC)c(OC)c2)csc1NC(=O)c1ccc([N+](=O)[O-])cc1C 751046556 GLMZQTOPCWKVHO-UHFFFAOYSA-N 470.503 5.078 5 20 JKBD CC1CCN(c2ccc([N+](=O)[O-])cc2C(=O)Nc2cccc(NC(=O)c3cccs3)c2)CC1 818594887 OCABOULIYRFTTA-UHFFFAOYSA-N 464.547 5.397 5 20 JKBD O=C(Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1)c1cc(-c2cccnc2)nc2ccccc12 871593238 GEYQRZJHRRWELZ-UHFFFAOYSA-N 453.483 5.581 5 20 JKBD NC(=O)c1cc(NC(=O)c2cc([N+](=O)[O-])ccc2N2CCC(Cc3ccccc3)CC2)ccc1Cl 913010877 MSXOOGIKKHKPFM-UHFFFAOYSA-N 492.963 5.059 5 20 JKBD Cc1sc2nc(CS[C@@H](C)C(=O)OCc3nc4ccccc4c4ccccc34)nc(O)c2c1C 913212337 UDDPALIVISMYJB-INIZCTEOSA-N 489.622 6.080 5 20 JKBD O=C(NCCNc1ccc([N+](=O)[O-])cc1)Nc1ccccc1SC[C@@H]1CC1(Cl)Cl 916696172 QNRDIFJCSRWXIM-ZDUSSCGKSA-N 455.367 5.114 5 20 JKBD Cc1nc(C)c(-c2csc(NC(=O)c3cc([N+](=O)[O-])ccc3N3CCC(C)CC3)n2)s1 918629320 UUFGNPNRZHXWCZ-UHFFFAOYSA-N 457.581 5.280 5 20 JKBD O=C(Cc1ccc(NC(=O)c2ccc(Br)cc2)cc1)OCc1cc(F)ccc1[N+](=O)[O-] 919397705 VKLSHKNLXSKZDU-UHFFFAOYSA-N 487.281 5.035 5 20 JKBD Cc1cc(COc2ccc(C(=O)Nc3ccc(Cl)c([N+](=O)[O-])c3)cc2Br)no1 921276092 JZAMTAPOQJGAKT-UHFFFAOYSA-N 466.675 5.138 5 20 JKBD C[C@@H]1CCC[C@H]1C(=O)NC1(c2ccc(NC(=O)Cn3ccc4ccc([N+](=O)[O-])cc43)cc2)CCC1 1786277849 WWQHDBYTJWULJW-WZONZLPQSA-N 474.561 5.120 5 20 JKBD O=C(Cc1cc([N+](=O)[O-])ccc1F)Nc1ccc(C2(NC(=O)[C@]3(F)CCCC=C3F)CCC2)cc1 1786671654 OUAZKVNPOUDFFV-VWLOTQADSA-N 487.478 5.156 5 20 JKBD Cc1noc(C)c1C(=O)Nc1ccc(C2(NC(=O)C3(c4cccc([N+](=O)[O-])c4)CCC3)CCC2)cc1 1787331439 NBKJTAFDBWYIPZ-UHFFFAOYSA-N 488.544 5.069 5 20 JKBD O=C(NC1(c2ccc(NC(=O)c3n[nH]cc3[N+](=O)[O-])cc2)CCC1)c1ccccc1Oc1ccccc1 1789689336 HNURNXPATFAKHH-UHFFFAOYSA-N 497.511 5.172 5 20 JKBD O=C(/C=C/c1ccccc1[N+](=O)[O-])Nc1ccc(C2(NC(=O)/C=C/c3ccco3)CCC2)cc1 1792315545 ZWCVRVUUAULENX-XBXUPPNFSA-N 457.486 5.049 5 20 JKBD Cc1cc(CCCC(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2ccc4ccoc4c2)C3)c([N+](=O)[O-])cc1F 1793405760 ZWTCSLKBCSTHCN-KOUNCHBCSA-N 493.535 5.063 5 20 JKBD O=C(CCc1cccc([N+](=O)[O-])c1)Nc1cc([C@@H]2CCCCN2C(=O)/C=C/C2CCCCC2)[nH]n1 1815538198 AJMKTANGFQGKFJ-JLQMKUNGSA-N 479.581 5.079 5 20 JKBD O=C(CCc1cccc([N+](=O)[O-])c1)N1CCC([C@@H]2CCCCN2C(=O)Cc2ccc(Cl)cc2)CC1 1826500060 IMWFQURFRHPNMJ-VWLOTQADSA-N 498.023 5.043 5 20 JKBD Cc1cc(O)c([N+](=O)[O-])cc1C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2ccc(C3CC3)cc2)CC1 1830788908 DTBASBCQNOZDRU-XMMPIXPASA-N 491.588 5.033 5 20 JKBD O=C(C[C@@H]1C[C@@H]2CC[C@H]1C2)N1CCC([C@@H]2CCCCN2C(=O)CSc2ccccc2[N+](=O)[O-])CC1 1831777288 NVISAYVQKJJKDY-SWUCNREESA-N 499.677 5.133 5 20 JKBD COc1ccc([N+](=O)[O-])cc1NC(=O)[C@@H](C)Sc1nnc(-c2cccs2)n1Cc1ccccc1 3465668 KQJZJJUTBZSIKX-OAHLLOKOSA-N 495.586 5.091 5 20 JKBD Cc1cccc([N+](=O)[O-])c1NC(=O)CSc1nnc(-c2ccc(Cl)cc2Cl)n1CC(C)C 9847472 QXBUGZYUGURCCD-UHFFFAOYSA-N 494.404 5.855 5 20 JKBD Cc1occc1-c1nnc(SCC(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)n1-c1ccccc1 22033487 BACMUJGQMCSOBP-UHFFFAOYSA-N 469.910 5.128 5 20 JKBD O=C(OCC(=O)N1N=C(c2cc3ccccc3o2)C[C@H]1c1ccco1)c1ccc(Cl)c([N+](=O)[O-])c1 24458898 MWUXGZHPAYJJFE-IBGZPJMESA-N 493.859 5.122 5 20 JKBD Cc1nn(Cc2ccc(C(=O)Nc3ccc(-c4cn5ccsc5n4)cc3)cc2)c(C)c1[N+](=O)[O-] 29794875 QOXJPGIHECDGPH-UHFFFAOYSA-N 472.530 5.085 5 20 JKBD C[C@@H](Nc1ccc(C(=O)N(Cc2cccc(Br)c2)C2CC2)cc1[N+](=O)[O-])c1ccccn1 302967421 HKULPOJXZGJWGN-MRXNPFEDSA-N 495.377 5.730 5 20 JKBD O=C(Nc1nnc(C(F)F)s1)c1c2c(nc3ccccc13)/C(=C/c1ccc([N+](=O)[O-])cc1)CCC2 409461713 WHINXRRDVFQVRA-WYMLVPIESA-N 493.495 6.061 5 20 JKBD O=C(C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)NCc1cc(F)cc(F)c1 503030389 IZWCROJNHGZFFF-RQZCQDPDSA-N 465.481 5.730 5 20 JKBD Cc1cc(NC(=O)c2ccccc2Cl)sc1C(=O)N1c2ccc([N+](=O)[O-])cc2C[C@H]1C 504300284 VJFAXTUWNSFLLC-CYBMUJFWSA-N 455.923 5.462 5 20 JKBD C[C@@H]1Cc2cc([N+](=O)[O-])ccc2N1C(=O)c1ccc(COc2cccc(Br)c2)o1 504303298 GATFNJTVKYRRRS-CYBMUJFWSA-N 457.280 5.121 5 20 JKBD C[C@H]1Cc2cc([N+](=O)[O-])ccc2N1C(=O)Cc1ccc(NC(=O)c2ccc(Br)cc2)cc1 504305546 WCCDWQPTZJUNOV-HNNXBMFYSA-N 494.345 5.130 5 20 JKBD COc1cc(C(=O)Nc2nc(-c3ccc(C)s3)c(C)s2)c([N+](=O)[O-])cc1OC(F)F 504866458 ZHUCHOKPVOSGDX-UHFFFAOYSA-N 455.464 5.259 5 20 JKBD C[C@H](Nc1ccc(C(=O)N(C)[C@@H](C)c2ccc(C(F)(F)F)cc2)cc1[N+](=O)[O-])c1ccccn1 506188063 GOHHUSIZJIDBPC-HOTGVXAUSA-N 472.467 6.015 5 20 JKBD CCCc1ccc([C@@H](NC(=O)c2cc(OC)c(OCC)cc2[N+](=O)[O-])c2cccs2)cc1 507206376 ZDMYQVZDIVJSIX-HSZRJFAPSA-N 454.548 5.536 5 20 JKBD Cc1ccc(-c2nnc(-c3ccc(C(=O)N(Cc4ccc([N+](=O)[O-])cc4)C(C)C)cc3)o2)cc1 509708706 AXJQJJVKSBHKJK-UHFFFAOYSA-N 456.502 5.671 5 20 JKBD O=C(Nc1ccccc1OC[C@H]1CCCCO1)c1cc([N+](=O)[O-])ccc1NCc1ccccc1 511400632 WVQJCFQHZIWADA-OAQYLSRUSA-N 461.518 5.407 5 20 JKBD COc1cc(C(=O)Nc2nc(-c3ccccc3F)cs2)c([N+](=O)[O-])cc1OCc1cscn1 511411219 DKONAORLYFAQQM-UHFFFAOYSA-N 486.506 5.154 5 20 JKBD C[C@@H]([C@H]1C[C@H]2CC[C@H]1C2)n1c(SCc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)nnc1-c1ccco1 514298533 PHGCLEVBYBGRMU-RIVXBTQJSA-N 492.561 5.786 5 20 JKBD C[C@H](Sc1nnc(-c2ccccc2)n1[C@@H](C)c1ccccc1)C(=O)Nc1ccccc1[N+](=O)[O-] 515488152 VKSSYCHTWOPRLY-ROUUACIJSA-N 473.558 5.582 5 20 JKBD CSc1ccc([C@@H](CNc2cc3ncnc(O)c3cc2[N+](=O)[O-])N2CCc3sccc3C2)cc1 515550209 GLQYCLGXSNXSBY-JOCHJYFZSA-N 493.614 5.239 5 20 JKBD C[C@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)Nc1ccc(Cl)cc1NC(=O)c1ccco1 520381636 AGKDDZXICQGMER-NSHDSACASA-N 464.261 5.153 5 20 JKBD Cc1ccc(Sc2ccc(C(=O)N3CCC(C(=O)NC4CCCCC4)CC3)cc2[N+](=O)[O-])cc1 520965338 OOGQHKABTIXTJC-UHFFFAOYSA-N 481.618 5.356 5 20 JKBD Cc1ccc(NC(=O)c2cccc(C(F)(F)F)c2)cc1NC(=O)N(C)Cc1ccccc1[N+](=O)[O-] 521298883 UMNGADIPCYAFHS-UHFFFAOYSA-N 486.450 5.838 5 20 JKBD Cc1cnn([C@@H]2CCCc3ccccc32)c1NC(=O)c1ccc(N[C@@H](C)c2ccccn2)c([N+](=O)[O-])c1 524378349 PEGIFPUZQBUFAU-UQBPGWFLSA-N 496.571 5.846 5 20 JKBD CC(C)N(Cc1nnc(-c2ccccc2Cl)o1)C(=O)c1ccc(N2CCC[C@H](C)C2)c([N+](=O)[O-])c1 600864520 LFGSRRAOXURYRP-KRWDZBQOSA-N 497.983 5.585 5 20 JKBD CCNC(=O)c1cccc(NC(=O)c2ccccc2Sc2ccc(C(F)(F)F)cc2[N+](=O)[O-])c1 603385519 DXFGLXYKDFSIRX-UHFFFAOYSA-N 489.475 5.767 5 20 JKBD Cc1ccc(Sc2ccc(NC(=O)c3ccc(S(C)(=O)=O)c([N+](=O)[O-])c3)cc2)cc1C 603461733 NHVGLUQMNAZTKD-UHFFFAOYSA-N 456.545 5.019 5 20 JKBD O=C(N[C@@H](c1ccc(F)cc1)c1cccs1)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-] 603732661 PSTVYXVJPYFRGP-SFHVURJKSA-N 454.401 5.256 5 20 JKBD O=C(Nc1cccc(CNC(=O)c2cc([N+](=O)[O-])ccc2Sc2ccccc2)c1)c1ccncc1 604023772 SOTOMIQQYQWIES-UHFFFAOYSA-N 484.537 5.323 5 20 JKBD Cc1cccc(NC(=O)Nc2cccc(CNC(=O)[C@H](C)Sc3ccc([N+](=O)[O-])cc3)c2)c1 604180426 XGOPOVLFIIPDDY-KRWDZBQOSA-N 464.547 5.344 5 20 JKBD COc1cc(C(=O)NC2CCN(C(C)(C)C)CC2)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 604182720 KMXWGZDTJUFBPW-UHFFFAOYSA-N 461.946 5.042 5 20 JKBD C[C@@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)N1CCC[C@H]1c1cccc(Br)c1 604446952 LGNQZUISGVJMHU-WBMJQRKESA-N 453.720 5.142 5 20 JKBD O=C(C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)N(Cc1cccnc1)C1CC1 604484984 HFUONAIXRFNTFJ-ZHZULCJRSA-N 470.554 5.721 5 20 JKBD O=C(Cc1coc2cc(O)ccc12)O[C@@H](C(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1)c1ccccc1 779873662 WWBSJZUASKDUGX-HSZRJFAPSA-N 480.860 5.166 5 20 JKBD Cc1cc(NC(=O)Cc2cn(-c3ccccc3)nc2-c2ccc([N+](=O)[O-])cc2)ccc1N(C)C 915195694 BNUDMKLQJCIAEO-UHFFFAOYSA-N 455.518 5.003 5 20 JKBD C[C@H](NC(=O)c1cc([N+](=O)[O-])ccc1Cl)c1cccc(NC(=O)Cc2ccccc2F)c1 916074762 ZBXQOBAKIJHLMH-AWEZNQCLSA-N 455.873 5.060 5 20 JKBD Cc1ccc(NC(=S)Nc2ccc([N+](=O)[O-])cc2)cc1NC(=S)Nc1ccc([N+](=O)[O-])cc1 916115775 XIHVKMVHPTXQLN-UHFFFAOYSA-N 482.547 5.429 5 20 JKBD C[C@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)OCC(=O)Nc1cc(Cl)c(Cl)cc1Cl 916523184 NPIJQIXHXXNMLZ-VIFPVBQESA-N 463.726 5.218 5 20 JKBD CC(=O)N(c1ccc(C)cc1)c1nc(/C=C2\N=C(c3ccc(Cl)c([N+](=O)[O-])c3)OC2=O)cs1 917601048 LDOVBZMZVZEGHF-ZDLGFXPLSA-N 482.905 5.042 5 20 JKBD Cc1ccc(NS(=O)(=O)c2ccc(Cl)c(C(=O)N[C@H](C)c3cccc([N+](=O)[O-])c3)c2)cc1C 918135714 JBACYOGMCVZZPC-MRXNPFEDSA-N 487.965 5.157 5 20 JKBD O=C(CSc1ccccc1[N+](=O)[O-])NC1(c2ccc(NC(=O)[C@@H](F)c3ccccc3)cc2)CCC1 1786615204 KUPNMGAAZYJWEM-DEOSSOPVSA-N 493.560 5.532 5 20 JKBD O=C(CSc1ccccc1[N+](=O)[O-])NC1(c2ccc(NC(=O)c3cccs3)cc2)CCC1 1787276554 MCDQHGGFUFUHLV-UHFFFAOYSA-N 467.572 5.196 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)NC1(c2ccc(NC(=O)c3ccc(Cl)o3)cc2)CCC1 1788881222 XZOYPNSKIIQRCD-UHFFFAOYSA-N 471.872 5.350 5 20 JKBD Cc1cc(C(=O)NC2(c3ccc(NC(=O)c4cccc(F)c4[N+](=O)[O-])cc3)CCC2)c(C)o1 1790698520 XIEBTGIGOZBORI-UHFFFAOYSA-N 451.454 5.005 5 20 JKBD O=C(Cc1cc(F)ccc1[N+](=O)[O-])Nc1ccc(C2(NC(=O)CCCC(F)(F)F)CCC2)cc1 1792308284 IKJUXEXTPVGAFN-UHFFFAOYSA-N 481.446 5.143 5 20 JKBD Cc1ccc([C@@H](C)C(=O)N2CCC([C@@H]3CCCCN3C(=O)Cc3cc([N+](=O)[O-])ccc3F)CC2)cc1 1824950136 YZMKAMWCJGQXEV-IBVKSMDESA-N 495.595 5.008 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)N1CCC([C@H]2CCCCN2C(=O)CCC2CCCC2)CC1 1826269259 DAMSNCDXJZQDBS-HSZRJFAPSA-N 473.589 5.246 5 20 JKBD CC(C)CCC(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cccc(Br)c2[N+](=O)[O-])CC1 1831382032 NVKLOIVWARYPQA-FQEVSTJZSA-N 494.430 5.027 5 20 JKBD CCCCC[C@@H](C)C(=O)N1CCCC[C@H]1C1CCN(C(=O)Cc2cc(F)ccc2[N+](=O)[O-])CC1 1831468060 IWOTWIGIPAKFGC-XXBNENTESA-N 475.605 5.113 5 20 JKBD O=C(c1cc2cc([N+](=O)[O-])ccc2s1)N1CC[C@H]2[C@@H]1CCN2C(=O)C1(c2ccccc2)CCCC1 1847428273 GIIGRNAVWLQFDC-VXKWHMMOSA-N 489.597 5.137 5 20 JKBD O=C(Cc1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1)NCc1coc(-c2cccs2)n1 10881342 KYNXCWCRYCTNIX-UHFFFAOYSA-N 485.525 5.023 5 20 JKBD CC(=O)N(c1nc(/C=C/c2ccc3c([N+](=O)[O-])cccc3n2)cs1)c1ccc(F)cc1F 15188871 PBMIUKUSKZHTST-VOTSOKGWSA-N 452.442 5.733 5 20 JKBD c1ccc(Cn2c(CN3CCCC3)nnc2SCc2nc3ccccc3c3ccccc23)cc1 26055381 OXASZWYLBKAOAB-UHFFFAOYSA-N 465.626 5.916 5 20 JKBD COC(=O)c1c(C)n(C2CC2)c2ccc(OC(=O)Cn3c4ccccc4c(=O)c4ccccc43)cc12 71822917 HDTQKQZUKKCKDA-UHFFFAOYSA-N 480.520 5.145 5 20 JKBD O=C(CSc1nnc(-c2ccccc2)n1-c1ccccc1)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 255932797 PFGIKHCGIRRENQ-UHFFFAOYSA-N 499.474 5.592 5 20 JKBD COc1cc(C(=O)N(Cc2ccco2)c2ccc(F)cc2C)c([N+](=O)[O-])cc1OC(F)F 501152692 RZMGAPBCWDAUGJ-UHFFFAOYSA-N 450.369 5.092 5 20 JKBD COc1cc(C(=O)Nc2ccc(OCCN(C)C)cc2)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 502756836 MOYRTRZUAQOOMC-UHFFFAOYSA-N 485.924 5.242 5 20 JKBD COc1ccc(Br)cc1[C@@H]1CCCN1C(=O)[C@@H](C)Oc1ccc(Cl)cc1[N+](=O)[O-] 504877108 RTPAOJLKTAWFBA-WBMJQRKESA-N 483.746 5.150 5 20 JKBD Cc1nn(Cc2ccc(C(=O)NC3(c4ccc(Br)cc4)CCC3)cc2)c(C)c1[N+](=O)[O-] 520683520 JJKQDBYPPDXFKC-UHFFFAOYSA-N 483.366 5.028 5 20 JKBD COc1ccc([C@@H](C)N[C@@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Br)c2ccccc2)cc1 521153040 JPJAUBQVIDNSQB-IVZQSRNASA-N 484.350 5.397 5 20 JKBD COC(=O)Cc1ccc(NC(=O)c2ccccc2Sc2ccc(C(F)(F)F)cc2[N+](=O)[O-])cc1 600664182 VGRVHOQUZSILDP-UHFFFAOYSA-N 490.459 5.733 5 20 JKBD C[C@@H](NC(=O)Nc1cc([N+](=O)[O-])ccc1OC(F)F)c1ccc(OCc2cccnc2)cc1 603829788 AZKJLHZNQZGEBD-CQSZACIVSA-N 458.421 5.053 5 20 JKBD Cn1cc(CCCNC(=O)c2c3c(nc4ccccc24)/C(=C\c2ccc([N+](=O)[O-])cc2)CCC3)cn1 608849553 BNGCMDQPXPSMDB-PGMHBOJBSA-N 481.556 5.116 5 20 JKBD O=[N+]([O-])c1cc(Br)ccc1Sc1nnc(-c2ccc(F)cc2)n1C[C@@H]1CCCO1 608855757 IJTQNBIUTOZBAB-HNNXBMFYSA-N 479.331 5.085 5 20 JKBD C[C@H](CN(C)C(=O)c1ccc(C(=O)N(C)C[C@H](C)c2ccccc2)c([N+](=O)[O-])c1)c1ccccc1 609044503 ABXMCTKVCZMKGZ-RTWAWAEBSA-N 473.573 5.346 5 20 JKBD O=C(NC1CCN(C(=O)c2ccccc2)CC1)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1 612978624 HKOGFOKPNIJECY-UHFFFAOYSA-N 479.920 5.075 5 20 JKBD O=C(OCCc1ccc([N+](=O)[O-])cc1)c1cnn(-c2ncc(C(F)(F)F)cc2Cl)c1C(F)F 731102940 UNYXYKRUWZVWKF-UHFFFAOYSA-N 490.772 5.185 5 20 JKBD CC(=O)c1cccc(O[C@@H](C)C(=O)O[C@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2ccccc2)c1 745231457 YFDQUYJYPFUTAB-HJPURHCSSA-N 496.903 5.141 5 20 JKBD C[C@H](OC(=O)c1csc(-c2ccc([N+](=O)[O-])cc2)n1)C(=O)N[C@H](C)c1cccc2ccccc12 747956661 JDRTVFZKBALHBR-CVEARBPZSA-N 475.526 5.294 5 20 JKBD O=C(c1cc([N+](=O)[O-])ccc1N1CCOCC1)N(Cc1ccc(F)cc1)c1nc2ccccc2s1 749132034 VVQWRUUGLQTXTF-UHFFFAOYSA-N 492.532 5.027 5 20 JKBD CCN(C)Cc1cc(O[C@@H]2CCN(C(=O)c3cc([N+](=O)[O-])ccc3SCC3CCCC3)C2)ccn1 856629134 JAGMMOOUTDUUTO-HSZRJFAPSA-N 498.649 5.017 5 20 JKBD COc1c([N+](=O)[O-])cc(N[C@@H](C)c2ccccc2OC(F)F)c([N+](=O)[O-])c1Br 914571087 KOQXVIZTLNCZRA-QMMMGPOBSA-N 462.203 5.049 5 20 JKBD O=C(C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)NCCc1ccc([N+](=O)[O-])cc1 919855203 JATLAOVEVPSWJZ-XDJHFCHBSA-N 488.525 5.402 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Cl)[C@H](NCc1ccc(N2CCCCC2=O)cc1)c1ccccc1 920062090 BDSVUDYWQTWTTC-RUZDIDTESA-N 492.963 5.235 5 20 JKBD Cc1ccc(C(=O)Nc2ccc(C3(NC(=O)c4cc5cc([N+](=O)[O-])ccc5s4)CCC3)cc2)o1 1786491829 CYHPEJBCHZUYDM-UHFFFAOYSA-N 475.526 5.772 5 20 JKBD O=C(NC1(c2ccc(NC(=O)c3cccc(F)c3[N+](=O)[O-])cc2)CCC1)c1cc(C(F)(F)F)c[nH]1 1790698642 FMNPNQKVZFUVEL-UHFFFAOYSA-N 490.413 5.142 5 20 JKBD COc1cc(C(=O)Nc2ccc(C3(NC(=O)CSC4CCCC4)CCC3)cc2)ccc1[N+](=O)[O-] 1792164246 XFUASRJAJVNYGJ-UHFFFAOYSA-N 483.590 5.027 5 20 JKBD O=C(/C=C/c1ccccc1[N+](=O)[O-])Nc1ccc(C2(NC(=O)c3c(F)ccnc3Cl)CCC2)cc1 1792315433 OEDMPACHBYUMPQ-IZZDOVSWSA-N 494.910 5.243 5 20 JKBD CC1(C)CCC(CC(=O)N2CC[C@@H](CNC(=O)c3cccc(F)c3[N+](=O)[O-])[C@@H]2c2cccnc2)CC1 1811320014 GGAMLKCDBKIZCF-RDPSFJRHSA-N 496.583 5.055 5 20 JKBD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2cccc3ccccc23)[nH]n1)c1cccc(F)c1[N+](=O)[O-] 1821169486 IRBONUBIBYAYHH-QFIPXVFZSA-N 487.491 5.230 5 20 JKBD CC[C@H](C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cc([N+](=O)[O-])c(O)cc2C)CC1)c1ccccc1 1826314274 AJZLVIFZDGNWEY-LADGPHEKSA-N 493.604 5.036 5 20 JKBD Cc1ccc(/C=C/C(=O)N2CCC([C@H]3CCCCN3C(=O)c3cc(F)cc([N+](=O)[O-])c3)CC2)s1 1830615619 MWBLBXDKNQGXOI-NDEDVSTASA-N 485.581 5.051 5 20 JKBD COc1cc([N+](=O)[O-])ccc1NC(=O)CSc1nnc(-c2ccccc2)n1-c1ccc(Cl)cc1 11196874 VZTNUXVOCULPMD-UHFFFAOYSA-N 495.948 5.235 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Cl)[C@@H](Nc1cccc(N2CCCCC2=O)c1)c1ccccc1 27048289 YDWJAOISYRZPLT-DEOSSOPVSA-N 478.936 5.557 5 20 JKBD O=C(OCc1nnc(-c2ccc([N+](=O)[O-])cc2)o1)c1cc(-c2ccccc2)nc2ccccc12 28614314 TZRONLPLGOJMMF-UHFFFAOYSA-N 452.426 5.217 5 20 JKBD COCCn1c(S[C@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)nc2cc(Cl)ccc21 32881411 ZGMUYZLZGKICQC-LLVKDONJSA-N 469.350 5.017 5 20 JKBD Cc1ccc(CN(Cc2ccco2)C(=O)c2ccc(N[C@@H](C)c3ccccn3)c([N+](=O)[O-])c2)s1 109202759 NBQZRVBWECDATC-SFHVURJKSA-N 476.558 5.968 5 20 JKBD O=C(CSc1ccc(C(F)(F)F)cc1[N+](=O)[O-])N(Cc1cccnc1)c1ccc(F)cc1 195701887 BRMQOTOAELCBGS-UHFFFAOYSA-N 465.428 5.473 5 20 JKBD CC(C)N(C)C(=O)c1ccc(Cl)c(NC(=O)c2csc(-c3cccc([N+](=O)[O-])c3)n2)c1 303167038 WCBVSLYGZOEXRB-UHFFFAOYSA-N 458.927 5.104 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Br)[C@H](NCc1cc2ccccc2[nH]1)c1ccccc1 476989811 NOZJCZQPHJTJGR-JOCHJYFZSA-N 479.334 5.308 5 20 JKBD Cc1cc([C@@H]2CCCN2C(=O)C/C(=C/c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)on1 481567839 CIFNCWOFTOERMV-NUVSWBFWSA-N 474.542 5.795 5 20 JKBD CCC(=O)Nc1ccc(C)c(NC(=O)c2ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])cc2)c1 481906830 LTRAKSSIDCEFEH-UHFFFAOYSA-N 453.882 5.950 5 20 JKBD Cc1ccc(NC(=O)C/C(=C\c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)cc1-n1cnnn1 482608887 SCYBLRSQXDQDNT-LDADJPATSA-N 497.540 5.058 5 20 JKBD O=C(N[C@@H](c1ccccc1)c1cccnc1)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1 485528586 DKTYNAQJFUIIPH-DEOSSOPVSA-N 459.889 5.955 5 20 JKBD CCCN(CC(=O)Nc1cc(Cl)ccc1Cl)C(=O)c1csc(-c2ccc([N+](=O)[O-])cc2)n1 496363451 PTOKJOTYGXWCKZ-UHFFFAOYSA-N 493.372 5.516 5 20 JKBD CC[C@@H](C)Sc1ccc(NC(=O)C(=O)N[C@@H](C)c2cccc([N+](=O)[O-])c2)c(C(F)(F)F)c1 501442864 UREXANNUXAHROT-OLZOCXBDSA-N 469.485 5.320 5 20 JKBD COc1ccc(/C=C(/CC(=O)O)c2nc3ccccc3o2)cc1OCc1ccc([N+](=O)[O-])cc1 502319553 KHRAXTPMZCZSKD-PDGQHHTCSA-N 460.442 5.339 5 20 JKBD COc1cc(C(=O)NCC2(c3ccccc3C)CCCCC2)c([N+](=O)[O-])cc1OCc1cscn1 505116554 CCSUXBCLOJCHFE-UHFFFAOYSA-N 495.601 5.579 5 20 JKBD CN(C)c1ccc(CNC(=O)c2ccccc2Sc2ccc(C(F)(F)F)cc2[N+](=O)[O-])cn1 505667764 AOAMBTDMZUPKMB-UHFFFAOYSA-N 476.480 5.156 5 20 JKBD COc1ccc(NC(=O)c2ccc(N3C[C@H](C)C[C@@H](C)C3)c([N+](=O)[O-])c2)cc1OCc1cccnc1 515498021 GNLUHFKEVLHCCI-RTBURBONSA-N 490.560 5.312 5 20 JKBD C[C@H](c1ccccc1)n1c(Sc2ccc(S(C)(=O)=O)cc2[N+](=O)[O-])nnc1-c1ccccc1 515555139 UCGCTPSIIIIYEQ-MRXNPFEDSA-N 480.571 5.017 5 20 JKBD COc1cc(C(=O)Nc2cccc(Cl)c2Cl)c([N+](=O)[O-])cc1OCc1cscn1 516700410 YEPMPNOFFGCLIW-UHFFFAOYSA-N 454.291 5.198 5 20 JKBD O=C(Nc1ccc2[nH]c(-c3ccc(F)cc3)nc2c1)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-] 517362613 CJFBOVXJZUKWCW-UHFFFAOYSA-N 474.370 5.471 5 20 JKBD Cc1ccc([N+](=O)[O-])cc1NC(=O)CN[C@H](c1ccccc1)c1ccc(Br)cc1F 518460243 RGQUMFHNXVESQH-JOCHJYFZSA-N 472.314 5.123 5 20 JKBD O=C(Nc1ccc2nc([C@H]3CCCO3)[nH]c2c1)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1 520262373 VCPTTYNEYVTSMA-JOCHJYFZSA-N 478.892 6.021 5 20 JKBD CSc1ccc(C(=O)N2CCCC[C@@H]2C(=O)Nc2cc(Cl)ccc2Cl)cc1[N+](=O)[O-] 523445776 ASTYMOJRTFYXPP-MRXNPFEDSA-N 468.362 5.257 5 20 JKBD Cc1cc(C)n(CCCNC(=O)c2ccccc2Sc2ccc(C(F)(F)F)cc2[N+](=O)[O-])n1 603468642 ULWSVKMGCSGPEX-UHFFFAOYSA-N 478.496 5.398 5 20 JKBD COc1ccc(CNCc2cc(F)cc(Br)c2)cc1OCc1ccc([N+](=O)[O-])cc1 603942046 AYDILESGRZPCKE-UHFFFAOYSA-N 475.314 5.374 5 20 JKBD C[C@H](CNC(=O)C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)CN1CCCCC1 604441494 GMZVHHIRKKYNAC-DDNKWHRWSA-N 478.618 5.373 5 20 JKBD Cc1csc(-c2cccc(NC(=O)c3ccc(N[C@@H](C)c4ccccn4)c([N+](=O)[O-])c3)c2)n1 608808439 JXNAXLUKRZNVJD-INIZCTEOSA-N 459.531 5.847 5 20 JKBD COc1ccc([C@@H](CNc2cc3c(cc2[N+](=O)[O-])CCC(=O)N3)c2c[nH]c3ccccc23)cc1 725784372 HJNSVOBZIZDNAW-HXUWFJFHSA-N 456.502 5.213 5 20 JKBD O=C(c1ccc(I)c([N+](=O)[O-])c1)N1CCc2sccc2[C@H]1c1cccs1 727748151 KBLUVAGGIGDPLH-KRWDZBQOSA-N 496.351 5.110 5 20 JKBD CN(CCNC(=O)C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)C(=O)OC(C)(C)C 728865794 DGIVMJWRSIUUEE-SDXDJHTJSA-N 496.589 5.118 5 20 JKBD Cc1ccc2c(Cl)c(C(=O)OCC(=O)Nc3ccc([N+](=O)[O-])cc3C(F)(F)F)sc2c1 729729078 XBHLJZIOYOJOEV-UHFFFAOYSA-N 472.828 5.586 5 20 JKBD C[C@H](OC(=O)c1ccc(NCc2ccccc2)c([N+](=O)[O-])c1)c1nnc(-c2ccc(F)cc2)o1 745967985 YQUFOASAXDPHKB-HNNXBMFYSA-N 462.437 5.314 5 20 JKBD Cc1c(NC(=O)[C@H](C)OC(=O)CCC(=O)c2ccc3c(c2)-c2ccccc2C3)cccc1[N+](=O)[O-] 746633036 BFKHOUDBPMZFKW-KRWDZBQOSA-N 472.497 5.008 5 20 JKBD Cc1ccc(NC(=O)[C@@H](OC(=O)c2csc(-c3ccc([N+](=O)[O-])cc3)n2)c2ccccc2)cc1 747955378 HSOZXJGAAOMKSC-QFIPXVFZSA-N 473.510 5.564 5 20 JKBD Cc1[nH]c2ccc(Br)cc2c1CC(=O)O[C@H](C)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 915434004 NGMOSVINSCYKNT-GFCCVEGCSA-N 485.294 5.044 5 20 JKBD CC(=O)N(c1ccc(C)c(C)c1)c1nc(COC(=O)CCOc2cc(C)ccc2[N+](=O)[O-])cs1 915440252 SKMYIENYGDEECS-UHFFFAOYSA-N 483.546 5.173 5 20 JKBD Cc1ccc(NC(=O)[C@@H](OC(=O)c2csc(Cc3ccccc3)n2)c2ccccc2)c([N+](=O)[O-])c1 915453884 HAFFPNONTBACIN-DEOSSOPVSA-N 487.537 5.487 5 20 JKBD O=C(Nc1cc([N+](=O)[O-])c(F)cc1F)[C@@H](Oc1cccc(Br)c1)c1ccccc1 916042506 CENIHKSHOGOFCE-IBGZPJMESA-N 463.234 5.394 5 20 JKBD CC(=O)N(c1nc(COC(=O)CCOc2ccccc2[N+](=O)[O-])cs1)c1c(C)cc(C)cc1C 919491689 MDWHHRCGHWPBSQ-UHFFFAOYSA-N 483.546 5.173 5 20 JKBD O=C(Nc1cccc(-n2ccnc2O)c1)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1 920082706 VCDDQBBJVCPDBV-UHFFFAOYSA-N 450.838 5.184 5 20 JKBD Cc1cc(C(=O)N2CCCC[C@@H]2C)ccc1NC(=O)c1cc([N+](=O)[O-])ccc1N1CCC(C)CC1 921153320 INOJFVWQHZJJOG-FQEVSTJZSA-N 478.593 5.406 5 20 JKBD Cc1ccc2oc(C(=O)NC3(c4ccc(NC(=O)/C=C/c5ccc([N+](=O)[O-])o5)cc4)CCC3)cc2n1 1786204414 GLIMTPPZDZFWCN-DHZHZOJOSA-N 486.484 5.099 5 20 JKBD O=C(NC1(c2ccc(NC(=O)C3CCC(F)(F)CC3)cc2)CCC1)c1nc2cc([N+](=O)[O-])ccc2[nH]1 1786246123 RNKYISJFIASAGX-UHFFFAOYSA-N 497.502 5.044 5 20 JKBD CNc1ccc(C(=O)Nc2ccc(C3(NC(=O)/C=C/c4ccccc4[N+](=O)[O-])CCC3)cc2)cc1 1788002871 GFBPAXNFZWXCSA-CXUHLZMHSA-N 470.529 5.098 5 20 JKBD O=C(/C=C/c1ccccc1[N+](=O)[O-])NC1(c2ccc(NC(=O)c3cc4sccn4c3)cc2)CCC1 1788413503 ODVDNGBCDFDRNA-IZZDOVSWSA-N 486.553 5.370 5 20 JKBD Cc1[nH]ccc1C(=O)Nc1ccc(C2(NC(=O)c3cc(Br)ccc3[N+](=O)[O-])CCC2)cc1 1788806621 ZRFGUZWEDNJDEX-UHFFFAOYSA-N 497.349 5.055 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)NC1(c2ccc(NC(=O)c3cc4ccoc4cn3)cc2)CCC1 1790834291 HPOPTRSMHDBKJD-UHFFFAOYSA-N 488.475 5.245 5 20 JKBD Cc1cc2cc(C(=O)Nc3ccc(C4(NC(=O)/C=C/c5ccc([N+](=O)[O-])o5)CCC4)cc3)ccc2[nH]1 1790985982 QNKOKQUHXKFLSG-DHZHZOJOSA-N 484.512 5.439 5 20 JKBD O=C(C[C@H]1C[C@@H]2CC[C@H]1C2)Nc1ccc(C2(NC(=O)CSc3ccccc3[N+](=O)[O-])CCC2)cc1 1791325284 GLVMHNSGGSJBFT-HSALFYBXSA-N 493.629 5.647 5 20 JKBD Cc1c(C(=O)NC2(c3ccc(NC(=O)[C@H]4C[C@@]4(F)Cl)cc3)CCC2)cc(Cl)cc1[N+](=O)[O-] 1791675853 BUWKKBAIQXRGLV-VGSWGCGISA-N 480.323 5.229 5 20 JKBD O=C(CC1CCC1)Nc1ccc(C2(NC(=O)c3ccc(Br)c([N+](=O)[O-])c3)CCC2)cc1 1792271701 KIWXGUQZCQZAKT-UHFFFAOYSA-N 486.366 5.295 5 20 JKBD CC(C)(C)CCCCCC(=O)N1CC[C@@H](CNC(=O)/C=C/c2ccc([N+](=O)[O-])o2)[C@@H]1c1cccnc1 1803263574 CCDXQMFRKNSIRX-PYEYBSRVSA-N 496.608 5.299 5 20 JKBD Cc1c(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)[C@@H]3CCC[C@H]3C)[nH]n2)cc(Cl)cc1[N+](=O)[O-] 1821293965 MMABIMQTQDBUKE-NRXGSXMXSA-N 473.961 5.022 5 20 JKBD CC[C@H]1CC[C@H](C(=O)Nc2cc([C@@H]3CCCCN3C(=O)CCc3cccc([N+](=O)[O-])c3)[nH]n2)CC1 1822222970 CJLBUHJZDJHERP-LEDOBFOHSA-N 481.597 5.159 5 20 JKBD O=C(CSc1ccccc1[N+](=O)[O-])N1CCC([C@@H]2CCCCN2C(=O)/C=C/c2ccccc2)CC1 1826531310 NRASDHHNCAIWFG-ZVQQDINOSA-N 493.629 5.020 5 20 JKBD O=C(c1ccc(Cl)c(F)c1)N1CCC([C@H]2CCCCN2C(=O)c2cc(F)cc([N+](=O)[O-])c2)CC1 1830618203 MPUWUCDMVMNHHV-JOCHJYFZSA-N 491.922 5.074 5 20 JKBD O=C(c1ccsc1)N1CCC([C@@H]2CCCCN2C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)CC1 1831060367 VCKNMYDBKMQJKC-FQEVSTJZSA-N 483.615 5.418 5 20 JKBD CCCCC[C@H](C)C(=O)N1CCCC[C@H]1C1CCN(C(=O)CSc2ccccc2[N+](=O)[O-])CC1 1831467771 ABNGOOSCGVQRTP-UNMCSNQZSA-N 489.682 5.523 5 20 JKBD O=C(/C=C/c1ccccc1[N+](=O)[O-])N1CCC([C@H]2CCCCN2C(=O)C[C@@H]2C[C@@H]3CC[C@H]2C3)CC1 1831484679 ZYYSLLWYIYIRBY-FZXSSXSTSA-N 479.621 5.054 5 20 JKBD COc1ccc(/C=C2\CCn3c2nc2cc(Cl)ccc2c3=O)cc1OCc1ccc([N+](=O)[O-])cc1 20620783 PGFQUQMTEMVUDI-LDADJPATSA-N 489.915 5.490 5 20 JKBD C[C@H](Sc1nc(-c2ccccc2)cs1)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 21957891 UUTOSRBIBQDGAT-NSHDSACASA-N 453.467 5.856 5 20 JKBD COc1ccc(-c2nnc(S[C@@H](C)C(=O)Nc3cccc([N+](=O)[O-])c3C)n2-c2ccccc2)cc1 23293629 DEKVYKGPIGVISL-KRWDZBQOSA-N 489.557 5.279 5 20 JKBD Cc1ccc(NC(=O)[C@@H](Sc2nncn2-c2cccc(Cl)c2)c2ccccc2)c([N+](=O)[O-])c1 25026410 FIGYQRJQKNPTLJ-NRFANRHFSA-N 479.949 5.609 5 20 JKBD O=C(Nc1cccc(CN[C@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2ccccc2)c1)C1CCC1 28384103 APFMBAHPZPVQDL-DEOSSOPVSA-N 492.963 5.456 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Cl)[C@H](N[C@H]1CCSc2c(F)cccc21)c1ccccc1 30504647 DXVIFLBEBOIDEU-PZJWPPBQSA-N 471.941 5.894 5 20 JKBD O=C(Cn1c2ccccc2c(=O)c2ccccc21)Nc1ccc(NC(=O)Nc2ccccc2)cc1 39551112 XSOQDTFKCNFTGP-UHFFFAOYSA-N 462.509 5.437 5 20 JKBD C[C@H](Nc1ccc(C(=O)N2CCC[C@H]2c2nc3ccccc3s2)cc1[N+](=O)[O-])c1ccccn1 108753510 JAHUBARREMWZRF-KKSFZXQISA-N 473.558 5.750 5 20 JKBD COc1ccc(F)cc1[C@@H](C)NC(=O)Cc1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1 117311033 GOZNOJAKBJTKHC-QGZVFWFLSA-N 474.492 5.015 5 20 JKBD C[C@@H](Nc1ccc(C(=O)NC[C@@H](c2cccc(Cl)c2)N2CCCC2)cc1[N+](=O)[O-])c1ccccn1 507050986 HEHULGHZQZJWQS-CJAUYULYSA-N 493.995 5.383 5 20 JKBD CCOc1cc(CNCc2ccc(F)c(F)c2)ccc1OCc1cc([N+](=O)[O-])cc2c1OCOC2 509597789 CQJSJYKLYAUIRQ-UHFFFAOYSA-N 486.471 5.007 5 20 JKBD COc1cc([C@@H](C)NC(=O)Nc2cc([N+](=O)[O-])ccc2OC(F)F)ccc1OCc1ccncc1 510850088 ODETXODCKGNBKL-CQSZACIVSA-N 488.447 5.062 5 20 JKBD COc1cc(CCNC(=O)N(Cc2ccc(Cl)c(Cl)c2)C(C)C)c([N+](=O)[O-])cc1OC 514026899 MAYDGGWWWRVQBA-UHFFFAOYSA-N 470.353 5.082 5 20 JKBD O=C(Nc1cccc(C(F)(F)F)c1)c1cccc(NC(=O)c2c[nH]c3cc([N+](=O)[O-])ccc23)c1 514839550 LFGWIFHHTDLXNT-UHFFFAOYSA-N 468.391 5.600 5 20 JKBD O=C(C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)N1CCC[C@@H]1c1cccc(F)c1 516142309 RSSUMHKYQKISKJ-NAENUDGNSA-N 487.556 6.638 5 20 JKBD CNc1ccc(C(=O)Nc2cccc(NC(=O)c3cccc(C(F)(F)F)c3)c2)cc1[N+](=O)[O-] 519057395 VZQLNEIPFYDDQC-UHFFFAOYSA-N 458.396 5.160 5 20 JKBD C[C@H]1CCCN(c2ccc(C(=O)N3CCC(c4nc5cc(Cl)ccc5o4)CC3)cc2[N+](=O)[O-])C1 603921793 NUPQZGXTUHZURO-INIZCTEOSA-N 482.968 5.646 5 20 JKBD C[C@H](NCc1ccc(Oc2ccc(F)cc2)c([N+](=O)[O-])c1)c1ccc(OCc2cccnc2)cc1 608781992 XUMNXQBPQXPOQL-IBGZPJMESA-N 473.504 6.351 5 20 JKBD O=C(C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)N1CCC[C@@H](N2CCCC2)C1 609346249 WDQISEIVQDURTL-JXAXNMIRSA-N 476.602 5.222 5 20 JKBD Cc1ccc(Sc2ccc(C(=O)N3CC[C@@H](CNC(=O)OC(C)(C)C)C3)cc2[N+](=O)[O-])cc1 725735169 WYJSXBNOFNZVMX-KRWDZBQOSA-N 471.579 5.041 5 20 JKBD CCc1cc[n+](/C(C(=S)Nc2cc(OC)ccc2OC)=C(/O)c2ccc(C)c([N+](=O)[O-])c2)cc1 726570435 OSIOQYPRHBRREP-UHFFFAOYSA-O 480.566 5.094 5 20 JKBD O=C(Nc1ccc(OC(=O)[C@H](OC2CCCC2)c2ccccc2)cc1)c1cc([N+](=O)[O-])ccc1Cl 726911173 LFNKREMIAHJHAW-XMMPIXPASA-N 494.931 6.106 5 20 JKBD O=C(OCC[C@H]1CCCCN1C(=O)c1cnc(Cc2ccc(F)cc2)s1)c1cccc([N+](=O)[O-])c1 727102307 ZATPHLUJOUPHQK-HXUWFJFHSA-N 497.548 5.023 5 20 JKBD C[C@@]1(c2cccc(NC(=O)CCC(=O)c3ccc4ccc5cccc6ccc3c4c56)c2)NC(=O)NC1=O 727755633 FVFRBCBJJHUVRS-PMERELPUSA-N 489.531 5.240 5 20 JKBD CC(C)n1c(S[C@@H](C)C(=O)Nc2ccc(F)c([N+](=O)[O-])c2)nnc1-c1ccc(Cl)cc1Cl 771712333 COYAUQICOGFUOV-NSHDSACASA-N 498.367 5.999 5 20 JKBD Cc1ccc(C(=O)O[C@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2ccccc2)cc1[N+](=O)[O-] 848943783 OFIZEDCDTTYIIH-FQEVSTJZSA-N 469.837 5.002 5 20 JKBD Cc1cc(C)n(Cc2cccc(-c3noc(-c4ccc(N[C@H](C)c5ccccn5)c([N+](=O)[O-])c4)n3)c2)n1 904531704 YGOWZCWLMNLGQK-LJQANCHMSA-N 495.543 5.742 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Cl)[C@@H](Nc1ccc2c(c1)OCCCO2)c1ccccc1 915871323 YFZJCEWEQLUBCI-QFIPXVFZSA-N 453.882 5.201 5 20 JKBD O=C(C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)NCc1ccccc1[N+](=O)[O-] 916423528 YITCITFIYAGMJS-AQTBWJFISA-N 474.498 5.360 5 20 JKBD CCOc1ccccc1-c1nn(CN(Cc2ccccc2[N+](=O)[O-])CC(F)(F)F)c(=S)o1 917451013 RARXKAKIHBFWOZ-UHFFFAOYSA-N 468.457 5.201 5 20 JKBD Cc1c(NC(=O)[C@@H](C)OC(=O)c2csc(-c3cc(Br)cs3)n2)cccc1[N+](=O)[O-] 919632225 QKQBIVNFJYBVIX-SNVBAGLBSA-N 496.364 5.035 5 20 JKBD C[C@H](OC(=O)c1cn(C)nc1-c1ccc([N+](=O)[O-])cc1)C(=O)Nc1c(Cl)cc(Cl)cc1Cl 920551129 UQPSZVSAXRFIJX-JTQLQIEISA-N 497.722 5.140 5 20 JKBD O=C(CSc1ccc(F)cc1F)NC1(c2ccc(NC(=O)c3ccc([N+](=O)[O-])o3)cc2)CCC1 1785747969 CKAIZWXDXSEYDD-UHFFFAOYSA-N 487.484 5.006 5 20 JKBD O=C(COC1CCCCC1)Nc1ccc(C2(NC(=O)Cc3ccc(Cl)cc3[N+](=O)[O-])CCC2)cc1 1786013975 JKJBPIWVMADQMC-UHFFFAOYSA-N 499.995 5.274 5 20 JKBD CN(C)c1ccc([N+](=O)[O-])cc1C(=O)Nc1ccc(C2(NC(=O)[C@]3(F)CCCC=C3F)CCC2)cc1 1790795271 PETXQCKNILHIQM-SANMLTNESA-N 498.530 5.154 5 20 JKBD O=C(c1cccc(F)c1[N+](=O)[O-])N1CCC([C@@H]2CCCCN2C(=O)c2ccc(Cl)cc2F)CC1 1823899297 WEIAPFNPERDDFM-NRFANRHFSA-N 491.922 5.074 5 20 JKBD Cc1c(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3ccccc3)CC2)cc(Cl)cc1[N+](=O)[O-] 1830735744 LKSTZEKCFUUEGV-JOCHJYFZSA-N 469.969 5.104 5 20 JKBD Cc1cccnc1C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)CC1 1831059020 AXHWCROADJAGBP-NRFANRHFSA-N 492.601 5.060 5 20 JKBD Cc1occc1C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)CC1 1831059046 BGTKYMFEHQBEEU-OAQYLSRUSA-N 481.574 5.258 5 20 JKBD Cc1cc(Cl)cc(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)/C=C/c3ccc([N+](=O)[O-])o3)CC2)c1 1832608425 SZWWEFBPFSMZIJ-YHCZKZFASA-N 485.968 5.096 5 20 JKBD CCSc1nnc(NC(=O)c2ccccc2Sc2ccc(C(F)(F)F)cc2[N+](=O)[O-])s1 14740327 LJUOOYQYNXKUPZ-UHFFFAOYSA-N 486.522 5.981 5 20 JKBD CC[C@H](C)Cc1c(C)sc2[nH]c(S[C@@H](C)c3nnc(-c4ccc([N+](=O)[O-])cc4)o3)nc(=O)c12 17952993 HDASPLCIQLFBAH-AAEUAGOBSA-N 485.591 5.693 5 20 JKBD O=C(CSc1nnc(-c2cccc(Cl)c2)o1)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 21547827 MDGGWXMGSNTIDB-UHFFFAOYSA-N 458.805 5.048 5 20 JKBD Cc1nn(Cc2ccc(C(=O)N(Cc3cccc(Br)c3)C3CC3)cc2)c(C)c1[N+](=O)[O-] 25090098 BMEHTDRVSSLRDJ-UHFFFAOYSA-N 483.366 5.024 5 20 JKBD CN(Cc1ccc(Br)o1)[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1 30213701 FIWHFBJEDKGWTN-IBGZPJMESA-N 478.730 5.416 5 20 JKBD Cc1ccccc1C(=O)NC1CCN(C(=O)c2ccc(SCCC(C)C)c([N+](=O)[O-])c2)CC1 32305405 HJRYJPWWQFVOCK-UHFFFAOYSA-N 469.607 5.076 5 20 JKBD CCCOc1cc(NC(=O)Cn2c3ccccc3c(=O)c3ccccc32)c([N+](=O)[O-])cc1OCCC 69523735 LVWNCVIFIYQBGF-UHFFFAOYSA-N 489.528 5.279 5 20 JKBD CCOc1cc(Br)c(NC(=O)Cn2c3ccccc3c(=O)c3ccccc32)cc1OCC 195631233 ZKTCEIZITIXLHP-UHFFFAOYSA-N 495.373 5.353 5 20 JKBD CCOc1cc(C(=O)N[C@H]2CCCc3nc(-c4ccc(F)cc4)sc32)c([N+](=O)[O-])cc1OC 303243386 KZHRKSBUZQZRPQ-INIZCTEOSA-N 471.510 5.072 5 20 JKBD Cc1ccc(Sc2ccc(C(=O)N[C@@H](C)c3ccc(NC(N)=O)cc3)cc2[N+](=O)[O-])cc1 480220828 RTJIPJQBUKTWDC-HNNXBMFYSA-N 450.520 5.036 5 20 JKBD Cc1cc(C(=O)NC2CCCCC2)ccc1NC(=O)c1csc(-c2ccc([N+](=O)[O-])cc2)n1 496614677 ZBNXVAOCUKKPHY-UHFFFAOYSA-N 464.547 5.342 5 20 JKBD COc1ccc([C@@H](C)NC(=O)C/C(=C/c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)cc1 498854582 JZWHOQWIRYXHHA-MNTXUITRSA-N 473.554 6.021 5 20 JKBD C[C@@H](Nc1ccc(C(=O)N(C)Cc2ccc(Br)s2)cc1[N+](=O)[O-])c1ccccn1 505997976 XPDVGIDDIZABIO-CYBMUJFWSA-N 475.368 5.259 5 20 JKBD Cc1ccc(Sc2ccc(CN[C@@H](c3ccccc3F)c3nccn3C)cc2[N+](=O)[O-])cc1 518770805 CACTUFZUSAIJJG-DEOSSOPVSA-N 462.550 5.806 5 20 JKBD O=c1c(Cl)c(NCc2cccc(COCc3ccccc3)c2)cnn1-c1ccc([N+](=O)[O-])cc1 522622247 DPXOAYMXYKUJRT-UHFFFAOYSA-N 476.920 5.123 5 20 JKBD Cc1nn(CCC(=O)N2C[C@H](c3ccccc3Cl)c3c([nH]c4ccccc34)[C@H]2C)c(C)c1[N+](=O)[O-] 523226874 JXSCCXVGGSIIOW-OXQOHEQNSA-N 491.979 5.668 5 20 JKBD COc1ccc(CSCC(=O)N(Cc2ccccn2)c2ccc(Cl)cc2)cc1[N+](=O)[O-] 603998401 ORUZAXRCZSDSDX-UHFFFAOYSA-N 457.939 5.118 5 20 JKBD CCOc1ccc(C(=O)N(Cc2ccc(Cl)c(Cl)c2)Cc2ccccn2)cc1[N+](=O)[O-] 604458390 IJOQISFGPBRJAZ-UHFFFAOYSA-N 460.317 5.538 5 20 JKBD COC(=O)c1ccccc1C(=O)c1ccc(N(C)C[C@@H]2CCCO[C@H]2c2ccccc2)c([N+](=O)[O-])c1 604520420 MPVVQENKSGTKGL-IDISGSTGSA-N 488.540 5.217 5 20 JKBD O=[N+]([O-])c1ccc(-c2ccc(CN[C@H](c3ccccc3)c3ccco3)o2)c(Br)c1 608835660 JPHGKENAARSTFE-JOCHJYFZSA-N 453.292 6.090 5 20 JKBD O=C(Nc1cc(-c2cccs2)nn1CCO)c1ccc(NCc2ccccc2Cl)c([N+](=O)[O-])c1 608944330 WQBYGAVPXINQJQ-UHFFFAOYSA-N 497.964 5.030 5 20 JKBD Cc1csc(Sc2ccc(C(=O)N3CCO[C@@H](c4ccc(F)c(Cl)c4)C3)cc2[N+](=O)[O-])n1 608962187 ALCFJCDVAVSURR-GOSISDBHSA-N 493.969 5.517 5 20 JKBD O=C(c1c2c(nc3ccccc13)/C(=C\c1cccc([N+](=O)[O-])c1)CCC2)N1CCC[C@H](n2ccnc2)C1 609131131 ICDZXWZNHYBJOT-ODFZLOHPSA-N 493.567 5.694 5 20 JKBD CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)NC1C[C@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1 609148118 CCUDJVATDNPDDN-ZIAGYGMSSA-N 455.399 5.424 5 20 JKBD O=C(Nc1ccc(OC(=O)c2cc(OCC(F)(F)F)ccc2[N+](=O)[O-])cc1)c1ccsc1 728886834 SQZQMUMPBORVBP-UHFFFAOYSA-N 466.393 5.069 5 20 JKBD C[C@@H](OC(=O)c1ccc(F)c(NC(=O)OC(C)(C)C)c1)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 730632283 QWTRRLGJZPCSDZ-GFCCVEGCSA-N 472.429 5.049 5 20 JKBD C[C@@H](OC(=O)c1ccc(COc2ccc3ccccc3c2)o1)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 746134905 JDOKYRXUQITYRY-MRXNPFEDSA-N 485.452 5.888 5 20 JKBD CCc1noc(C[C@@]2(O)CCCN(C(=O)CCC(=O)c3ccc4ccc5cccc6ccc3c4c56)C2)n1 856703947 NKRHYXIWQACEKT-PMERELPUSA-N 495.579 5.089 5 20 JKBD COc1c([N+](=O)[O-])cc(N[C@H](C)c2ccccc2OC(F)F)c([N+](=O)[O-])c1Br 914571086 KOQXVIZTLNCZRA-MRVPVSSYSA-N 462.203 5.049 5 20 JKBD CC(C)(C)OC(=O)Nc1ccc(C(=O)N(Cc2ccccc2[N+](=O)[O-])CC(F)(F)F)cc1 915865537 ZFEDLASUWZCOOZ-UHFFFAOYSA-N 453.417 5.147 5 20 JKBD Cc1ccc(N2C(=O)CC[C@H](C(=O)N[C@H](C)c3cccc([N+](=O)[O-])c3)[C@@H]2c2cccs2)cc1 917699623 DETJJXNQUJENPK-QATBIIFWSA-N 463.559 5.326 5 20 JKBD CC(C)[C@H](OC(=O)c1ccc(N[C@H](C)c2ccccn2)c([N+](=O)[O-])c1)C(=O)Nc1ccccc1F 920545609 UHMJLODPTRNTKR-MWTRTKDXSA-N 480.496 5.122 5 20 JKBD O=C(Cn1ccc2ccc([N+](=O)[O-])cc21)Nc1ccc(C2(NC(=O)[C@@H]3CC=CCC3)CCC2)cc1 1786276043 UWTZLZIUYZGNOS-HXUWFJFHSA-N 472.545 5.040 5 20 JKBD CN(C)c1ccc([N+](=O)[O-])cc1C(=O)NC1(c2ccc(NC(=O)CCCC(F)(F)F)cc2)CCC1 1786621619 MFYINOFFGGBHDX-UHFFFAOYSA-N 492.498 5.141 5 20 JKBD O=C(CSc1ccccc1)Nc1ccc(C2(NC(=O)Cc3cc([N+](=O)[O-])ccc3F)CCC2)cc1 1787774200 ZPHVMTXAEZNCIN-UHFFFAOYSA-N 493.560 5.203 5 20 JKBD COc1cc(C(=O)NC2(c3ccc(NC(=O)c4cc(F)c(F)cc4F)cc3)CCC2)ccc1[N+](=O)[O-] 1790636463 FUROCWYNIORVOG-UHFFFAOYSA-N 499.445 5.082 5 20 JKBD O=C(/C=C/c1ccccc1[N+](=O)[O-])NC1(c2ccc(NC(=O)c3n[nH]c4cccc(F)c34)cc2)CCC1 1790969496 VOTXIIANTSXLNN-NTEUORMPSA-N 499.502 5.071 5 20 JKBD O=C(/C=C/c1cccnc1)NC1(c2ccc(NC(=O)c3cc4cc([N+](=O)[O-])ccc4s3)cc2)CCC1 1791009817 AEKPTWGRMKEAGU-NYYWCZLTSA-N 498.564 5.666 5 20 JKBD Cc1cccc(Cl)c1C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cc(F)cc([N+](=O)[O-])c2)[nH]n1 1821144309 MCWXNIIHGABEHO-IBGZPJMESA-N 485.903 5.039 5 20 JKBD O=C(Nc1cc([C@H]2CCCCN2C(=O)CCC(F)(F)F)[nH]n1)c1cc2cc([N+](=O)[O-])ccc2s1 1821609957 QDQZYLARANDXHD-OAHLLOKOSA-N 495.483 5.181 5 20 JKBD CC[C@H](C)CC(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)CC1 1824348465 CRDLHSFSZDCSEH-UWJYYQICSA-N 471.623 5.479 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)N1CCCC[C@H]1C1CCN(C(=O)CCc2ccc(F)cc2)CC1 1830729419 OBMDDGSIAOZVHB-DEOSSOPVSA-N 499.558 5.048 5 20 JKBD O=C(C1CCCC1)N1CCC([C@@H]2CCCCN2C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)CC1 1831060875 KIXCUKJVFXUHRI-NRFANRHFSA-N 469.607 5.233 5 20 JKBD O=C(c1ccc2cnccc2c1)N1CCC([C@H]2CCCCN2C(=O)/C=C/c2ccccc2[N+](=O)[O-])CC1 1832907037 MNKMROHESYBIGF-QJASNXPTSA-N 498.583 5.090 5 20 JKBD Cc1ccc2nc(CNc3cc([N+](=O)[O-])ccc3Nc3cccc(C(F)(F)F)c3)cc(=O)n2c1 11725349 DQNOXPLGIUMPOY-UHFFFAOYSA-N 469.423 5.286 5 20 JKBD O=C(COC(=O)CCc1ncc(-c2ccc(Cl)cc2Cl)o1)Nc1ccc(Cl)c([N+](=O)[O-])c1 12271870 KVVWILJBESSAKN-UHFFFAOYSA-N 498.706 5.325 5 20 JKBD Cc1c(-c2ccccc2)sc(NC(=O)c2cc(Cl)ccc2[N+](=O)[O-])c1C(=O)N1CCOCC1 14389889 QFRPGNBMMUVPLU-UHFFFAOYSA-N 485.949 5.010 5 20 JKBD Cc1cccc(Oc2ccc(S(=O)(=O)N3CCCCC3)cc2NC(=O)c2ccccc2[N+](=O)[O-])c1 14820633 CRNVGJTXCWIBOZ-UHFFFAOYSA-N 495.557 5.122 5 20 JKBD C[C@H](Sc1nnc(-c2cccc(Cl)c2)o1)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 21548169 LEZLVTYCHAIMFM-VIFPVBQESA-N 472.832 5.436 5 20 JKBD CC(C)c1ccccc1-n1c(S[C@@H](C)C(=O)Nc2ccccc2[N+](=O)[O-])nnc1-c1cccnc1 21739219 OEYDFFMDBHFJNX-KRWDZBQOSA-N 488.573 5.480 5 20 JKBD CC(C)(C)c1ccc(-c2nnc(SCC(=O)Nc3ccc([N+](=O)[O-])cc3Br)o2)cc1 22249438 ITGUODNDVPAMBE-UHFFFAOYSA-N 491.367 5.436 5 20 JKBD CCOc1ccccc1NC(=O)[C@H](OC(=O)c1ccc(Cl)c([N+](=O)[O-])c1)c1ccccc1 23551933 KBSLUCVJIYFXNJ-OAQYLSRUSA-N 454.866 5.184 5 20 JKBD Cc1ccc(-c2nnc(-c3ccc(C(=O)O[C@@H](C)c4nnc(-c5ccc([N+](=O)[O-])cc5)o4)cc3)o2)cc1 24505603 ZHHWKFWSWOZWOQ-INIZCTEOSA-N 497.467 5.588 5 20 JKBD COc1cc(NC(=O)c2ccc(C(C)(C)C)c([N+](=O)[O-])c2)c(OC)cc1NC(=O)c1ccccc1 36774331 KTJSXAGERFIWNO-UHFFFAOYSA-N 477.517 5.414 5 20 JKBD COc1ccc(-c2nc(NC(=O)c3ccc(N[C@H](C)c4ccccn4)c([N+](=O)[O-])c3)sc2C)cc1 72016528 MZDFWKKDLIOCQK-OAHLLOKOSA-N 489.557 5.856 5 20 JKBD COc1cc(CNc2ccc([N+](=O)[O-])c(C(=O)N3CCCC3)c2)ccc1OCc1ccccc1 108309040 LQJFJDQTAPNNBP-UHFFFAOYSA-N 461.518 5.031 5 20 JKBD C[C@H](Nc1ccc(C(=O)NCc2ccc(CN3CCCCC3)cc2)cc1[N+](=O)[O-])c1ccccn1 108785978 FHARBPSDFLSINS-FQEVSTJZSA-N 473.577 5.079 5 20 JKBD Cc1nn(C)c(C)c1[C@H](C)C(=O)Nc1cc([N+](=O)[O-])ccc1Nc1cccc(C(F)(F)F)c1 476681614 IRTISDXDYKCQGC-LBPRGKRZSA-N 461.444 5.450 5 20 JKBD CCOc1cc(C(=O)Nc2ccc(OCc3cccc(F)c3)c(F)c2)c([N+](=O)[O-])cc1OC 483822448 QBBGKFOIAYMIRT-UHFFFAOYSA-N 458.417 5.112 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Cl)[C@H](NCC1CCN(Cc2cccs2)CC1)c1ccccc1 488492074 HNVCJTXFCXEFPL-XMMPIXPASA-N 499.036 5.491 5 20 JKBD CC[C@H](C)NC(=O)c1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2Oc2ccc(OC)cc2)cc1 507864800 QEOSFJKEPSJTTB-INIZCTEOSA-N 463.490 5.176 5 20 JKBD COc1ccc(Oc2ccc([N+](=O)[O-])cc2C(=O)Nc2cc(N3CCCC3=O)ccc2Cl)cc1 512465981 NPMJJHMDRMSNGQ-UHFFFAOYSA-N 481.892 5.428 5 20 JKBD C[C@@H](Nc1ccc(C(=O)Nc2cccc(CSc3ccccn3)c2)cc1[N+](=O)[O-])c1ccccn1 512558224 CPZVIUXGFJZGEE-GOSISDBHSA-N 485.569 6.103 5 20 JKBD Cc1ccccc1CN(Cc1ccccn1)C(=O)c1ccc(N[C@@H](C)c2ccccn2)c([N+](=O)[O-])c1 520497945 NBLGRMSCRXJRNZ-NRFANRHFSA-N 481.556 5.709 5 20 JKBD CSc1ccc(C(=O)c2ccccc2C(=O)Nc2ccc(-c3cnc[nH]3)cc2)cc1[N+](=O)[O-] 520615551 DBKFXBAJJPYKQL-UHFFFAOYSA-N 458.499 5.190 5 20 JKBD Cc1cc(=O)nc(-c2ccc(NC(=O)c3ccc(NCc4ccccc4Cl)c([N+](=O)[O-])c3)cc2)[nH]1 524467481 VIXZUPBGWSUQRP-UHFFFAOYSA-N 489.919 5.171 5 20 JKBD CN(Cc1ccc(F)cc1)C(=O)C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1 599167094 XGBYICHLBQAISF-XMHGGMMESA-N 461.518 5.933 5 20 JKBD CN(Cc1ccccc1[N+](=O)[O-])C(=O)Nc1cccc(C(=O)Nc2cccc(C(F)(F)F)c2)c1 603650580 WXFSTCCTNJUMDH-UHFFFAOYSA-N 472.423 5.530 5 20 JKBD Cc1nc(-c2cccs2)c(CC(=O)Nc2nc(-c3cccc([N+](=O)[O-])c3)c(C)s2)s1 603996989 KWJIKPZYAMSPOW-UHFFFAOYSA-N 456.574 5.701 5 20 JKBD C[C@@H](Nc1ccc(C(=O)N2CCC(CN(C)Cc3ccccc3)CC2)cc1[N+](=O)[O-])c1ccccn1 608964764 XVSQQUUZXSNNCX-OAQYLSRUSA-N 487.604 5.147 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Cl)[C@@H](c1ccccc1)N1CCO[C@H](c2cccc(F)c2)C1 608975949 BAPDHHSIMXTSLL-XZOQPEGZSA-N 469.900 5.141 5 20 JKBD CSc1ccc([N+](=O)[O-])c(C(=O)Nc2nc3cc(C(F)(F)F)ccc3n2Cc2ccco2)c1 619219563 LWMCDCJOMGNHFB-UHFFFAOYSA-N 476.436 5.579 5 20 JKBD COc1ccccc1C(C)(C)C(=O)Oc1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2Cl)cc1 746762943 SHKFJCFMTGBUIJ-UHFFFAOYSA-N 468.893 5.392 5 20 JKBD Cc1noc(C)c1COc1cc2ccccc2cc1C(=O)O[C@@H](C)C(=O)Nc1cccc([N+](=O)[O-])c1 775378077 SMAUWFRGOMJYLU-KRWDZBQOSA-N 489.484 5.116 5 20 JKBD CN(Cc1cc([N+](=O)[O-])ccc1Cl)C(=O)c1ccccc1SCC(=O)N(C)C1CCCCC1 811931759 RRDODEGHMXOMLY-UHFFFAOYSA-N 490.025 5.404 5 20 JKBD O=C1OC(c2cccc([N+](=O)[O-])c2)=N/C1=C/c1cccc(NC(=O)c2ccc(Cl)cc2Cl)c1 912754179 ZKMLHNFZLPULOY-KEBDBYFISA-N 482.279 5.498 5 20 JKBD Cc1sc(NC(=O)c2nc(Cl)c(Cl)c(Cl)c2Cl)nc1-c1cccc([N+](=O)[O-])c1 917790880 LYATXTCMACFZNW-UHFFFAOYSA-N 478.144 6.288 5 20 JKBD C[C@@H](Nc1ccc(C(=O)OCc2nc3cc(Cl)ccc3n2C)cc1[N+](=O)[O-])c1ccccn1 920544923 NNZTYJZEJPHYSK-CQSZACIVSA-N 465.897 5.060 5 20 JKBD CCO[C@H](C(=O)O[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1)c1ccccc1 920690140 ZFQBEUCMCNOMIP-YADHBBJMSA-N 468.893 5.249 5 20 JKBD Cc1ccc(NC(=O)c2cccc(C(F)(F)F)c2)cc1NC(=O)c1ccc(N)c([N+](=O)[O-])c1 920855303 HDYGUYCJALDCFK-UHFFFAOYSA-N 458.396 5.009 5 20 JKBD COc1ccc([C@@H](C)C(=O)NC2(c3ccc(NC(=O)Cc4cccc([N+](=O)[O-])c4)cc3)CCC2)cc1 1785791584 HANLIVCIMJHAFN-LJQANCHMSA-N 487.556 5.084 5 20 JKBD CCOc1ccccc1C(=O)Nc1ccc(C2(NC(=O)c3cc(F)cc([N+](=O)[O-])c3)CCC2)cc1 1790240901 VXMJEQAWXSVHAW-UHFFFAOYSA-N 477.492 5.194 5 20 JKBD O=C(NC1(c2ccc(NC(=O)C3(c4cccc([N+](=O)[O-])c4)CCC3)cc2)CCC1)[C@H]1[C@H]2SC=C[C@H]21 1790476646 PVRRBTMOVFBVMK-ZRBLBEILSA-N 489.597 5.026 5 20 JKBD O=C(Cc1ccc(Cl)cc1[N+](=O)[O-])NC1(c2ccc(NC(=O)C3CCSCC3)cc2)CCC1 1792349245 QWGJFUDHQAPREC-UHFFFAOYSA-N 488.009 5.068 5 20 JKBD CCC1(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)C3(c4cccc([N+](=O)[O-])c4)CCC3)n[nH]2)CCC1 1820841724 YDTRJVQTOLXJDK-OAQYLSRUSA-N 479.581 5.012 5 20 JKBD CC(C)(C)c1ccc(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)c3ccc(O)c([N+](=O)[O-])c3)n[nH]2)s1 1821046300 ZTPBDIKXHLFUSE-MRXNPFEDSA-N 497.577 5.002 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)N1CCCC[C@H]1C1CCN(C(=O)[C@H]2CC[C@H](C)CC2)CC1 1830729809 YZJUTDAVMSZDEG-NYDSKATKSA-N 473.589 5.102 5 20 JKBD CC(C)(C)CCCCCC(=O)N1CCCC12CN(C(=O)c1cccc([N+](=O)[O-])c1Br)C2 1846087141 WZDDGYZUEFETEF-UHFFFAOYSA-N 494.430 5.171 5 20 JKBD CNc1ccc(C(=O)OCc2csc(N(C(C)=O)c3ccc(Cl)c(Cl)c3)n2)cc1[N+](=O)[O-] 9924099 UHTHADOKUDCURK-UHFFFAOYSA-N 495.344 5.441 5 20 JKBD Cc1cccc(C)c1NC(=O)CN(C)C(=O)c1ccc(NCc2ccccc2Cl)c([N+](=O)[O-])c1 15758861 OBYNDROAKVNHQC-UHFFFAOYSA-N 480.952 5.188 5 20 JKBD Cc1sc2ncnc(S[C@H](C)C(=O)Nc3ccc([N+](=O)[O-])cc3C(F)(F)F)c2c1C 21359265 PSTMJLXTZSKCOA-SNVBAGLBSA-N 456.471 5.354 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Cl)[C@H](NCc1ccc(C(F)(F)F)cc1)c1ccccc1 28623181 KAEZFOZVJYURQE-HXUWFJFHSA-N 463.843 5.737 5 20 JKBD COCCN(C(=O)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1)c1nc2ccccc2s1 477387333 SPPOPQPGAWPCNO-UHFFFAOYSA-N 483.933 5.943 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)Nc2ccc(OCc3ccccc3Cl)cc2)cc1SC 486687723 KWRYRWOYVCSACM-UHFFFAOYSA-N 458.923 5.810 5 20 JKBD O=[N+]([O-])c1ccc(-c2ccc(CN[C@H](c3ccccc3)c3cccnc3)o2)c(Br)c1 488594883 RHSKSTIWTXKIIV-HSZRJFAPSA-N 464.319 5.892 5 20 JKBD COc1cc([C@H]2Nc3ccccc3C(=O)N2Cc2cccnc2)c([N+](=O)[O-])cc1OCc1ccccc1 489306432 SUJCRMXXNLRHFB-MHZLTWQESA-N 496.523 5.344 5 20 JKBD COc1ccc([N+](=O)[O-])cc1NC(=O)c1cc2cc(Br)cc(Br)c2o1 494029584 QHEHMXNBZDSHJM-UHFFFAOYSA-N 470.073 5.127 5 20 JKBD O=C(Nc1nnc(SCc2ccc(Cl)cc2)s1)c1csc(-c2ccc([N+](=O)[O-])cc2)n1 496450100 SBTWMIYFNCMGSE-UHFFFAOYSA-N 489.991 5.768 5 20 JKBD O=C(Nc1cccc(Cl)c1)N1CCCN(C(=O)c2cc3ccccc3c3cccnc23)CC1 499045505 MTDLZSURNHSEQB-UHFFFAOYSA-N 458.949 5.421 5 20 JKBD Cc1c(Cl)cccc1NC(=O)CCNC(=O)c1cc([N+](=O)[O-])ccc1Sc1ccccc1 505286623 YLCNTESDGVEXSU-UHFFFAOYSA-N 469.950 5.466 5 20 JKBD Cc1ccc(NC(=O)c2ccc(NCc3ccccc3)c([N+](=O)[O-])c2)c(OC[C@@H]2CCCO2)c1 508040319 KXTGVXVCCWFTJT-NRFANRHFSA-N 461.518 5.325 5 20 JKBD C[C@H]1CCC[C@H](OCc2cccc(NC(=O)c3ccc(Sc4nncn4C)c([N+](=O)[O-])c3)c2)C1 509024570 XFTRBPDCHIAYKK-JXFKEZNVSA-N 481.578 5.222 5 20 JKBD Cc1cc(C(=O)N2CCCC[C@H]2C)ccc1NC(=O)N(Cc1ccc([N+](=O)[O-])cc1)C(C)C 509238001 WZNWVAHFWHAYNY-LJQANCHMSA-N 452.555 5.360 5 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5.176 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)O[C@@H](C(=O)Nc2ccccc2C(F)(F)F)C(C)C)cc1SC 728649595 NGMZJCIOOTWYLH-GOSISDBHSA-N 486.468 5.164 5 20 JKBD O=C(OCc1nnc(-c2ccc([N+](=O)[O-])cc2)o1)c1oc2ccccc2c1CSc1cccs1 742980499 VUWZGBXSPPZYHE-UHFFFAOYSA-N 493.522 6.102 5 20 JKBD CCc1cc[n+](/C(C(=S)Nc2cc(C)ccc2F)=C(/O)c2ccc(C)c([N+](=O)[O-])c2)cc1 744116009 KLKMWBXVUKDJSQ-UHFFFAOYSA-O 452.531 5.524 5 20 JKBD Cc1ccc(C(=O)c2ccccc2C(=O)O[C@@H](C)C(=O)Nc2cc([N+](=O)[O-])ccc2Cl)cc1C 800460369 QDVJLCWSMBOZHN-INIZCTEOSA-N 480.904 5.280 5 20 JKBD Cc1c(Br)cc([N+](=O)[O-])cc1-c1nc(-c2ccc(-n3cnc4ccccc43)nc2)no1 904489310 PUYFEDQSKLTJFD-UHFFFAOYSA-N 477.278 5.117 5 20 JKBD COc1ccccc1[C@H]1[C@H](C(=O)N(C)Cc2ccccc2[N+](=O)[O-])CCC(=O)N1c1ccc(C)cc1 914728684 GZKDIJNQHVIJHY-KCWPFWIISA-N 487.556 5.055 5 20 JKBD Cc1ccc(N(Cc2ccc(Cl)nc2)S(=O)(=O)c2ccc(Cl)c([N+](=O)[O-])c2)c(C)c1 915671668 UWIMYLLYOOWTDX-UHFFFAOYSA-N 466.346 5.309 5 20 JKBD CCCc1noc2nc(C3CC3)cc(C(=O)N(Cc3nnc(-c4cccc([N+](=O)[O-])c4)o3)C(C)C)c12 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JKBD C[C@@H](C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cccc(F)c2[N+](=O)[O-])[nH]n1)c1ccc(Cl)cc1 1814662159 ZKBZNMMYDLEWLK-VLIAUNLRSA-N 499.930 5.220 5 20 JKBD O=C(Cc1ccc(Cl)cc1[N+](=O)[O-])Nc1cc([C@H]2CCCCN2C(=O)CCC2CCCC2)[nH]n1 1814844340 DEHMZECWYBIVIO-HXUWFJFHSA-N 487.988 5.177 5 20 JKBD Cc1cc(Cl)ccc1C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cc(F)cc([N+](=O)[O-])c2)CC1 1823911578 DAEREXIGZJSCPB-QHCPKHFHSA-N 487.959 5.243 5 20 JKBD Cc1c(C(=O)N2CCC([C@@H]3CCCCN3C(=O)Cc3ccccc3)CC2)cc(Cl)cc1[N+](=O)[O-] 1826465803 PYWLQGSPPLWPQH-QHCPKHFHSA-N 483.996 5.033 5 20 JKBD O=C(CCc1cccc([N+](=O)[O-])c1)N1CCC([C@@H]2CCCCN2C(=O)c2cc3ccoc3s2)CC1 1827406974 GRVSWYMRYUUAME-QFIPXVFZSA-N 495.601 5.269 5 20 JKBD CCCCn1c(SCC(=O)Nc2ccc([N+](=O)[O-])cc2Cl)nnc1-c1ccc(OC)cc1 9482287 ZUWSGESWPXJUAT-UHFFFAOYSA-N 475.958 5.046 5 20 JKBD C[C@H](OC(=O)c1cc([N+](=O)[O-])ccc1Cl)C(=O)Nc1c(Cl)cc(Cl)cc1Cl 10666236 BLOPEBJRQAWATA-ZETCQYMHSA-N 452.077 5.392 5 20 JKBD COCCN(C(=O)c1ccc(SC(F)F)cc1)c1nc(-c2ccc([N+](=O)[O-])cc2)cs1 11224024 KAWNNGXZSDMTRZ-UHFFFAOYSA-N 465.503 5.326 5 20 JKBD COc1cc(NC(=O)c2ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])cc2)cc(OC)c1OC 14472839 NYVXCDCNZVFPSW-UHFFFAOYSA-N 458.854 5.319 5 20 JKBD O=C(Nc1ccccc1C(=O)OCc1csc(-c2ccsc2)n1)c1ccc([N+](=O)[O-])cc1Cl 15748540 VBPLRBKFGJDEJR-UHFFFAOYSA-N 499.957 6.043 5 20 JKBD C[C@@H](OC(=O)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1)C(=O)Nc1cccnc1Cl 16906079 CPJCAHPWBNEMKD-GFCCVEGCSA-N 476.272 5.273 5 20 JKBD O=C(c1ccccc1)c1ccc(Sc2nnc(-c3ccccc3Br)o2)c([N+](=O)[O-])c1 20667547 IWADZVLUJIAPQD-UHFFFAOYSA-N 482.315 5.790 5 20 JKBD O=C(CSc1ccc(C(F)(F)F)cc1[N+](=O)[O-])Nc1cccc(NC(=O)c2cccs2)c1 21141105 KJKMTTOBSBSCNU-UHFFFAOYSA-N 481.477 5.658 5 20 JKBD O=C(NCc1cccc(Cn2ccnc2)c1)c1ccc(NCc2ccccc2Cl)c([N+](=O)[O-])c1 29667855 XPRLQUGZLVVJKC-UHFFFAOYSA-N 475.936 5.035 5 20 JKBD C[C@H]1Oc2ccc(NC(=O)c3cc([N+](=O)[O-])ccc3Sc3ccc(Cl)cc3)cc2NC1=O 30560562 WJWCLIYIVZHVML-GFCCVEGCSA-N 469.906 5.371 5 20 JKBD CCN(C(=O)Cc1ccc(NC(=O)Cn2c3ccccc3c(=O)c3ccccc32)cc1)c1ccccc1 68709055 WPDRAAMDYXUSDL-UHFFFAOYSA-N 489.575 5.389 5 20 JKBD Brc1c2ccccc2c(Br)c2cc(-c3ccc4ccccc4c3)ccc12 95830000 ZXQCYJFPBNTPCT-UHFFFAOYSA-N 462.184 8.338 5 20 JKBD Cc1ccc(-c2csc(NC(=O)[C@@H]3CCCN(C(=O)c4ccc(Cl)cc4)C3)n2)cc1[N+](=O)[O-] 105352608 DWCKEWKEURACQQ-QGZVFWFLSA-N 484.965 5.171 5 20 JKBD Cc1cc(C(=O)N2CCC[C@@H](C)C2)ccc1NC(=O)c1ccc(N2CCC(C)CC2)c([N+](=O)[O-])c1 195703969 AXUHZNSNZRHCNW-LJQANCHMSA-N 478.593 5.264 5 20 JKBD O=C(CSc1nnc(-c2ccccc2Cl)n1Cc1ccccc1)c1cccc([N+](=O)[O-])c1 216806685 NPTFBLDPMRRQIS-UHFFFAOYSA-N 464.934 5.530 5 20 JKBD C[C@H](Nc1ccc(C(=O)NCCOc2ccccc2-c2ccccc2)cc1[N+](=O)[O-])c1ccccn1 303034485 OKJWSKFARKSDOZ-FQEVSTJZSA-N 482.540 5.639 5 20 JKBD CCC(=O)Nc1ccc(C)c(NC(=O)C2CCN(c3ccc(C(F)(F)F)cc3[N+](=O)[O-])CC2)c1 481828326 CYPCLQWVVSUBSK-UHFFFAOYSA-N 478.471 5.126 5 20 JKBD Cc1nnc(SCc2c(C(=O)N(Cc3ccc([N+](=O)[O-])cc3)C(C)C)oc3ccccc23)s1 499453829 HYZAZVNIYXHQNS-UHFFFAOYSA-N 482.587 5.844 5 20 JKBD COCCN(C(=O)c1csc(-c2cccs2)n1)c1nc(-c2ccc([N+](=O)[O-])cc2)cs1 502887222 BJYNTFOTZKMUMW-UHFFFAOYSA-N 472.573 5.197 5 20 JKBD Cc1cccc(-c2nc(C(C)C)no2)c1NC(=O)c1ccc(N[C@H](C)c2ccccn2)c([N+](=O)[O-])c1 505434087 URHZGTHUPPHJPH-QGZVFWFLSA-N 486.532 5.897 5 20 JKBD COc1cc(CNC(=O)N(Cc2ccc([N+](=O)[O-])cc2)C(C)C)ccc1OCc1ccccc1 509404367 AZBAEAYRWOYXEV-UHFFFAOYSA-N 463.534 5.303 5 20 JKBD CN(C)C(=O)C[C@@H](NCc1ccc(Oc2ccccc2Cl)c([N+](=O)[O-])c1)c1ccccc1 509614277 BEFJNCXTUIFSQV-HXUWFJFHSA-N 453.926 5.350 5 20 JKBD COc1cc(C(=O)Nc2cccc(-c3nccs3)c2)c([N+](=O)[O-])cc1OCc1cscn1 509980306 BAGDVMJXYPMZNF-UHFFFAOYSA-N 468.516 5.015 5 20 JKBD O=C(NCc1ccc([N+](=O)[O-])cc1)N[C@H](c1ccccc1)c1ccc(Br)cc1F 515747194 OFKCOBJYHIJMFD-HXUWFJFHSA-N 458.287 5.085 5 20 JKBD Cc1sc2nc(S[C@@H](C)c3cccc([N+](=O)[O-])c3)n(Cc3ccccn3)c(=O)c2c1C 515840217 JFJHRFIQKPKGER-HNNXBMFYSA-N 452.561 5.280 5 20 JKBD COc1ccc([N+](=O)[O-])c(C(=O)Nc2cccc(NC(=O)Nc3cccc(C(F)(F)F)c3)c2)c1 516774855 NPOLCRSWVOLIAW-UHFFFAOYSA-N 474.395 5.519 5 20 JKBD COc1ccc(CN[C@@H](c2ccc3c(c2)OCCO3)C(C)C)cc1OCc1ccc([N+](=O)[O-])cc1 518270086 XJJJJOFZCSCWBP-HHHXNRCGSA-N 478.545 5.441 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Cl)[C@H](NCc1cc(Cl)c2c(c1)OCCO2)c1ccccc1 520520191 SFEODDPOQOOOAL-OAQYLSRUSA-N 488.327 5.142 5 20 JKBD CC[C@@H](C)Sc1ccc(NC(=O)N2CCN(c3ccc([N+](=O)[O-])nc3)CC2)c(C(F)(F)F)c1 522183005 XWVYXBUJYKUVNK-CQSZACIVSA-N 483.516 5.253 5 20 JKBD CN(Cc1ccccc1[N+](=O)[O-])C(=O)Nc1ccc(NC(=O)c2ccoc2)cc1C(F)(F)F 603683382 ZMARDTKASKCQFL-UHFFFAOYSA-N 462.384 5.123 5 20 JKBD COC(=O)C[C@H]1CCCCN1C(=O)C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1 604479145 QLWQFPKCDMGVOX-WORNYLJVSA-N 479.558 5.079 5 20 JKBD COc1ccc([N+](=O)[O-])cc1NC(=O)c1ccccc1-c1nc(-c2cccc(Cl)c2)no1 609019207 BFQIKMYKWDFTCI-UHFFFAOYSA-N 450.838 5.226 5 20 JKBD Cc1cccc2c1CCN(C(=O)C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc3ccccc3s1)C2 729413674 CRAHGSJDWFLICR-RCCKNPSSSA-N 469.566 6.029 5 20 JKBD CCN(C)Cc1cc(O[C@H]2CCN(Cc3ccc(-c4ccc([N+](=O)[O-])cc4Cl)o3)C2)ccn1 856555252 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O=C(Nc1ccc(C2(NC(=O)c3cc(F)cc([N+](=O)[O-])c3)CCC2)cc1)c1ccnc(C(F)F)c1 1787018632 FQYUUPWAWHCJCP-UHFFFAOYSA-N 484.434 5.128 5 20 JKBD Cn1c(C(=O)Nc2ccc(C3(NC(=O)/C=C/c4ccc([N+](=O)[O-])o4)CCC3)cc2)cc2ccccc21 1788884651 FIUOVHLZNBVFHG-ACCUITESSA-N 484.512 5.141 5 20 JKBD O=C(Cc1ccc([N+](=O)[O-])cc1F)Nc1ccc(C2(NC(=O)[C@@H]3CCCCC3(F)F)CCC2)cc1 1791184661 YXFCLJQDSITRJL-FQEVSTJZSA-N 489.494 5.236 5 20 JKBD COc1cc(C(=O)Nc2ccc(C3(NC(=O)C4(C(F)(F)F)CCC4)CCC3)cc2)ccc1[N+](=O)[O-] 1792164090 TZVCSHTVWXFMOJ-UHFFFAOYSA-N 491.466 5.084 5 20 JKBD Cc1ccc2cc(C(=O)N3[C@H]4CC[C@@H]3C[C@H](NC(=O)c3c(F)ccc([N+](=O)[O-])c3C)C4)sc2c1 1801085385 PPTIRIVPPDISIQ-BCDXTJNWSA-N 481.549 5.131 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)N1CCC2(CCCN(C(=O)[C@H](C)Sc3ccccc3)C2)CC1 1805858408 PFGCROODRVHAKK-IBGZPJMESA-N 499.608 5.068 5 20 JKBD O=C(Nc1cc([C@@H]2CCCCN2C(=O)[C@@H]2CCC[C@H]3CCCC[C@@H]32)[nH]n1)c1ccc([N+](=O)[O-])cc1F 1821054580 PNEBDIJECQGCCX-WEGMGINNSA-N 497.571 5.369 5 20 JKBD C[C@H](Sc1ccccc1)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2ccc([N+](=O)[O-])cc2F)CC1 1824391513 FNZJWJRRWZLTSK-MHECFPHRSA-N 499.608 5.148 5 20 JKBD Cc1ccc(CC(=O)N2CCCC[C@H]2C2CCN(C(=O)c3cccc4ccoc34)CC2)cc1[N+](=O)[O-] 1830364581 UHXRCPWYYGKHST-DEOSSOPVSA-N 489.572 5.125 5 20 JKBD CC[C@H]1CC[C@H](C(=O)N2CCC([C@@H]3CCCCN3C(=O)c3cc(F)cc([N+](=O)[O-])c3)CC2)CC1 1830616164 UKOPKCGTIFFTLY-WXVUKLJWSA-N 473.589 5.184 5 20 JKBD C[C@H](C(=O)N1CCC([C@H]2CCCCN2C(=O)/C=C/c2ccccc2[N+](=O)[O-])CC1)c1ccccc1 1832906887 NUHVWECKBFRWCN-UDSUQADKSA-N 475.589 5.031 5 20 JKBD O=C(O[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1)c1cc(F)c(F)cc1Cl 11400618 YPHJPBPAVBWYFA-LJQANCHMSA-N 481.238 5.717 5 20 JKBD Cc1cccc(OCc2nnc(S[C@H](C(=O)Nc3ccc(C)cc3[N+](=O)[O-])c3ccccc3)o2)c1 12673548 KKQANHDKSNEHKR-QHCPKHFHSA-N 490.541 5.646 5 20 JKBD C[C@@](CC(=O)Nc1cc(Cl)c([N+](=O)[O-])cc1OCc1ccccc1)(C(=O)O)c1ccccc1 13467806 MSCRGUBNXXPMAM-DEOSSOPVSA-N 468.893 5.198 5 20 JKBD COc1ccc([N+](=O)[O-])cc1OCc1csc(-c2cc(Br)ccc2OC)n1 16671865 HUYKWTHDLUCTFZ-UHFFFAOYSA-N 451.298 5.077 5 20 JKBD C[C@@H](OC(=O)c1ccc(NCc2ccccc2)c([N+](=O)[O-])c1)C(=O)Nc1ccccc1Cl 16748736 LIDUEJKSDIGPDO-OAHLLOKOSA-N 453.882 5.044 5 20 JKBD C[C@H](OC(=O)COc1cc(Cl)c(Cl)cc1Cl)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 17531212 ZDRDNHGWKXJBIF-VIFPVBQESA-N 472.668 5.288 5 20 JKBD Cc1cc([N+](=O)[O-])ccc1NC(=O)COC(=O)c1sc(-c2ccc(C(F)(F)F)cc2)nc1C 25663670 QTTAOWUNLWYZCX-UHFFFAOYSA-N 479.436 5.149 5 20 JKBD C[C@@H](Nc1ccc(C(=O)N(C)Cc2csc(Br)c2)cc1[N+](=O)[O-])c1ccccn1 303024589 PPWPHTTZDXDPRK-CYBMUJFWSA-N 475.368 5.259 5 20 JKBD Cc1ccc(-c2nc(NC(=O)c3ccc(N[C@@H](C)c4ccccn4)c([N+](=O)[O-])c3)sc2C)s1 303143342 BNZGOMJIHSLVKX-AWEZNQCLSA-N 479.587 6.217 5 20 JKBD C[C@@H](Nc1ccc(C(=O)N(C)CCCc2cc(-c3ccccc3)n(C)n2)cc1[N+](=O)[O-])c1ccccn1 410083832 BKYNDGGUUPOORL-HXUWFJFHSA-N 498.587 5.268 5 20 JKBD C[C@@H](Nc1ccc(C(=O)Nc2ccc(Cc3ccncc3)cc2)cc1[N+](=O)[O-])c1ccccn1 506112304 JYRBVBRFPWEKND-GOSISDBHSA-N 453.502 5.401 5 20 JKBD O=C(CCc1ccccc1)N1CCC(NCc2ccc(Oc3ccc(F)cc3)c([N+](=O)[O-])c2)CC1 507926773 YAWYPGOYIFPSSR-UHFFFAOYSA-N 477.536 5.240 5 20 JKBD CCN(C(=O)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)[C@@H]1CCSc2ccc(Br)cc21 510304964 PMVITTULERTHHV-MRXNPFEDSA-N 498.786 5.035 5 20 JKBD CCOc1cc(-c2nc3c(F)cccc3n2C)ccc1OCc1cc([N+](=O)[O-])cc2c1OCOC2 513866539 UCOGOFKTJGMOPQ-UHFFFAOYSA-N 479.464 5.132 5 20 JKBD CCCC(=O)Nc1cccc(NC(=O)c2ccccc2C(=O)c2ccc(SC)c([N+](=O)[O-])c2)c1C 517908757 OVTYABRVGCOLDO-UHFFFAOYSA-N 491.569 5.847 5 20 JKBD C[C@@H](NC(=O)c1csc(-c2cccc([N+](=O)[O-])c2)n1)c1ccc(OCc2cccnc2)cc1 523301480 HOPTVKYATUBJPN-MRXNPFEDSA-N 460.515 5.183 5 20 JKBD Cc1ccc(-c2csc(NC(=O)c3ccc([N+](=O)[O-])cc3I)n2)c(C)c1 523389008 YHPFSWHRJMJSQI-UHFFFAOYSA-N 479.299 5.192 5 20 JKBD COc1ccc(N2C(=O)c3ccccc3N[C@H]2c2csc(-c3cccc([N+](=O)[O-])c3)n2)cc1 602762664 XSWFOWNDJCLUAR-JOCHJYFZSA-N 458.499 5.498 5 20 JKBD O=C(Nc1ccc2oc(C3CC3)nc2c1)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 603599151 DSRKYWKYDDRMDC-UHFFFAOYSA-N 474.439 5.487 5 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747961834 JTLSDUINFKQMTC-HNNXBMFYSA-N 453.520 5.334 5 20 JKBD O=C(Nc1ccccc1)C1=S=C(/C(Cl)=C\c2ccc(-c3ccc([N+](=O)[O-])cc3)s2)N=N1 844254030 IGRRWDMKXDNUSX-SFQUDFHCSA-N 468.947 6.001 5 20 JKBD CC(C)c1ccc(-c2nc(C(=O)OCC(=O)Nc3ccc(Cl)cc3[N+](=O)[O-])cs2)cc1 900225216 PQVCHXSKDYPHKQ-UHFFFAOYSA-N 459.911 5.291 5 20 JKBD COc1ccc(N2C(=S)N[C@@H](c3cccc([N+](=O)[O-])c3)C(C(=O)Nc3ccc(F)cc3)=C2C)cc1 916169068 ZLNHYRXKGRVTSJ-QHCPKHFHSA-N 492.532 5.091 5 20 JKBD C[C@@H](NC(=S)/C(=C(/O)c1ccc([N+](=O)[O-])cc1)[n+]1ccc(Cc2ccccc2)cc1)c1ccccc1 917614692 YBNDAIWSNNJQCT-OAQYLSRUSA-O 496.612 6.035 5 20 JKBD CSc1ccc(C(=O)c2ccccc2C(=O)N(C)Cc2ccn(-c3ccccc3)n2)cc1[N+](=O)[O-] 917766425 AAFIWQKYTBCFJQ-UHFFFAOYSA-N 486.553 5.006 5 20 JKBD C[C@@H]1CCCCN1C(=O)c1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2N2CCCC2)cc1Cl 918645318 FWFHIEICYHSXGD-MRXNPFEDSA-N 470.957 5.115 5 20 JKBD COC(=O)/C=C/c1ccc(Sc2nnc(-c3ccoc3C)n2Cc2ccccc2)c([N+](=O)[O-])c1 931413582 ZYTCMOWDDOHXJV-PKNBQFBNSA-N 476.514 5.140 5 20 JKBD O=C(Cc1cccc([N+](=O)[O-])c1)Nc1ccc(C2(NC(=O)c3cccc(-c4cnco4)c3)CCC2)cc1 1785795253 HEKBONLDPHQWLL-UHFFFAOYSA-N 496.523 5.240 5 20 JKBD Cc1c[nH]c(C)c1CCC(=O)Nc1ccc(C2(NC(=O)c3cccc(F)c3[N+](=O)[O-])CCC2)cc1 1786205925 ZLJNYZIMZGPZCK-UHFFFAOYSA-N 478.524 5.059 5 20 JKBD O=C(NC1(c2ccc(NC(=O)c3ccoc3Cl)cc2)CCC1)c1cc(F)cc([N+](=O)[O-])c1 1790206632 LATAZGUBDVYMSZ-UHFFFAOYSA-N 457.845 5.042 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)c3scnc3C3CC3)CCC2)cc1)c1cc(F)cc([N+](=O)[O-])c1 1790696555 IKTIBCQJFXYKDW-UHFFFAOYSA-N 480.521 5.129 5 20 JKBD O=C(CCc1ccco1)Nc1cc([C@@H]2CCCCN2C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)[nH]n1 1815935800 VEDCLVZLKAUVGT-IBGZPJMESA-N 493.545 5.064 5 20 JKBD O=C(Cc1ccc(Cl)cc1[N+](=O)[O-])N1CCCC[C@H]1C1CCN(C(=O)C2(F)CCCCC2)CC1 1824160278 AZLALJVEGLCBAQ-NRFANRHFSA-N 494.007 5.083 5 20 JKBD C/C(=C\c1cccs1)C(=O)N1CCC([C@H]2CCCCN2C(=O)c2ccc([N+](=O)[O-])cc2F)CC1 1830493167 ULXBPDBTLYLDND-CZTSOZTGSA-N 485.581 5.132 5 20 JKBD CC[C@H]1CC[C@H](C(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3cc(F)cc([N+](=O)[O-])c3)CC2)CC1 1831695521 BFAAYXGMMGCZDA-DRMXPCRNSA-N 473.589 5.184 5 20 JKBD CCCCC[C@H](C)C(=O)N1CCC([C@H]2CCCCN2C(=O)c2ccc([N+](=O)[O-])c(OC)c2)CC1 1832696646 DAMPMOLZWOBJGX-SIKLNZKXSA-N 473.614 5.053 5 20 JKBD CC(C)(C)CCCCCC(=O)N1CC2(CCCN2C(=O)c2cccc(Br)c2[N+](=O)[O-])C1 1845469402 SEPAUDOMQSCGED-UHFFFAOYSA-N 494.430 5.171 5 20 JKBD CNc1ccc(C(=O)OCc2csc(N(C(C)=O)c3c(C)cc(C)cc3Cl)n2)cc1[N+](=O)[O-] 9924205 QUHJEPQANDOWJW-UHFFFAOYSA-N 488.953 5.405 5 20 JKBD CC[C@H]1CCc2sc(-c3nnc(SCC(=O)Nc4c(C)cccc4[N+](=O)[O-])n3C)cc2C1 10440099 OUOALXUEATWEHV-AWEZNQCLSA-N 471.608 5.006 5 20 JKBD C[C@H](NC(=O)[C@@H](C)OC(=O)c1ccccc1C(=O)c1ccc(Cl)c([N+](=O)[O-])c1)c1ccc(F)cc1 11029310 TYUXNSFTQKKCRH-LSDHHAIUSA-N 498.894 5.041 5 20 JKBD O=C(CCNc1ccc(C(F)(F)F)cc1[N+](=O)[O-])N1CCC[C@H]1c1nc2ccccc2s1 15603507 XJVCJSRSELHUIU-INIZCTEOSA-N 464.469 5.389 5 20 JKBD O=C(Cn1c2ccccc2c(=O)c2ccccc21)Nc1cccc(CSc2ccccn2)c1 60279615 AEXHNVRGLHTHCU-UHFFFAOYSA-N 451.551 5.481 5 20 JKBD O=C(NCc1ccc(F)cc1)c1ccc(NC(=O)c2csc(-c3cccc([N+](=O)[O-])c3)n2)cc1 215723595 UDNWTSYUAUBGBW-UHFFFAOYSA-N 476.489 5.040 5 20 JKBD C[C@@H]1CCCN(c2ccc(C(=O)Nc3cc(C(=O)Nc4ccccc4)ccc3Cl)cc2[N+](=O)[O-])C1 483414626 ODUXBKYYYBWJKC-QGZVFWFLSA-N 492.963 5.989 5 20 JKBD O=C(Nc1ccc(Cl)cn1)C1CCN(C(=O)c2cc([N+](=O)[O-])ccc2Sc2ccccc2)CC1 487978630 MPWRPGICHDPIOR-UHFFFAOYSA-N 496.976 5.285 5 20 JKBD O=C(C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)N(Cc1cccs1)C1CC1 498533318 XHHDJXDRTOVNJY-NBVRZTHBSA-N 475.595 6.388 5 20 JKBD CCOc1cc(CN[C@H](C)c2cc(C)oc2C)ccc1OCc1cc([N+](=O)[O-])cc2c1OCOC2 507928704 FFZFOHLEQAHSCB-QGZVFWFLSA-N 482.533 5.500 5 20 JKBD O=C(c1ccc([N+](=O)[O-])s1)N(C[C@H]1CCCO1)c1nc(-c2cccc(C(F)(F)F)c2)cs1 514935539 NPFAEYWCIVRNCM-CQSZACIVSA-N 483.493 5.624 5 20 JKBD CC(C)OC(=O)C[C@H](NC(=O)Nc1ccc(OC(F)F)c(Cl)c1)c1ccccc1[N+](=O)[O-] 515223890 BOMJSGAZALNMLV-HNNXBMFYSA-N 471.844 5.054 5 20 JKBD C[C@H](NCc1ccc(-c2cccc([N+](=O)[O-])c2)o1)c1cc2c(cc1Br)OCCO2 518266767 DTBHEHRFZBUGIA-ZDUSSCGKSA-N 459.296 5.239 5 20 JKBD C[C@H](NC(=O)N(C)CCCCCc1cc(-c2cccc(F)c2)no1)c1cccc([N+](=O)[O-])c1 520160231 GXMIFIRUQMADJL-KRWDZBQOSA-N 454.502 5.504 5 20 JKBD O=C(Nc1nc2c(s1)C[C@H](c1ccccc1)CC2)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-] 520643565 QSPCUWXEMBBMFN-CQSZACIVSA-N 477.464 5.517 5 20 JKBD COc1ccc(CSCC(=O)N(c2ccccc2)c2nc3ccccc3s2)cc1[N+](=O)[O-] 603564856 FBFAMGCMFFUSEM-UHFFFAOYSA-N 465.556 5.811 5 20 JKBD CCOc1cc(C(=O)N[C@H](c2ccc(Br)cc2)C2CCC2)c([N+](=O)[O-])cc1OC 604017781 XUKCHCKNBSPVKU-FQEVSTJZSA-N 463.328 5.036 5 20 JKBD C[C@H](Nc1ccc(C(=O)N[C@@H]2C[C@H]2c2cccc(Br)c2)cc1[N+](=O)[O-])c1ccccn1 608809385 FBGAVOCWJYKGCV-DHUIEDIVSA-N 481.350 5.211 5 20 JKBD Cc1ccc(C(=O)N2CCSCC2)cc1NC(=O)c1ccc(SCCC(C)C)c([N+](=O)[O-])c1 608946111 QTXSDPZDWYAUNU-UHFFFAOYSA-N 487.647 5.483 5 20 JKBD O=C(C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)N1CCCO[C@@H](c2ccccc2)C1 609230561 LGXRQLPNOSHXFQ-YPKVGQCMSA-N 499.592 6.125 5 20 JKBD O=C(CCC(=O)c1ccc2ccc3cccc4ccc1c2c34)NCc1ccc(-n2ccnc2)nc1 728152149 SRHRZVSQESBWOK-UHFFFAOYSA-N 458.521 5.444 5 20 JKBD O=C(Nc1ccccc1C(=O)NC1CCN(CC2CCCCC2)CC1)c1ccc([N+](=O)[O-])cc1Cl 744025139 FGOAYTNWOFEKNH-UHFFFAOYSA-N 499.011 5.275 5 20 JKBD Cc1c(C(=O)N2CCCC[C@@H]2C(=O)Nc2ccc(Cl)cc2Cl)cc([N+](=O)[O-])c(C)c1[N+](=O)[O-] 748617711 CCMOSBUJCSJTIX-QGZVFWFLSA-N 495.319 5.060 5 20 JKBD O=C(/C=C\c1nc2ccccc2s1)O[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1 849189618 CDGACOZRNBUYEW-FRHQNKJESA-N 493.928 5.794 5 20 JKBD C[C@H](Nc1ccc(-c2nc(-c3ccc(Br)o3)no2)cc1[N+](=O)[O-])c1ccccn1 904630589 WOUGKGSEBLTFEE-NSHDSACASA-N 456.256 5.235 5 20 JKBD C[C@H]1CCC[C@@H](C)N1C(=O)c1cc(Cl)ccc1NC(=O)c1cc(Cl)ccc1[N+](=O)[O-] 915154208 LAIIYMTXHBLTKV-BETUJISGSA-N 450.322 5.557 5 20 JKBD C[C@@H](OCc1ccccc1)C(=O)O[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1 915248176 IYLCDRBYIGGEIW-ZHRRBRCNSA-N 468.893 5.077 5 20 JKBD COc1cc2c(cc1OC)[C@@H](c1ccccc1)N(C(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1)CC2 915309334 VRAJCDYOAJUJQF-HSZRJFAPSA-N 467.909 5.445 5 20 JKBD CCOc1cc(/C=C\c2ccc3cccc([N+](=O)[O-])c3n2)ccc1OCCn1c([N+](=O)[O-])cnc1C 916153156 CEKZHBBRYGGHAH-YFHOEESVSA-N 489.488 5.204 5 20 JKBD COc1cc(/C=C(/Cl)c2nc(O)c3c(-c4ccccc4)csc3n2)cc([N+](=O)[O-])c1O 916155468 YDRUEGNLTZBCRX-VGOFMYFVSA-N 455.879 5.423 5 20 JKBD CSc1ccc(C(=O)OCc2csc(N(C(C)=O)c3ccc(C)cc3)n2)cc1[N+](=O)[O-] 918816359 PWXVCGPDWGCZGS-UHFFFAOYSA-N 457.533 5.123 5 20 JKBD C[C@@H](OC(=O)[C@@H](C)Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)Nc1c(Cl)cc(Cl)cc1Cl 920778709 LRVATWLKJJIKKM-RKDXNWHRSA-N 496.130 5.546 5 20 JKBD COC(=O)/C=C\c1ccc(Sc2nnc(COc3ccccc3Cl)n2C2CC2)c([N+](=O)[O-])c1 931419349 FILOUEXGPWMCKI-XFFZJAGNSA-N 486.937 5.091 5 20 JKBD O=C(CSc1ccccc1)Nc1ccc(C2(NC(=O)Cc3cccc([N+](=O)[O-])c3)CCC2)cc1 1787775071 BSXUJQGUKGWYPI-UHFFFAOYSA-N 475.570 5.064 5 20 JKBD Cc1ccc2[nH]c(C(=O)Nc3ccc(C4(NC(=O)c5cc(C)c([N+](=O)[O-])cn5)CCC4)cc3)cc2c1 1788965152 HMELTOMNNRPXFR-UHFFFAOYSA-N 483.528 5.149 5 20 JKBD O=C(Cc1cccc([N+](=O)[O-])c1)NC1(c2ccc(NC(=O)[C@@H]3[C@H]4Sc5ccccc5[C@@H]43)cc2)CCC1 1789527657 AIXZUHBREBYNOM-ZNZIZOMTSA-N 499.592 5.159 5 20 JKBD O=C(/C=C/c1ccccc1[N+](=O)[O-])NC1(c2ccc(NC(=O)c3cc(Cl)ccn3)cc2)CCC1 1789721307 DWPBQHCWIKRPKL-IZZDOVSWSA-N 476.920 5.104 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)c3cc(O)cc([N+](=O)[O-])c3)CCC2)cc1)c1ccc2ccoc2c1 1790892434 LDPAJOCXGNOYDJ-UHFFFAOYSA-N 471.469 5.108 5 20 JKBD O=C(C[C@@H]1C[C@@H]2CC[C@H]1C2)Nc1ccc(C2(NC(=O)c3nc4cc([N+](=O)[O-])ccc4[nH]3)CCC2)cc1 1791325275 GIZNQEIDSSGLDP-SQNIBIBYSA-N 487.560 5.045 5 20 JKBD COc1cc(CC(=O)NC2(c3ccc(NC(=O)[C@@H]4C[C@H]4c4ccccc4)cc3)CCC2)ccc1[N+](=O)[O-] 1791534333 SFICIJOVOIBVGU-BJKOFHAPSA-N 499.567 5.084 5 20 JKBD Cc1ccc(NC(=O)[C@@H](Sc2nnc(C)n2-c2ccccc2C)c2ccccc2)c([N+](=O)[O-])c1 10245689 OBLYFRNDXFSGMS-QHCPKHFHSA-N 473.558 5.573 5 20 JKBD COc1cc(C(=O)NC2CC(C)(C)NC(C)(C)C2)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 10813531 XVNCYMXXKGCZHI-UHFFFAOYSA-N 461.946 5.088 5 20 JKBD COc1cc(C(=O)OCC(=O)Nc2c(F)cccc2F)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 10912016 HOCSZTJEXYWPTA-UHFFFAOYSA-N 492.818 5.123 5 20 JKBD Cn1c(S[C@@H](C(=O)Nc2ccccc2)c2ccccc2)nc2cc3ccccc3cc2c1=O 11059670 HIKNQZAQQOUMSU-XMMPIXPASA-N 451.551 5.559 5 20 JKBD COc1cc(NC(=O)c2ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])cc2)ccc1N1CCCC1=O 11753146 PBUJUNYACOIDLR-UHFFFAOYSA-N 481.892 5.428 5 20 JKBD O=C(CSc1nc2scc(-c3ccc(F)cc3)c2c(=O)[nH]1)Nc1cc([N+](=O)[O-])ccc1Cl 18022852 GZDJLRDHQUSPGM-UHFFFAOYSA-N 490.925 5.083 5 20 JKBD CCc1cccc(C)c1NC(=O)COC(=O)Cc1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1 18961506 HTKMTDLNXJHIET-UHFFFAOYSA-N 498.539 5.043 5 20 JKBD Cc1c(NC(=O)[C@H](C)Sc2nnc(-c3ccccc3F)n2CC(C)C)cccc1[N+](=O)[O-] 21581652 ZNIANZOCWVHWFR-HNNXBMFYSA-N 457.531 5.076 5 20 JKBD CCc1cccc(CC)c1NC(=O)COC(=O)c1ccc(Sc2nc(C)cs2)c([N+](=O)[O-])c1 28831673 CCZHASLKRJJIGB-UHFFFAOYSA-N 485.587 5.431 5 20 JKBD COc1cc(C(=O)Nc2ccc3oc(=O)ccc3c2)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 108239761 VZFVNABOAGWDBN-UHFFFAOYSA-N 466.833 5.408 5 20 JKBD Cc1ccc([C@@H](CNC(=O)c2ccc(N[C@H](C)c3ccccn3)c([N+](=O)[O-])c2)N2CCCC2)cc1 109504845 YLCPWRCHUJWTAN-FQRUVTKNSA-N 473.577 5.038 5 20 JKBD C[C@H](c1ccc(Cl)c(Cl)c1)N(C)C(=O)c1ccc(Sc2nncn2C)c([N+](=O)[O-])c1 499486358 PIKNQLNCFUUTRH-LLVKDONJSA-N 466.350 5.015 5 20 JKBD CCc1ccc(Cl)c(CC)c1NC(=O)c1ccc(N[C@H](C)c2ccccn2)c([N+](=O)[O-])c1 506220566 QNGSOWVALNEHHH-OAHLLOKOSA-N 452.942 6.193 5 20 JKBD CCCNC(=O)c1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2Sc2ccccc2)cc1Cl 509406920 HZIFTVYTTPPDHQ-UHFFFAOYSA-N 469.950 5.792 5 20 JKBD O=C(N[C@H]1CCOc2c(Cl)cccc21)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 509668848 DPMNRUVZYPCELF-KRWDZBQOSA-N 483.874 5.123 5 20 JKBD CN(Cc1ccccc1[N+](=O)[O-])C(=O)c1nc(-c2cccs2)n(-c2cccc(C(F)(F)F)c2)n1 514487146 JIBOLJJBQPEGDO-UHFFFAOYSA-N 487.463 5.195 5 20 JKBD O=C(c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1)N(C[C@H]1CCCO1)[C@@H]1CCSC1 514493134 JSAMAZORQXXNAX-IEBWSBKVSA-N 462.955 5.167 5 20 JKBD CCOc1cc(C(=O)Nc2ccc(NCc3ccccc3)c(Cl)c2)c([N+](=O)[O-])cc1OC 519516864 RLUNABMHOGHCAS-UHFFFAOYSA-N 455.898 5.520 5 20 JKBD O=C1CCCN1C[C@H](NCc1ccc(-c2ccccc2[N+](=O)[O-])o1)c1cccc(C(F)(F)F)c1 520205140 ZDPJPEUTNAXMMB-FQEVSTJZSA-N 473.451 5.327 5 20 JKBD COc1cc2c(cc1OC)CN(Cc1ccccc1NC(=O)c1ccc([N+](=O)[O-])cc1Cl)CC2 520723328 UOBWUNREWHTDDM-UHFFFAOYSA-N 481.936 5.076 5 20 JKBD Cc1cc(C)n(-c2ccc(CNCc3ccc(-c4ccc([N+](=O)[O-])cc4Br)o3)cn2)n1 521334835 CMTZVXKREZGZOR-UHFFFAOYSA-N 482.338 5.105 5 20 JKBD Cc1ccccc1CN(Cc1cccnc1)C(=O)c1ccc(N[C@@H](C)c2ccccn2)c([N+](=O)[O-])c1 521532869 ALOJWIOCPDMHRN-NRFANRHFSA-N 481.556 5.709 5 20 JKBD CCOc1cccc([C@H](C)N[C@@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Br)c2ccccc2)c1 521726202 LNVWLYPOKZDNDM-QMHKHESXSA-N 498.377 5.787 5 20 JKBD Cc1c(NC(=O)c2cccnc2SCc2cccc(Br)c2)cccc1[N+](=O)[O-] 603637531 ZNQOCERBBUVWPJ-UHFFFAOYSA-N 458.337 5.605 5 20 JKBD COc1cc(C(=O)N(CC2CC2)c2ccc(Cl)c([N+](=O)[O-])c2)ccc1OCc1cscn1 728165680 PCMLCEFMPFYOAU-UHFFFAOYSA-N 473.938 5.349 5 20 JKBD COc1ccc([C@@H](NC(=O)c2cc([N+](=O)[O-])ccc2Cl)c2ccccc2)cc1Br 728497624 CYKINYFCRMLIPY-FQEVSTJZSA-N 475.726 5.539 5 20 JKBD Cc1cccc2[nH]cc(CCNC(=O)c3ccccc3NC(=O)c3ccc([N+](=O)[O-])cc3Cl)c12 728554888 VRKJZRJZABWSRM-UHFFFAOYSA-N 476.920 5.263 5 20 JKBD C[C@H](OC(=O)c1csc(-c2ccc([N+](=O)[O-])cc2)n1)C(=O)N[C@@H](C)c1ccc2c(c1)CCCC2 747958176 UUJWXSBHKVGBRC-HOTGVXAUSA-N 479.558 5.020 5 20 JKBD CC1CCN(c2ccc([N+](=O)[O-])cc2C(=O)N2CCC[C@@H](c3nc4ccccc4s3)C2)CC1 883989407 TVIGLVFHYMVDMS-GOSISDBHSA-N 464.591 5.461 5 20 JKBD CC(C)(C)OC(=O)NCCc1noc(-c2ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])cc2)n1 904765266 YGFKQBZRKJICDY-UHFFFAOYSA-N 460.874 5.158 5 20 JKBD CC(C)c1noc([C@H](C)OC(=O)C/C(=C\c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)n1 914897250 GHMPINJDCAQQFL-YSKWHIJTSA-N 478.530 5.946 5 20 JKBD COc1cc(C(=O)Nc2cc([N+](=O)[O-])c(F)cc2F)ccc1OCc1ccc(Br)s1 915284444 ZFTYJKGOVMFPHG-UHFFFAOYSA-N 499.289 5.537 5 20 JKBD CC(C)[C@H](OC(=O)Cn1c2ccccc2c(=O)c2ccccc21)C(=O)Nc1ccccc1Cl 915385420 XSWSLDQDXALPRV-VWLOTQADSA-N 462.933 5.015 5 20 JKBD C[C@@H](OC(=O)c1cccc(OCc2cccs2)c1)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 915464348 USYWQIJMVISUDN-CQSZACIVSA-N 451.460 5.203 5 20 JKBD O=C(Nc1cc(Cl)c([N+](=O)[O-])cc1OCc1ccccc1)c1cc(Cl)ccc1[N+](=O)[O-] 916827318 DVJBXUSFVCSJRL-UHFFFAOYSA-N 462.245 5.641 5 20 JKBD CCOC(=O)c1nc(COC(=O)c2ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])cc2)cs1 918882869 VSLJJSYZPFNCSF-UHFFFAOYSA-N 462.867 5.031 5 20 JKBD C[C@@H](Nc1ccc(C(=O)Nc2nc(-c3cccc([N+](=O)[O-])c3)cs2)cc1[N+](=O)[O-])c1ccccn1 919679637 ADLDTGDFAWXLJB-CQSZACIVSA-N 490.501 5.447 5 20 JKBD Cc1oc2cc(O)ccc2c1C(=O)NC1(c2ccc(NC(=O)Cc3cccc([N+](=O)[O-])c3)cc2)CCC1 1785791548 CRYSFCMFPFWXFX-UHFFFAOYSA-N 499.523 5.345 5 20 JKBD O=C(Cc1cccc([N+](=O)[O-])c1)Nc1ccc(C2(NC(=O)c3ccnc4ccccc34)CCC2)cc1 1785791653 JGEHUYNDOOQFKP-UHFFFAOYSA-N 480.524 5.133 5 20 JKBD Cc1cccc(CCC(=O)Nc2ccc(C3(NC(=O)c4c(F)ccc([N+](=O)[O-])c4C)CCC3)cc2)n1 1786737336 YXBUPZHSQMPTQC-UHFFFAOYSA-N 490.535 5.126 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)c3ncccc3-c3ccccc3)CCC2)cc1)c1ccc([N+](=O)[O-])[nH]1 1790185608 BNZMJYJNWPSIEY-UHFFFAOYSA-N 481.512 5.046 5 20 JKBD Cc1cc(C(=O)NC2(c3ccc(NC(=O)C4(c5cccc([N+](=O)[O-])c5)CCC4)cc3)CCC2)ccn1 1790476029 VMWOGBUKUTYXQW-UHFFFAOYSA-N 484.556 5.168 5 20 JKBD C[C@@H](C(=O)Nc1ccc(C2(NC(=O)Cc3ccc(Cl)cc3[N+](=O)[O-])CCC2)cc1)c1ccccn1 1791939476 ZCDSPTXNGBBVLH-QGZVFWFLSA-N 492.963 5.124 5 20 JKBD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CCCCCCCCc1ccccc1)c1ccc([N+](=O)[O-])[nH]1 1804259114 AVYKDVHJLKJKEB-NUNAXRQHSA-N 480.609 5.148 5 20 JKBD Cc1c(Cl)cccc1C(=O)N1CCCC2(CCN(C(=O)/C=C/c3ccccc3[N+](=O)[O-])CC2)C1 1805098541 ULQDHTMEXCGGAS-ZHACJKMWSA-N 481.980 5.115 5 20 JKBD Cc1ccc(CC(=O)N2CCCC3(CCN(C(=O)c4cc5cc([N+](=O)[O-])ccc5s4)CC3)C2)cc1 1809284138 IFIAGDNSPGKDRN-UHFFFAOYSA-N 491.613 5.205 5 20 JKBD CC(C)[C@H]1CC[C@H](C(=O)N2CCCC[C@@H]2c2cc(NC(=O)Cc3cc([N+](=O)[O-])ccc3F)n[nH]2)CC1 1815646133 ZUHPZTKFEJNXNR-PMAPCBKXSA-N 499.587 5.154 5 20 JKBD O=C(c1ccccc1Cl)N1CCC([C@@H]2CCCCN2C(=O)CCc2cccc([N+](=O)[O-])c2)CC1 1824841815 OTAXYWMILCVKCU-DEOSSOPVSA-N 483.996 5.114 5 20 JKBD O=C(/C=C/c1ccc([N+](=O)[O-])o1)N1CCC([C@H]2CCCCN2C(=O)c2cc3c(s2)CCCC3)CC1 1828557274 GETSPTDJUGPFNV-ZQAUEJBPSA-N 497.617 5.075 5 20 JKBD Cc1ccc(CC(=O)N2CCCC[C@H]2C2CCN(C(=O)c3ccc4ccoc4c3)CC2)cc1[N+](=O)[O-] 1830364045 HVLIETPLQBOFON-DEOSSOPVSA-N 489.572 5.125 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2ccc3cc[nH]c3c2)CC1 1830730028 SXRLMUAWHWWMHH-DEOSSOPVSA-N 492.551 5.071 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)N1CCCC[C@@H]1C1CCN(C(=O)CSc2ccccc2)CC1 1830730072 WRWMMMGLZIANOZ-HSZRJFAPSA-N 499.608 5.068 5 20 JKBD O=C(c1cc(F)cc([N+](=O)[O-])c1)N1CCC([C@@H]2CCCCN2C(=O)c2cccc3ccoc23)CC1 1830990814 KUBBMPJYXDQYSI-QHCPKHFHSA-N 479.508 5.027 5 20 JKBD Cc1ccc(CC(=O)N2CCC([C@@H]3CCCCN3C(=O)C[C@H](C)c3ccccc3)CC2)cc1[N+](=O)[O-] 1831506581 JIDPBPUKUXBPIO-NVQXNPDNSA-N 491.632 5.259 5 20 JKBD C[C@@]1(C(=O)N2CCC([C@@H]3CCCCN3C(=O)CSc3ccccc3[N+](=O)[O-])CC2)CC=CCC1 1831777625 ULEYMCPOLYKZTR-HFZDXXHNSA-N 485.650 5.053 5 20 JKBD Cc1ccc(NC(=O)[C@H](OC(=O)c2nc(-c3ccccc3)oc2C)c2ccccc2)c([N+](=O)[O-])c1 9717690 QALQUUXLUAPAJT-HSZRJFAPSA-N 471.469 5.403 5 20 JKBD O=C(Cc1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1)OCc1csc(-c2ccccn2)n1 10721365 WJXPFVKPYFMUSK-UHFFFAOYSA-N 497.536 5.252 5 20 JKBD C[C@H](OC(=O)c1ccc([N+](=O)[O-])cc1Cl)C(=O)Nc1ccc(OCc2ccccc2)cc1 11028882 JDWINNWGBPODHQ-HNNXBMFYSA-N 454.866 5.011 5 20 JKBD Cn1cnnc1Sc1ccc(C(=O)Nc2nc3ccc(SC(F)F)cc3s2)cc1[N+](=O)[O-] 15309022 UHKAIETULAWOTA-UHFFFAOYSA-N 494.530 5.051 5 20 JKBD Cc1c(Cl)cccc1Nc1nnc(SCC(=O)Nc2cc([N+](=O)[O-])ccc2F)s1 16323654 SRMRVGCRTWKCMS-UHFFFAOYSA-N 453.908 5.022 5 20 JKBD C[C@H](Oc1ccccc1)C(=O)O[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Br)c1ccccc1 28302501 FTMVMMUGZPPFBO-BTYIYWSLSA-N 499.317 5.048 5 20 JKBD Cc1ccc(-c2nc(NC(=O)c3ccc([N+](=O)[O-])cc3I)sc2C)s1 78416369 BTDFRKWAWZAOOQ-UHFFFAOYSA-N 485.328 5.254 5 20 JKBD O=C(Nc1nc(-c2cccc(C(F)(F)F)c2)cs1)c1cnn(-c2ccc([N+](=O)[O-])cc2)c1 107795850 HYEKSWQXVXZLDS-UHFFFAOYSA-N 459.409 5.175 5 20 JKBD C[C@H](NC(=O)c1cc([N+](=O)[O-])ccc1N1CCCCC1)c1ccc(OCc2cccnc2)cc1 108126287 OBSPGQYRMNWSGE-IBGZPJMESA-N 460.534 5.050 5 20 JKBD C[C@H](Nc1ccc(C(=O)N[C@H](C)c2cccc(OC(F)F)c2)cc1[N+](=O)[O-])c1ccccn1 108832726 PDFKOPHJFYRBGA-CABCVRRESA-N 456.449 5.255 5 20 JKBD CC(C)[C@H](NC(=O)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1)c1nc(-c2ccncc2)no1 110373782 HQTXAGLEVRNMEK-NRFANRHFSA-N 493.907 5.613 5 20 JKBD C[C@@H](Nc1ccc(C(=O)NCCOc2ccccc2-c2ccccc2)cc1[N+](=O)[O-])c1ccccn1 303034487 OKJWSKFARKSDOZ-HXUWFJFHSA-N 482.540 5.639 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)Nc2nc(-c3cccc4ccccc34)cs2)cc1SC 482212852 NQROAMFLBRGGRP-UHFFFAOYSA-N 451.529 5.854 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)Nc2nc(-c3ccccc3OC(F)F)cs2)cc1SC 484351209 OLLILTGHDGPZMR-UHFFFAOYSA-N 467.475 5.303 5 20 JKBD C[C@H](Nc1ccc(C(=O)Nc2ccc(Oc3ccccc3)cn2)cc1[N+](=O)[O-])c1ccccn1 487445435 JXADYVHMBSZHPP-KRWDZBQOSA-N 455.474 5.603 5 20 JKBD COc1ccc([C@H](NCc2nc(-c3ccc([N+](=O)[O-])cc3)no2)c2ccccc2)cc1Br 488043057 ODGATEBSPDDMRH-JOCHJYFZSA-N 495.333 5.295 5 20 JKBD Cc1ccc(NC(=O)c2ccccc2)cc1NC(=O)c1csc(-c2ccc([N+](=O)[O-])cc2)n1 496268801 WAFCXTWCLQCIQK-UHFFFAOYSA-N 458.499 5.531 5 20 JKBD Cc1c(NC(=O)c2ccc(N3CCC(C)CC3)c([N+](=O)[O-])c2)cccc1C(=O)Nc1ccccc1 498464696 PWKHVYVISCMTQH-UHFFFAOYSA-N 472.545 5.644 5 20 JKBD C[C@H](c1c(F)cccc1F)N(C)C(=O)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 498497885 SOVNHFVRKXJYQM-CYBMUJFWSA-N 471.426 5.328 5 20 JKBD C[C@@H](Nc1ccc(C(=O)N(C)Cc2cccc(Br)c2)cc1[N+](=O)[O-])c1ccccn1 503276859 VEZGGKIFBOZWST-OAHLLOKOSA-N 469.339 5.198 5 20 JKBD COC(=O)c1ccccc1C(=O)c1ccc(N[C@@H](c2ccccc2)c2nccs2)c([N+](=O)[O-])c1 505630675 DKQXNKLUEHNUSG-QFIPXVFZSA-N 473.510 5.270 5 20 JKBD Cc1noc(C2CCN(C(=O)c3ccccc3Sc3ccc(C(F)(F)F)cc3[N+](=O)[O-])CC2)n1 509123988 MIAFGESWMISHLM-UHFFFAOYSA-N 492.479 5.476 5 20 JKBD O=C(c1c2c(nc3ccccc13)/C(=C/c1ccc([N+](=O)[O-])cc1)CCC2)N1CCC(c2ncc[nH]2)CC1 509950801 BGUNESWHQCTMCE-DYTRJAOYSA-N 493.567 5.763 5 20 JKBD CC(=O)Nc1ccc2nc(NC(=O)c3cc([N+](=O)[O-])ccc3Sc3ccccc3)sc2c1 514354884 CONSQAHYKJDWAL-UHFFFAOYSA-N 464.528 5.566 5 20 JKBD O=[N+]([O-])c1cc(S(=O)(=O)N2CCCCC2)ccc1Sc1nnc(-c2ccc3ccccc3c2)o1 515480959 OWANQKJOZDKCST-UHFFFAOYSA-N 496.570 5.124 5 20 JKBD CC(C)CCOC1CCN([C@@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2ccccc2)CC1 520787397 GEFADHGFBJTCEJ-HSZRJFAPSA-N 459.974 5.455 5 20 JKBD CN(C)CCn1ccc(NC(=O)c2c3c(nc4ccccc24)/C(=C/c2ccc([N+](=O)[O-])cc2)CCC3)n1 522269902 GNPFAFLCVSUNEN-CZIZESTLSA-N 496.571 5.030 5 20 JKBD Cc1cc(-c2cc(C(=O)Nc3ccc([N+](=O)[O-])cc3F)c3cnn(C(C)C)c3n2)c(C)s1 524229753 WNGXFQWFHSIXEP-UHFFFAOYSA-N 453.499 5.657 5 20 JKBD CCCN(C(=O)c1cc(OC)c(OC)cc1[N+](=O)[O-])c1nc(-c2ccc(Cl)cc2Cl)cs1 603462816 CZKJOQJHZGPWNX-UHFFFAOYSA-N 496.372 6.099 5 20 JKBD Cc1ccc(NC(=O)c2cccc(C(F)(F)F)c2)cc1NC(=O)CCOc1ccccc1[N+](=O)[O-] 604449421 ZGZYLYIBROZALK-UHFFFAOYSA-N 487.434 5.582 5 20 JKBD O=C(Nc1ccc(OC(=O)c2ccc(-c3noc(C(F)(F)F)n3)cc2)cc1)c1cccc([N+](=O)[O-])c1 730469048 FMROICFZYFRKEJ-UHFFFAOYSA-N 498.373 5.135 5 20 JKBD CC(=O)N(C)c1ccc(N[C@@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2ccccc2)cc1 744264511 OUYLMDSSVBTEMU-JOCHJYFZSA-N 452.898 5.023 5 20 JKBD CN(C[C@H]1CCCN(C(=O)c2cc([N+](=O)[O-])ccc2Oc2ccccc2)C1)C(=O)OC(C)(C)C 744341469 HQZPQBYCYULMHK-GOSISDBHSA-N 469.538 5.106 5 20 JKBD COc1cc2[nH]c(/C(Cl)=C\c3ccc(-c4ccccc4[N+](=O)[O-])s3)nc(=O)c2cc1OC 810225902 PSOYFNZTPINGDB-OQLLNIDSSA-N 469.906 5.314 5 20 JKBD CC1=C(C(=O)Nc2ccc([N+](=O)[O-])cc2)[C@@H](c2cccs2)NC(=S)N1c1ccccc1 916160407 JYBPATJBKBNMLD-HXUWFJFHSA-N 450.545 5.005 5 20 JKBD CC(C)(C)c1cc[n+](/C(C(=S)Nc2ccc3ccccc3c2)=C(/O)c2cccc([N+](=O)[O-])c2)cc1 917610073 KIRITGXAFJBVJH-UHFFFAOYSA-O 484.601 6.656 5 20 JKBD C[C@H](OC(=O)c1ccc(N[C@@H](C)c2ccccn2)c([N+](=O)[O-])c1)C(=O)c1ccc2c(c1)CCC2 920546104 ULNBOKCGUDLILP-IRXDYDNUSA-N 459.502 5.080 5 20 JKBD C[C@@H](Nc1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2I)cc1)c1ccccc1 920810408 WWTJJGPRIIQRLO-CQSZACIVSA-N 487.297 5.625 5 20 JKBD O=C(NC1(c2ccc(NC(=O)c3cccc4ncccc34)cc2)CCC1)c1cc(F)cc([N+](=O)[O-])c1 1788906521 PCHKLDSLZOYXLZ-UHFFFAOYSA-N 484.487 5.344 5 20 JKBD Cc1cc(C(=O)NC2(c3ccc(NC(=O)c4ccc([N+](=O)[O-])cc4F)cc3)CCC2)c(C)o1 1790621947 GAXYEQOXSHMEHA-UHFFFAOYSA-N 451.454 5.005 5 20 JKBD CC(C)=CCCC(=O)NC1(c2ccc(NC(=O)Cc3ccc([N+](=O)[O-])cc3F)cc2)CCC1 1791183945 UIVOWAKGZFCJAR-UHFFFAOYSA-N 453.514 5.157 5 20 JKBD COc1cc(C(=O)Nc2ccc(C3(NC(=O)[C@@H]4CC=C(C)CC4)CCC3)cc2)ccc1[N+](=O)[O-] 1792164803 XUXBLAHNQUOVRS-GOSISDBHSA-N 463.534 5.098 5 20 JKBD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)[nH]n1)c1ccc(Cl)o1 1818427853 XSJOQBJURCFMPF-HNNXBMFYSA-N 499.936 5.399 5 20 JKBD CC(C)(C)CC(=O)N1CCC([C@H]2CCCCN2C(=O)c2cccc([N+](=O)[O-])c2Br)CC1 1830516470 CXAZUTNAAORQFW-GOSISDBHSA-N 494.430 5.027 5 20 JKBD Cc1c(Cl)cccc1C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cc(F)cc([N+](=O)[O-])c2)CC1 1830612400 FYDUHWBFHOEUPP-QHCPKHFHSA-N 487.959 5.243 5 20 JKBD COc1cc(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)/C(C)=C/c3cccs3)CC2)ccc1[N+](=O)[O-] 1832694402 IPKYIESSFNNOLQ-WTYVIMSDSA-N 497.617 5.002 5 20 JKBD O=C(CSc1ncc(C(F)(F)F)cc1Cl)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 9160670 XTUMHBBRDPIDJR-UHFFFAOYSA-N 459.755 5.412 5 20 JKBD CC(C)c1noc2ncc(C(=O)O[C@@H](C(=O)Nc3ccc([N+](=O)[O-])cc3Cl)c3ccccc3)cc12 11682610 AMXHPNHVMFSJCF-OAQYLSRUSA-N 494.891 5.445 5 20 JKBD Cc1ccc(-c2nnc(-c3ccc(C(=O)OCc4nnc(-c5ccc([N+](=O)[O-])cc5)o4)cc3)o2)cc1 16287893 ATNQYXSWGWPYNZ-UHFFFAOYSA-N 483.440 5.027 5 20 JKBD Cc1ccc(Cn2nc(C)c(C(=O)O[C@@H](C)c3nnc(-c4ccc([N+](=O)[O-])cc4)o3)c2Cl)cc1 17721729 NLAVOLWWEAUCML-HNNXBMFYSA-N 481.896 5.078 5 20 JKBD O=C(OCc1nnc(-c2ccc(Br)s2)o1)c1cc2cc([N+](=O)[O-])ccc2s1 18549094 QIYHGFFNNDDUJV-UHFFFAOYSA-N 466.294 5.041 5 20 JKBD CCOc1ccc([C@H](CNC(=O)c2cccc(C)c2[N+](=O)[O-])c2c[nH]c3ccccc23)cc1OC 23699210 NOGAKWUTDRNKLO-NRFANRHFSA-N 473.529 5.354 5 20 JKBD COc1ccc(CSc2nnc(SCC(=O)Nc3ccc(Cl)cc3[N+](=O)[O-])s2)cc1 36849004 ZCNHCEBZNKCIEE-UHFFFAOYSA-N 482.996 5.131 5 20 JKBD O=C(c1ccc(COc2ccc(F)cc2)o1)N(Cc1ccccc1[N+](=O)[O-])CC(F)(F)F 59253353 LDXPQGCQPSCLJS-UHFFFAOYSA-N 452.360 5.111 5 20 JKBD CCCCCC(=O)NC1CCN([C@@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2ccccc2)CC1 498644645 GSYWQKRNSUPLDK-XMMPIXPASA-N 487.000 5.089 5 20 JKBD O=C(Nc1cccc(NC(=O)c2cc([N+](=O)[O-])ccc2NCc2ccccc2)c1)c1ccoc1 499616583 JBFRIZQTOJMDJP-UHFFFAOYSA-N 456.458 5.305 5 20 JKBD O=C(Nc1cccc(C(=O)N2CCCC2)c1)c1cc([N+](=O)[O-])ccc1Sc1ccc(Cl)cc1 503015518 HYFXEQDZPGBRAL-UHFFFAOYSA-N 481.961 5.888 5 20 JKBD CN(Cc1cn(-c2ccccc2)nc1-c1cccs1)C(=O)c1cn(C)nc1-c1ccc([N+](=O)[O-])cc1 505980417 BLRVFLVTCBDEEY-UHFFFAOYSA-N 498.568 5.182 5 20 JKBD C[C@H](NC(=O)c1ccc(N[C@H](C)c2ccccn2)c([N+](=O)[O-])c1)c1nc2ccccc2n1C(F)F 506069137 HXIFRFXWIAKKJU-CABCVRRESA-N 480.475 5.399 5 20 JKBD Cc1noc([C@H](C)NC(=O)c2c3c(nc4ccccc24)/C(=C/c2cccc([N+](=O)[O-])c2)CCC3)n1 509111147 HLTHUZHMPBGFBK-VUODPORTSA-N 469.501 5.202 5 20 JKBD Cc1ccc(-c2csc(NC(=O)c3ccc([N+](=O)[O-])cc3I)n2)cc1C 511430170 UMNXMFHELGUWAA-UHFFFAOYSA-N 479.299 5.192 5 20 JKBD COc1cc([C@@H](C)NCc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)ccc1OCc1ccncc1 520210982 JSFLEZZPNFXYMH-GOSISDBHSA-N 459.502 5.688 5 20 JKBD C[C@H](COCC(F)(F)F)NC(=O)C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1 521504807 QPODLUCBMBYEST-DWKHYPNZSA-N 479.480 5.219 5 20 JKBD COc1cc([C@H](C)Nc2ccc(C(=O)Nc3ccc(C)cc3)cc2[N+](=O)[O-])cc(OC)c1OC 556029440 IUIOJHFRJNTQJQ-INIZCTEOSA-N 465.506 5.354 5 20 JKBD CN(Cc1ccccc1[N+](=O)[O-])C(=O)c1cccnc1SCc1ccc(Br)cc1 603738742 UPTSKJOGDTXSKL-UHFFFAOYSA-N 472.364 5.317 5 20 JKBD CCOc1cc([N+](=O)[O-])c(C(=O)Nc2cc(-c3ccccc3)nn2-c2ccccc2C)cc1OC 603760946 XVRWZIYTAKVPMO-UHFFFAOYSA-N 472.501 5.416 5 20 JKBD Cc1nc(-c2ccccc2)c(NC(=O)CSc2ccc(C(F)(F)F)cc2[N+](=O)[O-])s1 604538766 XIYPQNPYALGWCJ-UHFFFAOYSA-N 453.467 5.776 5 20 JKBD C[C@H](Nc1ccc(C(=O)Nc2cccc(-c3ccc4c(c3)OCCO4)n2)cc1[N+](=O)[O-])c1ccccn1 609382091 JLHBGHRXFQCEGT-KRWDZBQOSA-N 497.511 5.248 5 20 JKBD Cn1c(SCC(=O)N[C@H](c2cccs2)C(C)(C)C)nc2cc3ccccc3cc2c1=O 613973234 QEXKEGYJNZLOGB-OAQYLSRUSA-N 451.617 5.144 5 20 JKBD C[C@H](Nc1ccc(C(=O)Nc2ccc(Oc3ccc(F)cc3)cn2)cc1[N+](=O)[O-])c1ccccn1 729379648 VJOVJSZBZONMHK-INIZCTEOSA-N 473.464 5.742 5 20 JKBD O=C1OC(c2c(Cl)cccc2[N+](=O)[O-])=N/C1=C\c1cccc(NC(=O)c2ccccc2Cl)c1 730957405 CAEXSFRZZGCTEM-PDGQHHTCSA-N 482.279 5.498 5 20 JKBD CCS(=O)(=O)c1ccc(N2CCC(NCc3c4ccccc4cc4ccccc34)CC2)cc1 746362606 XARVBGVYPCCXGE-UHFFFAOYSA-N 458.627 5.545 5 20 JKBD COc1cc(NC(=O)c2csc(-c3cccc([N+](=O)[O-])c3)n2)ccc1NC(=O)OC(C)(C)C 747640374 QZWQFXFSPKWZFL-UHFFFAOYSA-N 470.507 5.326 5 20 JKBD C[C@H](OC(=O)C12CC3C[C@](C)(C1)C[C@@](C)(C3)C2)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 763158997 ORQUGDCZVYNSGO-WDNJPQFPSA-N 468.472 5.480 5 20 JKBD Cc1nn(Cc2ccccc2)c(Cl)c1C(=O)Nc1ccc([N+](=O)[O-])cc1C(=O)c1ccccc1 809931892 LWEXYNAUSBKHSL-UHFFFAOYSA-N 474.904 5.285 5 20 JKBD C[C@H](OC(=O)CSc1ccccc1[N+](=O)[O-])C(=O)Nc1c(Cl)cc(Cl)cc1Cl 819016187 HROGADLKLWOEIR-VIFPVBQESA-N 463.726 5.218 5 20 JKBD O=[N+]([O-])c1ccc(-c2nc(-c3cccnc3Oc3ccccc3)no2)c(I)c1 904453372 OZJMIJRCWXBYRE-UHFFFAOYSA-N 486.225 5.104 5 20 JKBD O=C(Nc1ccc(N2C(=O)c3ccccc3C2=O)c(Cl)c1)c1cc2cc([N+](=O)[O-])ccc2s1 916061636 LRTHUILPZJIMCQ-UHFFFAOYSA-N 477.885 5.516 5 20 JKBD CC(C)N(Cc1nnc(-c2cccc([N+](=O)[O-])c2)o1)C(=S)Nc1ccccc1Oc1ccccc1 917573469 YDEJFWNAVHDWIG-UHFFFAOYSA-N 489.557 6.045 5 20 JKBD Cc1cc(C(=O)O[C@@H](C(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)c2ccccc2)nn1C(C)(C)C 919351175 NXXRMIJPGHTGEJ-HXUWFJFHSA-N 470.913 5.045 5 20 JKBD C[C@H](OC(=O)c1csc(-c2ccc(Cl)cc2Cl)n1)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 921223489 KLYCOJCWKUDMLE-JTQLQIEISA-N 491.312 5.993 5 20 JKBD Cc1cc(C)nc(C(=O)Nc2ccc(C3(NC(=O)/C=C/c4ccccc4[N+](=O)[O-])CCC3)cc2)c1 1788351659 GRUBDUSXFWKFKG-MDWZMJQESA-N 470.529 5.068 5 20 JKBD Cc1ccc2oc(C(=O)NC3(c4ccc(NC(=O)/C=C/c5ccccc5[N+](=O)[O-])cc4)CCC3)cc2n1 1792317816 PPJKUEFQALRHPA-RIYZIHGNSA-N 496.523 5.506 5 20 JKBD CCC1(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)C3(c4cccc([N+](=O)[O-])c4)CCC3)[nH]n2)CCC1 1818950241 DGMNAJNVMYCFER-NRFANRHFSA-N 479.581 5.012 5 20 JKBD CC(C)[C@H]1CC[C@H](C(=O)N2CCCC[C@H]2c2cc(NC(=O)c3cc(F)cc([N+](=O)[O-])c3)n[nH]2)CC1 1821166803 FEFKJLCTPPBMPN-HOIFWPIMSA-N 485.560 5.225 5 20 JKBD Cc1c(C(=O)N2CCC([C@@H]3CCCCN3C(=O)c3ccsc3)CC2)cc(Cl)cc1[N+](=O)[O-] 1825796813 RCSYAJVZQWMYPB-FQEVSTJZSA-N 475.998 5.165 5 20 JKBD Cc1oc(C(C)(C)C)cc1C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cc(O)cc([N+](=O)[O-])c2)CC1 1825951452 QRRGNZSPPYJAPG-HSZRJFAPSA-N 497.592 5.046 5 20 JKBD O=C(c1cc(Cl)c(Cl)c(Cl)c1)N1CC2(CCCN2C(=O)CCc2cccc([N+](=O)[O-])c2)C1 1841808858 FMLPETZUAUTDEJ-UHFFFAOYSA-N 496.778 5.005 5 20 JKBD CN(Cc1cc([N+](=O)[O-])ccc1Cl)C(=O)c1ccc(Cl)c(NC(=O)c2cccs2)c1 10900001 DSTORVDSZMVLCX-UHFFFAOYSA-N 464.330 5.488 5 20 JKBD CC(C)OC(=O)C[C@@H](NC(=O)c1ccc(C2SCCCS2)cc1)c1ccccc1[N+](=O)[O-] 12861488 CWTGJTZYJSKBCV-LJQANCHMSA-N 474.604 5.276 5 20 JKBD CN(CC(=O)Nc1c(Cl)cccc1Cl)c1ccc(C(=O)c2ccccc2)cc1[N+](=O)[O-] 15171107 LKBKPWVDICWOEU-UHFFFAOYSA-N 458.301 5.208 5 20 JKBD C[C@H](OC(=O)c1cc(-c2ccc(F)cc2)nc2ccccc12)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 17529655 VWNIJIURZQWWSM-HNNXBMFYSA-N 484.443 5.917 5 20 JKBD CCn1c(S[C@H](C)C(=O)Nc2ccccc2OC(F)F)nc2cc3ccccc3cc2c1=O 18467551 NLQCFKLFSXTMEZ-CQSZACIVSA-N 469.513 5.290 5 20 JKBD O=C(Cn1c2ccccc2c(=O)c2ccccc21)OCC(=O)N1c2ccccc2CCc2ccccc21 22831612 SQHIHGOWWRSDNN-UHFFFAOYSA-N 488.543 5.161 5 20 JKBD COc1ccccc1-n1c(SCCC(=O)Nc2ccc([N+](=O)[O-])cc2)nnc1-c1cccs1 26364647 RBOIPSGNBMEDFW-UHFFFAOYSA-N 481.559 5.034 5 20 JKBD CC(C)NC(=O)Nc1ccc(CNC(=O)c2ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])cc2)cc1 46778871 IRJLHBYKNMFTHU-UHFFFAOYSA-N 482.924 5.500 5 20 JKBD CC(=O)Nc1ccc(NC(=O)c2ccc(Sc3nc(C)cs3)c([N+](=O)[O-])c2)c(Cl)c1 110593831 NYCZLGDYBCOKLA-UHFFFAOYSA-N 462.940 5.375 5 20 JKBD CC(C)CCSc1ccc(C(=O)N[C@H](c2nc(-c3ccncc3)no2)C(C)C)cc1[N+](=O)[O-] 110598929 CZLCVICFDSRKJS-FQEVSTJZSA-N 469.567 5.305 5 20 JKBD O=C(Nc1ccccc1NC(=O)N1CCCC1)c1ccc(NCc2ccccc2Cl)c([N+](=O)[O-])c1 485145532 OTMJADDQWPNODK-UHFFFAOYSA-N 493.951 5.740 5 20 JKBD COc1ccc([C@H](NC(=O)CCOc2ccccc2[N+](=O)[O-])c2ccccc2)cc1Br 485348270 HFCUCLDNIYPMPY-HSZRJFAPSA-N 485.334 5.041 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)Nc2ccc(NC(=O)Nc3ccc(Cl)cc3)cc2)cc1SC 486998724 GWFRMAIVLLJEQW-UHFFFAOYSA-N 486.937 5.875 5 20 JKBD CCCn1c2ccccc2c2nnc(S[C@@H](C)C(=O)Nc3ccc([N+](=O)[O-])cc3Cl)nc21 495456179 XRHIBBOWWOLMEU-LBPRGKRZSA-N 470.942 5.070 5 20 JKBD Cc1cc(N2CCSCC2)ccc1NC(=O)c1cc([N+](=O)[O-])ccc1Sc1ccccc1 497321886 MBTURKKOQXINES-UHFFFAOYSA-N 465.600 5.860 5 20 JKBD O=C(Nc1ccccc1COCc1ccccc1)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-] 500008983 BUNUZFVTYCFIGU-UHFFFAOYSA-N 460.408 5.505 5 20 JKBD CCCN(C(=O)c1nn(-c2ccccc2[N+](=O)[O-])c(C)cc1=O)[C@H](C)c1ccc(Cl)c(Cl)c1 502829861 OHVASQOJMNBCML-OAHLLOKOSA-N 489.359 5.369 5 20 JKBD Cc1ncc(CN(C)C(=O)c2ccccc2Sc2ccc(C(F)(F)F)cc2[N+](=O)[O-])s1 502921841 YPHJNKAYOPLONZ-UHFFFAOYSA-N 467.494 5.802 5 20 JKBD C[C@@H](Nc1ccc(C(=O)N2CCCC[C@H]2c2nc(-c3ccccc3)no2)cc1[N+](=O)[O-])c1ccccn1 505342005 FHUQGWNCLGQHRX-JPYJTQIMSA-N 498.543 5.580 5 20 JKBD CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)c1ccc(NC(=O)c2ccc(Br)o2)cc1 509720293 QZHBCGQRRLZLAO-UHFFFAOYSA-N 486.322 5.253 5 20 JKBD CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccc(=O)n(Cc2ccc(Cl)c(Cl)c2)c1 509999719 SLXDLGGIGACHKK-UHFFFAOYSA-N 489.359 5.554 5 20 JKBD COc1ccc([C@H](NC(=O)Cn2c3ccccc3c(=O)c3ccccc32)c2ccc(C)cc2)cc1 512874787 TUGVSEXTQKWIAQ-GDLZYMKVSA-N 462.549 5.378 5 20 JKBD Cc1sc(NC(=O)Cn2c(C(F)(F)F)nc3ccccc32)nc1-c1cccc([N+](=O)[O-])c1 515626164 UQAIEWKKVWFHJP-UHFFFAOYSA-N 461.425 5.034 5 20 JKBD C[C@@H](c1cccc(NC(=O)c2ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])cc2)c1)N1CCOCC1 521505427 OZZHYEQLHIPHNI-KRWDZBQOSA-N 481.936 5.686 5 20 JKBD COc1cc(C(=O)N2CCc3c(ccc(Cl)c3Cl)C2)c([N+](=O)[O-])cc1OCc1cscn1 522417489 XVKORXGQOPFAHO-UHFFFAOYSA-N 494.356 5.144 5 20 JKBD O=C(Nc1nc2c(s1)C(=O)CCC2)c1ccc(Sc2nc3ccccc3s2)c([N+](=O)[O-])c1 609021415 RSLZOXSHLRPETF-UHFFFAOYSA-N 482.568 5.584 5 20 JKBD CN1CCN(C[C@H](NCc2ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])cc2)c2ccccc2)CC1 609042216 OWDQPYDWZLVXNX-DEOSSOPVSA-N 480.996 5.119 5 20 JKBD COC(=O)c1coc(COC(=O)C/C(=C\c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)c1 726634974 NKSFURLGSAXPAU-MHWRWJLKSA-N 478.482 5.258 5 20 JKBD CCOc1cc(C(=O)Oc2ccc(NC(=O)c3cc([N+](=O)[O-])ccc3Cl)cc2)cc(Cl)c1O 761644637 AUYDYIYZGHNBTD-UHFFFAOYSA-N 491.283 5.477 5 20 JKBD CC(=O)Nc1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2N2CCC(Cc3ccccc3)CC2)cc1C 893557121 DVHXHGBNPUSTPE-UHFFFAOYSA-N 486.572 5.573 5 20 JKBD COc1cc(-c2nc(-c3cccnc3Oc3ccccc3)no2)c([N+](=O)[O-])cc1OC(F)F 904455284 ZIFYCXZGAOBPOV-UHFFFAOYSA-N 456.361 5.109 5 20 JKBD C/C(=C\c1nc(-c2ccc(N3CCN(c4ccc(F)cc4)CC3)nc2)no1)c1ccc([N+](=O)[O-])cc1 904642841 TUIVFESTZWCMOY-FBMGVBCBSA-N 486.507 5.066 5 20 JKBD Cc1ccccc1CNc1ccc(C(=O)O[C@@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)cc1 915481579 UVTSYUPESUVNMK-KRWDZBQOSA-N 458.474 5.483 5 20 JKBD Cc1[nH]c2ccccc2c1C1CCN(C(=O)c2cc([N+](=O)[O-])ccc2I)CC1 918369417 OULKGIFUDHXPFK-UHFFFAOYSA-N 489.313 5.009 5 20 JKBD Cc1c(C(=O)O[C@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2C(F)(F)F)oc2c(C)cccc12 920560150 KPGQIMJBWMQLJU-GFCCVEGCSA-N 450.369 5.161 5 20 JKBD O=C(NC1(c2ccc(NC(=O)c3cc4sccc4[nH]3)cc2)CCC1)c1cc(F)cc([N+](=O)[O-])c1 1789370132 JHJPHBLFLVAKEO-UHFFFAOYSA-N 478.505 5.338 5 20 JKBD O=C(NC1(c2ccc(NC(=O)c3cc([N+](=O)[O-])cc4c3OCC4)cc2)CCC1)c1ccc2cc[nH]c2c1 1790046530 LPBKLNMQXDXFRK-UHFFFAOYSA-N 496.523 5.073 5 20 JKBD O=C(NC1(c2ccc(NC(=O)C3(c4cccc([N+](=O)[O-])c4)CCC3)cc2)CCC1)C1CC(F)(F)C1 1790476967 JQLWDYIETSNMCF-UHFFFAOYSA-N 483.515 5.196 5 20 JKBD CC(C)(C)c1ncccc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cc3cc([N+](=O)[O-])ccc3s1)C2 1796425833 VPKPRGRBJRLHIY-BCDXTJNWSA-N 492.601 5.068 5 20 JKBD Cc1cc(Cl)ccc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc2cc([N+](=O)[O-])ccc2s1 1801206380 CJPOGIKPLZFVJT-BCDXTJNWSA-N 483.977 5.337 5 20 JKBD CCCCCc1cccc(CC(=O)N2CCC3(CCCN(C(=O)c4ccc([N+](=O)[O-])o4)C3)CC2)c1 1804651695 YTDQVZMNUXHIPC-UHFFFAOYSA-N 481.593 5.008 5 20 JKBD O=C(/C=C/c1ccccc1[N+](=O)[O-])Nc1cc([C@@H]2CCCCN2C(=O)c2cc(F)cc(Cl)c2)[nH]n1 1823503881 XVNZFSGIJRJLCR-SHBDEGQCSA-N 497.914 5.130 5 20 JKBD CC[C@H](C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2ccc([N+](=O)[O-])c(OC)c2)CC1)c1ccccc1 1826316641 CQWLCABVZLZVDB-ZEQRLZLVSA-N 493.604 5.031 5 20 JKBD Cc1ccc(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)CSc3ccccc3[N+](=O)[O-])CC2)c(C)c1 1829951958 KMPGCZNXXHQLRL-HSZRJFAPSA-N 495.645 5.237 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2c[nH]c(C(C)(C)C)c2)CC1 1830728867 PRZQUGNYFSFPKL-QFIPXVFZSA-N 498.599 5.215 5 20 JKBD CCC(C)(C)C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2ccc(Br)c([N+](=O)[O-])c2)CC1 1831386832 DYIKAGIGQLXDAW-IBGZPJMESA-N 494.430 5.027 5 20 JKBD O=C(CCC(=O)c1cccs1)O[C@@H](C(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1)c1ccccc1 10531347 GGCPPXCVUGWXHK-OAQYLSRUSA-N 472.906 5.196 5 20 JKBD Cc1ccc(-n2c(S[C@H](C)C(=O)Nc3ccc([N+](=O)[O-])cc3Cl)nnc2-c2ccncc2)cc1 10730307 ZSOQNULSCDIBRL-OAHLLOKOSA-N 494.964 5.319 5 20 JKBD C[C@H](Sc1nnc(Cc2cccs2)n1CCc1ccccc1)C(=O)Nc1ccc([N+](=O)[O-])cc1 12744178 IPXMHZWBMRGOMB-KRWDZBQOSA-N 493.614 5.201 5 20 JKBD C[C@@H](OC(=O)Cn1c2ccccc2c(=O)c2ccccc21)C(=O)Nc1ccc(Oc2ccccc2)cc1 14730492 ROTPLTPHSJINMV-HXUWFJFHSA-N 492.531 5.517 5 20 JKBD C[C@H](OC(=O)c1ccc(NCc2ccccc2)c([N+](=O)[O-])c1)C(=O)Nc1ccccc1C(F)(F)F 16748771 CJKWYKLWESEENA-HNNXBMFYSA-N 487.434 5.410 5 20 JKBD COc1cc(C(=O)O[C@@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)cc(Cl)c1OCC(C)C 17723057 QYVPHORGTZCLPG-ZDUSSCGKSA-N 475.885 5.260 5 20 JKBD O=C(Nc1ncc(Cc2ccc(Br)cc2)s1)c1ccc(Cl)cc1[N+](=O)[O-] 22191348 UBUYSGUBLLYRNY-UHFFFAOYSA-N 452.717 5.310 5 20 JKBD O=C(Nc1ccccc1)Nc1cccc(NC(=O)C2CCN(c3ccccc3[N+](=O)[O-])CC2)c1 45765927 AOBAJPBNPKUNQC-UHFFFAOYSA-N 459.506 5.094 5 20 JKBD CC(C)(C)OC(=O)N(CCCNC(=O)c1cc2ccccc2c2cccnc12)Cc1cccnc1 71968223 JLBMDOFEJBUJIV-UHFFFAOYSA-N 470.573 5.340 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)Nc2cc(C(C)(C)C)nn2-c2cccc(C)c2)cc1SC 482964816 QGISCFLHYDABGR-UHFFFAOYSA-N 454.552 5.369 5 20 JKBD CC(=O)NCC1CCN(C(=O)c2c3c(nc4ccccc24)/C(=C\c2ccc([N+](=O)[O-])cc2)CCC3)CC1 483132090 VSHDFLPPGLXXGD-XLNRJJMWSA-N 498.583 5.008 5 20 JKBD O=C(C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)NCCC(=O)NC1CCCCC1 491232446 MUMYSGFIIXXDNO-KNTRCKAVSA-N 492.601 5.090 5 20 JKBD Cc1ccc(Sc2ccc(C(=O)Nc3ccc(C(=O)N4CCCC4)cc3C)cc2[N+](=O)[O-])cc1 498486689 SXGKXZBDSMLAFB-UHFFFAOYSA-N 475.570 5.851 5 20 JKBD CSc1ccc([N+](=O)[O-])c(C(=O)Nc2ncc(Cc3cccc(Br)c3)s2)c1 505414339 GWRTZRJHKKKLCJ-UHFFFAOYSA-N 464.366 5.379 5 20 JKBD O=[N+]([O-])c1cc(CN[C@@H](c2ccccc2)c2nccs2)ccc1Oc1ccccc1Cl 507915771 VQQLFZYXOJJRFZ-QFIPXVFZSA-N 451.935 6.376 5 20 JKBD CCCOc1cc(NC(=O)c2cc(C)ccc2I)c([N+](=O)[O-])cc1OCCC 508768255 CXLBSICEJOWGJF-UHFFFAOYSA-N 498.317 5.338 5 20 JKBD CCCNC(=O)c1ccc(NC(=O)c2ccc(N3C[C@@H](C)C[C@H](C)C3)c([N+](=O)[O-])c2)cc1Cl 509373499 OPAOXYASSBMGJP-HOTGVXAUSA-N 472.973 5.123 5 20 JKBD Cc1ccc(NC(=O)CS[C@H](C)C(=O)Nc2nc(-c3ccc(C)c([N+](=O)[O-])c3)cs2)cc1 515164178 PHKBNBPMYOGVOS-OAHLLOKOSA-N 470.576 5.034 5 20 JKBD CCOc1cc(NC(=O)N2CCC(C(=O)c3ccc(C)cc3C)CC2)c([N+](=O)[O-])cc1OCC 515222164 BZKVDEBHRVXNGR-UHFFFAOYSA-N 469.538 5.136 5 20 JKBD O=C(Nc1nc(-c2cc(Cl)ccc2Cl)cs1)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-] 516069573 WMUDLHKSFCLNEV-UHFFFAOYSA-N 492.262 6.219 5 20 JKBD C[C@@H](CNC(=O)c1ccccc1Sc1ccc(C(F)(F)F)cc1[N+](=O)[O-])Cn1cccn1 517094844 XQQFQIWVSHZCHD-AWEZNQCLSA-N 464.469 5.027 5 20 JKBD CCSc1ccc(Cl)cc1NC(=O)c1ccc(N[C@H](C)c2ccccn2)c([N+](=O)[O-])c1 520542574 IMSSYSIQRWRRFR-CQSZACIVSA-N 456.955 6.181 5 20 JKBD Cc1csc(Sc2ccc(C(=O)Nc3ccc(Cl)c(C(=O)N(C)C)c3)cc2[N+](=O)[O-])n1 603623799 VRWKLHKWEHYWOP-UHFFFAOYSA-N 476.967 5.118 5 20 JKBD CCOc1cc([N+](=O)[O-])c(C(=O)N[C@@H](c2ccc(C(C)(C)C)cc2)C(F)(F)F)cc1OC 604257404 HPKWVADUZBHDHN-IBGZPJMESA-N 454.445 5.333 5 20 JKBD COc1ccc([C@@H](Nc2cnn(-c3ccc([N+](=O)[O-])cc3)c(=O)c2Cl)c2ccc(C)cc2)cc1 608830777 CLXXUVYVCHUXGH-DEOSSOPVSA-N 476.920 5.313 5 20 JKBD Cn1cc(CCCNC(=O)c2c3c(nc4ccccc24)/C(=C/c2cccc([N+](=O)[O-])c2)CCC3)cn1 608850652 ZPVNGBHKQHCUIS-RCCKNPSSSA-N 481.556 5.116 5 20 JKBD CCOc1ccc(C(=O)Nc2ccc(OC)c(OCc3ccc4ccccc4n3)c2)cc1[N+](=O)[O-] 609066208 MLWONRYWLJMBTK-UHFFFAOYSA-N 473.485 5.382 5 20 JKBD COc1ccc(CSCC(=O)N[C@@H]2CCCc3nc(-c4ccc(F)cc4)sc32)cc1[N+](=O)[O-] 609186826 UTVVWEUSDLELID-QGZVFWFLSA-N 487.578 5.293 5 20 JKBD O=C(OCc1nnc(-c2c(Cl)cccc2Cl)o1)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-] 726639094 XRDIJCDCDYMRPB-UHFFFAOYSA-N 492.193 5.250 5 20 JKBD O=C(Nc1ccc(OC(=O)c2c[nH]c3cc([N+](=O)[O-])ccc23)cc1)c1cc([N+](=O)[O-])ccc1Cl 733037757 GKTQZIBVMYWZSE-UHFFFAOYSA-N 480.820 5.109 5 20 JKBD Cc1ccc(C)c(NC(=O)[C@H](OC(=O)C2CCN(c3ccccc3[N+](=O)[O-])CC2)c2ccccc2)c1 844239970 RADMYQJDBLNKGZ-AREMUKBSSA-N 487.556 5.351 5 20 JKBD O=C1CC[C@H](c2noc(-c3ccc(NCc4ccccc4Cl)c([N+](=O)[O-])c3)n2)CN1CC1CCC1 856567157 VBWKYWHLHVUFJH-IBGZPJMESA-N 495.967 5.416 5 20 JKBD COc1ccc2[nH]cc(CC(=O)O[C@H](C(=O)Nc3ccc([N+](=O)[O-])cc3Cl)c3ccccc3)c2c1 915520530 WFYRKQZSOMKPKY-DEOSSOPVSA-N 493.903 5.204 5 20 JKBD O=[N+]([O-])c1cc(/C=C(/Cl)c2nc(O)c3c(-c4cccs4)csc3n2)ccc1Cl 916156546 CUVSLYMHBGKFHM-WUXMJOGZSA-N 450.328 6.424 5 20 JKBD CC(F)(F)C(C)(C)C(=O)Nc1ccc(C2(NC(=O)Cc3ccc([N+](=O)[O-])cc3F)CCC2)cc1 1786455891 DMBFEQPHFSKZDY-UHFFFAOYSA-N 477.483 5.092 5 20 JKBD O=C(Cc1cc([N+](=O)[O-])ccc1F)Nc1ccc(C2(NC(=O)c3cccc4cccnc34)CCC2)cc1 1786671260 ZJPXAKWNFGVECO-UHFFFAOYSA-N 498.514 5.273 5 20 JKBD Cc1c(Br)cc(C(=O)Nc2ccc(C3(NC(=O)c4ccc[nH]4)CCC3)cc2)cc1[N+](=O)[O-] 1790816698 ZAGNRXMTCJJMAG-UHFFFAOYSA-N 497.349 5.055 5 20 JKBD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc2cc([N+](=O)[O-])ccc2s1)c1cc(F)ccc1Cl 1801207254 RCGXRJYVBRVJLV-MUJYYYPQSA-N 487.940 5.168 5 20 JKBD CC(C)(C)CCCCCC(=O)N1CC[C@@H](CNC(=O)c2cc(O)cc([N+](=O)[O-])c2)[C@H]1c1cccnc1 1811689785 YMZFOCRENCITAQ-NBGIEHNGSA-N 496.608 5.012 5 20 JKBD Cc1c(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)CCC3CCC3)[nH]n2)cc(Cl)cc1[N+](=O)[O-] 1821288423 DWVBIGAXMORQHE-IBGZPJMESA-N 473.961 5.166 5 20 JKBD O=C(Nc1cc([C@@H]2CCCCN2C(=O)C2CC3(CCC3)C2)[nH]n1)c1cc2cc([N+](=O)[O-])ccc2s1 1821611132 NDBZSEARWRVPSG-IBGZPJMESA-N 493.589 5.419 5 20 JKBD CC(C)[C@H]1CC[C@H](C(=O)Nc2cc([C@@H]3CCCCN3C(=O)/C=C/c3ccc([N+](=O)[O-])o3)[nH]n2)CC1 1822100745 SSYSLSQBLLSALH-LHDMFZGTSA-N 483.569 5.079 5 20 JKBD Cc1ccc(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)Cc3ccc(Cl)cc3[N+](=O)[O-])CC2)s1 1825785108 DWZFYCDYWTYPCD-HXUWFJFHSA-N 490.025 5.094 5 20 JKBD C/C(=C\c1ccc(C)o1)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)Cc2ccc(C)c([N+](=O)[O-])c2)CC1 1829009340 HXZSGWGYOUPZMR-RALKEJGDSA-N 493.604 5.070 5 20 JKBD Cc1ccc(C(=O)N2CCCC[C@H]2C2CCN(C(=O)/C=C/c3ccc([N+](=O)[O-])o3)CC2)c(Cl)c1 1832604795 BZRFHWHGLPFYDV-OUZREKFBSA-N 485.968 5.096 5 20 JKBD O=C(O[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1)c1ccc([N+](=O)[O-])cc1Cl 11028659 KAOPTAYPPRNXQI-LJQANCHMSA-N 490.255 5.347 5 20 JKBD Cc1ccc2nc(-c3ccc(NC(=O)CSc4ccc(C(N)=O)cc4[N+](=O)[O-])cc3)sc2c1 15579409 FOSUQJFFFVSOEA-UHFFFAOYSA-N 478.555 5.010 5 20 JKBD CC(C)Cn1c(S[C@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)nc2ccc(Cl)cc2c1=O 17724685 NYPRJQVKILRSEC-CYBMUJFWSA-N 485.953 5.517 5 20 JKBD O=C(COC(=O)c1cc2sc3ccccc3c2s1)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 18655470 ZOYFZQXNKJQNKQ-UHFFFAOYSA-N 480.445 5.839 5 20 JKBD Cc1nc2ccccc2c2c(NC(=O)c3cc(S(C)(=O)=O)ccc3Cl)c3ccccc3n12 21319594 FISCKQDWBLJTIJ-UHFFFAOYSA-N 463.946 5.258 5 20 JKBD O=[N+]([O-])c1ccccc1CN(Cn1nc(-c2ccccc2F)n(C2CC2)c1=S)CC(F)(F)F 71966577 ASDWQVDGJJHHSP-UHFFFAOYSA-N 481.475 5.485 5 20 JKBD CCN(CC)C(=O)c1ccc(NC(=O)c2ccc(N3CCC[C@H](C)C3)c([N+](=O)[O-])c2)cc1Cl 117000957 MGWLOFDBTLPKOI-INIZCTEOSA-N 472.973 5.219 5 20 JKBD O=C(Nc1ccccc1C(=O)N1CC=C(c2ccc(O)cc2)CC1)c1ccc([N+](=O)[O-])cc1Cl 218424742 HLTBRHUNQIJBOG-UHFFFAOYSA-N 477.904 5.136 5 20 JKBD O=C(Nc1ccc(OCc2ccccc2)cc1)c1ccc([N+](=O)[O-])cc1I 303090728 DCLJZUOYJYSHPH-UHFFFAOYSA-N 474.254 5.031 5 20 JKBD O=C(c1ccccc1O)N1CCC(NCc2ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])cc2)CC1 436521044 KFJQEWIMKVWGQX-UHFFFAOYSA-N 481.936 5.141 5 20 JKBD C[C@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)N[C@@H](C)c1ccc(NC(=O)Nc2ccccc2)cc1 480747244 ZWXMRHZIVMNNHW-IRXDYDNUSA-N 464.547 5.597 5 20 JKBD Cc1ccc(NS(=O)(=O)c2ccc(Sc3nnc(-c4cccs4)o3)c([N+](=O)[O-])c2)c(C)c1 484073494 SRLKDGZAKDINAL-UHFFFAOYSA-N 488.572 5.275 5 20 JKBD CN(C(=O)c1ccc(NC(=O)c2c[nH]c3cc([N+](=O)[O-])ccc23)cc1Cl)C1CCCCC1 488643714 JNZDKSAUDFPPHZ-UHFFFAOYSA-N 454.914 5.387 5 20 JKBD CCC[C@@H](C)NC(=O)[C@H]1CCCN(C(=O)c2ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])cc2)C1 497472539 CBPAJMMDTCEAJH-AEFFLSMTSA-N 473.957 5.198 5 20 JKBD COc1ccc(C(=O)N2CCCCCC2)cc1NC(=O)c1ccc(N2CCC[C@H](C)C2)c([N+](=O)[O-])c1 501697475 MNGSNSNIDRTAQY-IBGZPJMESA-N 494.592 5.108 5 20 JKBD COc1cccc([C@H](CNC(=O)Nc2cc([N+](=O)[O-])ccc2C)c2c[nH]c3ccccc23)c1OC 503697224 PFYZQCKLIITONW-NRFANRHFSA-N 474.517 5.355 5 20 JKBD O=C(Cc1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1)N[C@H]1CCCOc2ccccc21 504730447 BNRXBLXCNFDLDI-DEOSSOPVSA-N 468.513 5.020 5 20 JKBD C[C@H](Nc1ccc(C(=O)NC[C@@H](c2cccc(Cl)c2)N2CCCC2)cc1[N+](=O)[O-])c1ccccn1 507050985 HEHULGHZQZJWQS-BVZFJXPGSA-N 493.995 5.383 5 20 JKBD C[C@H](Nc1ccc(C(=O)Nc2ccccc2CN2C[C@@H](C)O[C@H](C)C2)cc1[N+](=O)[O-])c1ccccn1 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O=[N+]([O-])c1ccc(-c2nn(-c3ccccc3)cc2CNCc2cn3cc(Cl)ccc3n2)cc1 608835808 UFSUKGDWZUOBKT-UHFFFAOYSA-N 458.909 5.038 5 20 JKBD CCN(Cc1ccc(CN(C)C)cc1)C(=O)c1ccccc1C(=O)c1ccc(SC)c([N+](=O)[O-])c1 608966026 OFRNAPJFHZGMBG-UHFFFAOYSA-N 491.613 5.272 5 20 JKBD COc1ccc([C@@H](NC(=O)C2CCN(c3ccc(C(F)(F)F)cc3[N+](=O)[O-])CC2)C2CC2)cc1 619224927 BODMSFBFRKMIST-QFIPXVFZSA-N 477.483 5.106 5 20 JKBD COc1cc([N+](=O)[O-])ccc1NC(=O)COC(=O)c1oc2ccccc2c1CSc1cccs1 742979789 CPIMJLKPJARRNB-UHFFFAOYSA-N 498.538 5.499 5 20 JKBD O=C(NO[C@H]1CCCCO1)c1c2c(nc3ccccc13)/C(=C/c1ccc([N+](=O)[O-])cc1)CCC2 749620675 WAJLHIRWJCPHJI-NGIFANIDSA-N 459.502 5.208 5 20 JKBD CC[C@@H](C)n1c(S[C@H](C)C(=O)Nc2cc([N+](=O)[O-])ccc2Cl)nnc1-c1ccccc1 749752024 OKXXTOSSPBOTJZ-ZIAGYGMSSA-N 459.959 5.597 5 20 JKBD CCN(Cc1ccccc1)C(=O)[C@H](C)OC(=O)c1ccccc1C(=O)c1ccc(Cl)c([N+](=O)[O-])c1 790606617 JNMJPHNMHRMZTD-KRWDZBQOSA-N 494.931 5.073 5 20 JKBD CC(=O)Nc1ccc(-c2csc(NC(=O)c3cc([N+](=O)[O-])ccc3N3CCC(C)CC3)n2)c(F)c1 790684037 CUPAPOOWNVQUOJ-UHFFFAOYSA-N 497.552 5.304 5 20 JKBD CC(C)N(Cc1nnc(-c2cccc([N+](=O)[O-])c2)o1)C(=O)/C=C/c1ccc(-c2ccc(F)cc2)s1 841515277 YDXGEUJWASVKDN-ACCUITESSA-N 492.532 5.963 5 20 JKBD O=C(CCOc1ccc(Cl)cc1)Oc1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2Cl)cc1 915810572 BMQAFLWRDHCPJV-UHFFFAOYSA-N 475.284 5.528 5 20 JKBD O=C(Oc1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2Cl)cc1)c1cnc(-c2ccccc2)s1 915811596 YEKOZABYMUKJGS-UHFFFAOYSA-N 479.901 5.843 5 20 JKBD Cc1cc(C(=O)O[C@@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)c2ccc(Br)cc2n1 919522257 BUTPHISLCWKDSC-LBPRGKRZSA-N 483.278 5.182 5 20 JKBD C[C@H](Nc1ccc(C(=O)OCC(=O)c2ccc(Cl)cc2Cl)cc1[N+](=O)[O-])c1ccccn1 920544618 DGLYZKRHFNWHNZ-ZDUSSCGKSA-N 474.300 5.509 5 20 JKBD Cc1ccoc1C(=O)Nc1ccc(C2(NC(=O)CSc3ccccc3[N+](=O)[O-])CCC2)cc1 1788694724 QZDRGGWGCSMQES-UHFFFAOYSA-N 465.531 5.036 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)c3cccc4cc[nH]c34)CCC2)cc1)c1cc([N+](=O)[O-])cc2c1OCC2 1790046033 DREPYKDSRLTVIC-UHFFFAOYSA-N 496.523 5.073 5 20 JKBD O=C(/C=C/c1ccc([N+](=O)[O-])o1)N1CCCC2(CCN(C(=O)c3ccc4occ(Cl)c4c3)CC2)C1 1805682684 ABMBZJLLEWLXRQ-ZZXKWVIFSA-N 497.935 5.146 5 20 JKBD CC1=CC[C@H](C(=O)Nc2cc([C@@H]3CCCCN3C(=O)c3cc4cc([N+](=O)[O-])ccc4s3)[nH]n2)CC1 1818809336 XTKIOBOWRJYYNM-JXFKEZNVSA-N 493.589 5.585 5 20 JKBD Cc1ccc(C(=O)N2CCCC[C@H]2c2cc(NC(=O)c3ccc([N+](=O)[O-])cc3F)n[nH]2)c(Cl)c1 1821049937 AKFFTDPXDOIKDO-FQEVSTJZSA-N 485.903 5.039 5 20 JKBD CCC[C@H]1CC[C@H](C(=O)Nc2cc([C@H]3CCCCN3C(=O)Cc3cccc([N+](=O)[O-])c3)[nH]n2)CC1 1822099211 UTDAUGSLNFDSNF-KKLQWCBXSA-N 481.597 5.159 5 20 JKBD CC1=CC[C@@H](C(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3cc(Cl)cc([N+](=O)[O-])c3C)CC2)CC1 1828350908 DAAXACIBSZUNRG-NFBKMPQASA-N 488.028 5.536 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)N1CCCC[C@H]1C1CCN(C(=O)C[C@@H]2C[C@@H]3CC[C@H]2C3)CC1 1830729035 IVARUTZDQGOQTR-HBDUWURDSA-N 485.600 5.102 5 20 JKBD Cc1ncc(C(=O)N2CCC([C@@H]3CCCCN3C(=O)c3cc4cc([N+](=O)[O-])ccc4s3)CC2)s1 1831061077 LYGHCQZKMPUXBG-IBGZPJMESA-N 498.630 5.122 5 20 JKBD CC[C@H]1CC[C@H](C(=O)N2CCC([C@H]3CCCCN3C(=O)Cc3cc(F)ccc3[N+](=O)[O-])CC2)CC1 1832888096 DWSGGZUBJKKBQB-ZILOHOTNSA-N 487.616 5.113 5 20 JKBD Cc1cc(CSc2ccccc2C(=O)O[C@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)on1 16698761 IYEFQVVLDHRIPB-CQSZACIVSA-N 466.475 5.152 5 20 JKBD CCn1c(S[C@@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)nc2sc3c(c2c1=O)CCCC3 20862054 KQYJVSNEHLKEIA-NSHDSACASA-N 493.010 5.038 5 20 JKBD CCN(CC)C(=O)Cc1ccc(NC(=O)c2ccc(NCc3ccccc3Cl)c([N+](=O)[O-])c2)cc1 33072138 SXHGPAJAUCTECA-UHFFFAOYSA-N 494.979 5.524 5 20 JKBD O=C(Cn1c2ccccc2c(=O)c2ccccc21)N[C@@H](Cn1cnc2ccccc21)c1ccc(F)cc1 69633694 ULDPHBIXBDUQLH-VWLOTQADSA-N 490.538 5.201 5 20 JKBD O=C(Nc1ccc(NC(=O)c2ccc([N+](=O)[O-])cc2Cl)c(C(F)(F)F)c1)c1ccccc1F 302969123 RUYBBHMSVRAGJW-UHFFFAOYSA-N 481.789 5.911 5 20 JKBD C[C@H](Nc1ccc(C(=O)N[C@@H](c2ccccc2)c2nccs2)cc1[N+](=O)[O-])c1ccccn1 303231194 VPXNCEMCPJOADP-AOMKIAJQSA-N 459.531 5.139 5 20 JKBD COc1ccccc1Oc1ccc(NC(=O)c2cc(SC)c(OC)cc2[N+](=O)[O-])cc1F 483349011 IYCYWEYWLMIWHE-UHFFFAOYSA-N 458.467 5.518 5 20 JKBD COc1ccc([C@@H](NCc2nc(-c3ccc([N+](=O)[O-])cc3)no2)c2ccccc2)cc1Br 488043058 ODGATEBSPDDMRH-QFIPXVFZSA-N 495.333 5.295 5 20 JKBD O=C(Nc1nc2ccccc2n1C1CCCCC1)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-] 488570321 PYWIVRILMLTICO-UHFFFAOYSA-N 462.428 5.643 5 20 JKBD Cc1nc(CN(C(=O)c2csc(-c3ccc([N+](=O)[O-])cc3)n2)c2ccc(F)cc2)cs1 496288279 ZXWRZSOWBNKXLD-UHFFFAOYSA-N 454.508 5.469 5 20 JKBD O=C(Nc1ccn(Cc2ccncc2)n1)c1ccccc1Sc1ccc(C(F)(F)F)cc1[N+](=O)[O-] 499467925 AOQKFOZIXICSOT-UHFFFAOYSA-N 499.474 5.657 5 20 JKBD CCN(C(=O)c1ccc(N[C@H](C)c2ccccn2)c([N+](=O)[O-])c1)[C@@H]1CCN([C@@H](C)c2ccccc2)C1 500001993 HKFQELRVHPSCBI-ZFGGDYGUSA-N 487.604 5.461 5 20 JKBD CCNC(=O)c1ccc(NC(=O)C/C(=C\c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)cc1 501078802 QPXXDHPIPPKRDP-XDJHFCHBSA-N 486.553 5.524 5 20 JKBD CC(C)Oc1ccc(CN[C@@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2ccccc2)cc1 502385008 JCNXGWUBCMZRGH-HSZRJFAPSA-N 453.926 5.505 5 20 JKBD C[C@@H]1CCCN(c2ccc(C(=O)Nc3ccc(NC(=O)c4ccco4)c(Cl)c3)cc2[N+](=O)[O-])C1 515871842 UEDSFSAIBUKZDT-OAHLLOKOSA-N 482.924 5.582 5 20 JKBD CCOc1cc(NC(=O)N(C)[C@@H](C)c2cccc(C(F)(F)F)c2)c([N+](=O)[O-])cc1OCC 562183852 FAEYGEJDOIVBOL-ZDUSSCGKSA-N 455.433 5.636 5 20 JKBD Cc1ccc(NC(=O)c2ccc(NCc3cccc(NC(=O)c4ccccn4)c3)c([N+](=O)[O-])c2)cc1 608972617 AYRZTYIKFYHZRD-UHFFFAOYSA-N 481.512 5.415 5 20 JKBD CN1CCN(C(=O)C/C(=C/c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)Cc2ccccc21 609036054 CSAHVAWMWREEKL-PGMHBOJBSA-N 484.581 5.614 5 20 JKBD C[C@H](NC(=O)c1ccc(C(=O)N[C@@H](C)c2c(F)cccc2F)c([N+](=O)[O-])c1)c1c(F)cccc1F 609044078 UWGKCJKAMOPMOX-STQMWFEESA-N 489.425 5.133 5 20 JKBD Cc1nc(-c2ccc(F)cc2)sc1[C@H](C)NC(=O)N(Cc1ccc([N+](=O)[O-])cc1)C(C)C 609213354 DTAUHMKFXLOUSI-INIZCTEOSA-N 456.543 5.847 5 20 JKBD COc1ccc([N+](=O)[O-])cc1COC(=O)Cc1csc(-c2cccc(C(F)(F)F)c2)n1 725970459 YXRWZUOKZRIKCO-UHFFFAOYSA-N 452.410 5.032 5 20 JKBD C[C@@H]1CN(c2ccc(NC(=O)c3cc([N+](=O)[O-])ccc3Cl)cc2C(F)(F)F)C[C@@H](C)O1 728010152 FHMZKFHKJRXGEW-VXGBXAGGSA-N 457.836 5.133 5 20 JKBD Cc1nc(-c2cccc(NC(=O)c3ccc(N[C@H](C)c4ccccn4)c([N+](=O)[O-])c3)c2)[nH]c1C 746880574 BZGHHFPPCYJXCS-QGZVFWFLSA-N 456.506 5.422 5 20 JKBD O=C(O[C@H](C(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1)c1ccccc1)c1csc(-c2ccccn2)n1 749410915 FBXYCHTXTQUKLL-FQEVSTJZSA-N 494.916 5.304 5 20 JKBD CC(C)(C)OC(=O)N1CCC(N(C(=O)c2ccc(Nc3ccccc3)c([N+](=O)[O-])c2)C2CC2)CC1 750834303 MPUFCPMHOBLIFJ-UHFFFAOYSA-N 480.565 5.343 5 20 JKBD O=[N+]([O-])c1cc(C(F)(F)F)ccc1NCCc1nc(-c2cccc(OCc3cccnc3)c2)no1 904500876 PMYRZSITGORFPE-UHFFFAOYSA-N 485.422 5.292 5 20 JKBD O=C(CCc1ncc(-c2ccc(Cl)cc2Cl)o1)OCCOc1cccc([N+](=O)[O-])c1 915384884 FROYDLFGFOMUGJ-UHFFFAOYSA-N 451.262 5.111 5 20 JKBD CC(C)N(Cc1nnc(-c2cccc([N+](=O)[O-])c2)o1)C(=O)CCn1c2ccccc2c2ccccc21 915824344 ZXSUSYVUKCCDRM-UHFFFAOYSA-N 483.528 5.580 5 20 JKBD O=C(Cn1ncc2ccc([N+](=O)[O-])cc21)Nc1ccc(Oc2ncc(Cl)cc2Cl)cc1 916411244 BYFGGBJAMSXDKC-UHFFFAOYSA-N 458.261 5.077 5 20 JKBD Cc1cccc(C)c1NC(=O)CCCOC(=O)c1ccccc1C(=O)c1ccc(Cl)c([N+](=O)[O-])c1 916589594 SXYHJRFKOWYUHS-UHFFFAOYSA-N 494.931 5.672 5 20 JKBD CCc1c(C(=O)Oc2ccc(NC(=O)c3cc([N+](=O)[O-])ccc3Cl)cc2)[nH]c(C)c1C(C)=O 916952870 UVUXSODXMQSESR-UHFFFAOYSA-N 469.881 5.121 5 20 JKBD COc1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2N2CCCCC2)cc1NC(=O)OC(C)(C)C 917108274 BJNYVDFUOYDRLL-UHFFFAOYSA-N 470.526 5.193 5 20 JKBD CC1CCN(c2ccc([N+](=O)[O-])cc2C(=O)N(C)CCCc2cc(-c3ccc(F)cc3)n[nH]2)CC1 917341930 MSROEXCQEOPXRM-UHFFFAOYSA-N 479.556 5.065 5 20 JKBD O=C(Nc1ccc(F)c(NC(=O)C2CCCCC2)c1)c1cc([N+](=O)[O-])ccc1N1CCCCC1 918620659 OKYAOXXNOPQLJT-UHFFFAOYSA-N 468.529 5.495 5 20 JKBD Cc1ccc(NC(=O)[C@@H](OC(=O)c2cccc(NC(=O)c3ccco3)c2)c2ccccc2)c([N+](=O)[O-])c1 919532718 HOBMWWIILMZGSN-DEOSSOPVSA-N 499.479 5.285 5 20 JKBD C[C@@H](SCc1ncc(-c2ccc(Cl)cc2)o1)C(=O)OCc1cc([N+](=O)[O-])cc2c1OCOC2 920673878 XAUMBZUCPXHLCI-CYBMUJFWSA-N 490.921 5.135 5 20 JKBD CC(C)c1nc(C(=O)Nc2ccc(C3(NC(=O)/C=C/c4ccccc4[N+](=O)[O-])CCC3)cc2)co1 1787028501 TYTQZSPWLAXNJR-MDWZMJQESA-N 474.517 5.167 5 20 JKBD Cc1cc(C(=O)Nc2ccc(C3(NC(=O)CCCc4cc(C)c(F)cc4[N+](=O)[O-])CCC3)cc2)on1 1787398883 AYJAWKYMXRGFOE-UHFFFAOYSA-N 494.523 5.109 5 20 JKBD Cc1cc(C(=O)NC2(c3ccc(NC(=O)c4cc5ccoc5s4)cc3)CCC2)ncc1[N+](=O)[O-] 1788416276 SMZPVSKJQGUOPN-UHFFFAOYSA-N 476.514 5.167 5 20 JKBD O=C(Cc1ccc([N+](=O)[O-])cc1F)NC1(c2ccc(NC(=O)c3ccc4occc4c3)cc2)CCC1 1789049236 GDFSTYKRZOYZJF-UHFFFAOYSA-N 487.487 5.471 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)c3cccc4c3oc3ccccc34)CCC2)cc1)c1n[nH]cc1[N+](=O)[O-] 1789691361 AHGSBQJMIZPGBQ-UHFFFAOYSA-N 495.495 5.279 5 20 JKBD Cc1ccc(C(=O)Nc2ccc(C3(NC(=O)C4(c5cccc([N+](=O)[O-])c5)CCC4)CCC3)cc2)c(C)n1 1789966954 OZVVCNDNVUBHAO-UHFFFAOYSA-N 498.583 5.476 5 20 JKBD CC(C)CC(=O)NC1(c2ccc(NC(=O)c3cccc([N+](=O)[O-])c3Br)cc2)CCC1 1790636731 OITKKRQLAQWCPD-UHFFFAOYSA-N 474.355 5.151 5 20 JKBD O=C(/C=C/c1ccccc1[N+](=O)[O-])N1CCC([C@H]2CCCCN2C(=O)c2cc(F)cc(Cl)c2)CC1 1832628340 UGKCPTKQJOODMO-UPWIVDSGSA-N 499.970 5.334 5 20 JKBD O=C(c1ccc(-c2cccnc2)cc1)N1CC2(CCCN2C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)C1 1845739427 WQTHZBYFMZFGMN-UHFFFAOYSA-N 498.564 5.002 5 20 JKBD C[C@@H](Sc1nnc(-c2cccs2)n1-c1ccccc1)C(=O)Nc1cccc([N+](=O)[O-])c1 11208823 BWHHQLGFJHVULD-CQSZACIVSA-N 451.533 5.023 5 20 JKBD Cc1cc(C)c(-c2csc(NC(=O)c3ccc(Sc4nncn4C)c([N+](=O)[O-])c3)n2)c(C)c1 14624988 XEZJVBOAILWKQI-UHFFFAOYSA-N 480.575 5.176 5 20 JKBD COCCN(C(=O)c1ccc(Cl)c(Cl)c1)c1nc(-c2ccc([N+](=O)[O-])cc2)cs1 14790542 PQWDFCUZQOTVBL-UHFFFAOYSA-N 452.319 5.318 5 20 JKBD O=C(OCc1nc2ccccc2n1C(F)F)c1ccccc1C(=O)c1ccc(Cl)c([N+](=O)[O-])c1 14902158 DOQOIVHXKOZQIQ-UHFFFAOYSA-N 485.830 5.581 5 20 JKBD CCOc1cc(C(=O)N(Cc2ccccc2)[C@@H](C)c2cccc(NC(C)=O)c2)c([N+](=O)[O-])cc1OC 23193480 RNYLDEZGIBOJGX-SFHVURJKSA-N 491.544 5.364 5 20 JKBD CNC(=O)c1cccc(CNC(=O)c2ccccc2Sc2ccc(C(F)(F)F)cc2[N+](=O)[O-])c1 25938070 ZWZNMEGEVYJMPL-UHFFFAOYSA-N 489.475 5.054 5 20 JKBD CSc1ccccc1NC(=O)CN(C)C(=O)c1ccc(NCc2ccccc2Cl)c([N+](=O)[O-])c1 31546780 QVRMDYOVRVLYME-UHFFFAOYSA-N 498.992 5.293 5 20 JKBD CNC(=O)c1ccc(Sc2nnc(-c3ccc(Cl)cc3Cl)n2C(C)C)c([N+](=O)[O-])c1 59984899 WLGKNAWBOXDYOM-UHFFFAOYSA-N 466.350 5.252 5 20 JKBD C[C@@H](Nc1ccc(C(=O)N[C@@H](c2ccccc2)c2ccccn2)cc1[N+](=O)[O-])c1ccccn1 108754784 WAANRSACGNEDQF-CJAUYULYSA-N 453.502 5.077 5 20 JKBD C[C@H](Nc1ccc(C(=O)Nc2cc(C(F)(F)F)ccc2N(C)C)cc1[N+](=O)[O-])c1ccccn1 108754795 QNTKKRSRWGBLQA-AWEZNQCLSA-N 473.455 5.500 5 20 JKBD C[C@@H](Sc1ncccc1[N+](=O)[O-])C(=O)N1N=C(c2ccc(Cl)cc2)C[C@@H]1c1ccco1 195660993 ULFJQJIDNKKRCA-FZKQIMNGSA-N 456.911 5.095 5 20 JKBD Cc1sc(NC(=O)[C@H](NC(=O)c2ccccc2Cl)C(C)C)nc1-c1cccc([N+](=O)[O-])c1 195703931 KQLDEURNUWOMCQ-GOSISDBHSA-N 472.954 5.073 5 20 JKBD Nc1c(Cl)cc(NC(=O)C2CCN(c3ccc(C(F)(F)F)cc3[N+](=O)[O-])CC2)cc1Cl 247655392 OYZMEARSCIKMFF-UHFFFAOYSA-N 477.270 5.358 5 20 JKBD C[C@H](Nc1ccc(C(=O)N2CCCN(Cc3ccc(Cl)cc3)CC2)cc1[N+](=O)[O-])c1ccccn1 303003582 NIPCHMFGXXHFJW-IBGZPJMESA-N 493.995 5.164 5 20 JKBD O=[N+]([O-])c1ccc(-c2noc(CN[C@@H](c3ccccc3)c3ccc(Br)cc3)n2)cc1 303015688 KPSBPWASFDCVAH-NRFANRHFSA-N 465.307 5.287 5 20 JKBD CC(C)CCSc1ccc(C(=O)Nc2ccccc2NC(=O)N2CCCC2)cc1[N+](=O)[O-] 485045126 YLBJHEUACXVHGU-UHFFFAOYSA-N 456.568 5.613 5 20 JKBD O=C(Nc1cccc(Cl)c1)N1CCCN(C(=O)c2cc([N+](=O)[O-])ccc2Oc2ccccc2)CC1 499021467 CPDYBCBCSYHBRI-UHFFFAOYSA-N 494.935 5.421 5 20 JKBD C[C@@H](NC(=O)c1ccc(N[C@H](C)c2ccccn2)c([N+](=O)[O-])c1)c1ccc(C(F)(F)F)cc1 506889146 DRGSRSRAVBDCPY-HUUCEWRRSA-N 458.440 5.673 5 20 JKBD CN(Cc1cn(-c2ccccc2)nc1-c1cccs1)Cc1cc([N+](=O)[O-])cc2c1OCOC2 508963913 NBNLRINHBHIRTD-UHFFFAOYSA-N 462.531 5.008 5 20 JKBD COc1cc(CNCc2nc3cc(Cl)ccc3s2)c([N+](=O)[O-])cc1OCc1ccccc1 509573899 VYAGLTDTABLQAS-UHFFFAOYSA-N 469.950 5.735 5 20 JKBD COc1cc(C(=O)N2CCC(Nc3ccc(F)cc3)CC2)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 512141221 VFFPHHKHZJYFHD-UHFFFAOYSA-N 499.926 5.905 5 20 JKBD O=C(Nc1cccc(OCc2ccc(F)cc2)c1)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-] 515808582 WBFVATDOTZTMTC-UHFFFAOYSA-N 464.371 5.506 5 20 JKBD CCOc1ccc2nc(-c3ccc(NC(=O)C(=O)N[C@@H](C)c4cccc([N+](=O)[O-])c4)cc3)sc2c1 517185308 ZWJKWHVMPXGJJU-HNNXBMFYSA-N 490.541 5.086 5 20 JKBD CSc1ccc(C(=O)c2ccccc2C(=O)Nc2ccc(C(=O)NC(C)C)c(C)c2)cc1[N+](=O)[O-] 521276177 QESGDZRIJDKJPI-UHFFFAOYSA-N 491.569 5.247 5 20 JKBD CN(Cc1ccncc1)C(=O)c1c2c(nc3ccccc13)/C(=C/c1cccc([N+](=O)[O-])c1)CCC2 601966353 CUAVJBAPWKSDOO-LTGZKZEYSA-N 464.525 5.687 5 20 JKBD COc1cc(CN(C)C(=O)c2ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])c(OC)c2)cc(OC)c1 603520757 XRTKTZVXAVXUSU-UHFFFAOYSA-N 486.908 5.339 5 20 JKBD O=C(c1cc([N+](=O)[O-])ccc1Sc1ccc(Cl)cc1)N1CCn2c1nc1ccccc12 603953368 LIVYCWBRCWXGNH-UHFFFAOYSA-N 450.907 5.410 5 20 JKBD O=C(C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1)N1CCC[C@@H]1c1ccccc1Cl 603996680 OVRKLVPKAOCEAC-LJQANCHMSA-N 481.902 5.847 5 20 JKBD Cc1cc(C)c(S(=O)(=O)Nc2cc(C(=O)N[C@@H](C)c3cccc([N+](=O)[O-])c3)ccc2C)c(C)c1 604108527 RCALYWKLRHQMQB-IBGZPJMESA-N 481.574 5.120 5 20 JKBD COc1cc(C(=O)Nc2ccc(OC(C)C)cc2C(F)(F)F)c([N+](=O)[O-])cc1OC(F)F 609218994 BCYSGCTZKQYVSK-UHFFFAOYSA-N 464.343 5.263 5 20 JKBD Cc1ccc[n+](/C(C(=S)Nc2c(Cl)ccc(C)c2Cl)=C(/O)c2cccc([N+](=O)[O-])c2)c1 728558502 NUHMEEXJQFOYCU-UHFFFAOYSA-O 475.377 6.129 5 20 JKBD Cc1ccsc1C(=O)Nc1ccc(Oc2ccc(S(=O)(=O)C(F)(F)F)cc2[N+](=O)[O-])cc1 729182513 UBRFLXOJWAGCSZ-UHFFFAOYSA-N 486.449 5.303 5 20 JKBD Cc1nnc([C@@H](C)OC(=O)c2ccccc2Sc2ccc(C(F)(F)F)cc2[N+](=O)[O-])o1 744478991 UAIIUFUJVZSIAT-SNVBAGLBSA-N 453.398 5.374 5 20 JKBD O=C(NCc1cn(Cc2ccccc2)nc1-c1ccccc1)c1cc([N+](=O)[O-])ccc1Br 750602761 VNRJRVPBSBJFJP-UHFFFAOYSA-N 491.345 5.199 5 20 JKBD CCOC(=O)/C(=C/c1ccc(-c2ccccc2[N+](=O)[O-])s1)c1nc(O)c2c(C)c(C)sc2n1 810225372 BYMCSJDVLHQMBA-LFIBNONCSA-N 481.555 5.754 5 20 JKBD C[C@H](OC(=O)c1cc([N+](=O)[O-])ccc1N1CCCCC1)C(=O)Nc1ccc(Cl)cc1Cl 823195197 RNERXCVZGSAEQR-ZDUSSCGKSA-N 466.321 5.076 5 20 JKBD Cc1ccc([N+](=O)[O-])cc1NC(=O)COC(=O)c1ccccc1-c1ncc(-c2ccccc2F)o1 899989861 BKARAIAQBAKYMQ-UHFFFAOYSA-N 475.432 5.160 5 20 JKBD O=C(Nc1ccc(Cl)c([N+](=O)[O-])c1)[C@H]1CCCN(C(=O)c2ccc(Cl)c(Cl)c2)C1 914838150 CZVBCBUBRGRFEW-LBPRGKRZSA-N 456.713 5.046 5 20 JKBD CN(Cc1ccccc1[N+](=O)[O-])C(=O)NC[C@@H](c1ccc(N(C)C)cc1)c1c[nH]c2ccccc12 915891750 OTAICPGUFXRANF-QHCPKHFHSA-N 471.561 5.116 5 20 JKBD CC(=O)Nc1ccc(S[C@@H](C)C(=O)Nc2cc(Cl)c([N+](=O)[O-])cc2OCc2ccccc2)cc1 917610849 XBTPHXZHKVQZKF-HNNXBMFYSA-N 499.976 5.905 5 20 JKBD Cc1sc(NC(=O)c2ccc(NC(=O)OC(C)(C)C)cc2)nc1-c1cccc([N+](=O)[O-])c1 917790761 KORQZNFDIAXXIY-UHFFFAOYSA-N 454.508 5.626 5 20 JKBD CC(=O)N(c1ccc(C)cc1)c1nc(COC(=O)c2cc([N+](=O)[O-])ccc2N2CCCCC2)cs1 918959424 JZBIKCDYIYMPFZ-UHFFFAOYSA-N 494.573 5.392 5 20 JKBD COc1cc(C(=O)O[C@@H](c2cc(C)cc(C)c2)C(F)(F)F)c([N+](=O)[O-])cc1OCc1cscn1 919994227 PWWSJMAIIXRKGG-FQEVSTJZSA-N 496.463 5.716 5 20 JKBD O=C(Cc1cccc([N+](=O)[O-])c1)Nc1ccc(C2(NC(=O)c3cc4cccnc4s3)CCC2)cc1 1785792294 WFVXENLDXBJFNK-UHFFFAOYSA-N 486.553 5.195 5 20 JKBD O=C(CSc1ccccc1[N+](=O)[O-])NC1(c2ccc(NC(=O)[C@@H]3CCC(F)(F)C3)cc2)CCC1 1785803599 USRWKJZELTVYDB-MRXNPFEDSA-N 489.544 5.256 5 20 JKBD C/C(=C\c1ccc(C)o1)C(=O)NC1(c2ccc(NC(=O)/C=C/c3ccc([N+](=O)[O-])o3)cc2)CCC1 1786207478 QJSWAXPXESKDBD-XFMAJURKSA-N 475.501 5.340 5 20 JKBD Cc1c(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)[C@H](c2ccccc2)C(C)C)C3)cc(Cl)cc1[N+](=O)[O-] 1800713085 PDLWNYKMFROHNM-XARGGIHNSA-N 483.996 5.248 5 20 JKBD CCCCCc1ccc(CC(=O)N2CCC3(CCCN(C(=O)c4ccc([N+](=O)[O-])o4)C3)CC2)cc1 1804649614 GLWPLBFWVPFFAN-UHFFFAOYSA-N 481.593 5.008 5 20 JKBD Cc1c(Cl)cccc1C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cc(F)cc([N+](=O)[O-])c2)CC1 1823915767 HXLYMOKYOCSDPV-QHCPKHFHSA-N 487.959 5.243 5 20 JKBD COc1cc(C(=O)N2CCC([C@H]3CCCCN3C(=O)CC3CCC(C)(C)CC3)CC2)ccc1[N+](=O)[O-] 1830426423 NPDSNYDHPGYAGU-HSZRJFAPSA-N 499.652 5.443 5 20 JKBD C[C@H](CC(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2ccc([N+](=O)[O-])cc2F)CC1)c1ccccc1 1831507509 QMYYMTMKWJGBOO-KBMIEXCESA-N 481.568 5.161 5 20 JKBD C[C@H](Sc1nnc(-c2ccco2)n1C1CCCCC1)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl 10015048 JBSQGNFOUCALAF-ZDUSSCGKSA-N 475.958 5.724 5 20 JKBD CC(C)CCn1c(S[C@@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)nc2cc(Cl)ccc2c1=O 17670479 GAMWDICHQXJMMI-AWEZNQCLSA-N 499.980 5.908 5 20 JKBD C[C@H](OC(=O)c1ccc2[nH]c3c(c2c1)CCCC3)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 21365606 MSCHZGAHHCIXCY-LBPRGKRZSA-N 475.423 5.158 5 20 JKBD C[C@@H](N[C@H]1CCSc2ccc(Cl)cc21)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 25216114 STNMSVVMBAYKHZ-BMIGLBTASA-N 459.877 5.421 5 20 JKBD CC(=O)Nc1cccc(-n2c(SCc3nc4ccccc4c4ccccc34)nnc2C2CC2)c1 26137605 ACEVGGWLJFNHSF-UHFFFAOYSA-N 465.582 6.097 5 20 JKBD COc1ccc(NC(=O)[C@@H](OC(=O)c2cccc(C)c2[N+](=O)[O-])c2ccccc2)cc1Cl 104495719 BGNXBDRZIHJFQN-NRFANRHFSA-N 454.866 5.102 5 20 JKBD CN(C)c1ccc([C@H](CNC(=O)c2cc([N+](=O)[O-])ccc2Cl)c2c[nH]c3ccccc23)cc1 104711264 JLQCUEACNBHGHY-NRFANRHFSA-N 462.937 5.357 5 20 JKBD C[C@@H](Nc1ccc(C(=O)Nc2ccc3nc(N4CCCC4)sc3c2)cc1[N+](=O)[O-])c1ccccn1 195605295 HQOPFVFPLVWSOA-MRXNPFEDSA-N 488.573 5.625 5 20 JKBD COc1cc(CSc2nnc(Nc3cccc(NC(C)=O)c3)s2)c([N+](=O)[O-])cc1OC(F)F 497339711 DFNGUKRHFUCBEZ-UHFFFAOYSA-N 497.505 5.051 5 20 JKBD CCc1cc(O)nc(-c2cccc(NC(=O)c3cc([N+](=O)[O-])ccc3Oc3ccc(OC)cc3)c2)n1 500342458 FJYUHHPRMMAPDK-UHFFFAOYSA-N 486.484 5.373 5 20 JKBD COc1ccc([N+](=O)[O-])cc1C(=O)Nc1sc(-c2ccccc2)c(C)c1C(=O)N1CCCCC1 503007576 ZYOVOOIHJSCAAT-UHFFFAOYSA-N 479.558 5.519 5 20 JKBD CSc1ccc([N+](=O)[O-])c(C(=O)Nc2ccc(CC(=O)N3CCCc4ccccc43)cc2)c1 503469149 LSQNNMFROSYENU-UHFFFAOYSA-N 461.543 5.091 5 20 JKBD CC(C)Oc1ccc([N+](=O)[O-])cc1CSc1nnc(CN2CCCCC2)n1Cc1ccccc1 511088755 IHJXPHJZKKRWDF-UHFFFAOYSA-N 481.622 5.300 5 20 JKBD O=[N+]([O-])c1ccc(-c2nn(-c3ccccc3)cc2CNC[C@@H]2CCN(c3ccccc3)C2)cc1 518769754 ZNDKWJVRVPWGJU-NRFANRHFSA-N 453.546 5.064 5 20 JKBD C[C@@H](SCC(=O)Nc1c(Br)cc([N+](=O)[O-])cc1Br)c1ccc(F)cc1 521614072 ZFVGKLWAWILFTD-SECBINFHSA-N 492.164 5.692 5 20 JKBD CC[C@@H](C)c1ccc2nc(N(Cc3ccccc3)C(=O)Cn3cc([N+](=O)[O-])ccc3=O)sc2c1 521799172 GQSPTDLVADPPNV-QGZVFWFLSA-N 476.558 5.113 5 20 JKBD O=C1c2cc(Cl)ccc2N[C@H](c2ccc(Br)cc2[N+](=O)[O-])N1c1ccncc1 602754019 AJMKFCCLGCKRNY-SFHVURJKSA-N 459.687 5.177 5 20 JKBD O=c1c2cc([N+](=O)[O-])ccc2nc2n1CC/C2=C\c1csc(-c2cccc(Br)c2)n1 603781399 SCNJWRDYFZWAKN-FMIVXFBMSA-N 481.331 5.135 5 20 JKBD O=C(CCc1nc(O)c2ccccc2n1)Nc1cc([N+](=O)[O-])ccc1Nc1cccc(C(F)(F)F)c1 603849624 LIOVNYDRFIVMFY-UHFFFAOYSA-N 497.433 5.577 5 20 JKBD O=C(Nc1ccccc1NS(=O)(=O)c1ccc(F)cc1)c1cc2cc([N+](=O)[O-])ccc2s1 604097908 YFGGZCAGUKYEQA-UHFFFAOYSA-N 471.491 5.002 5 20 JKBD COc1ccc(CNCc2cn(-c3ccccc3)nc2-c2ccc([N+](=O)[O-])cc2)cc1Br 608837212 FCRFBYHRYWFVIG-UHFFFAOYSA-N 493.361 5.508 5 20 JKBD O=C(Nc1ccccc1C(=O)N1CCCO[C@@H](c2ccccc2)C1)c1ccc([N+](=O)[O-])cc1Cl 609233103 PXFMFFJNIAFNKU-HSZRJFAPSA-N 479.920 5.104 5 20 JKBD C[C@H](NC(=O)[C@@H](C)Sc1nc2cc3ccccc3cc2c(=O)n1C)c1cc2ccccc2o1 622146058 HPVHJTXOJNRAQQ-JKSUJKDBSA-N 457.555 5.191 5 20 JKBD C[C@H](c1cccs1)N(Cc1ccccc1)C(=O)Cn1c2ccccc2c(=O)c2ccccc21 642073106 IDHMYFITYKOVNG-HXUWFJFHSA-N 452.579 6.006 5 20 JKBD CC(C)Sc1ccc([C@@H](C)NC(=O)c2cc([N+](=O)[O-])ccc2I)cc1 728832245 IVXSBKHDVTWGQL-GFCCVEGCSA-N 470.332 5.191 5 20 JKBD CC(C)(C)OC(=O)Nc1cc2ccccc2cc1C(=O)OCC(=O)Nc1cc([N+](=O)[O-])ccc1F 743246530 LIZVRHPOSRCWFV-UHFFFAOYSA-N 483.452 5.030 5 20 JKBD CN(C)c1ccc([C@H](CNC(=O)c2c[nH]c3ccc([N+](=O)[O-])cc23)c2c[nH]c3ccccc23)cc1 749367876 OLWQYGJQZQTCJI-QFIPXVFZSA-N 467.529 5.185 5 20 JKBD Cc1nc(CN(c2cccc(C(F)(F)F)c2)S(=O)(=O)c2ccc(Cl)c([N+](=O)[O-])c2)oc1C 749675323 QDZFFNUKLZSETM-UHFFFAOYSA-N 489.859 5.267 5 20 JKBD O=c1nc(/C(Cl)=C/c2ccc(-c3cccc([N+](=O)[O-])c3)o2)[nH]c2cc(C(F)(F)F)ccc12 916128134 SCFBFXQUDYKSSJ-YBEGLDIGSA-N 461.783 5.847 5 20 JKBD CCOc1cc(C(=O)Nc2nc(Cc3ccc(Br)cc3)cs2)c([N+](=O)[O-])cc1OC 917713793 PGRSYELVAZIAOJ-UHFFFAOYSA-N 492.351 5.064 5 20 JKBD O=C(NCCOC(=O)c1ccccc1-c1ncc(-c2ccccc2)o1)c1ccc([N+](=O)[O-])cc1Cl 920149408 XUSNOUGCXAFGGU-UHFFFAOYSA-N 491.887 5.157 5 20 JKBD C[C@H](Nc1ccc(C(=O)O[C@H](C)C(=O)c2ccc(Br)cc2)cc1[N+](=O)[O-])c1ccccn1 920549286 XAAAJZDCUYFQGK-LSDHHAIUSA-N 498.333 5.354 5 20 JKBD COc1ccc([N+](=O)[O-])c(C(=O)OCc2csc(N(C(C)=O)c3c(C)cc(C)cc3Cl)n2)c1 920704695 BWXQVNVQXMDHOH-UHFFFAOYSA-N 489.937 5.372 5 20 JKBD C[C@H](C(=O)Nc1ccc(C2(NC(=O)c3ccc([N+](=O)[O-])o3)CCC2)cc1)c1ccc(Cl)cc1 1785986762 BDFIZKSYBJEFKB-HNNXBMFYSA-N 467.909 5.393 5 20 JKBD Cc1cc(CCCC(=O)Nc2ccc(C3(NC(=O)c4cccnc4)CCC3)cc2)c([N+](=O)[O-])cc1F 1786274542 AEISRSLOJDGFRT-UHFFFAOYSA-N 490.535 5.208 5 20 JKBD O=C(NC1(c2ccc(NC(=O)C34CC(C(F)(F)F)(C3)C4)cc2)CCC1)c1ccc([N+](=O)[O-])cc1F 1786461575 OWCOHWGYOLXYIN-UHFFFAOYSA-N 491.441 5.214 5 20 JKBD O=C(CCC(F)(F)F)Nc1ccc(C2(NC(=O)CSc3ccccc3[N+](=O)[O-])CCC2)cc1 1787872539 OSTIHAUBWMBUQS-UHFFFAOYSA-N 481.496 5.164 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)c3cc4ccoc4s3)CCC2)cc1)c1cc(O)cc([N+](=O)[O-])c1 1790754585 DUZRXVXVUOINDT-UHFFFAOYSA-N 477.498 5.170 5 20 JKBD Cc1c(C(=O)Nc2ccc(C3(NC(=O)C4CC(F)(F)C4)CCC3)cc2)cc(Cl)cc1[N+](=O)[O-] 1790773529 JTIVWMZSDZVBIZ-UHFFFAOYSA-N 477.895 5.350 5 20 JKBD COc1cc(C(=O)Nc2ccc(C3(NC(=O)[C@@H]4CC=C(C)CC4)CCC3)cc2)cc([N+](=O)[O-])c1OC 1790815163 PLSUVHVJYDRQIZ-GOSISDBHSA-N 493.560 5.106 5 20 JKBD Cc1cncc(C(=O)NC2(c3ccc(NC(=O)c4cc5cc([N+](=O)[O-])ccc5s4)cc3)CCC2)c1 1791010976 MGSYPYPWBDLVPQ-UHFFFAOYSA-N 486.553 5.574 5 20 JKBD CC(C)(C)OCC(=O)NC1(c2ccc(NC(=O)c3cc4cc([N+](=O)[O-])ccc4s3)cc2)CCC1 1791011246 TVBSKEQBSNRYNN-UHFFFAOYSA-N 481.574 5.372 5 20 JKBD C[C@H](C(=O)Nc1ccc(C2(NC(=O)c3cc([N+](=O)[O-])cc4c3OCC4)CCC2)cc1)c1cccs1 1791814953 BNTGBQMJCGSGKP-INIZCTEOSA-N 491.569 5.143 5 20 JKBD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H]1C[C@H]1c1ccc(F)cc1)c1cc2cc([N+](=O)[O-])ccc2s1 1792918491 RRWLJMACNFYXMD-AINOVGTFSA-N 493.560 5.004 5 20 JKBD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)/C=C/c1ccccc1[N+](=O)[O-])c1ccccc1Oc1ccccc1 1804343806 CARMKTDBLZSYQK-QYPWNIQKSA-N 497.551 5.352 5 20 JKBD O=C(c1cc(F)cc([N+](=O)[O-])c1)N1CCC([C@@H]2CCCCN2C(=O)c2cccc(F)c2Cl)CC1 1830572534 RZSHILZDYRWGRU-NRFANRHFSA-N 491.922 5.074 5 20 JKBD Cc1c(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)[C@H]3CCC(F)(F)C3)CC2)cc(Cl)cc1[N+](=O)[O-] 1830734245 GQTHLNRPOGBSOQ-FXAWDEMLSA-N 497.970 5.225 5 20 JKBD Cc1cccc(C(=O)N2CCCC[C@H]2C2CCN(C(=O)c3cccc(F)c3[N+](=O)[O-])CC2)c1Cl 1832603949 XIZAPTXHBPQABD-NRFANRHFSA-N 487.959 5.243 5 20 JKBD C[C@@H](C(=O)N1CCCC[C@@H]1C1CCN(C(=O)Cc2ccc(Cl)cc2[N+](=O)[O-])CC1)c1ccccc1 1832889287 LCIHZCXVBGTPME-NTKDMRAZSA-N 498.023 5.214 5 20 JKBD O=C(NC[C@@H](c1ccccc1)c1c[nH]c2ccccc12)C1CCN(c2ccccc2[N+](=O)[O-])CC1 10691339 AOODIPRDNURJHI-QHCPKHFHSA-N 468.557 5.241 5 20 JKBD CCCCn1c(S[C@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)nnc1-c1ccc(OC)cc1 17656205 IIUNFDKIWFFSBV-OAHLLOKOSA-N 480.550 5.565 5 20 JKBD C[C@H](Sc1nnc(COc2ccccc2Cl)n1C1CC1)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 17712411 RPZSFJFZJQVGRA-ZDUSSCGKSA-N 498.952 5.657 5 20 JKBD C[C@H](OC(=O)c1ccccc1SCc1ccco1)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 18411044 VMWCZLAAMKZQDF-ZDUSSCGKSA-N 494.447 5.683 5 20 JKBD CSc1ccc(C(=O)c2ccccc2C(=O)N2CCC(C(=O)c3ccccc3)CC2)cc1[N+](=O)[O-] 26130273 XAKDXNGVZWJGHP-UHFFFAOYSA-N 488.565 5.283 5 20 JKBD COc1ccc(NC(=O)c2cc(-c3cc(C)sc3C)nc3c2cnn3C(C)C)c([N+](=O)[O-])c1 58530725 VOBSIJZMTCMCEQ-UHFFFAOYSA-N 465.535 5.527 5 20 JKBD COCCOc1cccc(NC(=O)c2ccc(NCc3ccccc3Cl)c([N+](=O)[O-])c2)c1 59771308 UPQCNSCAWNHXFZ-UHFFFAOYSA-N 455.898 5.138 5 20 JKBD O=C(Nc1ccc(F)c(NC(=O)C2CCCCC2)c1)C1CCN(c2ccccc2[N+](=O)[O-])CC1 107624999 GOXLOZUVRXUYIW-UHFFFAOYSA-N 468.529 5.108 5 20 JKBD COc1ccc(NC(=O)c2cc3ccccc3c3cccnc23)cc1NC(=O)c1cccc(F)c1 107876366 YQWOTOPZBWFAKZ-UHFFFAOYSA-N 465.484 6.040 5 20 JKBD Cc1cc(O[C@H](C)c2ccccc2)ccc1NC(=O)C1CCN(c2ccccc2[N+](=O)[O-])CC1 303187943 LXPULOGNFOXRQD-HXUWFJFHSA-N 459.546 5.898 5 20 JKBD C[C@H](NC(=O)c1cnn(-c2ncc(C(F)(F)F)cc2Cl)c1C(F)F)c1cccc([N+](=O)[O-])c1 409504535 VBPJPNBHKXFTMB-VIFPVBQESA-N 489.788 5.276 5 20 JKBD O=C(c1cc([N+](=O)[O-])ccc1Sc1ccccc1)N1CC=C(c2c[nH]c3ncccc23)CC1 485387523 SDKXKOITYCBHBW-UHFFFAOYSA-N 456.527 5.552 5 20 JKBD Cc1cc(=O)c(C(=O)Nc2cc(Cl)ccc2Oc2ccccc2)nn1-c1ccccc1[N+](=O)[O-] 492233795 JRPSTFONFDOIBM-UHFFFAOYSA-N 476.876 5.147 5 20 JKBD CCOc1ccc(NC(=O)CSc2nnc(-c3ccc(F)cc3)c3ccccc23)c([N+](=O)[O-])c1 499827315 GGFKIJIQSFZJOZ-UHFFFAOYSA-N 478.505 5.474 5 20 JKBD C[C@@H](Nc1ccc(C(=O)NCCc2ccc(Cl)cc2Cl)cc1[N+](=O)[O-])c1ccccn1 506113492 SDXVWQDZMUSZTN-CQSZACIVSA-N 459.333 5.442 5 20 JKBD O=C(Nc1ccc(Cl)cc1Cl)[C@H]1CCCCN1C(=O)c1cc2cccc([N+](=O)[O-])c2[nH]1 507359686 QBZASMSVEAMGNA-GOSISDBHSA-N 461.305 5.016 5 20 JKBD O=C(CN[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1)Nc1cccc2ccccc12 507879737 LQXXVVWJSBXGKE-VWLOTQADSA-N 488.931 5.310 5 20 JKBD COc1cc(CN[C@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Br)c2ccccc2)ccc1C 513188804 SBEVGIUFTCPUGB-QFIPXVFZSA-N 484.350 5.144 5 20 JKBD CC(=O)Nc1ccc(NC(=O)C/C(=C\c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)cc1 515000889 YJWGWUMDQLHLHT-NBVRZTHBSA-N 472.526 5.732 5 20 JKBD COc1cc(OC)cc(Oc2ccc(/C=C3\CCn4c3nc3ccc([N+](=O)[O-])cc3c4=O)cc2)c1 520472314 JLIBCWYSUQZOAW-GZTJUZNOSA-N 471.469 5.059 5 20 JKBD COc1ccccc1CNC(=O)C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1 598801023 VNIDMNIEERNZHO-XMHGGMMESA-N 459.527 5.460 5 20 JKBD NC(=O)c1ccc(F)c(NC(=O)c2ccccc2Sc2ccc(C(F)(F)F)cc2[N+](=O)[O-])c1 603762207 AFMZNEGWBCCODC-UHFFFAOYSA-N 479.411 5.255 5 20 JKBD COC(=O)c1ccoc1COc1cccc2c1N(C(=O)[C@@H](C)Sc1ccc([N+](=O)[O-])cc1)CCC2 608947302 NHEKDAOTXCYWBG-MRXNPFEDSA-N 496.541 5.013 5 20 JKBD CC[C@@H](C)NC(=O)c1cccc(CNc2ccc(C(=O)Nc3ccc(C)cc3)cc2[N+](=O)[O-])c1 608972649 DZZURPLMKASCRD-GOSISDBHSA-N 460.534 5.296 5 20 JKBD CC(=O)NCCCc1ccc(-c2csc(NC(=O)c3cc4ccccc4c4cccnc34)n2)cc1 643124999 YYWOSGYWDNOBSS-UHFFFAOYSA-N 480.593 5.833 5 20 JKBD CSc1ccc([C@H](CNC(=O)c2cc(F)c(F)cc2[N+](=O)[O-])N2CCc3sccc3C2)cc1 727708837 MCOFBQAVZZFCHW-NRFANRHFSA-N 489.569 5.186 5 20 JKBD Cc1ccc(NC(=O)C2CC2)cc1NC(=O)CCC(=O)c1ccc2ccc3cccc4ccc1c2c34 727766828 LAZCCSNZRFHVGC-UHFFFAOYSA-N 474.560 6.843 5 20 JKBD O=C(N[C@@H]1CCCc2nc(-c3ccc(F)cc3)sc21)c1cc([N+](=O)[O-])ccc1Br 729659287 QENUYVDCTFWAAC-MRXNPFEDSA-N 476.327 5.427 5 20 JKBD Cc1ncc([N+](=O)[O-])cc1C(=O)O[C@H](C(=O)Nc1cc(Cl)cc(Cl)c1)c1ccccc1 730011581 DFGUBUDRLISRBJ-IBGZPJMESA-N 460.273 5.142 5 20 JKBD COc1ccc(NC(=O)OC(C)(C)C)c(NC(=O)c2csc(-c3cccc([N+](=O)[O-])c3)n2)c1 747640510 ZXVFQTHCCRDIKV-UHFFFAOYSA-N 470.507 5.326 5 20 JKBD CSc1ccc(C(=O)OCC(=O)N(Cc2ccccc2)c2nc3c(s2)CCCC3)cc1[N+](=O)[O-] 749128414 OPGJYFFHGJKMBQ-UHFFFAOYSA-N 497.598 5.042 5 20 JKBD O=C(Nc1cc(Cl)c(Cl)cc1Cl)c1ccc([N+](=O)[O-])cc1I 751061311 FJEYISZNOKTDKG-UHFFFAOYSA-N 471.465 5.412 5 20 JKBD CCOc1cc(/C=C(/C(=O)O[C@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2C)c2ccccc2)ccc1O 852996726 CZDZCLBSNQJOQG-ISPGYRLHSA-N 490.512 5.119 5 20 JKBD COc1ccc(CNC(=O)Nc2ccccc2SC[C@H]2CC2(Cl)Cl)cc1[N+](=O)[O-] 918037813 YXRHKHMNTICZQP-CYBMUJFWSA-N 456.351 5.211 5 20 JKBD C[C@@H](OC(=O)[C@@H](C)Oc1cccc(C(C)(C)C)c1)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 919407281 JIPHHTBWINRVDS-ZIAGYGMSSA-N 482.455 5.249 5 20 JKBD Cc1cccc(N2C(=O)/C(=C/c3cn(C)nc3-c3ccc([N+](=O)[O-])cc3)c3ccccc3C2=O)c1 920064825 LREARCLUZNMNDP-BUVRLJJBSA-N 464.481 5.031 5 20 JKBD O=C(NC1(c2ccc(NC(=O)[C@H]3C[C@H]3C3CC3)cc2)CCC1)c1cccc(Br)c1[N+](=O)[O-] 1786054459 CLKHLYOGCZQGBK-OALUTQOASA-N 498.377 5.151 5 20 JKBD Cc1ccc(CCC(=O)Nc2ccc(C3(NC(=O)c4ccc([N+](=O)[O-])cc4F)CCC3)cc2)c(C)n1 1791772867 XPORXMUMIIRRIG-UHFFFAOYSA-N 490.535 5.126 5 20 JKBD Cc1c(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2ccc4sccc4c2O)C3)cc(Cl)cc1[N+](=O)[O-] 1800712406 HRFXGUIEXLFORK-MUJYYYPQSA-N 499.976 5.043 5 20 JKBD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc2cc([N+](=O)[O-])ccc2s1)c1ccc2occc2c1 1801206642 GCOASOFGDFKYJX-REPLKXPHSA-N 475.526 5.121 5 20 JKBD O=C(c1cc2cc([N+](=O)[O-])ccc2s1)N1CCC([C@H]2CCCCN2C(=O)C[C@H]2CCCCO2)CC1 1824913452 NCLPUUREQRUBST-FGZHOGPDSA-N 499.633 5.002 5 20 JKBD Cc1cccc(Cl)c1C(=O)N1CCCC[C@@H]1C1CCN(C(=O)Cc2cccc([N+](=O)[O-])c2)CC1 1830594235 RVRPQQHFBIZNST-HSZRJFAPSA-N 483.996 5.033 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)N1CCCC[C@H]1C1CCN(C(=O)[C@@H]2CCCCC2(F)F)CC1 1830728356 KMVSRIGROVSCRT-RXVVDRJESA-N 495.542 5.101 5 20 JKBD O=C(Cc1cc(F)ccc1[N+](=O)[O-])N1CCC([C@H]2CCCCN2C(=O)c2ccc(C3CC3)cc2)CC1 1830752887 QTAZGLYXKSGIPM-RUZDIDTESA-N 493.579 5.087 5 20 JKBD CSCc1c(C(=O)OCC(=O)Nc2ccc(C(F)(F)F)cc2[N+](=O)[O-])oc2ccccc12 9786756 QOESWYUAJPCVCZ-UHFFFAOYSA-N 468.409 5.018 5 20 JKBD O=C(O[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1)c1cc([N+](=O)[O-])ccc1Cl 10665344 NVRSUUMTYFNWNK-IBGZPJMESA-N 490.255 5.347 5 20 JKBD Cc1nn(Cc2ccc(C(=O)N3CCC(c4nc5ccccc5s4)CC3)cc2)c(C)c1[N+](=O)[O-] 14936561 LLXXHZVBBYNQTO-UHFFFAOYSA-N 475.574 5.086 5 20 JKBD CC1CCN(c2ccc(C(=O)O[C@@H](C)C(=O)Nc3ccccc3C(F)(F)F)cc2[N+](=O)[O-])CC1 15816530 RZAQTJMWQXOHAV-HNNXBMFYSA-N 479.455 5.034 5 20 JKBD CC(C)OC(=O)C[C@@H](NC(=O)c1sc2cc(F)ccc2c1Cl)c1ccccc1[N+](=O)[O-] 22187742 WPJOWZHUACUVCV-OAHLLOKOSA-N 464.902 5.415 5 20 JKBD CCc1ccccc1N(C(C)=O)c1nc(COC(=O)c2cc([N+](=O)[O-])ccc2N2CCCC2)cs1 26642709 WYHJNRITVAMXEE-UHFFFAOYSA-N 494.573 5.256 5 20 JKBD CCOC(=O)c1c(NC(=O)CSc2ccc([N+](=O)[O-])cc2)sc(C(=O)Nc2ccccc2)c1C 28605348 QOUUUALUBSVUCD-UHFFFAOYSA-N 499.570 5.125 5 20 JKBD Cc1nccc(-c2cccc(NC(=O)Cc3cn(-c4ccccc4)nc3-c3ccc([N+](=O)[O-])cc3)c2)n1 33125063 RJWVJFVCZKXOHT-UHFFFAOYSA-N 490.523 5.394 5 20 JKBD COc1ccc(Oc2ccc([N+](=O)[O-])cc2C(=O)Nc2nnc(Cc3ccccc3)s2)cc1 33149659 LJBDKCKXDYKQQB-UHFFFAOYSA-N 462.487 5.090 5 20 JKBD C[C@H](Sc1nnc(NCCc2cccs2)s1)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 45619608 UQQNSCLIYLMNLS-NSHDSACASA-N 460.566 5.066 5 20 JKBD Cc1cc(NC(=O)Cc2csc(-c3cccc(Br)c3)n2)n(-c2ccc([N+](=O)[O-])cc2)n1 105525835 DOMMOMURKTYYGB-UHFFFAOYSA-N 498.362 5.156 5 20 JKBD O=C(C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1)N1CCC(COc2ccccc2)CC1 108840377 VTOGCODDFWJUAI-UHFFFAOYSA-N 491.510 5.148 5 20 JKBD COc1cc(C(=O)Nc2ccc(OC3CCCC3)cc2)c([N+](=O)[O-])cc1OCc1cscn1 108906508 VENOERMWRKMIHJ-UHFFFAOYSA-N 469.519 5.213 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)Nc2ccnn2Cc2c(Cl)cccc2Cl)cc1SC 481996860 FWIKCGNXZIJFTB-UHFFFAOYSA-N 467.334 5.129 5 20 JKBD NC(=O)c1ccc(F)c(NC(=O)C/C(=C/c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)c1 483152017 CWNFEZXZBADXRK-WJDWOHSUSA-N 476.489 5.012 5 20 JKBD O=C(N[C@H](c1ccccc1)c1cccnc1)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 485509900 KGCRGGOAQRNOSP-HSZRJFAPSA-N 484.478 5.131 5 20 JKBD Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)c1ccc(NC(=O)c2ccc(Br)o2)cc1 490831562 YTOWLRPVHKPRGF-UHFFFAOYSA-N 458.268 5.072 5 20 JKBD O=C(Cc1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1)Nc1ccc(OC[C@H]2CCCO2)cc1 502049817 MLWHRYIJDLMCGS-AREMUKBSSA-N 498.539 5.187 5 20 JKBD C[C@H](Nc1ccc(C(=O)Nc2ccccc2N2CCCCCC2)cc1[N+](=O)[O-])c1ccccn1 506137544 OKAAQHMLGKHUHP-IBGZPJMESA-N 459.550 5.796 5 20 JKBD CCN(C(=O)N[C@@H](C)c1cccc([N+](=O)[O-])c1)[C@H]1CCSc2ccc(Br)cc21 507330874 RSOKWGHMRNHBES-UGSOOPFHSA-N 464.385 5.687 5 20 JKBD CCOc1cc(CN[C@@H]2CCSc3c(F)cccc32)ccc1OCCn1c([N+](=O)[O-])cnc1C 509609801 SLZOSNSJRXFKQB-HXUWFJFHSA-N 486.569 5.043 5 20 JKBD CCN(CC)S(=O)(=O)c1ccc(Oc2ccc(NC(=O)c3sccc3C)cc2)c([N+](=O)[O-])c1 511397853 KDJPGWTZXCIWRQ-UHFFFAOYSA-N 489.575 5.040 5 20 JKBD COc1ccc(CNC(=O)c2ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])c(OC)c2)cc1F 512304670 NGCHVQJUECUKMX-UHFFFAOYSA-N 460.845 5.127 5 20 JKBD COc1cc(C(=O)Nc2sc3c(c2C(=O)OC(C)C)CC[C@H](C)C3)c([N+](=O)[O-])cc1OC(F)F 514574813 XBTXQBVHYYFKAC-NSHDSACASA-N 498.504 5.209 5 20 JKBD CCOc1c(Br)cc(Cl)cc1NCc1nc(-c2ccc([N+](=O)[O-])cc2)no1 515664132 FHHOIXDQFHIOFT-UHFFFAOYSA-N 453.680 5.072 5 20 JKBD Cc1ccc([C@H](NC(=O)CCCn2c(=O)oc3cc([N+](=O)[O-])ccc32)c2ccc(F)cc2Cl)cc1 517436865 WVWSELWTRBMHEZ-DEOSSOPVSA-N 497.910 5.290 5 20 JKBD CCn1c(SCC(=O)N[C@@H](c2ccccc2)c2nccs2)nc2cc3ccccc3cc2c1=O 518127552 DFRKQKQUKYRXID-QHCPKHFHSA-N 486.622 5.024 5 20 JKBD O=C(Nc1cc2c(cc1[N+](=O)[O-])OCCCO2)c1csc(-c2ccc(Cl)cc2Cl)n1 553005389 LMUPZJIHVQTGQU-UHFFFAOYSA-N 466.302 5.439 5 20 JKBD COC(=O)CC1CCN(C(=O)c2c3c(nc4ccccc24)/C(=C/c2cccc([N+](=O)[O-])c2)CCC3)CC1 553011982 CBUBTBWQUDEMPE-LTGZKZEYSA-N 499.567 5.435 5 20 JKBD CCN(Cc1ccc(OC)cc1)C(=O)c1ccccc1C(=O)c1ccc(SC)c([N+](=O)[O-])c1 603526635 XEMIFNFCKYBTNS-UHFFFAOYSA-N 464.543 5.219 5 20 JKBD CCOc1ccc(-c2nc(CC(=O)N(Cc3ccccc3[N+](=O)[O-])CC(F)(F)F)cs2)cc1 603614321 DXTBWTHYHVIFPT-UHFFFAOYSA-N 479.480 5.251 5 20 JKBD C[C@@H](c1ccccc1)n1c(SCc2nc(-c3ccc([N+](=O)[O-])cc3)no2)nnc1-c1ccccc1 603917230 HRKFDGFPINUUTG-KRWDZBQOSA-N 484.541 5.805 5 20 JKBD C[C@@H](c1nnc(SCCCOc2ccc([N+](=O)[O-])cc2)n1-c1ccc(Cl)cc1)N(C)C 603945528 CWCABHFJLLSNFT-HNNXBMFYSA-N 461.975 5.013 5 20 JKBD COc1ccccc1N(C)C(=O)C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1 603992135 DMROIBMCMMPOOM-SDXDJHTJSA-N 459.527 5.807 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Cl)[C@H](NCc1cc2c(s1)CCCC2)c1ccccc1 604045747 GGZYJIJURNCEPS-JOCHJYFZSA-N 455.967 5.658 5 20 JKBD Cc1ccc(C(C)C)c(Oc2ccc(CN[C@H](C)c3nnc4n3CCCCC4)cc2[N+](=O)[O-])c1 604417895 JTYPUWLIYWVCPM-LJQANCHMSA-N 463.582 5.988 5 20 JKBD Cc1ccc(NC(=O)c2ccc(N3CCC[C@@H](c4nc5ccccc5o4)C3)c([N+](=O)[O-])c2)cc1 608972792 GPNDSLZQAWYHES-LJQANCHMSA-N 456.502 5.681 5 20 JKBD CCSc1ccc(Cl)cc1NC(=O)c1cc(OC)c(OCc2cscn2)cc1[N+](=O)[O-] 609218537 RGDWKPQFLLQVHJ-UHFFFAOYSA-N 479.967 5.657 5 20 JKBD C[C@@H](Nc1ccc(C(=O)Nc2ccnn2Cc2ccc(Cl)c(F)c2)cc1[N+](=O)[O-])c1ccccn1 609428108 KZEKMMPPJHEUOE-OAHLLOKOSA-N 494.914 5.453 5 20 JKBD O=C(COC(=O)c1csc(-c2cccc(C(F)(F)F)c2)n1)Nc1ccc(Cl)c([N+](=O)[O-])c1 725999817 VRAIAVFOMCYXDH-UHFFFAOYSA-N 485.827 5.186 5 20 JKBD COc1ccc(COc2cccc(F)c2)cc1NC(=O)c1ccc(Br)c([N+](=O)[O-])c1 745807013 SPJYYVUAAYYTNV-UHFFFAOYSA-N 475.270 5.336 5 20 JKBD O=C(Nc1sc2c(c1-c1nc3ccccc3[nH]1)CCCC2)c1cc([N+](=O)[O-])ccc1Br 751055060 RORCGLMCUMAXRT-UHFFFAOYSA-N 497.374 6.093 5 20 JKBD CCOc1cc(NC(=O)COc2ccc(C3SCCCS3)cc2)c([N+](=O)[O-])cc1OCC 790631075 YYQLUOYGEBYTLR-UHFFFAOYSA-N 478.592 5.278 5 20 JKBD O=C(COc1ccc(F)c(Cl)c1)Oc1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2Cl)cc1 907267969 IFAGOZLGWSSGOK-UHFFFAOYSA-N 479.247 5.277 5 20 JKBD Cc1nc2ccnn2c(C)c1CCC(=O)Nc1cc(Cl)c([N+](=O)[O-])cc1OCc1ccccc1 917609688 DWQRDYHUNWCOOG-UHFFFAOYSA-N 479.924 5.058 5 20 JKBD COc1ccc([C@H](C)C(=O)NC2(c3ccc(NC(=O)/C=C/c4ccc([N+](=O)[O-])o4)cc3)CCC2)cc1 1786205573 HSFAGYPKPVCTTG-SZEUEKNRSA-N 489.528 5.147 5 20 JKBD O=C(CCCOc1ccc(Cl)cc1)Nc1ccc(C2(NC(=O)c3ccc([N+](=O)[O-])o3)CCC2)cc1 1786697712 LOYRCYHNJBVDGZ-UHFFFAOYSA-N 497.935 5.448 5 20 JKBD COc1cscc1C(=O)Nc1ccc(C2(NC(=O)CSc3ccccc3[N+](=O)[O-])CCC2)cc1 1788827865 YYKBMMUYOXDINM-UHFFFAOYSA-N 497.598 5.205 5 20 JKBD O=C(Cn1ccc2ccc([N+](=O)[O-])cc21)NC1(c2ccc(NC(=O)c3ccc(F)cc3)cc2)CCC1 1790292441 XXZVIEQOTJVBJB-UHFFFAOYSA-N 486.503 5.137 5 20 JKBD C[C@H](Sc1ccccn1)C(=O)NC1(c2ccc(NC(=O)c3cc(F)cc([N+](=O)[O-])c3)cc2)CCC1 1790699418 OOJMYALTKYMYQC-INIZCTEOSA-N 494.548 5.057 5 20 JKBD CCc1oncc1C(=O)NC1(c2ccc(NC(=O)c3cc4cc([N+](=O)[O-])ccc4s3)cc2)CCC1 1791010971 LLNSAXMXNNSQQX-UHFFFAOYSA-N 490.541 5.421 5 20 JKBD Cc1c(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)[C@@H]2CCC[C@@H]3CCCC[C@@H]32)cc(Cl)cc1[N+](=O)[O-] 1797875050 OEBZKNHVFXYUPS-BGOZWBLRSA-N 488.028 5.415 5 20 JKBD CCC[C@H]1CC[C@H](C(=O)NC[C@H]2CCN(C(=O)c3cc(F)cc([N+](=O)[O-])c3)[C@H]2c2cccnc2)CC1 1812790065 OTDUGAHCZQYRMX-JDFHOKRYSA-N 496.583 5.055 5 20 JKBD O=C(Nc1cc([C@H]2CCCCN2C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)[nH]n1)c1ccoc1Cl 1820395332 KPOPZFIRQMZGEG-MRXNPFEDSA-N 499.936 5.399 5 20 JKBD Cc1c(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)CC3CCCC3)[nH]n2)cc(Cl)cc1[N+](=O)[O-] 1821290463 DJXWQMVAWMSRDS-IBGZPJMESA-N 473.961 5.166 5 20 JKBD O=C(/C=C/c1ccc([N+](=O)[O-])o1)N1CCC([C@@H]2CCCCN2C(=O)c2cc3c(s2)CCCC3)CC1 1828557272 GETSPTDJUGPFNV-DJGBTNNQSA-N 497.617 5.075 5 20 JKBD CC[C@H]1CC[C@H](C(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3cc(N(C)C)ccc3[N+](=O)[O-])CC2)CC1 1831696753 XWZJIAHPVJBJDN-QFZWGZQFSA-N 498.668 5.111 5 20 JKBD C[C@H](OC(=O)c1cc([N+](=O)[O-])ccc1Cl)C(=O)Nc1ccc(Cl)c(C(F)(F)F)c1 10666533 QMKSFPQQOWDONJ-QMMMGPOBSA-N 451.184 5.104 5 20 JKBD O=C(CSc1ccc([N+](=O)[O-])cc1)Nc1nnc(SCc2ccc(Cl)cc2)s1 16008606 MFMYZQFHQAARLP-UHFFFAOYSA-N 452.970 5.123 5 20 JKBD Cc1ccc(-c2nc(C(=O)Oc3ccc(NC(=O)c4cccc([N+](=O)[O-])c4)cc3)cs2)cc1 17344064 HKNQZBGEUXKBIZ-UHFFFAOYSA-N 459.483 5.498 5 20 JKBD C[C@@H](OC(=O)c1ccc(C2SCCCS2)cc1)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 17936948 DNJLYQOJKBTSSE-CYBMUJFWSA-N 457.533 5.432 5 20 JKBD CCCN(CC(=O)Nc1ccc(Cl)cc1Cl)C(=O)c1ccc(SC)c([N+](=O)[O-])c1 18004237 WAQWIBFYTZBSLG-UHFFFAOYSA-N 456.351 5.114 5 20 JKBD CNC(=O)c1ccc(CNC(=O)c2ccccc2Sc2ccc(C(F)(F)F)cc2[N+](=O)[O-])cc1 30452638 FFCKLOQVALXCLS-UHFFFAOYSA-N 489.475 5.054 5 20 JKBD Cc1ccc(NC(=O)c2ccccc2)cc1NC(=O)c1ccc(N[C@@H](C)c2ccccn2)c([N+](=O)[O-])c1 108832389 GMAYCXUCNAQHNA-IBGZPJMESA-N 495.539 5.976 5 20 JKBD CSc1nc(C(=O)O[C@@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2ccccc2)c2ccccn12 109023181 CBTKFKCGSRQEGK-HXUWFJFHSA-N 496.932 5.155 5 20 JKBD O=C(Nc1ccccc1C(=O)Nc1ccc(Oc2ccncc2)cc1)c1ccc([N+](=O)[O-])cc1Cl 109598123 KNPXRZONRYQVFM-UHFFFAOYSA-N 488.887 5.940 5 20 JKBD CCOc1c(Br)cc(Cl)cc1NC(=O)c1cc(OC)c(OC(F)F)cc1[N+](=O)[O-] 115463382 RRXILKATWQPZII-UHFFFAOYSA-N 495.660 5.272 5 20 JKBD CC1CCN(Cc2cccc(CNC(=O)c3ccc(N[C@@H](C)c4ccccn4)c([N+](=O)[O-])c3)c2)CC1 116692358 QXJQRATWIWVELE-NRFANRHFSA-N 487.604 5.325 5 20 JKBD CC(=O)N(C)C1CCN(C(=O)c2c3c(nc4ccccc24)/C(=C/c2ccc([N+](=O)[O-])cc2)CCC3)CC1 500026944 CNEQEGGSRKEIGH-DYTRJAOYSA-N 498.583 5.103 5 20 JKBD O=C(C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)Nc1cccc(-c2nnco2)c1 502190101 ZNBASASNOYWJOE-LDADJPATSA-N 483.509 5.824 5 20 JKBD C[C@@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccc(CC(=O)N2CCCc3ccccc32)cc1 503486855 LOQLIHBEVHJNIV-GOSISDBHSA-N 475.570 5.236 5 20 JKBD CCOc1cc(C(=O)N(C)[C@H]2CCSc3ccc(Br)cc32)c([N+](=O)[O-])cc1OC 504630113 YELSVQNMWYYIFN-HNNXBMFYSA-N 481.368 5.074 5 20 JKBD COc1cc(C(=O)Nc2ccc(Oc3ccncc3)c(Cl)c2)c([N+](=O)[O-])cc1OC(F)F 505744408 QIPAJPACDJNLFH-UHFFFAOYSA-N 465.796 5.298 5 20 JKBD COc1cc(C(=O)Nc2cccc(-c3cccs3)c2)c([N+](=O)[O-])cc1OCc1cscn1 505899092 OFPWNWZHHMUXTQ-UHFFFAOYSA-N 467.528 5.620 5 20 JKBD CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccc(C(=O)NCc2ccc(F)cc2)cc1 509228269 RDXPVZVCXSNVDE-UHFFFAOYSA-N 464.497 5.106 5 20 JKBD CC1CCN(c2ccc(C(=O)N(C)c3ccc(Br)cc3F)cc2[N+](=O)[O-])CC1 509704001 HVTAOUKUUAMKLH-UHFFFAOYSA-N 450.308 5.009 5 20 JKBD Cc1nn(Cc2ccc(C(=O)N(Cc3cccc(Br)c3)C(C)C)cc2)c(C)c1[N+](=O)[O-] 512270688 PPGXTBHCDSZJGE-UHFFFAOYSA-N 485.382 5.270 5 20 JKBD Cc1ccc(Sc2ccc(CN[C@H](C)c3ccc(S(=O)(=O)N(C)C)cc3)cc2[N+](=O)[O-])cc1 513627132 LFQPRYHNGKMVGW-GOSISDBHSA-N 485.631 5.156 5 20 JKBD COc1cc(C(=O)NC[C@H](OC)c2ccccc2)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 516138622 GYJRIEUOSIUEKJ-QFIPXVFZSA-N 456.882 5.167 5 20 JKBD O=C(C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)N1CCCN(c2ccccc2)CC1 516527744 YYIUXOFXHMGPMX-ZBJSNUHESA-N 498.608 5.874 5 20 JKBD Cc1c(C(=O)Nc2ccc(NC(=O)Nc3ccc(Cl)cc3)cc2)nnn1-c1cccc([N+](=O)[O-])c1 516800678 REESHUYTXGFMSW-UHFFFAOYSA-N 491.895 5.034 5 20 JKBD O=C(Cn1c2ccccc2c(=O)c2ccccc21)Nc1nc2c(s1)C[C@@H](c1ccccc1)CC2 520019717 GWQPWHBHKRDPNE-IBGZPJMESA-N 465.578 5.522 5 20 JKBD CO[C@@H](C)C(=O)Nc1cccc(N[C@@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2ccccc2)c1 520466939 KLLPEUHUKFSONY-OYHNWAKOSA-N 482.924 5.014 5 20 JKBD CS(=O)(=O)c1ccc(Oc2ccc(NC(=O)c3csc(-c4cccc([N+](=O)[O-])c4)n3)cc2)cc1 522534835 ICTGEUZBHVKEHQ-UHFFFAOYSA-N 495.538 5.166 5 20 JKBD COCCN(C(=O)[C@H]1C[C@@H]1c1ccc(C(F)(F)F)cc1)c1nc(-c2ccc([N+](=O)[O-])cc2)cs1 589197827 CPWGVNIUMJKUAD-MOPGFXCFSA-N 491.491 5.520 5 20 JKBD CC(C)c1ccc(OC2CCN(C(=O)c3cc(OCC(F)(F)F)ccc3[N+](=O)[O-])CC2)cc1 603927057 LZOPDKKHXHAPHJ-UHFFFAOYSA-N 466.456 5.343 5 20 JKBD COc1cc(C(=O)Nc2cccnc2N2CCCC2)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 604236575 VDRQDUVEAKCYIK-UHFFFAOYSA-N 468.897 5.297 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Cl)[C@@H](Nc1cccc(OCC(F)(F)F)c1)c1ccccc1 604469132 JMIKLGVVSRHQNX-FQEVSTJZSA-N 479.842 5.981 5 20 JKBD COc1cc(CN[C@H](C)c2ccc(-c3csc(C)n3)cc2)c([N+](=O)[O-])cc1OCC(F)(F)F 604532251 QDYIEKYYPBRDCJ-CYBMUJFWSA-N 481.496 5.827 5 20 JKBD CCOc1ccc(CNCc2cn(-c3ccccc3)nc2-c2ccc([N+](=O)[O-])cc2)cc1OC 608836425 XDGQZRCSRIFNCG-UHFFFAOYSA-N 458.518 5.145 5 20 JKBD COc1cc([N+](=O)[O-])ccc1NC(=O)COC(=O)c1sc2cc(Br)ccc2c1Cl 729873687 WFPUQJFTYQBVLY-UHFFFAOYSA-N 499.726 5.030 5 20 JKBD CCc1ccc(N(C(=O)COc2ccc([N+](=O)[O-])c(F)c2)c2nc3ccccc3s2)cc1 745739128 UUDZVHAARFUKJW-UHFFFAOYSA-N 451.479 5.650 5 20 JKBD Cc1c([N+](=O)[O-])cc(C(=O)N(Cc2ccc(Cl)c(Cl)c2)Cc2ccccn2)cc1[N+](=O)[O-] 748639955 FNLXGANAEYAYFL-UHFFFAOYSA-N 475.288 5.356 5 20 JKBD CC(=O)N(c1ccc(C)c(C)c1)c1nc(COC(=O)c2cc([N+](=O)[O-])c(C)c([N+](=O)[O-])c2C)cs1 748946200 DNZLXOFMONNTFF-UHFFFAOYSA-N 498.517 5.235 5 20 JKBD O=C(Nc1cc([N+](=O)[O-])ccc1F)[C@@H]1C[C@H]2CCCC[C@@H]2N1C(=O)c1ccc2ccccc2c1 751065048 QXKFENXZOQZFEA-DKLXNKCPSA-N 461.493 5.299 5 20 JKBD O=C(N[C@H](COc1ccccc1F)c1ccccc1)c1cc([N+](=O)[O-])ccc1Br 751090170 ZEFUKPSDHSCTNK-LJQANCHMSA-N 459.271 5.047 5 20 JKBD CC(=O)N(c1ccccc1)c1nc(COC(=O)c2c3ccccc3cc3ccccc23)cs1 754587231 BQEYSTNALIUBBO-UHFFFAOYSA-N 452.535 6.491 5 20 JKBD O=C(COC(=O)/C(=C\c1ccc(F)cc1)c1cccs1)Nc1cc(Cl)ccc1[N+](=O)[O-] 772042607 LIMBSHUWRAZYBJ-YBEGLDIGSA-N 460.870 5.171 5 20 JKBD CC(C)(C)OC(=O)N1CCCc2cc(NCc3ccc(C(F)(F)F)cc3[N+](=O)[O-])ccc21 864028233 RMKOCOXAOLEKRG-UHFFFAOYSA-N 451.445 5.913 5 20 JKBD C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc(-c2ccc(N3CCN(c4ccc(F)cc4)CC3)nc2)no1 904643353 YDEWSQKFBWZMIA-VLGSPTGOSA-N 486.507 5.066 5 20 JKBD CCOc1ccccc1C(=O)N1CCC[C@H]1C(=O)OCc1nc2ccccc2c2ccccc12 915009318 YXVQOOIFOQNWJS-VWLOTQADSA-N 454.526 5.135 5 20 JKBD CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)c1ccc(NS(=O)(=O)/C=C\c2ccccc2)cc1 919867665 LLVGFAYPWCZOAA-MSUUIHNZSA-N 479.558 5.058 5 20 JKBD O=C(NCCOC(=O)c1ccccc1SCc1cccs1)c1ccc([N+](=O)[O-])cc1Cl 920148090 KNLJAVDDJDEEHJ-UHFFFAOYSA-N 476.963 5.189 5 20 JKBD Cc1cccc(NC(=O)[C@@H](OC(=O)c2ccc(N[C@@H](C)c3ccccn3)c([N+](=O)[O-])c2)C(C)C)c1C 920543474 FEAIEMDWBNRNPL-DFBJGRDBSA-N 490.560 5.600 5 20 JKBD CC1=CC[C@@H](C(=O)Nc2ccc(C3(NC(=O)CSc4ccccc4[N+](=O)[O-])CCC3)cc2)CC1 1789113592 AYNUYURASVGJGE-LJQANCHMSA-N 479.602 5.567 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)c3ccccc3Cl)CCC2)cc1)c1ccc(O)c([N+](=O)[O-])c1 1790619211 SCLZQWJCKBAABH-UHFFFAOYSA-N 465.893 5.015 5 20 JKBD Cc1ccc(CC(=O)NC2(c3ccc(NC(=O)c4ccc5c(c4)C(=O)CC5)cc3)CCC2)cc1[N+](=O)[O-] 1790887275 YUCJZTSLPMSEJW-UHFFFAOYSA-N 497.551 5.023 5 20 JKBD C[C@H](CC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cc3cc([N+](=O)[O-])ccc3s1)C2)c1ccccc1 1801752707 SAIRVOZBDWCGNB-RZXSNQJFSA-N 477.586 5.255 5 20 JKBD CC(C)[C@H](C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cc(F)cc([N+](=O)[O-])c2)n[nH]1)c1ccccc1 1821163889 YQWRGXZBVZEQIW-VWNXMTODSA-N 493.539 5.203 5 20 JKBD C/C(=C\c1cccs1)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)Cc2ccc([N+](=O)[O-])cc2F)CC1 1823720161 SJDWNCWHVRXABO-MMYRTMNYSA-N 499.608 5.061 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)N1CCC([C@@H]2CCCCN2C(=O)/C=C/c2cccs2)CC1 1827078965 IRHDWTYMALHJJQ-FNNXTJRKSA-N 485.581 5.051 5 20 JKBD Cc1ccnc(C(=O)N2CCCC[C@H]2C2CCN(C(=O)c3cc4cc([N+](=O)[O-])ccc4s3)CC2)c1 1827759719 UYCVDRFSDUIPNA-QFIPXVFZSA-N 492.601 5.060 5 20 JKBD O=C(c1ccc(Cl)cc1F)N1CCC([C@@H]2CCCCN2C(=O)c2cc(F)cc([N+](=O)[O-])c2)CC1 1830612686 IAJPVCPKHUQQFU-QFIPXVFZSA-N 491.922 5.074 5 20 JKBD CC(C)=CCCC(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cc(Cl)cc([N+](=O)[O-])c2C)CC1 1830734306 CSCLDHGCEYTLNT-QFIPXVFZSA-N 476.017 5.536 5 20 JKBD Cc1cc2cc(C(=O)N3CCCC[C@H]3C3CCN(C(=O)c4cc(F)cc([N+](=O)[O-])c4)CC3)ccc2[nH]1 1831035541 CIRYSXRVKKLDFK-VWLOTQADSA-N 492.551 5.071 5 20 JKBD CC1(C(=O)N2CCC([C@@H]3CCCCN3C(=O)c3cc4cc([N+](=O)[O-])ccc4s3)CC2)CCC1 1831060049 NCYBRPVQTOGZRF-FQEVSTJZSA-N 469.607 5.233 5 20 JKBD C[C@H](CC(=O)N1CCC([C@@H]2CCCCN2C(=O)Cc2cc(F)ccc2[N+](=O)[O-])CC1)c1ccccc1 1832888068 BSMLXWKBMILRQK-NLFFAJNJSA-N 495.595 5.090 5 20 JKBD O=C(c1cc2ccoc2s1)N1CCC([C@@H]2CCCCN2C(=O)Cc2cc(F)ccc2[N+](=O)[O-])CC1 1832890256 VWJFADTYIDBDQZ-FQEVSTJZSA-N 499.564 5.018 5 20 JKBD O=C(c1cc2sccc2s1)N1CC2(CCCN2C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)C1 1845739097 KTJMIKOXBPWFSA-UHFFFAOYSA-N 483.596 5.217 5 20 JKBD O=C(Cc1c[nH]c2ccccc12)O[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1 10632572 PQANZCOGNXSGFX-QHCPKHFHSA-N 463.877 5.195 5 20 JKBD Cc1ccc([N+](=O)[O-])cc1NC(=O)c1ccc(NS(=O)(=O)c2cc(Cl)ccc2Cl)cc1 15411203 MBRDEYRCICGTOK-UHFFFAOYSA-N 480.329 5.263 5 20 JKBD COc1ccc([C@H]2CCCN2C(=O)C2CCN(c3ccc(C(F)(F)F)cc3[N+](=O)[O-])CC2)cc1 15598473 WUAQPZRODWGKEP-HXUWFJFHSA-N 477.483 5.202 5 20 JKBD COCCN(C(=O)c1cccc(OCc2cscn2)c1)c1nc(-c2ccc([N+](=O)[O-])cc2)cs1 16707492 CUSGVUPSMDJNSC-UHFFFAOYSA-N 496.570 5.047 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Cl)[C@H](N[C@H]1CCSc2ccccc21)c1ccccc1 19669692 ZUWWHHIPMZXVGG-SIKLNZKXSA-N 453.951 5.755 5 20 JKBD Cc1cc([N+](=O)[O-])ccc1NC(=O)CCSc1nnc(-c2ccoc2C)n1Cc1ccccc1 26369653 JTVYKNYGRUEFRX-UHFFFAOYSA-N 477.546 5.232 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Br)[C@@H](Nc1ccc(F)c(F)c1)c1ccccc1 26997466 BWBZYJTXHLCTPP-IBGZPJMESA-N 462.250 5.427 5 20 JKBD O=C(NC1(c2ccc(Br)cc2)CCOCC1)c1cc2cc([N+](=O)[O-])ccc2s1 195644287 OXNWMNLNPFATCH-UHFFFAOYSA-N 461.337 5.008 5 20 JKBD Cc1cc(NC(=O)c2cccc(F)c2)sc1C(=O)Nc1cc([N+](=O)[O-])ccc1OC(F)F 303011946 XDSZAJXGKRDLOR-UHFFFAOYSA-N 465.409 5.210 5 20 JKBD COc1ccc(Sc2ccc(NC(=O)c3cc(SC)c(OC)cc3[N+](=O)[O-])cc2)cc1 484289812 KMBAMJXDBZPDNO-UHFFFAOYSA-N 456.545 5.737 5 20 JKBD C[C@@H](c1cccs1)N(C)C(=O)C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1 485632008 YJZZQZACQJKGOF-KXGFGANYSA-N 463.584 6.416 5 20 JKBD Cc1cc(CNC(=O)c2c3c(nc4ccccc24)/C(=C/c2cccc([N+](=O)[O-])c2)CCC3)on1 496613511 VINSKCKLOFRLBR-QGOAFFKASA-N 454.486 5.246 5 20 JKBD C[C@@H](Nc1ccc(C(=O)N2CCC[C@H]2c2nc3ccccc3n2C)cc1[N+](=O)[O-])c1ccccn1 503153290 DKKFYQVBIOZKOT-HXOBKFHXSA-N 470.533 5.027 5 20 JKBD C[C@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)N(C)[C@@H]1CCSc2ccc(Br)cc21 504567169 ZILOENQWSBAVBM-YVEFUNNKSA-N 467.410 5.533 5 20 JKBD C[C@@H](Nc1ccc(C(=O)Nc2ccc(-c3nnc4n3CCCCC4)cc2)cc1[N+](=O)[O-])c1ccccn1 506116474 YKZCJPQDRLPBFJ-GOSISDBHSA-N 497.559 5.400 5 20 JKBD COc1cc(C(=O)Nc2cc(C(C)(C)C)nn2-c2ccc(C)cc2)c([N+](=O)[O-])cc1OC(F)F 514501647 JXOJXNAJNRRSLF-UHFFFAOYSA-N 474.464 5.249 5 20 JKBD O=C(CCc1ncc(-c2ccc(Cl)cc2Cl)o1)Nc1cc([N+](=O)[O-])ccc1OC(F)F 515096591 DFAODJUBUKMBCP-UHFFFAOYSA-N 472.231 5.729 5 20 JKBD COc1ccc([C@@H](CNC(=O)N(C)Cc2ccccc2[N+](=O)[O-])c2c[nH]c3ccccc23)cc1 603745904 ANZRPHRGQWQPBF-JOCHJYFZSA-N 458.518 5.058 5 20 JKBD C[C@@H]1C[C@@H](C)CN(c2ccc(C(=O)N3C[C@@H](C(F)(F)F)C[C@@H](C(F)(F)F)C3)cc2[N+](=O)[O-])C1 604257914 OJJCKNLHPVJZML-XOUADPBQSA-N 481.437 5.280 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Cl)[C@@H](c1ccccc1)N1CCCO[C@@H](c2ccccc2)C1 609233240 BSSMTRRCZVUMMT-DNQXCXABSA-N 465.937 5.392 5 20 JKBD CC(C)(C)OC(=O)Nc1ccc(NC(=O)CSc2ccc(C(F)(F)F)cc2[N+](=O)[O-])cn1 727339289 FYDNHUSHHBEHJO-UHFFFAOYSA-N 472.445 5.086 5 20 JKBD O=C(Nc1ccc(-c2nccs2)cc1)N1CCN(c2ccc([N+](=O)[O-])cc2C(F)(F)F)CC1 727587388 MTCPJFSSRWDOED-UHFFFAOYSA-N 477.468 5.091 5 20 JKBD C[C@@H](Nc1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2N2CCOCC2)cc1Cl)c1ccccc1 728024397 GKMJYKDRCLHIOV-QGZVFWFLSA-N 480.952 5.510 5 20 JKBD CC(C)[C@@H](OC(=O)c1csc(-c2cccc([N+](=O)[O-])c2)n1)C(=O)Nc1ccccc1Cl 747962287 QCVUUAJCSFHRKH-GOSISDBHSA-N 459.911 5.192 5 20 JKBD COC(=O)Nc1ccc(NC(=O)c2ccccc2Sc2ccc(C(F)(F)F)cc2[N+](=O)[O-])cc1 916474700 AHEABFOXUCVDFI-UHFFFAOYSA-N 491.447 6.195 5 20 JKBD CN(C(=O)c1ccc(SCc2ccccc2)cc1)S(=O)(=O)c1ccc(Cl)c([N+](=O)[O-])c1 916993235 HFUQUZWDBXPWQH-UHFFFAOYSA-N 476.963 5.001 5 20 JKBD CN(C(=O)c1ccc(NC(=O)c2ccc(Br)c([N+](=O)[O-])c2)cc1)C1CCCCC1 918176123 NNXPTYDWMFNETO-UHFFFAOYSA-N 460.328 5.014 5 20 JKBD C[C@@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)OCc1coc(-c2ccc(Br)cc2)n1 920777045 DKRVOMPIQKNVON-LLVKDONJSA-N 481.686 5.176 5 20 JKBD C[C@H](OC(=O)c1ccc(NCc2ccccc2Cl)c([N+](=O)[O-])c1)c1nc(-c2cccnc2)no1 922680297 BCISFQYVZILXEU-AWEZNQCLSA-N 479.880 5.223 5 20 JKBD COc1cc(C(=O)NC2(c3ccc(NC(=O)c4cc(C)cnc4Cl)cc3)CCC2)ccc1[N+](=O)[O-] 1787568249 ZNPHSGDJIMRQEV-UHFFFAOYSA-N 494.935 5.022 5 20 JKBD Cc1occ(C(F)(F)F)c1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(Cl)cc([N+](=O)[O-])c1C 1800711023 IDGCTGBYQMELLU-QDMKHBRRSA-N 499.873 5.042 5 20 JKBD Cc1ccc2cc(C(=O)N3[C@H]4CC[C@@H]3C[C@H](NC(=O)Cc3ccc(Cl)cc3[N+](=O)[O-])C4)sc2c1 1801082092 TVZYOVCAMJPLMR-ACDBMABISA-N 498.004 5.266 5 20 JKBD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc2cc([N+](=O)[O-])ccc2s1)c1cc(Cl)ccc1F 1801206486 JWZDTTNRXSABKF-MUJYYYPQSA-N 487.940 5.168 5 20 JKBD O=C(Cc1cccc([N+](=O)[O-])c1)N1CCCC2(CCN(C(=O)c3cc4cccc(F)c4s3)CC2)C1 1804751899 LNKBADLHGLIXOG-UHFFFAOYSA-N 495.576 5.036 5 20 JKBD Cc1cc(Cl)ccc1C(=O)N1CCCC2(CCN(C(=O)c3c(F)ccc([N+](=O)[O-])c3C)CC2)C1 1805091300 FYGDUAOSXHXFER-UHFFFAOYSA-N 487.959 5.163 5 20 JKBD Cc1c(C(=O)N2CC[C@H](CNC(=O)[C@H]3CC[C@H](C)CC3)[C@@H]2c2cccnc2)cc(Cl)cc1[N+](=O)[O-] 1813550401 YVGVLNMNWOHQMA-HKTKNQGOSA-N 499.011 5.098 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cc3ccoc3s2)[nH]n1 1821284507 XBNCJPBPIIDIPV-QGZVFWFLSA-N 497.508 5.193 5 20 JKBD O=C(c1ccc([N+](=O)[O-])o1)N1CCCC[C@@H]1C1CCN(C(=O)C2(c3ccc(Cl)cc3)CCC2)CC1 1823618221 PVEYDYSVHISVGU-OAQYLSRUSA-N 499.995 5.196 5 20 JKBD C[C@H](Sc1ccccc1)C(=O)N1CCCC[C@H]1C1CCN(C(=O)/C=C/c2ccc([N+](=O)[O-])o2)CC1 1824385578 SGOSLSZTZDPRQB-UEGYMVRISA-N 497.617 5.002 5 20 JKBD O=C(c1cc2cc([N+](=O)[O-])ccc2s1)N1CCC([C@@H]2CCCCN2C(=O)CC2CCCC2)CC1 1826262907 NYFVQJFPWSXBBY-QFIPXVFZSA-N 483.634 5.623 5 20 JKBD CC(C)(C)CC(=O)N1CCC([C@@H]2CCCCN2C(=O)C2(c3cccc([N+](=O)[O-])c3)CCC2)CC1 1830293381 ZRUFZUQXJKJXID-QHCPKHFHSA-N 469.626 5.072 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)N1CCCC[C@H]1C1CCN(C(=O)[C@H](C)c2ccccc2)CC1 1830729559 QYXMZJLPESDORU-KOSHJBKYSA-N 481.568 5.079 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)N1CCCC[C@H]1C1CCN(C(=O)[C@@H](C)c2ccccc2)CC1 1830729561 QYXMZJLPESDORU-UUOWRZLLSA-N 481.568 5.079 5 20 JKBD CCCCC[C@H](C)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)CSc2ccccc2[N+](=O)[O-])CC1 1831467770 ABNGOOSCGVQRTP-RBBKRZOGSA-N 489.682 5.523 5 20 JKBD Cc1csc(Sc2ccc(C(=O)Nc3ccc(NC(=O)c4ccco4)cc3)cc2[N+](=O)[O-])n1 11361686 BQMJUKHQSNUAKT-UHFFFAOYSA-N 480.527 5.609 5 20 JKBD Cn1c(SCc2nc(-c3cccc(Br)c3)no2)nc2cc3ccccc3cc2c1=O 19417863 KLPUVLQUBRJMAQ-UHFFFAOYSA-N 479.359 5.192 5 20 JKBD C[C@@H](Sc1nnc(NC2CCCCC2)s1)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 21357808 XTNFXOHIFIUTNM-SNVBAGLBSA-N 475.518 5.329 5 20 JKBD Cc1noc(C)c1CSCC(=O)O[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1 22523666 QWIBEZGPGKXQHD-NRFANRHFSA-N 489.937 5.009 5 20 JKBD Cc1c(NC(=O)[C@H](C)OC(=O)c2cc(C(F)(F)F)cc(C(F)(F)F)c2)cccc1[N+](=O)[O-] 22879368 RMIVZWVLBWTVJT-JTQLQIEISA-N 464.318 5.125 5 20 JKBD COc1cc([N+](=O)[O-])ccc1NC(=O)CSc1ncnc2scc(-c3ccc(C)cc3)c12 24848651 WBVNNTFLHIHIRF-UHFFFAOYSA-N 466.544 5.314 5 20 JKBD Cc1ccc(-n2cnnc2S[C@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2C(F)(F)F)cc1Cl 25027640 DGTRQGHPMWPDLP-LLVKDONJSA-N 485.875 5.275 5 20 JKBD COCCN(CC(C)C)C(=O)C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1 25997370 VGXPGCYLJMBFMX-RGEXLXHISA-N 453.564 5.266 5 20 JKBD CCOc1cc([N+](=O)[O-])c(C(=O)NC[C@H](c2ccccc2)c2c[nH]c3ccccc23)cc1OC 45863798 YYCBVEGMHTWYRG-HXUWFJFHSA-N 459.502 5.045 5 20 JKBD CC1CCN(c2ccc(C(=O)Nc3cc(Cl)ccc3OC[C@@H]3CCCO3)cc2[N+](=O)[O-])CC1 72023641 REINWSUOHQQMCO-IBGZPJMESA-N 473.957 5.295 5 20 JKBD O=C(Cc1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1)N[C@H](c1ccccc1)c1ccncc1 302684177 DFWZQAQJNNNGIR-MUUNZHRXSA-N 489.535 5.291 5 20 JKBD CCCOc1cc(NC(=O)c2c(-c3c(F)cccc3Cl)noc2C)c([N+](=O)[O-])cc1OCCC 302891439 GPIOTMHUVAUQBM-UHFFFAOYSA-N 491.903 6.181 5 20 JKBD Cc1ccc(C(=O)C2CCN(C(=O)c3ccc(N[C@@H](C)c4ccccn4)c([N+](=O)[O-])c3)CC2)cc1 409910666 MKKGSFNAOSJQPT-IBGZPJMESA-N 472.545 5.206 5 20 JKBD C[C@@H]1CCCN(c2ccc(C(=O)Nc3ccccc3NC(=O)C[C@H]3C=CCC3)cc2[N+](=O)[O-])C1 410092980 FXWSKFWVSIAGEI-MOPGFXCFSA-N 462.550 5.378 5 20 JKBD Cc1ccc(NC(=O)[C@H](c2ccccc2)N2CCC(OC3CCCCC3)CC2)c([N+](=O)[O-])c1 497406103 MYHGIXGPZOYGKJ-VWLOTQADSA-N 451.567 5.397 5 20 JKBD CSc1ccc(C(=O)N(C)[C@@H]2CCSc3ccc(Br)cc32)cc1[N+](=O)[O-] 504591231 GDXHFZJBIBLBIS-CQSZACIVSA-N 453.383 5.388 5 20 JKBD CC(C)N(CC(=O)Nc1ccc(Cl)cc1C(F)(F)F)C(=O)c1ccc(NC2CC2)c([N+](=O)[O-])c1 504805204 JGCUVAKWLGGQBC-UHFFFAOYSA-N 498.889 5.331 5 20 JKBD COc1cc(C(=O)Nc2cnc3onc(C)c3c2)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 505914877 FKMXJWWYNLCNEL-UHFFFAOYSA-N 454.826 5.146 5 20 JKBD O=C(NCCc1ccc([N+](=O)[O-])cc1)c1cccnc1SCc1cccc(Br)c1 509316457 XRSWURLZFBRWCK-UHFFFAOYSA-N 472.364 5.017 5 20 JKBD COc1cc(C(=O)Nc2ccc(CN3CCC(C)CC3)cc2)c([N+](=O)[O-])cc1OCc1cscn1 509931311 SLUKRJAXWZAORN-UHFFFAOYSA-N 496.589 5.123 5 20 JKBD CCOc1cc([N+](=O)[O-])c(C(=O)Nc2ccc(Oc3ccccc3OC)c(F)c2)cc1OC 510231120 WILTZQGVSLGUID-UHFFFAOYSA-N 456.426 5.194 5 20 JKBD C[C@H](NC(=O)NCC1(c2ccc(Cl)cc2Cl)CCOCC1)c1cccc([N+](=O)[O-])c1 510513865 JTVZNVJPWKLYNG-AWEZNQCLSA-N 452.338 5.010 5 20 JKBD C[C@@H](Nc1cccc(COCC(F)(F)C(F)F)c1)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl 511029660 PHWZRNZCXNHJBU-LLVKDONJSA-N 463.815 5.104 5 20 JKBD Cc1cc(NC(=O)c2ccc(N[C@H](C)c3ccccn3)c([N+](=O)[O-])c2)ccc1Oc1cccnc1 512133686 WEKVXMGDXVJEDO-GOSISDBHSA-N 469.501 5.911 5 20 JKBD CCOc1cc(CNCc2ccc(F)c(C)c2)ccc1OCc1cc([N+](=O)[O-])cc2c1OCOC2 520211259 DSALCECVYIAOLL-UHFFFAOYSA-N 482.508 5.176 5 20 JKBD COc1ccc([C@H](Nc2ccc(C(=O)Nc3ccc(C)cc3)cc2[N+](=O)[O-])c2nccn2C)cc1 524171095 IBWZCMHQCVQUBP-DEOSSOPVSA-N 471.517 5.099 5 20 JKBD COc1cc(C(=O)NC[C@H]2CC3c4ccccc4C2c2ccccc23)c([N+](=O)[O-])cc1OC(F)F 585704177 NBMLJXPLYKQSKE-UGRPMAQISA-N 480.467 5.232 5 20 JKBD COc1ccc(NC(=O)c2ccc(N3CCC(C)CC3)c([N+](=O)[O-])c2)cc1OCc1cccnc1 603598669 GAGUKFVKLWIHAM-UHFFFAOYSA-N 476.533 5.066 5 20 JKBD Cn1cnnc1Sc1ccc(C(=O)N(Cc2cccs2)c2ccc(F)cc2F)cc1[N+](=O)[O-] 603994519 ZSTHFPYMRYWDFA-UHFFFAOYSA-N 487.513 5.061 5 20 JKBD COc1ccc(-c2nnc(Sc3ccc(C(=O)Nc4ccc(C)cc4)cc3[N+](=O)[O-])n2C)cc1 608972486 OOWOFBXIGFHDAU-UHFFFAOYSA-N 475.530 5.111 5 20 JKBD C[C@@H](NC(=O)C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)c1nnc2ccccn12 610428543 ZTHFKZOWOJRSIG-WDMNMGCXSA-N 484.541 5.055 5 20 JKBD O=C(COC(=O)[C@@H]1C[C@@H]1c1ccc(Cl)cc1Cl)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 730610389 BWEQLFSPNKVHNU-CHWSQXEVSA-N 477.222 5.206 5 20 JKBD COc1ccc(N2C(=S)N[C@@H](c3ccc([N+](=O)[O-])o3)C(C(=O)Nc3cccc(Cl)c3)=C2C)cc1 812721646 ADIXHELCTMFWPJ-NRFANRHFSA-N 498.948 5.198 5 20 JKBD CC(C)N(Cc1nnc(-c2cccc([N+](=O)[O-])c2)o1)C(=O)c1cccc(NC(=O)C2CCCCC2)c1 915135869 YOCBTARIIOBAQQ-UHFFFAOYSA-N 491.548 5.214 5 20 JKBD O=C(Nc1ccc(N2C(=O)c3ccccc3C2=O)c(Cl)c1)c1cc2cc([N+](=O)[O-])ccc2o1 916061648 MRRGJUQIBYBXET-UHFFFAOYSA-N 461.817 5.047 5 20 JKBD CC[C@H](C)N1C(=O)N[C@H](c2ccc([N+](=O)[O-])cc2)C(C(=O)Nc2ccccc2C(F)(F)F)=C1C 916169720 HGVVTFYISMSBQT-RNODOKPDSA-N 476.455 5.391 5 20 JKBD CC(=O)N(c1ccc(Cl)cc1)c1nc(COC(=O)[C@@H](C)Sc2ccc([N+](=O)[O-])cc2)cs1 918875996 VUQZDCCEOGQHGC-CYBMUJFWSA-N 491.978 5.613 5 20 JKBD O=C(Cn1ccc2ccc([N+](=O)[O-])cc21)Nc1ccc(C2(NC(=O)[C@@H]3CCC(F)(F)C3)CCC2)cc1 1786275961 RBRSIXSFVHLBBA-GOSISDBHSA-N 496.514 5.119 5 20 JKBD O=C(CSC1CCCC1)Nc1ccc(C2(NC(=O)c3ccc([N+](=O)[O-])cc3F)CCC2)cc1 1786348224 HOVGBDKJBLDVFT-UHFFFAOYSA-N 471.554 5.157 5 20 JKBD Cc1cc(CCCC(=O)NC2(c3ccc(NC(=O)c4ncoc4C)cc3)CCC2)c([N+](=O)[O-])cc1F 1789889756 UXOKYQHMJNNOLX-UHFFFAOYSA-N 494.523 5.109 5 20 JKBD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)/C=C/c1ccc(F)cc1F)c1cc2cc([N+](=O)[O-])ccc2s1 1793921098 DSVSTUXHANOIHO-POVUVCFGSA-N 497.523 5.053 5 20 JKBD CCC[C@H]1CC[C@H](C(=O)N2CC[C@@H](CNC(=O)c3cc(F)cc([N+](=O)[O-])c3)[C@H]2c2cccnc2)CC1 1811306493 DZYXUDPYDBDKGK-SHNDDRJUSA-N 496.583 5.055 5 20 JKBD Cc1c(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)[C@H](C)Cc3ccco3)[nH]n2)cc(Cl)cc1[N+](=O)[O-] 1821294952 YACUTYJXGRCZOY-VLIAUNLRSA-N 499.955 5.057 5 20 JKBD CCC1(C(=O)N2CCCC[C@H]2c2cc(NC(=O)c3cc4cc([N+](=O)[O-])ccc4s3)n[nH]2)CCC1 1821609678 KGMMRHWUJFTYKJ-SFHVURJKSA-N 481.578 5.419 5 20 JKBD CC1(C)CCC(CC(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3ccc([N+](=O)[O-])o3)CC2)CC1 1830422742 YOIVIAHBAALVEJ-HXUWFJFHSA-N 459.587 5.028 5 20 JKBD Cc1cccc(C(C)C)c1NC(=O)[C@H](C)OC(=O)Cn1c2ccccc2c(=O)c2ccccc21 10722834 PUPUBCOHEOEOKA-IBGZPJMESA-N 456.542 5.157 5 20 JKBD C[C@@H](Sc1nnc(-c2cccs2)n1-c1ccccc1)C(=O)Nc1ccc(F)c([N+](=O)[O-])c1 11209736 NOYYAMBYBHMDHI-CYBMUJFWSA-N 469.523 5.162 5 20 JKBD C[C@@H](Oc1ccc2c(-c3ccc([N+](=O)[O-])cc3)cc(=O)oc2c1)C(=O)Nc1ccccc1C(F)(F)F 15370823 WEKYJYJHIXIUKW-CQSZACIVSA-N 498.413 5.793 5 20 JKBD Cc1ccc(-c2nn(-c3ccccc3)cc2CN(C)C(=S)Nc2ccc([N+](=O)[O-])cc2)cc1C 15662700 RMHHTCBACNOCMW-UHFFFAOYSA-N 471.586 5.893 5 20 JKBD CC(=O)Nc1cccc(Nc2nnc(Sc3ccc(C(=O)c4ccccc4)cc3[N+](=O)[O-])s2)c1 43727599 TWJJFIQCYKZMKH-UHFFFAOYSA-N 491.554 5.531 5 20 JKBD Cc1csc(Sc2ccc(C(=O)Nc3cccc(COCc4ccco4)c3)cc2[N+](=O)[O-])n1 107994617 UFLGGEXKVMZWKS-UHFFFAOYSA-N 481.555 6.073 5 20 JKBD O=C(c1csc([N+](=O)[O-])c1)N(C[C@@H]1CCCO1)c1nc(-c2ccc(Cl)cc2Cl)cs1 117233735 NKIVVWSEXKXVKE-ZDUSSCGKSA-N 484.386 5.912 5 20 JKBD COc1cc([C@@H](C)NC(=O)c2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)ccc1OCc1ccccc1 410057169 IXQXGEKJORRXNS-GOSISDBHSA-N 486.528 5.074 5 20 JKBD O=C(C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)NCC(=O)Nc1cccc(F)c1 497000893 KTJWDEJCRXAQIE-SFQUDFHCSA-N 490.516 5.029 5 20 JKBD COc1cc(C(=O)Nc2cccc(COC3CCCCC3)c2)c([N+](=O)[O-])cc1OC(F)F 502307259 SWFMWSQGAIGBSX-UHFFFAOYSA-N 450.438 5.306 5 20 JKBD CCCN(C(=O)CSc1ccc(C(N)=O)cc1[N+](=O)[O-])[C@@H](C)c1ccc(Cl)c(Cl)c1 502821594 HEZLBKLUMPGUDP-LBPRGKRZSA-N 470.378 5.092 5 20 JKBD O=C(Nc1ccc(Oc2ccncc2)c(Cl)c1)C1CCN(c2ccccc2[N+](=O)[O-])CC1 505743474 IAIZFDQFITYSCF-UHFFFAOYSA-N 452.898 5.291 5 20 JKBD O=[N+]([O-])c1cc(CNCc2ccnc(OCC(F)(F)F)c2)ccc1Oc1ccccc1Cl 509603485 VXPKUTQDNPLKFV-UHFFFAOYSA-N 467.831 5.666 5 20 JKBD CCCN(C(=O)c1ccc(N[C@@H](C)c2ccccn2)c([N+](=O)[O-])c1)[C@@H]1CCc2ccccc2C1 509996278 FSADZWHWGZKNCH-WMZHIEFXSA-N 458.562 5.573 5 20 JKBD C[C@H]1C[C@H](C)CN(c2ccc(C(=O)Nc3ccc(NC(=O)NCc4ccco4)cc3)cc2[N+](=O)[O-])C1 515545483 YBENLLMELPJWDC-ROUUACIJSA-N 491.548 5.244 5 20 JKBD COc1cc2nc(NC(=O)c3ccc(N[C@@H](C)c4ccccn4)c([N+](=O)[O-])c3)sc2cc1OC 516169898 ODLJPZHFQUYTKP-ZDUSSCGKSA-N 479.518 5.042 5 20 JKBD Cn1cnnc1Sc1ccc(C(=O)N[C@@H](c2ccc(Cl)cc2)C2CCCC2)cc1[N+](=O)[O-] 517858897 GUQQQOBIVVAPIS-HXUWFJFHSA-N 471.970 5.189 5 20 JKBD O=C(Nc1cccc(CNCc2cn(-c3ccccc3)nc2-c2ccc([N+](=O)[O-])cc2)c1)C1CCCC1 518759740 FXMYXMAZYBMMDC-UHFFFAOYSA-N 495.583 5.866 5 20 JKBD C[C@@H]1CCCN(c2ccc(C(=O)Nc3ccc(NC(=O)c4cccs4)cc3)cc2[N+](=O)[O-])C1 523334364 DDGIDOFGTGYEDA-MRXNPFEDSA-N 464.547 5.397 5 20 JKBD COc1cccc(-c2cc(NC(=O)c3cc(SC)ccc3[N+](=O)[O-])n(-c3ccccc3)n2)c1 603760657 PVRLFINLVSLMFL-UHFFFAOYSA-N 460.515 5.430 5 20 JKBD Cc1c(-c2ccccc2)sc(NC(=O)c2cc3c(cc2[N+](=O)[O-])OCO3)c1C(=O)N1CCCCC1 603941721 WKOGHULVVHABCL-UHFFFAOYSA-N 493.541 5.239 5 20 JKBD COc1cc(NC(=O)c2cc3ccccc3c3cccnc23)c(OC)cc1NC(=O)c1ccccc1 642518018 IYZJBEYJXLFQSF-UHFFFAOYSA-N 477.520 5.910 5 20 JKBD Cc1ccc(NC(=O)[C@@H](OC(=O)Cc2csc(C(C)(C)C)n2)c2ccccc2)c([N+](=O)[O-])c1 726835624 ZABWLTIZVVEULZ-NRFANRHFSA-N 467.547 5.123 5 20 JKBD C[C@H](Nc1ccc(C(=O)Oc2ccccc2OCC(F)(F)F)cc1[N+](=O)[O-])c1ccccn1 727641564 GVTBWWAQLDRAKJ-AWEZNQCLSA-N 461.396 5.323 5 20 JKBD C[C@@H](OC(=O)C[C@H](c1ccccc1)C(F)(F)F)C(=O)Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1 728655018 TXPVOLWFQJWZJN-CXAGYDPISA-N 493.463 5.325 5 20 JKBD COc1ccc([C@@H](OC(=O)c2csc(-c3cccc([N+](=O)[O-])c3)n2)[C@H](C)n2cccn2)cc1 729803347 NHTMGZMDIACYCK-BTYIYWSLSA-N 464.503 5.083 5 20 JKBD C[C@H]([C@H]1C[C@H]2CC[C@H]1C2)n1c(SCC(=O)Nc2cc([N+](=O)[O-])ccc2F)nnc1-c1ccco1 848592764 MNPUJMWHJFCNBM-WBTNSWJXSA-N 485.541 5.313 5 20 JKBD CC(C)(C)c1cc[n+](/C(C(=S)Nc2ccc(Cl)cc2)=C(/O)c2cccc([N+](=O)[O-])c2)cc1 916204552 ZBSLGRSULMWFQD-UHFFFAOYSA-O 468.986 6.157 5 20 JKBD COc1ccccc1-c1cc(C(=O)Oc2ccc3c(-c4ccc([N+](=O)[O-])cc4)cc(=O)oc3c2)no1 916970658 FDCVLALEZYFIDQ-UHFFFAOYSA-N 484.420 5.251 5 20 JKBD CCN(CC)CCN(Cc1ccc(Cl)c(Cl)c1)C(=S)Nc1ccc([N+](=O)[O-])cc1 920997285 RTAUAHXOSDURSJ-UHFFFAOYSA-N 455.411 5.442 5 20 JKBD COc1ccc(/C=C\C(=O)Oc2ccc(NC(=O)c3cc([N+](=O)[O-])ccc3Cl)cc2)cc1OC 923484556 MDHLSNCNTLBOCS-QCDXTXTGSA-N 482.876 5.137 5 20 JKBD Cc1ncccc1C(=O)Nc1ccc(C2(NC(=O)C3(c4cccc([N+](=O)[O-])c4)CCC3)CCC2)cc1 1787320369 IAEHJHMQNZBXNT-UHFFFAOYSA-N 484.556 5.168 5 20 JKBD COc1ccc(CC(=O)NC2(c3ccc(NC(=O)c4ccc5cc[nH]c5c4)cc3)CCC2)c([N+](=O)[O-])c1 1788914044 WQEBNYWWMSOFDL-UHFFFAOYSA-N 498.539 5.075 5 20 JKBD C[C@H](Sc1cccs1)C(=O)Nc1ccc(C2(NC(=O)c3ccc(O)c([N+](=O)[O-])c3)CCC2)cc1 1789416441 NMFWVCXKNBCFMZ-HNNXBMFYSA-N 497.598 5.290 5 20 JKBD O=C(Cc1cccc([N+](=O)[O-])c1)NC1(c2ccc(NC(=O)[C@H]3[C@H]4c5ccccc5S[C@H]43)cc2)CCC1 1789527656 AIXZUHBREBYNOM-UODIDJSMSA-N 499.592 5.159 5 20 JKBD C[C@H](Sc1ccccn1)C(=O)Nc1ccc(C2(NC(=O)c3cc(F)cc([N+](=O)[O-])c3)CCC2)cc1 1791834735 HCJPKILHOPASQJ-INIZCTEOSA-N 494.548 5.057 5 20 JKBD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CCCc1ccccc1F)c1cc2cc([N+](=O)[O-])ccc2s1 1793089679 UJCONQVWJFETAC-ACDBMABISA-N 495.576 5.223 5 20 JKBD Cc1ccc(SCC(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)cc1 1801207258 ZSFXVNSHQFTJPW-REPLKXPHSA-N 495.626 5.162 5 20 JKBD O=C(Nc1cc([C@H]2CCCCN2C(=O)c2ccc(-c3ccccc3)cc2)[nH]n1)c1ccc([N+](=O)[O-])o1 1814313772 YBKXEYAYYKFBIZ-OAQYLSRUSA-N 485.500 5.198 5 20 JKBD C[C@@H](CC(=O)N1CCC([C@@H]2CCCCN2C(=O)/C=C/c2ccc([N+](=O)[O-])o2)CC1)c1ccccc1 1824278469 JDMOMVCNXZVSIX-IQVDQNKCSA-N 479.577 5.015 5 20 JKBD O=C(Cc1ccc(Cl)cc1[N+](=O)[O-])N1CCC([C@@H]2CCCCN2C(=O)/C=C/c2ccccc2)CC1 1826527803 WMKIYIORPFBMQD-LUFJGRFYSA-N 496.007 5.124 5 20 JKBD C/C(=C\c1cccs1)C(=O)N1CCC([C@@H]2CCCCN2C(=O)Cc2ccc(C)c([N+](=O)[O-])c2)CC1 1830361682 GAJRIFNQHDMNRG-YEZCMDQSSA-N 495.645 5.230 5 20 JKBD CCn1c(S[C@@H](C)C(=O)Nc2cc([N+](=O)[O-])ccc2Cl)nnc1-c1cccc(Cl)c1 9822075 XRWNICZSJWROLF-NSHDSACASA-N 466.350 5.299 5 20 JKBD CCNC(=O)c1cccc(NC(=O)c2cc([N+](=O)[O-])ccc2Sc2ccc(Cl)cc2)c1 15023000 UGPPHHGEULWOEA-UHFFFAOYSA-N 455.923 5.401 5 20 JKBD O=C1c2ccccc2N[C@H](c2ccc(-c3ccc([N+](=O)[O-])cc3Cl)o2)N1C[C@@H]1CCCO1 15503653 MAFQAWYREHJBLF-NYHFZMIOSA-N 453.882 5.254 5 20 JKBD O=C(CCc1nc(-c2ccc(Cl)cc2)no1)Oc1ccc(NC(=O)c2cccc([N+](=O)[O-])c2)cc1 15603655 JEMSYLNEKOTADP-UHFFFAOYSA-N 492.875 5.089 5 20 JKBD COc1ccccc1/C=C(/C(=O)O[C@H](C)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)c1ccccc1 17540980 DLWHZJKQUSARCD-FIOICXDGSA-N 471.469 5.498 5 20 JKBD CCc1cccc(CC)c1NC(=S)N(Cc1nnc(-c2cccc([N+](=O)[O-])c2)o1)C(C)C 18142963 LEXMEWSQJZTKGK-UHFFFAOYSA-N 453.568 5.377 5 20 JKBD Cc1cccc(Nc2nnc(S[C@H](C)C(=O)Nc3ccc([N+](=O)[O-])cc3C(F)(F)F)s2)c1 21355905 VPSPZGNELMAYIE-LLVKDONJSA-N 483.497 5.636 5 20 JKBD CC(C)n1c(S[C@@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)nc2cc(Cl)ccc2c1=O 21463478 YKGLJQZFBBLCHL-NSHDSACASA-N 481.361 5.312 5 20 JKBD CC(C)n1c(SCc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)nnc1-c1ccc(Cl)cc1Cl 25763191 FMVJVEJJQLIIEB-UHFFFAOYSA-N 491.360 6.083 5 20 JKBD CC(C)CCSc1ccc(C(=O)Nc2ccc(NC(=O)NC[C@@H]3CCCO3)cc2)cc1[N+](=O)[O-] 27853322 VJRICNRQQNSXSZ-FQEVSTJZSA-N 486.594 5.286 5 20 JKBD C[C@@H](Nc1ccc(C(=O)N2CCN(Cc3cccc4ccccc34)CC2)cc1[N+](=O)[O-])c1ccccn1 108790495 GWLSEVHPJXNTRJ-OAQYLSRUSA-N 495.583 5.274 5 20 JKBD CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)CCc1ncc(-c2ccccc2Br)o1 195630501 VUDKLMPSYLGZOE-UHFFFAOYSA-N 472.339 5.382 5 20 JKBD O=C(Nc1cccc(N2C(=O)c3ccccc3C2=O)c1)c1cc([N+](=O)[O-])ccc1Sc1ccccc1 485695783 QUTQNZQTAGIOHK-UHFFFAOYSA-N 495.516 5.799 5 20 JKBD O=C(Nc1cccc(NC(=O)c2cccs2)c1)c1csc(-c2cccc([N+](=O)[O-])c2)n1 496356076 FOHYMSUQXOEAJJ-UHFFFAOYSA-N 450.501 5.284 5 20 JKBD O=C(Nc1cccc(F)c1)c1cccc(NC(=O)c2csc(-c3ccc([N+](=O)[O-])cc3)n2)c1 496611458 LNYQEVWGMRRNNF-UHFFFAOYSA-N 462.462 5.362 5 20 JKBD Cc1cc([N+](=O)[O-])ccc1C(=O)N[C@H](c1ccccc1)c1ccc2nc(C(F)(F)F)[nH]c2c1 508804433 TWZZMYFKORUXQK-HXUWFJFHSA-N 454.408 5.318 5 20 JKBD Cc1ccc(Sc2ccc(C(=O)N(CC(F)(F)F)c3nc(C)cs3)cc2[N+](=O)[O-])cc1 512639699 ZRFOMRATNSMBAQ-UHFFFAOYSA-N 467.494 6.028 5 20 JKBD C[C@H](Nc1ccc(C(=O)Nc2n[nH]c(-c3cccc4ccccc34)n2)cc1[N+](=O)[O-])c1ccccn1 513728349 HGFJSLCQJUEYMY-INIZCTEOSA-N 479.500 5.354 5 20 JKBD Cn1c(C(=O)N(C[C@H]2CCCO2)c2nc(-c3ccc(Cl)cc3Cl)cs2)ccc1[N+](=O)[O-] 514708809 DDBDLEBCYGFHOH-CYBMUJFWSA-N 481.361 5.189 5 20 JKBD Cc1ccc(-c2csc3ncnc(SCC(=O)N(C)Cc4ccccc4[N+](=O)[O-])c23)cc1 514902172 OJTJMGHJOIVKLJ-UHFFFAOYSA-N 464.572 5.326 5 20 JKBD Cc1cccc(Oc2ccc(Cl)cc2NC(=O)c2cc([N+](=O)[O-])cc(S(C)(=O)=O)c2)c1 516757644 CEDMHNGYMQINMM-UHFFFAOYSA-N 460.895 5.005 5 20 JKBD CN1C(=O)CCc2cc(NC(=O)c3ccc(NCc4ccccc4Cl)c([N+](=O)[O-])c3)ccc21 517080424 MQLBMUFOFQKTOE-UHFFFAOYSA-N 464.909 5.022 5 20 JKBD O=[N+]([O-])c1ccc(-c2ccc(CN[C@@H](c3ccc4c(c3)OCCO4)C3CC3)o2)c(Br)c1 517534548 ZCJXUBLFFVIAGA-HSZRJFAPSA-N 485.334 5.629 5 20 JKBD COc1ccc([C@H](NCc2cn(-c3ccccc3)nc2-c2ccc([N+](=O)[O-])cc2)c2nccn2C)cc1 517541088 QRPSZICDEAWJEE-MHZLTWQESA-N 494.555 5.069 5 20 JKBD CCOc1cc(NC(=O)N(C)[C@@H](C)c2ccc(C(F)(F)F)cc2)c([N+](=O)[O-])cc1OCC 519906170 LWZIRMUJVWXBIU-ZDUSSCGKSA-N 455.433 5.636 5 20 JKBD Cc1cc(=O)nc(-c2ccc(NC(=O)c3ccc(SCCC(C)C)c([N+](=O)[O-])c3)cc2)[nH]1 523415451 BFLYVHIGIYQPPW-UHFFFAOYSA-N 452.536 5.044 5 20 JKBD Cc1ccc(NC(=O)NC[C@H]2CCCN(C(=O)c3ccc(Nc4ccccc4)c([N+](=O)[O-])c3)C2)cc1 524273313 JKSVWKKLUUPZRQ-HXUWFJFHSA-N 487.560 5.321 5 20 JKBD Cc1ccc(C(=O)N2CCSCC2)cc1NC(=O)c1cc([N+](=O)[O-])ccc1Oc1ccccc1 550859707 QFTFAOIIZWAUGJ-UHFFFAOYSA-N 477.542 5.137 5 20 JKBD O=C(N[C@@H]1CCCc2nc(O)ccc21)c1cc([N+](=O)[O-])ccc1Sc1ccc(Cl)cc1 603209871 CHKDVCSHXISSHP-LJQANCHMSA-N 455.923 5.307 5 20 JKBD Cc1sc(C(=O)Nc2cc(OCC(F)(F)F)cc(OCC(F)(F)F)c2)cc1[N+](=O)[O-] 604137857 VOMPSSUGJSPMKU-UHFFFAOYSA-N 458.336 5.099 5 20 JKBD Cn1nc(C(F)(F)F)c(-c2ccc(Cl)cc2)c1NC(=O)c1ccn(-c2cccc([N+](=O)[O-])c2)n1 609026627 UCTUJTGEDXXRQG-UHFFFAOYSA-N 490.829 5.106 5 20 JKBD O=C(C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)Nc1cc(F)c(F)cc1F 609182663 OTAZWMDQSKJFMS-NTEUORMPSA-N 469.444 6.191 5 20 JKBD COc1cc(CSc2nnc(C3CC3)n2Cc2ccccc2)c([N+](=O)[O-])cc1OC(F)F 619252852 PQYBARIMFKUNCY-UHFFFAOYSA-N 462.478 5.014 5 20 JKBD O=C(Cn1c2ccccc2c(=O)c2ccccc21)N1CCCc2cc(Br)cc(F)c21 624544667 SWTAGHLIGVCYHM-UHFFFAOYSA-N 465.322 5.036 5 20 JKBD COc1ccccc1[C@@H](NCc1ccc(Oc2ccccc2Cl)c([N+](=O)[O-])c1)c1nccn1C 725845350 YUHXRODRJINWLW-XMMPIXPASA-N 478.936 5.662 5 20 JKBD CCc1cccc[n+]1/C(C(=S)Nc1ccc(OC)c(Cl)c1)=C(/O)c1ccc([N+](=O)[O-])cc1 726961811 LEXSLOBXBOMWBT-UHFFFAOYSA-O 470.958 5.430 5 20 JKBD Cc1ccsc1C(=O)Nc1ccc(OC(=O)c2cc(OCC(F)(F)F)ccc2[N+](=O)[O-])cc1 729217090 UNSSRFFVPWIERU-UHFFFAOYSA-N 480.420 5.377 5 20 JKBD COc1cc(C(=O)O[C@H](C)c2cccc(NC(=O)Cc3ccc(C)cc3)c2)c([N+](=O)[O-])cc1OC 731299599 DEUXNFOVPCELIH-QGZVFWFLSA-N 478.501 5.020 5 20 JKBD O=C1/C(=C\c2ccc(-c3ccc([N+](=O)[O-])cc3Br)o2)NC(=S)N1C1CCCCC1 747187726 OKMVVNGAWRUFJO-GZTJUZNOSA-N 476.352 5.008 5 20 JKBD C[C@H](OC(=O)c1csc(-c2ccc([N+](=O)[O-])cc2)n1)C(=O)N[C@H](C)c1ccc2ccccc2c1 747956537 HJBDMCGGVOUTKW-CVEARBPZSA-N 475.526 5.294 5 20 JKBD O=C(Nc1ccc(-c2ccccc2)cc1F)c1ccc([N+](=O)[O-])cc1I 751080024 RWFOHPUZMADBRX-UHFFFAOYSA-N 462.218 5.258 5 20 JKBD Cc1ccc(OCc2nc(COC(=O)c3ccc(Br)c([N+](=O)[O-])c3)cs2)cc1 811521022 XGJTYLZNSDESRA-UHFFFAOYSA-N 463.309 5.058 5 20 JKBD Cc1csc(Sc2ccc(-c3nc([C@H]4CCC(=O)N(CC5CCCC5)C4)no3)cc2[N+](=O)[O-])n1 856581461 GBZJHMMGRDXYPW-KRWDZBQOSA-N 499.618 5.457 5 20 JKBD CCOc1ccc(-c2nc(C)c(C(=O)O[C@H](C)C(=O)Nc3ccc([N+](=O)[O-])cc3Cl)s2)cc1 914909885 RIRRRFDSLVJSBO-CYBMUJFWSA-N 489.937 5.263 5 20 JKBD Cc1ccc(N2C(=O)/C(=C/c3ccc4c(c3)OCO4)N=C2SCc2csc([N+](=O)[O-])c2)cc1 917416511 YJULEQANNREPQO-LSCVHKIXSA-N 479.539 5.371 5 20 JKBD C[C@H](SCc1nc(O)c2c(-c3ccccc3)csc2n1)C(=O)OCc1cc(F)ccc1[N+](=O)[O-] 918899191 DUXVYUJLEQXTJW-ZDUSSCGKSA-N 499.545 5.476 5 20 JKBD CCN(Cc1ccc(-c2ccc(C(F)(F)F)cc2)o1)C(=O)C(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1 920197581 GAXHHPCJIWBHDQ-UHFFFAOYSA-N 495.841 5.514 5 20 JKBD O=C(/C=C\c1cnc2ccccc2n1)Oc1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2Cl)cc1 923386238 LQQWMWUZFNWHLS-GHXNOFRVSA-N 474.860 5.063 5 20 JKBD O=C(/C=C/c1ccc(O)cc1Cl)NC1(c2ccc(NC(=O)c3ccc([N+](=O)[O-])o3)cc2)CCC1 1785752064 VXNYMWPQBPAHIB-XCVCLJGOSA-N 481.892 5.008 5 20 JKBD O=C(/C=C/c1ccc([N+](=O)[O-])o1)Nc1ccc(C2(NC(=O)c3cc4ccoc4s3)CCC2)cc1 1786204388 BXMMBOAFXGVMFW-SOFGYWHQSA-N 477.498 5.457 5 20 JKBD O=C(NC1(c2ccc(NC(=O)c3cccc(F)c3[N+](=O)[O-])cc2)CCC1)c1cc2sccc2[nH]1 1790701000 INZXFAZMCOYANU-UHFFFAOYSA-N 478.505 5.338 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cccc(Cl)c2)n[nH]1 1820501211 AGKSDVGDEJCTCS-IBGZPJMESA-N 485.903 5.039 5 20 JKBD Cc1ccc(-c2ccccc2C(=O)Nc2cc([C@H]3CCCCN3C(=O)c3ccc([N+](=O)[O-])o3)[nH]n2)cc1 1821222793 AMAAWSIESKWCLH-JOCHJYFZSA-N 499.527 5.506 5 20 JKBD Cc1c(Cl)cccc1C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cccc(F)c2[N+](=O)[O-])CC1 1823915613 FXMKIWRJXUGWMN-JOCHJYFZSA-N 487.959 5.243 5 20 JKBD C[C@@H](CC(=O)N1CCC([C@H]2CCCCN2C(=O)/C=C/c2ccccc2[N+](=O)[O-])CC1)c1ccccc1 1832903485 DWFROWPOCNTNBH-WFDXBIBDSA-N 489.616 5.422 5 20 JKBD CCOc1ccccc1NC(=O)[C@H](OC(=O)c1cc([N+](=O)[O-])ccc1Cl)c1ccccc1 3513877 SLWVCEVQSRGCOK-OAQYLSRUSA-N 454.866 5.184 5 20 JKBD C[C@H](OC(=O)Cc1ccc(Cl)c(Cl)c1)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 11121262 XATRACKDIYLYDW-VIFPVBQESA-N 465.211 5.033 5 20 JKBD C[C@@H](OC(=O)c1cc(Cl)ccc1[N+](=O)[O-])C(=O)Nc1ccc(Cl)cc1C(F)(F)F 15798252 ZWWSSNORGBPPOW-MRVPVSSYSA-N 451.184 5.104 5 20 JKBD COc1ccc(NC(=O)[C@@H](C)Sc2nn(-c3ccc(Cl)cc3)c(=S)s2)c([N+](=O)[O-])c1 16766530 KTGVFYZPWNLJGS-SNVBAGLBSA-N 482.996 5.353 5 20 JKBD Cc1cccn2c(NC(=O)C3CCN(c4ccccc4[N+](=O)[O-])CC3)c(-c3ccccc3)nc12 21832285 RCHZFIRRDFJTFG-UHFFFAOYSA-N 455.518 5.073 5 20 JKBD Cc1cc(C)c(NC(=O)[C@H](C)OC(=O)c2ccc(NCc3ccccc3)c([N+](=O)[O-])c2)c(C)c1 23934836 QNUAPEHUQHODOB-IBGZPJMESA-N 461.518 5.316 5 20 JKBD CN(C)c1ccc2c(-c3cc(C(=O)O)ccc3C(=O)O)c3ccc4cc(=O)ccc4c3oc2c1 26742288 BZKKKCMJNZKKST-UHFFFAOYSA-N 453.450 5.229 5 20 JKBD CCOc1cc([N+](=O)[O-])c(C(=O)O[C@@H](C)C(=O)N2c3ccccc3Sc3ccccc32)cc1OC 27402004 VKYYBMCOJPVIEJ-HNNXBMFYSA-N 494.525 5.377 5 20 JKBD Cc1c(CSc2nnc(-c3nn(Cc4ccccc4)c(=O)c4ccccc34)o2)cccc1[N+](=O)[O-] 69640346 LYHJPBORSGTYIK-UHFFFAOYSA-N 485.525 5.004 5 20 JKBD C[C@H](Nc1ccc(C(=O)N2CCC(c3cc4ccccc4[nH]3)CC2)cc1[N+](=O)[O-])c1ccccn1 109348353 OJPSBSCLMGBWIN-SFHVURJKSA-N 469.545 5.664 5 20 JKBD CN(C[C@@H]1CCCCO1)C(=O)C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1 491922216 TYMSFDAQTLMOCW-BXWQOUMASA-N 451.548 5.163 5 20 JKBD O=C(C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)N(CCO)Cc1ccccc1 501922822 YHMOFGHYXMPTPT-PGMHBOJBSA-N 473.554 5.156 5 20 JKBD O=C(Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1)c1csc(-c2cnn(-c3ccccc3)c2)n1 503279285 YGFWVNQFMOYHCX-UHFFFAOYSA-N 474.527 5.280 5 20 JKBD Cc1c(NC(=O)[C@H](C)Nc2ccc3c(c2)CCC(=O)N3Cc2ccc(Cl)cc2)cccc1[N+](=O)[O-] 520124996 VFJASFBTEJDBTO-KRWDZBQOSA-N 492.963 5.475 5 20 JKBD C[C@H](CNC(=O)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-])c1c(Cl)cccc1Cl 522396736 QXRGWLROPUTVIP-SNVBAGLBSA-N 451.228 5.376 5 20 JKBD Cc1cccc(OC(F)F)c1NC(=O)Cc1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1 523279844 QLTPNLRHJLOETD-UHFFFAOYSA-N 478.455 5.539 5 20 JKBD CN(C)[C@H](CNC(=O)c1ccccc1Sc1ccc(C(F)(F)F)cc1[N+](=O)[O-])c1cccs1 600839360 UJJAAVYRTGTMHL-QGZVFWFLSA-N 495.548 5.859 5 20 JKBD CC(C)COC[C@@H](NCc1ccc(-c2ccc([N+](=O)[O-])cc2Br)o1)c1ccco1 608837281 YJAMZTXEXTWAHP-LJQANCHMSA-N 463.328 5.714 5 20 JKBD COc1ccc(C(=O)C2CCN(c3ccc(C(=O)Nc4ccc(C)cc4)cc3[N+](=O)[O-])CC2)cc1 608972477 NVPCSZKESUSADM-UHFFFAOYSA-N 473.529 5.263 5 20 JKBD O=C(Cn1c2ccccc2c(=O)c2ccccc21)N1CCC[C@@H]1c1cccc(Br)c1 614973583 WZDCEXAKOAFRPF-OAQYLSRUSA-N 461.359 5.281 5 20 JKBD O=C(Oc1ccc(-c2noc(-c3cccnc3)n2)cc1)c1csc(-c2cccc([N+](=O)[O-])c2)n1 729797500 FPJUXEPXJXAAQH-UHFFFAOYSA-N 471.454 5.050 5 20 JKBD Cc1nc(-c2ccc(CCNC(=O)c3cc([N+](=O)[O-])ccc3N3CCCCC3)s2)cs1 783675706 JROAJPNQJSOYHI-UHFFFAOYSA-N 456.593 5.051 5 20 JKBD CCc1nnc(COC(=O)c2c3c(nc4ccccc24)/C(=C\c2cccc([N+](=O)[O-])c2)CCC3)o1 808706420 JQWQMSGHSQGFMA-LGMDPLHJSA-N 470.485 5.322 5 20 JKBD CC1=C(C(=O)Nc2ccccc2C(F)(F)F)[C@H](c2ccc(Cl)c([N+](=O)[O-])c2)NC(=O)N1C1CC1 916170615 SUJIKWJIDBHCCW-IBGZPJMESA-N 494.857 5.408 5 20 JKBD C[C@H](OC(=O)[C@@H]1CCCN(C(=O)c2ccc(Cl)c(Cl)c2)C1)c1ccccc1[N+](=O)[O-] 920267500 KALYMGKHXCEIMD-DZGCQCFKSA-N 451.306 5.058 5 20 JKBD C[C@H](NC(=O)c1cccc(Cl)c1Cl)C(=O)Oc1ccc(-c2ccccc2)cc1[N+](=O)[O-] 920329638 MNSSQGPMJJCCFX-ZDUSSCGKSA-N 459.285 5.293 5 20 JKBD CC(C)CCSc1ccc(C(=O)N[C@@H](C)c2ccc(N3CCOC3=O)cc2)cc1[N+](=O)[O-] 920955592 WHQWTZHIPDVWEP-INIZCTEOSA-N 457.552 5.181 5 20 JKBD CC1=CC[C@H](C(=O)Nc2ccc(C3(NC(=O)CSc4ccccc4[N+](=O)[O-])CCC3)cc2)CC1 1789113562 AYNUYURASVGJGE-IBGZPJMESA-N 479.602 5.567 5 20 JKBD O=C(NC1(c2ccc(NC(=O)c3ccc([N+](=O)[O-])cc3F)cc2)CCC1)c1cc2ccccc2o1 1790622179 LDZLUHQXHYIMNQ-UHFFFAOYSA-N 473.460 5.542 5 20 JKBD O=C(NC1(c2ccc(NC(=O)[C@H]3[C@H]4SC=C[C@H]43)cc2)CCC1)c1cc2cc([N+](=O)[O-])ccc2s1 1791093682 QFWUBXPEGRRQOM-BWAGFHJFSA-N 491.594 5.432 5 20 JKBD O=C(CSc1ccccc1[N+](=O)[O-])N1CCC([C@H]2CCCCN2C(=O)/C=C/C2CCCC2)CC1 1830351937 PLTAQVIROAPFKL-CHHLAKQQSA-N 485.650 5.053 5 20 JKBD Cc1cc2cccc(C(=O)N3CCC([C@@H]4CCCCN4C(=O)c4ccc([N+](=O)[O-])cc4F)CC3)c2[nH]1 1830496132 HXONGYOADDYWFH-DEOSSOPVSA-N 492.551 5.071 5 20 JKBD Cc1cc2cc(C(=O)N3CCC([C@@H]4CCCCN4C(=O)c4cccc(F)c4[N+](=O)[O-])CC3)ccc2[nH]1 1830621997 XPKGMEWIFUWHDW-DEOSSOPVSA-N 492.551 5.071 5 20 JKBD CC(=O)N(c1nc(COC(=O)c2ccc(N3CCCC3)c([N+](=O)[O-])c2)cs1)c1ccc(C)cc1C 10733624 YDINMUBTMXBOGS-UHFFFAOYSA-N 494.573 5.310 5 20 JKBD COc1ccc([N+](=O)[O-])cc1NC(=O)c1cc2c(C)nn(Cc3ccc(Cl)cc3)c2s1 14877017 PTGZOFXQUPBGTR-UHFFFAOYSA-N 456.911 5.277 5 20 JKBD CC(=O)N(c1nc(/C=C/c2ccc3cccc([N+](=O)[O-])c3n2)cs1)c1ccc(F)cc1F 15188813 PARAXSQEJIHUPG-CMDGGOBGSA-N 452.442 5.733 5 20 JKBD Cc1ccccc1-n1c(S[C@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)nnc1-c1ccncc1 17660942 PMTAFAGAZBOZSC-MRXNPFEDSA-N 485.529 5.449 5 20 JKBD Cc1cccc(C)c1NC(=O)CNC(=O)c1cc([N+](=O)[O-])ccc1Sc1ccc(Cl)cc1 17854431 YBWCESFKZLZGBL-UHFFFAOYSA-N 469.950 5.385 5 20 JKBD O=C(COC(=O)c1csc(-c2cccc(Cl)c2)n1)Nc1ccc(C(F)(F)F)cc1[N+](=O)[O-] 17980639 MECLLULNRYGSMR-UHFFFAOYSA-N 485.827 5.186 5 20 JKBD COc1ccc([N+](=O)[O-])cc1NC(=O)[C@@H]1CCC(=O)N(c2ccc(C)cc2)[C@@H]1c1cccs1 104798098 LZABILXCIFJYCL-JPYJTQIMSA-N 465.531 5.096 5 20 JKBD Cc1nc(-c2ccc(CCNC(=O)c3ccc(N[C@@H](C)c4ccccn4)c([N+](=O)[O-])c3)cc2)cs1 108785997 OLBALXBWKWMLFY-KRWDZBQOSA-N 487.585 5.567 5 20 JKBD CC(C)n1ncc2c(C(=O)Nc3ccc([N+](=O)[O-])cc3C(=O)c3ccccc3)cc(C3CC3)nc21 478137545 ZOJUZQOVHBHFRE-UHFFFAOYSA-N 469.501 5.281 5 20 JKBD O=C(NCc1nccs1)c1c2c(nc3ccccc13)/C(=C\c1cccc([N+](=O)[O-])c1)CCC2 483639464 BTVXMNCOWVYGOC-LGMDPLHJSA-N 456.527 5.406 5 20 JKBD CC(C)CC(=O)N1CCC(NC(=O)c2cc([N+](=O)[O-])ccc2Sc2ccc(Cl)cc2)CC1 497523865 KPOPFTARZUYNEK-UHFFFAOYSA-N 475.998 5.166 5 20 JKBD O=C(CSc1ccc(C(F)(F)F)cc1[N+](=O)[O-])Nc1ccc(F)cc1Br 500042886 XHUKICDRLNKUAN-UHFFFAOYSA-N 453.211 5.246 5 20 JKBD COc1cc(C(=O)N[C@@H](C)c2ccc(Oc3ccccc3)cc2)c([N+](=O)[O-])cc1OC(F)F 506268067 DIJSIJMOBXHYDK-AWEZNQCLSA-N 458.417 5.488 5 20 JKBD CC(C)Oc1ccc([N+](=O)[O-])cc1CSc1nnc([C@H](C)N(C)C)n1-c1ccc(F)cc1 511046118 VEWKIJOMSAUJSY-HNNXBMFYSA-N 459.547 5.017 5 20 JKBD O=C(Nc1sc2c(c1-c1nc3ccccc3[nH]1)CCCC2)c1ccc(-n2ccnc2)c([N+](=O)[O-])c1 514501946 MRRUXZFXNWZZMJ-UHFFFAOYSA-N 484.541 5.516 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Cl)[C@H](NCc1ccc(F)cc1C(F)(F)F)c1ccccc1 515518282 CFGCQHHDAWSYAC-HXUWFJFHSA-N 481.833 5.876 5 20 JKBD C[C@@H]1CCCCN1C(=O)c1ccc(NC(=O)c2ccc(N3CCCC3)c([N+](=O)[O-])c2)cc1Cl 515611674 OFNSKXSQCNXYEM-MRXNPFEDSA-N 470.957 5.115 5 20 JKBD C[C@@H](NCc1ccc(-c2ccccc2[N+](=O)[O-])s1)c1cccc(NC(=O)c2ccccc2)c1 517535571 IWPBIRZRMBZGBJ-GOSISDBHSA-N 457.555 6.426 5 20 JKBD O=C(Nc1ccc2nc([C@@H]3CCCO3)[nH]c2c1)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1 520262374 VCPTTYNEYVTSMA-QFIPXVFZSA-N 478.892 6.021 5 20 JKBD COc1ccc2c(c1)CCCN(C(=O)C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc3ccccc3s1)C2 524155743 VOSIZJVOBZSLKH-PXLXIMEGSA-N 499.592 6.119 5 20 JKBD Cc1nn(Cc2ccc(C(=O)Nc3ccc(CN4CCCC[C@@H]4C)cc3)cc2)c(C)c1[N+](=O)[O-] 603680340 IPXWSKWONIRZQQ-SFHVURJKSA-N 461.566 5.083 5 20 JKBD COc1ccc(Oc2ccc([N+](=O)[O-])cc2C(=O)Nc2cc(NC(=O)C3CC3)ccc2C)cc1 603757796 HNIZYHQMUZVKTN-UHFFFAOYSA-N 461.474 5.305 5 20 JKBD O=C(Cc1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1)N1CCC[C@H]1c1ccc(O)cc1 604485273 IGXUDGBIOOOSDZ-VWLOTQADSA-N 468.513 5.059 5 20 JKBD C[C@H](Nc1ccc(C(=O)Nc2c(-c3ccccc3)ncn2C2CC2)cc1[N+](=O)[O-])c1ccccn1 604544461 KQENDMMLLHIRDR-KRWDZBQOSA-N 468.517 5.614 5 20 JKBD O=C(NCc1ccncc1)Nc1cccc(NC(=O)c2ccc(NCc3ccccc3)c([N+](=O)[O-])c2)c1 609174286 HXFJKPUWEVEZTO-UHFFFAOYSA-N 496.527 5.176 5 20 JKBD Cc1ccc(-c2nnc([C@H](C)Nc3ccc(NS(=O)(=O)c4ccc(C)c([N+](=O)[O-])c4)cc3)o2)cc1 610550763 NVQVGXZHKXZUDR-KRWDZBQOSA-N 493.545 5.236 5 20 JKBD Cn1c(SCC(=O)N[C@@H](c2cccs2)C(C)(C)C)nc2cc3ccccc3cc2c1=O 613973232 QEXKEGYJNZLOGB-NRFANRHFSA-N 451.617 5.144 5 20 JKBD O=[N+]([O-])c1ccc(Sc2nnc(-c3ccc(Cl)cc3)n2Cc2ccco2)c2ccncc12 619680488 STFGNPKGKKGODK-UHFFFAOYSA-N 463.906 5.847 5 20 JKBD C[C@@H](c1nnc(-c2cccc(Cl)c2)o1)N1CCN(c2ccc([N+](=O)[O-])cc2C(F)(F)F)CC1 727438340 SUOMXADYELBPEM-ZDUSSCGKSA-N 481.862 5.200 5 20 JKBD C[C@H](OC(=O)[C@@H]1C[C@@H]1c1ccc(Cl)c(Cl)c1)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 727927053 LNANLQQIKOTEEE-ZWKOPEQDSA-N 491.249 5.594 5 20 JKBD Cc1ccc(C)c(N(C(=O)c2ccc(OS(=O)(=O)c3cccc([N+](=O)[O-])c3)cc2)C(C)C)c1 728169020 PWHUKZFCJIAKKT-UHFFFAOYSA-N 468.531 5.035 5 20 JKBD CC(=O)N(c1nc(COC(=O)c2cc(F)ccc2[N+](=O)[O-])cs1)c1c(C)cc(C)cc1Cl 743197334 JMIWKDSIVCCRGZ-UHFFFAOYSA-N 477.901 5.502 5 20 JKBD COc1cccc(NC(=O)CSc2ccccc2C(=O)N(C)Cc2cc([N+](=O)[O-])ccc2Cl)c1 772458539 CHTXSJSWDAMGSC-UHFFFAOYSA-N 499.976 5.260 5 20 JKBD CCn1c(S[C@@H](C)C(=O)Nc2ccc(N3CCCC3)cc2)nc2cc3ccccc3cc2c1=O 857311141 OQCLHDONNTURPM-SFHVURJKSA-N 472.614 5.289 5 20 JKBD CC(C)N(Cc1nnc(-c2cccc([N+](=O)[O-])c2)o1)C(=O)CCSc1ccccc1Cl 864244713 KJLUPHKZOPZTIM-UHFFFAOYSA-N 460.943 5.218 5 20 JKBD COc1cc2[nH]c(/C(Cl)=C\c3ccc(-c4ccc([N+](=O)[O-])cc4Cl)o3)nc(=O)c2cc1OC 916126777 JPGWGRAWLGNXLC-LZYBPNLTSA-N 488.283 5.499 5 20 JKBD Cc1ccc(/C(O)=C(/C(=S)N[C@H](C)c2ccccc2)[n+]2ccc(C(C)(C)C)cc2)cc1[N+](=O)[O-] 917613244 QLEMJFQTCAQACG-LJQANCHMSA-O 476.622 6.050 5 20 JKBD C[C@@H](OC(=O)c1cc2cccc([N+](=O)[O-])c2[nH]1)C(=O)Nc1c(Cl)cc(Cl)cc1Cl 919523349 RKJBUGAEMCHFGL-MRVPVSSYSA-N 456.669 5.220 5 20 JKBD C[C@H]1C[C@@H](C)CN(c2ccc(C(=O)O[C@H](C)c3nnc(-c4ccccc4)o3)cc2[N+](=O)[O-])C1 921249398 FDINDSBFWRDNRB-IXDOHACOSA-N 450.495 5.045 5 20 JKBD CSc1cc(C(=O)O[C@@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2ccccc2)ccc1N 927936189 BECZTGARAUMTPJ-HXUWFJFHSA-N 471.922 5.089 5 20 JKBD Cc1nscc1C(=O)Nc1ccc(C2(NC(=O)c3cc4cc([N+](=O)[O-])ccc4s3)CCC2)cc1 1787193743 JQMSBKZTDLPWFO-UHFFFAOYSA-N 492.582 5.636 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)c3cc4ccccc4o3)CCC2)cc1)c1nc2cc([N+](=O)[O-])ccc2[nH]1 1790827333 KDPRKFGYDIZXMR-UHFFFAOYSA-N 495.495 5.279 5 20 JKBD Cc1ccc(CC(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2ccc(-c4ccccc4)cc2)C3)cc1[N+](=O)[O-] 1800140630 CZVKNAJKGUABEK-OOSCYNTBSA-N 483.568 5.065 5 20 JKBD CC(C)[C@H]1CC[C@H](C(=O)N2CCCC[C@H]2c2cc(NC(=O)Cc3cccc([N+](=O)[O-])c3)n[nH]2)CC1 1814377105 SSXBMSOZUMHIFO-JTAQYXEDSA-N 481.597 5.015 5 20 JKBD Cc1cc(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)c3ccc(C(C)(C)C)s3)n[nH]2)ncc1[N+](=O)[O-] 1818343362 ZPBKMCMSEDLEOT-QGZVFWFLSA-N 496.593 5.000 5 20 JKBD CC1=CC[C@H](C(=O)Nc2cc([C@H]3CCCCN3C(=O)C3(c4cccc([N+](=O)[O-])c4)CCC3)[nH]n2)CC1 1818807473 BSGNUCLOWSHDKG-WMZHIEFXSA-N 491.592 5.178 5 20 JKBD O=C(Nc1cc([C@H]2CCCCN2C(=O)CCc2cccc([N+](=O)[O-])c2)[nH]n1)c1ccc(Cl)c(F)c1 1821039611 OXDLLWSFXIJJJK-OAQYLSRUSA-N 499.930 5.049 5 20 JKBD COc1cc(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)CC3CCC(C)(C)CC3)[nH]n2)ccc1[N+](=O)[O-] 1823285317 WMGSCKUXCJULET-FQEVSTJZSA-N 497.596 5.239 5 20 JKBD Cc1cc(C)c(C(=O)N2CCC([C@H]3CCCCN3C(=O)/C=C/c3ccc([N+](=O)[O-])o3)CC2)c(C)c1 1824279863 ZXBZBIWNIKRIRA-ISGGHPHESA-N 479.577 5.060 5 20 JKBD O=C(CCc1c[nH]c2ccccc12)O[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1 8649509 LPKLYHPBOLUQFI-DEOSSOPVSA-N 477.904 5.585 5 20 JKBD CCOc1cc(NC(=O)c2cc3c(C)nn(Cc4ccccc4)c3s2)c([N+](=O)[O-])cc1OCC 10962385 UFSBSLXRTFFYRS-UHFFFAOYSA-N 480.546 5.412 5 20 JKBD CC(=O)Nc1ccc(NC(=O)COC(=O)c2c3ccccc3cc3ccccc23)c(C(F)(F)F)c1 22787216 RCVMVWQKWNNNII-UHFFFAOYSA-N 480.442 5.766 5 20 JKBD O=C(c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1)N1CCC(c2nnc3ccccn23)CC1 24327571 SJLXQQLAYYRNDK-UHFFFAOYSA-N 477.908 5.103 5 20 JKBD CCn1c2ccccc2c2cc(NC(=O)c3cc(OC)c(OCCOC)cc3[N+](=O)[O-])ccc21 45812147 DECNJXNWUFVBBD-UHFFFAOYSA-N 463.490 5.009 5 20 JKBD O=C(c1cc2ccccc2c2cccnc12)N1CCC[C@@H](c2nc(-c3ccc(Cl)cc3)no2)C1 116669459 DVFQLGLXWNUCAN-LJQANCHMSA-N 468.944 6.111 5 20 JKBD CSc1ccc(C(=O)c2ccccc2C(=O)N2CC[C@H](c3ccccc3F)C2)cc1[N+](=O)[O-] 410292256 SEAWCXBHASPBRB-KRWDZBQOSA-N 464.518 5.317 5 20 JKBD O=C(Nc1ccc(Cn2cncn2)cc1)c1ccc(Sc2nc3ccccc3s2)c([N+](=O)[O-])c1 477542864 PDIWTCXITIMSKZ-UHFFFAOYSA-N 488.554 5.248 5 20 JKBD COCCN(C(=O)[C@@H](C)c1ccc2cc(OC)ccc2c1)c1nc(-c2ccc([N+](=O)[O-])cc2)cs1 483263618 BBIKBSVNYYAHRN-KRWDZBQOSA-N 491.569 5.663 5 20 JKBD COc1ccccc1Nc1nc(-c2ccccc2)c(CC(=O)NCc2ccccc2[N+](=O)[O-])s1 485149098 KXGVHOIDRFXUPT-UHFFFAOYSA-N 474.542 5.329 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Cl)[C@@H](N[C@H](CN1CCCC1)c1ccccc1)c1ccccc1 493536740 LVMURQOGZQUUNO-RPBOFIJWSA-N 478.980 5.355 5 20 JKBD O=C(Nc1cccc(NC(=O)c2ccn(-c3cccc([N+](=O)[O-])c3)n2)c1)c1cccc(C(F)(F)F)c1 504796094 KBNXEDYXGOYJFL-UHFFFAOYSA-N 495.417 5.304 5 20 JKBD COc1ccc(CN[C@@H]2CCSc3ccc(F)cc32)cc1OCc1ccc([N+](=O)[O-])cc1 507955137 ZAETWOCSKBXXTJ-OAQYLSRUSA-N 454.523 5.648 5 20 JKBD COc1cc(C(=O)Nc2ccc(Oc3ccc(C)cc3OC)c(F)c2)c([N+](=O)[O-])cc1OC 510267168 LEGVNQWYORTMSC-UHFFFAOYSA-N 456.426 5.113 5 20 JKBD C[C@@H](CN1CCCCC1)NC(=O)C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1 512946373 AVMMSDAYYJIGQR-XTFSCAMASA-N 464.591 5.126 5 20 JKBD COc1ccccc1OCc1ccc(C(=O)Nc2nc(-c3cccc([N+](=O)[O-])c3)cs2)o1 514429321 NZRJWKDYEDICIC-UHFFFAOYSA-N 451.460 5.151 5 20 JKBD COc1cc([C@@H](C)N[C@@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2ccccc2)cc(OC)c1OC 515516945 LHHPXQMOSDISJT-IQMFZBJNSA-N 499.951 5.305 5 20 JKBD C[C@@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)Nc1ccc(Cl)cc1NC(=O)c1ccco1 520381634 AGKDDZXICQGMER-LLVKDONJSA-N 464.261 5.153 5 20 JKBD CC(C)NC(=O)c1ccc(Cl)c(NC(=O)c2cc([N+](=O)[O-])ccc2Oc2ccccc2)c1 524292861 QJNVNQYFPSONFI-UHFFFAOYSA-N 453.882 5.431 5 20 JKBD C[C@H](Sc1nnc(-c2ccccc2)c2ccccc12)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 594669210 GASGISUQCKEJRS-AWEZNQCLSA-N 498.486 6.343 5 20 JKBD CCN1CCc2nc(NC(=O)c3ccc(Oc4ccc(Cl)cc4[N+](=O)[O-])cc3)sc2C1 600202799 ANBWWTRHIUHYNE-UHFFFAOYSA-N 458.927 5.127 5 20 JKBD Cc1ccc(NC(=O)C/C(=C\c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)cc1C(N)=O 608948083 SXRPIAXAYPDGQO-SFQUDFHCSA-N 472.526 5.181 5 20 JKBD O=C(Cn1c2ccccc2c(=O)c2ccccc21)OCc1nnc(-c2c(Cl)cccc2Cl)o1 726634636 ICAFCKNDRIJJPM-UHFFFAOYSA-N 480.307 5.255 5 20 JKBD Nc1ccc(C(=O)Nc2ccccc2OCc2ncc(-c3cccc(Cl)c3)o2)cc1[N+](=O)[O-] 726784076 ODIHHAWXUDDOFK-UHFFFAOYSA-N 464.865 5.317 5 20 JKBD O=C(CCC(=O)c1ccc2ccc3cccc4ccc1c2c34)Nc1ccn(CCc2ccncc2)n1 727756736 ZCHOXXWSPDHRKV-UHFFFAOYSA-N 472.548 6.020 5 20 JKBD C[C@H](OC(=O)CCc1nc2cc(C(F)(F)F)ccc2s1)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 730606358 DQMPMUUVGSFFDW-NSHDSACASA-N 492.435 5.510 5 20 JKBD CCOC(=O)c1c(-c2ccc(C)cc2)csc1NC(=O)c1cc(OC)c(OCC)cc1[N+](=O)[O-] 750659400 OSICMHKPZZZXCU-UHFFFAOYSA-N 484.530 5.468 5 20 JKBD O=C(COC(=O)c1c[nH]c2cc([N+](=O)[O-])ccc12)Nc1c(Cl)c(Cl)cc(Cl)c1Cl 756767450 YXUMQXYBKAAXJG-UHFFFAOYSA-N 477.087 5.485 5 20 JKBD O=C(Cc1noc(C/C(=C\c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)n1)Nc1ccccc1 904383300 VJOFTOSAYDFYND-NBVRZTHBSA-N 497.536 5.552 5 20 JKBD Cc1ccc(N(Cc2csc(C)n2)S(=O)(=O)c2ccc(Cl)c([N+](=O)[O-])c2)c(C)c1 915671161 KKJVMJUSCLXMPS-UHFFFAOYSA-N 451.957 5.025 5 20 JKBD C[C@@H](Nc1ccc(C(=O)Nc2ccc(N3CCCCC3)c(Cl)c2)cc1[N+](=O)[O-])c1ccccn1 919770280 OEBJHTGRDWTEID-QGZVFWFLSA-N 479.968 6.059 5 20 JKBD COc1ccc([N+](=O)[O-])cc1NC(=O)c1cc(-c2ccncc2)nc2ccc(Br)cc12 919985171 FHXYSGIDTSBASU-UHFFFAOYSA-N 479.290 5.228 5 20 JKBD C[C@H](Nc1ccc(C(=O)OCc2ccc(Br)s2)cc1[N+](=O)[O-])c1ccccn1 920121256 JDLZGJXRYDXEDZ-LBPRGKRZSA-N 462.325 5.344 5 20 JKBD C[C@H](Nc1ccc(C(=O)OCC(=O)C23CC4CC(CC(C4)C2)C3)cc1[N+](=O)[O-])c1ccccn1 920545710 IHJNYFWUQZPDBX-BTVKBFDZSA-N 463.534 5.105 5 20 JKBD Cc1ccc(NC(=O)[C@@H](C)OC(=O)c2ccc(N[C@H](C)c3ccccn3)c([N+](=O)[O-])c2)c(Cl)c1 920548113 PTVXOKAGRDEDTN-HZPDHXFCSA-N 482.924 5.309 5 20 JKBD Cc1c(C(=O)N(Cc2nnc(-c3cccc([N+](=O)[O-])c3)o2)C(C)C)oc2ccc(Cl)cc12 921194905 LYBTYVDQPHSHOZ-UHFFFAOYSA-N 454.870 5.404 5 20 JKBD O=C(COc1ccc([N+](=O)[O-])c(F)c1)Nc1cccc(C(=O)Nc2cccc(C(F)(F)F)c2)c1 921267804 CSAJLRJGHLXBMK-UHFFFAOYSA-N 477.370 5.023 5 20 JKBD O=C(CCOc1ccc(F)cc1)Nc1ccc(C2(NC(=O)c3ccc([N+](=O)[O-])cc3F)CCC2)cc1 1785987005 HTMIWFQZKFQPDI-UHFFFAOYSA-N 495.482 5.090 5 20 JKBD CNc1ccc(C(=O)Nc2ccc(C3(NC(=O)Cc4ccc(Cl)cc4[N+](=O)[O-])CCC3)cc2)cc1 1787994479 GBCDOFVUMUYQTC-UHFFFAOYSA-N 492.963 5.280 5 20 JKBD O=C(Cc1ccc([N+](=O)[O-])cc1F)Nc1ccc(C2(NC(=O)[C@H]3CCCCC3(F)F)CCC2)cc1 1791184662 YXFCLJQDSITRJL-HXUWFJFHSA-N 489.494 5.236 5 20 JKBD CC[C@H](C)CC(=O)NC1(c2ccc(NC(=O)CSc3ccccc3[N+](=O)[O-])cc2)CCC1 1791521282 HLMUPSUKOLTVDX-KRWDZBQOSA-N 455.580 5.257 5 20 JKBD Cc1ccc(C(=O)Nc2cc([C@H]3CCCCN3C(=O)c3cc(F)cc([N+](=O)[O-])c3)[nH]n2)cc1Cl 1814590538 LYCSKFWGURAOHN-HXUWFJFHSA-N 485.903 5.039 5 20 JKBD O=C(Nc1cc([C@H]2CCCCN2C(=O)c2ccoc2Cl)[nH]n1)c1cc2cc([N+](=O)[O-])ccc2s1 1821609303 BHIIZWDABGBFPD-MRXNPFEDSA-N 499.936 5.399 5 20 JKBD O=C(CCc1ccccc1Cl)N1CCC([C@@H]2CCCCN2C(=O)/C=C/c2ccc([N+](=O)[O-])o2)CC1 1824275866 GZAFGUQIMZNLSF-SRLUVNLFSA-N 499.995 5.107 5 20 JKBD Cc1oc(C(C)(C)C)cc1C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cc(F)cc([N+](=O)[O-])c2)CC1 1830615112 RLCKGZSMFAIKDP-QHCPKHFHSA-N 499.583 5.480 5 20 JKBD Cc1cc(C(=O)N2CCC([C@H]3CCCCN3C(=O)c3cc(Cl)cc([N+](=O)[O-])c3C)CC2)cnc1C 1830734564 NOPHZZAOXSIBFD-HSZRJFAPSA-N 499.011 5.116 5 20 JKBD CCCn1c(SCC(=O)Nc2ccc([N+](=O)[O-])cc2Cl)nnc1-c1ccc(Cl)cc1 9138769 XSMYHLVFPDEGSU-UHFFFAOYSA-N 466.350 5.301 5 20 JKBD Cc1ccc([N+](=O)[O-])cc1NC(=O)COC(=O)c1ccccc1CSc1nc2ccccc2o1 9555925 ZRSTVXMULFLJIV-UHFFFAOYSA-N 477.498 5.132 5 20 JKBD CCOc1ccc(NS(=O)(=O)c2cc(NC(=O)c3cc(Cl)ccc3[N+](=O)[O-])ccc2C)cc1 15430986 QHONDVJDMJKHAS-UHFFFAOYSA-N 489.937 5.008 5 20 JKBD Cc1nn(-c2ccccc2)c(C)c1CN[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1 15505229 KWOVKXIBRBGWHF-VWLOTQADSA-N 489.963 5.520 5 20 JKBD COc1ccc(OC)c([C@H](C)N[C@@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2ccccc2)c1 15509383 HFECAMICHKOKOR-NPMXOYFQSA-N 469.925 5.296 5 20 JKBD COc1cc2c(cc1OC)[C@@H](c1ccccc1)N(C(=O)c1ccc(Br)c([N+](=O)[O-])c1)CC2 16002207 NIEXVINTHCHTPN-HSZRJFAPSA-N 497.345 5.162 5 20 JKBD Cc1csc(Sc2ccc(C(=O)O[C@@H](C)C(=O)Nc3ccccc3Cl)cc2[N+](=O)[O-])n1 16903556 XBAFTKUDPDMLLM-LBPRGKRZSA-N 477.951 5.348 5 20 JKBD CC(C)CC(=O)Nc1ccc(NC(=O)C2CCN(c3ccc(C(F)(F)F)cc3[N+](=O)[O-])CC2)cc1 25760437 MATBDKGZEYSNNM-UHFFFAOYSA-N 492.498 5.453 5 20 JKBD Cc1ccc(Sc2ccc(C(=O)Nc3cc4c(cc3Cl)NC(=O)CO4)cc2[N+](=O)[O-])cc1 33193995 RCAWPLJIJQQKFR-UHFFFAOYSA-N 469.906 5.291 5 20 JKBD C[C@H]1CCC[C@H](C)N1C(=O)c1cc(Cl)ccc1NC(=O)C1CCN(c2ccccc2[N+](=O)[O-])CC1 302990263 XHFJRLWZHZUIOI-ROUUACIJSA-N 499.011 5.506 5 20 JKBD Cc1ccc(S(=O)(=O)Nc2ccc(NC(=O)c3sc(C(C)(C)C)nc3C)cc2)cc1[N+](=O)[O-] 489935657 PXVOQRQUDHGGMZ-UHFFFAOYSA-N 488.591 5.019 5 20 JKBD Cc1ccc(-c2nc(C)c([C@H](C)NC(=O)c3cn(C)nc3-c3ccc([N+](=O)[O-])cc3)s2)cc1 502447609 TYUMOROZZLZCOY-HNNXBMFYSA-N 461.547 5.227 5 20 JKBD O=C(CSc1ccc(C(F)(F)F)cc1[N+](=O)[O-])Nc1cccc(OCc2cscn2)c1 505050618 DOVIQPIDLXNNQA-UHFFFAOYSA-N 469.466 5.380 5 20 JKBD CN(C)Cc1cccc(NC(=O)C/C(=C/c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)c1 506775513 IQQVNFRZFCEMOP-ZHZULCJRSA-N 472.570 5.836 5 20 JKBD Cc1ccc(C(C)C)c(Oc2ccc(CNC3CCN(C(=O)CC(C)C)CC3)cc2[N+](=O)[O-])c1 507904967 RQCMKOGUPHKOLO-UHFFFAOYSA-N 467.610 5.946 5 20 JKBD O=[N+]([O-])c1ccccc1Sc1nnc(-c2cccnc2)n1-c1ccc(Br)cc1 515164661 LVNWJYDANGIEGO-UHFFFAOYSA-N 454.309 5.151 5 20 JKBD CC(=O)N(c1ccc(F)cc1)c1nc(COc2ccc([N+](=O)[O-])cc2Cc2ccccc2)cs1 515605802 RNLOPQBSITXSEF-UHFFFAOYSA-N 477.517 6.045 5 20 JKBD Cc1cc(C(=O)N2CCC[C@H](C)C2)ccc1NC(=O)c1ccc(N2CCC[C@@H](C)C2)c([N+](=O)[O-])c1 519023870 MHHFIURXNKGTMY-MOPGFXCFSA-N 478.593 5.264 5 20 JKBD CCn1c(COC(=O)c2ccccc2NC(=O)c2ccc([N+](=O)[O-])cc2Cl)nc2cc(F)ccc21 727508600 ZAJUFZMXFXWPII-UHFFFAOYSA-N 496.882 5.366 5 20 JKBD CN(C(=O)c1cccc(C(=O)N(CC2CC2)c2ccc(Cl)c([N+](=O)[O-])c2)c1)c1ccccc1 729652841 JSVSLKFAFBDCNE-UHFFFAOYSA-N 463.921 5.582 5 20 JKBD CC1CCN(c2ccc([N+](=O)[O-])cc2C(=O)Nc2ccc(C(=O)Nc3ccccc3)cc2)CC1 746375828 UJFUWUUPKTXJPF-UHFFFAOYSA-N 458.518 5.336 5 20 JKBD O=C(OCC(=O)N(c1ccccc1)C1CCCCC1)c1csc(-c2cccc([N+](=O)[O-])c2)n1 747962878 KYUAVEHNGOGOKX-UHFFFAOYSA-N 465.531 5.241 5 20 JKBD CC(C)n1c(S[C@H](C)C(=O)Nc2ccc(F)c([N+](=O)[O-])c2)nnc1-c1ccc(Cl)cc1Cl 771712319 COYAUQICOGFUOV-LLVKDONJSA-N 498.367 5.999 5 20 JKBD CC1=C(C(=O)Nc2ccc(F)cc2)[C@@H](c2ccc([N+](=O)[O-])o2)NC(=S)N1c1ccc(C)c(F)c1 812990143 YCCHJJBXVNWNGC-OAQYLSRUSA-N 484.484 5.123 5 20 JKBD C[C@H](OC(=O)c1ccc(Cl)c([N+](=O)[O-])c1)C(=O)N1c2ccccc2Sc2ccccc21 821470246 USVTXUCGSUJUHT-ZDUSSCGKSA-N 454.891 5.623 5 20 JKBD CCc1ccc(NC(=O)[C@@H](C)OC(=O)c2ccccc2NC(=O)c2ccc([N+](=O)[O-])cc2Cl)cc1 847365884 GFBFXYYRRATWIM-OAHLLOKOSA-N 495.919 5.247 5 20 JKBD Cc1ccc(-c2nnc(-c3ccc(C(=O)O[C@H](C)C(=O)Nc4cccc([N+](=O)[O-])c4C)cc3)o2)cc1 857835457 QERSLNPWMGMWET-QGZVFWFLSA-N 486.484 5.113 5 20 JKBD COc1ccc(NC(=O)C2=S=C(/C(Cl)=C\c3ccc(C(C)C)c([N+](=O)[O-])c3)N=N2)cc1 912963713 UTICTNSIHVNKDY-LICLKQGHSA-N 458.927 5.404 5 20 JKBD COc1cc(-c2cc(C(=O)Nc3cc([N+](=O)[O-])c(C)cc3C)c3ccccc3n2)cc(OC)c1OC 916702956 LJGFSUCOLLNGPE-UHFFFAOYSA-N 487.512 5.705 5 20 JKBD COc1cc(C(=O)Nc2nc(-c3cccs3)n[nH]2)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 917127194 WIPASVXWILBQOW-UHFFFAOYSA-N 471.882 5.148 5 20 JKBD C[C@H](NC(=S)/C(=C(/O)c1cccc([N+](=O)[O-])c1)[n+]1ccc(C(C)(C)C)cc1)c1ccccc1 917612401 JJHFUAOHDDVYPD-SFHVURJKSA-O 462.595 5.742 5 20 JKBD O=C(CCc1ccsc1)Nc1ccc(C2(NC(=O)Cc3cc([N+](=O)[O-])ccc3F)CCC2)cc1 1788185128 UAHKZBOKDVVEDM-UHFFFAOYSA-N 481.549 5.105 5 20 JKBD O=C(Cc1cc([N+](=O)[O-])ccc1F)NC1(c2ccc(NC(=O)c3cc4[nH]ccc4s3)cc2)CCC1 1789101967 XVCOFOMVELGFRV-UHFFFAOYSA-N 492.532 5.267 5 20 JKBD O=C(CC1CCC1)NC1(c2ccc(NC(=O)c3cccc(Br)c3[N+](=O)[O-])cc2)CCC1 1790751713 SMZKTBOPVCWROE-UHFFFAOYSA-N 486.366 5.295 5 20 JKBD COc1cc(C(=O)Nc2ccc(C3(NC(=O)[C@H]4CCCCC4(F)F)CCC3)cc2)ccc1[N+](=O)[O-] 1792163986 QJPMFSVZNXIYIY-LJQANCHMSA-N 487.503 5.177 5 20 JKBD O=C(c1ccc([N+](=O)[O-])o1)N1CCCC2(CCN(C(=O)c3cc4c(Cl)cccc4s3)CC2)C1 1804650899 RBTJAXIOHFLORM-UHFFFAOYSA-N 487.965 5.215 5 20 JKBD O=C(CCC1CCCC1)N1CCCC2(CCN(C(=O)C3(c4cccc([N+](=O)[O-])c4)CCC3)CC2)C1 1808952191 REUOHQKRQHJOLJ-UHFFFAOYSA-N 481.637 5.218 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)N1CCC([C@@H]2CCCCN2C(=O)CCC2CCCC2)CC1 1826269260 DAMSNCDXJZQDBS-QHCPKHFHSA-N 473.589 5.246 5 20 JKBD CC1=CC[C@@H](C(=O)N2CCCC[C@H]2C2CCN(C(=O)CSc3ccccc3[N+](=O)[O-])CC2)CC1 1828352323 OMEKGGZGLWHMRT-YADHBBJMSA-N 485.650 5.053 5 20 JKBD Cc1c(C(=O)N2CCC([C@H]3CCCCN3C(=O)c3ccc([N+](=O)[O-])cc3F)CC2)oc2ccccc12 1830495506 BOTNCYRJUCVVQG-HSZRJFAPSA-N 493.535 5.336 5 20 JKBD O=C(c1ccc(Cl)c(F)c1)N1CCC([C@H]2CCCCN2C(=O)c2cccc(F)c2[N+](=O)[O-])CC1 1830621948 VARATNWREQPRRP-OAQYLSRUSA-N 491.922 5.074 5 20 JKBD C/C=C/C=C\C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)CC1 1831061072 LYBOGXZLUFLZAY-AXVWPGNMSA-N 467.591 5.175 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)N1CCC([C@@H]2CCCCN2C(=O)CCc2ccccc2F)CC1 1832396224 YTAQGLGYAJEQRH-DEOSSOPVSA-N 499.558 5.048 5 20 JKBD Cc1nc(S[C@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2C(F)(F)F)c2c(C)c(C)sc2n1 9788731 JUIWEIBQZGMRJX-SNVBAGLBSA-N 470.498 5.663 5 20 JKBD CC(=O)N(c1nc(COC(=O)c2cc([N+](=O)[O-])ccc2Cl)cs1)c1c(C)cc(C)cc1Cl 10665561 VMVKIBQFWCCLFI-UHFFFAOYSA-N 494.356 6.017 5 20 JKBD C[C@H]1CCC[C@@H](C)N1C(=O)COc1ccc(C(=O)Nc2nc(-c3cccc([N+](=O)[O-])c3)cs2)cc1 14376797 RMFCRIMDKLVQCW-CALCHBBNSA-N 494.573 5.139 5 20 JKBD CC(C)c1cccc(C(C)C)c1NC(=O)c1ccc(OS(=O)(=O)c2cccc([N+](=O)[O-])c2)cc1 14473381 DNRIVLPEEKTLDM-UHFFFAOYSA-N 482.558 5.862 5 20 JKBD O=C(Nc1ccc(-c2nnc3n2CCCCC3)cc1)c1cc([N+](=O)[O-])ccc1Sc1ccccc1 15995623 NPZWJZJWXBJBJN-UHFFFAOYSA-N 485.569 5.983 5 20 JKBD COc1ccc(-c2nnc(COC(=O)c3cc([N+](=O)[O-])ccc3Sc3ccccc3)o2)cc1 18259931 KVPYZXBRTHVYOE-UHFFFAOYSA-N 463.471 5.162 5 20 JKBD C[C@H](OC(=O)Cc1coc2ccc3ccccc3c12)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 21451830 VOCJSWFXWZVZKY-ZDUSSCGKSA-N 486.402 5.626 5 20 JKBD CC(C)c1cccc(C(C)C)c1NC(=O)COC(=O)C1CCN(c2ccccc2[N+](=O)[O-])CC1 24850569 XGRHIDVSUGWGJQ-UHFFFAOYSA-N 467.566 5.240 5 20 JKBD COc1ccc(-c2ccc(/C=C(\Cl)c3nnc(C(=O)Nc4ccccc4)s3)o2)c([N+](=O)[O-])c1 26223636 NCCIIYRINRMTTF-BOPFTXTBSA-N 482.905 5.704 5 20 JKBD COc1ccc(C)cc1CN[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Br)c1ccccc1 28374555 INHJMPLAPOKSHW-JOCHJYFZSA-N 484.350 5.144 5 20 JKBD O=C(CSc1nc2ccccc2c(=O)n1C1CCCCC1)Nc1ccc([N+](=O)[O-])cc1Cl 28609217 HHBZYQAPVHJKJK-UHFFFAOYSA-N 472.954 5.194 5 20 JKBD O=[N+]([O-])c1ccc(-c2noc(CSc3nnc(-c4ccccc4Cl)n3C3CCCC3)n2)cc1 107674942 QRWYTCXQGUERHV-UHFFFAOYSA-N 482.953 5.964 5 20 JKBD O=[N+]([O-])c1ccc(-c2nnc(CSc3nc4cc(Cl)ccc4n3Cc3ccccc3)o2)cc1 410063705 BAFFTVBWXZHTTI-UHFFFAOYSA-N 477.933 5.989 5 20 JKBD C[C@@H](NC(=O)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1)c1ccc(NC(N)=O)cc1 480286684 JZECVZONLNXTKL-CYBMUJFWSA-N 454.870 5.022 5 20 JKBD CCOc1cc([N+](=O)[O-])c(C(=O)N[C@H](C)c2ccc(NC(=O)Nc3ccccc3)cc2)cc1OC 480780492 SFPYUYLJQAZYBD-MRXNPFEDSA-N 478.505 5.137 5 20 JKBD CCOc1cc(NC(=O)c2c(-c3c(Cl)cccc3Cl)noc2C)c([N+](=O)[O-])cc1OCC 495271905 IGNKAOQBWYPLSL-UHFFFAOYSA-N 480.304 5.915 5 20 JKBD O=C(c1csc(-c2cccc([N+](=O)[O-])c2)n1)N(Cc1cccc(Br)c1)C1CC1 498211419 HRVRASPNFIZSNG-UHFFFAOYSA-N 458.337 5.286 5 20 JKBD CCCOc1ccc(Oc2ncccc2CNC(=O)c2cc(SC)ccc2[N+](=O)[O-])cc1 501637355 PGGSVYVGNUZQFH-UHFFFAOYSA-N 453.520 5.223 5 20 JKBD COc1cccc([C@H](CNC(=O)N(C)Cc2ccccc2[N+](=O)[O-])c2c[nH]c3ccccc23)c1OC 503714986 GLUZUXLKUVJKEI-QFIPXVFZSA-N 488.544 5.067 5 20 JKBD CCOc1cc([N+](=O)[O-])c(C(=O)N(C)[C@@H]2CCSc3ccc(Br)cc32)cc1OC 504623284 XQFQRDUNSAKKOW-OAHLLOKOSA-N 481.368 5.074 5 20 JKBD CNC(=O)c1ccc(N[C@H](c2ccccc2)c2ccc(Br)cc2F)c([N+](=O)[O-])c1 506995158 ORCOSCOLASPWPO-HXUWFJFHSA-N 458.287 5.058 5 20 JKBD C[C@H](Nc1ccc(C(=O)Nc2cc(C(F)(F)F)ccc2-n2cccn2)cc1[N+](=O)[O-])c1ccccn1 507389585 DXSRTUYWMJTNGB-HNNXBMFYSA-N 496.449 5.620 5 20 JKBD CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)c1ccc(SCc2cn3ccccc3n2)cc1 509695356 HCTRAVIUCCHQOX-UHFFFAOYSA-N 460.559 5.586 5 20 JKBD COc1cc(C(=O)N[C@@H](c2ccc(Cl)cc2)C2CC2)c([N+](=O)[O-])cc1OCc1cscn1 512599872 KZFGMKBIRIYYKJ-OAQYLSRUSA-N 473.938 5.173 5 20 JKBD O=[N+]([O-])c1ccc(-c2nnc(CSc3nnc(-c4ccccc4)c(-c4ccccc4)n3)o2)cc1 513803339 DSRSYHXEPNKGQC-UHFFFAOYSA-N 468.498 5.456 5 20 JKBD Cc1cc(N2CCCC2)ccc1NC(=O)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 514882288 SHDPEHDDVCBSSP-UHFFFAOYSA-N 476.499 5.377 5 20 JKBD O=C(Nc1cc([N+](=O)[O-])ccc1OC(F)F)c1cn(-c2ccccc2)nc1-c1cccs1 515098208 RMNCZCREXOXKFZ-UHFFFAOYSA-N 456.430 5.363 5 20 JKBD Cc1nc(CSc2ccc(C(=O)Nc3nc(-c4cccc([N+](=O)[O-])c4)c(C)s3)cc2)cs1 515626220 TYOGEMCQBKTLGG-UHFFFAOYSA-N 482.612 6.336 5 20 JKBD O=C(Cn1c2ccccc2c(=O)c2ccccc21)Nc1ccc(Cl)cc1NC(=O)c1ccco1 515820120 HTDQEQREGWAUIO-UHFFFAOYSA-N 471.900 5.292 5 20 JKBD COc1ccc([C@H]2CCCN2C(=O)COc2ccc(-c3ccccc3)cc2[N+](=O)[O-])cc1OC 518657383 MLJKTFKKXXSEBF-OAQYLSRUSA-N 462.502 5.022 5 20 JKBD COc1cc(C(=O)Nc2cccc(COC3CCCCC3)c2)c([N+](=O)[O-])cc1OCc1cscn1 520661761 RBHJRURAUZKEIG-UHFFFAOYSA-N 497.573 5.741 5 20 JKBD Cn1cnnc1Sc1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2Sc2ccccc2)cc1 522868319 LZGKVWRRLLNKGF-UHFFFAOYSA-N 463.544 5.278 5 20 JKBD CC(=O)Nc1cccc([C@H](C)N(Cc2ccccc2)C(=O)CSc2ccc([N+](=O)[O-])cc2)c1 590475791 DTQBHOTVZJGHKK-SFHVURJKSA-N 463.559 5.435 5 20 JKBD O=C(Nc1cc(Cl)ccc1Cl)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 602310605 WPPWJLYPIFHGDC-UHFFFAOYSA-N 462.255 5.776 5 20 JKBD C[C@@H](NC(=O)Nc1cc([N+](=O)[O-])ccc1OC(F)F)c1ccc(NC(=O)c2ccc(F)cc2)cc1 604084722 FMXUAKWKLKIJOU-CYBMUJFWSA-N 488.422 5.470 5 20 JKBD Cc1cc(C(=O)NCC(C)C)ccc1NC(=O)c1cc([N+](=O)[O-])ccc1Sc1ccccc1 604517739 DKNWZBWINDIAMI-UHFFFAOYSA-N 463.559 5.693 5 20 JKBD CN(CCNC(=O)C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)C1CCCC1 609190124 OCNCMBWOGFGZGY-MNDPQUGUSA-N 464.591 5.126 5 20 JKBD CO[C@H](C)c1cccc(NC(=O)c2ccccc2NC(=O)c2ccc([N+](=O)[O-])cc2Cl)c1 726956679 DBSGCQVOJBMUOS-CQSZACIVSA-N 453.882 5.460 5 20 JKBD CC(C)[C@H](OC(=O)c1csc(-c2ccc([N+](=O)[O-])cc2)n1)C(=O)Nc1ccccc1C(F)(F)F 747954902 NXPHZYYXLJFLIJ-SFHVURJKSA-N 493.463 5.557 5 20 JKBD COc1ccc(-c2cc3[nH]c(/C(Cl)=C/c4ccc(C)c([N+](=O)[O-])c4)nc(=O)c3s2)cc1 797247061 DOBDVICTIQETNQ-SXGWCWSVSA-N 453.907 5.614 5 20 JKBD O=[N+]([O-])c1ccc(/C=C(\Cc2nc(-c3ccc(F)cn3)no2)c2nc3ccccc3s2)cc1 904935081 VYHLCIUCLIMTHK-RVDMUPIBSA-N 459.462 5.572 5 20 JKBD O=C(O[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1)c1cc2cccc([N+](=O)[O-])c2[nH]1 917331629 SRACYONOZOKHJL-NRFANRHFSA-N 494.847 5.175 5 20 JKBD O=[N+]([O-])c1ccccc1CN(Cn1nc(Nc2cccc(F)c2)sc1=S)CC(F)(F)F 917449625 GGZHOMMUMUNMRO-UHFFFAOYSA-N 473.477 5.487 5 20 JKBD CCc1cccc[n+]1/C(C(=S)Nc1c(C(C)C)cccc1C(C)C)=C(/O)c1ccc([N+](=O)[O-])cc1 917610646 OYSAXMTXIAWMSF-UHFFFAOYSA-O 490.649 7.015 5 20 JKBD Cc1ccc(NC(=O)[C@@H](OC(=O)Cc2nc(-c3ccccc3)oc2C)c2ccccc2)c([N+](=O)[O-])c1 918941394 KOIHMQNMKXGMDD-VWLOTQADSA-N 485.496 5.332 5 20 JKBD C[C@@H](OC(=O)c1cc2cc([N+](=O)[O-])ccc2o1)C(=O)N1c2ccccc2Sc2ccccc21 919212525 TVQPZSBGIISHCT-CQSZACIVSA-N 460.467 5.716 5 20 JKBD COc1cccc([C@H](C)C(=O)O[C@@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2ccccc2)c1 919733069 PHDIUFIAPXDZCI-OYHNWAKOSA-N 468.893 5.284 5 20 JKBD Cc1ccc(OC(=O)c2ccc(N[C@@H](C)c3ccccn3)c([N+](=O)[O-])c2)c(C(=O)NCC(C)C)c1 920285769 PDIJJNRJFJQVMF-SFHVURJKSA-N 476.533 5.076 5 20 JKBD C[C@H](OC(=O)c1ccc(N[C@H](C)c2ccccn2)c([N+](=O)[O-])c1)C(=O)N1CCC[C@@H]1c1cccs1 920546336 YHIBSQLNDBVVND-LLGFUMIMSA-N 494.573 5.133 5 20 JKBD O=C(/C=C/c1ccccc1[N+](=O)[O-])NC1(c2ccc(NC(=O)COC3CCCCC3)cc2)CCC1 1786018443 BPILVHWJIWUFFO-LFIBNONCSA-N 477.561 5.091 5 20 JKBD O=C(Cc1ccc([N+](=O)[O-])cc1F)NC1(c2ccc(NC(=O)[C@@H](F)c3ccccc3)cc2)CCC1 1786613748 VOCXDPJPPQDHFE-DEOSSOPVSA-N 479.483 5.121 5 20 JKBD O=C(Cc1cc([N+](=O)[O-])ccc1F)Nc1ccc(C2(NC(=O)c3cccc4ccncc34)CCC2)cc1 1786672859 VBZUPGVVBDXSFZ-UHFFFAOYSA-N 498.514 5.273 5 20 JKBD Cc1cc(C(=O)Nc2ccc(C3(NC(=O)c4ccc5ccoc5c4)CCC3)cc2)ncc1[N+](=O)[O-] 1788766680 PPRHQTAWFLCZJJ-UHFFFAOYSA-N 470.485 5.106 5 20 JKBD Cc1cc(C(=O)NC2(c3ccc(NC(=O)c4cc5c(C)cccc5[nH]4)cc3)CCC2)ncc1[N+](=O)[O-] 1789271653 KJARNYGEEKYCOS-UHFFFAOYSA-N 483.528 5.149 5 20 JKBD C[C@H](C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cc(F)cc([N+](=O)[O-])c2)n[nH]1)c1ccc(Cl)cc1 1821163358 LUZULEJXSFWUBC-LHSJRXKWSA-N 499.930 5.220 5 20 JKBD CCC(C)(C)C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2ccc(Br)c([N+](=O)[O-])c2)CC1 1830522268 BFULRINZBDQLLI-IBGZPJMESA-N 494.430 5.027 5 20 JKBD Cc1c(C(=O)N2CCC([C@@H]3CCCCN3C(=O)c3cccc(F)c3[N+](=O)[O-])CC2)oc2ccccc12 1830621836 NPLWVXUUPVOKBC-QFIPXVFZSA-N 493.535 5.336 5 20 JKBD Cc1ccc([C@@H](C)C(=O)N2CCCC[C@H]2C2CCN(C(=O)c3cccc(F)c3[N+](=O)[O-])CC2)cc1 1831530673 VIAOTJJONSZORB-DVECYGJZSA-N 481.568 5.079 5 20 JKBD CC(C)(C)CCCCCC(=O)N1CCCC12CN(C(=O)c1cccc(Br)c1[N+](=O)[O-])C2 1846086969 CVCMUNMZECQFIQ-UHFFFAOYSA-N 494.430 5.171 5 20 JKBD Cc1ccc(NC(=O)[C@H](C)OC(=O)c2ccc(Sc3nc(C)cs3)c([N+](=O)[O-])c2)c(C)c1 16903572 JBPMKLMGUSHKPK-HNNXBMFYSA-N 471.560 5.312 5 20 JKBD CCn1c(S[C@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)nnc1-c1ccc(Cl)cc1 17659603 XXIHWVIMRWOVDZ-GFCCVEGCSA-N 456.915 5.430 5 20 JKBD COc1ccc([N+](=O)[O-])cc1C(=O)OCC(=O)Nc1c(Cl)c(Cl)cc(Cl)c1Cl 19284680 MIWNVGGLNIFBQK-UHFFFAOYSA-N 468.076 5.013 5 20 JKBD CCn1c(S[C@H](C)C(=O)Nc2ccc(OC(F)F)cc2)nc2cc3ccccc3cc2c1=O 22178351 IHPLHVABILEQPG-CQSZACIVSA-N 469.513 5.290 5 20 JKBD C[C@H](Sc1nc2cc3ccccc3cc2c(=O)n1C)C(=O)Nc1ccccc1-c1ccccc1 22253588 PZATYGUSSSXTQR-SFHVURJKSA-N 465.578 5.873 5 20 JKBD COc1ccccc1-n1c(S[C@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2)nnc1-c1cccs1 23545788 NGALXDRNESMFJY-CQSZACIVSA-N 481.559 5.032 5 20 JKBD C[C@H](OC(=O)c1ccc(NCc2ccccc2)c([N+](=O)[O-])c1)C(=O)Nc1ncc(Cl)cc1Cl 23642759 ZISCAZCIRBOPIU-ZDUSSCGKSA-N 489.315 5.093 5 20 JKBD O=C(CSc1nnc(-c2ccco2)n1-c1ccccc1)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 28811490 HSTSUJMXGMLQHQ-UHFFFAOYSA-N 489.435 5.185 5 20 JKBD COc1ccc(-c2nnc(SCC(=O)Nc3ccc([N+](=O)[O-])cc3Cl)n2-c2ccccc2)cc1 36809022 SIVHBSDZIXWCBY-UHFFFAOYSA-N 495.948 5.235 5 20 JKBD Cc1cccc(SCC(=O)Nc2c(Br)cc([N+](=O)[O-])cc2Br)c1 60134612 PPQUDBBPTAJVPU-UHFFFAOYSA-N 460.147 5.159 5 20 JKBD O=C(Nc1ccccc1C(=O)Nc1cccc(OCC(F)(F)F)c1)c1ccc([N+](=O)[O-])cc1Cl 106255497 UEYVTQQXIDOZDH-UHFFFAOYSA-N 493.825 5.694 5 20 JKBD Cc1ccc(OC2CCN(C(=O)c3ccc(N[C@H](C)c4ccccn4)c([N+](=O)[O-])c3)CC2)cc1C 108830527 SUYDVZXAQTZNGG-HXUWFJFHSA-N 474.561 5.463 5 20 JKBD C[C@H](Nc1ccc(C(=O)Nc2ccccc2OCc2cscn2)cc1[N+](=O)[O-])c1ccccn1 109989336 KDTFHGIEEMNCHX-INIZCTEOSA-N 475.530 5.451 5 20 JKBD O=C(Nc1cc(Cl)ccc1OC[C@H]1CCCO1)c1csc(-c2ccc([N+](=O)[O-])cc2)n1 215730922 YBYIAOYOVBOBSJ-MRXNPFEDSA-N 459.911 5.182 5 20 JKBD Cc1nc(C2(NC(=O)C/C(=C\c3ccc([N+](=O)[O-])cc3)c3nc4ccccc4s3)CCCC2)no1 410134920 CBMWOPDNTZXGRZ-NBVRZTHBSA-N 489.557 5.412 5 20 JKBD Cc1c(C(=O)N(Cc2ccccc2[N+](=O)[O-])CC(F)(F)F)cnn1-c1cccc(C(F)(F)F)c1 486071798 UKOLGLQNXDQAPW-UHFFFAOYSA-N 486.372 5.312 5 20 JKBD O=C(Nc1cccc(C(=O)N2CCSCC2)c1)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1 494156398 IZWFPXHHDQPUJL-UHFFFAOYSA-N 497.960 5.482 5 20 JKBD COc1cc(C(=O)NCc2ncc(-c3ccccc3)[nH]2)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 497524702 HNPYIWASFVXZNN-UHFFFAOYSA-N 478.892 5.369 5 20 JKBD CC[C@@H](C)Sc1ccc(NC(=O)COc2ccc([N+](=O)[O-])c(OC)c2)c(C(F)(F)F)c1 499593157 CFPCXIIIJZNIKC-GFCCVEGCSA-N 458.458 5.530 5 20 JKBD COc1ccc(-c2nc(C)c(C(=O)N(Cc3ccc([N+](=O)[O-])cc3)C(C)C)s2)cc1OC 502005458 FOHHRNQACREWKY-UHFFFAOYSA-N 455.536 5.095 5 20 JKBD CCOC(=O)C1CCC(NC(=O)c2cc([N+](=O)[O-])ccc2Sc2ccc(Cl)cc2)CC1 503137819 OJBWNYVYYUJGRA-UHFFFAOYSA-N 462.955 5.251 5 20 JKBD COc1cc(C(=O)NCCc2ccn(-c3ccccc3)n2)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 505816946 CYDCTFRSOKWMIC-UHFFFAOYSA-N 492.919 5.207 5 20 JKBD COc1cc(NC(=O)c2ccc(N[C@@H](C)c3ccccn3)c([N+](=O)[O-])c2)c(OC)cc1Cl 505993368 WJGNLCMSLBXEIK-ZDUSSCGKSA-N 456.886 5.086 5 20 JKBD C[C@H](Nc1ccc(C(=O)Nc2ccc(-c3cnc(C4CC4)o3)cc2)cc1[N+](=O)[O-])c1ccccn1 506195782 YNQRRDHDEQGYHX-INIZCTEOSA-N 469.501 5.948 5 20 JKBD CCOc1cc(CN[C@@H]2CCc3cc(F)ccc32)ccc1OCc1cc([N+](=O)[O-])cc2c1OCOC2 507910640 ADGDOQGBLWHJCS-XMMPIXPASA-N 494.519 5.355 5 20 JKBD COc1cc(C(=O)N(C)[C@H](C)c2cccc(Cl)c2)c([N+](=O)[O-])cc1OCc1cscn1 512403398 LBLIQXGMTQOEJV-CYBMUJFWSA-N 461.927 5.126 5 20 JKBD COCCN(C(=O)[C@@H]1CCC[C@H](C(F)(F)F)C1)c1nc(-c2ccc([N+](=O)[O-])cc2)cs1 515159541 KYMZAEQAQVUJNF-CABCVRRESA-N 457.474 5.066 5 20 JKBD O=C(Nc1cc(-c2nnc3n2CCCCC3)ccc1F)c1cc2cc([N+](=O)[O-])ccc2s1 518177830 QQGZWZLOIIKZHU-UHFFFAOYSA-N 451.483 5.186 5 20 JKBD O=[N+]([O-])c1ccc(-c2nn(-c3ccccc3)cc2CNC2CCN(Cc3ccccc3)CC2)cc1 518748490 VJLHOEDQPJPPBS-UHFFFAOYSA-N 467.573 5.202 5 20 JKBD CCOC(=O)c1sc(N(C(=O)[C@H](C)Oc2ccc(Cl)cc2[N+](=O)[O-])c2ccccc2)nc1C 521250019 KJUMFLKYJUGKON-AWEZNQCLSA-N 489.937 5.322 5 20 JKBD Cc1ncsc1CNC(=O)C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1 521513008 YEPKLCQZWXEPLQ-MHWRWJLKSA-N 450.545 5.217 5 20 JKBD O=C(CC1CCCC1)N1CCCN(C(=O)c2ccc(NCc3ccccc3Cl)c([N+](=O)[O-])c2)CC1 521660600 CJMJTHKGZXONJM-UHFFFAOYSA-N 499.011 5.115 5 20 JKBD Cc1csc(Sc2ccc(C(=O)N(C)[C@@H](c3cccc(F)c3)c3cnn(C)c3)cc2[N+](=O)[O-])n1 523243181 UUWUCJGWIURGBV-NRFANRHFSA-N 497.577 5.245 5 20 JKBD O=C(N[C@H](c1cccs1)C1CC1)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 589327579 XGCRXWZDUDKFKO-IBGZPJMESA-N 453.486 5.159 5 20 JKBD CN(c1ccccc1)c1ccc(CNc2ccc(C(N)=O)c(N3CCCCC3)c2)cc1[N+](=O)[O-] 600848918 YVUFQEMTNXBFBP-UHFFFAOYSA-N 459.550 5.064 5 20 JKBD COCCN(C(=O)c1csc(-c2ccc(C)o2)n1)c1nc(-c2ccc([N+](=O)[O-])cc2)cs1 603615933 URLPHVIGKGJXMT-UHFFFAOYSA-N 470.532 5.036 5 20 JKBD Cc1cc(NC(=O)C(C)(C)C)sc1C(=O)Nc1nc(-c2cccc([N+](=O)[O-])c2)c(C)s1 603997172 AHGCBCXKRYHZFP-UHFFFAOYSA-N 458.565 5.634 5 20 JKBD O=C(Nc1nc(-c2cccc(C(F)(F)F)c2)cs1)c1ccn(-c2ccc([N+](=O)[O-])cc2)n1 604469765 QQPQGYLCVLHSQV-UHFFFAOYSA-N 459.409 5.175 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Cl)[C@@H](NC[C@H]1CCCN(Cc2ccccc2)C1)c1ccccc1 604474096 HIWWNBYVPYXQGC-RLWLMLJZSA-N 493.007 5.430 5 20 JKBD COc1cccc([C@@H](Nc2ccc(C(=O)Nc3ccc(C)cc3)cc2[N+](=O)[O-])c2nccn2C)c1 608971775 QHTQSVQPTABXEZ-XMMPIXPASA-N 471.517 5.099 5 20 JKBD C[C@@H](NC(=O)Nc1ccc(CNC(=O)c2ccc(C(F)(F)F)cc2)cc1)c1cccc([N+](=O)[O-])c1 609356254 MLNSANIVDVNRTN-OAHLLOKOSA-N 486.450 5.426 5 20 JKBD CC(=O)N(c1cccc(Cl)c1)c1nc(COC(=O)c2cc(F)c(F)cc2[N+](=O)[O-])cs1 725935163 FXXUJVDLOXJMQT-UHFFFAOYSA-N 467.837 5.025 5 20 JKBD COc1ccc(NC(=O)[C@H](OC(=O)c2cc(F)c(F)cc2[N+](=O)[O-])c2ccccc2)cc1Cl 725936407 BAVVSNAJDFTNJP-HXUWFJFHSA-N 476.819 5.072 5 20 JKBD O=C(CCC(=O)c1ccc2ccc3cccc4ccc1c2c34)NCc1ccnc(N2CCOCC2)c1 727754641 VEDKQORDZLKNRS-UHFFFAOYSA-N 477.564 5.095 5 20 JKBD CC(C)Oc1ccc([N+](=O)[O-])cc1CSc1nnc(CSc2nc3ccccc3s2)n1C 729151902 YJJYAOHVZSTSML-UHFFFAOYSA-N 487.632 5.705 5 20 JKBD Cc1c(C(=O)Nc2nc(-c3cccc(Br)c3)cs2)cc([N+](=O)[O-])c(C)c1[N+](=O)[O-] 748605212 SMPMZSYFXGZRNW-UHFFFAOYSA-N 477.296 5.258 5 20 JKBD O=C1CC[C@@H](c2noc(-c3ccc(NCc4ccccc4Cl)c([N+](=O)[O-])c3)n2)CN1CC1CCC1 856567181 VBWKYWHLHVUFJH-LJQANCHMSA-N 495.967 5.416 5 20 JKBD C[C@@H](Nc1ccc(-c2nc(-c3cccc(C(F)(F)F)c3)no2)cc1[N+](=O)[O-])c1ccccn1 904315693 UESNFMBNRCYBID-CYBMUJFWSA-N 455.396 5.899 5 20 JKBD O=C(Nc1ccc(OC(=O)[C@H]2CCCc3ccccc32)cc1)c1cc([N+](=O)[O-])ccc1Cl 907269921 XQSVBURDIZKHHD-FQEVSTJZSA-N 450.878 5.526 5 20 JKBD Cc1ccc(C(=O)O[C@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)cc1NC(=O)c1ccccc1F 915515923 DPLKJFOROZAPDA-CQSZACIVSA-N 499.882 5.132 5 20 JKBD COCc1ccccc1NC(=O)c1cc([N+](=O)[O-])ccc1N1CCC(Cc2ccccc2)CC1 918621625 NELNBBMRWLBWDB-UHFFFAOYSA-N 459.546 5.453 5 20 JKBD Cc1nn(Cc2ccc(C(=O)OCc3cccc(C(=O)Nc4ccccc4)c3)cc2)c(C)c1[N+](=O)[O-] 919008201 RWPQPQJEMLFSKM-UHFFFAOYSA-N 484.512 5.066 5 20 JKBD Cc1ccc(CC(=O)NC2(c3ccc(NC(=O)c4cc(F)cnc4Cl)cc3)CCC2)cc1[N+](=O)[O-] 1789718634 QZPSTROJGLSIPL-UHFFFAOYSA-N 496.926 5.081 5 20 JKBD O=C(NC1(c2ccc(NC(=O)C3(c4cccc([N+](=O)[O-])c4)CCC3)cc2)CCC1)c1ccco1 1790475858 ICRCJHRYKKJEPB-UHFFFAOYSA-N 459.502 5.057 5 20 JKBD O=C(NC1(c2ccc(NC(=O)C3(c4cccc([N+](=O)[O-])c4)CCC3)cc2)CCC1)c1coc(Cl)n1 1790475886 JUECGEVKVPPUAW-UHFFFAOYSA-N 494.935 5.106 5 20 JKBD O=C(/C=C\c1c[nH]c2ccccc12)NC1(c2ccc(NC(=O)c3ccc(O)c([N+](=O)[O-])c3)cc2)CCC1 1790619104 SWCRFKMIZDYZSH-QPEQYQDCSA-N 496.523 5.243 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)[C@@H]3C[C@H]3C3CC3)CCC2)cc1)c1ccc(Br)c([N+](=O)[O-])c1 1790641665 CCFLZAKRYDVIQN-RBUKOAKNSA-N 498.377 5.151 5 20 JKBD Cc1c(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)Cc2ccc3ccccc3c2)cc(Cl)cc1[N+](=O)[O-] 1795541631 YRVXOEIJVAEPNI-NUNAXRQHSA-N 491.975 5.204 5 20 JKBD CC(C)[C@H](C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2ccc([N+](=O)[O-])o2)[nH]n1)c1ccc(Cl)cc1 1814936688 GTMDPRDMVNBOAB-GCJKJVERSA-N 499.955 5.310 5 20 JKBD CC[C@H](C)CC(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)[nH]n1 1815044486 NCMRFXDUUMTTED-KBXCAEBGSA-N 469.567 5.275 5 20 JKBD C[C@@H](Sc1ccccc1)C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cccc(F)c2[N+](=O)[O-])CC1 1824392709 ROMJWJWVPHZJBE-JPYJTQIMSA-N 499.608 5.148 5 20 JKBD C/C(=C\c1ccc(C)o1)C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2c(F)ccc([N+](=O)[O-])c2C)CC1 1829009932 QKZOVZWBXRMTAW-JOPBRCQMSA-N 497.567 5.281 5 20 JKBD CCCn1c(S[C@@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)nnc1-c1ccc(Cl)cc1 9138787 QTLOTBRRTXCTMH-LBPRGKRZSA-N 480.377 5.689 5 20 JKBD Cc1cccc(C)c1NC(=O)CNC(=O)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1 14045943 GHAIFRPJKWVHBC-UHFFFAOYSA-N 453.882 5.026 5 20 JKBD O=C(Nc1ccccc1C(=O)NCCc1ccc(Cl)cc1)c1ccc([N+](=O)[O-])cc1Cl 15372929 KANMPUMOTXQIJL-UHFFFAOYSA-N 458.301 5.126 5 20 JKBD COc1cc2c(cc1NC(=O)c1ccc(Cn3nc(C)c([N+](=O)[O-])c3C)cc1)oc1ccccc12 15600550 ACTANJKDBKGPML-UHFFFAOYSA-N 470.485 5.617 5 20 JKBD CSc1ccc(NC(=O)c2ccc(NS(=O)(=O)c3ccc(Cl)c([N+](=O)[O-])c3)cc2)cc1 16832538 GQORSZAQUKWYGK-UHFFFAOYSA-N 477.951 5.023 5 20 JKBD C[C@@H](OC(=O)Cc1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1)c1nnc(-c2ccccc2)o1 18961826 QEQUONUXBPRLOG-GOSISDBHSA-N 495.495 5.344 5 20 JKBD CN(Cc1ccc(OC(F)F)cc1)C(=O)Cc1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1 24178236 STHVJPBQWCBJKS-UHFFFAOYSA-N 492.482 5.250 5 20 JKBD COc1cc(C(=O)N2CCC[C@H]2c2ccncc2)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 27272322 FELGCMXMXYNCKV-SFHVURJKSA-N 453.882 5.421 5 20 JKBD Cc1cc(C(=O)O[C@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2ccccc2)ccc1[N+](=O)[O-] 28300892 JJFLGCFVDWEMJH-FQEVSTJZSA-N 469.837 5.002 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Cl)[C@@H](NC1CCN(CCc2ccccc2)CC1)c1ccccc1 30501185 XOBDKNXKYMTMAT-SANMLTNESA-N 493.007 5.225 5 20 JKBD C[C@H](Nc1ccc(C(=O)Nc2cc3c(cc2Cl)OCCCO3)cc1[N+](=O)[O-])c1ccccn1 108788125 PDQYIRQQFBHBJR-AWEZNQCLSA-N 468.897 5.230 5 20 JKBD CCc1c(C(=O)Nc2nc(-c3cccc([N+](=O)[O-])c3)c(C)s2)cnn1-c1ccc(F)cc1 195704186 IJALVPMSKGAABH-UHFFFAOYSA-N 451.483 5.166 5 20 JKBD CC[C@H](C)c1ccc([C@H](NC(=O)c2cc([N+](=O)[O-])cc(S(C)(=O)=O)c2)c2cccs2)cc1 410095404 QZNPOPGZYDJAIB-NYHFZMIOSA-N 472.588 5.093 5 20 JKBD Cc1occc1C(=O)Nc1cc(NC(=O)c2ccc(NCc3ccccc3)c([N+](=O)[O-])c2)ccc1F 481200169 PIXLMCQFJGYKAE-UHFFFAOYSA-N 488.475 5.752 5 20 JKBD Cc1ccc(-c2cc(C(=O)Nc3cc([N+](=O)[O-])ccc3OC(F)F)c3cnn(C(C)C)c3n2)s1 485871440 QDGQGFAHNBXHNT-UHFFFAOYSA-N 487.488 5.811 5 20 JKBD Cc1ccc(-c2csc(NC(=O)c3nnn(-c4cccc(F)c4)c3C(F)(F)F)n2)cc1[N+](=O)[O-] 499279155 DYXMGNQQUQOEFT-UHFFFAOYSA-N 492.414 5.018 5 20 JKBD CCOc1c(Br)cc(Cl)cc1NC(=O)Cn1ccc2cc([N+](=O)[O-])ccc21 504723680 AIPKNYFILWHPTN-UHFFFAOYSA-N 452.692 5.003 5 20 JKBD O=C(Nc1cc2c(cc1[N+](=O)[O-])OCCCO2)c1sc2cc(C(F)(F)F)ccc2c1Cl 514902222 UYKFHAHFMOLICF-UHFFFAOYSA-N 472.828 5.895 5 20 JKBD Cc1cccc(Oc2ncccc2NC(=O)c2cc(OCC(F)(F)F)ccc2[N+](=O)[O-])c1C 515666481 NDVBYLXBUPFMLR-UHFFFAOYSA-N 461.396 5.592 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Cl)[C@@H](NCc1cccc(OCC(F)(F)F)c1)c1ccccc1 515756710 AVWRLWXCWHDDKG-NRFANRHFSA-N 493.869 5.659 5 20 JKBD CC(=O)Nc1cc(NC(=O)c2cc([N+](=O)[O-])ccc2Sc2ccc(Cl)cc2)ccc1Cl 516370820 OVPQEUFYAMQKEW-UHFFFAOYSA-N 476.341 6.264 5 20 JKBD C[C@H](CNC(=O)c1ccccc1Sc1ccc(C(F)(F)F)cc1[N+](=O)[O-])Cn1cccn1 517094845 XQQFQIWVSHZCHD-CQSZACIVSA-N 464.469 5.027 5 20 JKBD COc1cc(C(=O)N[C@@H](c2ccc(C)cc2)c2ccc(F)cc2Cl)c([N+](=O)[O-])cc1OC(F)F 518646582 UXJGVVQJTZIDTA-NRFANRHFSA-N 494.853 5.825 5 20 JKBD COc1ccc([C@@H]2CCCN2C(=O)COc2ccc(-c3ccccc3)cc2[N+](=O)[O-])cc1OC 518657382 MLJKTFKKXXSEBF-NRFANRHFSA-N 462.502 5.022 5 20 JKBD CC(C)(C)c1ccc(Oc2ccc(CNCCc3nnc4n3CCCCC4)cc2[N+](=O)[O-])cc1 518769618 JWKIBXPLKVAZNB-UHFFFAOYSA-N 463.582 5.335 5 20 JKBD CC(C)(C)c1ccc(C(=O)N2CCC[C@H](c3nc(-c4ccc(F)cc4)no3)C2)cc1[N+](=O)[O-] 522584091 JYXKBKONZRZLCE-KRWDZBQOSA-N 452.486 5.101 5 20 JKBD O=C(Nc1cnc2ccccc2c1)c1ccc(C(=O)Nc2cnc3ccccc3c2)c([N+](=O)[O-])c1 524353238 UVYCNIPFDAZEJZ-UHFFFAOYSA-N 463.453 5.196 5 20 JKBD O=C(c1ccccc1)c1ccc(Sc2nnc(-c3ccncc3)n2CC(F)(F)F)c([N+](=O)[O-])c1 561509067 MOQZFEDQHHICEU-UHFFFAOYSA-N 485.447 5.193 5 20 JKBD O=C(C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)NCc1ccccc1OC(F)F 590767599 DHNTXZKZSNVEBF-QGOAFFKASA-N 495.507 6.053 5 20 JKBD CS(=O)(=O)c1cc(NCc2ccc(Oc3ccc(F)cc3)c([N+](=O)[O-])c2)ccc1Cl 600846872 JYZLVOJGSDLLSV-UHFFFAOYSA-N 450.875 5.195 5 20 JKBD Cc1ccc(NC(=O)C(C)C)cc1N[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1 604044386 JUQHIAIBOPHYDU-QHCPKHFHSA-N 480.952 5.943 5 20 JKBD COc1cc(C(=O)N2CCc3ccc([N+](=O)[O-])cc32)ccc1OCc1ccc(Br)cc1 604077393 NSEVGZNUIHTEFA-UHFFFAOYSA-N 483.318 5.148 5 20 JKBD CC(C)c1nnc(CSc2nc3cc([N+](=O)[O-])ccc3n2-c2cccc(C(F)(F)F)c2)o1 608869638 UQWHXRBEAZDLIA-UHFFFAOYSA-N 463.441 5.751 5 20 JKBD COc1ccc(Oc2ccc([N+](=O)[O-])cc2C(=O)Nc2cccc([C@H](C)N3CCOCC3)c2)cc1 609183085 MJNQSYFHDIVXJN-SFHVURJKSA-N 477.517 5.041 5 20 JKBD CSc1ccc([N+](=O)[O-])c(C(=O)Nc2ccc(S(=O)(=O)Nc3ccc(Cl)cc3)cc2)c1 612863108 NLRCFENARDXJJA-UHFFFAOYSA-N 477.951 5.023 5 20 JKBD COc1ccc(CC[C@H]2CCCCN2C(=O)c2ccc(Br)c([N+](=O)[O-])c2)cc1OC 726150265 HPPPYLOFWPRHMB-QGZVFWFLSA-N 477.355 5.002 5 20 JKBD O=C(CCC(=O)c1ccc2ccc3cccc4ccc1c2c34)Nc1cccc(Cn2cncn2)c1 727767454 CGSNEXSMOUETTI-UHFFFAOYSA-N 458.521 5.825 5 20 JKBD C[C@@H](Nc1ccc(C(=O)Nc2ccc(OCc3cccnc3)cc2)cc1[N+](=O)[O-])c1ccccn1 728496081 ORHWNIUTJHPWIH-GOSISDBHSA-N 469.501 5.389 5 20 JKBD COCCSc1ccc([C@H](C)Nc2cc([N+](=O)[O-])c(OC)c(Br)c2[N+](=O)[O-])cc1 728909511 ONVLJFLJZUKPSG-NSHDSACASA-N 486.344 5.186 5 20 JKBD O=C(O[C@@H](C(=O)Nc1ccccc1)c1ccccc1)c1csc(-c2ccc([N+](=O)[O-])cc2)n1 747957836 CRVXWMTTZQBINL-OAQYLSRUSA-N 459.483 5.255 5 20 JKBD Cc1c(C(=O)Nc2cc(C(F)(F)F)ccc2N2CCCCC2)cc([N+](=O)[O-])cc1[N+](=O)[O-] 857716598 HHGWRDZKIWKXQM-UHFFFAOYSA-N 452.389 5.073 5 20 JKBD CC(C)(C)OC(=O)NC1(c2noc(-c3ccc(NCc4ccccc4)c([N+](=O)[O-])c3)n2)CCC1 904558188 VFKKWPMEDUJNKN-UHFFFAOYSA-N 465.510 5.161 5 20 JKBD CC(=O)N(c1cccc(Cl)c1)c1nc(/C=C2/N=C(c3ccc([N+](=O)[O-])c(C)c3)OC2=O)cs1 912758460 KEYZTQYWLWIMMD-VCHYOVAHSA-N 482.905 5.042 5 20 JKBD Cc1cc(C)c(/C=C\C(=O)O[C@@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2C(F)(F)F)cc1C 915494199 ZVQZAYNGQZYNCM-KKTNHOPESA-N 450.413 5.122 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Cl)[C@H](Nc1ccc(OC[C@@H]2CCCO2)cc1)c1ccccc1 917937297 DAMAFYNIHLTSNU-XUZZJYLKSA-N 481.936 5.598 5 20 JKBD Cc1ccc(OCc2ccc(C(=O)N(Cc3nnc(-c4cccc([N+](=O)[O-])c4)o3)C(C)C)o2)c(C)c1 919681170 OZOFYZCSCGFIQT-UHFFFAOYSA-N 490.516 5.484 5 20 JKBD O=C(Cc1cccc([N+](=O)[O-])c1)Nc1ccc(C2(NC(=O)C34CC(C(F)(F)F)(C3)C4)CCC2)cc1 1785791687 GYWAHLOAYQMYEJ-UHFFFAOYSA-N 487.478 5.004 5 20 JKBD O=C(NC1(c2ccc(NC(=O)[C@H](F)c3ccccc3)cc2)CCC1)c1ccc([N+](=O)[O-])cc1F 1786613239 JRACQEFFLBUJRG-JOCHJYFZSA-N 465.456 5.192 5 20 JKBD Cc1ccc(-c2ccccc2C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cc([N+](=O)[O-])c(O)cc2C)C3)cc1 1800604624 AZRZVICFMCMTLR-KOUNCHBCSA-N 499.567 5.150 5 20 JKBD CC(C)c1ccc(C(=O)Nc2cc([C@H]3CCCCN3C(=O)/C=C/c3ccc([N+](=O)[O-])o3)[nH]n2)cc1 1820590522 WIGHFTUOJYPULU-XMZCSZCVSA-N 477.521 5.054 5 20 JKBD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2ccccc2)[nH]n1)c1cc2cc([N+](=O)[O-])ccc2s1 1821609317 CFNFTNILAXLDBK-IBGZPJMESA-N 475.530 5.152 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)N1CCCC[C@H]1C1CCN(C(=O)C23CCC(CC2)CC3)CC1 1830728472 CRQGBYOASJJEIL-OZGZLMSGSA-N 485.600 5.246 5 20 JKBD Cc1cc2ccccc2c2c1op(N1C[C@@H](C)O[C@H](C)C1)oc1c(C)cc3ccccc3c12 2382215204 JZJCPVUIWMCYHM-WOJBJXKFSA-N 457.510 7.958 5 20 JKBD C[C@@H](Sc1nnc(-c2ccccc2Cl)n1C)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 9810105 ZAIRDXDFXMSFSH-SNVBAGLBSA-N 485.875 5.182 5 20 JKBD COc1cccc([C@H](CNC(=O)c2ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])c(OC)c2)N(C)C)c1 18016939 ADCHCSFCAPWULN-NRFANRHFSA-N 499.951 5.090 5 20 JKBD O=C(Cn1cc([N+](=O)[O-])cn1)Nc1cc(Cl)ccc1Oc1ccc(C(=O)c2ccccc2)cc1 28281951 ZORFEMNCBADQQL-UHFFFAOYSA-N 476.876 5.107 5 20 JKBD Cc1csc(Sc2ccc([N+](=O)[O-])cc2C(=O)OCC(=O)Nc2ccccc2C(C)C)n1 28832357 KTSKZUCXHDWKGZ-UHFFFAOYSA-N 471.560 5.430 5 20 JKBD O=[N+]([O-])c1cc(/C=C2\SC(=S)N=C2O)ccc1Sc1ccc(Br)cc1 34895743 NXVWMRWFCYOOSH-ZSOIEALJSA-N 453.364 5.838 5 20 JKBD COc1cccc(-c2nn(-c3ccc(C)cc3)cc2C(=O)Nc2cc([N+](=O)[O-])ccc2OC)c1 45354731 BDOPGXHTRXIFDC-UHFFFAOYSA-N 458.474 5.025 5 20 JKBD COc1ccc(NC(=O)c2ccc([N+](=O)[O-])c(C)c2)cc1NC(=O)c1ccc(Cl)cc1F 59784267 BVBKNUFLDPSPSF-UHFFFAOYSA-N 457.845 5.209 5 20 JKBD O=[N+]([O-])c1ccc(-c2noc(CSc3nnc(-c4ccccc4)c(-c4ccccc4)n3)n2)cc1 69628512 JNPGEWCBLLFCMA-UHFFFAOYSA-N 468.498 5.456 5 20 JKBD O=C(Nc1cc(-c2nnc3n2CCCCC3)ccc1F)c1ccc(Nc2ccccc2)c([N+](=O)[O-])c1 105725670 KQOYGBLRSXJKFC-UHFFFAOYSA-N 486.507 5.715 5 20 JKBD COc1ccc([C@H](Cc2ccccc2C)NC(=O)c2cc(SC)c(OC)cc2[N+](=O)[O-])cc1OC 483612440 ICYPTNRKSQORFF-FQEVSTJZSA-N 496.585 5.365 5 20 JKBD Cc1cc(NC(=O)c2ccc(N3C[C@@H](C)C[C@H](C)C3)c([N+](=O)[O-])c2)ccc1NC(=O)c1ccco1 490149585 UDKLMCSZBTXXMH-IRXDYDNUSA-N 476.533 5.483 5 20 JKBD C[C@@H](c1cc(F)ccc1F)N(C)C(=O)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 498572568 AXHFGQHWPAOSRT-ZDUSSCGKSA-N 471.426 5.328 5 20 JKBD C[C@@H](Nc1ccc(C(=O)Nc2cccc(NC(=O)c3ccoc3)c2)cc1[N+](=O)[O-])c1ccccn1 499621839 VSYLHSBTTSWYDZ-MRXNPFEDSA-N 471.473 5.261 5 20 JKBD C[C@@H](Nc1ccc(C(=O)Nc2nc(-c3cc(F)ccc3F)cs2)cc1[N+](=O)[O-])c1ccccn1 506233806 OLBFOCOLJVMYEP-CYBMUJFWSA-N 481.484 5.817 5 20 JKBD CCCOc1ccc(Oc2ncccc2CNc2ccc([N+](=O)[O-])c(C(=O)N3CCCC3)c2)cc1 510727031 JSOHANITRFMMFU-UHFFFAOYSA-N 476.533 5.419 5 20 JKBD COc1ccc(NC(=O)c2ccc(N3CCC[C@@H](C)C3)c([N+](=O)[O-])c2)cc1OCC(F)(F)F 518227984 FSGBQKAZVSKKTI-CQSZACIVSA-N 467.444 5.033 5 20 JKBD CSc1ccc(C(=O)c2ccccc2C(=O)N2CC3C[C@H]4CC2C[C@@H](C3)C4)cc1[N+](=O)[O-] 521550392 NGFSQOLQNLKINY-GIOYIUAESA-N 450.560 5.198 5 20 JKBD C[C@@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)N1CCC[C@H](c2nc(-c3ccc(Cl)cc3)no2)C1 522506102 KNJLUXKZQDNIJM-ZBFHGGJFSA-N 472.954 5.185 5 20 JKBD CCOc1cc([N+](=O)[O-])c(C(=O)Nc2sc3c(c2C(=O)OC(C)C)CC[C@H](C)C3)cc1OC 603673393 ORKLMWBWABXDHJ-ZDUSSCGKSA-N 476.551 5.006 5 20 JKBD C[C@H](Sc1nnc(-c2ccccc2)n1[C@H](C)c1ccccc1)C(=O)Nc1cccc([N+](=O)[O-])c1 603917400 PPRZFSJKCVJYHC-MSOLQXFVSA-N 473.558 5.582 5 20 JKBD Cc1ccc(NC(=O)c2cccc(C(F)(F)F)c2)cc1NS(=O)(=O)c1c(C)cccc1[N+](=O)[O-] 604447735 FDLQBKJKIPQRTD-UHFFFAOYSA-N 493.463 5.284 5 20 JKBD CO[C@@H](C)c1cccc(N[C@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Br)c2ccccc2)c1 608889099 IASZWNZSQPFKQC-NYHFZMIOSA-N 484.350 5.857 5 20 JKBD Cn1cc(C(=O)Nc2ccc(-c3nc4c(Cl)cccc4[nH]3)cc2)c(-c2ccc([N+](=O)[O-])cc2)n1 608947949 JSJOXCJJAYVQFE-UHFFFAOYSA-N 472.892 5.444 5 20 JKBD O=C(Nc1nc(-c2ccccc2OC(F)F)cs1)C1CCN(c2ccccc2[N+](=O)[O-])CC1 609021917 YOZUHPARIBUNNP-UHFFFAOYSA-N 474.489 5.175 5 20 JKBD O=[N+]([O-])c1ccc(-c2ccc(CNC[C@H](O)c3ccccc3C(F)(F)F)o2)c(Br)c1 726606794 NCAHXWCUNYHBDC-SFHVURJKSA-N 485.256 5.459 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)Nc2cc(NC(=O)OC(C)(C)C)ccc2F)cc1SC 728465155 HGSFNSXNRWVXGL-UHFFFAOYSA-N 451.476 5.064 5 20 JKBD CCOC(=O)c1c(-c2ccccc2)csc1NC(=O)c1cc(OCC)c(OC)cc1[N+](=O)[O-] 747400857 UREUWHPEWVSRSM-UHFFFAOYSA-N 470.503 5.160 5 20 JKBD CC1CCN(c2ccc([N+](=O)[O-])cc2C(=O)N(C)C[C@H]2CCCO[C@H]2c2ccccc2)CC1 747785059 RIPCYDOELPXPDI-BWKNWUBXSA-N 451.567 5.071 5 20 JKBD CCOc1cc(C(=O)O[C@@H](C)c2ccccc2NC(=O)c2ccccc2)c([N+](=O)[O-])cc1OC 748015072 MRRMHHJQKUGCJJ-INIZCTEOSA-N 464.474 5.172 5 20 JKBD C[C@H](OC(=O)CSc1ccccc1[N+](=O)[O-])C(=O)Nc1ccccc1Oc1ccccc1 856204488 ZQHLFTBOTSJRJG-INIZCTEOSA-N 452.488 5.050 5 20 JKBD C[C@@H](Cc1ccco1)C(=O)NC1(c2ccc(NC(=O)CCc3cccc([N+](=O)[O-])c3)cc2)CCC1 1786601420 MKFXMOHHMROPNS-IBGZPJMESA-N 475.545 5.133 5 20 JKBD Cc1cnoc1C(=O)Nc1ccc(C2(NC(=O)c3cc4cc([N+](=O)[O-])ccc4s3)CCC2)cc1 1789980174 OGUHUWISQMGKII-UHFFFAOYSA-N 476.514 5.167 5 20 JKBD COc1cc(CC(=O)Nc2ccc(C3(NC(=O)c4cccc5ccoc45)CCC3)cc2)ccc1[N+](=O)[O-] 1790479527 PSGPKKDQJPDAIX-UHFFFAOYSA-N 499.523 5.340 5 20 JKBD O=C(NC1(c2ccc(NC(=O)c3nc4cc([N+](=O)[O-])ccc4[nH]3)cc2)CCC1)c1ccc2occc2c1 1790827329 JYUUCUIDKVUWFN-UHFFFAOYSA-N 495.495 5.279 5 20 JKBD O=C(NC1(c2ccc(NC(=O)c3cc4cc([N+](=O)[O-])ccc4s3)cc2)CCC1)c1cccnc1 1791009882 BQQKJUOOMXBDDC-UHFFFAOYSA-N 472.526 5.266 5 20 JKBD Cc1cscc1C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cc(Cl)cc([N+](=O)[O-])c2C)[nH]n1 1818241815 CYGOPXHOQKMCFG-SFHVURJKSA-N 487.969 5.269 5 20 JKBD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2ccc([N+](=O)[O-])cc2F)[nH]n1)[C@@H]1CCC[C@H]2CCCC[C@H]21 1818931160 JGKZDUUPDXAYKY-UYCVCSCRSA-N 497.571 5.369 5 20 JKBD Cc1cc(O)c([N+](=O)[O-])cc1C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cccc3ccccc23)[nH]n1 1821345223 GTOQVDMQJFOSCF-QFIPXVFZSA-N 499.527 5.105 5 20 JKBD Cc1ccc(-c2cc(C(=O)N3CCC([C@@H]4CCCCN4C(=O)c4ccc([N+](=O)[O-])o4)CC3)c[nH]2)cc1 1823610249 BZUTVSTVVPUCLR-QHCPKHFHSA-N 490.560 5.038 5 20 JKBD O=C(c1cc2ccoc2s1)N1CCC([C@H]2CCCCN2C(=O)CCc2cccc([N+](=O)[O-])c2)CC1 1824839984 QYOMNWINUIXMBQ-JOCHJYFZSA-N 495.601 5.269 5 20 JKBD CC1(C)CC(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3cc4cc([N+](=O)[O-])ccc4s3)CC2)C1 1831933129 WHTGODYQVHRZSZ-OAQYLSRUSA-N 483.634 5.479 5 20 JKBD CCn1c(S[C@@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)nnc1-c1ccc(Cl)cc1 9070825 XPVBEFUPPGNPNE-NSHDSACASA-N 466.350 5.299 5 20 JKBD Cc1ccc(NC(=O)[C@H](Sc2ccc3c(c2)OCCCO3)c2ccccc2)c([N+](=O)[O-])c1 10603280 VEJJBWJSIXBYTO-HSZRJFAPSA-N 450.516 5.537 5 20 JKBD O=C(CCc1c(-c2ccccc2)[nH]c2ccc(F)cc12)OCc1nnc(-c2ccc([N+](=O)[O-])cc2)o1 10636407 RRZFFIOVUKLFRD-UHFFFAOYSA-N 486.459 5.608 5 20 JKBD CC(C)CCSc1ccc(C(=O)N(C)CC(=O)Nc2c(Cl)cccc2Cl)cc1[N+](=O)[O-] 15527834 MPZLQFVHRQWZEC-UHFFFAOYSA-N 484.405 5.751 5 20 JKBD O=C(C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1)N1CCC[C@@H]1c1cccs1 15788060 KTFKRGMEBBKVEP-QGZVFWFLSA-N 453.486 5.255 5 20 JKBD Cc1c(C(=O)O[C@@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)oc2ccc(Br)cc12 17662634 YTNQHWVXGQMBHN-NSHDSACASA-N 472.251 5.380 5 20 JKBD CCN(CC)S(=O)(=O)c1ccc(Oc2nc(-c3ccccc3)c3ccccc3n2)c([N+](=O)[O-])c1 18055828 AOJHIIRIIOOBIX-UHFFFAOYSA-N 478.530 5.028 5 20 JKBD COc1cc(Cl)c(C)cc1NC(=O)[C@H](C)Sc1nc2cc3ccccc3cc2c(=O)n1C 18591179 PZPBTVBSYOTSLU-AWEZNQCLSA-N 467.978 5.176 5 20 JKBD COc1ccc(/C=C2\N=C(S[C@H](C)c3cccc([N+](=O)[O-])c3)N(c3cccc(OC)c3)C2=O)cc1 21603727 CZLVIUYSFGHQSX-SNNLMFDCSA-N 489.553 5.850 5 20 JKBD CSc1ccc(C(=O)O[C@@H](C)C(=O)Nc2ccccc2Oc2ccccc2)cc1[N+](=O)[O-] 22161797 WOJLWWXDGXYVAK-HNNXBMFYSA-N 452.488 5.293 5 20 JKBD Cc1c(NC(=O)[C@@H](C)Sc2nnc(-c3ccco3)n2C2CCCCC2)cccc1[N+](=O)[O-] 22282932 LDBSLEZQRNGRBD-OAHLLOKOSA-N 455.540 5.379 5 20 JKBD C[C@@H](OC(=O)c1ccc(-c2ccc(F)cc2)s1)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 23266733 STRLHZPXRUKFQG-LLVKDONJSA-N 482.411 5.665 5 20 JKBD COc1ccc(CN(C)C(=O)c2ccc(NCc3ccccc3Cl)c([N+](=O)[O-])c2)cc1OC 23493138 ADEUPONWRXYBMV-UHFFFAOYSA-N 469.925 5.150 5 20 JKBD COc1cc2c(cc1OC)[C@@H](c1cccs1)N(C(=O)c1ccc(Cl)cc1[N+](=O)[O-])CC2 24445066 MBMSDOVUXOUUOP-NRFANRHFSA-N 458.923 5.115 5 20 JKBD CCOCc1ccc(CN[C@@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Br)c2ccccc2)cc1 28386497 XXUDDFMHSHVTAA-HSZRJFAPSA-N 498.377 5.363 5 20 JKBD COC(=O)c1cc(NC(=O)c2ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])cc2)c(F)cc1F 31027440 DJOTUBGGBMXOOT-UHFFFAOYSA-N 462.792 5.358 5 20 JKBD O=C(CSc1ccc(C(F)(F)F)cc1[N+](=O)[O-])Nc1cc(N2CCCC2=O)ccc1Cl 71895263 CMYKOQGKUAIGSR-UHFFFAOYSA-N 473.860 5.125 5 20 JKBD Cc1cc(C)n([C@@H](C)C(=O)Nc2ccc(NC(=O)c3ccc(Cl)c([N+](=O)[O-])c3)cc2Cl)n1 72038701 FICMQSADPZCAJR-ZDUSSCGKSA-N 476.320 5.167 5 20 JKBD COc1ccc(NC(=O)c2ccc(N3CCC[C@H](C)C3)c([N+](=O)[O-])c2)cc1OCc1cccnc1 409736762 OAGJQANHAWTNDP-SFHVURJKSA-N 476.533 5.066 5 20 JKBD Cc1nc([N+](=O)[O-])cn1CCC(=O)N1C[C@H](c2ccccc2Cl)c2c([nH]c3ccccc23)[C@@H]1C 488805044 LIVKCNZVUGYVDR-HNAYVOBHSA-N 477.952 5.360 5 20 JKBD CCOc1cc(NC(=O)c2nc(C(C)C)n(-c3ccccc3Cl)n2)c([N+](=O)[O-])cc1OCC 498314954 GXQULWPHUZNXQB-UHFFFAOYSA-N 473.917 5.002 5 20 JKBD O=C(CSc1nnc(COc2ccc(Cl)cc2Cl)o1)Nc1ccc(Cl)cc1[N+](=O)[O-] 501770867 QNGLLLYZNTVYKB-UHFFFAOYSA-N 489.724 5.248 5 20 JKBD CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)c1csc(-c2cc(Br)cs2)n1 501990953 PVHXBVBOYRQQCM-UHFFFAOYSA-N 466.382 5.593 5 20 JKBD CCCn1c(C)cc(-c2csc(NC(=O)c3cn(C)nc3-c3ccc([N+](=O)[O-])cc3)n2)c1C 506021646 KZFNUVUFXYUSRY-UHFFFAOYSA-N 464.551 5.199 5 20 JKBD CCN(Cc1cccc(Br)c1)C(=O)c1ccc(N[C@@H](C)c2ccccn2)c([N+](=O)[O-])c1 506209291 ZAAVJIFKJOHXMR-INIZCTEOSA-N 483.366 5.588 5 20 JKBD C[C@H](Nc1ccc(C(=O)N(C)Cc2cccc(C(F)(F)F)c2)cc1[N+](=O)[O-])c1ccccn1 507402585 LMHOVLBOQZDRQH-HNNXBMFYSA-N 458.440 5.454 5 20 JKBD O=C(c1ccc(Sc2nc3ccccc3s2)c([N+](=O)[O-])c1)N1CCCC[C@@H]1c1ncc[nH]1 509952023 LFNPRVPEGMCCEW-MRXNPFEDSA-N 465.560 5.446 5 20 JKBD O=C(Nc1ccccc1OC[C@@H]1CCCCO1)c1ccc(NCc2ccccc2)c([N+](=O)[O-])c1 510019843 PDLSFLJQOOLCSU-NRFANRHFSA-N 461.518 5.407 5 20 JKBD O=C(Nc1ccccc1CC(c1c[nH]c2ccccc12)c1c[nH]c2ccccc12)c1ccc([N+](=O)[O-])o1 514620632 UTDUBFSDHJISTJ-UHFFFAOYSA-N 490.519 6.777 5 20 JKBD CC[C@H](C)NC(=O)c1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2Sc2ccccc2)c(C)c1 519049837 JBVCKFCQYBRKEZ-KRWDZBQOSA-N 463.559 5.835 5 20 JKBD COc1ccc(COc2cccc(F)c2)cc1N[C@@H](C)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 519888716 ICSFNOWBFOPKAK-HNNXBMFYSA-N 464.453 5.545 5 20 JKBD COc1ccc([C@@H](Cc2ccc(F)cc2)NC(=O)C2CCN(c3ccccc3[N+](=O)[O-])CC2)cc1 520557884 RWRWXRLFQXSFNG-XMMPIXPASA-N 477.536 5.059 5 20 JKBD CCN(CC(=O)Nc1ccccc1C(F)(F)F)c1ccc(C(=O)c2ccccc2)cc1[N+](=O)[O-] 550313287 QQYVKOHODYIWAT-UHFFFAOYSA-N 471.435 5.310 5 20 JKBD CCOc1cc(NC(=O)CCc2ncc(-c3ccccc3Cl)o2)c([N+](=O)[O-])cc1OCC 590646974 IYCUCZDDSWENED-UHFFFAOYSA-N 459.886 5.272 5 20 JKBD Cc1ccc(C)c(OCc2nnc(S[C@@H](C)C(=O)Nc3ccc([N+](=O)[O-])cc3C(F)(F)F)o2)c1 594640109 BJDBIMVIADYBFE-ZDUSSCGKSA-N 496.467 5.312 5 20 JKBD O=C(Nc1nc(-c2ccccc2Cl)cs1)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-] 603727650 JCWSDVOKYOOIRP-UHFFFAOYSA-N 457.817 5.565 5 20 JKBD Cc1ccc(CN(C)[C@@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Br)c2ccccc2)o1 603742707 CQOVICUOKSYYLZ-HXUWFJFHSA-N 458.312 5.071 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Cl)[C@@H](c1ccccc1)N1CCO[C@H](c2ccccc2F)C1 608976085 KOEQJHYYMPAHSS-XZOQPEGZSA-N 469.900 5.141 5 20 JKBD C[C@@H](NCc1ccc(-c2ccc([N+](=O)[O-])cc2Br)o1)c1nc2ccccc2n1C(F)F 609006719 SPOHOLDKEKWXPV-GFCCVEGCSA-N 491.292 6.213 5 20 JKBD Cc1ccc(-c2csc(NC(=O)c3ccc(N4C(=O)c5ccccc5C4=O)cc3)n2)cc1[N+](=O)[O-] 619729385 XOIACXCGPMZPII-UHFFFAOYSA-N 484.493 5.080 5 20 JKBD Cc1cc(O[C@@H](C)c2ccccc2)ccc1NC(=O)[C@@H]1CC(=O)N(c2ccc(F)c([N+](=O)[O-])c2)C1 728010801 JQJMJZRPKMALHL-PKOBYXMFSA-N 477.492 5.174 5 20 JKBD CSc1ccc([N+](=O)[O-])c(C(=O)Nc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(C(F)(F)F)c2)c1 728013500 MYSSKIMSKVDCQE-CHWSQXEVSA-N 469.485 5.201 5 20 JKBD O=C(OCc1cnc2ccccc2c1)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 730698245 DLTZXRMINJDCSS-UHFFFAOYSA-N 459.424 5.122 5 20 JKBD Cc1cccc(-c2nnc([C@@H](C)OC(=O)c3ccc(N4CCC(C)CC4)c([N+](=O)[O-])c3)o2)c1 745931654 YTYOUBLYHIBFCS-QGZVFWFLSA-N 450.495 5.108 5 20 JKBD C[C@H](C(=O)Nc1cc([N+](=O)[O-])ccc1Cl)N1CCC(c2nc(C(C)(C)C)cs2)CC1 750069495 YVGYFXOQMQDBJS-CYBMUJFWSA-N 450.992 5.209 5 20 JKBD COc1cc([C@H](C)NC(=O)c2cc([N+](=O)[O-])ccc2Br)ccc1OC1CCCC1 751085624 ADUGVOHXORMCKL-ZDUSSCGKSA-N 463.328 5.178 5 20 JKBD Cc1c(C(=O)O[C@@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2ccccc2)cnn1-c1ccccc1 792734122 IJBBTRGTRFWNJD-HSZRJFAPSA-N 490.903 5.279 5 20 JKBD Cc1ccc(N2C(=O)CC[C@H](C(=O)Nc3cc([N+](=O)[O-])c(F)cc3F)[C@@H]2c2cccs2)cc1 825487357 APQGVBZYJMKBGK-OYHNWAKOSA-N 471.485 5.366 5 20 JKBD C[C@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)O[C@H](C)C(=O)Nc1ccccc1Cc1ccccc1 856620274 IBURIQIHPBXAOS-MSOLQXFVSA-N 464.543 5.237 5 20 JKBD Cc1cccc(-c2noc(COC(=O)c3ccccc3C(=O)c3ccc(Cl)c([N+](=O)[O-])c3)n2)c1 915368705 KBZXHYBEACWWIS-UHFFFAOYSA-N 477.860 5.195 5 20 JKBD COc1ccc(C(=O)Nc2cc(Cl)c([N+](=O)[O-])cc2OCc2ccccc2)cc1OC(F)F 915829580 WGYPEBWMYGYPFE-UHFFFAOYSA-N 478.835 5.690 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Cl)[C@H](Nc1cccc(N2CCCCC2)c1)c1ccccc1 920061824 JITQICGRRBQAHC-XMMPIXPASA-N 464.953 6.030 5 20 JKBD O=C(NC1(c2ccc(NC(=O)c3ccc([N+](=O)[O-])o3)cc2)CCC1)c1cnc2ccc(Cl)cc2c1 1785751237 UMIYMYOGKGFCHT-UHFFFAOYSA-N 490.903 5.451 5 20 JKBD O=C(NC1(c2ccc(NC(=O)[C@@H]3C[C@H]3C3CC3)cc2)CCC1)c1cc(Br)ccc1[N+](=O)[O-] 1786056020 JQJSTNFAVXVJLV-RBUKOAKNSA-N 498.377 5.151 5 20 JKBD O=C(/C=C/c1ccc([N+](=O)[O-])o1)Nc1ccc(C2(NC(=O)CCC3CCCC3)CCC2)cc1 1786206147 APWREKPDTYSWJT-SDNWHVSQSA-N 451.523 5.306 5 20 JKBD Cc1cc(CCCC(=O)Nc2ccc(C3(NC(=O)c4cncs4)CCC3)cc2)c([N+](=O)[O-])cc1F 1786274954 RXTDCMWSDAQADH-UHFFFAOYSA-N 496.564 5.269 5 20 JKBD O=C(NC1(c2ccc(NC(=O)c3ccc([N+](=O)[O-])cc3F)cc2)CCC1)c1ccc2cc[nH]c2c1 1790621811 IHKAFGPQOIXVAM-UHFFFAOYSA-N 472.476 5.277 5 20 JKBD CC[C@@H](C)[C@@H](C(=O)N1CCC2(CCCN(C(=O)Cc3cccc([N+](=O)[O-])c3)C2)CC1)c1ccccc1 1804751434 QJAFMBAXLSKPDN-AJTFRIOCSA-N 491.632 5.198 5 20 JKBD COc1cc(C(=O)N2CCC([C@H]3CCCCN3C(=O)c3cc(C)cc(Cl)c3)CC2)ccc1[N+](=O)[O-] 1832612539 WUEXCXHQXCSRKP-JOCHJYFZSA-N 499.995 5.112 5 20 JKBD CC(=O)Nc1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2Sc2ccc(Cl)cc2)cc1Cl 12734964 IXORYWCLSBTHAY-UHFFFAOYSA-N 476.341 6.264 5 20 JKBD COc1ccc([C@@H]2Nc3ccccc3C(=O)N2Cc2ccco2)cc1OCc1ccc([N+](=O)[O-])cc1 15248861 GFUCFZKRPZPZMX-AREMUKBSSA-N 485.496 5.542 5 20 JKBD COc1ccc(C)cc1NC(=O)[C@H](C)OC(=O)c1ccc(Sc2nc(C)cs2)c([N+](=O)[O-])c1 16903600 JNKKGLCKEBDTJU-AWEZNQCLSA-N 487.559 5.012 5 20 JKBD COc1cc(-c2nnc(S[C@H](C)c3cccc([N+](=O)[O-])c3)n2C2CCCCC2)cc(OC)c1OC 21602899 NUNWZFPDWYBEBL-MRXNPFEDSA-N 498.605 6.238 5 20 JKBD CCOc1cc(C(=O)NC[C@H]2CC3c4ccccc4C2c2ccccc23)c([N+](=O)[O-])cc1OC 22878631 PCNRSPBZMCWMME-SIMYWZFQSA-N 458.514 5.029 5 20 JKBD C[C@@H](Sc1ccc(C(F)(F)F)cn1)C(=O)Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1 25827723 RFIOXEIPZQDMIU-SNVBAGLBSA-N 454.455 5.251 5 20 JKBD CN(CCCNC(=O)c1cc([N+](=O)[O-])ccc1Sc1ccc(Cl)cc1)CC(F)(F)F 478909732 SQGCSOWLKSOIBN-UHFFFAOYSA-N 461.893 5.013 5 20 JKBD O=C(Nc1ccc(F)c(NS(=O)(=O)c2cccs2)c1)c1cc2ccccc2c2cccnc12 485761236 IWDCVCRUZLIERG-UHFFFAOYSA-N 477.542 5.642 5 20 JKBD CSc1ccc(C(=O)c2ccccc2C(=O)Nc2cccc(OCc3cccnc3)c2)cc1[N+](=O)[O-] 502092674 NQUJKCRUDMQSMO-UHFFFAOYSA-N 499.548 5.774 5 20 JKBD COc1ccc(NC(=O)c2ccc(N[C@H](C)c3ccccn3)c([N+](=O)[O-])c2)cc1OCc1cccnc1 506235595 WOLXHNRMNCKEDV-GOSISDBHSA-N 499.527 5.398 5 20 JKBD Cc1nn(Cc2ccc(C(=O)N(C)Cc3ccccc3-c3ccccc3)cc2)c(C)c1[N+](=O)[O-] 506504826 OTKBDZWTQJCSGG-UHFFFAOYSA-N 454.530 5.396 5 20 JKBD CC[C@@]1(c2ccc(NC(=O)c3cc([N+](=O)[O-])ccc3Sc3ccccc3)cc2)CCC(=O)NC1=O 509402993 YJNOAUFJCVEXKD-SANMLTNESA-N 489.553 5.083 5 20 JKBD COc1cc([N+](=O)[O-])ccc1NC(=O)CSc1nnc(-c2ccccc2)n1[C@@H](C)c1ccccc1 515487191 VIBDAYRBFWFCGV-KRWDZBQOSA-N 489.557 5.202 5 20 JKBD O=C(Nc1ccc(C(=O)N2CCc3ccc([N+](=O)[O-])cc32)cc1)c1cc(Cl)cc(Cl)c1 515883823 LYTQFCXFSIYLQM-UHFFFAOYSA-N 456.285 5.357 5 20 JKBD Cc1c(NC(=O)C(=O)NC(c2ccc(Cl)cc2)c2ccc(Cl)cc2)cccc1[N+](=O)[O-] 516443681 INMWTNWFVJSHET-UHFFFAOYSA-N 458.301 5.054 5 20 JKBD Cc1ncsc1CN(C)C(=O)c1ccccc1Sc1ccc(C(F)(F)F)cc1[N+](=O)[O-] 518699617 FETFEQNWMJSTNB-UHFFFAOYSA-N 467.494 5.802 5 20 JKBD COc1cc(C(=O)Nc2ccc(NC(=O)C3CC3)nc2)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 521789832 HUIIDFIYRPWTRO-UHFFFAOYSA-N 482.880 5.045 5 20 JKBD Cc1nn(-c2ccccc2)c(C)c1CNCc1ccc(-c2ccc([N+](=O)[O-])cc2Br)o1 521821209 HSSNZONYUOBUHR-UHFFFAOYSA-N 481.350 5.710 5 20 JKBD Cc1ccc(NC(=O)[C@@H](Sc2nnc(-c3ccccc3F)o2)c2ccccc2)c([N+](=O)[O-])c1 592943589 IGBNJTQGHZZGNY-FQEVSTJZSA-N 464.478 5.564 5 20 JKBD O=C(Nc1nc(-c2ccc(OC(F)F)cc2)cs1)c1ccc(N2CCCC2)c([N+](=O)[O-])c1 601063990 BEFOHGOOQXMHCC-UHFFFAOYSA-N 460.462 5.172 5 20 JKBD O=C(Nc1cccc(CNCc2ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])cc2)c1)C1CCC1 603557165 SSUQYRXMNRRYID-UHFFFAOYSA-N 465.937 6.069 5 20 JKBD COc1cc(C)ccc1Oc1ccc(NC(=O)c2cc(OCC(F)(F)F)ccc2[N+](=O)[O-])cn1 603741374 SLOWSISAXMCQAW-UHFFFAOYSA-N 477.395 5.293 5 20 JKBD O=C(Nc1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2Sc2ccccc2)cc1Cl)c1ccco1 604119286 JOOXADURYNOBKG-UHFFFAOYSA-N 493.928 6.497 5 20 JKBD C[C@@H]1CCCN(c2ccc(C(=O)N3C[C@@H](C(F)(F)F)C[C@H](C(F)(F)F)C3)cc2[N+](=O)[O-])C1 604257589 IFFGIOGXUBNOMD-SNPRPXQTSA-N 467.410 5.034 5 20 JKBD COc1cc(C(=O)N2CC[C@@H](Nc3ccccc3)C2)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 609113308 CUICFEWCAHJBDF-LJQANCHMSA-N 467.909 5.376 5 20 JKBD COc1cc(CSc2nc(O)c3c4c(sc3n2)CCCC4)c([N+](=O)[O-])cc1OC(F)F 619237426 WLNQKAQAMVDCFU-UHFFFAOYSA-N 469.491 5.086 5 20 JKBD O=[N+]([O-])c1ccc(Sc2nnc(COc3ccccc3F)n2-c2ccccc2)c2ccncc12 619675734 AMQKPLFSGALVFO-UHFFFAOYSA-N 473.489 5.593 5 20 JKBD Cc1[nH]nc(C(=O)Nc2nc(-c3cc(C)n(Cc4ccccc4Cl)c3C)cs2)c1[N+](=O)[O-] 749720267 YIAXDXCLUXXHHL-UHFFFAOYSA-N 470.942 5.122 5 20 JKBD CCOc1ccc([C@H](C)Nc2cc([N+](=O)[O-])c(OC)c(Br)c2[N+](=O)[O-])cc1OCC 835071657 RSJUVLSUFSNUEW-NSHDSACASA-N 484.303 5.245 5 20 JKBD O=C(Nc1ccccc1C(=O)Nc1cccc(OC(F)(F)F)c1)c1ccc([N+](=O)[O-])cc1Cl 881451432 VBFLLMJYCMOQCL-UHFFFAOYSA-N 479.798 5.651 5 20 JKBD O=C(OCc1nnc(-c2ccc(Br)o2)o1)c1cc([N+](=O)[O-])ccc1Oc1ccccc1 917257405 NIUFDWXQDLGLCH-UHFFFAOYSA-N 486.234 5.150 5 20 JKBD COc1c([N+](=O)[O-])cc(NCc2nc3cc(Cl)ccc3s2)c([N+](=O)[O-])c1Br 920486240 UZEHDNZZWIFEGY-UHFFFAOYSA-N 473.692 5.149 5 20 JKBD CC(C)c1nc(COC(=O)C/C(=C/c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)no1 920514333 UYDHZBZQMOCNOT-WJDWOHSUSA-N 464.503 5.385 5 20 JKBD COc1cc(C2SCCS2)ccc1OC(=O)[C@H](C)Oc1ccc(Cl)cc1[N+](=O)[O-] 920789764 CHPNQRMPDPBQIO-NSHDSACASA-N 455.941 5.108 5 20 JKBD C[C@H](Nc1ccc(C(=O)N(C)c2ccccc2-c2ccccc2)cc1[N+](=O)[O-])c1ccccn1 920819672 JOXTYLDDGFZKER-IBGZPJMESA-N 452.514 6.107 5 20 JKBD Cc1c(C(=O)Nc2ccccc2C(=O)Nc2cccc(C(F)(F)F)c2)cc([N+](=O)[O-])cc1[N+](=O)[O-] 920819843 MHYRRICSEUAJTP-UHFFFAOYSA-N 488.378 5.335 5 20 JKBD COc1ccc(C(=O)NC2(c3ccc(NC(=O)/C=C/c4ccc([N+](=O)[O-])o4)cc3)CCC2)c(Cl)c1 1786207932 AGFSXVJYZWDDKW-DHZHZOJOSA-N 495.919 5.311 5 20 JKBD O=C(NC1(c2ccc(NC(=O)c3cc(Cl)c(F)cc3F)cc2)CCC1)c1ccc([N+](=O)[O-])o1 1790611993 RSNYQERCEUNIMU-UHFFFAOYSA-N 475.835 5.181 5 20 JKBD O=C(c1cc(F)cc([N+](=O)[O-])c1)N1CCC2(CCCN(C(=O)C3(c4ccccc4)CCCC3)C2)CC1 1805240624 MDZCCRBVEVOIPK-UHFFFAOYSA-N 493.579 5.091 5 20 JKBD CC(C)[C@H]1CC[C@H](C(=O)N2CCC3(CCCN(C(=O)CCc4cccc([N+](=O)[O-])c4)C3)CC2)CC1 1806494748 YQXFBQOLOMHTHW-RQNOJGIXSA-N 483.653 5.221 5 20 JKBD CC1(C)CCC(CC(=O)N2CCCC[C@@H]2c2cc(NC(=O)c3ccc([N+](=O)[O-])cc3F)n[nH]2)CC1 1821051640 CSEQYTPWVYFOQV-OAQYLSRUSA-N 485.560 5.369 5 20 JKBD O=C([C@@H]1CCC[C@@H]2CCCC[C@H]21)N1CCC([C@@H]2CCCCN2C(=O)c2ccc([N+](=O)[O-])o2)CC1 1823614499 LUXNLZISMZENPO-PDGJWGCVSA-N 471.598 5.028 5 20 JKBD Cc1cc(C(=O)OCC(=O)Nc2ccc([N+](=O)[O-])cc2C(F)(F)F)c(C)n1C1CCCCC1 17941160 WEDNJHCOYJIJFG-UHFFFAOYSA-N 467.444 5.333 5 20 JKBD CCOC(=O)c1sc(-c2ccc(OC)c(OC)c2)cc1NC(=O)c1ccc([N+](=O)[O-])cc1Cl 19212186 QFSNHIPOBDXTGW-UHFFFAOYSA-N 490.921 5.423 5 20 JKBD COc1ccccc1NC(=O)Cc1nc(COC(=O)c2c3ccccc3cc3ccccc23)cs1 22112352 AOSAWGZBMLHMNO-UHFFFAOYSA-N 482.561 5.996 5 20 JKBD COc1cc(C(=O)Nc2nc(-c3ccc(Br)cc3)c(C)s2)c([N+](=O)[O-])cc1OC 22372664 KJEUJPJXPLTLHG-UHFFFAOYSA-N 478.324 5.059 5 20 JKBD COc1ccc(NC(=O)[C@H](C)OC(=O)c2ccc(COc3ccc4ccccc4c3)o2)c([N+](=O)[O-])c1 24070286 NCGFSZMDOMYEDX-INIZCTEOSA-N 490.468 5.113 5 20 JKBD O=C(NC1CCN(C(=O)c2ccoc2)CC1)c1cc([N+](=O)[O-])ccc1Sc1ccc(Cl)cc1 45892492 GPPNFFFHPUFYCA-UHFFFAOYSA-N 485.949 5.027 5 20 JKBD C[C@H](NC(=O)[C@@H](C)Sc1ccc([N+](=O)[O-])cc1)c1ccc(NC(=O)c2ccc(F)cc2)cc1 71988240 QJFVBXCEIUFAIQ-JKSUJKDBSA-N 467.522 5.344 5 20 JKBD O=C(Nc1c(F)cccc1N1CCCC1)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 110640283 RAQLWDFABYNOKE-UHFFFAOYSA-N 480.462 5.208 5 20 JKBD O=C(Nc1ncn(Cc2cccc(Br)c2)n1)c1cc2ccccc2c2cccnc12 195749310 IVAXLJLOTYJPQV-UHFFFAOYSA-N 458.319 5.043 5 20 JKBD COc1cc(C(=O)Nc2c(C)c(C(C)(C)C)nn2-c2ccccc2)c([N+](=O)[O-])cc1OC(F)F 410016925 RPGUMYBSZLPJIA-UHFFFAOYSA-N 474.464 5.249 5 20 JKBD C[C@@H]1C[C@@H](C)CN(c2ccc(C(=O)Nc3ccc(N(C)C)cc3C(F)(F)F)cc2[N+](=O)[O-])C1 485293118 ZOAFZIQFJLBPHI-HUUCEWRRSA-N 464.488 5.414 5 20 JKBD C[C@H]1C[C@@H](C)CN(c2ccc(C(=O)Nc3cc(N4CCCC4=O)ccc3Cl)cc2[N+](=O)[O-])C1 485376041 IJRQZJFPGBVQJO-IYBDPMFKSA-N 470.957 5.110 5 20 JKBD CCCN(CCC)C(=O)c1ccc(NC(=O)c2csc(-c3cccc([N+](=O)[O-])c3)n2)cc1 496241113 AKQKRLVRGQZUIQ-UHFFFAOYSA-N 452.536 5.233 5 20 JKBD O=C(C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)Nc1cccc(N2CCCC2=O)c1 503140362 KEZAMPJLLAHUFP-XDJHFCHBSA-N 498.564 5.901 5 20 JKBD CC(=O)CCc1ccc(OCc2cccc(C(=O)N3c4ccc([N+](=O)[O-])cc4C[C@@H]3C)c2)cc1 504382641 VGYKALVOGNEGJS-SFHVURJKSA-N 458.514 5.287 5 20 JKBD COc1cc(C(=O)Nc2ccc(NC3CCOCC3)cc2)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 513070495 QHCQIIHFVLZTHU-UHFFFAOYSA-N 497.935 5.892 5 20 JKBD COc1cc(OC)c(CNCc2ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])cc2)c(OC)c1 513072449 AMVVPIJVGADPFM-UHFFFAOYSA-N 458.898 5.356 5 20 JKBD CC(=O)Nc1cccc([C@H](C)NCc2cn(-c3ccccc3)nc2-c2ccc([N+](=O)[O-])cc2)c1 520206801 NLKMJQXRMBSBGE-SFHVURJKSA-N 455.518 5.257 5 20 JKBD O=C(NCc1ccccc1[N+](=O)[O-])Nc1ccc2c(c1)CCC(=O)N2Cc1ccc(Cl)cc1 521671578 NWVIPGRWKJYJNC-UHFFFAOYSA-N 464.909 5.049 5 20 JKBD O=C(CSc1cccc(Cl)c1)Nc1c(Br)cc([N+](=O)[O-])cc1Br 522391334 QAOKXEGGTZEETI-UHFFFAOYSA-N 480.565 5.504 5 20 JKBD O=C(Nc1ccnn1Cc1cccc2ccccc12)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-] 603759663 RWCQQABTQGBVHP-UHFFFAOYSA-N 470.407 5.186 5 20 JKBD Cc1ccc(C(=O)C2CCN(C(=O)c3ccc(N4CCC[C@@H](C)C4)c([N+](=O)[O-])c3)CC2)c(C)c1 603875605 TWXMSODGBFVIJG-LJQANCHMSA-N 463.578 5.183 5 20 JKBD O=C(Nc1cc(Cl)ccc1Cl)[C@H]1CCCCN1C(=O)c1c[nH]c2ccc([N+](=O)[O-])cc12 604546034 IAZGQIPBHOXNQD-LJQANCHMSA-N 461.305 5.016 5 20 JKBD O=C(c1cc2cc([N+](=O)[O-])ccc2s1)N1CCC[C@H](c2nc(-c3cccc(F)c3)no2)C1 608817277 KOCRLAHXQQNSOU-AWEZNQCLSA-N 452.467 5.018 5 20 JKBD Cn1ccnc1[C@H](NCc1ccc(-c2ccc([N+](=O)[O-])cc2Br)o1)c1ccc(F)cc1 608835837 XWBDQAOUZXILDK-OAQYLSRUSA-N 485.313 5.369 5 20 JKBD CC(=O)NCc1ccc(-c2csc(NC(=O)c3ccc(Nc4ccccc4)c([N+](=O)[O-])c3)n2)s1 610587019 KTHZWOGNQKGRQU-UHFFFAOYSA-N 493.570 5.412 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])c(Cl)c1)[C@H]1CCCN(C(=O)c2ccc(Cl)c(Cl)c2)C1 727711165 PCVQMIFLUGTLCY-LBPRGKRZSA-N 456.713 5.046 5 20 JKBD COCCOc1ccc(CNC(=O)CCC(=O)c2ccc3ccc4cccc5ccc2c3c45)cn1 727768971 URBIJWRFVHVSAX-UHFFFAOYSA-N 466.537 5.284 5 20 JKBD C[C@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)Oc1ccc(NC(=O)c2ccc(F)cc2)cc1 728243682 PQDBPIYIGDIENM-ZDUSSCGKSA-N 458.829 5.013 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)Nc2nc3ccc(SC(F)F)cc3s2)cc1SC 728454748 WBVOYGVTCNLJMP-UHFFFAOYSA-N 457.505 5.502 5 20 JKBD C[C@H](OC(=O)c1c(Cl)cccc1[N+](=O)[O-])C(=O)Nc1ccc(Cl)cc1C(F)(F)F 730644725 FISTUHRTQFZTIH-QMMMGPOBSA-N 451.184 5.104 5 20 JKBD O=C(Nc1ccc(Cn2cnc3ccccc32)cc1)c1ccc(Br)c([N+](=O)[O-])c1 746388172 SNBKNIKJBDVLME-UHFFFAOYSA-N 451.280 5.008 5 20 JKBD O=C(CSc1nnc(Nc2ccc(SC(F)F)cc2)s1)N1CCc2cc([N+](=O)[O-])ccc21 753502790 OQOORGRVQCOECK-UHFFFAOYSA-N 495.558 5.186 5 20 JKBD CC(C)Cn1cc([C@H]2N(C(=O)c3cc([N+](=O)[O-])ccc3Oc3ccccc3)CC23CCOCC3)cn1 849532005 NJOXGBMRJMWLLS-RUZDIDTESA-N 490.560 5.234 5 20 JKBD COc1cc(CNc2cc(C(=O)N(C)C(C)C)ccc2Cl)ccc1OCc1ccc([N+](=O)[O-])cc1 864004404 ZWQAXBDHCGQTBK-UHFFFAOYSA-N 497.979 5.928 5 20 JKBD O=C(Nc1ccc(OC(=O)c2cccc(OCc3cccnc3)c2)cc1)c1cccc([N+](=O)[O-])c1 916036132 JGYLCJIZZWBELT-UHFFFAOYSA-N 469.453 5.040 5 20 JKBD O=C(Nc1nc(Cc2ccc(Br)cc2)cs1)c1ccc(Cl)cc1[N+](=O)[O-] 918139565 GJBNAVFZEXVGCK-UHFFFAOYSA-N 452.717 5.310 5 20 JKBD Cc1cc(O[C@@H](C)C(=O)O[C@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2C(F)(F)F)ccc1C(C)C 919406745 FEUGEBRCOTYRKH-CABCVRRESA-N 482.455 5.383 5 20 JKBD C[C@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)O[C@@H](C)c1nc(-c2cccc(C(F)(F)F)c2)no1 920778195 KYRKLUBUENSROB-QWRGUYRKSA-N 485.802 5.389 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)c3ccc(C(F)(F)F)cc3F)CCC2)cc1)c1ccc([N+](=O)[O-])[nH]1 1790188652 YVZSBWVYAFHBRO-UHFFFAOYSA-N 490.413 5.142 5 20 JKBD O=C(C[C@@H]1C[C@@H]2CC[C@H]1C2)Nc1ccc(C2(NC(=O)CSc3ccccc3[N+](=O)[O-])CCC2)cc1 1791325278 GLVMHNSGGSJBFT-AABGKKOBSA-N 493.629 5.647 5 20 JKBD CC[C@H](C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc2cc([N+](=O)[O-])ccc2s1)c1ccccc1 1801206879 BENRDURFFPRFLN-IIZPIQPGSA-N 477.586 5.255 5 20 JKBD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2ccc([N+](=O)[O-])cc2F)[nH]n1)[C@@H]1CCC[C@@H]2CCCC[C@@H]21 1818931159 JGKZDUUPDXAYKY-CVFMPKEZSA-N 497.571 5.369 5 20 JKBD C[C@@H](Sc1ccccc1)C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cc(F)cc([N+](=O)[O-])c2)CC1 1824393151 YCCVTUDQXQCJGR-KOSHJBKYSA-N 499.608 5.148 5 20 JKBD O=C(/C=C/c1ccccc1[N+](=O)[O-])N1CCC([C@@H]2CCCCN2C(=O)c2ccc3occc3c2)CC1 1828262322 VDTWVYLTIKHYQA-LJTKGQTQSA-N 487.556 5.288 5 20 JKBD O=C(/C=C/c1ccccc1[N+](=O)[O-])N1CCC([C@@H]2CCCCN2C(=O)c2sccc2Cl)CC1 1829446651 WJXGGOQWPMDQOF-IBDYFIJFSA-N 488.009 5.256 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cc3sccc3[nH]2)CC1 1830733585 MXHPCXSYVXHGRD-OAQYLSRUSA-N 498.580 5.132 5 20 JKBD O=C(C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1)N1CC=C(c2c[nH]c3ccccc23)CC1 14349054 MDKGOFGOFRBQKL-UHFFFAOYSA-N 498.505 5.627 5 20 JKBD COc1cc(C(=O)O[C@H](C)C(=O)Nc2c(C)cccc2C)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 16941327 AUOXQMXVSMEWJS-MRXNPFEDSA-N 498.919 5.850 5 20 JKBD COc1cc(CN(C)C(=O)C2CCN(c3ccccc3[N+](=O)[O-])CC2)ccc1OCc1ccccc1 18134645 HHBYPDFVLFHRMD-UHFFFAOYSA-N 489.572 5.057 5 20 JKBD Cn1cnc([N+](=O)[O-])c1Sc1nnc(-c2ccc(F)cc2)n1-c1ccc(SC(F)F)cc1 26145753 URPSHUJGYBFPKG-UHFFFAOYSA-N 478.481 5.181 5 20 JKBD Cc1cccc(C(C)C)c1NC(=O)COC(=O)c1ccc(NCc2ccccc2)c([N+](=O)[O-])c1 28612767 JACRMKWRNWGFDB-UHFFFAOYSA-N 461.518 5.434 5 20 JKBD CSc1ccc([N+](=O)[O-])c(C(=O)Nc2ccc(NC(=O)c3ccccc3F)cc2C(F)(F)F)c1 69643799 GSEFQKILBJAZFY-UHFFFAOYSA-N 493.438 5.979 5 20 JKBD Cc1ccc(C)c(Sc2ccc(NC(=O)c3cc([N+](=O)[O-])cc(S(C)(=O)=O)c3)cc2)c1 109024361 GFNAXBQRELQRTP-UHFFFAOYSA-N 456.545 5.019 5 20 JKBD CSc1ccc(C(=O)N[C@H](C)c2ccc(NC(=O)c3ccc(F)cc3)cc2)cc1[N+](=O)[O-] 195533604 VXIVGCXDZWWUSF-CQSZACIVSA-N 453.495 5.199 5 20 JKBD CCCN(Cc1nc(O)c2ccc(Cl)cc2n1)C(=O)c1csc(-c2ccc([N+](=O)[O-])cc2)n1 302997314 GVHAGWPPGIPBLZ-UHFFFAOYSA-N 483.937 5.073 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)Nc2ccc3nc(Cc4ccccc4F)[nH]c3c2)cc1SC 483353389 OFFZDSWNPXOYEF-UHFFFAOYSA-N 466.494 5.184 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)Nc2c(C)cnn2[C@H]2CCCc3ccccc32)cc1SC 483700231 PIZBFQHGIUIICJ-SFHVURJKSA-N 452.536 5.008 5 20 JKBD O=C(N[C@@H]1CCN2CCC[C@@H]2C1)c1c2c(nc3ccccc13)/C(=C\c1ccc([N+](=O)[O-])cc1)CCC2 485014289 OGIAHCLCNJPCAE-GMEUVKRLSA-N 482.584 5.377 5 20 JKBD CCCc1ccc([C@@H](NC(=O)c2cc(OCC)c(OC)cc2[N+](=O)[O-])c2cccs2)cc1 503241753 BWBUOSOSOCMJQZ-HSZRJFAPSA-N 454.548 5.536 5 20 JKBD Cc1ccc(S(=O)(=O)Nc2ccc(NC(=O)CCCCC(=O)c3ccccc3)cc2)cc1[N+](=O)[O-] 512103297 CFUJRAWMGWGCOQ-UHFFFAOYSA-N 495.557 5.086 5 20 JKBD O=[N+]([O-])c1ccc(-c2noc(CNc3ccccc3Oc3ncc(Cl)cc3Cl)n2)cc1 515662116 CEIGOVWEZYKTIN-UHFFFAOYSA-N 458.261 5.751 5 20 JKBD CCOc1ccc(Oc2ccc(Cl)cc2NC(=O)C(=O)N[C@H](C)c2cccc([N+](=O)[O-])c2)cc1 516045889 SPSPWTYJSKFUQT-OAHLLOKOSA-N 483.908 5.255 5 20 JKBD Cn1cc(C(=O)Nc2ccc3nc(-c4ccccc4Cl)[nH]c3c2)c(-c2ccc([N+](=O)[O-])cc2)n1 516368752 CEHUMRBIQALENW-UHFFFAOYSA-N 472.892 5.444 5 20 JKBD O=C(c1ccc(N[C@@H](c2ccc(F)cc2)c2ccccc2Cl)c([N+](=O)[O-])c1)N1CCOCC1 517092170 FNQABMDWLISWGF-QHCPKHFHSA-N 469.900 5.061 5 20 JKBD CCOC(=O)c1sc(N(C(=O)[C@@H](C)Oc2ccc(Cl)cc2[N+](=O)[O-])c2ccccc2)nc1C 521250022 KJUMFLKYJUGKON-CQSZACIVSA-N 489.937 5.322 5 20 JKBD O=C(Cc1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1)NCc1csc(Br)c1 521670163 BJUUHTXHPVZPRL-UHFFFAOYSA-N 497.374 5.130 5 20 JKBD Cc1ccc(CN(C)C(=O)C/C(=C\c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)s1 524127932 TYXQSZVKQKJOIN-QGOAFFKASA-N 463.584 6.164 5 20 JKBD COc1ccc(COc2cccc(F)c2)cc1N[C@H](C)C(=O)Nc1cccc([N+](=O)[O-])c1C 558108244 BDCGLEGWAWPBAI-MRXNPFEDSA-N 453.470 5.069 5 20 JKBD O=C(c1cc2ccccc2c2cccnc12)N1CCC[C@@H](c2nc(-c3ccc(F)cc3)no2)C1 588107529 OARAQSVJVYPFGY-LJQANCHMSA-N 452.489 5.597 5 20 JKBD COc1cc(C(=O)Nc2cc(-c3ccccc3)nn2-c2ccc(C)cc2C)c([N+](=O)[O-])cc1OC 603760857 VGNASFMBOWYIEV-UHFFFAOYSA-N 472.501 5.334 5 20 JKBD COc1cc(C(=O)Nc2cc(C(=O)Nc3ccccc3)ccc2C)c([N+](=O)[O-])cc1OC(F)F 603764188 GSPQDMXSWMKNIN-UHFFFAOYSA-N 471.416 5.018 5 20 JKBD C[C@@H](Nc1ccc(NC(=O)c2ccco2)c(Cl)c1)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl 604126638 GOLCHZCHWWBIKW-LLVKDONJSA-N 463.277 5.186 5 20 JKBD O=c1c(Cl)c(NCc2ccccc2COCc2ccccc2)cnn1-c1ccc([N+](=O)[O-])cc1 608830588 HKBZPEFLDVPGSV-UHFFFAOYSA-N 476.920 5.123 5 20 JKBD O=C(c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1)N1CCO[C@@H](c2ccc(F)c(F)c2)C1 608964639 KIIJMZCMPGAOEW-JOCHJYFZSA-N 474.847 5.532 5 20 JKBD CC(C)(C)OC(=O)C1CCN(C(=O)c2cc([N+](=O)[O-])ccc2Sc2ccc(Cl)cc2)CC1 608989178 BDPGARWHKSUTPJ-UHFFFAOYSA-N 476.982 5.593 5 20 JKBD CN1C(=O)CCc2cc(NC(=O)C/C(=C/c3ccc([N+](=O)[O-])cc3)c3nc4ccccc4s3)ccc21 609186042 VDHUQJLBNQLMKD-RGEXLXHISA-N 498.564 5.683 5 20 JKBD C[C@H](N[C@H](C)c1ccc(F)c(Br)c1)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 609387851 KNJBVLCUAIVHQW-ZJUUUORDSA-N 478.240 5.193 5 20 JKBD O=C(COC(=O)c1csc(-c2ccccc2Cl)n1)Nc1ccc(C(F)(F)F)cc1[N+](=O)[O-] 727562955 CKYVQPZVKJKQMD-UHFFFAOYSA-N 485.827 5.186 5 20 JKBD COc1ccc(CSCC(=O)N2CCC[C@@H]2c2ccccc2C(F)(F)F)cc1[N+](=O)[O-] 728034780 FXELJZRLTRVYSK-QGZVFWFLSA-N 454.470 5.219 5 20 JKBD Cc1c(C(=O)Nc2ccc(Oc3ccc(C(F)(F)F)cc3)nc2)cc([N+](=O)[O-])cc1[N+](=O)[O-] 729382538 XRRYNSVYKAFTRV-UHFFFAOYSA-N 462.340 5.270 5 20 JKBD CC(=O)N(c1nc(COC(=O)c2c[nH]c3cc([N+](=O)[O-])ccc23)cs1)c1c(C)cc(C)cc1Cl 756766956 FHVQPXICJQSDMD-UHFFFAOYSA-N 498.948 5.844 5 20 JKBD O=C(Nc1ccc(Br)cc1Br)c1cc([N+](=O)[O-])ccc1N1CCCCC1 855030320 JNAWUSYBFQAQCN-UHFFFAOYSA-N 483.160 5.362 5 20 JKBD C[C@@H](OC(=O)c1ccc(-n2ccnc2)c([N+](=O)[O-])c1)C(=O)N1c2ccccc2Sc2ccccc21 855086508 YRFNTXLXSUQIIW-MRXNPFEDSA-N 486.509 5.155 5 20 JKBD C[C@@H](Nc1ccc(-c2nc(-c3ccc(Br)o3)no2)cc1[N+](=O)[O-])c1ccccn1 904630588 WOUGKGSEBLTFEE-LLVKDONJSA-N 456.256 5.235 5 20 JKBD C[C@H](OC(=O)c1cc2ccccc2c(Cl)n1)C(=O)Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1 915445829 KDGITAVTXLWEPR-LBPRGKRZSA-N 482.905 5.104 5 20 JKBD C[C@@H](NC(=O)c1cc([N+](=O)[O-])ccc1N1CCCCC1)c1cccc(OCc2ccccn2)c1 917756896 TTYCNBDFBBZBOR-LJQANCHMSA-N 460.534 5.050 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)C3CC4(CCC4)C3)CCC2)cc1)c1cccc(F)c1[N+](=O)[O-] 1790702621 QXYDOKUSCVIDHO-UHFFFAOYSA-N 451.498 5.062 5 20 JKBD CC(C)(C)CCCCCC(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cc(O)cc([N+](=O)[O-])c2)n[nH]1 1821262828 CPZIEHWBPCNHJC-NRFANRHFSA-N 485.585 5.326 5 20 JKBD O=C(Nc1cc([C@H]2CCCCN2C(=O)CCc2ccco2)[nH]n1)c1cc2cc([N+](=O)[O-])ccc2s1 1821612063 QMNPXNXLEZGTPN-LJQANCHMSA-N 493.545 5.064 5 20 JKBD CN(C)c1ccc([N+](=O)[O-])c(C(=O)N2CCCC[C@H]2C2CCN(C(=O)/C=C/C3CCCCC3)CC2)c1 1829649452 FMIJLYOXMSYTDS-MYILAFDMSA-N 496.652 5.031 5 20 JKBD O=C(c1cccc(F)c1[N+](=O)[O-])N1CCC([C@@H]2CCCCN2C(=O)c2c(F)cccc2Cl)CC1 1829899006 ISHUAIYFXVTAKI-FQEVSTJZSA-N 491.922 5.074 5 20 JKBD O=C(c1cccc(F)c1[N+](=O)[O-])N1CCC([C@@H]2CCCCN2C(=O)c2cc(F)cc(Cl)c2)CC1 1832629038 LASDQLVUHUBTIB-NRFANRHFSA-N 491.922 5.074 5 20 JKBD COc1ccc(NC(=O)[C@H](Sc2nc3cc4ccccc4cc3c(=O)n2C)c2ccccc2)cc1 16133157 VMDMWCICTUQHAB-RUZDIDTESA-N 481.577 5.567 5 20 JKBD Cc1ccc(-c2nnc(-c3ccc(C(=O)OCC(=O)Nc4cc(Cl)ccc4[N+](=O)[O-])cc3)o2)cc1 16287831 JFXWEUNHNLHNGV-UHFFFAOYSA-N 492.875 5.069 5 20 JKBD Cc1ccc(NC(=O)c2nnc(/C(Cl)=C/c3ccc(-c4ccc([N+](=O)[O-])cc4)o3)s2)cc1 26228658 WYIIJSRHLFVJMB-PDGQHHTCSA-N 466.906 6.004 5 20 JKBD COc1ccc(Oc2ccc([N+](=O)[O-])cc2C(=O)Nc2nc(CN3CCCCC3)cs2)cc1 30558098 AFYBNDSJEWQJHF-UHFFFAOYSA-N 468.535 5.090 5 20 JKBD CCN(C(=O)Cc1ccc(NC(=O)c2ccc(NC3CC3)c([N+](=O)[O-])c2)cc1)c1ccccc1 108340012 OCCDGRRPNFTBNZ-UHFFFAOYSA-N 458.518 5.017 5 20 JKBD C[C@H](Nc1ccc(C(=O)N2CCC[C@H](c3nc4ccccc4o3)C2)cc1[N+](=O)[O-])c1ccccn1 108781256 WTUWXZGXZIUXMQ-HKUYNNGSSA-N 471.517 5.324 5 20 JKBD C[C@H](Nc1ccc(C(=O)N[C@H]2CCSc3ccc(F)cc32)cc1[N+](=O)[O-])c1ccccn1 108788888 POGPPEBUVFPIHB-LIRRHRJNSA-N 452.511 5.269 5 20 JKBD Cc1ccc(NC(=O)C(C)C)cc1NC(=O)c1ccc(N[C@@H](C)c2ccccn2)c([N+](=O)[O-])c1 507072237 QLCUWLUZGXRTMD-KRWDZBQOSA-N 461.522 5.318 5 20 JKBD COc1cc(CNCc2ccc(N3CCCCCC3)nc2)c([N+](=O)[O-])cc1OCc1ccccc1 508105500 UKDVMWNUKJVADQ-UHFFFAOYSA-N 476.577 5.248 5 20 JKBD COc1cc(CNC[C@H]2CCCO[C@H]2c2ccccc2)c([N+](=O)[O-])cc1OCc1ccccc1 509614472 BOINQAQLZXAINR-AMGIVPHBSA-N 462.546 5.440 5 20 JKBD COc1cc(CCC2CCN(C(=O)Cn3c4ccccc4c(=O)c4ccccc43)CC2)cc(OC)c1 514342769 NERCNZGUPYKOED-UHFFFAOYSA-N 484.596 5.043 5 20 JKBD O=C(COc1ccc(-c2ccccc2)cc1[N+](=O)[O-])N1CCC[C@@H]1c1ccc2c(c1)OCCCO2 517914696 UFDHMKQWDWJUGO-JOCHJYFZSA-N 474.513 5.166 5 20 JKBD COc1cc(C(=O)Nc2cc(C)nn2-c2cc(C(F)(F)F)ccc2Cl)c([N+](=O)[O-])cc1OC 590772321 CHPPVXCIJCQMCK-UHFFFAOYSA-N 484.818 5.031 5 20 JKBD O=C(NCc1ccco1)Nc1ccc(NC(=O)c2ccc(Nc3ccccc3)c([N+](=O)[O-])c2)cc1 594754740 BWOFGBOSIXIWTK-UHFFFAOYSA-N 471.473 5.505 5 20 JKBD COc1ccc(CSCC(=O)Nc2nc3cc(C(F)(F)F)ccc3s2)cc1[N+](=O)[O-] 603566820 JHNKHUTWIJWSQQ-UHFFFAOYSA-N 457.455 5.104 5 20 JKBD Cc1nc(C)c(-c2csc(NC(=O)c3ccc(N4CCC(C)CC4)c([N+](=O)[O-])c3)n2)s1 603904438 HLTDTBOGSRKGIZ-UHFFFAOYSA-N 457.581 5.280 5 20 JKBD COc1ccc(CSCC(=O)Nc2ccc(Sc3nc(C)cs3)cc2C)cc1[N+](=O)[O-] 608848535 VUAHWJAZUQJTEM-UHFFFAOYSA-N 475.617 5.700 5 20 JKBD Cc1ccc(Sc2ccc(C(=O)Nc3c(C)nn(C)c3Oc3cccnc3)cc2[N+](=O)[O-])cc1 608961790 KTZDFVZETIMJCS-UHFFFAOYSA-N 475.530 5.536 5 20 JKBD O=C(c1ccc(C(=O)N2CCC[C@@H]2c2ccsc2)cc1[N+](=O)[O-])N1CCC[C@H]1c1ccsc1 609044539 KKTIWPUOYUFMEA-RTWAWAEBSA-N 481.599 5.672 5 20 JKBD Cc1sc(NC(=O)Cc2coc(-c3ccc(Cl)cc3)n2)nc1-c1cccc([N+](=O)[O-])c1 609216911 WJJBOHZEQBTUHT-UHFFFAOYSA-N 454.895 5.516 5 20 JKBD O=[N+]([O-])c1ccc(-c2nn(-c3ccccc3)cc2CNCc2cccc(OC(F)F)c2)cc1 609223625 QQTYJSOIRIIIMK-UHFFFAOYSA-N 450.445 5.339 5 20 JKBD Cc1nc(C)c(CCNC(=O)C/C(=C\c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)s1 609382683 MZYJHZBWQTXCKT-QGOAFFKASA-N 478.599 5.567 5 20 JKBD O=C(Cc1c[nH]c2cc(F)ccc12)O[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1 725947868 ITQMJJNJRDLGQR-QHCPKHFHSA-N 481.867 5.334 5 20 JKBD C[C@@H](OC(=O)C[C@@H](c1ccccc1)C(F)(F)F)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 728654009 SXIOWKZTMWLFCU-RISCZKNCSA-N 478.345 5.220 5 20 JKBD O=C(O[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1)c1ccn(-c2ccccc2F)n1 730604566 JTTJLHVNASIHSN-JOCHJYFZSA-N 494.866 5.110 5 20 JKBD CC(=O)c1cccc(O[C@H](C)C(=O)Oc2ccc(NC(=O)c3cc([N+](=O)[O-])ccc3Cl)cc2)c1 745042461 DVGDAWSAFFTOPZ-OAHLLOKOSA-N 482.876 5.076 5 20 JKBD O=C(COC(=O)c1csc(-c2ccc([N+](=O)[O-])cc2)n1)Nc1ccc(Cl)c(C(F)(F)F)c1 747955908 OMGJVPGXXKXKRR-UHFFFAOYSA-N 485.827 5.186 5 20 JKBD COc1ccc(Br)cc1-c1nc(COC(=O)CCOc2ccccc2[N+](=O)[O-])cs1 919491827 SHANITYOHBFPIQ-UHFFFAOYSA-N 493.335 5.002 5 20 JKBD COc1ccc(C)cc1NC(=O)[C@H](OC(=O)[C@@H](C)Oc1ccc(Cl)cc1[N+](=O)[O-])c1ccccc1 920778138 IILWPDIYVDOLTK-WAIKUNEKSA-N 498.919 5.256 5 20 JKBD O=C(/C=C/c1ccc([N+](=O)[O-])o1)Nc1ccc(C2(NC(=O)[C@@]3(F)CCCCC3(F)F)CCC2)cc1 1786207454 OJCAKVVKLBPPTP-LBQODKDLSA-N 491.466 5.253 5 20 JKBD COc1cc(C(=O)NC2(c3ccc(NC(=O)[C@H]4CCCCC4(F)F)cc3)CCC2)ccc1[N+](=O)[O-] 1786467349 QVRBALALGXILHZ-LJQANCHMSA-N 487.503 5.177 5 20 JKBD O=C(CCc1cccc([N+](=O)[O-])c1)NC1(c2ccc(NC(=O)c3ccnc(Cl)c3)cc2)CCC1 1787380331 UMNNDVHMZMEPFF-UHFFFAOYSA-N 478.936 5.024 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)c3cccc(F)c3[N+](=O)[O-])CCC2)cc1)c1ccoc1Cl 1790206602 GLXQNFZVVFPQPT-UHFFFAOYSA-N 457.845 5.042 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)c3cccc4ncccc34)CCC2)cc1)c1cc(F)cc([N+](=O)[O-])c1 1790696631 PSHPQALMBKQQAQ-UHFFFAOYSA-N 484.487 5.344 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)Nc1ccc(C2(NC(=O)c3cnnc4ccccc34)CCC2)cc1 1790770534 GTIQRXALKPORDA-UHFFFAOYSA-N 499.502 5.047 5 20 JKBD CN(C)c1ccc([N+](=O)[O-])cc1C(=O)Nc1ccc(C2(NC(=O)c3ccc4occc4c3)CCC2)cc1 1790794146 GQPUFEGOMMLEOW-UHFFFAOYSA-N 498.539 5.469 5 20 JKBD COc1cc(C(=O)NC2(c3ccc(NC(=O)[C@]4(F)CCCC=C4F)cc3)CCC2)ccc1[N+](=O)[O-] 1792378163 OIGVBCPFHQQDSE-VWLOTQADSA-N 485.487 5.097 5 20 JKBD COc1ccc(Cl)c(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)c1 1801208360 AFZHICZSPGYKBM-MUJYYYPQSA-N 499.976 5.037 5 20 JKBD O=C(c1cc2cc([N+](=O)[O-])ccc2s1)N1CCCC[C@@H]1c1cc(NC(=O)C2(F)CCCCC2)n[nH]1 1818883293 UOMSJZHAWSGNOF-GOSISDBHSA-N 499.568 5.511 5 20 JKBD CC(C)(Cc1ccccc1)C(=O)N1CCCC[C@H]1C1CCN(C(=O)/C=C/c2ccc([N+](=O)[O-])o2)CC1 1824097260 OSHYKFLWBHSVDO-CWSBKQHBSA-N 493.604 5.090 5 20 JKBD O=C(c1cccc2ccccc12)N1CCC([C@H]2CCCCN2C(=O)c2ccc([N+](=O)[O-])cc2F)CC1 1830497040 WMNXZBVNASQMTP-AREMUKBSSA-N 489.547 5.434 5 20 JKBD CC[C@H]1CC[C@H](C(=O)N2CCCC[C@@H]2C2CCN(C(=O)/C=C/c3ccc([N+](=O)[O-])o3)CC2)CC1 1831691817 PQASKFYHZHIBSF-SMKSDRDFSA-N 471.598 5.037 5 20 JKBD COc1ccc(/C=C2\N=C(SCc3ccc([N+](=O)[O-])cc3)N(c3cccc(OC)c3)C2=O)cc1 9640565 HXPLAYYAXXPQJA-UCQKPKSFSA-N 475.526 5.289 5 20 JKBD O=C(COC(=O)Cn1c2ccccc2c(=O)c2ccccc21)Nc1cccc(Oc2ccccc2)c1 10722642 ZCWRAYFCFXDGLC-UHFFFAOYSA-N 478.504 5.129 5 20 JKBD O=C(O[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1)c1cc(Cl)ccc1F 18799260 SRWFNPMBPDHRMD-IBGZPJMESA-N 463.248 5.578 5 20 JKBD Cc1cccc([N+](=O)[O-])c1NC(=O)CSC1=N/C(=C\c2ccccc2)C(=O)N1c1ccc(F)cc1 23646966 SXYCJTZVMPWGCE-ZHZULCJRSA-N 490.516 5.158 5 20 JKBD CCc1cc(=O)[nH]c(-c2cccc(NC(=O)c3ccc(Oc4ccc(Cl)cc4[N+](=O)[O-])cc3)c2)n1 71931275 WLOVTMOEAHCVNC-UHFFFAOYSA-N 490.903 5.606 5 20 JKBD CC(=O)N(c1nc(/C=C\c2ccc3cccc([N+](=O)[O-])c3n2)cs1)c1ccc(F)cc1F 208896424 PARAXSQEJIHUPG-HJWRWDBZSA-N 452.442 5.733 5 20 JKBD COc1cc(F)c(NC(=O)c2cc([N+](=O)[O-])ccc2Sc2ccc(Cl)cc2)cc1OC 410024645 FOVVVXQLOQOLIE-UHFFFAOYSA-N 462.886 5.808 5 20 JKBD O=C(C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)NCCCn1cnc2ccccc21 486448342 NUEUHZHPKHJGTD-CAPFRKAQSA-N 497.580 5.691 5 20 JKBD O=C(Nc1ccc(S(=O)(=O)Nc2ccc(F)cc2F)cc1)c1cc2ccccc2c2cccnc12 490788638 BZDULUGOLPCITD-UHFFFAOYSA-N 489.503 5.719 5 20 JKBD O=C(Nc1ccc(Cl)c(-c2nnc3n2CCCCC3)c1)c1csc(-c2cccc([N+](=O)[O-])c2)n1 496379968 PNMPCRGSWYDXMX-UHFFFAOYSA-N 494.964 5.609 5 20 JKBD O=C([C@@H]1C[C@H]1c1ccc(Br)cc1)N(Cc1ccccc1[N+](=O)[O-])CC(F)(F)F 499379737 VEVXWNNMXIHWKF-JKSUJKDBSA-N 457.246 5.052 5 20 JKBD CCOc1cc(NC(=O)c2ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])c(OC)c2)ccc1OC 502027303 QHQKIFPCRSCFCE-UHFFFAOYSA-N 472.881 5.709 5 20 JKBD COc1cc(CN[C@H](C)c2cccc(N3CCCC3=O)c2)ccc1OCc1ccc([N+](=O)[O-])cc1 507904102 OJNHXTXWKXZPJI-LJQANCHMSA-N 475.545 5.160 5 20 JKBD COc1ccc(CNCc2ccc(Oc3ccccc3Cl)c([N+](=O)[O-])c2)cc1NC(C)=O 507914235 OERYPYBQEWQWLE-UHFFFAOYSA-N 455.898 5.297 5 20 JKBD COc1ccc2c(-c3ccccc3)c(C(=O)NCCc3cc(OC)c(OC)cc3[N+](=O)[O-])oc2c1 508645073 JTRYHCNRFNODCE-UHFFFAOYSA-N 476.485 5.006 5 20 JKBD CCOc1ccc(Br)cc1CN(C(=O)N[C@H](C)c1cccc([N+](=O)[O-])c1)C1CC1 509471735 PXDHPLQLIBLUNV-CQSZACIVSA-N 462.344 5.191 5 20 JKBD COC(=O)CC1CCN(C(=O)c2ccccc2Sc2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 553012663 SVLLLLUKKJBXPO-UHFFFAOYSA-N 482.480 5.180 5 20 JKBD CC(C)(NC(=O)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-])c1cccc(C(F)(F)F)c1 574296771 SUMYQIFJSIMNKB-UHFFFAOYSA-N 450.335 5.220 5 20 JKBD CN1CCC(N(C)C(=O)c2c3c(nc4ccccc24)/C(=C/c2ccc([N+](=O)[O-])cc2)CCC3)CC1 590780427 ZQYSLFGIJCUPPW-CZIZESTLSA-N 470.573 5.186 5 20 JKBD Cc1cc([N+](=O)[O-])ccc1NC(=O)CCSc1nnc(-c2ccncc2)n1-c1ccc(Cl)cc1 592995265 IRYIGABNIXMODR-UHFFFAOYSA-N 494.964 5.320 5 20 JKBD O=C(C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)Nc1cnn(-c2ccncc2)c1 608899334 AAYHBTYDNDVATN-AQTBWJFISA-N 482.525 5.355 5 20 JKBD COCCOc1cc([N+](=O)[O-])c(C(=O)Nc2nc(-c3ccc4ccccc4c3)cs2)cc1OC 619564368 PXAQFTWKJFUTQL-UHFFFAOYSA-N 479.514 5.158 5 20 JKBD CC(C)[C@@H](OC(=O)Cc1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1)c1ccccn1 750635383 NAOMHAOJTXZEIB-AREMUKBSSA-N 456.502 5.326 5 20 JKBD O=C(Nc1cc(Cl)ccc1Cl)[C@H]1CCCCN1C(=O)c1ccc(Cl)c([N+](=O)[O-])c1 751246582 NSDNDGVNLTZFNS-MRXNPFEDSA-N 456.713 5.188 5 20 JKBD C[C@@H](Cc1noc(-c2ccc(N[C@H](C)c3ccccn3)c([N+](=O)[O-])c2)n1)N(C)C(=O)OC(C)(C)C 904654836 IIETYGXVIDKVLU-JKSUJKDBSA-N 482.541 5.011 5 20 JKBD CCOC(=O)Nc1ccc(NC(=O)c2ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])cc2)cc1 916069251 QJLRQLBXXPMUQC-UHFFFAOYSA-N 455.854 5.861 5 20 JKBD COc1ccc(-c2nn(-c3ccccc3)cc2C(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)c(OC)c1 916694248 AJZLOOQHMMAWOM-UHFFFAOYSA-N 478.892 5.370 5 20 JKBD CC(=O)Nc1cc(C(=O)O[C@@H](C(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)c2ccccc2)ccc1C 919177349 JZGJIAYBVDWRKK-JOCHJYFZSA-N 481.892 5.052 5 20 JKBD CC(=O)N(c1ccc(C)c(C)c1)c1nc(COC(=O)c2cc3cc([N+](=O)[O-])ccc3[nH]2)cs1 919515948 IOTMFAYUBZQLJW-UHFFFAOYSA-N 464.503 5.191 5 20 JKBD CC(=O)N(c1nc(COC(=O)c2cc3cc([N+](=O)[O-])ccc3[nH]2)cs1)c1c(C)cc(C)cc1Cl 919516064 NVJVXKGOXIYQRV-UHFFFAOYSA-N 498.948 5.844 5 20 JKBD Cc1ccc(/C(O)=C(/C(=S)Nc2ccc3c(c2)CCC3)[n+]2ccc(C(C)(C)C)cc2)cc1[N+](=O)[O-] 920396080 PVEYRQMXCNDPLK-UHFFFAOYSA-O 488.633 6.300 5 20 JKBD Cc1noc([C@@H](C)OC(=O)C/C(=C/c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)n1 926630695 IBUHRWWCNIARPW-YYTPVVGHSA-N 450.476 5.131 5 20 JKBD Cc1cc(C)nc(C(=O)Nc2ccc(C3(NC(=O)CSc4ccccc4[N+](=O)[O-])CCC3)cc2)c1 1788352256 IKIQKRBOHHMTPV-UHFFFAOYSA-N 490.585 5.147 5 20 JKBD O=C(CCCC(F)(F)F)NC1(c2ccc(NC(=O)c3cc(F)cc([N+](=O)[O-])c3)cc2)CCC1 1790695305 KXCPJNYPJXHXBP-UHFFFAOYSA-N 467.419 5.214 5 20 JKBD Cc1ccc(CC(=O)NC2(c3ccc(NC(=O)c4cc5ccoc5cn4)cc3)CCC2)cc1[N+](=O)[O-] 1790832753 WQWJPYRMNINESU-UHFFFAOYSA-N 484.512 5.035 5 20 JKBD CC/C=C(\C)C(=O)Nc1ccc(C2(NC(=O)CSc3ccccc3[N+](=O)[O-])CCC2)cc1 1792064981 AIOYYCKQAAQGHL-REZTVBANSA-N 453.564 5.177 5 20 JKBD Cc1cc(CCCC(=O)N2CCCC3(CCN(C(=O)c4ccc(F)cc4)CC3)C2)c([N+](=O)[O-])cc1F 1805821376 LRNGAJHAPNKXRT-UHFFFAOYSA-N 499.558 5.049 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2ccccc2Cl)[nH]n1 1821287154 MYHMPYQOTMXOOP-LJQANCHMSA-N 485.903 5.039 5 20 JKBD O=C(Nc1cc([C@H]2CCCCN2C(=O)C2CCCC2)[nH]n1)c1cc2cc([N+](=O)[O-])ccc2s1 1821610313 YFKQXBDVTCPTIR-GOSISDBHSA-N 467.551 5.029 5 20 JKBD C[C@@]1(C(=O)N2CCC([C@@H]3CCCCN3C(=O)Cc3ccc(Cl)cc3[N+](=O)[O-])CC2)CC=CCC1 1824159117 SODXDRCZUGMABV-BKMJKUGQSA-N 488.028 5.157 5 20 JKBD Cc1ccc(C(=O)N2CCC([C@H]3CCCCN3C(=O)/C=C/c3ccc([N+](=O)[O-])o3)CC2)cc1Cl 1824275508 BXVNAQGSBLCDLZ-FGBWHXJSSA-N 485.968 5.096 5 20 JKBD CC[C@H]1CC[C@H](C(=O)N2CCCC[C@H]2C2CCN(C(=O)Cc3cc(F)ccc3[N+](=O)[O-])CC2)CC1 1831695768 QYTFVIINDWWQSZ-PTLVVNQVSA-N 487.616 5.113 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)N1CCC([C@@H]2CCCCN2C(=O)[C@H]2C[C@@H]2c2ccccc2)CC1 1831785621 BPLXPNMNSIMOTM-SLSDLSHTSA-N 493.579 5.079 5 20 JKBD O=C(Nc1nnc(SCc2ccc(Cl)cc2)s1)c1ccc(Br)c([N+](=O)[O-])c1 16008597 MIDGMRNSSLQTIB-UHFFFAOYSA-N 485.772 5.407 5 20 JKBD O=C(Nc1nc(-c2cc(Cl)sc2Cl)cs1)c1cc([N+](=O)[O-])ccc1N1CCOCC1 18091555 SFSBFGPEIRDDEB-UHFFFAOYSA-N 485.374 5.176 5 20 JKBD Cc1nc(SCC(=O)Nc2c(C)cccc2[N+](=O)[O-])c2cc(-c3ccccc3)sc2n1 20888619 QHSYXPOKXQJZBY-UHFFFAOYSA-N 450.545 5.614 5 20 JKBD CC(C)c1ccc(-c2nc(CC(=O)OCc3nnc(-c4ccc([N+](=O)[O-])cc4)o3)cs2)cc1 25196127 REDYBHIBZWBKSL-UHFFFAOYSA-N 464.503 5.178 5 20 JKBD COc1ccc(Cl)cc1CN(C)C(=O)c1ccc(N[C@H](C)c2ccccn2)c([N+](=O)[O-])c1 108787699 IBCZEQLMMILLLU-OAHLLOKOSA-N 454.914 5.097 5 20 JKBD C[C@H](Nc1ccc(C(=O)N[C@@H]2CCc3c(Br)cccc32)cc1[N+](=O)[O-])c1ccccn1 303190614 MNUVQSMITAQXDT-VBKZILBWSA-N 481.350 5.343 5 20 JKBD CC(C)NC(=O)Cc1ccc(NC(=O)c2ccc(NCc3ccccc3Cl)c([N+](=O)[O-])c2)cc1 482363552 CLWFDWDNKGXENS-UHFFFAOYSA-N 480.952 5.180 5 20 JKBD O=C(C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)Nc1cccc(Cn2cncn2)c1 487510286 OYUCEFOTAZEOJB-NDENLUEZSA-N 496.552 5.414 5 20 JKBD CCOc1cc([N+](=O)[O-])c(C(=O)N2CCC(c3c[nH]c4c(CC)cccc34)CC2)cc1OC 490815883 ADBZOLYDONLOBH-UHFFFAOYSA-N 451.523 5.066 5 20 JKBD COc1cc(C(=O)Nc2nc(-c3cccc([N+](=O)[O-])c3)cs2)ccc1OCc1cscn1 498268710 VQQUTSKITPFVFP-UHFFFAOYSA-N 468.516 5.015 5 20 JKBD C[C@H](Nc1ccc(F)c(NC(=O)Cc2ccccc2)c1)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl 515717375 GFBYLLVWFVFUPJ-AWEZNQCLSA-N 470.888 5.008 5 20 JKBD CC[C@H](C)NC(=O)c1ccc(NC(=O)c2ccc(N3C[C@H](C)C[C@@H](C)C3)c([N+](=O)[O-])c2)c(C)c1 520557691 FXAZQJKLDUGFDL-LMMKCTJWSA-N 466.582 5.166 5 20 JKBD COc1cc(C(=O)N2CCC[C@H]2c2ccc(C)c(C)c2)c([N+](=O)[O-])cc1OCc1cscn1 521250600 CVNMLHWCEIAWQR-FQEVSTJZSA-N 467.547 5.233 5 20 JKBD C[C@@H](NCc1ccccc1CN1CCC(O)CC1)c1ccc(-c2ccccc2[N+](=O)[O-])s1 537401197 VKZVLRVNNSUIEZ-GOSISDBHSA-N 451.592 5.131 5 20 JKBD CN1C/C(=C/c2ccc(N(C)c3ccccc3)c([N+](=O)[O-])c2)c2nc3ccccc3c(C(=O)O)c2C1 603781505 OCDDEMQGHIFAKE-RGEXLXHISA-N 480.524 5.595 5 20 JKBD CC(C)NC(=O)Nc1ccc(CN[C@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2ccccc2)cc1 604044219 CZOKPLQSANNNBW-QHCPKHFHSA-N 495.967 5.248 5 20 JKBD C[C@@H](Nc1ccc(C(=O)N(Cc2ccc3c(c2)OCO3)C2CCCC2)cc1[N+](=O)[O-])c1ccccn1 604295895 HZIOOJHSNGVRLI-GOSISDBHSA-N 488.544 5.477 5 20 JKBD C[C@@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)Nc1ccc(C(=O)N2CCCC[C@H]2C)c(Cl)c1 604443648 GQNWDTRMATYBDR-ZIAGYGMSSA-N 480.348 5.322 5 20 JKBD O=C(Nc1cccc(CNCc2cn(-c3ccccc3)nc2-c2ccc([N+](=O)[O-])cc2)c1)C1CCC1 608835583 BEBQMTSUYUPHOA-UHFFFAOYSA-N 481.556 5.476 5 20 JKBD CN(c1ccc(Oc2ccc(Br)cc2[N+](=O)[O-])cc1)S(=O)(=O)c1cccs1 608855759 IOJUEIYXVAILAG-UHFFFAOYSA-N 469.338 5.036 5 20 JKBD O=C(Cc1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1)Nc1ccc(F)cc1C(F)(F)F 609065224 IQSXNMCKXKUYPJ-UHFFFAOYSA-N 484.409 5.787 5 20 JKBD Cc1nc(-c2cccs2)c(CC(=O)Nc2nc(-c3ccc(C)c([N+](=O)[O-])c3)cs2)s1 619729525 BOUAXUMGBFKMOQ-UHFFFAOYSA-N 456.574 5.701 5 20 JKBD Cc1cccc(C(=O)Nc2ccc3nc(NC(=O)c4cccc(C)c4[N+](=O)[O-])ccc3c2)c1[N+](=O)[O-] 728151140 TUZKCMQKAVWCRH-UHFFFAOYSA-N 485.456 5.173 5 20 JKBD O=c1cc(-c2ccc([N+](=O)[O-])cc2)c2ccc(Oc3ccc4nnc(-c5ccccc5)n4n3)cc2o1 728566678 UNJVVZOCMWSTJI-UHFFFAOYSA-N 477.436 5.265 5 20 JKBD Cc1csc(Sc2ccc(C(=O)Nc3ccc(SC(=O)N(C)C)cc3)cc2[N+](=O)[O-])n1 729243243 PSAGELLTNBIXBC-UHFFFAOYSA-N 474.589 5.537 5 20 JKBD Cc1ccc(NC(=O)[C@@H](OC(=O)c2ccc(Cl)nc2Cl)c2ccccc2)c([N+](=O)[O-])c1 747937035 YJRFENFWKPKCIV-SFHVURJKSA-N 460.273 5.142 5 20 JKBD Cc1cc2oc(=O)cc(COC(=O)C3CCN(c4ccccc4[N+](=O)[O-])CC3)c2cc1C(C)C 844240100 ODBVFVQKBUHUTJ-UHFFFAOYSA-N 464.518 5.093 5 20 JKBD Cc1c(C(=O)Nc2ccc(Cl)cc2C(=O)N2[C@H](C)CCC[C@H]2C)cc([N+](=O)[O-])cc1[N+](=O)[O-] 915153838 CFEQKTTXSUOYOX-CHWSQXEVSA-N 474.901 5.120 5 20 JKBD O=C(C=C1CCCC1)O[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Br)c1ccccc1 917983404 BNPFRYCZMCVNGT-HXUWFJFHSA-N 459.296 5.081 5 20 JKBD O=C(C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)OCc1noc(C2CC2)n1 920513536 JPMXTIAPWNCFQM-WJDWOHSUSA-N 462.487 5.139 5 20 JKBD C[C@@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)O[C@H](C)C(=O)N1c2ccccc2Sc2ccccc21 920777561 KVGGQFSKCQSMLR-HUUCEWRRSA-N 498.944 5.777 5 20 JKBD O=C(Nc1ccccc1C(=O)Nc1cccc(COCC2CC2)c1)c1ccc([N+](=O)[O-])cc1Cl 920855142 AFEMTEFCVBRHOO-UHFFFAOYSA-N 479.920 5.679 5 20 JKBD O=C(Nc1ccc(Oc2ccccc2)cc1C(F)(F)F)c1cc([N+](=O)[O-])ccc1N1CCOCC1 921155476 QZTLTEBTDFZYJR-UHFFFAOYSA-N 487.434 5.495 5 20 JKBD Cc1cncc(CCC(=O)NC2(c3ccc(NC(=O)/C=C/c4ccccc4[N+](=O)[O-])cc3)CCC2)c1 1792315448 PKYGRCGFKAEESX-RIYZIHGNSA-N 484.556 5.078 5 20 JKBD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)[nH]n1)c1ccc(F)s1 1816029561 SSCWIVQCPGTZMW-HNNXBMFYSA-N 499.549 5.353 5 20 JKBD O=C(Nc1cc([C@H]2CCCCN2C(=O)/C=C/c2ccccc2[N+](=O)[O-])[nH]n1)c1cc2ccoc2s1 1817828275 RTXOJEPPXIJEGY-CSHXORCISA-N 491.529 5.145 5 20 JKBD Cc1c(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)C3(F)CCCCC3)n[nH]2)cc(Cl)cc1[N+](=O)[O-] 1818881231 AWPIUFQMQCBYCM-GOSISDBHSA-N 491.951 5.258 5 20 JKBD O=C(Nc1cc([C@H]2CCCCN2C(=O)c2ccc(F)cc2)[nH]n1)c1cc2cc([N+](=O)[O-])ccc2s1 1821610051 SVZHDIIJGQKZEY-LJQANCHMSA-N 493.520 5.291 5 20 JKBD CC(C)[C@H]1CC[C@H](C(=O)Nc2cc([C@H]3CCCCN3C(=O)c3cc(F)cc([N+](=O)[O-])c3)[nH]n2)CC1 1822103824 HJYCUTFSULIMNT-DRSNIGMVSA-N 485.560 5.225 5 20 JKBD O=C(c1cc(Cl)c(Cl)cc1F)N1CCC([C@@H]2CCCCN2C(=O)c2ccc([N+](=O)[O-])o2)CC1 1823617020 XIOFQKANRGOIRM-SFHVURJKSA-N 498.338 5.181 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)N1CCC([C@H]2CCCCN2C(=O)CSc2ccccc2)CC1 1826520541 BXZQMJLGUWKFDY-HSZRJFAPSA-N 499.608 5.068 5 20 JKBD Cc1cc2cc(C(=O)N3CCCC[C@@H]3C3CCN(C(=O)c4cc(F)cc([N+](=O)[O-])c4)CC3)ccc2[nH]1 1831035540 CIRYSXRVKKLDFK-RUZDIDTESA-N 492.551 5.071 5 20 JKBD CSCc1c(C(=O)O[C@@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2C(F)(F)F)oc2ccccc12 9786398 JBWUWDHBZKEXSU-NSHDSACASA-N 482.436 5.407 5 20 JKBD CSc1ccc(C(=O)c2ccccc2C(=O)OCc2coc(-c3cccs3)n2)cc1[N+](=O)[O-] 10154546 MNOGLQMXPCDWKW-UHFFFAOYSA-N 480.523 5.621 5 20 JKBD Cc1ccc([N+](=O)[O-])cc1NC(=O)Cc1ccc(NS(=O)(=O)c2ccc(Cl)c(Cl)c2)cc1 15410661 IILFJEGUHZGKQT-UHFFFAOYSA-N 494.356 5.192 5 20 JKBD CCCc1ccc(-c2nc(NC(=O)c3cc(OC)c(OCC)cc3[N+](=O)[O-])sc2C)cc1 19358307 LTVNIINRZOQKDU-UHFFFAOYSA-N 455.536 5.639 5 20 JKBD O=C(CSc1nnc(-c2cccc(Cl)c2)o1)Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1 21547959 CXDOPHALMSFLON-UHFFFAOYSA-N 473.923 5.153 5 20 JKBD CSCC[C@@H](NC(=O)c1cccc([N+](=O)[O-])c1)C(=O)OCc1sc2ccccc2c1Cl 24977103 FFVFQWSMMOWVIF-MRXNPFEDSA-N 478.979 5.058 5 20 JKBD Cc1cc(C(=O)Cn2nc(-c3cccc([N+](=O)[O-])c3)ccc2=O)c(C)n1CCc1ccc(Cl)cc1 195741483 ICXPTKYCXIRJCX-UHFFFAOYSA-N 490.947 5.016 5 20 JKBD CCOC(=O)c1cc(-c2ccccc2)sc1NC(=O)c1cc(SC)c(OC)cc1[N+](=O)[O-] 482263164 CHQGMPZIDRDRLA-UHFFFAOYSA-N 472.544 5.483 5 20 JKBD CC[C@@H](C)C(=O)Nc1cccc(CNC(=O)CSc2ccc(C(F)(F)F)cc2[N+](=O)[O-])c1 500012204 JILCKXRKEKDMIJ-CYBMUJFWSA-N 469.485 5.007 5 20 JKBD O=C(N[C@H](c1ccc(Cl)cc1)c1ccsc1)c1ccc([N+](=O)[O-])cc1I 508590043 UERIMFLYUZJUBN-QGZVFWFLSA-N 498.729 5.434 5 20 JKBD Cc1ccc(-c2csc(NC(=O)C3CCC(NC(=O)CC4CCCCC4)CC3)n2)cc1[N+](=O)[O-] 508804241 XULDNYDLRWQPJL-UHFFFAOYSA-N 484.622 5.611 5 20 JKBD O=C(c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-])N1CCC(c2nc3cc(Cl)ccc3s2)CC1 512218016 SWBPBUXAAYGEAH-UHFFFAOYSA-N 499.898 5.819 5 20 JKBD Cc1cc(NC(=O)N[C@H](CC(=O)OC(C)C)c2ccccc2[N+](=O)[O-])ccc1Oc1cccnc1 512771412 VJSWCHNKQWLZSI-OAQYLSRUSA-N 478.505 5.295 5 20 JKBD COc1ccc(CNC2CCN(Cc3ccc(F)cc3)CC2)cc1OCc1ccc([N+](=O)[O-])cc1 513092240 KDDAPLNHMYOXSH-UHFFFAOYSA-N 479.552 5.076 5 20 JKBD COc1ccc(CNC(=O)c2ccccc2Sc2ccc(C(F)(F)F)cc2[N+](=O)[O-])cn1 515357749 RGEMSBPHIRAZJZ-UHFFFAOYSA-N 463.437 5.098 5 20 JKBD CC(=O)Nc1cc(NC(=O)c2ccc(NCc3ccccc3Cl)c([N+](=O)[O-])c2)ccc1Cl 516370745 GPXPDSXHASJUHK-UHFFFAOYSA-N 473.316 5.724 5 20 JKBD C[C@H]1CCCCN1CCNC(=O)C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1 518044604 ZOSRSJSOCRHUMA-OBKVJGTNSA-N 464.591 5.126 5 20 JKBD O=C(Nc1ccc2c(c1)CCC(=O)N2Cc1ccc(Cl)cc1)c1c[nH]c2cc([N+](=O)[O-])ccc12 520111194 SOMFZMXNWNSHJE-UHFFFAOYSA-N 474.904 5.461 5 20 JKBD Cc1ccccc1NC(=O)[C@H]1CCc2ccccc2N1C(=O)c1csc(-c2cccc([N+](=O)[O-])c2)n1 524228637 SFTZKQGMODKEBL-XMMPIXPASA-N 498.564 5.627 5 20 JKBD Cc1nn(Cc2ccc(F)cc2)c2sc(C(=O)Nc3cc([N+](=O)[O-])ccc3OC(F)F)cc12 603638642 BXMYHEVERTVDMC-UHFFFAOYSA-N 476.436 5.356 5 20 JKBD Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)c1cccnc1Oc1ccc(F)cc1Br 603780077 PCZRONNNCYOBQS-UHFFFAOYSA-N 460.259 5.553 5 20 JKBD CCOc1ccc(C(=O)Nc2nnc(SCc3ccc(Cl)cc3)s2)cc1[N+](=O)[O-] 603825507 NREIALZQLOAIKD-UHFFFAOYSA-N 450.929 5.043 5 20 JKBD CN(C)c1ccc(C(=O)c2ccccc2C(=O)N2CCC[C@H](c3cc4ccccc4[nH]3)C2)cc1[N+](=O)[O-] 604244528 SWPGIPOIKDJXLI-NRFANRHFSA-N 496.567 5.393 5 20 JKBD O=[N+]([O-])c1cnc2ccc(Br)cc2c1N1CCC(OCCc2ccccc2)CC1 604472696 WYROURIMSHQAHU-UHFFFAOYSA-N 456.340 5.134 5 20 JKBD Cc1nc(-c2ccccc2)c(NC(=O)c2ccc(N[C@@H](C)c3ccccn3)c([N+](=O)[O-])c2)s1 604538763 ULINYILTTGGWDD-HNNXBMFYSA-N 459.531 5.847 5 20 JKBD O=[N+]([O-])c1ccccc1-c1ccc(CN[C@@H]2C[C@@H](C(F)(F)F)C[C@@H](C(F)(F)F)C2)s1 608835869 REXAAUSXNMXIPJ-ITGUQSILSA-N 452.420 6.322 5 20 JKBD Cc1ccc(NC(=O)[C@@H](OC(=O)c2c(Cl)cccc2[N+](=O)[O-])c2ccccc2)c([N+](=O)[O-])c1 730645542 XTMFJDPEEGQJJA-FQEVSTJZSA-N 469.837 5.002 5 20 JKBD O=C(CSc1nnc(COc2ccc(Cl)cc2Cl)o1)Nc1ccc(Cl)c([N+](=O)[O-])c1 745942067 ZWEQIWQKOXNTGU-UHFFFAOYSA-N 489.724 5.248 5 20 JKBD O=C(Cc1c[nH]c2cc(F)ccc12)Oc1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2Cl)cc1 751055567 VRWQBTNCCGHJDZ-UHFFFAOYSA-N 467.840 5.269 5 20 JKBD C[C@@H](OC(=O)c1cc([N+](=O)[O-])ccc1N1CCCCC1)C(=O)Nc1cccc(Cl)c1Cl 823194351 DQMZHGPGHAYXGZ-CYBMUJFWSA-N 466.321 5.076 5 20 JKBD CC1=C(C(=O)Nc2ccc([N+](=O)[O-])cc2)[C@@H](c2ccc3ncccc3c2)NC(=O)N1Cc1cccs1 840197451 ZAUINNURVAUXJT-XMMPIXPASA-N 499.552 5.384 5 20 JKBD O=[N+]([O-])c1cccc(Br)c1CNc1cccc(S(=O)(=O)C2CCCCC2)c1 864039573 XFMUOXLQRHMOFM-UHFFFAOYSA-N 453.358 5.076 5 20 JKBD CN(C(=O)c1ccccc1NC(=O)c1ccc([N+](=O)[O-])cc1Cl)c1ccc2ccccc2c1 864094998 SMUGNAOFCYQUFB-UHFFFAOYSA-N 459.889 5.930 5 20 JKBD O=C(Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1)c1cc(-c2ccncc2)nc2ccccc12 871594586 NOSQRSOSPVDTQC-UHFFFAOYSA-N 453.483 5.581 5 20 JKBD Cn1cc(-c2nc(-c3ccccc3OCc3ccccc3)no2)c(-c2ccc([N+](=O)[O-])cc2)n1 904466195 ZZJLBCNSVMHXSF-UHFFFAOYSA-N 453.458 5.291 5 20 JKBD C[C@H](Oc1ccc(Cl)cc1Br)C(=O)O[C@@H](C)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 907683924 OMMGDJKMCNOSLN-QWRGUYRKSA-N 496.701 5.132 5 20 JKBD O=C(/C=C\c1ccc([N+](=O)[O-])cc1)Oc1ccc(NC(=O)c2ccccc2Br)cc1 910110799 RMBVMOPTGREVCW-AUWJEWJLSA-N 467.275 5.228 5 20 JKBD CCc1cccc[n+]1/C(C(=S)Nc1ccc2c(c1)OC(F)(F)O2)=C(/O)c1cccc([N+](=O)[O-])c1 920397834 WZKUXTWYUIMNMU-UHFFFAOYSA-O 486.476 5.090 5 20 JKBD CC(C)CCSc1ccc(C(=O)N2CCC[C@@H](CNC(=O)OC(C)(C)C)C2)cc1[N+](=O)[O-] 920473798 HEFXTCINLFNWMR-KRWDZBQOSA-N 465.616 5.110 5 20 JKBD O=C(NC1(c2ccc(NC(=O)c3ccc([N+](=O)[O-])o3)cc2)CCC1)c1cnc2c(F)c(F)ccc2c1 1785751224 UDKGLRDYIGRMLI-UHFFFAOYSA-N 492.438 5.076 5 20 JKBD O=C(Cc1cc([N+](=O)[O-])ccc1F)Nc1ccc(C2(NC(=O)CCCCn3cccc3)CCC2)cc1 1786672994 ZMUATDATYFCJTK-UHFFFAOYSA-N 492.551 5.083 5 20 JKBD O=C(/C=C/c1ccccc1[N+](=O)[O-])NC1(c2ccc(NC(=O)c3ccc4ncoc4c3)cc2)CCC1 1789078930 GDERBKFBYTXUES-NTUHNPAUSA-N 482.496 5.197 5 20 JKBD O=C(/C=C/c1ccc([N+](=O)[O-])o1)NC1(c2ccc(NC(=O)c3cccc4cnccc34)cc2)CCC1 1789324800 ZRZPJALMLDMREZ-PKNBQFBNSA-N 482.496 5.197 5 20 JKBD O=C(NC1(c2ccc(NC(=O)c3ccc([N+](=O)[O-])cc3F)cc2)CCC1)c1cc2ccsc2[nH]1 1790626406 WFMQMYGMNXLZOJ-UHFFFAOYSA-N 478.505 5.338 5 20 JKBD C[C@@H](Sc1cccs1)C(=O)NC1(c2ccc(NC(=O)c3cc(O)cc([N+](=O)[O-])c3)cc2)CCC1 1790755975 KMZFIWOFLXCSAW-OAHLLOKOSA-N 497.598 5.290 5 20 JKBD O=C(CCc1cccc([N+](=O)[O-])c1)NC1(c2ccc(NC(=O)c3cc4ccoc4cn3)cc2)CCC1 1790830064 GWFLNTJBKTVJDE-UHFFFAOYSA-N 484.512 5.117 5 20 JKBD Cc1ccc(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)c3cc4cc([N+](=O)[O-])ccc4s3)[nH]n2)o1 1815386215 BJEONRLBTYMSKB-KRWDZBQOSA-N 479.518 5.054 5 20 JKBD O=C(c1ccsc1)N1CCC([C@H]2CCCCN2C(=O)C2(c3cccc([N+](=O)[O-])c3)CCC2)CC1 1830291638 QWCUALOEXIGFKM-HSZRJFAPSA-N 481.618 5.012 5 20 JKBD O=C(CCCc1ccccc1F)N1CCC([C@@H]2CCCCN2C(=O)c2cccc(F)c2[N+](=O)[O-])CC1 1830616777 MYTMLMDQTQMYQU-DEOSSOPVSA-N 499.558 5.129 5 20 JKBD CCC[C@H]1CC[C@H](C(=O)N2CCCC[C@H]2C2CCN(C(=O)/C=C/c3ccc([N+](=O)[O-])o3)CC2)CC1 1831561502 LMZXWJZHYRBSAZ-MEVZXMIGSA-N 485.625 5.427 5 20 JKBD CCC[C@H](C(=O)N1CCC([C@@H]2CCCCN2C(=O)/C=C/c2ccccc2[N+](=O)[O-])CC1)n1cccc1 1832906607 CZYUIKPFKVSZQO-FDYGDTCYSA-N 492.620 5.071 5 20 JKBD O=C(Nc1nc2cc(C(F)(F)F)ccc2n1Cc1ccco1)c1ccc([N+](=O)[O-])cc1Cl 10998845 WRGNPXUEAVIKQR-UHFFFAOYSA-N 464.787 5.510 5 20 JKBD O=C(Nc1ccccc1Oc1ccccc1Cl)C1CCN(c2ccccc2[N+](=O)[O-])CC1 14673774 KPPPUHQTJZNQTG-UHFFFAOYSA-N 451.910 5.896 5 20 JKBD Cc1ccc(NC(=O)[C@@H](OC(=O)c2cnc(Cl)c(Cl)c2)c2ccccc2)c([N+](=O)[O-])c1 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Cc1ccc(C(=O)Nc2cccc([N+](=O)[O-])c2C)cc1S(=O)(=O)Nc1cc(Cl)ccc1F 508806641 PTAWOUKOPQIJOU-UHFFFAOYSA-N 477.901 5.057 5 20 JKBD COc1ccccc1NC(=O)Nc1cc(NC(=O)[C@H](C)Sc2ccc([N+](=O)[O-])cc2)ccc1OC 509451596 QNAFZYQHOTZYEM-HNNXBMFYSA-N 496.545 5.375 5 20 JKBD COc1cc(C(=O)Nc2nc3c(C)cc(C)cc3s2)c([N+](=O)[O-])cc1OCc1cscn1 511627942 MNTILBDZJNXUAW-UHFFFAOYSA-N 470.532 5.118 5 20 JKBD COc1cc(C(=O)N[C@H](c2ccc(F)cc2)C(C)(C)C)c([N+](=O)[O-])cc1OCc1cscn1 512177771 IBSSVSFEAYLCAG-OAQYLSRUSA-N 473.526 5.295 5 20 JKBD COc1cc(CN[C@H](C)c2cccc([N+](=O)[O-])c2)ccc1OCC(=O)Nc1ccc(F)c(Cl)c1 513114749 HBYPQOZERQGTRM-OAHLLOKOSA-N 487.915 5.264 5 20 JKBD CSc1ccc([N+](=O)[O-])c(C(=O)Nc2ccc(C(=O)N(C)C3CCCCC3)c(Cl)c2)c1 515614032 DIYVMVROXVBULF-UHFFFAOYSA-N 461.971 5.627 5 20 JKBD C[C@@H](Nc1ccccc1OC[C@H]1CCCCO1)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 518013025 BWASXFKKZHIZAD-GDBMZVCRSA-N 467.444 5.001 5 20 JKBD C[C@H](Nc1ccc(C(=O)Nc2cccc(-c3ccc4c(c3)CCO4)n2)cc1[N+](=O)[O-])c1ccccn1 518144099 GMIKMJFKDXZGDM-KRWDZBQOSA-N 481.512 5.412 5 20 JKBD COc1ccc([C@H](Cc2ccc(F)cc2)NC(=O)c2cc(OCC(F)(F)F)ccc2[N+](=O)[O-])cc1 520618269 LBCKXYFRGUMMPS-NRFANRHFSA-N 492.425 5.397 5 20 JKBD C[C@H](NC(=O)c1csc(-c2ccc([N+](=O)[O-])cc2)n1)c1ccc(OCc2cccnc2)cc1 522092992 WGZOIKRRERIJQM-INIZCTEOSA-N 460.515 5.183 5 20 JKBD Cc1occc1-c1nnc(SCc2nc(-c3ccc([N+](=O)[O-])cc3)no2)n1Cc1ccccc1 603748246 IPXYKYFEGBIRIA-UHFFFAOYSA-N 474.502 5.145 5 20 JKBD CC(C)(C)C(=O)N1CCOc2ccc(NC(=O)c3ccc(NCc4ccccc4)c([N+](=O)[O-])c3)cc21 604192242 NHXQFLZZLANMEW-UHFFFAOYSA-N 488.544 5.231 5 20 JKBD COC(=O)[C@H](c1ccc(Cl)c(Cl)c1)N(C)C(=O)c1csc(-c2cccc([N+](=O)[O-])c2)n1 604570416 XAEFUTKWHGOLSY-KRWDZBQOSA-N 480.329 5.011 5 20 JKBD C[C@H]1CN(Cc2ccc(CNCc3ccc(-c4ccccc4[N+](=O)[O-])s3)cc2)C[C@H](C)O1 608835819 WOMXJJUBTXRASG-OALUTQOASA-N 451.592 5.222 5 20 JKBD CCOc1cc([N+](=O)[O-])c(C(=O)Nc2cc(-c3ccccc3C)nn2Cc2ccccc2)cc1OC 608943385 JOQYMTWBTAHKGX-UHFFFAOYSA-N 486.528 5.475 5 20 JKBD C[C@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)OCc1nnc(-c2c(Cl)cccc2Cl)o1 726633530 VPPGQTAICCAIIN-JTQLQIEISA-N 454.291 5.176 5 20 JKBD Cn1c(CSc2nc3ccccc3s2)nnc1Sc1ccc(Br)cc1[N+](=O)[O-] 726788080 VZIDELYSKAVGET-UHFFFAOYSA-N 494.421 5.539 5 20 JKBD C[C@H]1CN(c2ccc(NC(=S)Nc3ccc([N+](=O)[O-])cc3)cc2C(F)(F)F)C[C@H](C)O1 727981056 ALWVTCPIXGIDAS-STQMWFEESA-N 454.474 5.036 5 20 JKBD CCOC(=O)c1cc(-c2ccccc2)ccc1NC(=O)c1cc(SC)c(OC)cc1[N+](=O)[O-] 728472783 UUYORVJEJBGBRI-UHFFFAOYSA-N 466.515 5.421 5 20 JKBD Cc1c(NC(=O)c2cc([N+](=O)[O-])ccc2N2CCCCC2)cccc1C(=O)Nc1ccccc1 748199068 NFMZFPYFGZSERG-UHFFFAOYSA-N 458.518 5.398 5 20 JKBD Cc1cc(C(=O)Nc2cc(Cl)c([N+](=O)[O-])cc2OCc2ccccc2)c2c(C)noc2n1 836498540 HZACZHFOIAFKTB-UHFFFAOYSA-N 452.854 5.233 5 20 JKBD COc1ccc2[nH]cc(CC(=O)O[C@@H](C(=O)Nc3ccc([N+](=O)[O-])cc3Cl)c3ccccc3)c2c1 915520531 WFYRKQZSOMKPKY-XMMPIXPASA-N 493.903 5.204 5 20 JKBD CC1=C(C(=O)Nc2ccccc2)[C@@H](c2cc([N+](=O)[O-])c(F)cc2F)NC(=O)N1Cc1ccccc1 916723219 IYOAZDZTMLQLDN-HSZRJFAPSA-N 478.455 5.052 5 20 JKBD Cc1nc(-c2ccc(NC(=O)c3ccccc3NC(=O)c3ccc([N+](=O)[O-])cc3Cl)cc2)oc1C 917498816 CTNFUWIFYAINFO-UHFFFAOYSA-N 490.903 6.025 5 20 JKBD COc1ccc([C@@H](C)OC(=O)C2CCN(c3ccc(C(F)(F)F)cc3[N+](=O)[O-])CC2)cc1 920165081 BTODGZYETKKPKB-CQSZACIVSA-N 452.429 5.143 5 20 JKBD O=C(CCc1cccc([N+](=O)[O-])c1)Nc1ccc(C2(NC(=O)CCOc3ccccc3)CCC2)cc1 1786601688 MHELIKYTITYEAF-UHFFFAOYSA-N 487.556 5.131 5 20 JKBD O=C(CCc1ccsc1)NC1(c2ccc(NC(=O)c3ccc([N+](=O)[O-])cc3F)cc2)CCC1 1790623011 DGIKALGHPFJAKU-UHFFFAOYSA-N 467.522 5.176 5 20 JKBD Cc1ccc(CCC(=O)NC2(c3ccc(NC(=O)c4cc(F)cc([N+](=O)[O-])c4)cc3)CCC2)c(C)n1 1790699430 OXMMEIJUUWXZJN-UHFFFAOYSA-N 490.535 5.126 5 20 JKBD Cc1cc(CCCC(=O)N2CCCC3(CCN(C(=O)[C@H]4CCC[C@H]4C)CC3)C2)c([N+](=O)[O-])cc1F 1805821568 WFXYEZDNZVCLNY-KNQAVFIVSA-N 487.616 5.032 5 20 JKBD O=C(/C=C/c1ccccc1[N+](=O)[O-])Nc1cc([C@@H]2CCCCN2C(=O)c2ccc3occc3c2)[nH]n1 1823505231 YGAQZGQVCKWBEL-CRWWQRIJSA-N 485.500 5.083 5 20 JKBD O=C(Cc1ccc2ccccc2c1)N1CCC([C@@H]2CCCCN2C(=O)Cc2cccc([N+](=O)[O-])c2)CC1 1823678754 WGIRMGQQMBVNCP-NDEPHWFRSA-N 499.611 5.153 5 20 JKBD COc1ccccc1CN(Cc1cccs1)C(=O)c1ccc(Br)c([N+](=O)[O-])c1 16015027 PRKXPLQMZCGURV-UHFFFAOYSA-N 461.337 5.270 5 20 JKBD Cc1ccccc1-n1c(SCc2ccc(C(N)=O)cc2[N+](=O)[O-])nnc1-c1c[nH]c2ccccc12 16763440 FGFNHHOFTRKFAJ-UHFFFAOYSA-N 484.541 5.023 5 20 JKBD C[C@@H](Sc1nc2ccc([N+](=O)[O-])cc2s1)C(=O)N(C)Cc1ccc(Br)cc1 23214207 HGOSSAWATCNWHT-LLVKDONJSA-N 466.382 5.106 5 20 JKBD CCn1c(S[C@@H](C)C(=O)N2CCC[C@@H]2c2cccs2)nc2cc3ccccc3cc2c1=O 26581195 MWBXMNIXHILNMZ-HRAATJIYSA-N 463.628 5.475 5 20 JKBD Cc1ccc(-c2nc(C)c([C@H](C)NC(=O)c3ccc(Sc4nncn4C)c([N+](=O)[O-])c3)s2)cc1 303245780 ARTOABHIJJEZSW-AWEZNQCLSA-N 494.602 5.106 5 20 JKBD COc1ccc(OC(F)F)c(NC(=O)c2ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])c(OC)c2)c1 482177113 FWFVGHXERRCWEK-UHFFFAOYSA-N 494.834 5.911 5 20 JKBD COc1cccc([C@@H](CNC(=O)N(C)Cc2ccccc2[N+](=O)[O-])c2c[nH]c3ccccc23)c1OC 503714984 GLUZUXLKUVJKEI-JOCHJYFZSA-N 488.544 5.067 5 20 JKBD O=C(Nc1cc(Cl)ccc1N1CCCCC1)c1ccc([N+](=O)[O-])cc1I 508803059 SJQOIMVTMGBNDH-UHFFFAOYSA-N 485.709 5.095 5 20 JKBD CCN(Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[C@H]1CCSc2ccc(Br)cc21 509068361 XFZZAUQNOLUMME-KRWDZBQOSA-N 475.368 5.466 5 20 JKBD CC[C@]1(c2ccc(NC(=O)c3cc([N+](=O)[O-])ccc3Sc3ccccc3)cc2)CCC(=O)NC1=O 509402991 YJNOAUFJCVEXKD-AREMUKBSSA-N 489.553 5.083 5 20 JKBD COc1cc(/C=C2/CCn3c2nc2ccc([N+](=O)[O-])cc2c3=O)ccc1OCc1ccc(Cl)cc1 514645855 NDWMZTRJMQCZLP-PDGQHHTCSA-N 489.915 5.490 5 20 JKBD COc1cc([N+](=O)[O-])ccc1NC(=O)CNc1ccccc1NC(=O)c1ccc(C(C)(C)C)cc1 515445073 FEBUDTUEASBCCL-UHFFFAOYSA-N 476.533 5.204 5 20 JKBD CCCOc1ccc(-c2csc(NC(=O)c3cc(OCC(F)(F)F)ccc3[N+](=O)[O-])n2)cc1 516074007 GSDQPHWQKYVEOU-UHFFFAOYSA-N 481.452 5.701 5 20 JKBD Cc1ccc(NC(=O)c2cccc(C(F)(F)F)c2)cc1NCc1nc(-c2ccc([N+](=O)[O-])cc2)no1 518910267 GGCORBXXRCVTIA-UHFFFAOYSA-N 497.433 5.836 5 20 JKBD COc1cc(C(=O)Nc2ccc(F)c(C(F)(F)F)c2)c([N+](=O)[O-])cc1OCc1cscn1 520761317 LOCKOQMPVUWHAX-UHFFFAOYSA-N 471.388 5.049 5 20 JKBD Cc1cc(C(=O)Nc2nc(-c3ccc(OC(F)F)cc3OC(F)F)cs2)ccc1[N+](=O)[O-] 522053434 OPLYDLZLRDYKPN-UHFFFAOYSA-N 471.388 5.482 5 20 JKBD COc1ccc(N2C(=O)c3ccccc3N[C@@H]2c2csc(-c3cccc([N+](=O)[O-])c3)n2)c(OC)c1 602761544 SQFCMEYCZQYURM-QHCPKHFHSA-N 488.525 5.507 5 20 JKBD COc1ccc(-c2ccc(/C=C3\CN(C)Cc4c3nc3ccccc3c4C(=O)O)o2)c([N+](=O)[O-])c1 603781559 UGDPEDODAQDUMP-RVDMUPIBSA-N 471.469 5.096 5 20 JKBD COc1ccc(COCc2cccc(NC(=O)[C@@H](C)Sc3ccc([N+](=O)[O-])cc3)c2)cc1 604465149 OTYNPUMFVWJJLM-QGZVFWFLSA-N 452.532 5.440 5 20 JKBD Cc1ccc(NC(=O)c2ccc(Sc3nnc(-c4ccccc4Cl)o3)c([N+](=O)[O-])c2)cc1 608971669 NLADWVUEYYWHQN-UHFFFAOYSA-N 466.906 6.010 5 20 JKBD COc1ccccc1NC(=O)C1CCN(c2ccc(C(=O)Nc3ccc(C)cc3)cc2[N+](=O)[O-])CC1 608973059 UFHOFEYXAKFUFV-UHFFFAOYSA-N 488.544 5.019 5 20 JKBD CCC(CC)c1cc[n+](/C(C(=S)NCC(F)(F)F)=C(/O)c2ccc([N+](=O)[O-])cc2)cc1 725760730 HSLLHOPTBRSTBD-UHFFFAOYSA-O 454.494 5.149 5 20 JKBD C[C@H](OC(=O)c1cc(F)c(F)cc1[N+](=O)[O-])C(=O)N1c2ccccc2Sc2ccccc21 725936552 FXJJKHJFOZVFFH-LBPRGKRZSA-N 456.426 5.248 5 20 JKBD C[C@H](OC(=O)CC[C@H](O)c1ccc(C(C)(C)C)cc1)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 726873102 OVWVYFJBAIKNSV-YWZLYKJASA-N 453.495 5.060 5 20 JKBD CC(=O)N1CCC(COC(=O)c2c3c(nc4ccccc24)/C(=C\c2cccc([N+](=O)[O-])c2)CCC3)CC1 727771549 SJNTXVXBPPIOJU-JWGURIENSA-N 499.567 5.435 5 20 JKBD C[C@@H](Nc1ccc(C(=O)Nc2ccccc2SC(=O)N(C)C)cc1[N+](=O)[O-])c1ccccn1 729247265 FUPDLCVUYIJXOI-OAHLLOKOSA-N 465.535 5.189 5 20 JKBD C[C@H](OC(=O)[C@H]1C[C@H]1c1ccc(Cl)cc1Cl)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 730613832 MHVLAEMWTBEFLQ-HERUPUMHSA-N 491.249 5.594 5 20 JKBD O=C(COc1ccc([N+](=O)[O-])c(F)c1)Nc1nnc(SCc2c(Cl)cccc2Cl)s1 745739317 XXOOUZPVDSWXQP-UHFFFAOYSA-N 489.337 5.202 5 20 JKBD COc1ccc(NCc2ccc(Br)cc2[N+](=O)[O-])cc1NC(=O)OC(C)(C)C 819065582 QOYFRCWTIHVJDJ-UHFFFAOYSA-N 452.305 5.325 5 20 JKBD C[C@H](Cc1noc(-c2ccc(NCc3ccccc3)c([N+](=O)[O-])c2)n1)N(C)C(=O)OC(C)(C)C 904655334 KFZWEBLTCYDOOP-MRXNPFEDSA-N 467.526 5.055 5 20 JKBD COc1ccc2c(ccn2CC(=O)Oc2ccc(NC(=O)c3cc([N+](=O)[O-])ccc3Cl)cc2)c1 915810609 DFWRBSTYFHPLHO-UHFFFAOYSA-N 479.876 5.069 5 20 JKBD O=c1nc(/C(Cl)=C\c2ccc(-c3ccc([N+](=O)[O-])cc3)o2)[nH]c2cc(C(F)(F)F)ccc12 916128265 VIQYHXNTMKCFDW-MHWRWJLKSA-N 461.783 5.847 5 20 JKBD CC1CCN(c2ccc([N+](=O)[O-])cc2C(=O)NCc2cccc(COCc3ccco3)c2)CC1 917120947 PXNBCFBJXXSSLA-UHFFFAOYSA-N 463.534 5.071 5 20 JKBD COc1cc(C(=O)OCc2noc(C(C)(C)C)n2)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 918953888 ZQVKPXJYJQKBBP-UHFFFAOYSA-N 461.858 5.087 5 20 JKBD Cc1sc2nc(CS[C@@H](C)C(=O)Oc3ccc(-c4ccccc4)cc3[N+](=O)[O-])nc(O)c2c1C 920331391 YTJSAFADMUNTTR-HNNXBMFYSA-N 495.582 5.816 5 20 JKBD O=C(CCc1cccc([N+](=O)[O-])c1)Nc1ccc(C2(NC(=O)CCCc3ccncc3)CCC2)cc1 1786602568 SKTAAHMNNGYHDY-UHFFFAOYSA-N 486.572 5.079 5 20 JKBD O=C(CCCc1ccncc1)Nc1ccc(C2(NC(=O)CCc3cccc([N+](=O)[O-])c3)CCC2)cc1 1786906538 KKRZZNHGHWNJEP-UHFFFAOYSA-N 486.572 5.079 5 20 JKBD CCOc1ccccc1C(=O)NC1(c2ccc(NC(=O)c3cc(F)cc([N+](=O)[O-])c3)cc2)CCC1 1790697431 JHYFOGYYMIPUQD-UHFFFAOYSA-N 477.492 5.194 5 20 JKBD C[C@@H](C(=O)NC1(c2ccc(NC(=O)c3cc4cc([N+](=O)[O-])ccc4s3)cc2)CCC1)n1cccn1 1791010384 MCAMSUWWLGDRFV-INIZCTEOSA-N 489.557 5.015 5 20 JKBD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc2ccoc12)c1cc2cc([N+](=O)[O-])ccc2s1 1801102605 GIUIJCRLSLHAET-BCDXTJNWSA-N 475.526 5.121 5 20 JKBD O=C(Nc1cc([C@H]2CCCCN2C(=O)c2ccc([N+](=O)[O-])[nH]2)[nH]n1)c1sc2ccccc2c1Cl 1818606724 BXPHTJGRNDEIPK-OAHLLOKOSA-N 498.952 5.134 5 20 JKBD Cc1c(C(=O)Nc2cc([C@H]3CCCCN3C(=O)[C@H](F)c3ccccc3)[nH]n2)cc(Cl)cc1[N+](=O)[O-] 1821289759 KPIZQYMKHPDTOO-DENIHFKCSA-N 499.930 5.296 5 20 JKBD CC(C)/C=C/C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cc3cc([N+](=O)[O-])ccc3s2)n[nH]1 1821611152 OKRWDHOTTWGJLC-AHKGRUIUSA-N 467.551 5.051 5 20 JKBD O=C(Nc1cc([C@H]2CCCCN2C(=O)CCc2ccoc2)[nH]n1)c1cc2cc([N+](=O)[O-])ccc2s1 1821611264 OYECACOWWDWWEE-LJQANCHMSA-N 493.545 5.064 5 20 JKBD O=C(CCc1cccc([N+](=O)[O-])c1)N1CCCC[C@@H]1C1CCN(C(=O)C23CCC(CC2)CC3)CC1 1824843194 PZONYLMTGULVGQ-ZUYJMMGOSA-N 481.637 5.118 5 20 JKBD Cc1cscc1C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)CC1 1831061180 OMFHLRYGKGJVHI-NRFANRHFSA-N 497.642 5.727 5 20 JKBD O=C(c1ccc(Cl)cc1)N1CCC([C@H]2CCCCN2C(=O)/C=C/c2ccccc2[N+](=O)[O-])CC1 1832903955 JBFJNUGBYASEKA-UQNNOOFXSA-N 481.980 5.195 5 20 JKBD O=C(c1ccc2cc[nH]c2c1)N1CCC([C@H]2CCCCN2C(=O)/C=C/c2ccccc2[N+](=O)[O-])CC1 1832907281 RLEREQSHDBUGOD-CFQHJMILSA-N 486.572 5.023 5 20 JKBD O=C(c1cc(Cl)c(Cl)c(Cl)c1)N1CC2(CCCN2C(=O)/C=C/c2ccccc2[N+](=O)[O-])C1 1847061094 CYOMCJZHLRTUSY-VOTSOKGWSA-N 494.762 5.085 5 20 JKBD C[C@@H](Sc1nnc(-c2ccccc2F)n1C1CC1)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl 9636830 BDMFCOVJVPUWQB-LLVKDONJSA-N 461.906 5.100 5 20 JKBD COc1ccc(C)cc1NC(=O)[C@@H](Sc1nc2ccc([N+](=O)[O-])cc2s1)c1ccccc1 10592286 JXUZWQKRELNZPS-NRFANRHFSA-N 465.556 5.994 5 20 JKBD CC(=O)N(c1nc(COC(=O)c2ccc(Cl)c([N+](=O)[O-])c2)cs1)c1c(C)cc(C)cc1Cl 11025228 QORMEDVOICDJLQ-UHFFFAOYSA-N 494.356 6.017 5 20 JKBD Cc1cccc(NC(=O)c2ccccc2NC(=O)c2ccc(Br)c([N+](=O)[O-])c2)c1 14816721 FUDAQGONJXGZLP-UHFFFAOYSA-N 454.280 5.170 5 20 JKBD C[C@@H](Sc1nnc(-c2ccccc2)n1Cc1ccco1)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl 21684919 DVBGSDBINQCMJJ-CQSZACIVSA-N 483.937 5.267 5 20 JKBD O=C(CSc1nnc(-c2ccc(Cl)cc2)o1)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 23585675 HAFLDNORPJTAAW-UHFFFAOYSA-N 458.805 5.048 5 20 JKBD CNC(=O)Cc1ccc(NC(=O)c2ccccc2Sc2ccc(C(F)(F)F)cc2[N+](=O)[O-])cc1 29360115 WFADLRAFTXXFKN-UHFFFAOYSA-N 489.475 5.306 5 20 JKBD CS(=O)(=O)c1ccc(C(=O)Nc2cc([N+](=O)[O-])ccc2Nc2cccc(C(F)(F)F)c2)cc1 32531789 GHDSMXVNMXWWQM-UHFFFAOYSA-N 479.436 5.013 5 20 JKBD CCCc1ccc(-c2nc(NC(=O)c3cc(SC)c(OC)cc3[N+](=O)[O-])sc2C)cc1 97546337 RTWSJOSDNDAZGX-UHFFFAOYSA-N 457.577 5.962 5 20 JKBD CCCN(Cc1nnc(-c2ccccc2Cl)o1)C(=O)[C@H](C)Sc1ccc([N+](=O)[O-])cc1 104791790 XUQDAPLYUKFMIX-AWEZNQCLSA-N 460.943 5.218 5 20 JKBD O=C(COc1ccccc1[N+](=O)[O-])Nc1ccc(NC(=O)c2ccc(F)cc2)cc1C(F)(F)F 302940577 LBJVLSHYCGTUKT-UHFFFAOYSA-N 477.370 5.023 5 20 JKBD COCc1c(Br)cccc1NC(=O)c1ccc(N2C[C@@H](C)C[C@H](C)C2)c([N+](=O)[O-])c1 303142811 RIBMABYCMDJEKN-GJZGRUSLSA-N 476.371 5.238 5 20 JKBD C[C@@H](Nc1ccc(C(=O)Nc2nc3c(s2)C(=O)CC(C)(C)C3)cc1[N+](=O)[O-])c1ccccn1 409589032 ZSLOMGJIWVIJBO-CYBMUJFWSA-N 465.535 5.027 5 20 JKBD O=C(c1ccc(COc2ccccc2Br)cc1)N1CCc2cc([N+](=O)[O-])ccc21 478129629 AWIXLUJLLFGRDJ-UHFFFAOYSA-N 453.292 5.139 5 20 JKBD C[C@H](Nc1ccc(C(=O)N(Cc2ccc([C@@H]3C[C@H]3C)o2)C2CC2)cc1[N+](=O)[O-])c1ccccn1 506217653 KUVIDYOJANHQFU-LLGFUMIMSA-N 460.534 5.684 5 20 JKBD CN(C)c1ccc(NC(=O)c2ccc(NCc3ccccc3)c([N+](=O)[O-])c2)c(C(F)(F)F)c1 509173757 YKVWZHYBVDVJBR-UHFFFAOYSA-N 458.440 5.544 5 20 JKBD Cc1cccn2cc(-c3ccc(NC(=O)c4ccc([N+](=O)[O-])cc4I)cc3)nc12 509720390 JTOJTGHHKDULKP-UHFFFAOYSA-N 498.280 5.075 5 20 JKBD Cc1csc(Sc2ccc(C(=O)Nc3ccc(-n4cccn4)c(F)c3)cc2[N+](=O)[O-])n1 510120799 SWGKHZPBWFRQDY-UHFFFAOYSA-N 455.496 5.088 5 20 JKBD O=C(Cc1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1)N(Cc1ccco1)c1ccccn1 519074305 CPTWCRVTSAVFIA-UHFFFAOYSA-N 479.496 5.211 5 20 JKBD C[C@H](Nc1ccc(C(=O)N(CCc2ccccc2F)C2CCCC2)cc1[N+](=O)[O-])c1ccccn1 519884897 MPBXZJMNGCPMNP-IBGZPJMESA-N 476.552 5.930 5 20 JKBD COc1cc(C(=O)Nc2ccc(Oc3ccc(F)cc3)c3ccncc23)c([N+](=O)[O-])cc1OC(F)F 524327797 FHLCQPFOZLMHCT-UHFFFAOYSA-N 499.401 5.937 5 20 JKBD CSc1ccc(C(=O)c2ccccc2C(=O)Nc2nccn2Cc2ccccc2)cc1[N+](=O)[O-] 561299471 LIFVLVXMTAQMPE-UHFFFAOYSA-N 472.526 5.045 5 20 JKBD CN(Cc1cc(Br)cs1)C(=O)c1cc([N+](=O)[O-])ccc1NCc1ccccc1 603762314 GCXQBZWRWJWPIJ-UHFFFAOYSA-N 460.353 5.303 5 20 JKBD C[C@H]1C[C@@H](C)CN(c2ccc(C(=O)N3CCC(C(=O)c4cc(F)ccc4F)CC3)cc2[N+](=O)[O-])C1 603905529 HUKZIGQIEFMMOQ-CALCHBBNSA-N 485.531 5.090 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Cl)[C@@H](NCc1ccccc1OCC(F)(F)F)c1ccccc1 604046671 JKWUAQUTSAMZCS-NRFANRHFSA-N 493.869 5.659 5 20 JKBD O=C(c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1)N(Cc1ccncc1)C[C@H]1CCCO1 604545930 SDKJUIAGXIOSCT-OAQYLSRUSA-N 467.909 5.257 5 20 JKBD C[C@@H](Nc1ccc(C(=O)N2CCC(c3nc(-c4ccccc4)no3)CC2)cc1[N+](=O)[O-])c1ccccn1 609141692 GWWNHVDSBSNJCV-GOSISDBHSA-N 498.543 5.233 5 20 JKBD Cc1ccc(-c2nnc(S[C@@H](C(=O)Nc3ccc(C)cc3[N+](=O)[O-])c3ccccc3)o2)cc1 619647575 MDGPHBGOVUXELJ-OAQYLSRUSA-N 460.515 5.734 5 20 JKBD C[C@H](OC(=O)c1cc([N+](=O)[O-])ccc1Br)c1nc(-c2cccc(C(F)(F)F)c2)no1 725985464 KGVBJBWIPDYFTF-VIFPVBQESA-N 486.200 5.344 5 20 JKBD Cc1ccc(Oc2ccc(Cl)cc2NC(=O)Cn2c(C)nc([N+](=O)[O-])c2Br)cc1 726431981 QYYYIJDCGGERRY-UHFFFAOYSA-N 479.718 5.255 5 20 JKBD C[C@@H](NCc1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1)c1ccc2c(c1)CCC(=O)N2 726607698 XLMMHJCKAYBQTN-GOSISDBHSA-N 467.529 5.183 5 20 JKBD C[C@@H]1CN(c2ccc(NC(=O)c3ccc(Cl)cc3[N+](=O)[O-])cc2C(F)(F)F)C[C@@H](C)O1 728038515 KADSSEMKZIDFCU-VXGBXAGGSA-N 457.836 5.133 5 20 JKBD O=C(NO[C@@H]1CCCCO1)c1c2c(nc3ccccc13)/C(=C\c1ccc([N+](=O)[O-])cc1)CCC2 749620678 WAJLHIRWJCPHJI-RIXQQTFQSA-N 459.502 5.208 5 20 JKBD CC(C)(C)c1ccc(Cn2nccc2NC(=O)c2cc([N+](=O)[O-])ccc2Br)cc1 751063714 QPGQHWGRTNIZSV-UHFFFAOYSA-N 457.328 5.152 5 20 JKBD Cc1nc(NC(=O)c2cc([N+](=O)[O-])ccc2Br)sc1Cc1ccccc1F 751092502 FZMUDDNSBYIAIH-UHFFFAOYSA-N 450.289 5.104 5 20 JKBD CC1=C(C(=O)Nc2cccc(C)c2C)[C@H](c2ccc(-c3ccccc3[N+](=O)[O-])s2)NC(=S)N1 812923826 FTZDOBOJXBXCIX-QFIPXVFZSA-N 478.599 5.372 5 20 JKBD CC(=O)N(c1nc(COC(=O)CSc2ccccc2[N+](=O)[O-])cs1)c1c(C)cc(C)cc1C 819010528 GSFSDJBCHYJPOB-UHFFFAOYSA-N 485.587 5.497 5 20 JKBD CC(C)N(Cc1nnc(-c2cccc([N+](=O)[O-])c2)o1)C(=O)CSc1cc(Cl)ccc1Cl 864244716 KNIIKJLYJOEGPS-UHFFFAOYSA-N 481.361 5.481 5 20 JKBD CN(Cc1nc(-c2ccc(OCc3cccnc3)cc2)no1)c1cc(Br)ccc1[N+](=O)[O-] 904467223 VLBITPCOJNMHOM-UHFFFAOYSA-N 496.321 5.018 5 20 JKBD O=[N+]([O-])c1cc(Br)ccc1-c1nc(-c2cccc(OCc3cccnc3)c2)no1 904505801 JRTXDFZKVTUMKU-UHFFFAOYSA-N 453.252 5.048 5 20 JKBD O=C(Nc1ccc(OC[C@@H](O)COc2cccc3ccccc23)cc1)c1cc([N+](=O)[O-])ccc1Cl 914795190 LIPIKVVYCYGEIW-HXUWFJFHSA-N 492.915 5.472 5 20 JKBD C[C@@H](OC(=O)CCOc1ccccc1-c1ccccc1)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl 914998998 DNBWJDJESJNKEU-MRXNPFEDSA-N 468.893 5.255 5 20 JKBD Cc1cc(NC(=O)c2ccccc2Cl)sc1C(=O)OCc1nc(-c2cccc([N+](=O)[O-])c2)no1 915579606 WIFGYCUNWGFQKX-UHFFFAOYSA-N 498.904 5.277 5 20 JKBD O=C(Nc1ccc(F)c([N+](=O)[O-])c1)c1c2c(nc3ccccc13)CCN(Cc1ccccc1)C2 916667073 LKEQAXSRQLQUSD-UHFFFAOYSA-N 456.477 5.093 5 20 JKBD COc1ccc2[nH]cc(C3=CCN(C(=O)c4cc([N+](=O)[O-])ccc4N4CCC(C)CC4)CC3)c2c1 918114529 MLJMYQDLEZBRAV-UHFFFAOYSA-N 474.561 5.251 5 20 JKBD Cc1cc(CCCC(=O)NC2(c3ccc(NC(=O)c4conc4C)cc3)CCC2)c([N+](=O)[O-])cc1F 1787457012 RJRISQPGERGITP-UHFFFAOYSA-N 494.523 5.109 5 20 JKBD COc1cc(CC(=O)Nc2ccc(C3(NC(=O)c4ccc5cc[nH]c5c4)CCC3)cc2)ccc1[N+](=O)[O-] 1790478151 OAQONHJGBFBURP-UHFFFAOYSA-N 498.539 5.075 5 20 JKBD O=C(CCCC(F)(F)F)NC1(c2ccc(NC(=O)c3ccc([N+](=O)[O-])cc3F)cc2)CCC1 1790622965 YKUDAWLNRRPVPG-UHFFFAOYSA-N 467.419 5.214 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)[C@H]3CCCCC3(F)F)CCC2)cc1)c1cccc(F)c1[N+](=O)[O-] 1790700293 YUSRHSHBOQPWMB-GOSISDBHSA-N 475.467 5.307 5 20 JKBD CC1(C)CC(C(=O)NC2(c3ccc(NC(=O)CSc4ccccc4[N+](=O)[O-])cc3)CCC2)C1 1791522902 DWDYJAQDJRKQAX-UHFFFAOYSA-N 467.591 5.257 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)NC1(c2ccc(NC(=O)CCc3ccoc3)cc2)CCC1 1791955713 JXAFUIZMOPZQRQ-UHFFFAOYSA-N 465.481 5.016 5 20 JKBD Cc1c(C(=O)N2CCC3(CCCN(C(=O)C4(c5ccccc5)CC4)C3)CC2)cc(Cl)cc1[N+](=O)[O-] 1804900000 KIUJSQWSWNWHKE-UHFFFAOYSA-N 496.007 5.133 5 20 JKBD CC(C)c1ccc(C(=O)N2CC[C@H](CNC(=O)/C=C/c3ccccc3[N+](=O)[O-])[C@@H]2c2cccnc2)cc1 1814194138 LNNSALBZMVBJOX-JGPWACIWSA-N 498.583 5.146 5 20 JKBD CCC[C@H]1CC[C@H](C(=O)Nc2cc([C@@H]3CCCCN3C(=O)c3ccc([N+](=O)[O-])c(OC)c3)[nH]n2)CC1 1822100031 FMUUPNGXKVHJJM-WFXMLNOXSA-N 497.596 5.239 5 20 JKBD O=C(/C=C/c1ccccc1[N+](=O)[O-])N1CCC([C@H]2CCCCN2C(=O)C2CCC(F)(F)CC2)CC1 1824329196 SFVMMWSHSMRCAL-HYGBKTPJSA-N 489.563 5.053 5 20 JKBD Cc1ccc(C(=O)N2CCC([C@@H]3CCCCN3C(=O)c3cc(F)cc([N+](=O)[O-])c3)CC2)cc1Cl 1830612926 MFZRLRVBTZCKKM-QHCPKHFHSA-N 487.959 5.243 5 20 JKBD Cc1ccc(NC(=O)[C@@H](OC(=O)c2ccccc2Br)c2ccccc2)c([N+](=O)[O-])c1 11026289 ZOIFWRSGIJYLEX-FQEVSTJZSA-N 469.291 5.203 5 20 JKBD C[C@@H](Sc1ncc(-c2ccccc2)n1CC(F)(F)F)C(=O)Nc1ccccc1[N+](=O)[O-] 109623326 LWNMQUSWZFMKGK-CYBMUJFWSA-N 450.442 5.140 5 20 JKBD C[C@@H]1CCCCN1CC(=O)Nc1ccc(F)c(NC(=O)c2cc3cc([N+](=O)[O-])ccc3s2)c1 117336013 LRHIBMFTWLPAEL-CQSZACIVSA-N 470.526 5.014 5 20 JKBD Cc1cc(C)n(-c2ccc(CNc3ccc([N+](=O)[O-])c(C(=O)N4CCCC4)c3)c(C(F)(F)F)c2)n1 303036604 RZDUXEHVEXQOHC-UHFFFAOYSA-N 487.482 5.264 5 20 JKBD COc1ccc([N+](=O)[O-])c(C(=O)Nc2sc(-c3ccccc3)c(C)c2C(=O)N2CCCCC2)c1 409940437 CBOKTNNZRKAEJS-UHFFFAOYSA-N 479.558 5.519 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)Nc2cc(Cl)ccc2Sc2nccn2C)cc1SC 483466209 FIDJLCJOISRGIB-UHFFFAOYSA-N 464.956 5.116 5 20 JKBD C[C@H]1CCc2c(sc3nc([C@H](C)Sc4nc5cc6ccccc6cc5c(=O)n4C)nc(O)c23)C1 495383249 BARAIONPMWNFNZ-KBPBESRZSA-N 488.638 5.775 5 20 JKBD O=C(Nc1ccc(CC(=O)N2CCSCC2)cc1)c1cc([N+](=O)[O-])ccc1Sc1ccccc1 499486267 OPPPPEXCCYLSQN-UHFFFAOYSA-N 493.610 5.116 5 20 JKBD Cc1c(C(=O)Nc2ccc(Oc3ncc(Cl)cc3Cl)cc2)nnn1-c1cccc([N+](=O)[O-])c1 500380761 YQENKKQVRSSILU-UHFFFAOYSA-N 485.287 5.230 5 20 JKBD Cc1cccc([N+](=O)[O-])c1NC(=O)CSc1nnc(-c2ccc(Cl)cc2Cl)n1C(C)C 502592504 FYZDAEJZGYZIQM-UHFFFAOYSA-N 480.377 5.780 5 20 JKBD O=C(Nc1cc(Br)cnc1O)c1cc([N+](=O)[O-])ccc1Sc1ccc(Cl)cc1 504236537 SOURYLAAGURSFF-UHFFFAOYSA-N 480.727 5.515 5 20 JKBD Cc1sc(CNC(=O)C2CCN(c3ccccc3[N+](=O)[O-])CC2)nc1-c1ccc(Cl)cc1 509671213 OJFSKCHODDZETP-UHFFFAOYSA-N 470.982 5.213 5 20 JKBD Cc1ccc(S(=O)(=O)Nc2ccc(NC(=O)c3cc(C(C)C)n(C(C)(C)C)n3)cc2)cc1[N+](=O)[O-] 512105203 KZGWYXQTTVINCE-UHFFFAOYSA-N 499.593 5.031 5 20 JKBD COc1cc(C(=O)Nc2ccc(Cl)cc2Cl)c([N+](=O)[O-])cc1OCc1cscn1 512378821 BNXLCRYHLJGAOO-UHFFFAOYSA-N 454.291 5.198 5 20 JKBD O=C(NCc1ccc(OCC(F)(F)F)nc1)c1cc([N+](=O)[O-])ccc1Sc1ccccc1 516106028 DNUKWTVRQUEMMP-UHFFFAOYSA-N 463.437 5.012 5 20 JKBD COc1cc([C@@H](C)NCc2ccc(-c3ccccc3[N+](=O)[O-])s2)ccc1OCc1ccncc1 518272571 BLFRAOMMZFRVBN-GOSISDBHSA-N 475.570 6.157 5 20 JKBD O=C(Nc1cccc(OC(F)F)c1)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 603760711 RICBYWZZXGIYCT-UHFFFAOYSA-N 459.371 5.070 5 20 JKBD COc1ccc([C@@H](Cc2ccc(F)cc2)N[C@@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)cc1 604459755 IZEUCPFMMWLAIE-QMHKHESXSA-N 462.481 5.427 5 20 JKBD C[C@H]1CCCN(c2ccc(C(=O)Nc3cc(C(=O)N4CCCCC4)ccc3Cl)cc2[N+](=O)[O-])C1 608873357 VBMSYKHETOIYRC-KRWDZBQOSA-N 484.984 5.363 5 20 JKBD COc1cc(C(=O)Nc2ccc(F)cc2C(F)(F)F)c([N+](=O)[O-])cc1OCc1cscn1 609065340 VSSJWJSOXKJRGY-UHFFFAOYSA-N 471.388 5.049 5 20 JKBD CC(C)Oc1ccc([N+](=O)[O-])cc1COC(=O)COc1ccc(C2SCCCS2)cc1 729116972 ARICOVMEMQWFIC-UHFFFAOYSA-N 463.577 5.373 5 20 JKBD Cc1ccc2nc(-c3cccnc3)cc(C(=O)O[C@@H](C)C(=O)Nc3cc([N+](=O)[O-])ccc3Cl)c2c1 730442606 XANFLORPSSIFLZ-HNNXBMFYSA-N 490.903 5.351 5 20 JKBD Cc1c(C(=O)O[C@H](C)c2nc(-c3cccc(C(F)(F)F)c3)no2)cc([N+](=O)[O-])c(C)c1[N+](=O)[O-] 748946371 HGCHHWNYZSVPAL-LLVKDONJSA-N 480.355 5.107 5 20 JKBD CN(C)c1ccc([C@@H](CNC(=O)c2c[nH]c3ccc([N+](=O)[O-])cc23)c2c[nH]c3ccccc23)cc1 749367875 OLWQYGJQZQTCJI-JOCHJYFZSA-N 467.529 5.185 5 20 JKBD O=C(Nc1cc([N+](=O)[O-])ccc1F)c1sc(-c2ccccc2)cc1OCC(=O)N1CCCCC1 917611646 NDISYJACXXMLAU-UHFFFAOYSA-N 483.521 5.106 5 20 JKBD C[C@@H](NC(=O)c1cccc(Cl)c1Cl)C(=O)OCc1nc2ccccc2c2ccccc12 919210337 SAHAQKXHHXZGNM-CQSZACIVSA-N 453.325 5.557 5 20 JKBD CC(C)N(Cc1ccc([N+](=O)[O-])cc1)Cn1nc(-c2ccncc2)n(-c2ccccc2)c1=S 919950683 OYPJZEKESGJVNC-UHFFFAOYSA-N 460.563 5.242 5 20 JKBD CCCc1onc(C)c1C(=O)NC1(c2ccc(NC(=O)CCc3cccc([N+](=O)[O-])c3)cc2)CCC1 1786600615 YWFLQCZBKZQABL-UHFFFAOYSA-N 490.560 5.224 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)c3ccc4occc4c3)CCC2)cc1)c1cc(F)cc([N+](=O)[O-])c1 1790696674 WEAPQESVKHNEBI-UHFFFAOYSA-N 473.460 5.542 5 20 JKBD O=C(CCCCn1cccc1)NC1(c2ccc(NC(=O)c3cccc(F)c3[N+](=O)[O-])cc2)CCC1 1790700950 GGTBCWCFVHGZAT-UHFFFAOYSA-N 478.524 5.154 5 20 JKBD Cc1cccc(CCC(=O)NC2(c3ccc(NC(=O)c4c(F)ccc([N+](=O)[O-])c4C)cc3)CCC2)n1 1790771128 RFIFXPDQZNHNHW-UHFFFAOYSA-N 490.535 5.126 5 20 JKBD COc1cc(CC(=O)NC2(c3ccc(NC(=O)[C@@H](C)c4ccccc4)cc3)CCC2)ccc1[N+](=O)[O-] 1792313291 PCVIMJDYUOFAFD-IBGZPJMESA-N 487.556 5.084 5 20 JKBD CC(C)[C@H](C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1ccc([N+](=O)[O-])cc1F)C2)c1ccc(Cl)cc1 1793224063 UFILYPRSHURGHH-YWNPBTLJSA-N 487.959 5.079 5 20 JKBD Cc1c(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2ccc(OC(C)(C)C)cc2)cc(Cl)cc1[N+](=O)[O-] 1800498342 PTLHKFXBRLMMRS-ACDBMABISA-N 499.995 5.300 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)C1(c3ccc(Cl)cc3)CCC1)C2 1800700388 RQVCGMADADTNQO-ACDBMABISA-N 499.970 5.069 5 20 JKBD Cc1oc(C(C)(C)C)cc1C(=O)N1CCCC2(CCN(C(=O)Cc3cc([N+](=O)[O-])ccc3F)CC2)C1 1808375812 PTYWUBXDTZEMFW-UHFFFAOYSA-N 499.583 5.020 5 20 JKBD CC(C)(C)CCCCCC(=O)NC[C@@H]1CCN(C(=O)Cc2cccc([N+](=O)[O-])c2)[C@H]1c1cccnc1 1812804684 SEAZHXIRIAUQCR-HOFKKMOUSA-N 494.636 5.235 5 20 JKBD CC(C)c1ccc(CC(=O)N2CCCC[C@@H]2c2cc(NC(=O)c3ccc([N+](=O)[O-])cc3F)n[nH]2)cc1 1821051483 ZXERDTWTFZZPJT-HSZRJFAPSA-N 493.539 5.129 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)Nc1cc([C@H]2CCCCN2C(=O)CCC2CCCC2)[nH]n1 1821283206 LRJWOLXEHLEFLB-HXUWFJFHSA-N 471.533 5.042 5 20 JKBD CC[C@H](C)[C@H](C(=O)N1CCC([C@H]2CCCCN2C(=O)c2ccc([N+](=O)[O-])o2)CC1)c1ccccc1 1823611626 MORZDZIFYGBDBD-SWHJIRTISA-N 481.593 5.251 5 20 JKBD Cc1c(C(=O)N2CCC([C@@H]3CCCCN3C(=O)/C=C/c3ccc([N+](=O)[O-])o3)CC2)oc2ccccc12 1824277585 SZHMBSXPIPJUJZ-CRWWQRIJSA-N 491.544 5.189 5 20 JKBD C[C@H](Sc1ccccc1)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)/C=C/c2ccc([N+](=O)[O-])o2)CC1 1824385577 SGOSLSZTZDPRQB-MAPOSKBOSA-N 497.617 5.002 5 20 JKBD Cc1ccc(S/C=C/C(=O)N2CCCC[C@H]2C2CCN(C(=O)c3ccc([N+](=O)[O-])o3)CC2)cc1 1828878846 QSMHVFIPZKHBRO-ZDJZVTAXSA-N 483.590 5.036 5 20 JKBD O=C(/C=C/c1ccco1)N1CCC([C@@H]2CCCCN2C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)CC1 1831059603 IQPYILZADDKUFY-GLJAUCNMSA-N 493.585 5.349 5 20 JKBD CCCCC[C@@H](C)C(=O)N1CCC([C@@H]2CCCCN2C(=O)Cc2cc(F)ccc2[N+](=O)[O-])CC1 1832889357 WACFMTHKHLVKPF-XXBNENTESA-N 475.605 5.113 5 20 JKBD O=C(c1ncccc1-c1ccccc1)N1CC2(CCCN2C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)C1 1845738949 VELPHDUFGVKAAV-UHFFFAOYSA-N 498.564 5.002 5 20 JKBD O=C(Cn1c2ccccc2c(=O)c2ccccc21)Nc1ccc(Cc2nc3ccccc3s2)cc1 11250527 YTAWGYIPSFBWJK-UHFFFAOYSA-N 475.573 5.994 5 20 JKBD C[C@H](OC(=O)c1cc(-c2ccccc2)nc2ccccc12)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 17483248 OPWHWCKZCQTVIL-INIZCTEOSA-N 466.453 5.778 5 20 JKBD CCOc1cc([N+](=O)[O-])c(C(=O)OCc2csc(N(C(C)=O)c3ccc(C)cc3C)n2)cc1OC 19159589 JIULCMJHKRVVOD-UHFFFAOYSA-N 499.545 5.117 5 20 JKBD COc1cccc(NC(=O)c2ccccc2NC(=O)Cn2c3ccccc3c(=O)c3ccccc32)c1 22017982 WFWCWSANEVKBMG-UHFFFAOYSA-N 477.520 5.054 5 20 JKBD CCOc1cc(C(=O)NC[C@@H]2CC3c4ccccc4C2c2ccccc23)c([N+](=O)[O-])cc1OC 22878625 PCNRSPBZMCWMME-WAFXNIOSSA-N 458.514 5.029 5 20 JKBD COc1ccc(NC(=O)c2cc(OC)c(OC(F)F)cc2[N+](=O)[O-])cc1Cc1ccccc1 24826884 LLXJWJPSVUZANU-UHFFFAOYSA-N 458.417 5.057 5 20 JKBD COc1cc(F)ccc1NC(=O)C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1 25797970 BIABXDJWQKWIPA-VBKFSLOCSA-N 463.490 5.922 5 20 JKBD COc1cc(C(=O)N[C@@H](C)CC(C)(C)c2ccccc2)c([N+](=O)[O-])cc1OCc1cscn1 60110798 TWCWBXIIUCNSOQ-INIZCTEOSA-N 469.563 5.125 5 20 JKBD COc1cc(C(=O)N[C@H](C)CC(C)(C)c2ccccc2)c([N+](=O)[O-])cc1OCc1cscn1 60110801 TWCWBXIIUCNSOQ-MRXNPFEDSA-N 469.563 5.125 5 20 JKBD Cc1nn(Cc2ccc(C(=O)Nc3ccccc3CN3CCc4ccccc43)cc2)c(C)c1[N+](=O)[O-] 71940246 IGQJIBTWUPPGDW-UHFFFAOYSA-N 481.556 5.271 5 20 JKBD CC(=O)Oc1ccc(-c2ccc(C(=O)O[C@@H](C)C(=O)Nc3ccc([N+](=O)[O-])cc3Cl)cc2)cc1 104539296 UMCISRQTJAQBPZ-AWEZNQCLSA-N 482.876 5.025 5 20 JKBD CCOc1ccc([C@H](CNC(=O)c2cc([N+](=O)[O-])c(C)s2)c2c[nH]c3ccccc23)cc1OC 105837845 LOSAOUSUVHUFKS-SFHVURJKSA-N 479.558 5.415 5 20 JKBD Cc1ccc(NC(=O)Nc2ccccc2)cc1NC(=O)c1ccc(Br)c([N+](=O)[O-])c1 107801667 XEOPLGQLMYRERF-UHFFFAOYSA-N 469.295 5.562 5 20 JKBD O=C(c1c[nH]c2ccc([N+](=O)[O-])cc12)N(Cc1ccc(Cl)c(Cl)c1)Cc1ccccn1 110396547 WQLROXGNMWAIMQ-UHFFFAOYSA-N 455.301 5.621 5 20 JKBD O=C(NCc1ccccc1[N+](=O)[O-])Nc1ccc(NC(=O)c2ccc(F)cc2)cc1C(F)(F)F 410145725 OCEKAARHFXPZSK-UHFFFAOYSA-N 476.386 5.327 5 20 JKBD C[C@H](c1ccccc1)N(C)C(=O)C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1 491174901 SEYJWGSKVAMJFC-WKSXIXGESA-N 457.555 6.355 5 20 JKBD COc1cccc([C@@H](CNC(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2c[nH]c3ccccc23)c1OC 503677060 RDBLXBSISSZQDI-LJQANCHMSA-N 494.935 5.700 5 20 JKBD C[C@@H](Nc1ccc(C(=O)N(C)CCOc2ccc(Br)cc2)cc1[N+](=O)[O-])c1ccccn1 505987125 NWYCVAPDFZLLLU-MRXNPFEDSA-N 499.365 5.076 5 20 JKBD CC(C)Sc1ccc([N+](=O)[O-])cc1C(=O)Nc1nc(-c2ccc3c(c2)CCC(=O)N3)cs1 507742024 NDVTVVXXJOCBJO-UHFFFAOYSA-N 468.560 5.356 5 20 JKBD O=C1CCCN1c1cccc(CNCc2ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])cc2)c1 509600911 KFGOIVNJKHEGMJ-UHFFFAOYSA-N 451.910 5.457 5 20 JKBD COc1cc(C(=O)Nc2cccc(-c3csc(C)n3)c2)c([N+](=O)[O-])cc1OCc1cscn1 509893479 LFAFWIGTDVZFPE-UHFFFAOYSA-N 482.543 5.323 5 20 JKBD O=C(Nc1nccs1)c1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2NCc2ccccc2)cc1 512322456 JDEBZUTXOOSISU-UHFFFAOYSA-N 473.514 5.168 5 20 JKBD CC[C@H](C)c1ccc([C@@H](NC(=O)C(=O)Nc2cc([N+](=O)[O-])ccc2OC)c2cccs2)cc1 515140876 APCUQJMFWFLENO-OYHNWAKOSA-N 467.547 5.023 5 20 JKBD COc1cc(C(=O)Nc2cccc(NC(=O)c3ccccc3)c2C)c([N+](=O)[O-])cc1OC(F)F 515739693 KUBGESAHWWRMIB-UHFFFAOYSA-N 471.416 5.018 5 20 JKBD C[C@H](Nc1ccc(C(=O)Nc2ccccc2-c2nc3ccccc3s2)cc1[N+](=O)[O-])c1ccccn1 518423373 JMFZURFKHJLVII-KRWDZBQOSA-N 495.564 6.692 5 20 JKBD C[C@@H]1CCCCN1CCCNC(=O)C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1 518747918 QCSSLUATHFDFNR-JUJXNAJKSA-N 478.618 5.516 5 20 JKBD C[C@H](S[C@@H](C)c1ccc(OC(F)(F)F)cc1)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 518917015 NWPCICUTWYRVKX-QWRGUYRKSA-N 482.402 6.334 5 20 JKBD O=C(C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)Nc1ccc(F)c(F)c1F 603470333 STDBJESKHYBVTO-SDNWHVSQSA-N 469.444 6.191 5 20 JKBD COc1cc(C(=O)Nc2nc(Cc3ccccc3)c(-c3ccccc3)s2)c([N+](=O)[O-])cc1OC 603670964 VNRRURYDUMYKAE-UHFFFAOYSA-N 475.526 5.579 5 20 JKBD O=C(c1cc(N[C@@H]2C[C@@H](C(F)(F)F)C[C@@H](C(F)(F)F)C2)ccc1[N+](=O)[O-])N1CCCC1 603943522 MXJICEHWGUAMSW-IMRBUKKESA-N 453.383 5.152 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Cl)[C@H](Nc1cccc(COCc2ccco2)c1)c1ccccc1 604045982 NQVVJKLVHSOXCN-RUZDIDTESA-N 491.931 6.350 5 20 JKBD COc1ccc(-c2ccc(CN[C@@H](c3ccc(Cl)cc3)c3nccn3C)o2)c([N+](=O)[O-])c1 608835649 GLIDVAZRPJKMDJ-QFIPXVFZSA-N 452.898 5.130 5 20 JKBD CCCCN1Cc2cccc(N[C@@H](C)C(=O)Nc3ccc([N+](=O)[O-])cc3C(F)(F)F)c2C1 608981180 LLDDNPMOZBOZRT-AWEZNQCLSA-N 450.461 5.168 5 20 JKBD COc1cc(C(=O)Nc2nc(-c3ccccc3OC(F)F)cs2)c([N+](=O)[O-])cc1OC(F)F 609021644 KFIOGBIBJXNRJJ-UHFFFAOYSA-N 487.387 5.182 5 20 JKBD O=C(COC(=O)c1csc(-c2ccc(Cl)c(Cl)c2)n1)Nc1cc(Cl)ccc1[N+](=O)[O-] 744605328 SUIXPGQBPHSNMV-UHFFFAOYSA-N 486.720 5.474 5 20 JKBD Cc1c(C(=O)N(CC2CC2)c2ccc(Cl)c([N+](=O)[O-])c2)sc2nc3n(c(=O)c12)CCCCC3 745353991 NIGRXMWOJBJYJJ-UHFFFAOYSA-N 486.981 5.111 5 20 JKBD COc1cc(C)ccc1Oc1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2Br)cn1 751085504 WPOOCDXVNOXUDA-UHFFFAOYSA-N 458.268 5.114 5 20 JKBD C[C@H]1C[C@@H](C)CN(c2ccc(C(=O)OCC(=O)Nc3c(Cl)cccc3Cl)cc2[N+](=O)[O-])C1 787458032 ZGNLZNRSRKPDHD-OKILXGFUSA-N 480.348 5.179 5 20 JKBD CC(C)(C)OC(=O)Nc1ccc(CC(=O)Nc2nc(-c3cccc([N+](=O)[O-])c3)cs2)cc1 906717113 PGSZHXKSEZQSDK-UHFFFAOYSA-N 454.508 5.247 5 20 JKBD CC(=O)Nc1ccc(N[C@@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2ccccc2)cc1C 913095709 WFSRRGLDLHTQKK-JOCHJYFZSA-N 452.898 5.307 5 20 JKBD Cc1cc(Br)cc(C)c1NC(=O)N[C@@H](CC(=O)OC(C)C)c1ccccc1[N+](=O)[O-] 915707753 GGRWHOBLJVTADX-KRWDZBQOSA-N 478.343 5.179 5 20 JKBD CC(=O)N(c1ccc(F)cc1)c1nc(COC(=O)c2c3ccccc3cc3ccccc23)cs1 918867611 BZVYVSQHGAGQQA-UHFFFAOYSA-N 470.525 6.630 5 20 JKBD CCC(CC)(Cc1nc2ccccc2s1)C(=O)OCc1cc([N+](=O)[O-])cc2c1OCOC2 919109377 UDUPJWSRIWXLIT-UHFFFAOYSA-N 456.520 5.163 5 20 JKBD C[C@H](OC(=O)c1ccc(N[C@@H](C)c2ccccn2)c([N+](=O)[O-])c1)C(=O)N[C@H](C)c1ccc(Cl)cc1 920548890 UUFFRMVDHOJOCK-IKGGRYGDSA-N 496.951 5.239 5 20 JKBD Cc1cc(O)c([N+](=O)[O-])cc1C(=O)Nc1ccc(C2(NC(=O)c3cc4[nH]ccc4s3)CCC2)cc1 1790809534 PBELRRXLLJFZDW-UHFFFAOYSA-N 490.541 5.213 5 20 JKBD COc1cc(C(=O)Nc2ccc(C3(NC(=O)c4sccc4C)CCC3)cc2)ccc1[N+](=O)[O-] 1792164193 YSZJYSDQOBYANW-UHFFFAOYSA-N 465.531 5.035 5 20 JKBD Cc1scc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)c1C 1801207524 QEIFMMPMUFFQLA-BJWYYQGGSA-N 469.588 5.053 5 20 JKBD Cc1ccc(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)CSc3ccccc3[N+](=O)[O-])n[nH]2)c(C)c1 1822312946 HUPNBDJIKDCQMH-HXUWFJFHSA-N 493.589 5.033 5 20 JKBD O=C(/C=C/c1ccccc1[N+](=O)[O-])Nc1cc([C@@H]2CCCCN2C(=O)c2ccc3ccoc3c2)[nH]n1 1823502633 FBVQIEBBYBDDNX-NEQMZLFVSA-N 485.500 5.083 5 20 JKBD C[C@@H]1C[C@]1(C)C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)CC1 1830223035 CTTZHKGPIFVKJW-BXEPQMNJSA-N 469.607 5.089 5 20 JKBD O=C(COC(=O)CSc1ccc([N+](=O)[O-])cc1)Nc1c(Cl)c(Cl)cc(Cl)c1Cl 9352116 CEXIBZLCQPHWEC-UHFFFAOYSA-N 484.144 5.482 5 20 JKBD CCCCn1c(SCc2cc(OC)c(OC(F)F)cc2[N+](=O)[O-])nc2ccccc2c1=O 12721183 GMDAHMXKUPZYJQ-UHFFFAOYSA-N 465.478 5.007 5 20 JKBD CCCc1ccc([C@H](NC(=O)c2ccc(Sc3nncn3C)c([N+](=O)[O-])c2)c2cccs2)cc1 18136439 CWEOZOOQFKYUPE-QFIPXVFZSA-N 493.614 5.408 5 20 JKBD CCCn1c(S[C@@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)nnc1-c1cccc(C)c1 21159200 ALGIYOUVGXEGCO-AWEZNQCLSA-N 459.959 5.344 5 20 JKBD CSCC[C@H](NC(=O)c1cccc([N+](=O)[O-])c1)C(=O)Nc1ccc(Oc2cccc(F)c2)cc1 108567996 AUQOKXDDTMSEKY-QFIPXVFZSA-N 483.521 5.016 5 20 JKBD C[C@@H](Nc1ccc(C(=O)N2CCCN(Cc3ccc(Cl)cc3)CC2)cc1[N+](=O)[O-])c1ccccn1 303003584 NIPCHMFGXXHFJW-LJQANCHMSA-N 493.995 5.164 5 20 JKBD Cc1cnn(Cc2cc(F)ccc2F)c1NC(=O)c1ccc(N2C[C@H](C)C[C@@H](C)C2)c([N+](=O)[O-])c1 502689151 HMYLJBWDFVLAFN-HZPDHXFCSA-N 483.519 5.161 5 20 JKBD Cc1ncc(CN(C)C(=O)C/C(=C/c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)s1 502906441 HKTOVRZTQRISMI-BOPFTXTBSA-N 464.572 5.559 5 20 JKBD CC(C)N(C(=O)CCCn1c(=O)oc2cc([N+](=O)[O-])ccc21)c1ccc(Cl)c(Cl)c1 505073817 MALCTQMKTSRXDS-UHFFFAOYSA-N 452.294 5.031 5 20 JKBD COc1cc(C(=O)N[C@H](C)c2ccc(Oc3ccccc3)cc2)c([N+](=O)[O-])cc1OC(F)F 506268070 DIJSIJMOBXHYDK-CQSZACIVSA-N 458.417 5.488 5 20 JKBD O=[N+]([O-])c1cc(CNCc2cn(-c3ccccc3)nc2-c2ccncc2)ccc1Oc1ccc(F)cc1 507896536 OYTIQYDAUUBJRS-UHFFFAOYSA-N 495.514 6.064 5 20 JKBD Cc1ccc(Sc2ccc(CNCc3ccc(N4C[C@H](C)O[C@@H](C)C4)nc3)cc2[N+](=O)[O-])cc1 509598644 CUBAPYISACVOLN-PMACEKPBSA-N 478.618 5.353 5 20 JKBD O=C(Nc1ccc2nc(-c3cc(F)ccc3F)[nH]c2c1)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-] 516524883 MUWNIKHRWKBUSE-UHFFFAOYSA-N 492.360 5.610 5 20 JKBD CCOc1cc(CN[C@@H]2CCC(C)(C)c3ccccc32)ccc1OCCn1c([N+](=O)[O-])cnc1C 517547521 YFQYLFGQFMAZFG-HSZRJFAPSA-N 478.593 5.480 5 20 JKBD COc1ccc(C(=O)N2CCCC2)cc1NC(=O)c1ccc(Sc2nc(C)cs2)c([N+](=O)[O-])c1 519874594 IJIOQKGYQQOHMG-UHFFFAOYSA-N 498.586 5.008 5 20 JKBD C[C@H](COCC(F)(F)F)NC(=O)c1ccccc1Sc1ccc(C(F)(F)F)cc1[N+](=O)[O-] 520066011 PVJWJLGYYWSMAK-LLVKDONJSA-N 482.402 5.462 5 20 JKBD Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)c1ccccc1SCC(=O)NC12CC3CC(CC(C3)C1)C2 603501586 SHFJZSPYZPEDDN-UHFFFAOYSA-N 493.629 5.641 5 20 JKBD Cc1ccc(Sc2ccc(C(=O)N3CCCc4cc(S(C)(=O)=O)ccc43)cc2[N+](=O)[O-])cc1 603960178 DBJBFYWJCCVCTD-UHFFFAOYSA-N 482.583 5.051 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Cl)[C@@H](NCc1ccc(N2CCCCC2)nc1)c1ccccc1 604045559 UOYDCFZRSMQAQS-DEOSSOPVSA-N 479.968 5.103 5 20 JKBD CC(C)c1nc(CCNC(=O)C/C(=C/c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)cs1 608819900 DIYSBSXOXIPGSZ-AQTBWJFISA-N 492.626 6.074 5 20 JKBD Cc1ccccc1NC(=O)[C@H]1CCc2ccccc2N1C(=O)C1CCN(c2ccccc2[N+](=O)[O-])CC1 608872013 JVKDXDZAGIEOAT-HHHXNRCGSA-N 498.583 5.106 5 20 JKBD CCNc1ccc(C(=O)Nc2ccc(OC)c(OCc3ccc4ccccc4n3)c2)cc1[N+](=O)[O-] 609066112 IFYHIKCHFBJMPY-UHFFFAOYSA-N 472.501 5.415 5 20 JKBD CC(C)(C)c1ccc(Oc2ccc(CNC3CCN(C(=O)CC(F)(F)F)CC3)cc2[N+](=O)[O-])cc1 609223759 VTKIGDSDQMYHRN-UHFFFAOYSA-N 493.526 5.718 5 20 JKBD CN(C(=O)CSc1nnc(Cc2ccccc2)n1-c1ccc(Cl)cc1)c1ccc([N+](=O)[O-])cc1 619740681 ZHNPNPYIFJKAGG-UHFFFAOYSA-N 493.976 5.175 5 20 JKBD O=C(Nc1ccccc1OCc1ncc(-c2cccc(Cl)c2)o1)c1cc([N+](=O)[O-])ccc1Cl 726763465 ILNMMWKFUKEHFB-UHFFFAOYSA-N 484.295 6.388 5 20 JKBD COc1ccc(C(=O)Oc2ccc(NC(=O)c3cc([N+](=O)[O-])ccc3Cl)cc2)c(Cl)c1 730956876 SAJUJGUXJNGDJZ-UHFFFAOYSA-N 461.257 5.382 5 20 JKBD Cc1c(C(=O)Oc2ccc(NC(=O)c3cc([N+](=O)[O-])ccc3Cl)cc2)oc2c1C(=O)CCC2 915810677 HUZKBLDZYFRKAY-UHFFFAOYSA-N 468.849 5.140 5 20 JKBD C[C@@H](c1ccccc1)n1c(SCC(=O)Nc2cc([N+](=O)[O-])ccc2F)nnc1-c1ccccc1 917254620 RCZZPYNKJOYXHW-INIZCTEOSA-N 477.521 5.333 5 20 JKBD O=C(Cc1ccc(NC(=O)c2cc3ccccc3o2)cc1)Nc1cc([N+](=O)[O-])c(F)cc1F 919994501 SPPOWLGGPRFDCM-UHFFFAOYSA-N 451.385 5.053 5 20 JKBD C[C@@H](Nc1ccc(C(=O)OCC(=O)c2cccc3ccccc23)cc1[N+](=O)[O-])c1ccccn1 920547603 OTQFBUITMWXPSI-QGZVFWFLSA-N 455.470 5.356 5 20 JKBD CC1=C(C(=O)Nc2ccc([N+](=O)[O-])cc2)[C@H](c2ccc(O)c(Cl)c2)NC(=O)N1Cc1cccs1 921298640 KEKYFMJPKBXENA-NRFANRHFSA-N 498.948 5.195 5 20 JKBD Cc1ccncc1C(=O)Nc1ccc(C2(NC(=O)c3cc4cc([N+](=O)[O-])ccc4s3)CCC2)cc1 1788822696 CGXMGYNBOBNVPC-UHFFFAOYSA-N 486.553 5.574 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)NC1(c2ccc(NC(=O)c3cnccc3Cl)cc2)CCC1 1789680304 DNVDJCQQEWLQAH-UHFFFAOYSA-N 482.899 5.152 5 20 JKBD O=C(C[C@@H]1C[C@@H]2CC[C@H]1C2)NC1(c2ccc(NC(=O)c3cccc(F)c3[N+](=O)[O-])cc2)CCC1 1790698635 LEDMDGFVYBUKNF-SQNIBIBYSA-N 465.525 5.308 5 20 JKBD CN(C)c1ccc([N+](=O)[O-])cc1C(=O)Nc1ccc(C2(NC(=O)CSC3CCCC3)CCC2)cc1 1790791673 CFYKKEPKLQDLOO-UHFFFAOYSA-N 496.633 5.084 5 20 JKBD O=C(NC1(c2ccc(NC(=O)c3ccc(C(F)(F)F)cc3F)cc2)CCC1)c1ccc([N+](=O)[O-])o1 1792169165 YHGDRNWOHYFXII-UHFFFAOYSA-N 491.397 5.407 5 20 JKBD Cc1ccc(N2C(=O)/C(=C\c3ccc4c(c3)OCO4)N=C2SCc2ccccc2[N+](=O)[O-])cc1 8750966 ZKHXEMRLOMLAIY-UDWIEESQSA-N 473.510 5.309 5 20 JKBD COc1ccc(-c2nc(COC(=O)Cn3c4ccccc4c(=O)c4ccccc43)cs2)cc1OC 10722988 DWYMXNNKZIOUHA-UHFFFAOYSA-N 486.549 5.039 5 20 JKBD COc1ccc(NC(C)=O)cc1NC(=O)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1 10935656 OWKDQHZZOHSPIY-UHFFFAOYSA-N 455.854 5.260 5 20 JKBD Cc1cc2oc(=O)cc(COC(=O)Cn3c4ccccc4c(=O)c4ccccc43)c2cc1C(C)C 11277387 GLWNQVWHMWISQN-UHFFFAOYSA-N 467.521 5.436 5 20 JKBD O=C1c2ccccc2N[C@H](c2cn(-c3ccccc3)nc2-c2ccc([N+](=O)[O-])cc2)N1C[C@@H]1CCCO1 15503707 PLCXEUWOIHIJDM-CUNXSJBXSA-N 495.539 5.193 5 20 JKBD Cc1cc([N+](=O)[O-])ccc1NC(=O)COC(=O)c1ccc(COc2ccc3ccccc3c2)o1 24919135 RWJMWIOARSFHEL-UHFFFAOYSA-N 460.442 5.024 5 20 JKBD Cc1nn(CC(C)C)c(C)c1CC(=O)O[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1 28442522 GQJCSZHOPZHSGU-XMMPIXPASA-N 498.967 5.183 5 20 JKBD C[C@@H](NC(=O)c1ccccc1SCC(=O)NC12CC3CC(CC(C3)C1)C2)c1cccc([N+](=O)[O-])c1 195697032 SPNODHCCGSGEPW-IHAPDJFTSA-N 493.629 5.263 5 20 JKBD O=C(NC1CCCCC1)c1ccc(NC(=O)c2csc(-c3ccc([N+](=O)[O-])cc3)n2)cc1 215730085 WZXRGONLHCXMRB-UHFFFAOYSA-N 450.520 5.033 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)Nc2nc3c(s2)C[C@H](c2ccccc2)CC3)cc1SC 303196858 NIUWHWIPVBRXST-CQSZACIVSA-N 455.561 5.307 5 20 JKBD O=C(Nc1nc(-c2ccc(Cl)cc2Cl)cs1)c1cc2c(cc1[N+](=O)[O-])OCCO2 484539868 ZPVKRBMSEKHZRO-UHFFFAOYSA-N 452.275 5.049 5 20 JKBD C[C@@H](N[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1)c1ccc(OC(F)F)cc1 493604714 WCACMEOZCFKTPU-SZNDQCEHSA-N 475.879 5.880 5 20 JKBD COc1cc(C(=O)Nc2ccc(NCc3ccccc3)c(Cl)c2)c([N+](=O)[O-])cc1OC(F)F 497519828 CEEGNNJEKLBPMY-UHFFFAOYSA-N 477.851 5.723 5 20 JKBD COc1ccc(Oc2ccc([N+](=O)[O-])cc2C(=O)Nc2cccc(C(=O)N3CCCC3)c2C)cc1 499591810 NVYOXGRQYLKUFV-UHFFFAOYSA-N 475.501 5.192 5 20 JKBD COc1cc(CNCc2cc(Cl)c3c(c2)OCCCO3)ccc1OCc1ccc([N+](=O)[O-])cc1 508330979 XKJPSGBEACXNHZ-UHFFFAOYSA-N 484.936 5.287 5 20 JKBD CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccc(C(=O)NCCc2ccccc2)cc1 509211140 NCDLZKRECBMYAL-UHFFFAOYSA-N 460.534 5.010 5 20 JKBD COc1cc(C(=O)Nc2cc3c(cc2[N+](=O)[O-])OCCCO3)cc(Cl)c1OCCC(C)C 514864571 VHCBZUXKRPGOGQ-UHFFFAOYSA-N 464.902 5.095 5 20 JKBD CN(Cc1ccccc1[N+](=O)[O-])C(=O)Nc1ccc(NC(=O)c2ccccc2)cc1C(F)(F)F 515135985 IGCCOMBVDOWVBJ-UHFFFAOYSA-N 472.423 5.530 5 20 JKBD COc1cccc(-c2nn(-c3ccccc3)cc2C(=O)Nc2cc([N+](=O)[O-])ccc2OC(F)F)c1 515215989 CQQJAXXJNBZWRD-UHFFFAOYSA-N 480.427 5.310 5 20 JKBD O=C(c1cc(F)ccc1F)C1CCN(C(=O)c2ccc(Nc3ccccc3)c([N+](=O)[O-])c2)CC1 515422527 DRBHMUIMZOYBIV-UHFFFAOYSA-N 465.456 5.352 5 20 JKBD CC(=O)N(c1nc(COc2ccc(-c3ccccc3)cc2[N+](=O)[O-])cs1)c1c(C)cc(C)cc1C 517912596 ZAHDHKZGHKDTMW-UHFFFAOYSA-N 487.581 6.907 5 20 JKBD C[C@H](NC(=O)N(C)CCCCCc1cc(-c2cccc(F)c2)n[nH]1)c1cccc([N+](=O)[O-])c1 518377671 OVKGKQMYBOYXNN-KRWDZBQOSA-N 453.518 5.239 5 20 JKBD O=C(CCNc1ccc(C(F)(F)F)cc1[N+](=O)[O-])Nc1ccc(OCc2ccncc2)cc1 521492653 ZUMDOKIDGOKARP-UHFFFAOYSA-N 460.412 5.028 5 20 JKBD Cc1ccnc(NC(=O)c2c3c(nc4ccccc24)/C(=C/c2ccc([N+](=O)[O-])cc2)CCC3)n1 602218421 YHMHWKVNIBJPKV-OBGWFSINSA-N 451.486 5.371 5 20 JKBD C[C@@H]1C[C@H]1c1ccc(CNC(=O)Cc2cn(-c3ccccc3)nc2-c2ccc([N+](=O)[O-])cc2)o1 603971446 LCKJUUMOHMMGFQ-UZUQRXQVSA-N 456.502 5.023 5 20 JKBD CCNC(=O)c1ccc(NC(=O)c2ccc(NCc3ccccc3Cl)c([N+](=O)[O-])c2)c(C)c1 603993435 WQJAZRUPPBHOJC-UHFFFAOYSA-N 466.925 5.171 5 20 JKBD CC(C)CNC(=O)c1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2NCc2ccccc2)cc1Cl 604004351 LMYWEZKQXHFNIY-UHFFFAOYSA-N 480.952 5.498 5 20 JKBD O=C(Nc1ccc(-c2ncon2)cc1)c1cc([N+](=O)[O-])ccc1Sc1ccc(Cl)cc1 608875285 RQZGGFLXYZXNHI-UHFFFAOYSA-N 452.879 5.702 5 20 JKBD O=C(C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)N1CCC[C@@H]1CN1CCCCC1 609023905 AJYACKBPSBQGKE-ZGZCKBCJSA-N 490.629 5.612 5 20 JKBD O=C(Nc1nc(-c2ccc(OCc3ccccc3)cc2)cs1)c1cc(F)c(F)cc1[N+](=O)[O-] 727709444 STDORUWLQVEWII-UHFFFAOYSA-N 467.453 5.828 5 20 JKBD COc1ccc(C)cc1NC(=O)[C@H](OC(=O)c1c(Cl)cccc1[N+](=O)[O-])c1ccccc1 730644526 LOGKVTIEMBJKOF-OAQYLSRUSA-N 454.866 5.102 5 20 JKBD O=C(Cn1ccc2cc([N+](=O)[O-])ccc21)Oc1ccc(NC(=O)c2ccccc2Br)cc1 743606957 BEMKMFIUTKMQGW-UHFFFAOYSA-N 494.301 5.170 5 20 JKBD C[C@@H](OC(=O)c1csc(-c2ccc([N+](=O)[O-])cc2)n1)C(=O)N(c1nccs1)C1CCCCC1 747957209 LESGAGKLEXXMJM-CQSZACIVSA-N 486.575 5.086 5 20 JKBD C[C@H](Nc1ccc(C(=O)O[C@H](c2ccncc2)c2ccc(F)cc2)cc1[N+](=O)[O-])c1ccccn1 748569916 AOMZYSREXHTAPU-GKVSMKOHSA-N 472.476 5.643 5 20 JKBD Cc1sc(NC(=O)c2cc(F)c(F)cc2[N+](=O)[O-])nc1-c1ccc(Br)cc1 750562115 MZSPPDBWBSPGBK-UHFFFAOYSA-N 454.252 5.320 5 20 JKBD O=C(Nc1cc([N+](=O)[O-])ccc1F)[C@@H]1C[C@@H]2CCCC[C@@H]2N1C(=O)c1ccc2ccccc2c1 751065050 QXKFENXZOQZFEA-NWVWQQAFSA-N 461.493 5.299 5 20 JKBD C[C@@H](OC(=O)c1ccccc1-c1ncc(-c2ccccc2F)o1)C(=O)Nc1ccccc1[N+](=O)[O-] 899997883 LSPPGSZSVZKNST-OAHLLOKOSA-N 475.432 5.240 5 20 JKBD O=C1OC(c2ccc(Cl)c([N+](=O)[O-])c2)=N/C1=C/c1cccc(NC(=O)c2ccccc2Cl)c1 912756069 PRWAULBIJGMLBP-YBFXNURJSA-N 482.279 5.498 5 20 JKBD Cc1onc(-c2c(Cl)cccc2Cl)c1C(=O)OCC(=O)Nc1ccc([N+](=O)[O-])cc1Cl 913350655 UQVKCUUFXOPIMF-UHFFFAOYSA-N 484.679 5.314 5 20 JKBD COc1cc(C(=O)Nc2cc(Cl)ccc2C(N)=O)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 914742131 UHOHSJKJPQHVSF-UHFFFAOYSA-N 476.272 5.054 5 20 JKBD CCOc1ccc(-c2nc(C)c(C(=O)O[C@H](C)c3nnc(-c4ccc([N+](=O)[O-])cc4)o3)s2)cc1 914909275 YVTSLZGEQAMZIC-CQSZACIVSA-N 480.502 5.393 5 20 JKBD COc1ccc(S[C@@H](C)C(=O)Oc2ccc(NC(=O)c3cc([N+](=O)[O-])ccc3Cl)cc2)cc1 916952009 NHCLHWRDKKNSTA-AWEZNQCLSA-N 486.933 5.595 5 20 JKBD COc1ccc(-n2ccc(C(=O)Nc3cc(Cl)c([N+](=O)[O-])cc3OCc3ccccc3)n2)cc1 919985329 JXOKRCONLNOLJT-UHFFFAOYSA-N 478.892 5.274 5 20 JKBD Cc1cc(C(=O)Nc2ccc(C3(NC(=O)c4cccc([N+](=O)[O-])c4Br)CCC3)cc2)c[nH]1 1788815781 QVQZVEQUENIOQP-UHFFFAOYSA-N 497.349 5.055 5 20 JKBD O=C(NC1(c2ccc(NC(=O)c3ccc([N+](=O)[O-])cc3F)cc2)CCC1)c1ccc2ccoc2c1 1790626521 ZXOLTKATRJUQEU-UHFFFAOYSA-N 473.460 5.542 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)Nc1ccc(C2(NC(=O)c3scnc3C3CC3)CCC2)cc1 1790770389 BIYRVPJYXAQRPF-UHFFFAOYSA-N 494.548 5.438 5 20 JKBD Cc1cnoc1C(=O)NC1(c2ccc(NC(=O)c3cc4cc([N+](=O)[O-])ccc4s3)cc2)CCC1 1791010742 UMMDMOGJTPRFQQ-UHFFFAOYSA-N 476.514 5.167 5 20 JKBD Cc1c(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2c(Cl)cccc2Cl)cc(Cl)cc1[N+](=O)[O-] 1799548983 DNXHOQVEFCOCSD-QDMKHBRRSA-N 496.778 5.429 5 20 JKBD C[C@@H](C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cccc(F)c2[N+](=O)[O-])n[nH]1)c1ccc(Cl)cc1 1821167094 CUTBVOJGJKLCMZ-VLIAUNLRSA-N 499.930 5.220 5 20 JKBD Cc1occc1C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cc3cc([N+](=O)[O-])ccc3s2)n[nH]1 1821609597 HYADUDNEURSELJ-GOSISDBHSA-N 479.518 5.054 5 20 JKBD O=C(/C=C/c1ccccc1[N+](=O)[O-])Nc1cc([C@H]2CCCCN2C(=O)c2cccc3ccoc23)[nH]n1 1823504072 ZWLYRLJKJFDSEQ-VDZCTEQFSA-N 485.500 5.083 5 20 JKBD CCOc1ccsc1C(=O)N1CCCC[C@H]1C1CCN(C(=O)/C=C/c2ccccc2[N+](=O)[O-])CC1 1823648611 UQRQROHQDARKBA-ZJVMWOEPSA-N 497.617 5.002 5 20 JKBD Cc1csc(C(=O)N2CCCC[C@H]2C2CCN(C(=O)Cc3ccc(Cl)cc3[N+](=O)[O-])CC2)c1 1824672951 UHNGFEMJYIYHMA-FQEVSTJZSA-N 490.025 5.094 5 20 JKBD C[C@@H](OC(=O)c1ccc(COc2ccccc2)cc1)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 9480597 ONSWPKNTTKKAPD-OAHLLOKOSA-N 488.418 5.377 5 20 JKBD C[C@@H](OC(=O)Cc1csc(-c2ccc(Cl)cc2)n1)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 16665246 KJKJOEHAAXYCHB-GFCCVEGCSA-N 470.894 5.269 5 20 JKBD CC(C)n1c(S[C@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)nc2cc(Cl)ccc2c1=O 17667977 INCLIVWDTTXYKO-GFCCVEGCSA-N 471.926 5.442 5 20 JKBD Cc1ccc(C)c(OCc2nnc(S[C@H](C)c3nnc(-c4ccc([N+](=O)[O-])cc4)o3)o2)c1 17717099 WVIFVQJRQBTICE-CQSZACIVSA-N 453.480 5.077 5 20 JKBD COc1ccccc1-n1c(S[C@@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2)nnc1-c1cccs1 23545785 NGALXDRNESMFJY-AWEZNQCLSA-N 481.559 5.032 5 20 JKBD C[C@@H](Sc1nnc2c(Cl)cc(C(F)(F)F)cn12)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl 36798309 OYLLNHYSPQBQAO-SSDOTTSWSA-N 480.255 5.082 5 20 JKBD Cc1ccc(Oc2ccc(NC(=O)c3ccc(Cn4nc(C)c([N+](=O)[O-])c4C)cc3)cn2)cc1 107914148 YCJHKUZIMKPRJN-UHFFFAOYSA-N 457.490 5.204 5 20 JKBD C[C@@H](Nc1ccc(C(=O)Nc2ccccc2OC[C@H]2CCCCO2)cc1[N+](=O)[O-])c1ccccn1 108910908 QOERSVPRKXZRAV-UYAOXDASSA-N 476.533 5.363 5 20 JKBD CC(=O)Nc1ccc(C(F)(F)F)cc1NC(=O)c1ccc(Sc2nc(C)cs2)c([N+](=O)[O-])c1 109163871 MTLBCAKGHZMWNJ-UHFFFAOYSA-N 496.492 5.740 5 20 JKBD COc1ccc([N+](=O)[O-])cc1NC(=O)c1oc2ccccc2c1CSc1nnc(C)s1 109385760 ZMWPPKIMQQHFRQ-UHFFFAOYSA-N 456.505 5.054 5 20 JKBD O=[N+]([O-])c1ccc(-c2nnc(CSc3nnc(-c4ccc(F)cc4)c4ccccc34)o2)cc1 247303068 FSKUXCKPHXUTLX-UHFFFAOYSA-N 459.462 5.686 5 20 JKBD COc1cc(C(=O)N[C@H]2CCCC[C@@H]2Cc2ccccc2)c([N+](=O)[O-])cc1OCc1cscn1 476725640 DQFQTUMFQRHJCI-NQIIRXRSSA-N 481.574 5.170 5 20 JKBD COc1cc(C(=O)N[C@H](C)c2ccc(NC(N)=O)cc2)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 480314987 GRESDEHEFBOBCC-CYBMUJFWSA-N 484.896 5.031 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)N(Cc2nnc(-c3ccccc3Cl)o2)C(C)C)cc1SC 481906558 KVPMEEYSXIABPY-UHFFFAOYSA-N 476.942 5.080 5 20 JKBD CCn1c(S[C@H](C)c2nnc(-c3cccc(Cl)c3)o2)nc2cc3ccccc3cc2c1=O 501423855 OLCZTRRJXAIOQY-CQSZACIVSA-N 462.962 6.126 5 20 JKBD Cc1nc(-c2cccc(NC(=O)c3ccc(N[C@H](C)c4ccccn4)c([N+](=O)[O-])c3)c2)cs1 505990958 JENCDZSYGIRNEE-OAHLLOKOSA-N 459.531 5.847 5 20 JKBD COc1c(Cl)cc(NC(=O)N[C@H](CC(=O)OC(C)C)c2ccccc2[N+](=O)[O-])cc1Cl 513878520 PMFAAPONEQATEW-MRXNPFEDSA-N 470.309 5.115 5 20 JKBD COc1cc([C@H]2Nc3ccccc3C(=O)N2c2ccc(F)cc2Cl)c([N+](=O)[O-])cc1OC 515591749 VSSRFZDJGSXJER-NRFANRHFSA-N 457.845 5.176 5 20 JKBD Cc1nc(-c2ccc(CNC(=O)c3ccc(N[C@@H](C)c4ccccn4)c([N+](=O)[O-])c3)s2)cs1 516585827 BGZMKLQYWBRFOO-AWEZNQCLSA-N 479.587 5.586 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Cl)[C@H](NC[C@@H]1CCCO[C@H]1c1ccccc1)c1ccccc1 518002897 JWCILCHCWZTIAV-AMDXRBSFSA-N 479.964 5.686 5 20 JKBD CCOc1ccc(NC(=O)c2cc(OCC(F)(F)F)ccc2[N+](=O)[O-])c(C(F)(F)F)c1 518851872 ZWXAFFSGZKASDA-UHFFFAOYSA-N 452.307 5.206 5 20 JKBD Cc1c(NC(=O)[C@H](C)Oc2ccc(Cl)cc2[N+](=O)[O-])cccc1C(=O)N1CCc2sccc2C1 521277053 WVZQIBHIVBWXOA-HNNXBMFYSA-N 499.976 5.223 5 20 JKBD CCCO[C@H]1CCCN(C(=O)c2ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])c(OC)c2)CC1 521731019 UZMZFEDKGDMRML-SFHVURJKSA-N 462.930 5.470 5 20 JKBD Cc1nn(CCC(=O)N2C[C@H](c3ccccc3Cl)c3c([nH]c4ccccc34)[C@@H]2C)c(C)c1[N+](=O)[O-] 523226873 JXSCCXVGGSIIOW-OXJNMPFZSA-N 491.979 5.668 5 20 JKBD Cc1nc(CCNC(=O)c2ccc(Sc3nc4ccccc4s3)c([N+](=O)[O-])c2)cs1 600814854 VGOBXHDMFNAZMX-UHFFFAOYSA-N 456.574 5.093 5 20 JKBD CCCOc1ccc(C(F)(F)F)cc1NC(=O)C1CCN(c2ccccc2[N+](=O)[O-])CC1 603440702 CMHXWQCVYXHTAU-UHFFFAOYSA-N 451.445 5.258 5 20 JKBD C[C@@H](Sc1ccc(S(=O)(=O)N2CCCCCC2)cc1[N+](=O)[O-])c1nc(-c2cccs2)no1 604059850 NGMCVTBFRIIFEX-CQSZACIVSA-N 494.620 5.124 5 20 JKBD O=[N+]([O-])c1cc(Br)ccc1Sc1nnc(-c2ccncc2)n1-c1ccccc1 608855760 KMHNQWSCKJARKY-UHFFFAOYSA-N 454.309 5.151 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1F)c1cccnc1SCc1cccc(Br)c1 608871057 RHXFZOZLSFXZIF-UHFFFAOYSA-N 462.300 5.436 5 20 JKBD CO[C@H](C)c1cccc(NC(=O)C/C(=C\c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)c1 608874506 DIZAQNMBGIQAPR-HDAKKWKLSA-N 473.554 6.481 5 20 JKBD CN(C(=O)c1ccc(C(=O)N(C)[C@@H]2CCc3ccccc32)c([N+](=O)[O-])c1)[C@H]1CCc2ccccc21 609043776 RIBFGLVRKIRKSW-LOSJGSFVSA-N 469.541 5.114 5 20 JKBD Cc1ccc(NC(=O)c2cccc(C(F)(F)F)c2)cc1NC(=O)c1cc(F)c(F)cc1[N+](=O)[O-] 727710697 ZKUCXBAXFCMWRM-UHFFFAOYSA-N 479.361 5.705 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)O[C@H](C)c2ccc(NC(=O)c3ccccc3)cc2)cc1SC 728770902 ZMRKLLINJDZUOD-OAHLLOKOSA-N 466.515 5.496 5 20 JKBD COc1ccc(-c2nc(COC(=O)c3csc(-c4ccc([N+](=O)[O-])cc4)n3)cs2)cc1 747955886 DTMKWRHABUYCNI-UHFFFAOYSA-N 453.501 5.207 5 20 JKBD O=C(C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)Nc1ccc2nc(O)[nH]c2c1 857748684 CMGRZYBGTBVQFO-RVDMUPIBSA-N 471.498 5.356 5 20 JKBD CCOc1cc(-c2nc(-c3cccc(NC(=O)OC(C)(C)C)c3)no2)c([N+](=O)[O-])cc1OC 904634424 OHVUBLHMNRRZLE-UHFFFAOYSA-N 456.455 5.066 5 20 JKBD Cc1sc(NC(=O)c2cc(-c3ccncc3)nc3ccccc23)nc1-c1cccc([N+](=O)[O-])c1 917792181 XFJPJBAQWWXKDM-UHFFFAOYSA-N 467.510 5.889 5 20 JKBD CSc1ccc(C(=O)OCC(=O)N2CCC[C@H]2c2ccc(Cl)c(Cl)c2)cc1[N+](=O)[O-] 918816366 QIDNNGSPHXAFNU-INIZCTEOSA-N 469.346 5.144 5 20 JKBD O=C(NCCOC(=O)[C@H](Sc1ccccc1)c1ccccc1)c1ccc([N+](=O)[O-])cc1Cl 920149169 TXXNQUFOCVELKJ-OAQYLSRUSA-N 470.934 5.055 5 20 JKBD C[C@@H](Nc1ccc(C(=O)OCC(=O)N(C)[C@H](C)c2ccc(Cl)cc2)cc1[N+](=O)[O-])c1ccccn1 920544225 JUBABFMPHCCPMM-IAGOWNOFSA-N 496.951 5.193 5 20 JKBD O=C(CCC1CCCC1)Nc1ccc(C2(NC(=O)c3ccc([N+](=O)[O-])c4c3OCO4)CCC2)cc1 1787618750 WJISXDROPFDZBS-UHFFFAOYSA-N 479.533 5.042 5 20 JKBD O=C(Cc1c[nH]c2ccccc12)Nc1ccc(C2(NC(=O)c3cc(F)cc([N+](=O)[O-])c3)CCC2)cc1 1790396603 VKRRVPJDOVGUTB-UHFFFAOYSA-N 486.503 5.206 5 20 JKBD COc1cc(CC(=O)Nc2ccc(C3(NC(=O)[C@H]4C[C@@H]4c4ccccc4)CCC3)cc2)ccc1[N+](=O)[O-] 1790479166 AELHQRULHKVMFD-RPWUZVMVSA-N 499.567 5.084 5 20 JKBD C/C(=C\c1ccc(C)o1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc2cc([N+](=O)[O-])ccc2s1 1801206928 DVHPVNDDVLOMIY-QZBGTXJESA-N 479.558 5.066 5 20 JKBD CC(C)[C@H](C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2ccc([N+](=O)[O-])[nH]2)[nH]n1)c1ccc(Cl)cc1 1814938333 IDBHKUSHEQEVND-KNQAVFIVSA-N 498.971 5.045 5 20 JKBD O=C(Nc1cc([C@@H]2CCCCN2C(=O)/C=C/c2ccc([N+](=O)[O-])o2)[nH]n1)[C@@H]1CCC[C@H]2CCCC[C@H]21 1818926832 BVUMPXASHNVPRR-FGKHOMNMSA-N 495.580 5.223 5 20 JKBD Cc1c(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)c3ccc(Cl)o3)[nH]n2)cc(Cl)cc1[N+](=O)[O-] 1821294940 XJNYIZGYWOQLOI-HNNXBMFYSA-N 492.319 5.146 5 20 JKBD O=C(CSc1nnc(-c2ccccc2F)n1C1CC1)Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1 9637047 VRTYMSPIZCMASY-UHFFFAOYSA-N 496.549 5.182 5 20 JKBD C[C@H](OC(=O)CSCc1cccc(Cl)c1)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 10147360 VJMAWYCTTBLBFL-NSHDSACASA-N 476.860 5.071 5 20 JKBD CN(CC(=O)Nc1c(Cl)cccc1Cl)C(=O)c1ccc(NCc2ccccc2)c([N+](=O)[O-])c1 15527934 ZQSMNHXPUKVSTF-UHFFFAOYSA-N 487.343 5.224 5 20 JKBD CCCn1c(S[C@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)nnc1-c1ccc(Cl)cc1 17656598 QABQDZNNLJOWKZ-CYBMUJFWSA-N 470.942 5.820 5 20 JKBD CN(Cc1cn(Cc2ccccc2Cl)nc1-c1ccccc1)C(=O)Cc1ccc([N+](=O)[O-])cc1 19617479 RAHWXHJIKMJUPQ-UHFFFAOYSA-N 474.948 5.361 5 20 JKBD O=C(OCc1nnc(-c2ccc([N+](=O)[O-])cc2)o1)/C(=C/c1ccc(F)cc1)c1cccs1 20864720 PRFVHLWCYYLZQN-LDADJPATSA-N 451.435 5.129 5 20 JKBD COC(=O)c1ccc(F)c(NC(=O)c2ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])c(OC)c2)c1 26499340 KULRLVMETKRZMG-UHFFFAOYSA-N 474.828 5.227 5 20 JKBD CC(=O)NCc1ccc(-c2nc(NC(=O)c3ccc(C(C)(C)C)c([N+](=O)[O-])c3)sc2C)s1 30528611 APPDGAUOPNBBGM-UHFFFAOYSA-N 472.592 5.274 5 20 JKBD CCn1c(S[C@@H](C(=O)Nc2cccc(NC(C)=O)c2)C(C)C)nc2cc3ccccc3cc2c1=O 31747503 KGKIDJKLNMVOGI-XMMPIXPASA-N 488.613 5.283 5 20 JKBD C[C@@H](NC(=O)c1ccc(N2CCCC2)c([N+](=O)[O-])c1)c1ccc(NC(=O)c2ccc(F)cc2)cc1 68737199 QNXNNLQPKKFVLT-QGZVFWFLSA-N 476.508 5.077 5 20 JKBD COc1cccc([C@@H](CNC(=O)c2c[nH]c3ccc([N+](=O)[O-])cc23)c2c[nH]c3ccccc23)c1OC 109889539 XRPKIXMBMSLVQY-OAQYLSRUSA-N 484.512 5.137 5 20 JKBD COc1cc(C(=O)N2CCCC[C@@H]2c2ncc[nH]2)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 303143654 QIYHFGGLWUWQDX-MRXNPFEDSA-N 456.886 5.140 5 20 JKBD Cn1ccnc1Sc1ccccc1NC(=O)CSc1ccc(C(F)(F)F)cc1[N+](=O)[O-] 499232861 IFQUJOIXYZNUGD-UHFFFAOYSA-N 468.482 5.229 5 20 JKBD Cc1nn(Cc2ccc(C(=O)N(C3CC3)[C@H](C)c3cccc(C(F)(F)F)c3)cc2)c(C)c1[N+](=O)[O-] 502849016 VLWDVMDFUZZCGB-MRXNPFEDSA-N 486.494 5.841 5 20 JKBD Cc1noc([C@H]2CCCN(C(=O)c3ccc(Sc4nc5ccccc5s4)c([N+](=O)[O-])c3)C2)n1 509154811 OBOWVIAEMABXEC-HNNXBMFYSA-N 481.559 5.067 5 20 JKBD Cc1ccc(-c2csc(NC(=O)Cc3csc(Cc4ccccc4)n3)n2)cc1[N+](=O)[O-] 512235257 WHIJRCVBJFRDNW-UHFFFAOYSA-N 450.545 5.255 5 20 JKBD COc1c(Br)cc(Cl)cc1NC(=O)[C@@H](C)Oc1ccc(Cl)cc1[N+](=O)[O-] 518830575 SOKVMECAUBJXOE-MRVPVSSYSA-N 464.099 5.079 5 20 JKBD O=C(Cn1ccc2cc([N+](=O)[O-])ccc21)Nc1ccc(NC(=O)c2ccccc2)cc1C(F)(F)F 521549209 NUDJKCMZCDZTLL-UHFFFAOYSA-N 482.418 5.459 5 20 JKBD C[C@H](C[C@H]1CCCO1)NC(=O)C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1 522552087 QWUVHOKBHNADGR-SBZMSRDWSA-N 451.548 5.209 5 20 JKBD O=C(Nc1cc(Cl)ccc1Cl)[C@H]1CCCCN1C(=O)CSc1ccc([N+](=O)[O-])cc1 523444119 WWFNZXVAAMPXNM-GOSISDBHSA-N 468.362 5.014 5 20 JKBD O=C(C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)N1CCC[C@H](c2ncc[nH]2)C1 524340005 KTAFLZSOZDNARG-OGBKAESYSA-N 473.558 5.265 5 20 JKBD CC(C)(CNC(=O)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-])c1ccc(Br)cc1 603901531 CLBBURQOQAGDRL-UHFFFAOYSA-N 475.261 5.006 5 20 JKBD CC(C)c1nccn1Cc1cccc(NC(=O)c2ccc(NCc3ccccc3)c([N+](=O)[O-])c2)c1 603927088 QOUAIOJWASVBOI-UHFFFAOYSA-N 469.545 5.827 5 20 JKBD CCc1cccc2c(C3CCN(C(=O)c4ccc(Cn5nc(C)c([N+](=O)[O-])c5C)cc4)CC3)c[nH]c12 604193433 VSMQKDYXSNBCJG-UHFFFAOYSA-N 485.588 5.520 5 20 JKBD Cc1csc(Sc2ccc(NC(=O)c3cc(OCC(F)(F)F)ccc3[N+](=O)[O-])c(C)c2)n1 608848258 HZJILWABSNVNOA-UHFFFAOYSA-N 483.493 6.013 5 20 JKBD O=C(Nc1cccnc1)c1ccc(NC(=O)c2cc(OCC(F)(F)F)ccc2[N+](=O)[O-])cc1Cl 608875283 RPPCTXWCOASSBN-UHFFFAOYSA-N 494.813 5.089 5 20 JKBD O=C(N[C@@H]1CCc2nc(-c3ccccc3)ncc2C1)c1cc([N+](=O)[O-])ccc1Sc1ccccc1 608965281 YGWWRBAFPWNQEB-HXUWFJFHSA-N 482.565 5.490 5 20 JKBD O=C(N[C@H]1CCCc2nc(-c3ccc(F)cc3)sc21)C1CCN(c2ccccc2[N+](=O)[O-])CC1 609186775 PEXJWYNLYZFAFA-IBGZPJMESA-N 480.565 5.268 5 20 JKBD Cc1ccc(C(=O)Nc2nc3ccc(NC(=O)c4cc(Cl)ccc4[N+](=O)[O-])cc3s2)s1 726537429 MEWZALNAUUKWED-UHFFFAOYSA-N 472.935 5.732 5 20 JKBD C[C@@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)OCc1nnc(-c2c(Cl)cccc2Cl)o1 726639552 ZOLQFTMTLRSKPM-SECBINFHSA-N 472.668 5.116 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)OCc2csc(COc3ccc(C)cc3)n2)cc1SC 728650555 GWMFVGXXEMUVIF-UHFFFAOYSA-N 460.533 5.026 5 20 JKBD Nc1c(Cl)cc(N[C@@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2ccccc2)cc1Cl 746640480 XDTAUGYSCCEHLR-LJQANCHMSA-N 465.724 5.929 5 20 JKBD CC(C)n1c2ccccc2n2c(SCC(=O)Nc3nc(-c4cccc([N+](=O)[O-])c4)cs3)nnc12 847207551 VIMAHVGYDRASQA-UHFFFAOYSA-N 493.574 5.027 5 20 JKBD COc1ccc([C@@H]2NC(=O)c3sc4ccccc4c3N2)cc1OCc1ccc([N+](=O)[O-])cc1 877854062 MAXWIOJTMULWMN-QHCPKHFHSA-N 461.499 5.251 5 20 JKBD C[C@H](Oc1ccc(C(C)(C)C)cc1)C(=O)O[C@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 916535685 HVRCFYABSUTAFY-KGLIPLIRSA-N 482.455 5.249 5 20 JKBD CN(C(=O)c1ccccc1NC(=O)CSc1ccc(C(F)(F)F)cc1[N+](=O)[O-])C1CCCCC1 917803578 SQRIRGPSGFCVHG-UHFFFAOYSA-N 495.523 5.749 5 20 JKBD C[C@@H](Nc1ccc(C(=O)Nc2cc(F)c(N3CCCC3)c(F)c2)cc1[N+](=O)[O-])c1ccccn1 919750153 UIQFYFWDQNICTQ-OAHLLOKOSA-N 467.476 5.294 5 20 JKBD Cc1cc(C)c(NC(=O)c2ccc(OS(=O)(=O)c3cc([N+](=O)[O-])ccc3C)cc2)c(Cl)c1 929061594 JLMKOWIEHSIGAS-UHFFFAOYSA-N 474.922 5.193 5 20 JKBD Cc1cc(C(=O)NC2(c3ccc(NC(=O)Cn4ccc5ccc([N+](=O)[O-])cc54)cc3)CCC2)cnc1C 1786275495 JURRVEUGQOPLGE-UHFFFAOYSA-N 497.555 5.009 5 20 JKBD O=C(Cc1cccc([N+](=O)[O-])c1)NC1(c2ccc(NC(=O)c3ccc4occc4c3O)cc2)CCC1 1790929081 BLOBSBISTFJIOV-UHFFFAOYSA-N 485.496 5.037 5 20 JKBD C[C@H](C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2ccc([N+](=O)[O-])cc2F)n[nH]1)c1ccc(Cl)cc1 1821049306 JMDXTGZJJFFQJH-QKKBWIMNSA-N 499.930 5.220 5 20 JKBD Cc1cc(Cl)ccc1C(=O)N1CCCC[C@H]1C1CCN(C(=O)/C=C/c2ccc([N+](=O)[O-])o2)CC1 1823907973 LDURTUVTKFPDBE-OUZREKFBSA-N 485.968 5.096 5 20 JKBD O=C(c1cccc(F)c1[N+](=O)[O-])N1CCC([C@H]2CCCCN2C(=O)c2cc(Cl)ccc2F)CC1 1823938842 LCIYXVRXJOJVHK-OAQYLSRUSA-N 491.922 5.074 5 20 JKBD Cc1ccc(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)CSc3ccccc3[N+](=O)[O-])CC2)c(F)c1 1830470189 WUODGFMDGCKCHR-JOCHJYFZSA-N 499.608 5.068 5 20 JKBD Cc1csc(Sc2ccc(C(=O)N(C)Cc3cc([N+](=O)[O-])ccc3Cl)cc2[N+](=O)[O-])n1 10897990 FXKBNPRGDWCNMJ-UHFFFAOYSA-N 478.939 5.345 5 20 JKBD COc1ccc(NC(=O)[C@@H](C)Sc2nnc(-c3ccccc3)c(-c3ccccc3)n2)c([N+](=O)[O-])c1 16058486 SJINORLNHRCDBH-MRXNPFEDSA-N 487.541 5.242 5 20 JKBD COc1cc(C(=O)O[C@@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)ccc1OCc1ccccc1 17536257 AJZNGELAFASWQJ-INIZCTEOSA-N 475.457 5.150 5 20 JKBD CCOc1cc(C(=O)Nc2nc3ccc(Oc4ccccc4)cc3s2)c([N+](=O)[O-])cc1OC 18082618 JFPLQCBFPVVTHK-UHFFFAOYSA-N 465.487 5.656 5 20 JKBD COc1ccc(-c2nc(CSc3nc4cc5ccccc5cc4c(=O)n3C)cs2)cc1OC 22254436 CTAVUEMUBMNTMC-UHFFFAOYSA-N 475.595 5.520 5 20 JKBD COCc1cccc(NC(=O)c2ccccc2Sc2ccc(C(F)(F)F)cc2[N+](=O)[O-])c1 25824410 YNKSQOODKNEDTP-UHFFFAOYSA-N 462.449 6.164 5 20 JKBD O=C(OCc1nnc(-c2ccc([N+](=O)[O-])cc2)o1)c1ccccc1OCc1ccccc1Cl 28614622 IRWRDEBBGDTULQ-UHFFFAOYSA-N 465.849 5.234 5 20 JKBD CC(C)NC(=O)c1ccc(N[C@@H](C)c2ccc(NC(=O)c3ccc(F)cc3)cc2)c([N+](=O)[O-])c1 59420567 AMKKPZWTSYQLPP-INIZCTEOSA-N 464.497 5.298 5 20 JKBD O=C(c1ccc([N+](=O)[O-])cc1I)N(Cc1cccs1)Cc1cccs1 72068610 RLXQOPSGKFZGPM-UHFFFAOYSA-N 484.340 5.165 5 20 JKBD COc1ccc([C@H](CNC(=O)c2cc(SC)ccc2[N+](=O)[O-])c2c[nH]c3ccccc23)cc1 105256158 CFGQUERYHZYOFN-NRFANRHFSA-N 461.543 5.369 5 20 JKBD CN(CCCCc1ccccc1)C(=O)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 302927168 DNGMFZRYCLQXMM-UHFFFAOYSA-N 463.500 5.311 5 20 JKBD C[C@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)N[C@@H]1CCCc2nc(-c3ccc(F)cc3)sc21 303258187 OSYZCSJOFBWMEF-SCLBCKFNSA-N 457.552 5.532 5 20 JKBD O=C(C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)N[C@@H]1COc2ccccc2C1 480069827 NCQQENOTBRCJNS-ACSPXDACSA-N 471.538 5.255 5 20 JKBD O=C(C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)Nc1ccccc1Cn1cncn1 490880117 WFSWMIMFQAUOBP-DEDYPNTBSA-N 496.552 5.414 5 20 JKBD O=C(Nc1cc(F)cc(N2CCOCC2)c1)c1cc([N+](=O)[O-])ccc1Sc1ccc(Cl)cc1 498619468 SLBNJZGQOQSIKX-UHFFFAOYSA-N 487.940 5.627 5 20 JKBD COCCN(C(=O)c1oc2c(C)cccc2c1C)c1nc(-c2ccc([N+](=O)[O-])cc2)cs1 506217315 FBVQMZYTJAKWHU-UHFFFAOYSA-N 451.504 5.375 5 20 JKBD COc1ccc(N(Cc2cccs2)C(=O)c2cc(OC)c(OC(F)F)cc2[N+](=O)[O-])cc1 514740576 YRJUNJQWSHRUJT-UHFFFAOYSA-N 464.446 5.122 5 20 JKBD CCOc1ccc(Oc2ccc(Cl)cc2NC(=O)C(=O)N[C@@H](C)c2cccc([N+](=O)[O-])c2)cc1 516045888 SPSPWTYJSKFUQT-HNNXBMFYSA-N 483.908 5.255 5 20 JKBD Cc1ccc(C(N)=O)cc1NC(=O)c1c2c(nc3ccccc13)/C(=C\c1ccc([N+](=O)[O-])cc1)CCC2 520078810 IQTUZIASFVYZFV-CYVLTUHYSA-N 492.535 5.680 5 20 JKBD CC[C@H](C)NC(=O)c1ccc(NC(=O)c2ccc(N3C[C@@H](C)C[C@@H](C)C3)c([N+](=O)[O-])c2)c(C)c1 520557693 FXAZQJKLDUGFDL-SCTDSRPQSA-N 466.582 5.166 5 20 JKBD O=[N+]([O-])c1ccc(-c2ccc(CN[C@@H](c3ccccc3)c3ccccn3)o2)c(Br)c1 520955215 CAPBRBCYUGHPOH-QHCPKHFHSA-N 464.319 5.892 5 20 JKBD O=C(Nc1cc(-c2ccoc2)nn1-c1ccccc1)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-] 522097309 AXHUNNCXVZYDHD-UHFFFAOYSA-N 472.379 5.234 5 20 JKBD O=C(Nc1cc(OCC(F)(F)F)cc(OCC(F)(F)F)c1)c1ccc([N+](=O)[O-])cc1Cl 585732904 VSMIDZTVGSFDMX-UHFFFAOYSA-N 472.725 5.383 5 20 JKBD COc1cc([N+](=O)[O-])ccc1NC(=O)CSc1nnc(-c2ccco2)n1[C@@H](C)[C@H]1C[C@H]2CC[C@H]1C2 594534381 FPQFLUATHWVWIE-NBOOPKSLSA-N 497.577 5.183 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Cl)C(=O)N[C@@H](CCCc1ccccc1)c1ccccc1 603706437 JAALFFRORVZQTI-NRFANRHFSA-N 451.910 5.067 5 20 JKBD O=C(CSc1ccc([N+](=O)[O-])cc1)Nc1ccc(NC(=O)c2ccccc2F)cc1C(F)(F)F 603744095 MAXLRGVCJSJAMI-UHFFFAOYSA-N 493.438 5.736 5 20 JKBD O=C(c1ccc(-n2cncn2)c([N+](=O)[O-])c1)N(Cc1ccc(Cl)cc1)c1ccccc1Cl 604019119 CYZFSXGZJIEKFD-UHFFFAOYSA-N 468.300 5.329 5 20 JKBD O=C(Nc1cccc(C(F)(F)F)c1)c1cccc(NC(=O)c2c[nH]c3ccc([N+](=O)[O-])cc23)c1 604537725 BMIFWLGDEMELLU-UHFFFAOYSA-N 468.391 5.600 5 20 JKBD COc1cc([C@H](C)Nc2cnn(-c3ccc([N+](=O)[O-])cc3)c(=O)c2Cl)ccc1OC1CCCC1 608830980 VXEYHGJIZLVDKX-HNNXBMFYSA-N 484.940 5.297 5 20 JKBD C[C@@H]1CO[C@@H](c2ccccc2)CN1C(=O)C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1 608966519 PCMJOFQBGSFRJL-XLXQETLTSA-N 499.592 6.124 5 20 JKBD O=C1Nc2cc(Cl)ccc2[C@@H]1C1CCN(C(=O)c2ccc(Nc3ccccc3)c([N+](=O)[O-])c2)CC1 608971027 GZWUMKRKNWMFHN-DEOSSOPVSA-N 490.947 5.580 5 20 JKBD Cn1c(S[C@H](C(=O)NCc2ccccc2)c2ccccc2)nc2cc3ccccc3cc2c1=O 677801564 VEEJJJQMRAHEKC-VWLOTQADSA-N 465.578 5.237 5 20 JKBD CCc1cccc[n+]1/C(C(=S)Nc1ccc2c(c1)OCCCO2)=C(/O)c1ccc(C)c([N+](=O)[O-])c1 727419052 RFWKGWHGPYKDHV-UHFFFAOYSA-O 492.577 5.238 5 20 JKBD C[C@@H]1CN(c2ccc(NC(=S)Nc3ccc([N+](=O)[O-])cc3)cc2C(F)(F)F)C[C@@H](C)O1 727981055 ALWVTCPIXGIDAS-CHWSQXEVSA-N 454.474 5.036 5 20 JKBD Cc1c(C(=O)N[C@H]2CCCc3nc(-c4ccc(F)cc4)sc32)cc([N+](=O)[O-])c(C)c1[N+](=O)[O-] 729419126 HNUQLVRMFWLNEE-INIZCTEOSA-N 470.482 5.190 5 20 JKBD C[C@H](OC(=O)c1c(Cl)cccc1[N+](=O)[O-])C(=O)N(Cc1ccccc1)Cc1ccccc1 730645431 LWEDTTSAZGGVPX-KRWDZBQOSA-N 452.894 5.023 5 20 JKBD O=C(Cn1c2ccccc2c(=O)c2ccccc21)OCc1ccc(Br)cc1Cl 747239026 KHBLNUFRICACKC-UHFFFAOYSA-N 456.723 5.314 5 20 JKBD CC(C)N(Cc1nnc(-c2cccc([N+](=O)[O-])c2)o1)C(=O)COC(c1ccccc1)c1ccccc1 916550702 COPDCRRWGSGFQE-UHFFFAOYSA-N 486.528 5.188 5 20 JKBD CCCCn1c(-c2ccc(Cl)cc2)nn(CCC(=O)N[C@H](C)c2cccc([N+](=O)[O-])c2)c1=S 917701463 TVCMMGGLEUGMFR-MRXNPFEDSA-N 488.013 5.710 5 20 JKBD COc1cc(C(=O)Oc2cccc(Cl)c2Cl)c([N+](=O)[O-])cc1OCc1cscn1 919975515 VXLIWSSZJXNBPG-UHFFFAOYSA-N 455.275 5.165 5 20 JKBD C[C@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)O[C@H](C)c1nc(-c2cccc(C(F)(F)F)c2)no1 920778193 KYRKLUBUENSROB-MNOVXSKESA-N 485.802 5.389 5 20 JKBD Cc1c(C(=O)Nc2ccc(Oc3ccccc3)cc2C(F)(F)F)cc([N+](=O)[O-])cc1[N+](=O)[O-] 921155530 VJWBZDUYDTZVTK-UHFFFAOYSA-N 461.352 5.875 5 20 JKBD O=C(Cc1ccc2ncccc2c1)Nc1ccc(C2(NC(=O)c3cccc(F)c3[N+](=O)[O-])CCC2)cc1 1786557241 YRDBRBZNPSCKJU-UHFFFAOYSA-N 498.514 5.273 5 20 JKBD CCOc1cccc(C(=O)Nc2ccc(C3(NC(=O)Cc4cc([N+](=O)[O-])ccc4F)CCC3)cc2)c1 1790340959 HOUCGWBQMXWQQA-UHFFFAOYSA-N 491.519 5.123 5 20 JKBD COc1cc(CC(=O)Nc2ccc(C3(NC(=O)c4sccc4Cl)CCC3)cc2)ccc1[N+](=O)[O-] 1790479194 CIFKCONDMVMHHJ-UHFFFAOYSA-N 499.976 5.309 5 20 JKBD CC(C)(C)c1ccc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)Cc2ccc(Cl)cc2[N+](=O)[O-])C3)s1 1797150940 YGRHPTSMLAISDE-BCDXTJNWSA-N 490.025 5.102 5 20 JKBD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)/C=C/c1ccccc1[N+](=O)[O-])c1cccc2c1oc1ccccc12 1804345382 CWLVEBUCHILOKI-BNYZZTEFSA-N 495.535 5.459 5 20 JKBD Cc1ccccc1C(=O)N1CCCC[C@@H]1C1CCN(C(=O)Cc2ccc(Cl)cc2[N+](=O)[O-])CC1 1829942429 HCQCAWUWTIRJKL-HSZRJFAPSA-N 483.996 5.033 5 20 JKBD CC(=O)N(c1nc(COC(=O)c2ccc([N+](=O)[O-])cc2Cl)cs1)c1c(C)cc(C)cc1Cl 11028711 YSUGITNXLCRWQI-UHFFFAOYSA-N 494.356 6.017 5 20 JKBD Cc1cc(C)c(CNC(=O)c2c3c(nc4ccccc24)/C(=C/c2cccc([N+](=O)[O-])c2)CCC3)c(=O)[nH]1 12826165 XVQIXXPGJNSURS-XSFVSMFZSA-N 494.551 5.255 5 20 JKBD Cc1nn(Cc2ccc(C(=O)NCC(c3ccccc3)c3ccccc3)cc2)c(C)c1[N+](=O)[O-] 14941871 GCMWOWOKPJRDFJ-UHFFFAOYSA-N 454.530 5.018 5 20 JKBD COCc1c(C(=O)O[C@@H](C(=O)Nc2ccc(C)cc2[N+](=O)[O-])c2ccccc2)oc2ccccc12 21122600 UDQJOSNDNHKBQY-HSZRJFAPSA-N 474.469 5.333 5 20 JKBD CCOc1cc([N+](=O)[O-])c(C(=O)N(Cc2ccccc2)[C@@H](C)c2cccc(NC(C)=O)c2)cc1OC 23193521 AQYMEZJTUSKXBL-SFHVURJKSA-N 491.544 5.364 5 20 JKBD Cc1ccc(-c2csc3ncnc(SCC(=O)Nc4cc([N+](=O)[O-])ccc4F)c23)cc1 24493358 CCPFNGHHSDIJOU-UHFFFAOYSA-N 454.508 5.445 5 20 JKBD CC(C)c1nnc(S[C@@H](C)C(=O)Nc2nc(-c3cccc([N+](=O)[O-])c3)cs2)n1Cc1ccco1 29963427 LCNOAFRXIXTZRV-AWEZNQCLSA-N 498.590 5.194 5 20 JKBD O=C(Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1)c1cccnc1SCc1ccc(F)cc1 69640672 MYEHBNFPXQGRAR-UHFFFAOYSA-N 466.519 5.797 5 20 JKBD CCCc1nc(CN(c2ccccc2OC)S(=O)(=O)c2cc([N+](=O)[O-])ccc2Cl)cs1 107672995 VDSGBZXUQMYOFC-UHFFFAOYSA-N 481.983 5.061 5 20 JKBD CN(CCCc1cc(-c2cccc(F)c2)n[nH]1)C(=O)c1ccc(NCc2ccccc2)c([N+](=O)[O-])c1 117694542 HMYLWJXCTCFDSW-UHFFFAOYSA-N 487.535 5.441 5 20 JKBD C[C@@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)N[C@H](C)c1cccc(NC(=O)Cc2ccccc2F)c1 483238468 KICFRBBIAOYJKD-IAGOWNOFSA-N 481.549 5.273 5 20 JKBD C[C@H](Nc1ccc(C(=O)NCc2cccc(CN3CCCCCC3)c2)cc1[N+](=O)[O-])c1ccccn1 489653131 YCSALKZKGPFWHS-NRFANRHFSA-N 487.604 5.469 5 20 JKBD O=C(Nc1cccc(CN2CCCCC2=O)c1)c1cc([N+](=O)[O-])ccc1Sc1ccc(Cl)cc1 497337770 IDMOZOSFZZZNGX-UHFFFAOYSA-N 495.988 6.164 5 20 JKBD O=C(CSc1nnc(Cc2cccs2)n1CCc1ccccc1)c1ccc([N+](=O)[O-])cc1 500425825 FPOZDBBDACJYKI-UHFFFAOYSA-N 464.572 5.056 5 20 JKBD C[C@@H](Nc1ccc(C(=O)Nc2ccc(Sc3nccn3C)cc2)cc1[N+](=O)[O-])c1ccccn1 504114293 ZJFFXZPECRLCKO-MRXNPFEDSA-N 474.546 5.300 5 20 JKBD CC(=O)Nc1cc(F)c(F)cc1NC(=O)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1 508477897 QAHNIHVCEQDART-UHFFFAOYSA-N 461.808 5.529 5 20 JKBD Cc1cccc(Oc2ccccc2NC(=O)c2ccc([N+](=O)[O-])cc2I)c1 508899794 QRISFTXZKBMPRP-UHFFFAOYSA-N 474.254 5.552 5 20 JKBD CCCN(C(=O)c1ccc(N[C@H](C)c2ccccn2)c([N+](=O)[O-])c1)[C@H]1CCc2ccccc2C1 509996280 FSADZWHWGZKNCH-XXBNENTESA-N 458.562 5.573 5 20 JKBD CCOc1ccc(C(=O)Nc2ccc(NC(=O)c3ccoc3)cc2C(F)(F)F)cc1[N+](=O)[O-] 514574647 ONJXHPWITJSZSQ-UHFFFAOYSA-N 463.368 5.110 5 20 JKBD COc1cc(NC(=O)c2ccccc2)c(OC)cc1NC(=O)Nc1ccc([N+](=O)[O-])cc1Cl 516716301 KMFTWPMLSVECSZ-UHFFFAOYSA-N 470.869 5.162 5 20 JKBD Cc1c(C(=O)Nc2nc(-c3ccc(OC(F)F)cc3OC(F)F)cs2)cccc1[N+](=O)[O-] 519939101 ZYSMARSLYHENOR-UHFFFAOYSA-N 471.388 5.482 5 20 JKBD CCOc1ccc(NC(=O)c2ccc(N3CCC[C@@H](C)C3)c([N+](=O)[O-])c2)c(C(F)(F)F)c1 520403738 WZXNMTWILRKUOK-CQSZACIVSA-N 451.445 5.501 5 20 JKBD CC[C@H](C)NC(=O)c1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2NCc2ccccc2)c(C)c1 520592511 VNPYHOOODOMLAK-SFHVURJKSA-N 460.534 5.296 5 20 JKBD Cc1ccc(NC(=O)c2cccc(C(F)(F)F)c2)cc1NC(=O)CSc1ccc([N+](=O)[O-])cc1 521291950 HLTNXEFTUOBUCH-UHFFFAOYSA-N 489.475 5.905 5 20 JKBD Cc1csc([C@H](C)NC(=O)C/C(=C/c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)n1 524323144 OUXUWBDCCDLOCB-ZCQLHAAUSA-N 464.572 5.778 5 20 JKBD O=[N+]([O-])c1cccc(-c2noc(CN[C@H](c3ccccc3)c3ccc(Br)cc3)n2)c1 560973354 GFXQSZFZFFMQMR-OAQYLSRUSA-N 465.307 5.287 5 20 JKBD O=C(Cn1c2ccccc2c(=O)c2ccccc21)N[C@H]1CCCc2nc(-c3ccc(F)cc3)sc21 591271789 RJOKKHQBXIBELS-NRFANRHFSA-N 483.568 5.611 5 20 JKBD O=C(NCc1cccc(OCc2ccccn2)c1)c1cc([N+](=O)[O-])ccc1Sc1ccccc1 603772179 FXDVMLRQMJXGBR-UHFFFAOYSA-N 471.538 5.650 5 20 JKBD CC(=O)Nc1ccc(S[C@H](C)C(=O)Nc2nc(-c3ccc(C)c([N+](=O)[O-])c3)cs2)cc1 603952164 HTXGEALDRVCGAJ-CYBMUJFWSA-N 456.549 5.104 5 20 JKBD COc1cc([C@@H](C)NC(=O)CSc2ccc([N+](=O)[O-])cc2)ccc1OCc1ccccc1 603986589 AAVBHGSGHXCCSR-QGZVFWFLSA-N 452.532 5.152 5 20 JKBD C[C@@H](Nc1ccc(C(=O)Nc2ccc(Cn3cnc4ccccc43)cc2)cc1[N+](=O)[O-])c1ccccn1 604497949 BSWBLNQHUVDRPQ-LJQANCHMSA-N 492.539 5.813 5 20 JKBD O=C(NC1C[C@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1)c1csc(-c2cccc([N+](=O)[O-])c2)n1 604517453 JMDPUALSXLDIEP-GHMZBOCLSA-N 467.391 5.358 5 20 JKBD C[C@H](Nc1ccc(C(=O)Nc2ccc(NC3CCCCC3)cc2)cc1[N+](=O)[O-])c1ccccn1 604539413 NPVHQFJYNCRLLW-SFHVURJKSA-N 459.550 6.160 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Cl)[C@H](NCc1cccc(OCC(F)F)c1)c1ccccc1 608834906 ZXOVIWUGHJAJMZ-JOCHJYFZSA-N 475.879 5.362 5 20 JKBD CC[C@H](NC(=O)C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)c1nc2ccccc2[nH]1 608950327 QMVNYEPZOODVML-PUWPPSGDSA-N 497.580 6.279 5 20 JKBD CSc1ccc([N+](=O)[O-])c(C(=O)N[C@H]2c3cc(Br)ccc3SC[C@@H]2C)c1 609219122 GSMFGUHUHBHDFG-DYZYQPBXSA-N 453.383 5.292 5 20 JKBD CC(C)OC(=O)C[C@@H](NC(=O)c1ccc(-c2nc3ccccc3s2)o1)c1ccccc1[N+](=O)[O-] 610925529 XAACBVNJVUGCCZ-QGZVFWFLSA-N 479.514 5.277 5 20 JKBD COc1ccccc1-c1nnc(Sc2ccc([N+](=O)[O-])c3cnccc23)n1CCc1ccccc1 619711275 OXTYZFNNCJGPBT-UHFFFAOYSA-N 483.553 5.804 5 20 JKBD Cc1cc[n+](/C(C(=S)Nc2ccc(OC(C)C)cc2)=C(/O)c2ccc([N+](=O)[O-])cc2)cc1 726574100 LTRLMAVSVBAHJC-UHFFFAOYSA-O 450.540 5.301 5 20 JKBD COC1CCN(c2ccc(NC(=O)c3ccc([N+](=O)[O-])cc3Cl)cc2C(F)(F)F)CC1 728012705 LKLPUVMVFNIVGY-UHFFFAOYSA-N 457.836 5.135 5 20 JKBD Cc1c(C(=O)N(C)[C@H]2CCSc3ccc(Br)cc32)cc([N+](=O)[O-])c(C)c1[N+](=O)[O-] 728845049 QGPRDKQVYKJISR-HNNXBMFYSA-N 480.340 5.191 5 20 JKBD CCCS(=O)(=O)c1ccccc1S[C@@H](C)C(=O)OCc1nc2ccccc2c2ccccc12 730628888 YEJZRDASVBIVLT-SFHVURJKSA-N 479.623 5.796 5 20 JKBD CC(C)N(C(=O)COC(=O)C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)C(C)C 748579051 JRAWYIQYCDHWSY-CPNJWEJPSA-N 481.574 5.324 5 20 JKBD O=C(Nc1ccc(-n2cncn2)c(Cl)c1)c1ccc(NCc2ccccc2Cl)c([N+](=O)[O-])c1 749144215 UCRYWSVEPKBDEQ-UHFFFAOYSA-N 483.315 5.347 5 20 JKBD COc1ccc([N+](=O)[O-])cc1C(=O)OCC(=O)N1c2ccccc2Sc2ccc(Cl)cc21 749785554 NTIKOURMABSTKB-UHFFFAOYSA-N 470.890 5.243 5 20 JKBD C[C@@H](OC(=O)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1)c1nc(-c2ccccc2)no1 761642315 JVBHYVJYYMTAOK-CQSZACIVSA-N 490.438 5.184 5 20 JKBD Cc1cccc(C(C)C)c1NC(=O)[C@@H](C)OC(=O)CNc1ccc(C(F)(F)F)cc1[N+](=O)[O-] 772382587 SNXGBROXGMQFOT-CQSZACIVSA-N 467.444 5.028 5 20 JKBD Cc1cccc([N+](=O)[O-])c1NC(=O)COC(=O)c1ccccc1-c1ncc(-c2ccccc2F)o1 899990399 PAEAPEMHJCQZAV-UHFFFAOYSA-N 475.432 5.160 5 20 JKBD CCOc1cc([N+](=O)[O-])c(C(=O)O[C@H](C(=O)Nc2cc(Cl)ccc2Cl)C(C)C)cc1OC 915374255 YYUQXEYXIPAQCB-IBGZPJMESA-N 485.320 5.129 5 20 JKBD CC(C)[C@@H](OC(=O)c1cc2cc([N+](=O)[O-])ccc2s1)C(=O)Nc1ccccc1C(F)(F)F 915379605 CEAPHLDXFSYUAA-GOSISDBHSA-N 466.437 5.648 5 20 JKBD Cc1cc(NC(=O)c2ccccc2Cl)sc1C(=O)O[C@H](C)C(=O)Nc1cccc([N+](=O)[O-])c1 915580111 JKZHVCNFKNPOSV-CYBMUJFWSA-N 487.921 5.054 5 20 JKBD COc1ccc([N+](=O)[O-])cc1OC(=O)c1sc(NC(=O)c2ccc(F)cc2Cl)cc1C 917425126 RDXAPEUWCLQHAY-UHFFFAOYSA-N 464.858 5.237 5 20 JKBD O=C(Oc1ccc2c(-c3ccc([N+](=O)[O-])cc3)cc(=O)oc2c1)c1csc(-c2ccccn2)n1 920999358 RCGYPETYILKCQH-UHFFFAOYSA-N 471.450 5.106 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)NC1(c2ccc(NC(=O)[C@@H]3CCC(F)(F)C3)cc2)CCC1 1785804005 DNDHVUQLOTZLJV-OAHLLOKOSA-N 475.467 5.225 5 20 JKBD CC(C)C1(C(=O)NC2(c3ccc(NC(=O)/C=C/c4ccc([N+](=O)[O-])o4)cc3)CCC2)CCC1 1786208009 DIRDFRJZNMPLLH-PKNBQFBNSA-N 451.523 5.161 5 20 JKBD Cc1cc(C(=O)Nc2ccc(C3(NC(=O)c4sccc4Cl)CCC3)cc2)ncc1[N+](=O)[O-] 1788766812 IKOWGRKLNHTRJV-UHFFFAOYSA-N 470.938 5.075 5 20 JKBD Cc1ccc(CC(=O)Nc2ccc(C3(NC(=O)c4scnc4C4CC4)CCC3)cc2)cc1[N+](=O)[O-] 1790524766 UVNFEHPHESJGRT-UHFFFAOYSA-N 490.585 5.228 5 20 JKBD Cc1occc1C(=O)NC1(c2ccc(NC(=O)c3c(F)ccc([N+](=O)[O-])c3C)cc2)CCC1 1790771209 WHEUKWIEAJMZNU-UHFFFAOYSA-N 451.454 5.005 5 20 JKBD Cc1ncccc1CCC(=O)NC1(c2ccc(NC(=O)/C=C/c3ccccc3[N+](=O)[O-])cc2)CCC1 1792315301 AFNJVAGJBMZBMJ-XNTDXEJSSA-N 484.556 5.078 5 20 JKBD Cc1c(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cc4cc([N+](=O)[O-])ccc4s2)C3)oc2ccccc12 1797418928 OUKAHZBXYFAVMF-BCDXTJNWSA-N 489.553 5.430 5 20 JKBD Cc1cc(CCCC(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)C[C@@H](C)c2ccccc2)c([N+](=O)[O-])cc1F 1801747484 GUWZDVHXEPYAIM-LZQXYRQZSA-N 495.595 5.197 5 20 JKBD Cc1oc(C(C)(C)C)cc1C(=O)N1CCCC2(CCN(C(=O)CCc3cccc([N+](=O)[O-])c3)CC2)C1 1808375749 PBQNVQBNXYCASI-UHFFFAOYSA-N 495.620 5.271 5 20 JKBD O=C(c1cc2cc([N+](=O)[O-])ccc2s1)N1CCC([C@@H]2CCCCN2C(=O)CCC2CCC2)CC1 1824355176 UFRBXPZOZLTRKO-QFIPXVFZSA-N 483.634 5.623 5 20 JKBD O=C(/C=C/c1ccccc1[N+](=O)[O-])N1CCC([C@@H]2CCCCN2C(=O)c2cccc(Cl)c2)CC1 1829974292 RRXSTSNSWYJAHD-RGPPVUSESA-N 481.980 5.195 5 20 JKBD C[C@@H](OC(=O)Cn1c2ccccc2c(=O)c2ccccc21)C(=O)N[C@H](C)c1ccc(Cl)cc1Cl 10722922 RGMZHLQTSCSZMI-HZPDHXFCSA-N 497.378 5.271 5 20 JKBD C[C@@H](OC(=O)Cc1ccc(Cl)cc1Cl)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 11482246 NNXRLQRYUQAEBF-SECBINFHSA-N 465.211 5.033 5 20 JKBD CCc1ccccc1NC(=O)CN(C)C(=O)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1 15558242 ATADCGJDJFMGGU-UHFFFAOYSA-N 467.909 5.314 5 20 JKBD CCOc1ccc([C@@H](CNC(=O)c2ccc([N+](=O)[O-])cc2)c2c[nH]c3ccccc23)cc1OC 16176385 SZSOLHFGYQXGSA-OAQYLSRUSA-N 459.502 5.045 5 20 JKBD Cc1cc(NC(=O)c2ccc(F)cc2Cl)sc1C(=O)N1CCc2cc([N+](=O)[O-])ccc21 58999781 BAIUJYNYCWVGDD-UHFFFAOYSA-N 459.886 5.212 5 20 JKBD COc1ccc(/C=C2/N=C(S[C@H](C)c3cccc([N+](=O)[O-])c3)N(c3cccc(OC)c3)C2=O)cc1 208755506 CZLVIUYSFGHQSX-PTZPRWATSA-N 489.553 5.850 5 20 JKBD COCCOc1ccc(NC(=O)c2ccc(N[C@H](C)c3ccccn3)c([N+](=O)[O-])c2)cc1Cl 410088011 JJWDTVXQSXVIQG-OAHLLOKOSA-N 470.913 5.094 5 20 JKBD Cc1ccc(Sc2ccc(CNC3CCN(C(=O)c4ccccc4O)CC3)cc2[N+](=O)[O-])cc1 436522884 XZVYIEPTHDTTGB-UHFFFAOYSA-N 477.586 5.154 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)N(C)Cc2cc(C)c(OCC(F)(F)F)c(C)c2)cc1SC 483467707 USBNBJKBFQIJIJ-UHFFFAOYSA-N 472.485 5.155 5 20 JKBD CCC(=O)N[C@@H]1CCCN(C(=O)c2c3c(nc4ccccc24)/C(=C/c2cccc([N+](=O)[O-])c2)CCC3)C1 499568438 BPTHAFULPYGFQM-ICFXLVBESA-N 498.583 5.151 5 20 JKBD CCc1cc(O)nc(-c2cccc(NC(=O)c3cc([N+](=O)[O-])ccc3Sc3ccccc3)c2)n1 500329464 AARATOCKYHVQSG-UHFFFAOYSA-N 472.526 5.723 5 20 JKBD Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)CSc1nnc(-c2ccc(Cl)cc2)n1Cc1ccco1 514842341 DMBXTWGHWCJTET-UHFFFAOYSA-N 497.964 5.496 5 20 JKBD Cc1ccc(C(=O)Nc2cccc(C(F)(F)F)c2)cc1NC(=O)c1ccc([N+](=O)[O-])cc1F 520446831 DONJHZAXTPFMPK-UHFFFAOYSA-N 461.371 5.566 5 20 JKBD COc1cc(C(=O)N[C@@H](c2ccccc2)c2cc3ccccc3o2)c([N+](=O)[O-])cc1OC(F)F 585691768 XKOPVXFRICWYBY-QFIPXVFZSA-N 468.412 5.470 5 20 JKBD COc1cc([C@@H](C)Nc2ccc([N+](=O)[O-])c(C(=O)N3CCCC3)c2)ccc1OCCC(C)C 603943502 KXMJPNSECKWKFW-GOSISDBHSA-N 455.555 5.437 5 20 JKBD NC(=O)c1ccc(NC(=O)c2ccccc2Sc2ccc(C(F)(F)F)cc2[N+](=O)[O-])cc1F 608851115 ULMGATILIXJJPT-UHFFFAOYSA-N 479.411 5.255 5 20 JKBD Cc1nc(COc2ccccc2C(=O)Nc2nc(-c3ccc(C)c([N+](=O)[O-])c3)cs2)cs1 619729665 WJJMJHGIIJGHND-UHFFFAOYSA-N 466.544 5.623 5 20 JKBD COc1ccc(CN[C@H](C)c2ccc(N3CCCC3=O)cc2)cc1OCc1ccc([N+](=O)[O-])cc1 725848332 OSYMXCXQUCPPMJ-LJQANCHMSA-N 475.545 5.160 5 20 JKBD Cc1c(C(=O)N[C@@H](C)c2ccc(NC(=O)Nc3ccccc3)cc2)cc([N+](=O)[O-])c(C)c1[N+](=O)[O-] 748712868 ICAOSRJVZIARFG-INIZCTEOSA-N 477.477 5.255 5 20 JKBD CN(Cc1cc([N+](=O)[O-])ccc1Cl)C(=O)c1ccccc1SCC(=O)Nc1ccc(F)cc1 772460603 MCFVNHGICBDLBI-UHFFFAOYSA-N 487.940 5.390 5 20 JKBD CC(C)(C)OC(=O)C1(c2noc(-c3ccc(NCc4ccccc4)c([N+](=O)[O-])c3)n2)CCC1 904821365 QJYDUBJZBNGGNG-UHFFFAOYSA-N 450.495 5.020 5 20 JKBD CSc1cc(C(=O)COC(=O)c2cc([N+](=O)[O-])ccc2Oc2ccccc2)ccc1NC(C)=O 919193659 YSILEHDMSAFXBN-UHFFFAOYSA-N 480.498 5.107 5 20 JKBD C[C@H](OC(=O)c1csc(-c2ccc(Cl)s2)n1)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 920676157 NGRFSZWUHGNUFD-VIFPVBQESA-N 462.896 5.401 5 20 JKBD O=C(/C=C/c1ccc([N+](=O)[O-])o1)Nc1ccc(C2(NC(=O)C[C@@H]3C[C@@H]4CC[C@H]3C4)CCC2)cc1 1786208261 UGGNBTNEDBZBKH-APXNVGFCSA-N 463.534 5.161 5 20 JKBD O=C(/C=C/c1ccccc1[N+](=O)[O-])NC1(c2ccc(NC(=O)c3ccc(C(F)(F)F)[nH]3)cc2)CCC1 1789675817 KHROWZGHCMDCPI-AWNIVKPZSA-N 498.461 5.403 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)[C@H]3[C@@H]4CCC[C@H]3c3ccccc3N4)CCC2)cc1)c1ccc([N+](=O)[O-])[nH]1 1790185009 FQQCIDXWQDGVBR-UWDQQESISA-N 499.571 5.049 5 20 JKBD Cc1ccc(CC(=O)Nc2ccc(C3(NC(=O)C4CCC(F)(F)CC4)CCC3)cc2)cc1[N+](=O)[O-] 1790523922 JQMXXXRVISJJIX-UHFFFAOYSA-N 485.531 5.405 5 20 JKBD CCn1nc(C(C)C)cc1C(=O)NC1(c2ccc(NC(=O)c3ccc([N+](=O)[O-])cc3F)cc2)CCC1 1790625776 NBPMJWLJWXHNDE-UHFFFAOYSA-N 493.539 5.135 5 20 JKBD CC[C@@H](C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(Cl)cc([N+](=O)[O-])c1C)c1ccccc1 1800710193 XTQJASKPYSERGB-PLACYPQZSA-N 469.969 5.002 5 20 JKBD Cc1cc(Cl)cc(C(=O)N2CCC([C@H]3CCCCN3C(=O)c3cccc(F)c3[N+](=O)[O-])CC2)c1 1830623542 VUWVNUXWVRIZLH-JOCHJYFZSA-N 487.959 5.243 5 20 JKBD Cc1c(C(=O)N2CCCC[C@H]2C2CCN(C(=O)/C=C/C(C)C)CC2)cc(Cl)cc1[N+](=O)[O-] 1830738563 UPGYECARARXBJP-CQQBXOTJSA-N 461.990 5.002 5 20 JKBD CCOC(=O)c1c(NC(=O)c2ccc([N+](=O)[O-])cc2Cl)sc(C(=O)Nc2ccccc2)c1C 14659217 IJPWSKMDMMLXNT-UHFFFAOYSA-N 487.921 5.299 5 20 JKBD O=C(COC(=O)C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)NCc1cccs1 18494134 LTGXXMNTTYCPPU-ATVHPVEESA-N 493.566 5.056 5 20 JKBD O=C(c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1)N1CCO[C@H](c2ccc(F)cc2)C1 29113429 QYINOUDAWCAECD-QFIPXVFZSA-N 456.857 5.393 5 20 JKBD Cc1ccc(NC(=O)[C@@H](Sc2nn(-c3ccccc3)c(=S)s2)c2ccccc2)c([N+](=O)[O-])c1 36186301 VKYYBMOVYSKTOE-FQEVSTJZSA-N 494.623 6.352 5 20 JKBD C[C@@H]1c2cc3c(cc2C2(CCCC2)CN1C(=O)Cn1c2ccccc2c(=O)c2ccccc21)OCCO3 39539796 ZTPYESNOWKBLAQ-HXUWFJFHSA-N 494.591 5.341 5 20 JKBD Cc1ccc(-c2csc(NC(=O)c3ccccc3-c3nc(C(C)(C)C)no3)n2)cc1[N+](=O)[O-] 60376095 LKESCXZFZXWIDK-UHFFFAOYSA-N 463.519 5.627 5 20 JKBD CC1CCN(c2ccc([N+](=O)[O-])cc2C(=O)Nc2nnc(SCc3cccs3)s2)CC1 104886111 HTXQZDDEDCMYOA-UHFFFAOYSA-N 475.621 5.289 5 20 JKBD COc1ccc(/C=C2/N=C(S[C@@H](C)c3cccc([N+](=O)[O-])c3)N(c3cccc(OC)c3)C2=O)cc1 208755469 CZLVIUYSFGHQSX-ZZQPOVDQSA-N 489.553 5.850 5 20 JKBD O=C(NCC(F)(F)F)c1ccc(NC(=O)c2ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])cc2)cc1 477930564 AMQQTGFBSXSKJF-UHFFFAOYSA-N 493.825 5.585 5 20 JKBD CCOc1c(OC)cc(CNC(=O)c2ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])cc2)cc1OC 493083050 WFWZXUXMNUHHCN-UHFFFAOYSA-N 486.908 5.386 5 20 JKBD O=C(c1csc(-c2ccc([N+](=O)[O-])cc2)n1)N(Cc1nnc(-c2ccc(Cl)cc2)o1)C1CC1 496446291 HOIMXKPZSLMHTJ-UHFFFAOYSA-N 481.921 5.227 5 20 JKBD CC(C)CCSc1ccc(C(=O)Nc2ccc(CS(=O)(=O)C(C)(C)C)cc2)cc1[N+](=O)[O-] 497770515 WKUQKCXGACVYPL-UHFFFAOYSA-N 478.636 5.699 5 20 JKBD O=C(Nc1ccccc1C(=O)N1CC[C@@H](c2ccccc2F)C1)c1ccc([N+](=O)[O-])cc1Cl 500104559 PBKCRIAFQGLEOI-OAHLLOKOSA-N 467.884 5.269 5 20 JKBD COc1cc(C(=O)N[C@@H](C)c2sc(-c3ccccc3)nc2C)c([N+](=O)[O-])cc1OC(F)F 501605425 JPSYKESWGZKGNA-NSHDSACASA-N 463.462 5.128 5 20 JKBD C[C@@H]1Cc2cc([N+](=O)[O-])ccc2N1C(=O)c1ccc(CNC(=O)C23CC4CC(CC(C4)C2)C3)cc1 504286155 JXNJVMNOXKWGFR-OINFGROXSA-N 473.573 5.019 5 20 JKBD CCCN(C(=O)c1ccc(SCCC(C)C)c([N+](=O)[O-])c1)C1CCN(C(=O)c2ccccc2)CC1 505325134 GKMOPUBRDCAFQS-UHFFFAOYSA-N 497.661 5.890 5 20 JKBD O=C(NCc1ccccc1-c1ccc(Cn2cncn2)cc1)c1cc2cc([N+](=O)[O-])ccc2s1 505398265 YASNIYRSXDCYKI-UHFFFAOYSA-N 469.526 5.046 5 20 JKBD CSc1ccc(C(=O)c2ccccc2C(=O)NCC(=O)Nc2cccc3ccccc23)cc1[N+](=O)[O-] 506608082 MKMKHKNZSPEPJW-UHFFFAOYSA-N 499.548 5.069 5 20 JKBD CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)c1cccc(NC(=O)c2ccc(Br)o2)c1 509715931 YJSRRBKTJLAFBC-UHFFFAOYSA-N 486.322 5.253 5 20 JKBD O=C(Nc1cccc(NC(=O)c2ccc([N+](=O)[O-])cc2F)c1)Nc1cccc(C(F)(F)F)c1 510287208 KUNVERHXXZPVPH-UHFFFAOYSA-N 462.359 5.649 5 20 JKBD CCOc1cc(NC(=O)N2CCC(c3c[nH]c4ccc(OC)cc34)CC2)c([N+](=O)[O-])cc1OCC 510409234 DANUBQFBAOTRNV-UHFFFAOYSA-N 482.537 5.294 5 20 JKBD COc1cc(C(=O)Nc2nc(-c3ccccc3OC)cs2)c([N+](=O)[O-])cc1OCc1cscn1 511143862 RCDOWOQRNDQLHG-UHFFFAOYSA-N 498.542 5.023 5 20 JKBD COc1ccc(-c2nc(C)c(C(=O)Nc3nc(-c4cccc([N+](=O)[O-])c4)cs3)s2)cc1 514517446 CTQRPJIMGRSOQH-UHFFFAOYSA-N 452.517 5.411 5 20 JKBD COc1ccc(F)cc1[C@H](C)N[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1 515525475 RXEVYWZOIJPKHU-RCDICMHDSA-N 457.889 5.427 5 20 JKBD Cc1nccc(CNC(=O)c2c3c(nc4ccccc24)/C(=C\c2ccc([N+](=O)[O-])cc2)CCC3)n1 520477995 WDSOXTGLMNWCLC-CYVLTUHYSA-N 465.513 5.048 5 20 JKBD C[C@@H](NCc1ccc(-c2cccc([N+](=O)[O-])c2)o1)c1ccc(NC(=O)c2ccc(F)cc2)cc1 558931666 HZLRWQKBJPNKNK-QGZVFWFLSA-N 459.477 6.097 5 20 JKBD CSc1ccc(C(=O)c2ccccc2C(=O)Nc2nnc(Cc3ccccc3)s2)cc1[N+](=O)[O-] 600853387 VYPNPRLYIYMGNE-UHFFFAOYSA-N 490.566 5.242 5 20 JKBD COc1cc(CCNC(=O)Nc2ccc(Cc3nc4ccccc4s3)cc2)c([N+](=O)[O-])cc1OC 603648349 SDQLXDRRSNGBMF-UHFFFAOYSA-N 492.557 5.177 5 20 JKBD CCCc1ccc([C@H](NC(=O)C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2cccs2)cc1 603705432 BEDDGCRNILDUKL-FQEVSTJZSA-N 457.939 5.107 5 20 JKBD CCNC(=O)c1ccc(NC(=O)c2ccc(Sc3nc4ccccc4s3)c([N+](=O)[O-])c2)c(C)c1 603993058 GSFKPAIAIAXVOR-UHFFFAOYSA-N 492.582 5.666 5 20 JKBD Cc1ccc(NC(=O)c2ccc(NCc3cccc(NC(=O)c4ccncc4)c3)c([N+](=O)[O-])c2)cc1 608972780 MMUSWVJESUGYCV-UHFFFAOYSA-N 481.512 5.415 5 20 JKBD Cc1cccc(NC(=O)[C@@H](OC(=O)c2csc(-c3ccc([N+](=O)[O-])cc3)n2)C(C)C)c1C 747958322 YOWKHSCKSHWFNM-FQEVSTJZSA-N 453.520 5.155 5 20 JKBD O=C(COC(=O)c1csc(-c2cccc([N+](=O)[O-])c2)n1)Nc1ccc(-c2ccccc2)cc1 747964469 ZLZOYZCJZKHYCB-UHFFFAOYSA-N 459.483 5.181 5 20 JKBD O=C(OCc1cccc2cccnc12)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 808819241 KNJZGBAPONONNC-UHFFFAOYSA-N 459.424 5.122 5 20 JKBD C[C@H](Nc1ccc(-c2nc(-c3cccc(OCc4cccnc4)c3)no2)cc1[N+](=O)[O-])c1ccccn1 904500433 LUOKCKZQHVYBAA-SFHVURJKSA-N 494.511 5.854 5 20 JKBD Cc1ccc(Sc2ccc(-c3nc(-c4ccc(S(C)(=O)=O)cc4)no3)cc2[N+](=O)[O-])cc1 904543571 KLYBCDUGNVCCGW-UHFFFAOYSA-N 467.528 5.175 5 20 JKBD CCC(=O)Nc1cccc(C(=O)Nc2cc(Cl)c([N+](=O)[O-])cc2OCc2ccccc2)c1 917610370 NGJDRUJSSCFVBX-UHFFFAOYSA-N 453.882 5.428 5 20 JKBD O=C(C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)NCc1ccc(Cl)nc1 917724684 JYEZNJJTZPYPND-GZTJUZNOSA-N 464.934 5.500 5 20 JKBD Cc1cc(C(=O)Nc2ccc(C3(NC(=O)/C=C\c4c[nH]c5ccccc45)CCC3)cc2)ncc1[N+](=O)[O-] 1788765127 SXNHLSIKOQUPNL-GHXNOFRVSA-N 495.539 5.241 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)Nc1ccc(C2(NC(=O)c3cncc4cnccc34)CCC2)cc1 1790772448 QVEFEXKETHTYFP-UHFFFAOYSA-N 499.502 5.047 5 20 JKBD CC(C)C1(C(=O)N2CCCC[C@H]2c2cc(NC(=O)Cc3ccc(Cl)cc3[N+](=O)[O-])n[nH]2)CCC1 1814845537 APWKFUFTFFVSGE-IBGZPJMESA-N 487.988 5.032 5 20 JKBD Cc1ccc(C(=O)N2CCCC[C@H]2c2cc(NC(=O)c3cccc(F)c3[N+](=O)[O-])n[nH]2)cc1Cl 1821167906 SDMWAOOPLSOJCB-IBGZPJMESA-N 485.903 5.039 5 20 JKBD Cc1ccc([C@H](C)C(=O)N2CCCC[C@@H]2C2CCN(C(=O)Cc3ccc([N+](=O)[O-])cc3F)CC2)cc1 1831531618 YEOSZVKRJGRUNB-RXFWQSSRSA-N 495.595 5.008 5 20 JKBD C[C@H](C(=O)N1CCCC[C@H]1C1CCN(C(=O)/C=C/c2ccccc2[N+](=O)[O-])CC1)c1cccs1 1832147776 OELSTTNIWVOEBM-PIYNUTBUSA-N 481.618 5.093 5 20 JKBD Cc1nc(-c2ccc(F)cc2)sc1C(=O)O[C@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 18018121 KMBRFXKYEBLNFD-LLVKDONJSA-N 497.426 5.369 5 20 JKBD Cc1ccccc1OCc1nnc(SCc2cc([N+](=O)[O-])cc3c2OCOC3)n1-c1ccccc1 22619890 ABTDYKRHFOOCHY-UHFFFAOYSA-N 490.541 5.222 5 20 JKBD CN(c1ccc(Oc2ccc([N+](=O)[O-])cn2)cc1)S(=O)(=O)c1ccc(Cl)c(C(F)(F)F)c1 23606450 BTJYFEMLLYNBKX-UHFFFAOYSA-N 487.843 5.279 5 20 JKBD COCc1ccccc1CNC(=O)C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1 25795674 GDNNWFVDQHBJHK-STZFKDTASA-N 473.554 5.598 5 20 JKBD Cc1ccc(NC(=O)c2nnc(/C(Cl)=C/c3ccc(-c4cccc([N+](=O)[O-])c4)o3)s2)cc1 26228656 DDYPEMXQVZTXJU-PDGQHHTCSA-N 466.906 6.004 5 20 JKBD O=C(CCNc1ccccc1[N+](=O)[O-])N(Cc1ccc(Cl)c(Cl)c1)Cc1ccccn1 72052651 GKRJXAHJDFVSFG-UHFFFAOYSA-N 459.333 5.328 5 20 JKBD COc1ccc([C@@H]2[C@H](C(=O)Nc3cccc([N+](=O)[O-])c3C)CCC(=O)N2c2ccc(OC)cc2)cc1 481380805 LTEZQYBUBQRPAA-ATIYNZHBSA-N 489.528 5.043 5 20 JKBD COCCN(C(=O)c1cc(C2CC2)nc2ccccc12)c1nc(-c2ccc([N+](=O)[O-])cc2)cs1 483241973 DSOFXJUKCMXYTK-UHFFFAOYSA-N 474.542 5.437 5 20 JKBD Cc1c(CN2CCSCC2)cccc1NC(=O)c1ccc(NCc2ccccc2)c([N+](=O)[O-])c1 490125696 RHSWUZMMTISMPH-UHFFFAOYSA-N 476.602 5.316 5 20 JKBD COc1ccc([N+](=O)[O-])cc1CN[C@@H](c1ccc(F)cc1)c1ccccc1I 504245996 XTEZLKPOXMCOBG-NRFANRHFSA-N 492.288 5.226 5 20 JKBD Cc1cc(CN2CCSCC2)ccc1NC(=O)c1cc([N+](=O)[O-])ccc1Sc1ccccc1 509202250 HVGFYIIAURFQFS-UHFFFAOYSA-N 479.627 5.856 5 20 JKBD Cc1ccc(Cn2c(SCc3nc(-c4cccc([N+](=O)[O-])c4)no3)nc3ccccc3c2=O)cc1 514904025 VSDNCSBIKWBOKZ-UHFFFAOYSA-N 485.525 5.004 5 20 JKBD COc1cc(C(=O)Nc2cc(F)c(OC)c(F)c2)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 515733109 YCKYTIJSWLRIDH-UHFFFAOYSA-N 464.808 5.588 5 20 JKBD COc1cccc(Oc2ccc(NC(=O)c3cc(OC)c(OC(F)F)cc3[N+](=O)[O-])cc2)c1 515740014 CTNMEPCKZAIGBC-UHFFFAOYSA-N 460.389 5.258 5 20 JKBD O=[N+]([O-])c1ccc(-c2nn(-c3ccccc3)cc2CNCc2csc(Br)c2)cc1 517548861 IWDJPBMEGGMXJZ-UHFFFAOYSA-N 469.364 5.561 5 20 JKBD CN(C)CC(C)(C)CNC(=O)c1ccccc1Sc1ccc(C(F)(F)F)cc1[N+](=O)[O-] 518736542 CCMHRFCCWXAJOI-UHFFFAOYSA-N 455.502 5.082 5 20 JKBD COc1cc(C(=O)Nc2ccc(Oc3ccccc3C(F)(F)F)c(F)c2)c([N+](=O)[O-])cc1OC 521295642 WKYVQAGKXOWNMF-UHFFFAOYSA-N 480.370 5.815 5 20 JKBD CCCC(=O)NC[C@H]1CCCN(C(=O)c2cc([N+](=O)[O-])ccc2Sc2ccc(Cl)cc2)C1 523171202 RWVSYNYXFHICBW-MRXNPFEDSA-N 475.998 5.168 5 20 JKBD O=C(Nc1c(-c2ccccc2)nc2ccccn12)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-] 545287857 WOEGTVKAOMFTKT-UHFFFAOYSA-N 456.380 5.103 5 20 JKBD CN(C)[C@H](CNC(=O)C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)c1cccs1 600838709 NQNFIENLXRTOGJ-JOIYNNFJSA-N 492.626 5.616 5 20 JKBD CCN(CC)C(=O)c1ccc(CNCc2ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])cc2)cc1 603633491 QWGWHPRUQKYVFQ-UHFFFAOYSA-N 467.953 5.812 5 20 JKBD CCCC(=O)Nc1ccc(CNc2ccc(S(=O)(=O)Nc3ccc(C)cc3C)cc2[N+](=O)[O-])cc1 603861344 SWLWCFDEUVBCRY-UHFFFAOYSA-N 496.589 5.363 5 20 JKBD C[C@H]1CCCCN1Cc1ccc(NC(=O)c2cc(OCC(F)(F)F)ccc2[N+](=O)[O-])cc1 603965634 DVRPJLUTLNHYCG-HNNXBMFYSA-N 451.445 5.163 5 20 JKBD C[C@@H](NC(=O)c1cccc(NC(=O)Cc2ccc(Br)cc2)c1)c1cccc([N+](=O)[O-])c1 603966876 IWQPVSGJLATKCE-OAHLLOKOSA-N 482.334 5.030 5 20 JKBD Cc1ccc(-c2noc(CCC(=O)Nc3nc(-c4cccc([N+](=O)[O-])c4)c(C)s3)n2)cc1F 604118464 TWNWIKWHPMTSBY-UHFFFAOYSA-N 467.482 5.096 5 20 JKBD Cc1sc(NC(=O)c2ccc(N[C@H](C)c3ccccn3)c([N+](=O)[O-])c2)nc1-c1ccccc1 604295353 MVUOYHJMAWBXRV-OAHLLOKOSA-N 459.531 5.847 5 20 JKBD COC(=O)c1ccc2c(O)nc(/C=C/c3ccc(-c4ccc([N+](=O)[O-])cc4Cl)o3)nc2c1 608800942 CMWUMMVQSRIGKT-WEVVVXLNSA-N 451.822 5.114 5 20 JKBD Cc1cc(C(=O)O[C@@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2cc(Br)ccc2n1 725976978 SUYAFZJGCPHHNJ-NSHDSACASA-N 492.713 5.051 5 20 JKBD Cc1occc1-c1cc(NC(=O)c2ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])cc2)n(CCO)n1 727316825 KSXMBWNXOITSOG-UHFFFAOYSA-N 482.880 5.050 5 20 JKBD CCCN(C(=O)c1ccc(N[C@@H](C)c2ccccn2)c([N+](=O)[O-])c1)[C@@H]1CCN(C(=O)OC(C)(C)C)C1 729428143 XLROQGNVEUONTD-AZUAARDMSA-N 497.596 5.025 5 20 JKBD CC(=O)N(c1ccc(C)cc1)c1nc(/C=C2\N=C(c3c(Cl)cccc3[N+](=O)[O-])OC2=O)cs1 730958634 YCKBVNMMCXITAU-YVLHZVERSA-N 482.905 5.042 5 20 JKBD CC(C)(C)OC(=O)Nc1cc2ccccc2cc1C(=O)OCc1nnc(-c2ccc([N+](=O)[O-])cc2)o1 743246835 XXRBZTFHVJKIOR-UHFFFAOYSA-N 490.472 5.502 5 20 JKBD CC(C)c1ncc(Cl)c(C(=O)Oc2ccc3c(-c4ccc([N+](=O)[O-])cc4)cc(=O)oc3c2)n1 743608911 QUBCWDHELIRLHV-UHFFFAOYSA-N 465.849 5.154 5 20 JKBD O=C(Nc1cc([N+](=O)[O-])ccc1F)c1cc2cc(Br)cc(Br)c2o1 747371885 CAZSHDUQAQENED-UHFFFAOYSA-N 458.037 5.257 5 20 JKBD O=C(COC(=O)c1csc(-c2ccc([N+](=O)[O-])cc2)n1)c1ccc2c(c1)Cc1ccccc1-2 747954780 LDAJCZBFPPDLKV-UHFFFAOYSA-N 456.479 5.329 5 20 JKBD C[C@@H](OC(=O)c1cc2c3ccccc3n(C)c2s1)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl 762203877 KYJMMFXGYACROC-LLVKDONJSA-N 457.895 5.139 5 20 JKBD O=C(Nc1cc2c(cc1[N+](=O)[O-])OCCCO2)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1 790650674 PZTCGJQVPGBKJQ-UHFFFAOYSA-N 485.836 5.362 5 20 JKBD Cc1ccc(Cl)cc1NC(=O)COc1ccc2c(-c3ccc([N+](=O)[O-])cc3)cc(=O)oc2c1 844160200 GHTIDQIYBYSCST-UHFFFAOYSA-N 464.861 5.348 5 20 JKBD COc1ccc(-c2cc(NCCC(=O)Nc3ccccc3[N+](=O)[O-])ccc2OC(F)F)cc1 844260054 YDQIFQFVLLUDKY-UHFFFAOYSA-N 457.433 5.313 5 20 JKBD Cc1ccc(NC(=O)COC(=O)c2ccc(Sc3nc(C)cs3)c([N+](=O)[O-])c2)c(Cl)c1 849120032 LQQUIDKNAHVNRP-UHFFFAOYSA-N 477.951 5.268 5 20 JKBD CC(=O)c1ccc(-c2ccc(C(=O)N(Cc3nnc(-c4cccc([N+](=O)[O-])c4)o3)C(C)C)o2)cc1 864244687 JDYNUVYGUJJUQB-UHFFFAOYSA-N 474.473 5.158 5 20 JKBD Cc1sc(NC(=O)CCNc2ccc(C(F)(F)F)cc2[N+](=O)[O-])c(C(N)=O)c1-c1ccccc1 913193814 XFMBKVPBABBKIF-UHFFFAOYSA-N 492.479 5.190 5 20 JKBD COc1cc2c(cc1OC)[C@@H](c1cccs1)N(C(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1)CC2 915309020 KCYPMRKCRCEKGM-NRFANRHFSA-N 473.938 5.507 5 20 JKBD C[C@H](OC(=O)c1cccnc1Oc1ccc(Cl)cc1Cl)C(=O)Nc1ccc(F)c([N+](=O)[O-])c1 920912488 LKIKKPDVZHVYDD-NSHDSACASA-N 494.262 5.412 5 20 JKBD CCOc1ccsc1C(=O)Nc1ccc(C2(NC(=O)Cc3cccc([N+](=O)[O-])c3)CCC2)cc1 1785770717 MKAXFJHUXLACBR-UHFFFAOYSA-N 479.558 5.045 5 20 JKBD O=C(CCC1CCCC1)NC1(c2ccc(NC(=O)c3ccc(O)c([N+](=O)[O-])c3)cc2)CCC1 1790618514 DHSWYYIYBRFNAS-UHFFFAOYSA-N 451.523 5.019 5 20 JKBD O=C(Cc1cc(F)ccc1[N+](=O)[O-])Nc1ccc(C2(NC(=O)c3ccc4ncccc4c3)CCC2)cc1 1792308735 GVAIRTGHYWZOHK-UHFFFAOYSA-N 498.514 5.273 5 20 JKBD O=C(/C=C/c1ccc([N+](=O)[O-])o1)NC1(c2ccc(NC(=O)[C@@]3(F)CCCC=C3F)cc2)CCC1 1792374991 KDYDYCMMPMPNCM-KMEWNKIWSA-N 471.460 5.081 5 20 JKBD O=C(CC1CCCC1)N1CCCC[C@@H]1c1cc(NC(=O)C2(c3cccc([N+](=O)[O-])c3)CCC2)n[nH]1 1820841028 OETDGVXWHPLGRO-JOCHJYFZSA-N 479.581 5.012 5 20 JKBD CC[C@H](C(=O)N1CCCC[C@H]1C1CCN(C(=O)/C=C/c2ccc([N+](=O)[O-])o2)CC1)c1ccccc1 1826309557 BDTSFBDKVCHQAD-QAYVAONCSA-N 479.577 5.015 5 20 JKBD O=C([C@@H]1CC=CCC1)N1CCC([C@H]2CCCCN2C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)CC1 1831059987 MFCRTKVQUJRRLQ-DENIHFKCSA-N 481.618 5.399 5 20 JKBD Cc1cccc([N+](=O)[O-])c1NC(=O)CSc1nnc(-c2ccccc2F)n1Cc1ccccc1 9330677 ADIYAYCQNXBBEW-UHFFFAOYSA-N 477.521 5.080 5 20 JKBD CSc1ccc(C(=O)c2ccccc2C(=O)OCc2nc(-c3ccsc3)no2)cc1[N+](=O)[O-] 16685648 CRLSLGKASPYFRC-UHFFFAOYSA-N 481.511 5.016 5 20 JKBD CC(C)CC(=O)Nc1ccc(NC(=O)CSc2ccc(C(F)(F)F)cc2[N+](=O)[O-])cc1 25756204 KULUOXSPYWJAEC-UHFFFAOYSA-N 455.458 5.329 5 20 JKBD Cc1ccc(Sc2ccc(C(=O)N3CCCN(C(=O)c4ccccc4)CC3)cc2[N+](=O)[O-])cc1 29429809 BHRTUWZKWYTKAY-UHFFFAOYSA-N 475.570 5.043 5 20 JKBD O=C(C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)NCCc1c[nH]c2ccccc12 29571262 DAQIWUOXALNCPY-HKWRFOASSA-N 482.565 5.975 5 20 JKBD C[C@H](Sc1nnc(-c2cccs2)n1Cc1ccccc1)C(=O)Nc1cccc([N+](=O)[O-])c1 36859545 SGHPWFVQUFWTGU-HNNXBMFYSA-N 465.560 5.082 5 20 JKBD Cc1nn(Cc2ccc(C(=O)N(C)c3ccc(Br)cc3Cl)cc2)c(C)c1[N+](=O)[O-] 108919693 XKQZIQZLMALRDO-UHFFFAOYSA-N 477.746 5.149 5 20 JKBD Cc1c(NC(=O)c2ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])cc2)cccc1C(=O)N1CCCC1 109725134 MCNUMYPVBBLXCL-UHFFFAOYSA-N 479.920 5.837 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)NC[C@H](c2ccccc2)c2c[nH]c3ccccc23)cc1SC 482296546 SCEKAKUGQUUICM-LJQANCHMSA-N 461.543 5.369 5 20 JKBD Cc1ccc(C(=O)Nc2ccccc2)cc1NC(=O)c1ccc(N2CCC(C)CC2)c([N+](=O)[O-])c1 483293880 HULNILOUNAWNFD-UHFFFAOYSA-N 472.545 5.644 5 20 JKBD COc1cc(C(=O)Nc2ccc(-c3ncc[nH]3)cc2)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 502532587 UDHSRKKKWRQUEI-UHFFFAOYSA-N 464.865 5.692 5 20 JKBD O=C(Nc1cccc(C(=O)N2CCCC2)c1)c1ccc(NCc2ccccc2Cl)c([N+](=O)[O-])c1 502703487 JBGZIRBWTAPWBL-UHFFFAOYSA-N 478.936 5.349 5 20 JKBD CN(C(=O)c1ccc(N2CCCC2)c([N+](=O)[O-])c1)[C@@H]1CCSc2ccc(Br)cc21 504558248 BWIHOHCQRUTZTH-QGZVFWFLSA-N 476.396 5.267 5 20 JKBD COc1ccc(-c2csc(NC(=O)c3cn(C)nc3-c3ccc([N+](=O)[O-])cc3)n2)cc1Cl 506005342 UVMZNEKPPGEGOU-UHFFFAOYSA-N 469.910 5.033 5 20 JKBD CCCC(=O)Nc1cccc(NC(=O)CSc2ccc(C(F)(F)F)cc2[N+](=O)[O-])c1C 518654372 ZOYVRQQETIVBKY-UHFFFAOYSA-N 455.458 5.391 5 20 JKBD C[C@H](CC(=O)Nc1cccc(N2CCCC2)c1)NC(=O)c1cc2ccccc2c2cccnc12 523555945 FKCFGWCYJVZRIR-LJQANCHMSA-N 452.558 5.135 5 20 JKBD Cc1ncc([N+](=O)[O-])cc1C(=O)Nc1ncc(Cc2cc(C(F)(F)F)cc(C(F)(F)F)c2)s1 602225853 DLBPATALWRZCOJ-UHFFFAOYSA-N 490.385 5.635 5 20 JKBD O=C1c2ccccc2N[C@@H](c2csc(-c3cccc([N+](=O)[O-])c3)n2)N1Cc1ccc2c(c1)OCO2 602756676 DHCBKHVZULVPPC-HSZRJFAPSA-N 486.509 5.214 5 20 JKBD COc1cc(OC)cc(C(=O)c2c(NC(=O)c3ccccc3[N+](=O)[O-])sc3c2CCCC3)c1 603450700 BSJQCRKWFVAKQT-UHFFFAOYSA-N 466.515 5.036 5 20 JKBD Cc1cc([N+](=O)[O-])ccc1NC(=O)CN[C@@H](c1ccccc1)c1ccc(Br)cc1F 604009793 ZZKBCBDCZVMPBM-QFIPXVFZSA-N 472.314 5.123 5 20 JKBD Cn1ccnc1[C@H](NCc1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1)c1ccc(F)cc1 608835747 MUKBQMOEFZIHGV-AREMUKBSSA-N 482.519 5.199 5 20 JKBD COCCNC(=O)c1ccc(Cl)c(NC(=O)c2cc([N+](=O)[O-])ccc2Sc2ccccc2)c1 609060965 LGYLKCWGXIQTCR-UHFFFAOYSA-N 485.949 5.028 5 20 JKBD CN(C)C(=O)COc1ccc(NC(=O)CCC(=O)c2ccc3ccc4cccc5ccc2c3c45)cc1 727754115 HVSFOVAGJIXVED-UHFFFAOYSA-N 478.548 5.653 5 20 JKBD C[C@@H](NC(=O)c1cc([N+](=O)[O-])ccc1Br)c1cccc(NC(=O)c2ccccc2)c1 751089049 RNLPHAJAVWFCAX-CQSZACIVSA-N 468.307 5.101 5 20 JKBD CC(C)c1ccc2cc(C(=O)O[C@@H](C)C(=O)Nc3ccc([N+](=O)[O-])cc3C(F)(F)F)[nH]c2c1 914669108 UGWFKZYFPZQFNY-LBPRGKRZSA-N 463.412 5.402 5 20 JKBD Cc1ccc(C(C)C)cc1O[C@H](C)C(=O)N(Cc1nnc(-c2cccc([N+](=O)[O-])c2)o1)C(C)C 916036401 PCVRKUXIMJCQFY-GOSISDBHSA-N 466.538 5.281 5 20 JKBD COc1cc(C(=O)Nc2ccc(-n3ccnc3C)nc2)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 917190335 RNKFFNPZWZRVHN-UHFFFAOYSA-N 479.880 5.191 5 20 JKBD Cc1c(C(=O)Nc2ccccc2SC[C@@H]2CC2(Cl)Cl)cc([N+](=O)[O-])cc1[N+](=O)[O-] 917751461 MBAKQMWGBAWXGC-NSHDSACASA-N 456.307 5.350 5 20 JKBD CCN(Cc1ccccc1NC(=O)C1CCN(c2ccccc2[N+](=O)[O-])CC1)C(=O)OC(C)(C)C 918605423 FGAWYBLMDPOGKR-UHFFFAOYSA-N 482.581 5.207 5 20 JKBD C[C@@H](OC(=O)[C@@H](C)Oc1ccc(Cl)c(Cl)c1)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 919443582 RXPDSFNUCHYMQV-NXEZZACHSA-N 495.237 5.258 5 20 JKBD C[C@H](OC(=O)c1cc2cc([N+](=O)[O-])ccc2[nH]1)C(=O)Nc1c(Cl)cc(Cl)cc1Cl 919514663 UCPCWMUWYVWEQJ-QMMMGPOBSA-N 456.669 5.220 5 20 JKBD COc1cc(/C=C\C(=O)O[C@H](C)c2ccccc2[N+](=O)[O-])ccc1OCc1c(C)noc1C 920268051 MGIXXKUPAPVPTG-UILAEWCASA-N 452.463 5.105 5 20 JKBD Cc1cc(C(=O)Nc2ccc(C3(NC(=O)c4ccc(Cl)cc4)CCC3)cc2)ncc1[N+](=O)[O-] 1788766604 IRSAADMYGAZOMF-UHFFFAOYSA-N 464.909 5.013 5 20 JKBD O=C(/C=C/c1cc2ccccc2o1)Nc1ccc(C2(NC(=O)c3ccc([N+](=O)[O-])[nH]3)CCC2)cc1 1789116127 IOKDRRPOUXADAL-JLHYYAGUSA-N 470.485 5.130 5 20 JKBD CCc1cnc(C(=O)Nc2ccc(C3(NC(=O)CSc4ccccc4[N+](=O)[O-])CCC3)cc2)s1 1789653083 FKOVVRDBDIVUGM-UHFFFAOYSA-N 496.614 5.154 5 20 JKBD O=C(NC1(c2ccc(NC(=O)C3(c4cccc([N+](=O)[O-])c4)CCC3)cc2)CCC1)C1=CCCS1 1790476964 JDSPQNUVTHMBGD-UHFFFAOYSA-N 477.586 5.171 5 20 JKBD O=C(/C=C/c1ccc([N+](=O)[O-])o1)NC1(c2ccc(NC(=O)c3cccc4nscc34)cc2)CCC1 1790941003 ICGCMUHLLAPIMG-PKNBQFBNSA-N 488.525 5.259 5 20 JKBD Cc1cc(C(=O)N2CC[C@@H](CNC(=O)CCCCCC(C)(C)C)[C@H]2c2cccnc2)ncc1[N+](=O)[O-] 1812807181 MWDSCWLLLGUMTF-SQJMNOBHSA-N 495.624 5.009 5 20 JKBD CC(C)[C@H](C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2ccc([N+](=O)[O-])cc2F)[nH]n1)c1ccccc1 1814932102 WGLZIFLUZRXWPB-UPVQGACJSA-N 493.539 5.203 5 20 JKBD Cc1cc(O)c([N+](=O)[O-])cc1C(=O)N1CCCC[C@@H]1c1cc(NC(=O)CC2CCC(C)(C)CC2)n[nH]1 1820978272 HMWCKWBLDWYDHB-HXUWFJFHSA-N 497.596 5.244 5 20 JKBD Cc1c(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)c3ccoc3Cl)[nH]n2)cc(Cl)cc1[N+](=O)[O-] 1821293921 KQSNSDZCFZHAKZ-INIZCTEOSA-N 492.319 5.146 5 20 JKBD O=C(Nc1cc([C@H]2CCCCN2C(=O)c2ccccc2F)[nH]n1)c1cc2cc([N+](=O)[O-])ccc2s1 1821609960 QJRAGACUMZXNMB-LJQANCHMSA-N 493.520 5.291 5 20 JKBD C[C@H](C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)CC1)n1cccc1 1831062636 WJPSQOZDAKHVKT-XMSQKQJNSA-N 494.617 5.106 5 20 JKBD O=C(c1ccc(-c2ccccc2)nc1)N1CC2(CCCN2C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)C1 1845739434 XHQDDWHUAHVPIE-UHFFFAOYSA-N 498.564 5.002 5 20 JKBD Cc1cc(C)c(NC(=S)N(Cc2nnc(-c3cccc([N+](=O)[O-])c3)o2)C(C)C)c(Cl)c1 15151617 JGHZSJGRDJBIPK-UHFFFAOYSA-N 459.959 5.522 5 20 JKBD Cc1cccc(-c2nnc(COC(=O)Cc3cn(-c4ccccc4)nc3-c3ccc([N+](=O)[O-])cc3)o2)c1 18961562 JERMLTPZMPACRD-UHFFFAOYSA-N 495.495 5.092 5 20 JKBD CCOc1ccccc1Nc1nnc(S[C@@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2C)s1 23378856 LOTMSSIQARUYPV-ZDUSSCGKSA-N 459.553 5.016 5 20 JKBD CCn1c(SCC(=O)Nc2ncc(Cl)cc2Cl)nc2cc3ccccc3cc2c1=O 24892263 BUNFXGCARZLVKP-UHFFFAOYSA-N 459.358 5.002 5 20 JKBD COc1cc(C(=O)Nc2cc(Cl)ccc2OCC(F)(F)F)c([N+](=O)[O-])cc1OC(F)F 26496483 ZLVMCEBSMVGPDO-UHFFFAOYSA-N 470.734 5.052 5 20 JKBD CN(C(=O)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1)C1CCN(CCc2ccccn2)CC1 72054366 GWRGBBYFEUUHTQ-UHFFFAOYSA-N 494.979 5.215 5 20 JKBD COc1cccc([C@H](CNC(=O)N[C@H](C)c2cccc([N+](=O)[O-])c2)c2c[nH]c3ccccc23)c1OC 195559676 ZQGGCSPODGXBGP-HXOBKFHXSA-N 488.544 5.286 5 20 JKBD O=C(c1ccc(Oc2ccc(C(F)(F)F)cn2)cc1)N(Cc1ccccc1[N+](=O)[O-])CC(F)(F)F 195611977 AAPCZIFCIDUYLD-UHFFFAOYSA-N 499.367 6.006 5 20 JKBD Cc1cc(C(=O)N(Cc2ccccc2[N+](=O)[O-])CC(F)(F)F)c2ccc(Br)cc2n1 195695298 SOPFJXIIAXHQOX-UHFFFAOYSA-N 482.256 5.419 5 20 JKBD Cc1sc(NC(=O)c2cc(Br)ccc2Cl)nc1-c1cccc([N+](=O)[O-])c1 195703909 SYTLQXLVBSYVBV-UHFFFAOYSA-N 452.717 5.695 5 20 JKBD CCOc1ccc(C(=O)N(CC(=O)Nc2ccccc2F)Cc2ccc(Cl)cc2)cc1[N+](=O)[O-] 488055862 XXRJDISJUKTBCB-UHFFFAOYSA-N 485.899 5.067 5 20 JKBD CCC(=O)Nc1ccc(Cl)c(NC(=O)c2ccc(N3C[C@H](C)C[C@@H](C)C3)c([N+](=O)[O-])c2)c1 488564631 DVCBIDZBWYDLJM-HUUCEWRRSA-N 458.946 5.331 5 20 JKBD O=C(N[C@H](Cc1ccc(O)cc1)c1nc2ccccc2[nH]1)c1csc(-c2cccc([N+](=O)[O-])c2)n1 496612863 RFTSLPHIFIRLJJ-OAQYLSRUSA-N 485.525 5.014 5 20 JKBD O=C(Nc1ccccc1OCc1cscn1)c1ccc(NCc2ccccc2Cl)c([N+](=O)[O-])c1 503464855 WCHKAONAKQQZHQ-UHFFFAOYSA-N 494.960 6.148 5 20 JKBD C[C@@H]1Cc2cc([N+](=O)[O-])ccc2N1C(=O)c1ccc(Oc2ccc(Br)cc2)nc1 504303703 IMJPBVKLBYLCCX-CYBMUJFWSA-N 454.280 5.136 5 20 JKBD C[C@H](Nc1ccc(C(=O)N[C@H](c2ccc(Cl)cc2)c2nccn2C)cc1[N+](=O)[O-])c1ccccn1 506084500 ANEOINISEMKLPH-QMHKHESXSA-N 490.951 5.069 5 20 JKBD CCCN(C(=O)c1ccc(N[C@H](C)c2ccccn2)c([N+](=O)[O-])c1)[C@@H]1CCc2ccccc2C1 509996270 FSADZWHWGZKNCH-AUSIDOKSSA-N 458.562 5.573 5 20 JKBD COc1ccc(CNC(=O)C/C(=C\c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)cc1F 512301021 BFFAZVZXCLLOSH-LDADJPATSA-N 477.517 5.599 5 20 JKBD CC[C@@H](C)c1ccc([C@@H](NC(=O)C(=O)Nc2cc([N+](=O)[O-])ccc2OC)c2cccs2)cc1 515140874 APCUQJMFWFLENO-IVZQSRNASA-N 467.547 5.023 5 20 JKBD Cc1ccc(NS(=O)(=O)c2ccc(NCc3ccnc(N4CCCCC4)c3)c([N+](=O)[O-])c2)c(C)c1 515480401 MPWLJVIKVKVIOU-UHFFFAOYSA-N 495.605 5.010 5 20 JKBD CC(C)CCSc1ccc(C(=O)Nc2ccccc2S(=O)(=O)C(C)C)cc1[N+](=O)[O-] 524228230 IWMUZMHPANTASH-UHFFFAOYSA-N 450.582 5.167 5 20 JKBD C[C@H](Cc1cccs1)NC(=O)C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1 603573575 OYFQYLPDKUQUGE-WDMNMGCXSA-N 463.584 5.944 5 20 JKBD Cc1ccccc1-c1cc(C(=O)Nc2cc([N+](=O)[O-])ccc2OC(F)F)c2cnn(C(C)C)c2n1 603638398 MHJGUHXUQQSPPC-UHFFFAOYSA-N 481.459 5.750 5 20 JKBD CC(=O)N(c1ccc(Cl)cc1)c1nc(/C=C(/c2ccncc2)c2ccc([N+](=O)[O-])cc2)cs1 603945999 ZWUWLROQYQOWJO-OEAKJJBVSA-N 476.945 6.373 5 20 JKBD CCN(C[C@@H]1CCOC1)C(=O)c1c2c(nc3ccccc13)/C(=C/c1cccc([N+](=O)[O-])c1)CCC2 604431429 HNUJIWWXSBCFHZ-GDUPUGJQSA-N 471.557 5.519 5 20 JKBD O=C(NC1C[C@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1)c1csc(-c2ccc([N+](=O)[O-])cc2)n1 604517445 CZKLOUZPOKIADG-GHMZBOCLSA-N 467.391 5.358 5 20 JKBD C[C@@H](NCc1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1)c1ccc(OC(F)F)cc1 608835621 FBPMUPSQCZCWII-QGZVFWFLSA-N 464.472 5.900 5 20 JKBD CCc1cc[n+](/C(C(=S)NC23CC4CC(CC(C4)C2)C3)=C(/O)c2ccc([N+](=O)[O-])cc2)cc1 725763709 KNJDMYSCFXSYAR-UHFFFAOYSA-O 464.611 5.214 5 20 JKBD Cc1c([N+](=O)[O-])cc(C(=O)Nc2nc(C3CC3)c(Cc3ccc(F)cc3)s2)cc1[N+](=O)[O-] 727097539 PSDYPTQSFJWYLB-UHFFFAOYSA-N 456.455 5.128 5 20 JKBD O=C(CSC[C@@H]1CCCCO1)Nc1cc(Cl)c([N+](=O)[O-])cc1OCc1ccccc1 727296030 AHRRBJXOJPMSNQ-INIZCTEOSA-N 450.944 5.068 5 20 JKBD O=C(NCc1ccccc1-c1ccc(Cn2ccnc2)cc1)Nc1ccc(Cl)c([N+](=O)[O-])c1 729037541 XWGPEVUVGQACET-UHFFFAOYSA-N 461.909 5.482 5 20 JKBD Cc1csc(Nc2cccc(NC(=O)c3ccc(Cn4nc(C)c([N+](=O)[O-])c4C)cc3)c2)n1 729335013 SPMGHCQSMZPQLJ-UHFFFAOYSA-N 462.535 5.217 5 20 JKBD O=C(Cn1c2ccccc2c(=O)c2ccccc21)O[C@H](c1ccc(Br)cc1)C(F)(F)F 731147117 IUHAXOHFIKHYLG-JOCHJYFZSA-N 490.275 5.764 5 20 JKBD C[C@@H](OC(=O)Cc1csc(-c2ccc(Cl)cc2Cl)n1)C(=O)Nc1ccc([N+](=O)[O-])cc1 747259869 WGJWXAZJQSXCPB-LLVKDONJSA-N 480.329 5.138 5 20 JKBD COC(=O)c1c(-c2ccccc2Cl)csc1NC(=O)c1cc([N+](=O)[O-])ccc1Cl 747614212 GHJMYKGHOUNRBP-UHFFFAOYSA-N 451.287 5.669 5 20 JKBD CC(C)(C)c1ccc([C@@H]2CCCN2C(=O)COC(=O)c2csc(-c3ccc([N+](=O)[O-])cc3)n2)cc1 747954714 KLAMEUMMDWVRPR-QFIPXVFZSA-N 493.585 5.536 5 20 JKBD O=C(O[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1)c1c[nH]c2ccc([N+](=O)[O-])cc12 749319118 ZRUSTAQIUQROOM-NRFANRHFSA-N 494.847 5.175 5 20 JKBD CCCCOc1ccc([C@@H](C)NC(=O)c2cc([N+](=O)[O-])ccc2Br)cc1OC 751091786 ZTAQVTFGIHFGBN-CYBMUJFWSA-N 451.317 5.036 5 20 JKBD CSc1ccc([N+](=O)[O-])c(C(=O)OCC(=O)N(Cc2ccccc2)c2nc3c(s2)CCCC3)c1 761198733 SSFNKJUXOOBLII-UHFFFAOYSA-N 497.598 5.042 5 20 JKBD CN(Cc1cc([N+](=O)[O-])ccc1Cl)C(=O)c1cc([N+](=O)[O-])ccc1NCc1ccccc1 812211397 XQCPKADZXBRIBF-UHFFFAOYSA-N 454.870 5.041 5 20 JKBD O=C1/C(=C\c2ccc(-c3ccc([N+](=O)[O-])cc3)o2)NC(=S)N1c1ccccc1C(F)(F)F 917606473 RXDDRJULBRJOTH-LFIBNONCSA-N 459.405 5.136 5 20 JKBD CCOc1cc(NC(=O)c2ccccc2NC(=O)c2ccc([N+](=O)[O-])cc2Cl)ccc1OC 918615942 GWYZJOACQZIHQC-UHFFFAOYSA-N 469.881 5.160 5 20 JKBD CC(C)c1ccccc1NC(=O)COC(=O)c1ccc(N[C@@H](C)c2ccccn2)c([N+](=O)[O-])c1 920545135 FYFGBUKPCXJPBU-KRWDZBQOSA-N 462.506 5.082 5 20 JKBD C[C@@H](Nc1ccc(C(=O)OCc2ncc(-c3ccc(F)cc3)o2)cc1[N+](=O)[O-])c1ccccn1 920546504 KIPSBCGZDFRYGT-OAHLLOKOSA-N 462.437 5.314 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)C3(c4cccc([N+](=O)[O-])c4)CCC3)CCC2)cc1)c1ccco1 1787271324 LMFAJWYZCIMQBY-UHFFFAOYSA-N 459.502 5.057 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)C3(c4ccc(Cl)cc4)CC3)CCC2)cc1)c1ccc([N+](=O)[O-])[nH]1 1790186991 UIEBAXZLEFLGRL-UHFFFAOYSA-N 478.936 5.056 5 20 JKBD Cc1cc(O)c([N+](=O)[O-])cc1C(=O)Nc1ccc(C2(NC(=O)Cc3c[nH]c4ccccc34)CCC2)cc1 1790809480 LVHHVRBGAKGFON-UHFFFAOYSA-N 498.539 5.081 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)c3ccncc3F)CCC2)cc1)c1cc2cc([N+](=O)[O-])ccc2s1 1791011239 SKECTPJTBGLEKA-UHFFFAOYSA-N 490.516 5.405 5 20 JKBD Cc1ccc(C(=O)NC2(c3ccc(NC(=O)CSc4ccccc4[N+](=O)[O-])cc3)CCC2)c(C)n1 1791522403 PNOOIFYQVPQIRA-UHFFFAOYSA-N 490.585 5.147 5 20 JKBD COc1cc(C(=O)Nc2ccc(C3(NC(=O)C4CCC(F)(F)CC4)CCC3)cc2)ccc1[N+](=O)[O-] 1792163960 OFSUMAKIHITPQW-UHFFFAOYSA-N 487.503 5.177 5 20 JKBD CC(C)c1ccc(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)Cc3cc([N+](=O)[O-])ccc3F)n[nH]2)cc1 1815644551 QOHJSLQDKZSWDY-HSZRJFAPSA-N 493.539 5.129 5 20 JKBD CC(C)[C@H]1CC[C@H](C(=O)Nc2cc([C@H]3CCCCN3C(=O)Cc3ccc([N+](=O)[O-])cc3F)[nH]n2)CC1 1822104915 QLADCRGEPZBTQL-PMAPCBKXSA-N 499.587 5.154 5 20 JKBD Cc1c(Cl)cccc1C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cccc(F)c2[N+](=O)[O-])CC1 1830616279 GKRZQDCMCPJMMP-QFIPXVFZSA-N 487.959 5.243 5 20 JKBD O=C(c1cc(F)ccc1Cl)N1CCC([C@@H]2CCCCN2C(=O)c2cc(F)cc([N+](=O)[O-])c2)CC1 1830618222 OKOCNECXLWRIFF-QFIPXVFZSA-N 491.922 5.074 5 20 JKBD O=C(c1ccc(C2CC2)cc1)N1CCC([C@H]2CCCCN2C(=O)Cc2ccc([N+](=O)[O-])cc2F)CC1 1831295014 VGYHHJNPZMLDOJ-AREMUKBSSA-N 493.579 5.087 5 20 JKBD CCn1c(Cc2ccccc2)nnc1S[C@@H](C(=O)Nc1ccc(C)cc1[N+](=O)[O-])c1ccccc1 9629185 PAGBSZJKKSSAEW-XMMPIXPASA-N 487.585 5.578 5 20 JKBD Cc1c(Cl)cccc1-n1ccnc1SCC(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 21533504 GTIUPBLZWBYVRB-UHFFFAOYSA-N 470.860 5.492 5 20 JKBD O=C(CSc1nc2ccccc2o1)O[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1 22029879 OPJMBMHQHBEGMR-NRFANRHFSA-N 497.916 5.405 5 20 JKBD O=C(Nc1ccccc1Cc1ccccc1)c1ccc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)cc1 29000360 POMCCQIURJPEJC-UHFFFAOYSA-N 487.537 5.239 5 20 JKBD CC(=O)Nc1cccc(Nc2nnc(SCc3nc4ccccc4c4ccccc34)s2)c1 46587908 PLLMFFOZQPOEPR-UHFFFAOYSA-N 457.584 6.234 5 20 JKBD CCN1C/C(=C\c2ccc(-c3ccccc3[N+](=O)[O-])s2)c2nc3ccccc3c(C(=O)O)c2C1 105401266 KXSFGMCQCZSRGN-DTQAZKPQSA-N 471.538 5.946 5 20 JKBD C[C@@H](Nc1ccc(C(=O)N[C@H]2CCSc3ccc(F)cc32)cc1[N+](=O)[O-])c1ccccn1 108788889 POGPPEBUVFPIHB-KUHUBIRLSA-N 452.511 5.269 5 20 JKBD CSc1ccc([C@@H](CNC(=O)c2ccc([N+](=O)[O-])cc2F)N2CCc3sccc3C2)cc1 302927432 BHAHNHVNBICYFZ-OAQYLSRUSA-N 471.579 5.047 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)Nc2c(C)cnn2[C@@H]2CCCc3ccccc32)cc1SC 483700230 PIZBFQHGIUIICJ-GOSISDBHSA-N 452.536 5.008 5 20 JKBD O=C(Cn1c2ccccc2c(=O)c2ccccc21)NC[C@@H](c1ccccc1)N1CCc2sccc2C1 484822525 RDZIYGNIVQOUPI-MHZLTWQESA-N 493.632 5.132 5 20 JKBD C[C@H](N[C@H](Cc1cccc(F)c1)c1cccc(F)c1)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 488009029 SVGOUNLBAKYAQU-OYHNWAKOSA-N 450.445 5.558 5 20 JKBD O=C(N[C@H](Cc1cccc(F)c1)c1cccc(F)c1)C1CCN(c2ccccc2[N+](=O)[O-])CC1 489957454 QABSSRXFZQXHJL-HSZRJFAPSA-N 465.500 5.190 5 20 JKBD Cc1nc(-c2ccccc2)sc1[C@@H](C)NC(=O)C1CCN(c2ccccc2[N+](=O)[O-])CC1 507535776 PZKOZSKLKCBZAE-MRXNPFEDSA-N 450.564 5.121 5 20 JKBD COc1cc(CNCc2cccc(Br)c2)ccc1OCc1ccc([N+](=O)[O-])cc1 507945924 PCXQSSBCNHMUGJ-UHFFFAOYSA-N 457.324 5.235 5 20 JKBD CSc1ccc(C(=O)c2ccccc2C(=O)Nc2ccc(N3CCCC3)cc2C)cc1[N+](=O)[O-] 513842329 FRVOYVGZAVVTLS-UHFFFAOYSA-N 475.570 5.709 5 20 JKBD O=C(CN1CCC[C@H]1c1cccs1)Nc1cc(N2CCC[C@@H]2c2cccs2)ccc1[N+](=O)[O-] 514884968 QAVYPUZPXDGSOA-LEWJYISDSA-N 482.631 5.835 5 20 JKBD CSc1ccc(C(=O)c2ccccc2C(=O)Nc2ccc3c(c2)CCCN3C(C)=O)cc1[N+](=O)[O-] 522199292 NVKOZIDIOOIJFS-UHFFFAOYSA-N 489.553 5.099 5 20 JKBD O=C(Cc1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1)N[C@H](c1ccccc1)[C@H]1CCCO1 523275394 VSGYJOXMLIABTH-LEAFIULHSA-N 482.540 5.027 5 20 JKBD COc1cc(C(=O)N[C@@H](c2nnc3ccccn23)C(C)C)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 523565879 QGPPSPZSLWJUHK-JOCHJYFZSA-N 495.923 5.219 5 20 JKBD CN(CC(=O)NC(C)(C)C)C(=O)c1c2c(nc3ccccc13)/C(=C/c1ccc([N+](=O)[O-])cc1)CCC2 600840423 LACRJSCEVPHOPH-KNTRCKAVSA-N 486.572 5.007 5 20 JKBD COc1cc(C(=O)N[C@@H](c2ccccc2)c2ccc(Cl)c(Cl)c2)c([N+](=O)[O-])cc1OC 604006886 YRXDCHZFFXOUOL-NRFANRHFSA-N 461.301 5.438 5 20 JKBD C[C@H](Nc1ccc(C(=O)N2C[C@H](C(F)(F)F)C[C@@H](C(F)(F)F)C2)cc1[N+](=O)[O-])c1ccccn1 604310684 CXYXTUIEEYHQDE-NWANDNLSSA-N 490.404 5.366 5 20 JKBD O=C(Nc1ccc(Oc2ccccc2C(F)(F)F)c(F)c1)c1cc2c(cc1[N+](=O)[O-])OCO2 604450814 HMXLBLKFPDRNFE-UHFFFAOYSA-N 464.327 5.526 5 20 JKBD Cc1ccc(S(C)(=O)=O)cc1NC(=O)c1cc([N+](=O)[O-])ccc1Sc1ccc(Cl)cc1 604467416 RNKOSDMOVPYJIT-UHFFFAOYSA-N 476.963 5.364 5 20 JKBD C[C@@H](NC(=O)C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)c1nc2ccccc2[nH]1 604469153 OARXDBUYVBLNAZ-WDMNMGCXSA-N 483.553 5.889 5 20 JKBD CCOc1cc([N+](=O)[O-])c(C(=O)Nc2nc(-c3ccco3)c(-c3ccco3)s2)cc1OC 604561016 PJSJKRBWWHOSDT-UHFFFAOYSA-N 455.448 5.231 5 20 JKBD C[C@H](OC(=O)C1CCN(c2ncc(C(F)(F)F)cc2Cl)CC1)c1cccc([N+](=O)[O-])c1 729436367 YIEQIAGOKCWXEQ-LBPRGKRZSA-N 457.836 5.183 5 20 JKBD CCCc1cc[n+](/C(C(=S)Nc2cc(C)ccc2F)=C(/O)c2ccc(C)c([N+](=O)[O-])c2)cc1 744117449 YYAVXHYEFPOKOG-UHFFFAOYSA-O 466.558 5.914 5 20 JKBD Cc1ccc(-c2nc(C)c(C(=O)OCc3nc(-c4ccc([N+](=O)[O-])cc4)no3)s2)c(C)c1 746597046 VXZIMDQCEHQYLJ-UHFFFAOYSA-N 450.476 5.051 5 20 JKBD O=C(CCc1cccc(F)c1F)Oc1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2Cl)cc1 749786930 XGGKJGUBSNLQKC-UHFFFAOYSA-N 460.820 5.317 5 20 JKBD CC(C)(C)OC(=O)N1CCOC[C@@H]1c1noc(-c2ccc(Sc3ccc([N+](=O)[O-])cc3)cc2)n1 904692349 NFCJYHQKTKRVQW-LJQANCHMSA-N 484.534 5.104 5 20 JKBD CC(=O)N[C@@H](CC(=O)Nc1cc(Cl)c([N+](=O)[O-])cc1OCc1ccccc1)c1ccccc1 916827390 GMGYOBDGQBQESW-FQEVSTJZSA-N 467.909 5.033 5 20 JKBD Cc1cccc([N+](=O)[O-])c1NC(=O)COC(=O)c1cc(-c2ccccc2)nc2cc(F)ccc12 920586632 RPQXGZQGMKDESZ-UHFFFAOYSA-N 459.433 5.053 5 20 JKBD O=C(/C=C/c1ccc([N+](=O)[O-])o1)NC1(c2ccc(NC(=O)CCC3CCCC3)cc2)CCC1 1787617010 RNVBPVSOPNACGF-SDNWHVSQSA-N 451.523 5.306 5 20 JKBD Cc1cc2cccc(C(=O)NC3(c4ccc(NC(=O)c5cc(C)c([N+](=O)[O-])cn5)cc4)CCC3)c2[nH]1 1788766460 SRZSJTIOTCBTDY-UHFFFAOYSA-N 483.528 5.149 5 20 JKBD COc1cc(C(=O)NC2(c3ccc(NC(=O)c4sccc4Cl)cc3)CCC2)ccc1[N+](=O)[O-] 1789900952 MSYCTWMMQQLPSL-UHFFFAOYSA-N 485.949 5.380 5 20 JKBD O=C(NC1(c2ccc(NC(=O)c3cccc(F)c3[N+](=O)[O-])cc2)CCC1)c1ccc2occc2c1 1790701623 XMQIRHDQVMOSRQ-UHFFFAOYSA-N 473.460 5.542 5 20 JKBD CC(C)Oc1ccc(C(=O)Nc2ccc(C3(NC(=O)c4ccc([N+](=O)[O-])o4)CCC3)cc2)c(F)c1 1790795409 FRVNBMXUJRANQC-UHFFFAOYSA-N 481.480 5.176 5 20 JKBD Cc1cc(O)c([N+](=O)[O-])cc1C(=O)Nc1ccc(C2(NC(=O)c3cccc4ccncc34)CCC2)cc1 1790808127 SZDYNSRCAOFPQP-UHFFFAOYSA-N 496.523 5.219 5 20 JKBD O=C(/C=C/c1ccccc1[N+](=O)[O-])N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1c(F)cc(Cl)cc1Cl 1800578598 FPWJHLDANVXVMO-ORIYUZMUSA-N 492.334 5.006 5 20 JKBD Cc1cc2cc(C(=O)Nc3cc([C@@H]4CCCCN4C(=O)/C=C/c4ccccc4[N+](=O)[O-])[nH]n3)ccc2[nH]1 1821585927 JHROPJMVWMBVFG-YKATVRGKSA-N 498.543 5.127 5 20 JKBD CC[C@H]1CC[C@H](C(=O)N2CCC([C@H]3CCCCN3C(=O)c3ccc([N+](=O)[O-])cc3F)CC2)CC1 1830497807 NIXXNGKOGIYUBY-DRMXPCRNSA-N 473.589 5.184 5 20 JKBD CC[C@@H](C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cccc(F)c2[N+](=O)[O-])CC1)c1ccccc1 1830615734 BKEODPZIPKKNQF-QPPBQGQZSA-N 481.568 5.161 5 20 JKBD O=C(c1ccc2ccoc2c1)N1CCC([C@@H]2CCCCN2C(=O)c2cc(F)cc([N+](=O)[O-])c2)CC1 1830617475 CABXLCQVOMLSQR-QHCPKHFHSA-N 479.508 5.027 5 20 JKBD Cc1ccc([N+](=O)[O-])cc1NC(=O)CSc1nnc(-c2ccccc2Cl)n1C1CCCC1 8988500 MVWVNISJGIPFLP-UHFFFAOYSA-N 471.970 5.661 5 20 JKBD COc1ccc(CNC(=O)C/C(=C/c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)cc1 15014033 QURNJWJEBYYKFZ-RGEXLXHISA-N 459.527 5.460 5 20 JKBD C[C@@H](c1nc2ccccc2s1)N(C)C(=O)Cc1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1 32341868 BMFNLRHQWYLWMA-SFHVURJKSA-N 497.580 5.819 5 20 JKBD COC(=O)c1cnc(NC(=O)c2ccccc2Sc2ccc(C(F)(F)F)cc2[N+](=O)[O-])s1 32493978 GNPRVILITJILJP-UHFFFAOYSA-N 483.449 5.260 5 20 JKBD O=C(NCc1ccc(Cn2ccccc2=O)cc1)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1 108917395 RJDOYIKQQXVZLK-UHFFFAOYSA-N 489.915 5.181 5 20 JKBD C[C@H](Sc1nnc(-c2ccncc2)n1Cc1ccccc1)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl 253494547 XYABYGOTPRIDNO-HNNXBMFYSA-N 494.964 5.069 5 20 JKBD Cc1cc(Br)cc(Cl)c1NC(=O)CSc1ccc(C(F)(F)F)cc1[N+](=O)[O-] 303011563 OWZHYUYOIYWVIT-UHFFFAOYSA-N 483.693 6.069 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)Nc2cc(-c3nnc4n3CCCCC4)ccc2Cl)cc1SC 482071567 UYYZXKWKEXURIT-UHFFFAOYSA-N 487.969 5.216 5 20 JKBD Cc1nn(-c2ccc(Cl)cc2)c(C)c1CC(=O)N(Cc1ccccc1[N+](=O)[O-])CC(F)(F)F 486072645 LAPJHUCUJVXVLS-UHFFFAOYSA-N 480.874 5.184 5 20 JKBD COc1ccccc1NS(=O)(=O)c1cc([N+](=O)[O-])ccc1N[C@H](C)c1ccc(OC(F)F)cc1 492351400 MCPPILWLPWAMJM-CQSZACIVSA-N 493.488 5.179 5 20 JKBD CCCN(CC(=O)Nc1ccc(Cl)cc1Cl)C(=O)c1csc(-c2cccc([N+](=O)[O-])c2)n1 497370423 YLTLYEUFDKKYKJ-UHFFFAOYSA-N 493.372 5.516 5 20 JKBD CC[C@H](C)Sc1ccc(NC(=O)c2cc(OC)c(OCc3cscn3)cc2[N+](=O)[O-])c(C)c1 498454786 SKRGPUCLXYRPDN-HNNXBMFYSA-N 487.603 6.090 5 20 JKBD CN(CCCCCc1cc(-c2ccccc2)no1)C(=O)C1CCN(c2ccccc2[N+](=O)[O-])CC1 506506840 XUOQXJVFLCOOFH-UHFFFAOYSA-N 476.577 5.338 5 20 JKBD COc1cc(CN[C@@H](c2ccccc2)c2nccs2)c([N+](=O)[O-])cc1OCc1ccccc1 507914454 QFJXSCCZJVQPPE-DEOSSOPVSA-N 461.543 5.518 5 20 JKBD C[C@H](Nc1ccc(C(=O)N[C@@H](C(=O)Nc2ccccc2)c2ccccc2)cc1[N+](=O)[O-])c1ccccn1 508854891 IBRDRLJSWUQKBW-AFMDSPMNSA-N 495.539 5.273 5 20 JKBD Cn1ccnc1[C@@H](NCc1ccc(Oc2ccccc2Cl)c([N+](=O)[O-])c1)c1ccc(Cl)cc1 509617139 ISYVOSYUYAIMGM-QHCPKHFHSA-N 483.355 6.307 5 20 JKBD COc1cc(C(=O)Nc2nnc(SCc3c(Cl)cccc3Cl)s2)ccc1[N+](=O)[O-] 510928605 APKTUSGYZRYLLW-UHFFFAOYSA-N 471.347 5.306 5 20 JKBD COc1cc(C(=O)Nc2nc3c(s2)C(=O)CCC3)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 522514120 DEBABEHNIRZTIX-UHFFFAOYSA-N 473.894 5.277 5 20 JKBD O=C(c1csc(-c2ccc([N+](=O)[O-])cc2)n1)N1CCC[C@H](c2nc3ccccc3s2)C1 523301772 RALMUUNFGQYHMS-HNNXBMFYSA-N 450.545 5.348 5 20 JKBD COc1cc(CNC[C@@H]2CCCO[C@H]2c2ccccc2)ccc1OCc1ccc([N+](=O)[O-])cc1 524680557 GATUSBNBWTZRJG-HOFKKMOUSA-N 462.546 5.440 5 20 JKBD O=C(C1CCC(NCc2ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])cc2)CC1)N1CCSCC1 549242430 NHOAKOLVWZTJQD-UHFFFAOYSA-N 490.025 5.264 5 20 JKBD COc1cc(C(=O)Nc2sc3c(c2C(=O)c2cccs2)CCCC3)c([N+](=O)[O-])cc1OC 591355148 CACGVIZZEIRFLU-UHFFFAOYSA-N 472.544 5.097 5 20 JKBD Cc1c(C(=O)N(C[C@@H]2CCCO2)c2nc(-c3cccc(C(F)(F)F)c3)cs2)cccc1[N+](=O)[O-] 592949756 FXGMSPRUXONOJI-KRWDZBQOSA-N 491.491 5.871 5 20 JKBD C[C@@H](c1ccccc1Cl)N(C)C(=O)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 603511616 NIMKJJURCOAKEP-AWEZNQCLSA-N 469.891 5.703 5 20 JKBD CN(C(=O)CSc1ccccc1C(=O)Nc1cc([N+](=O)[O-])ccc1OC(F)F)C1CCCCC1 603638846 YGWBVKZNQSRDET-UHFFFAOYSA-N 493.532 5.332 5 20 JKBD CCN(Cc1ccccc1)C(=O)c1cc(NC(=O)c2cc(OC)c(OC)cc2[N+](=O)[O-])ccc1Cl 603989377 CIFPDQVXGXOBAL-UHFFFAOYSA-N 497.935 5.180 5 20 JKBD C[C@@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)N1CCC[C@@H]1c1cccc(Br)c1 604446951 LGNQZUISGVJMHU-MLGOLLRUSA-N 453.720 5.142 5 20 JKBD Cc1cccc(COc2ccc([C@H](C)NC(=O)CCCn3c(=O)oc4cc([N+](=O)[O-])ccc43)cc2)c1 609032774 GQMXXTNKLXAEEB-IBGZPJMESA-N 489.528 5.048 5 20 JKBD Cc1cc(O[C@H](C)c2ccccc2)ccc1NC(=O)c1ccc(Sc2nncn2C)c([N+](=O)[O-])c1 609066507 HPZSYKOXPLVHJU-QGZVFWFLSA-N 489.557 5.575 5 20 JKBD Cc1ccc(-c2csc(NC(=O)C3(c4ccccc4Cl)CCOCC3)n2)cc1[N+](=O)[O-] 609326489 DVBQSSMPXQIQAM-UHFFFAOYSA-N 457.939 5.367 5 20 JKBD CCc1cccc[n+]1/C(C(=S)Nc1ccc(Cl)nc1)=C(/O)c1ccc(C)c([N+](=O)[O-])c1 727160577 VWMODVFVMALLTG-UHFFFAOYSA-O 455.947 5.125 5 20 JKBD CCOC(=O)c1c(-c2ccc(F)cc2)csc1NC(=O)c1cc(SC)c(OC)cc1[N+](=O)[O-] 728455405 OKNSPCXUVOXGMJ-UHFFFAOYSA-N 490.534 5.622 5 20 JKBD COCCN(C(=O)c1sccc1SC(F)F)c1nc(-c2ccc([N+](=O)[O-])cc2)cs1 730470005 VKUKRSKRMVUENJ-UHFFFAOYSA-N 471.532 5.388 5 20 JKBD CC[C@H](C)c1ccccc1NC(=O)[C@H](C)OC(=O)c1csc(-c2cccc([N+](=O)[O-])c2)n1 747961087 FYONJXNQRXPWAZ-GJZGRUSLSA-N 453.520 5.416 5 20 JKBD Cc1ccc(NC(=O)[C@@H](OC(=O)c2cc(C(C)C)nc3onc(C)c23)c2ccccc2)c([N+](=O)[O-])c1 813364237 KUMPIZRRCBZNOE-QHCPKHFHSA-N 488.500 5.408 5 20 JKBD CC(C)N(CC(=O)Nc1ccc(Cl)cc1C(F)(F)F)C(=O)/C=C\c1ccc([N+](=O)[O-])cc1 820133074 MRYCJEVRDKTZNL-YHYXMXQVSA-N 469.847 5.156 5 20 JKBD Cc1ccccc1-c1cc(C(=O)O[C@@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2)c2cnn(C(C)C)c2n1 827213920 YZPBPCQOCSXFEB-KRWDZBQOSA-N 487.516 5.080 5 20 JKBD CCc1ccccc1NC(=O)[C@H](C)Oc1ccc2c(-c3ccc([N+](=O)[O-])cc3)cc(=O)oc2c1 851958928 LNESNNNHKOULGN-INIZCTEOSA-N 458.470 5.337 5 20 JKBD O=C(COC(=O)c1cc([N+](=O)[O-])ccc1Oc1ccccc1)Nc1ncc(C(F)(F)F)cc1Cl 919192872 PHPSGEHRUKZZTI-UHFFFAOYSA-N 495.797 5.250 5 20 JKBD O=C(Cn1ccc2ccc([N+](=O)[O-])cc21)Nc1ccc(C2(NC(=O)CCC(F)(F)F)CCC2)cc1 1786277029 ARKFREHGOFQVBJ-UHFFFAOYSA-N 488.466 5.026 5 20 JKBD COc1cc(CC(=O)NC2(c3ccc(NC(=O)[C@@H]4CC=C(C)CC4)cc3)CCC2)ccc1[N+](=O)[O-] 1789115197 PIAHHVAJTURPRB-HXUWFJFHSA-N 477.561 5.026 5 20 JKBD Cc1ccc(C(=O)NC2(c3ccc(NC(=O)C4(c5cccc([N+](=O)[O-])c5)CCC4)cc3)CCC2)o1 1790476786 BCOAKAIKAMGYFH-UHFFFAOYSA-N 473.529 5.366 5 20 JKBD O=C(Cc1c[nH]c2ccccc12)NC1(c2ccc(NC(=O)c3ccc([N+](=O)[O-])cc3F)cc2)CCC1 1790626500 XRJAFYVQAQBTQC-UHFFFAOYSA-N 486.503 5.206 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)c3cccc4cnccc34)CCC2)cc1)c1cc(F)cc([N+](=O)[O-])c1 1790697671 LBAYGMLMYHOVMG-UHFFFAOYSA-N 484.487 5.344 5 20 JKBD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)Cc1ccc(Cl)s1)c1cc2cc([N+](=O)[O-])ccc2s1 1794170980 ACBQMRFUTPPDJR-QDMKHBRRSA-N 490.006 5.019 5 20 JKBD Cc1oc(C(C)(C)C)cc1C(=O)N1CCC2(CCCN(C(=O)CCc3cccc([N+](=O)[O-])c3)C2)CC1 1806490312 FHNYEKZFHROWDU-UHFFFAOYSA-N 495.620 5.271 5 20 JKBD Cc1c(C(=O)N2CCC3(CCCN(C(=O)CCc4cccc([N+](=O)[O-])c4)C3)CC2)oc2ccccc12 1806490583 UUXRUGVBSPVOGO-UHFFFAOYSA-N 489.572 5.127 5 20 JKBD CCCc1ccc(C(=O)N2CCC3(CCCN(C(=O)CCc4cccc([N+](=O)[O-])c4)C3)CC2)cc1 1806493114 QFCQHAJDZCUJBG-UHFFFAOYSA-N 477.605 5.025 5 20 JKBD CC(C)c1ccc(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)/C=C/c3ccc([N+](=O)[O-])o3)n[nH]2)cc1 1814969552 HLJDZDUFKWGHOP-XMZCSZCVSA-N 477.521 5.054 5 20 JKBD Cc1c(C(=O)N2CCC([C@H]3CCCCN3C(=O)CCC(F)(F)F)CC2)cc(Cl)cc1[N+](=O)[O-] 1826671787 UUPFYROCEHLNMS-GOSISDBHSA-N 489.922 5.132 5 20 JKBD CC(C)c1ccc(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)/C=C/c3ccc([N+](=O)[O-])o3)CC2)cc1 1830055102 NIBVNQUJKCRLOW-IYNHSRRRSA-N 479.577 5.258 5 20 JKBD CC1=CC[C@H](C(=O)N2CCC([C@@H]3CCCCN3C(=O)c3cc(Cl)cc([N+](=O)[O-])c3C)CC2)CC1 1830735730 LEYYOUVYNCLASF-REWPJTCUSA-N 488.028 5.536 5 20 JKBD COc1ccc(Br)cc1-c1nc(COC(=O)c2cccc(C)c2[N+](=O)[O-])cs1 9022525 VMEBDDMIVYSKEQ-UHFFFAOYSA-N 463.309 5.155 5 20 JKBD CC(C)c1ccc(CSc2nnc(SCc3ccc(C(N)=O)cc3[N+](=O)[O-])s2)cc1 16116735 LJYJAIBLXBKLDF-UHFFFAOYSA-N 460.606 5.253 5 20 JKBD Cc1cc(C)cc(-n2ccnc2S[C@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2C(F)(F)F)c1 23052344 PRHREJCEWBNUOF-CQSZACIVSA-N 464.469 5.535 5 20 JKBD CC(C)c1ccc(CSc2nnc(S[C@H](C)C(=O)Nc3ccccc3[N+](=O)[O-])s2)cc1 26093342 SPYLZVPRBOIQHU-CQSZACIVSA-N 474.633 5.981 5 20 JKBD CCOc1ccccc1NC(=O)[C@H](Sc1nc2ccc([N+](=O)[O-])cc2s1)c1ccccc1 28303000 FSYNBXOTEGLXHL-OAQYLSRUSA-N 465.556 6.075 5 20 JKBD CC[C@H](C(=O)N1CCC(NC(=O)c2cc3ccccc3c3cccnc23)CC1)c1ccccc1 72056893 PLYDDWPZKUICEU-QHCPKHFHSA-N 451.570 5.303 5 20 JKBD O=C(/C=C\c1cnc2ccccc2n1)O[C@@H](C(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1)c1ccccc1 207446932 MGKLZYRNWNVPSO-JVCIDUABSA-N 488.887 5.128 5 20 JKBD C[C@H]1CCC[C@@H](OCc2cccc(NC(=O)CCCn3c(=O)oc4cc([N+](=O)[O-])ccc43)c2)C1 303027514 WGHSLVHPNBYFPH-LAUBAEHRSA-N 467.522 5.017 5 20 JKBD C[C@H](Nc1ccc(C(=O)Nc2cc(F)ccc2Oc2ccccc2)cc1[N+](=O)[O-])c1ccccn1 303174476 JSESTHFHLXVAQP-KRWDZBQOSA-N 472.476 6.347 5 20 JKBD O=C(Nc1cc(C2CCCC2)nn1-c1ccccc1)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-] 478059990 HYHRXCRLBFFGKO-UHFFFAOYSA-N 474.439 5.632 5 20 JKBD C[C@@H](Cn1ccnc1)NC(=O)c1c2c(nc3ccccc13)/C(=C/c1cccc([N+](=O)[O-])c1)CCC2 481310957 OGOGEYRCLMSGIC-OFBHVFLISA-N 467.529 5.035 5 20 JKBD COCCN(C(=O)c1csc(-c2cccc([N+](=O)[O-])c2)n1)[C@H](C)c1cccc(C(F)(F)F)c1 500298419 JSEJIBNCTMOISO-CQSZACIVSA-N 479.480 5.587 5 20 JKBD Cn1cnnc1Sc1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2Sc2ccccc2)cc1Cl 503684706 ZDRQEIGLCSUOQZ-UHFFFAOYSA-N 497.989 5.931 5 20 JKBD CCN(C(=O)CCOc1ccccc1[N+](=O)[O-])[C@H]1CCSc2ccc(Br)cc21 504642830 UCHHIHMGNGZPCL-INIZCTEOSA-N 465.369 5.212 5 20 JKBD COc1ccc(CSCC(=O)Nc2ccc(Sc3nnc(C)s3)cc2C)cc1[N+](=O)[O-] 505922138 XXSUKVYFRQMKAT-UHFFFAOYSA-N 476.605 5.095 5 20 JKBD C[C@H]1CN(c2ccc(CNCc3ccc(Oc4ccc(Cl)cc4[N+](=O)[O-])cc3)cn2)C[C@@H](C)O1 509600729 JXVUXCGFYRRLDH-HDICACEKSA-N 482.968 5.339 5 20 JKBD O=C(Cc1ccccc1[N+](=O)[O-])Nc1cccc(NC(=O)Nc2cccc(C(F)(F)F)c2)c1 510300264 SUTVULXGZIEEJN-UHFFFAOYSA-N 458.396 5.439 5 20 JKBD O=C(COc1ccccc1[N+](=O)[O-])C(c1nc2ccccc2s1)c1nc2ccccc2s1 513667635 VEDHNULVHIYLGR-UHFFFAOYSA-N 461.524 5.594 5 20 JKBD CC(=O)Nc1cc(N[C@@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Br)c2ccccc2)ccc1C 515763045 WAFQQKGAPIRBLS-JOCHJYFZSA-N 497.349 5.416 5 20 JKBD COc1cc(C(=O)Nc2ccc3nc(C(C)C)sc3c2)c([N+](=O)[O-])cc1OCc1cscn1 520676072 IGBPUCDDRVBKBN-UHFFFAOYSA-N 484.559 5.624 5 20 JKBD O=C(Nc1ccccc1C(=O)N1CCC(OCc2ccccc2)CC1)c1ccc([N+](=O)[O-])cc1Cl 592728846 HOYUPPLCFLSJGQ-UHFFFAOYSA-N 493.947 5.322 5 20 JKBD C[C@@H](Nc1ccc(CCN2CCCCC2)cc1)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 604046844 KIFXKLNPLMILMW-MRXNPFEDSA-N 464.488 5.081 5 20 JKBD CC(C)(C)C(=O)N1CCC(NCc2ccc(Oc3ccc(C(C)(C)C)cc3)c([N+](=O)[O-])c2)CC1 608781941 JMAZYRGHPIAHJM-UHFFFAOYSA-N 467.610 5.811 5 20 JKBD O=C(Nc1ccc(C(=O)Nc2ccc([N+](=O)[O-])cc2F)cc1)c1cccc(Br)c1 608870625 JCKGTYNMYCVNLR-UHFFFAOYSA-N 458.243 5.001 5 20 JKBD COCCN(C(=O)c1csc(-c2ccccc2C)n1)c1nc(-c2ccc([N+](=O)[O-])cc2)cs1 608930766 AIOZYJAIRKJVMD-UHFFFAOYSA-N 480.571 5.443 5 20 JKBD CN(C)CCc1ccc(NC(=O)C/C(=C\c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)cc1 609062875 KWIBFPZTLGUAKI-HEHNFIMWSA-N 486.597 5.878 5 20 JKBD CCS(=O)(=O)Nc1ccc(NC(=O)CCC(=O)c2ccc3ccc4cccc5ccc2c3c45)cc1 727767490 FVAJCLIKIGMACC-UHFFFAOYSA-N 484.577 5.947 5 20 JKBD CC(C)(C)OC(=O)N1CCC[C@H](N(Cc2ccccc2)Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C1 730663617 PMGKRRLSACUGQG-QFIPXVFZSA-N 493.564 5.047 5 20 JKBD O=C(Nc1ccc(=O)n(Cc2ccc(Cl)c(Cl)c2)c1)c1ccc(Br)c([N+](=O)[O-])c1 743696263 RIPPGWGCJTXUQZ-UHFFFAOYSA-N 497.132 5.126 5 20 JKBD C[C@@H](Nc1ccc(C(=O)OCc2csc(C3CCCC3)n2)cc1[N+](=O)[O-])c1ccccn1 746584259 WKOHSPUSKNXVEB-OAHLLOKOSA-N 452.536 5.634 5 20 JKBD COc1cc([C@H](C[N+](=O)[O-])c2c[nH]c3ccccc23)ccc1OS(=O)(=O)c1ccc(SC)cc1 747452421 BUSSVHGRRLVXHO-NRFANRHFSA-N 498.582 5.075 5 20 JKBD CCOc1ccc(CC(=O)O[C@@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2ccccc2)cc1 780482862 BHZYBDBUKUKNNK-HSZRJFAPSA-N 468.893 5.113 5 20 JKBD O=[N+]([O-])c1ccc(NCCCc2nc(-c3ccc(Cn4cnc5ccccc54)cc3)no2)cc1 904473897 VJQKVMQIYOPJKU-UHFFFAOYSA-N 454.490 5.088 5 20 JKBD O=[N+]([O-])c1cccc(-c2nc(-c3nc(-c4ccc(-n5cnc6ccccc65)nc4)no3)cs2)c1 904488196 JTCRLIKIRIISPW-UHFFFAOYSA-N 467.470 5.169 5 20 JKBD Cc1ccc(-n2ncc(C(=O)OCc3nnc(-c4ccc([N+](=O)[O-])cc4)o3)c2C2CC2)cc1Cl 914917470 WFXJOHBMFNHYHV-UHFFFAOYSA-N 479.880 5.027 5 20 JKBD Cc1cccc(Oc2ccccc2NC(=O)c2cc([N+](=O)[O-])ccc2I)c1 915276258 QKWPPXQIAXEMKC-UHFFFAOYSA-N 474.254 5.552 5 20 JKBD O=C(Nc1ccc(OC(=O)[C@@H]2CCC[C@@H](C(F)(F)F)C2)cc1)c1cc([N+](=O)[O-])ccc1Cl 916035717 GIZJVMPZEFMUKM-CHWSQXEVSA-N 470.831 5.775 5 20 JKBD C[C@@H](Sc1cc(Cl)ccc1Cl)C(=O)O[C@H](C)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 919509300 NSQGLZKVUNZBFV-GHMZBOCLSA-N 468.318 5.737 5 20 JKBD C[C@H](Nc1ccc(C(=O)Nc2cc(F)c(N3CCCC3)c(F)c2)cc1[N+](=O)[O-])c1ccccn1 919750152 UIQFYFWDQNICTQ-HNNXBMFYSA-N 467.476 5.294 5 20 JKBD COc1cc(C(=O)Oc2ccc(Cl)c(C(F)(F)F)c2)c([N+](=O)[O-])cc1OCc1cscn1 919986921 NXSIZOYEJRNZNO-UHFFFAOYSA-N 488.827 5.530 5 20 JKBD CC(=O)N(c1ccc(C(F)(F)F)cc1)c1nc(COC(=O)c2ccc([N+](=O)[O-])cc2F)cs1 920537652 GZOPALDOZJULKJ-UHFFFAOYSA-N 483.399 5.251 5 20 JKBD C[C@@H](OC(=O)c1csc(-c2ccc(Cl)cc2Cl)n1)C(=O)Nc1ccc(F)c([N+](=O)[O-])c1 921226295 WPVZTJHKFZZZFD-SECBINFHSA-N 484.292 5.348 5 20 JKBD Cc1ccc(C)c(OCC(=O)Nc2ccc(C3(NC(=O)/C=C/c4ccc([N+](=O)[O-])o4)CCC3)cc2)c1 1786675286 GZTAGGHYACZPFQ-ZRDIBKRKSA-N 489.528 5.031 5 20 JKBD O=C(CCc1cccc([N+](=O)[O-])c1)NC1(c2ccc(NC(=O)c3ccc4ncoc4c3)cc2)CCC1 1789076542 OXICBKZBELOCRR-UHFFFAOYSA-N 484.512 5.117 5 20 JKBD CC1=CC[C@@H](C(=O)Nc2ccc(C3(NC(=O)Cc4cc(F)ccc4[N+](=O)[O-])CCC3)cc2)CC1 1789113739 CVOUSYQCSDWNNF-GOSISDBHSA-N 465.525 5.157 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)c3cc(-c4ccccc4)no3)CCC2)cc1)c1cc(O)cc([N+](=O)[O-])c1 1790755951 HQVHRDODBRZQSF-UHFFFAOYSA-N 498.495 5.017 5 20 JKBD O=C(NC1(c2ccc(NC(=O)c3cc4cc([N+](=O)[O-])ccc4s3)cc2)CCC1)c1ccncc1 1791011314 XFCKGQVUOMWPQW-UHFFFAOYSA-N 472.526 5.266 5 20 JKBD O=C(CCc1cccc([N+](=O)[O-])c1)N1CCC2(CCCN(C(=O)Cc3ccc4ccccc4c3)C2)CC1 1809125055 LHLBJUZDLIDLLZ-UHFFFAOYSA-N 499.611 5.155 5 20 JKBD COc1cc(C(=O)Nc2cc([C@H]3CCCCN3C(=O)[C@H]3CC[C@H](C(C)C)CC3)[nH]n2)ccc1[N+](=O)[O-] 1823286657 DEGFIPGQELRPDD-DBXWQHBBSA-N 497.596 5.095 5 20 JKBD Cc1ccc(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3cc4cc([N+](=O)[O-])ccc4s3)CC2)nc1 1826072998 IDLOMNSTAWQYOE-JOCHJYFZSA-N 492.601 5.060 5 20 JKBD O=C(c1cccc(F)c1[N+](=O)[O-])N1CCC([C@@H]2CCCCN2C(=O)c2cc3ccccc3o2)CC1 1828192237 ZFGPVQOBWSHFQM-NRFANRHFSA-N 479.508 5.027 5 20 JKBD C[C@H](OC(=O)c1sccc1-c1ccccc1)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 10986228 HGECILZVONDSAB-LBPRGKRZSA-N 464.421 5.526 5 20 JKBD Cc1nc(-c2ccc(CN[C@H](C(=O)Nc3ccc([N+](=O)[O-])cc3Cl)c3ccccc3)s2)cs1 15506906 KWCVMJOGNSLIRM-QFIPXVFZSA-N 499.017 6.211 5 20 JKBD O=C(Nc1ccc(OC(=O)c2cccc(OCc3cscn3)c2)cc1)c1cccc([N+](=O)[O-])c1 16260655 PTMKEAGUQKEVSN-UHFFFAOYSA-N 475.482 5.102 5 20 JKBD Cc1ccc(NC(=O)[C@H](OC(=O)c2cnc(Cl)c(Cl)c2)c2ccccc2)c([N+](=O)[O-])c1 20751802 GHNBBAQTBUZMHE-GOSISDBHSA-N 460.273 5.142 5 20 JKBD O=C(NCc1coc(-c2cccs2)n1)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1 26065115 CHZQCQLGYMCMHI-UHFFFAOYSA-N 455.879 5.687 5 20 JKBD O=C(C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1)N1CCCCC[C@@H]1c1ccncc1 479161022 JKHSOTVAOCCXQB-HXUWFJFHSA-N 476.499 5.369 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)NCC2(c3ccc(Cl)cc3Cl)CCOCC2)cc1SC 483329173 YZJAQUTXTYBVNQ-UHFFFAOYSA-N 485.389 5.110 5 20 JKBD CC(C)(C)c1cc(NC(=O)c2cc(OCC(F)(F)F)ccc2[N+](=O)[O-])n(-c2ccc(F)cc2)n1 485415798 WWSMPZRYYFOEQY-UHFFFAOYSA-N 480.418 5.411 5 20 JKBD O=C(CSc1ccc(C(F)(F)F)cc1[N+](=O)[O-])N1CCC(Oc2ccc(F)cc2F)CC1 501626917 LIZLUIOMHSCDJC-UHFFFAOYSA-N 476.423 5.054 5 20 JKBD COc1ccc([C@@H](C)NC(=O)C/C(=C\c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)cc1F 503212728 QHIUAEVILDUPKV-CXDFQFJYSA-N 491.544 6.160 5 20 JKBD CC[C@@H](C)n1c(SCC(=O)Nc2ccc([N+](=O)[O-])cc2C(F)(F)F)nnc1-c1ccccc1 504282674 VZXUBSBVMFBCCN-CYBMUJFWSA-N 479.484 5.574 5 20 JKBD CSc1ccc(C(=O)c2ccccc2C(=O)N(C)Cc2ccc(Br)o2)cc1[N+](=O)[O-] 509452451 QOCRYHHQFCHFEK-UHFFFAOYSA-N 489.347 5.175 5 20 JKBD O=C(NCc1cn(-c2ccccc2)nc1-c1ccccc1)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-] 512357099 GBVKXDZKNLRSSZ-UHFFFAOYSA-N 496.445 5.319 5 20 JKBD CC[C@H](C)N(Cc1ccccc1)C(=O)c1cc(OC)c(OCc2cscn2)cc1[N+](=O)[O-] 512591249 VZPXPFFSDVWDKL-INIZCTEOSA-N 455.536 5.080 5 20 JKBD CC[C@@H](C)Oc1ccc(NC(=O)c2cc(OC)c(OCc3cscn3)cc2[N+](=O)[O-])cc1 512798825 XIFKTXRHZSGMPY-CQSZACIVSA-N 457.508 5.069 5 20 JKBD C[C@H]1CCCN(c2ccc(C(=O)Nc3cccc(OCC(=O)Nc4ccccc4)c3)cc2[N+](=O)[O-])C1 515614692 JBVBIWWLCDVVSP-IBGZPJMESA-N 488.544 5.101 5 20 JKBD CCCOc1ccc(CN[C@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Br)c2ccccc2)cc1 515758170 DYWLFOZASQNBSA-QHCPKHFHSA-N 498.377 5.616 5 20 JKBD O=c1c(Cl)c(NCc2ccc(-c3nc4ccccc4s3)o2)cnn1-c1ccc([N+](=O)[O-])cc1 522624310 MYHHWBHFPRERDF-UHFFFAOYSA-N 479.905 5.276 5 20 JKBD O=C(c1ccc(Sc2nc3ccccc3s2)c([N+](=O)[O-])c1)N1CCC(n2ccnc2)CC1 523576041 NVGXYGAFUNDGAE-UHFFFAOYSA-N 465.560 5.030 5 20 JKBD CC(C)[C@@H](NC(=O)c1ccc(NCc2ccccc2Cl)c([N+](=O)[O-])c1)c1nnc2ccccn12 523845220 LSWYKQYZRMHATR-JOCHJYFZSA-N 478.940 5.030 5 20 JKBD O=C(Nc1ccccc1)[C@@H]1CCc2ccccc2N1C(=O)Cn1c2ccccc2c(=O)c2ccccc21 555068312 MIISHLUMCSZJPI-NDEPHWFRSA-N 487.559 5.141 5 20 JKBD CC(=O)Nc1ccc(C)c(N[C@@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Br)c2ccccc2)c1 604043926 HIBVKJKKTVMIGI-JOCHJYFZSA-N 497.349 5.416 5 20 JKBD C[C@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)NC1C[C@@H](C(F)(F)F)C[C@H](C(F)(F)F)C1 604442926 WOMYPHWPYXVWSU-GUBZILKMSA-N 462.774 5.041 5 20 JKBD C[C@H](Nc1ccc(C(=O)N(C)C[C@H]2CCCO[C@@H]2c2ccccc2)cc1[N+](=O)[O-])c1ccccn1 604519714 QVKKTBVHJPANCR-IATMXGELSA-N 474.561 5.403 5 20 JKBD CN(CCCCCc1cc(-c2cccc(F)c2)no1)C(=O)c1c[nH]c2ccc([N+](=O)[O-])cc12 604550664 VRPVGNYWRPJTHB-UHFFFAOYSA-N 450.470 5.355 5 20 JKBD O=C(c1ccc(NCc2ccccc2)c([N+](=O)[O-])c1)N1CCC(c2n[nH]c(-c3ccccc3)n2)CC1 608891068 QGDUWUAPMGMDKH-UHFFFAOYSA-N 482.544 5.012 5 20 JKBD COc1ccc(CCN(Cc2ccccc2)C(=O)C2CCN(c3ccccc3[N+](=O)[O-])CC2)cc1 608898359 XAEJDQSYTZRXLH-UHFFFAOYSA-N 473.573 5.091 5 20 JKBD CC(C)[C@H](C)N1Cc2cccc(N[C@@H](C)C(=O)Nc3ccc([N+](=O)[O-])cc3C(F)(F)F)c2C1 609041239 GTYXNXLUMLFLIJ-GJZGRUSLSA-N 464.488 5.413 5 20 JKBD Cn1cc([N+](=O)[O-])cc1C(=O)N(C[C@@H]1CCCO1)c1nc(-c2ccc(Cl)cc2Cl)cs1 612566693 PYTFEMQKGNPPEZ-AWEZNQCLSA-N 481.361 5.189 5 20 JKBD CCCc1cc[n+](/C(C(=S)N[C@@H](C)c2cccs2)=C(/O)c2ccc(C)c([N+](=O)[O-])c2)cc1 726579491 MAVZZGXNBSUOIN-KRWDZBQOSA-O 468.624 5.767 5 20 JKBD O=C(OCc1nccn1CC(F)(F)F)c1ccc(Sc2nc3ccccc3s2)c([N+](=O)[O-])c1 728614879 KVIZODVIBNVPBL-UHFFFAOYSA-N 494.476 5.472 5 20 JKBD C/C(=C/C(=O)N(Cc1nnc(-c2cccc([N+](=O)[O-])c2)o1)C(C)C)c1ccc(C(F)(F)F)cc1 748167101 GADWRSHAYIMOID-PTNGSMBKSA-N 474.439 5.504 5 20 JKBD CN(C(=O)CSc1nnc(Nc2ccc(SC(F)F)cc2)s1)c1ccc([N+](=O)[O-])cc1 801700905 UXATXQZCCXTSFN-UHFFFAOYSA-N 483.547 5.260 5 20 JKBD Cc1c(C(=O)Nc2nc(-c3sccc3Br)cs2)cc([N+](=O)[O-])cc1[N+](=O)[O-] 916420478 LXYGOQMLHJFNQM-UHFFFAOYSA-N 469.298 5.011 5 20 JKBD CC(C)NC(=O)c1ccc(Cl)cc1NC(=O)c1ccc(N[C@H](C)c2ccccn2)c([N+](=O)[O-])c1 919845980 IULVDCREBXTFLQ-OAHLLOKOSA-N 481.940 5.207 5 20 JKBD CCCNC(=O)c1ccc(Cl)cc1NC(=O)c1ccc(N[C@@H](C)c2ccccn2)c([N+](=O)[O-])c1 919848777 NPBMTQHZZHCBCQ-HNNXBMFYSA-N 481.940 5.208 5 20 JKBD COc1ccc(-c2[nH]c3ccccc3c2CCC(=O)Nc2ccc(F)c([N+](=O)[O-])c2)c(OC)c1 920018947 JWEMASKRHFLNTO-UHFFFAOYSA-N 463.465 5.471 5 20 JKBD CCOC(=O)c1c(NC(=O)c2cc([N+](=O)[O-])ccc2Cl)sc(C(=O)Nc2ccccc2)c1C 927204932 GLUBCWRGZYFMDK-UHFFFAOYSA-N 487.921 5.299 5 20 JKBD O=C(/C=C/c1ccc([N+](=O)[O-])o1)NC1(c2ccc(NC(=O)[C@@H]3C[C@H]3c3ccc(F)cc3)cc2)CCC1 1786028293 DTHROLALASKNPC-BUHQFNOLSA-N 489.503 5.278 5 20 JKBD Cc1ccc(C(=O)Nc2ccc(C3(NC(=O)/C=C/c4ccc([N+](=O)[O-])o4)CCC3)cc2)s1 1787281423 FCRFGURUNJSYDJ-DHZHZOJOSA-N 451.504 5.019 5 20 JKBD O=C(Cn1ccc2ccc([N+](=O)[O-])cc21)NC1(c2ccc(NC(=O)c3ccsc3)cc2)CCC1 1787282540 OYICJIAQPMRSFA-UHFFFAOYSA-N 474.542 5.059 5 20 JKBD Cc1cc(C)nc(C(=O)Nc2ccc(C3(NC(=O)Cn4ccc5ccc([N+](=O)[O-])cc54)CCC3)cc2)c1 1788349860 XVYGICQJBUMPMI-UHFFFAOYSA-N 497.555 5.009 5 20 JKBD COc1cc(CC(=O)NC2(c3ccc(NC(=O)[C@]4(C)CC=CCC4)cc3)CCC2)ccc1[N+](=O)[O-] 1791992984 YPHNAKNXVZMMJW-AREMUKBSSA-N 477.561 5.026 5 20 JKBD CC1(C)CCC(CC(=O)N2CCCC[C@H]2c2cc(NC(=O)Cc3cccc([N+](=O)[O-])c3)n[nH]2)CC1 1814376175 UPVZDMGZTUHZBL-QFIPXVFZSA-N 481.597 5.159 5 20 JKBD O=C(Nc1cc([C@H]2CCCCN2C(=O)c2cccc(F)c2[N+](=O)[O-])[nH]n1)c1cccc2ccccc12 1818454255 NQZWJQXHWUAQCH-JOCHJYFZSA-N 487.491 5.230 5 20 JKBD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2ccc([N+](=O)[O-])cc2F)[nH]n1)c1cc2sccc2s1 1819029536 TZGSITDBDUPZKC-INIZCTEOSA-N 499.549 5.353 5 20 JKBD Cc1cc(CCCC(=O)N2CCCC[C@@H]2C2CCN(C(=O)CC3CCC3)CC2)c([N+](=O)[O-])cc1F 1824370062 KESZLUQVUQBKLM-XMMPIXPASA-N 487.616 5.175 5 20 JKBD COc1ccc(Nc2nc(COC(=O)Cn3c4ccccc4c(=O)c4ccccc43)cs2)cc1 10723004 UZUXICGHIQHACJ-UHFFFAOYSA-N 471.538 5.107 5 20 JKBD CCc1ccccc1N(C(C)=O)c1nc(COC(=O)c2ccc(N3CCCC3)c([N+](=O)[O-])c2)cs1 10733626 ZQLIFHMPOYKCEU-UHFFFAOYSA-N 494.573 5.256 5 20 JKBD O=C(COC(=O)Cn1c2ccccc2c(=O)c2ccccc21)Nc1ccc(Cl)cc1C(F)(F)F 11276007 NBJFAUCPULVHKP-UHFFFAOYSA-N 488.849 5.009 5 20 JKBD O=C(Cn1c2ccccc2c(=O)c2ccccc21)OCC(=O)N(c1ccccc1)C1CCCCC1 11278218 OMHFPLIIHVZZSZ-UHFFFAOYSA-N 468.553 5.064 5 20 JKBD C[C@@H](OC(=O)Cn1c2ccccc2c(=O)c2ccccc21)C(=O)Nc1cc(Cl)ccc1Cl 14846528 FQXKGQXBKNSSJI-CQSZACIVSA-N 469.324 5.032 5 20 JKBD O=[N+]([O-])c1ccc(-c2nnc(CSc3nnc(-c4c[nH]c5ccccc45)n3C3CC3)o2)cc1 17882197 DOOQBVTYWIFUFX-UHFFFAOYSA-N 459.491 5.012 5 20 JKBD Cc1cccc(-c2nnc(SCC(=O)Nc3ccc([N+](=O)[O-])cc3Cl)n2Cc2ccco2)c1 22045492 IZSWXXBZUDUAIQ-UHFFFAOYSA-N 483.937 5.187 5 20 JKBD C[C@H](Sc1ccc(C(F)(F)F)cn1)C(=O)Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1 25827730 RFIOXEIPZQDMIU-JTQLQIEISA-N 454.455 5.251 5 20 JKBD O=[N+]([O-])c1cccc(-c2noc(CSc3nnc(-c4ccccc4)n3-c3ccc(F)cc3)n2)c1 31840873 UJBMXZDKTALPEB-UHFFFAOYSA-N 474.477 5.324 5 20 JKBD CC(C)[C@@H](NC(=O)c1ccc(N[C@H](C)c2ccccn2)c([N+](=O)[O-])c1)c1ccc2c(c1)OCCO2 108787330 QQAITVJJONCDMY-CRICUBBOSA-N 476.533 5.061 5 20 JKBD C[C@@H](Nc1ccc(C(=O)NC2CCN(Cc3ccc(Cl)cc3)CC2)cc1[N+](=O)[O-])c1ccccn1 108791358 WQLCUTXFDKDLMQ-GOSISDBHSA-N 493.995 5.211 5 20 JKBD Cc1csc(Sc2ccc(C(=O)Nc3ccccc3SC(=O)N(C)C)cc2[N+](=O)[O-])n1 110646382 TYWUCMHJNBGGOW-UHFFFAOYSA-N 474.589 5.537 5 20 JKBD O=C(c1cc([N+](=O)[O-])ccc1Oc1ccccc1)N1CCC(Oc2ccc(F)cc2F)CC1 195641176 XNZOVVRLNPPDEU-UHFFFAOYSA-N 454.429 5.349 5 20 JKBD Cc1ccc(C(=O)Nc2nc(-c3cccc([N+](=O)[O-])c3)c(C)s2)cc1NC(=O)c1ccccc1 195704290 KFOKQMHTVUXTHC-UHFFFAOYSA-N 472.526 5.840 5 20 JKBD C[C@H](Nc1ccc(C(=O)Nc2ncc(Cc3ccc(F)c(F)c3)s2)cc1[N+](=O)[O-])c1ccccn1 410039686 CMMGZGKOCUXZJE-AWEZNQCLSA-N 495.511 5.741 5 20 JKBD O=[N+]([O-])c1ccc(-c2nn(-c3ccccc3)cc2CN[C@@H](c2ccccc2)c2cccnc2)cc1 488617489 KNSYFXNJQHQJBL-MHZLTWQESA-N 461.525 5.722 5 20 JKBD CC(C)Oc1ccc(NC(=O)c2ccccc2C(=O)c2ccc(N(C)C)c([N+](=O)[O-])c2)c(F)c1 498029280 QDPDOUZCQLDYDW-UHFFFAOYSA-N 465.481 5.070 5 20 JKBD C[C@@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)C(c1nc2ccccc2s1)c1nc2ccccc2s1 513648552 RKMLYVUJPCSGTE-CQSZACIVSA-N 491.619 6.696 5 20 JKBD C[C@H]1C[C@@H](C)CN(c2ccc(C(=O)Nc3ccc(NC(=O)NCc4ccco4)cc3)cc2[N+](=O)[O-])C1 515545477 YBENLLMELPJWDC-HDICACEKSA-N 491.548 5.244 5 20 JKBD CC1(C)CN(CC2CN(C(=O)c3cccc4c(=O)c5ccccc5[nH]c34)C2)c2cc(C3CC3)ccc21 565373051 OJVOLRRUWMYOFO-UHFFFAOYSA-N 477.608 5.429 5 20 JKBD CC(C)(C)c1ccc(C(=O)Nc2cc(-c3nnc4n3CCCCC4)ccc2Cl)cc1[N+](=O)[O-] 591773419 OQTIKFAAUWNGAC-UHFFFAOYSA-N 467.957 5.783 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Br)[C@H](NCc1cccc(Cl)c1)c1ccccc1 603744417 LOAZLGZJDBYPMX-HXUWFJFHSA-N 474.742 5.480 5 20 JKBD C[C@@H](Nc1ccc([N+](=O)[O-])c(C(=O)N2CCCC2)c1)c1cccc(NC(=O)Cc2ccccc2F)c1 603943408 CORDARGLPCXUDD-GOSISDBHSA-N 490.535 5.324 5 20 JKBD C[C@H]1C[C@@H](C)CN(c2ccc(C(=O)N(C)C[C@H]3CCCO[C@@H]3c3ccccc3)cc2[N+](=O)[O-])C1 604519056 HJGXFQNCADGILO-PFDCSPEHSA-N 465.594 5.317 5 20 JKBD CC(C)(C)[C@H](NC(=O)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1cccc(C(F)(F)F)c1 608923630 KJGMRHYMLGFJJZ-MRXNPFEDSA-N 457.836 5.109 5 20 JKBD CCOc1cc([N+](=O)[O-])c(C(=O)N2CCCc3cc(Br)cc(Cl)c32)cc1OC 609219627 ZXPJLAQQHMTNDA-UHFFFAOYSA-N 469.719 5.011 5 20 JKBD O=C(Cc1csc(COc2ccc(Cl)cc2)n1)Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1 611957566 FSNOANQIHLIYJL-UHFFFAOYSA-N 486.962 5.588 5 20 JKBD CC(C)N(Cc1nnc(-c2cccc([N+](=O)[O-])c2)o1)C(=S)N[C@H](C)c1ccc(Cl)cc1Cl 726449683 QWVXWOJTBRIJFM-CYBMUJFWSA-N 494.404 5.798 5 20 JKBD CN(C(=O)c1ccc(NC(=O)c2cc(F)c(F)cc2[N+](=O)[O-])cc1Cl)C1CCCCC1 727708315 OLQKTWCEOBHAHY-UHFFFAOYSA-N 451.857 5.183 5 20 JKBD Cc1nc(COc2ccc(N[C@H](C(=O)Nc3ccc([N+](=O)[O-])cc3Cl)c3ccccc3)cc2)no1 731041455 ZSZYUFRBIKTCSJ-QHCPKHFHSA-N 493.907 5.311 5 20 JKBD CN(C)c1ccc([C@H](CNc2cc3ncnc(O)c3cc2[N+](=O)[O-])c2c[nH]c3ccccc23)cc1 784157494 ISHONARZHNPDNX-FQEVSTJZSA-N 468.517 5.035 5 20 JKBD Cc1noc2nc(-c3ccc(F)cc3)cc(C(=O)O[C@@H](C)c3nnc(-c4ccc([N+](=O)[O-])cc4)o3)c12 813355046 WCADEWSXBSUFKS-ZDUSSCGKSA-N 489.419 5.214 5 20 JKBD Cc1cc(C(=O)N2CCC[C@H]2c2nc(-c3ccsc3C(F)(F)F)no2)ccc1[N+](=O)[O-] 904924396 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O=C(CSc1ccccc1[N+](=O)[O-])NC1(c2ccc(NC(=O)c3cnoc3C3CC3)cc2)CCC1 1787598492 WZFNERZKFOLPQB-UHFFFAOYSA-N 492.557 5.000 5 20 JKBD O=C(Cc1cscn1)Nc1ccc(C2(NC(=O)c3cc4cc([N+](=O)[O-])ccc4s3)CCC2)cc1 1788205158 ZYANOYLYGPBPKY-UHFFFAOYSA-N 492.582 5.256 5 20 JKBD Cc1cc(C(=O)Nc2ccc(C3(NC(=O)c4oc5ccccc5c4C)CCC3)cc2)ncc1[N+](=O)[O-] 1788766420 MRURKBMALOWSQF-UHFFFAOYSA-N 484.512 5.414 5 20 JKBD CCc1cc(C(=O)Nc2ccc(C3(NC(=O)c4ccc([N+](=O)[O-])cc4F)CCC3)cc2)cc(C)n1 1788839457 CQYLKMYGGIVWII-UHFFFAOYSA-N 476.508 5.061 5 20 JKBD C[C@H](Sc1cccs1)C(=O)Nc1ccc(C2(NC(=O)c3ccc([N+](=O)[O-])o3)CCC2)cc1 1789413149 AWLYDZIVAUYFTP-AWEZNQCLSA-N 471.560 5.178 5 20 JKBD C/C(=C\c1cccnc1)C(=O)NC1(c2ccc(NC(=O)Cc3ccc(C)c([N+](=O)[O-])c3)cc2)CCC1 1790525302 MJPBAOFRPSFIBU-HMMYKYKNSA-N 484.556 5.078 5 20 JKBD Cc1cc(C(=O)NC2(c3ccc(NC(=O)c4cccc(Br)c4[N+](=O)[O-])cc3)CCC2)c[nH]1 1790752066 YFYHPNPOOPJGPW-UHFFFAOYSA-N 497.349 5.055 5 20 JKBD Cc1cc(O)c([N+](=O)[O-])cc1C(=O)Nc1ccc(C2(NC(=O)CSc3ccccc3)CCC2)cc1 1790806121 XHIZOMKDAXGADL-UHFFFAOYSA-N 491.569 5.149 5 20 JKBD CC(C)(C)c1cc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2ccc([N+](=O)[O-])o2)cc(C(C)(C)C)c1 1792398834 DYLLQQHDXUJIRE-WKCHPHFGSA-N 481.593 5.348 5 20 JKBD C[C@H](C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2ccc([N+](=O)[O-])cc2F)[nH]n1)c1ccc(Cl)cc1 1814660666 MZWXRAXVKPAUHI-LHSJRXKWSA-N 499.930 5.220 5 20 JKBD Cc1cc(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)[C@@H]3CCC[C@@H]4CCCC[C@H]43)CC2)ncc1[N+](=O)[O-] 1827828479 YZMUVRGFKVDLSZ-LVVCFHABSA-N 496.652 5.138 5 20 JKBD CS(=O)(=O)c1ccc2nc(NC(=O)c3cc([N+](=O)[O-])ccc3Sc3ccccc3)sc2c1 14462027 ZBZIQBFPGSMEIP-UHFFFAOYSA-N 485.568 5.012 5 20 JKBD C[C@H](Sc1nnc(-c2ccccc2)n1Cc1ccco1)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 17665226 BCTHPJHQCCBFLN-HNNXBMFYSA-N 474.502 5.398 5 20 JKBD CNc1ccc(C(=O)Nc2cccc(C(=O)Nc3cccc(C(F)(F)F)c3)c2)cc1[N+](=O)[O-] 22471828 KUFRAQCDOHJOPM-UHFFFAOYSA-N 458.396 5.160 5 20 JKBD Cc1c(NC(=O)[C@@H](C)OC(=O)c2cc(C(F)(F)F)cc(C(F)(F)F)c2)cccc1[N+](=O)[O-] 22879363 RMIVZWVLBWTVJT-SNVBAGLBSA-N 464.318 5.125 5 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5 20 JKBD COc1ccccc1NC(=O)Nc1cc(NC(=O)[C@@H](C)Sc2ccc([N+](=O)[O-])cc2)ccc1OC 509451599 QNAFZYQHOTZYEM-OAHLLOKOSA-N 496.545 5.375 5 20 JKBD CCOC(=O)[C@H]1CCCCN1C(=O)C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1 509858774 WHNAOQZXAJTKAA-BKBDBRRMSA-N 479.558 5.079 5 20 JKBD CSc1ccc([N+](=O)[O-])c(C(=O)N2CCCC[C@@H]2C(=O)Nc2ccc(Cl)cc2Cl)c1 515071550 KLTIGMBSCOIGAG-GOSISDBHSA-N 468.362 5.257 5 20 JKBD COc1cc(C(=O)Nc2cc(Cl)ccc2SC(C)C)c([N+](=O)[O-])cc1OCc1cscn1 521535859 NJJQUXCDFIDMQO-UHFFFAOYSA-N 493.994 6.045 5 20 JKBD O=C(Nc1ccc(F)c(-c2nnc3n2CCCCC3)c1)c1csc(-c2ccc([N+](=O)[O-])cc2)n1 522092965 LZMVYOCWMNMXFV-UHFFFAOYSA-N 478.509 5.095 5 20 JKBD COc1cc(C(=O)Nc2ccc(N[C@H](C)c3ccccc3)c(Cl)c2)c([N+](=O)[O-])cc1OC(F)F 524422265 GSMQHVMYGGBALI-CYBMUJFWSA-N 491.878 6.284 5 20 JKBD COc1cc(C(=O)Nc2nc(C)c3c(n2)CCCC3)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 585709127 UVPONWRZTCPXSM-UHFFFAOYSA-N 468.897 5.279 5 20 JKBD COc1ccc(N2C(=O)c3ccccc3N[C@@H]2c2csc(-c3cccc([N+](=O)[O-])c3)n2)cc1 602762665 XSWFOWNDJCLUAR-QFIPXVFZSA-N 458.499 5.498 5 20 JKBD O=C(C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)N[C@@H]1CCCc2nc(O)ccc21 603461321 SZIILQGPXJKVLA-RUDRXDDOSA-N 486.553 5.430 5 20 JKBD COc1ccc(-c2nnc(SCc3nc(-c4ccc([N+](=O)[O-])cc4)no3)n2C2CCCCC2)cc1 603748418 PIQXHSLLFLTCAS-UHFFFAOYSA-N 492.561 5.709 5 20 JKBD Cc1cc(C(=O)N2CCC(C)CC2)ccc1NC(=O)CCNc1ccc(C(F)(F)F)cc1[N+](=O)[O-] 603993437 VVBSPYODKDDHCS-UHFFFAOYSA-N 492.498 5.235 5 20 JKBD Cc1ccc(NC(=O)C(C)C)cc1N[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1 604044385 JUQHIAIBOPHYDU-HSZRJFAPSA-N 480.952 5.943 5 20 JKBD CC1CCN(c2ccc(C(=O)Nc3ccc(F)c(NC(=O)Cc4ccccc4)c3)cc2[N+](=O)[O-])CC1 604103514 STOGDLPGGNMLPG-UHFFFAOYSA-N 490.535 5.404 5 20 JKBD O=C(Nc1ccc(C(=O)NC2CCCC2)cc1)c1ccc(NCc2ccccc2)c([N+](=O)[O-])c1 604176204 HVRJJTOOFGAGEF-UHFFFAOYSA-N 458.518 5.132 5 20 JKBD C[C@@H](Nc1ccc(C(=O)Nc2cccc(-c3cn4cccnc4n3)c2)cc1[N+](=O)[O-])c1ccccn1 604338041 IJESSZSYBIEIRG-QGZVFWFLSA-N 479.500 5.125 5 20 JKBD O=C(CCCn1c(=O)oc2cc([N+](=O)[O-])ccc21)Nc1ccc(-c2nc3c(Cl)cccc3[nH]2)cc1 608948072 SKYJOBFMAAOQQM-UHFFFAOYSA-N 491.891 5.118 5 20 JKBD Cc1nc(-c2ccc(F)cc2)sc1[C@H](C)N[C@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 609221880 HGPVZWDQPDAKLX-WCQYABFASA-N 496.486 5.862 5 20 JKBD COc1ccc(C)cc1NC(=O)[C@H](OC(=O)c1cc([N+](=O)[O-])ccc1Br)c1ccccc1 725985545 MHKZALLKWHPNFD-OAQYLSRUSA-N 499.317 5.211 5 20 JKBD Cc1cc[n+](/C(C(=S)NCc2cccc(C(F)(F)F)c2)=C(/O)c2cccc([N+](=O)[O-])c2)cc1 726569650 DMIYRMJAGKYKAS-UHFFFAOYSA-O 474.484 5.211 5 20 JKBD O=C(Cc1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2N2CCCCC2)cc1)Nc1ccccc1F 728006381 TUNHBPSCUVYHLQ-UHFFFAOYSA-N 476.508 5.158 5 20 JKBD CCOc1cc(CNC(C)(C)c2ccc(F)cc2)ccc1OCc1cc([N+](=O)[O-])cc2c1OCOC2 728593064 LHDXYXWXTSZZCH-UHFFFAOYSA-N 496.535 5.603 5 20 JKBD C[C@@H](OC(=O)c1ccc(Oc2ccccc2)c(N)c1)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 728638533 CZNQPPZDZQCWLW-CYBMUJFWSA-N 489.406 5.172 5 20 JKBD C[C@@H](OC(=O)c1csc(-c2ccc(Cl)cc2)n1)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 763008813 HWRNMCZLSUSHKX-LLVKDONJSA-N 456.867 5.340 5 20 JKBD COc1ccc(CCC(=O)O[C@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2ccccc2)cc1F 792725697 LVZIHGUJEIXLHU-QHCPKHFHSA-N 486.883 5.252 5 20 JKBD COc1cc(CNc2ccc([C@H](O)C(F)(F)F)cc2)ccc1OCc1ccc([N+](=O)[O-])cc1 864043737 NUQLDAYIMRVGAX-QFIPXVFZSA-N 462.424 5.390 5 20 JKBD CC(=O)Nc1ccc(NC(=O)c2ccccc2Sc2ccc(C(F)(F)F)cc2[N+](=O)[O-])cc1C 893536812 LQDRPRMBARYZLS-UHFFFAOYSA-N 489.475 6.284 5 20 JKBD COc1cc(-c2noc(-c3cc([N+](=O)[O-])cc(Br)c3C)n2)cc(Cl)c1OC 904404270 DGQXTLSUZQZQTM-UHFFFAOYSA-N 454.664 5.053 5 20 JKBD CC(=O)N(c1ccc(Cl)cc1)c1nc(CSc2nc3ccc([N+](=O)[O-])cc3s2)cs1 917561058 HGMGWAJVFARQLT-UHFFFAOYSA-N 476.992 6.291 5 20 JKBD O=C(COc1ccc(Cl)c2cccnc12)Oc1ccc(NC(=O)c2cccc([N+](=O)[O-])c2)cc1 917563036 ZTQREAUIGVJRBY-UHFFFAOYSA-N 477.860 5.033 5 20 JKBD C[C@@H](OC(=O)Cn1c2ccccc2c(=O)c2ccccc21)c1cccc(NC(=O)c2ccccc2)c1 919054828 AMQVQAQANBXOBY-HXUWFJFHSA-N 476.532 5.711 5 20 JKBD Cc1ccc(C(=O)Nc2cccc(C(F)(F)F)c2)cc1NC(=O)c1cc([N+](=O)[O-])ccc1C 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C[C@H](CC(=O)Nc1ccc(C2(NC(=O)/C=C/c3ccc([N+](=O)[O-])o3)CCC2)cc1)Oc1ccccc1 1791144144 KOSYYVPEYHZSCY-XYDKVEKUSA-N 489.528 5.193 5 20 JKBD COc1c(C)cc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cc4cc([N+](=O)[O-])ccc4s2)C3)cc1C 1800609673 PZBBHEBRMJMBQX-ACDBMABISA-N 493.585 5.001 5 20 JKBD Cc1cc(Cl)c(Cl)cc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1c(F)ccc([N+](=O)[O-])c1C)C2 1800791274 OIXKIYQOEWRRJC-QDMKHBRRSA-N 494.350 5.223 5 20 JKBD COc1cc(C)c(C)cc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc2cc([N+](=O)[O-])ccc2s1 1801206731 GZZQLLAICPZURW-REPLKXPHSA-N 493.585 5.001 5 20 JKBD CCC[C@H]1CC[C@H](C(=O)N2CC[C@H](CNC(=O)c3ccc([N+](=O)[O-])cc3F)[C@@H]2c2cccnc2)CC1 1810747645 WCOJFQSRYICZQY-JDFHOKRYSA-N 496.583 5.055 5 20 JKBD CC(C)=CCCC(=O)N1CCC([C@H]2CCCCN2C(=O)Cc2ccc(Cl)cc2[N+](=O)[O-])CC1 1824162102 HXAZOUZNCQTUHP-JOCHJYFZSA-N 476.017 5.157 5 20 JKBD O=C(c1cc2cc([N+](=O)[O-])ccc2s1)N1CCC([C@H]2CCCCN2C(=O)/C=C/c2ccoc2)CC1 1825056477 YHPKPVWCGBDDGQ-ZMTJCJBESA-N 493.585 5.349 5 20 JKBD O=C(c1ccc2ccoc2c1)N1CCC([C@@H]2CCCCN2C(=O)c2ccc([N+](=O)[O-])cc2F)CC1 1830499333 SNNOTTJCLUNMFR-QHCPKHFHSA-N 479.508 5.027 5 20 JKBD CCC[C@H]1CC[C@H](C(=O)N2CCCC[C@H]2C2CCN(C(=O)c3cc(C)c([N+](=O)[O-])cn3)CC2)CC1 1831560985 IQMIVYCZRKBMIV-SSPYTLHUSA-N 484.641 5.138 5 20 JKBD O=C(c1ccc(Cl)c(Cl)c1)N1CC2(CCCN2C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)C1 1845739312 IFZNFEVKDQRBCJ-UHFFFAOYSA-N 490.368 5.247 5 20 JKBD CC(C)[C@H](C(=O)N1CCCC12CN(C(=O)c1cc3cc([N+](=O)[O-])ccc3s1)C2)c1ccc(F)cc1 1846284414 NXFSITFISSNROX-QHCPKHFHSA-N 495.576 5.205 5 20 JKBD CCn1c(S[C@@H](C(=O)Nc2ccc(C)cc2[N+](=O)[O-])c2ccccc2)nnc1-c1ccccc1 9484683 OWSSCANHEYOQJV-JOCHJYFZSA-N 473.558 5.654 5 20 JKBD Cc1csc(SCc2ccccc2C(=O)OCC(=O)Nc2ccc(Cl)cc2[N+](=O)[O-])n1 9623668 HPFPIBIWTIFDNT-UHFFFAOYSA-N 477.951 5.101 5 20 JKBD Cc1c(C(=O)Nc2cccc(C(=O)Nc3cccc(C(F)(F)F)c3)c2)cc([N+](=O)[O-])cc1[N+](=O)[O-] 14907692 QQIXDXNFDUGEBJ-UHFFFAOYSA-N 488.378 5.335 5 20 JKBD C[C@H](OC(=O)c1ccccc1-c1ncc(-c2ccccc2)o1)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 19165250 SFRJUKBPIPRRST-INIZCTEOSA-N 482.452 5.885 5 20 JKBD COc1cccc(-c2nnc(SCC(=O)Nc3ccc([N+](=O)[O-])cc3Cl)n2-c2ccccc2)c1 21123533 GKQBAOKFKJMAJY-UHFFFAOYSA-N 495.948 5.235 5 20 JKBD CCn1c(-c2ccc3c(c2)OCCO3)cnc1S[C@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl 23291169 KCKMCCFSTZKQPU-CYBMUJFWSA-N 488.953 5.022 5 20 JKBD Cc1cc([N+](=O)[O-])ccc1NC(=O)CSc1nn(-c2ccc(Cl)cc2)c(=S)s1 23589470 JOQIRVGNKULWOI-UHFFFAOYSA-N 452.970 5.264 5 20 JKBD CCn1c(SCc2nc(=O)c3c(-c4ccco4)csc3[nH]2)nc2cc3ccccc3cc2c1=O 26115658 AHHSFJCXZFLSIB-UHFFFAOYSA-N 486.578 5.420 5 20 JKBD O=C(Oc1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2Cl)cc1)c1cccc(OC[C@@H]2CCCO2)c1 26365496 FFPRJKWXGKNPPD-NRFANRHFSA-N 496.903 5.278 5 20 JKBD O=C(CCSc1nnc(-c2ccc(F)cc2)n1Cc1ccccc1)Nc1ccc([N+](=O)[O-])cc1 26369513 RAGPGCAFPMZWDN-UHFFFAOYSA-N 477.521 5.162 5 20 JKBD Cn1ccnc1[C@H](NC(=O)c1ccc(NCc2ccccc2)c([N+](=O)[O-])c1)c1ccc(Cl)cc1 28946995 GBWRERQIFRAPLB-HSZRJFAPSA-N 475.936 5.113 5 20 JKBD O=C1/C(=C\c2ccc(-c3ccccc3[N+](=O)[O-])o2)NC(=S)N1c1ccc(OC(F)(F)F)cc1 212804619 LLLJBIQOJANTBF-LFIBNONCSA-N 475.404 5.016 5 20 JKBD CCN(CC)C(=O)c1ccc(NC(=O)c2ccc(N[C@@H](C)c3ccccn3)c([N+](=O)[O-])c2)cc1Cl 303024907 RZKIIRWILBCINT-INIZCTEOSA-N 495.967 5.551 5 20 JKBD CCc1ccc(-c2csc(NC(=O)c3cc(OCC(F)(F)F)ccc3[N+](=O)[O-])n2)s1 476171361 SOAZBKXMARBWTK-UHFFFAOYSA-N 457.455 5.536 5 20 JKBD CC(C)(C)S(=O)(=O)Cc1ccc(Nc2ccc(C(=O)c3ccccc3)cc2[N+](=O)[O-])cc1 498247047 FJWQXQBNLOGQRM-UHFFFAOYSA-N 452.532 5.283 5 20 JKBD Cc1nnc(SCc2c(C(=O)Nc3cc4c(cc3[N+](=O)[O-])OCCCO4)oc3ccccc23)s1 499284268 AEANLXIDNQDMIP-UHFFFAOYSA-N 498.542 5.207 5 20 JKBD CC(C)[C@H](C)NC(=O)C1CCN(C(=O)c2ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])cc2)CC1 500240799 YVXFXJWPUIXCCJ-INIZCTEOSA-N 473.957 5.053 5 20 JKBD COc1ccc([C@@H]2CCN(C(=O)c3ccccc3NC(=O)c3ccc([N+](=O)[O-])cc3Cl)C2)cc1 504920218 SXPUPTHNGHOGSM-QGZVFWFLSA-N 479.920 5.139 5 20 JKBD COc1ccccc1NS(=O)(=O)c1cc([N+](=O)[O-])ccc1N[C@@H](c1ccccc1)c1nccs1 505570756 OXSRCNLVKRQYOP-QFIPXVFZSA-N 496.570 5.062 5 20 JKBD CCOc1cc(CN[C@@H](C)c2cc(C)oc2C)ccc1OCc1cc([N+](=O)[O-])cc2c1OCOC2 507928703 FFZFOHLEQAHSCB-KRWDZBQOSA-N 482.533 5.500 5 20 JKBD O=[N+]([O-])c1cc(CNCCc2nccn2Cc2ccccc2)ccc1Oc1ccccc1Cl 509570685 PSNKXKIGRAQUQY-UHFFFAOYSA-N 462.937 5.618 5 20 JKBD C[C@H](NCc1ccc(Oc2ccccc2Cl)c([N+](=O)[O-])c1)c1ccc(S(=O)(=O)N(C)C)cc1 509604034 XOOPBSFISRKWDY-INIZCTEOSA-N 489.981 5.142 5 20 JKBD Cn1ncc2c1CCC[C@@H]2NC(=O)c1ccccc1Sc1ccc(C(F)(F)F)cc1[N+](=O)[O-] 512787236 GGOXNIQFJPGIOR-INIZCTEOSA-N 476.480 5.306 5 20 JKBD Cn1ccnc1C(=O)c1ccc(N2CCC[C@H]2c2ccc(F)c(C(F)(F)F)c2)c([N+](=O)[O-])c1 600852284 JNJKWEDFPJOQEH-KRWDZBQOSA-N 462.403 5.059 5 20 JKBD C[C@@H](NC(=O)c1ccc(NC(=O)c2ccc(Br)cc2)cc1)c1cccc([N+](=O)[O-])c1 603966964 RSFWZDYLBKRYGZ-CQSZACIVSA-N 468.307 5.101 5 20 JKBD COc1cc(C(=O)Nc2ccc(Cl)c(C(=O)NC3CCCCC3)c2)c([N+](=O)[O-])cc1OC(F)F 604025067 BZLLZUMVJUXWDC-UHFFFAOYSA-N 497.882 5.173 5 20 JKBD O=C(NC1CCN(CC(F)F)CC1)c1ccccc1Sc1ccc(C(F)(F)F)cc1[N+](=O)[O-] 604509477 MESDVXZJSBFLQB-UHFFFAOYSA-N 489.466 5.224 5 20 JKBD Cc1ccc(C(=O)Nc2cccc(C(F)(F)F)c2)cc1NC(=O)c1c[nH]c2ccc([N+](=O)[O-])cc12 608854609 PXASCBXDHDZAMH-UHFFFAOYSA-N 482.418 5.908 5 20 JKBD COc1ccc(Oc2ccc([N+](=O)[O-])cc2C(=O)N2CCC[C@H](c3nc4ccc(C)cc4[nH]3)C2)cc1 608986394 BIGHHYNKGBUEOC-SFHVURJKSA-N 486.528 5.600 5 20 JKBD O=C(Nc1cccc(SC(F)F)c1)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 727347272 HAWDAPASRSKWRW-UHFFFAOYSA-N 475.439 5.783 5 20 JKBD CCN(c1ccccc1)S(=O)(=O)c1cc(NC(=O)c2cc(Cl)ccc2[N+](=O)[O-])ccc1Cl 862215088 CIVUCAINUYXZJY-UHFFFAOYSA-N 494.356 5.369 5 20 JKBD O=C(Nc1ccccc1C(=O)NCc1ccccc1Br)c1ccc([N+](=O)[O-])cc1Cl 914478751 FGOMJTZVSBIIQD-UHFFFAOYSA-N 488.725 5.193 5 20 JKBD O=C(OCc1nc(-c2cccc([N+](=O)[O-])c2)no1)c1ccc(Oc2ccc(C(F)(F)F)cn2)cc1 914887910 ONGSGHUWRYLOQF-UHFFFAOYSA-N 486.362 5.208 5 20 JKBD CC(=O)N(c1nc(/C=C2/C(=O)Nc3cc(Cl)c([N+](=O)[O-])cc32)cs1)c1ccc(F)cc1F 915115106 WZJVBTLPQCXRKN-WLRTZDKTSA-N 476.848 5.160 5 20 JKBD C[C@H]1Cc2cc([N+](=O)[O-])ccc2N1Cn1nc(-c2c[nH]c3ccccc23)n(C[C@@H]2CCCO2)c1=S 915205125 JDVITUCDSGOBPL-LPHOPBHVSA-N 490.589 5.058 5 20 JKBD CC(=O)c1ccc(C(=O)O[C@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Br)c2ccccc2)cc1 915564689 HVZGSJIAZQVIJE-NRFANRHFSA-N 497.301 5.097 5 20 JKBD CCOc1ccc(C(=O)Nc2nc(Cc3ccc(Br)cc3)cs2)cc1[N+](=O)[O-] 917711824 IAMTYTWTKBEBJA-UHFFFAOYSA-N 462.325 5.056 5 20 JKBD C[C@H](Nc1ccc(N(C)Cc2ccccc2)cc1)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 917940825 OWAFZPYDIDSWQY-INIZCTEOSA-N 472.467 5.689 5 20 JKBD COc1cc([C@@H](C)NC(=O)c2cc([N+](=O)[O-])ccc2N2CCCC2)ccc1OC1CCCC1 918586956 UITXOUDLFTXKRU-QGZVFWFLSA-N 453.539 5.016 5 20 JKBD Cc1ccc2[nH]cc(CC(=O)NC3(c4ccc(NC(=O)/C=C/c5ccc([N+](=O)[O-])o5)cc4)CCC3)c2c1 1786205575 HTDJVGZSAZFYSO-DHZHZOJOSA-N 498.539 5.368 5 20 JKBD O=C(CCc1ccc[nH]1)Nc1ccc(C2(NC(=O)c3cc4cc([N+](=O)[O-])ccc4s3)CCC2)cc1 1788191803 LSSWDPPMCNUVFH-UHFFFAOYSA-N 488.569 5.518 5 20 JKBD O=C(Cc1cc(F)ccc1[N+](=O)[O-])NC1(c2ccc(NC(=O)c3ccc4cnccc4c3)cc2)CCC1 1789014544 BSDPIUBXFORWFI-UHFFFAOYSA-N 498.514 5.273 5 20 JKBD C/C(=C\c1ccc(C)o1)C(=O)NC1(c2ccc(NC(=O)c3cc(F)cc([N+](=O)[O-])c3)cc2)CCC1 1790697910 YQJWHYYNBXMWDH-FOWTUZBSSA-N 477.492 5.487 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)c3sccc3Cl)CCC2)cc1)c1cc(O)cc([N+](=O)[O-])c1 1790756395 DDEGLWAAUSLTDI-UHFFFAOYSA-N 471.922 5.077 5 20 JKBD CC(C)(C)c1ccc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cc4cc([N+](=O)[O-])ccc4s2)C3)cn1 1792442112 HEZYXJDBTGRZAQ-REPLKXPHSA-N 492.601 5.068 5 20 JKBD Cc1nc2cccc(C(=O)N[C@@H]3C[C@@H]4CC[C@H](C3)N4C(=O)c3cc(Cl)cc([N+](=O)[O-])c3C)c2s1 1800711185 APZUNRYFILYLJG-BJWYYQGGSA-N 498.992 5.040 5 20 JKBD O=C(Nc1cc([C@H]2CCCCN2C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)[nH]n1)c1ccc(F)s1 1816029562 SSCWIVQCPGTZMW-OAHLLOKOSA-N 499.549 5.353 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cccc(Cl)c2)CC1 1830734138 ZCFBIFYSQYNYEJ-QFIPXVFZSA-N 487.959 5.243 5 20 JKBD C[C@H](C(=O)N1CCC([C@H]2CCCCN2C(=O)/C=C/c2ccccc2[N+](=O)[O-])CC1)c1cccs1 1832903418 BWBSFMRDSALGIS-KSAVBPPNSA-N 481.618 5.093 5 20 JKBD O=C(COc1ccccc1Cl)O[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1 10361815 MXQPLVDSAISXIH-NRFANRHFSA-N 475.284 5.204 5 20 JKBD C[C@H](OC(=O)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1)c1nnc(-c2cccs2)o1 17741266 WHNPUILGLZRPKT-LBPRGKRZSA-N 496.467 5.246 5 20 JKBD CCn1c(SCC(=O)Nc2ccccc2Br)nc2cc3ccccc3cc2c1=O 22177935 KKVOJNIUXGGYQY-UHFFFAOYSA-N 468.376 5.063 5 20 JKBD O=C(c1cc2cc([N+](=O)[O-])ccc2s1)N1CCN(Cc2csc(-c3ccc(F)cc3)n2)CC1 24920802 XEQRANQVPKXLMU-UHFFFAOYSA-N 482.562 5.030 5 20 JKBD Cc1nc(-c2ccc(C(F)(F)F)cc2)sc1C(=O)O[C@H](C)C(=O)Nc1ccccc1[N+](=O)[O-] 25664267 QIUMJHGXEFITDD-GFCCVEGCSA-N 479.436 5.230 5 20 JKBD COc1ccc(CN[C@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2ccccc2)cc1OC(F)F 30495985 HZFVXXJPNVWHOJ-NRFANRHFSA-N 491.878 5.328 5 20 JKBD CCOc1cccc2cc([C@H](C)NC(=O)c3ccc(N[C@@H](C)c4ccccn4)c([N+](=O)[O-])c3)oc12 108789318 NXFSUBUIBKJBMD-IRXDYDNUSA-N 474.517 5.799 5 20 JKBD CC(=O)Nc1ccc(NC(=O)C2CCN(c3ccc(C(F)(F)F)cc3[N+](=O)[O-])CC2)c(Cl)c1 110594888 DDQOLWLFDSSNMH-UHFFFAOYSA-N 484.862 5.081 5 20 JKBD CCCn1c(SCc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)nnc1-c1ccc(Cl)cc1 409810702 IOGMRSWVNFEXIS-UHFFFAOYSA-N 456.915 5.259 5 20 JKBD O=C(Nc1ccc(F)c(NC(=O)C2CCCCC2)c1)c1csc(-c2ccc([N+](=O)[O-])cc2)n1 496244749 LASKWMHVIUGZHV-UHFFFAOYSA-N 468.510 5.629 5 20 JKBD CN(CC(=O)Nc1ccccc1)C(=O)c1cc([N+](=O)[O-])ccc1Sc1ccc(Cl)cc1 499660736 ZLHNQGBIRYVEJF-UHFFFAOYSA-N 455.923 5.110 5 20 JKBD COCCN(C(=O)c1cc(C(C)C)nc2ccccc12)c1nc(-c2ccc([N+](=O)[O-])cc2)cs1 500283020 XHDMZDDUBIKZPA-UHFFFAOYSA-N 476.558 5.683 5 20 JKBD CCSc1ccc([C@H](C)NC(=O)c2ccc(N[C@H](C)c3ccccn3)c([N+](=O)[O-])c2)cc1 504711584 JZWKBJZPCAAQFV-DLBZAZTESA-N 450.564 5.766 5 20 JKBD CCCCSc1ccc([N+](=O)[O-])cc1C(=O)Nc1nc(-c2ccc3c(c2)CCC(=O)N3)cs1 507754270 IQSVRVWMJWODNW-UHFFFAOYSA-N 482.587 5.748 5 20 JKBD CCOc1cc([N+](=O)[O-])c(C(=O)Nc2ccc(NC(=O)c3ccc(Cl)cc3)cc2)cc1OC 509833334 RHWLAJNONMCKAH-UHFFFAOYSA-N 469.881 5.160 5 20 JKBD COc1ccc([N+](=O)[O-])cc1NC(=O)[C@H](C)Nc1ccc(Oc2ccc(C)cc2OC)c(F)c1 512544268 LOBLGRIUPBKXTJ-HNNXBMFYSA-N 469.469 5.291 5 20 JKBD C[C@H]1CCCCN1Cc1ccc(NC(=O)c2ccc(N[C@H](C)c3ccccn3)c([N+](=O)[O-])c2)cc1 518439356 NKBSKVKSUGVTAN-VQTJNVASSA-N 473.577 5.790 5 20 JKBD COc1cc(CNCc2nc3cc(Cl)ccc3s2)c([N+](=O)[O-])cc1OCC(F)(F)F 520961374 NVWFYLICCPNHCS-UHFFFAOYSA-N 461.849 5.097 5 20 JKBD CC(C)CCSc1ccc(C(=O)N2CCC(NC(=O)C3CCCCC3)CC2)cc1[N+](=O)[O-] 521549189 KNWJJSIREWBKRO-UHFFFAOYSA-N 461.628 5.034 5 20 JKBD O=C(Nc1ccc(F)cc1)C1CCN(C(=O)c2cc([N+](=O)[O-])ccc2Sc2ccccc2)CC1 523568490 WXENRHAWXXCDMW-UHFFFAOYSA-N 479.533 5.376 5 20 JKBD O=C(Nc1cc([N+](=O)[O-])ccc1OC(F)F)c1cccc(NC(=O)c2ccc(Br)o2)c1 603755613 PDSVIVLYBRSXBT-UHFFFAOYSA-N 496.220 5.056 5 20 JKBD CN(C(=O)CSc1nc2cc([N+](=O)[O-])ccc2n1-c1cccc(C(F)(F)F)c1)c1nccs1 603904191 OUYYQFCCXRHMOX-UHFFFAOYSA-N 493.492 5.164 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Cl)[C@@H](NCC1CCN(Cc2ccccc2)CC1)c1ccccc1 604435232 DELHJKHBKUPCAN-SANMLTNESA-N 493.007 5.430 5 20 JKBD C[C@@H](OC(=O)c1cc(F)c(F)cc1[N+](=O)[O-])C(=O)Nc1c(Cl)cc(Cl)cc1Cl 725936634 DWCOSXIZVDBQSM-ZCFIWIBFSA-N 453.612 5.017 5 20 JKBD COc1cc(C(=O)OCC(=O)N2c3ccccc3Sc3ccc(Cl)cc32)ccc1[N+](=O)[O-] 725946507 TUDUTONXMUBFNS-UHFFFAOYSA-N 470.890 5.243 5 20 JKBD CCc1cc[n+](/C(C(=S)Nc2c(Cl)ccc(C)c2Cl)=C(/O)c2ccc([N+](=O)[O-])cc2)cc1 728559027 VNUYWEMZMBEKHI-UHFFFAOYSA-O 489.404 6.383 5 20 JKBD O=C(COC(=O)[C@H]1C[C@H]1c1ccc(Cl)cc1Cl)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 730610392 BWEQLFSPNKVHNU-STQMWFEESA-N 477.222 5.206 5 20 JKBD Cc1c([N+](=O)[O-])cc(C(=O)Nc2ccc3c(c2)CCC(=O)N3Cc2ccc(Cl)cc2)cc1[N+](=O)[O-] 743714750 RBYZEKBLWGBONJ-UHFFFAOYSA-N 494.891 5.197 5 20 JKBD CC(=O)c1cccc(O[C@H](C)C(=O)O[C@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2ccccc2)c1 745231458 YFDQUYJYPFUTAB-MWTRTKDXSA-N 496.903 5.141 5 20 JKBD C[C@H](Nc1ccc(C(=O)Oc2cccc(C(=O)Nc3ccccc3)c2)cc1[N+](=O)[O-])c1ccccn1 746785751 JSRXJIAJUNIPCU-SFHVURJKSA-N 482.496 5.634 5 20 JKBD O=C(Nc1ccnn1Cc1c(Cl)cccc1Cl)c1cc([N+](=O)[O-])ccc1Br 751068533 MCWLLBPSRWGGGO-UHFFFAOYSA-N 470.110 5.161 5 20 JKBD CC(C)c1ccc(-c2ncc(COC(=O)CCCn3c(=O)oc4cc([N+](=O)[O-])ccc43)s2)cc1 804907643 CPFHJEZLHQRAMP-UHFFFAOYSA-N 481.530 5.273 5 20 JKBD CC(C)N(C)Cc1cc(O[C@@H]2CCN(c3cc(Cl)c(C(F)(F)F)cc3[N+](=O)[O-])C2)ccn1 856535782 HGKRLVZGZYDXDP-MRXNPFEDSA-N 472.895 5.160 5 20 JKBD Cc1ccc(Sc2ccc(C(=O)Nc3nc(C)c(-c4nnc(S)n4C)s3)cc2[N+](=O)[O-])cc1 911596567 YZJHGHGSFRTAKW-UHFFFAOYSA-N 498.615 5.156 5 20 JKBD Cc1ccc(NC(=O)[C@@H](OC(=O)c2sc(C(C)C)nc2C)c2ccccc2)c([N+](=O)[O-])c1 915505943 UICYXHFRZBOYLP-IBGZPJMESA-N 453.520 5.328 5 20 JKBD CC(C)N(Cc1ccc([N+](=O)[O-])cc1)Cn1nc(-c2ccc(F)cc2)n(C[C@@H]2CCCO2)c1=S 919950911 XFXNWZPTONXZDK-QFIPXVFZSA-N 485.585 5.175 5 20 JKBD O=C(CSc1nnc(-c2ccc(Cl)cc2)o1)Oc1ccc(-c2ccccc2)cc1[N+](=O)[O-] 920329685 NRLHLFHPVZJNMQ-UHFFFAOYSA-N 467.890 5.663 5 20 JKBD Cc1occc1C(=O)Nc1ccc(C2(NC(=O)c3cc4cc([N+](=O)[O-])ccc4s3)CCC2)cc1 1787367436 SMCSHSGIMOGYLC-UHFFFAOYSA-N 475.526 5.772 5 20 JKBD Cc1ncsc1C(=O)Nc1ccc(C2(NC(=O)C3(c4cccc([N+](=O)[O-])c4)CCC3)CCC2)cc1 1787423219 YMYQAABRQVIMAN-UHFFFAOYSA-N 490.585 5.229 5 20 JKBD Cc1c(C(=O)Nc2ccc(C3(NC(=O)CC4CCN(C)CC4)CCC3)cc2)cc(Cl)cc1[N+](=O)[O-] 1790774135 WOGFAYMSUVXZBF-UHFFFAOYSA-N 499.011 5.036 5 20 JKBD Cc1c(C(=O)N2CC[C@H](CNC(=O)/C=C/C3CCCC3)[C@H]2c2cccnc2)cc(Cl)cc1[N+](=O)[O-] 1808492206 CHBBAIMXAHYZBT-JBGVHOKCSA-N 496.995 5.018 5 20 JKBD Cc1cccc(C)c1C(=O)N1CCCC[C@@H]1c1cc(NC(=O)CSc2ccccc2[N+](=O)[O-])n[nH]1 1822312648 CXRFYDDZUFGTNY-LJQANCHMSA-N 493.589 5.033 5 20 JKBD C[C@@H](C(=O)N1CCCC[C@H]1C1CCN(C(=O)Cc2cccc([N+](=O)[O-])c2)CC1)c1ccc(Cl)cc1 1823972387 YVDZIVSNGQKORI-CLOONOSVSA-N 498.023 5.214 5 20 JKBD C[C@@H]1C[C@@]1(C)C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)CC1 1830223037 CTTZHKGPIFVKJW-UHUZZHMISA-N 469.607 5.089 5 20 JKBD O=C(c1cccc(F)c1Cl)N1CCC([C@@H]2CCCCN2C(=O)/C=C/c2ccccc2[N+](=O)[O-])CC1 1832903920 IOGVWZXWQCBEJM-LEQVUBRHSA-N 499.970 5.334 5 20 JKBD C[C@@H](OC(=O)CCSc1ccccc1Cl)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 10404766 WZMOMMWOHJAJJB-LLVKDONJSA-N 476.860 5.320 5 20 JKBD CC(=O)Nc1c(C)cccc1C(=O)O[C@@H](C(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1)c1ccccc1 11811520 IRJFDZAUANHKLY-JOCHJYFZSA-N 481.892 5.052 5 20 JKBD O=C(Nc1nc(-c2ccc(I)cc2)cs1)c1ccc([N+](=O)[O-])cc1Cl 12002274 LKXIEQHSYHERNR-UHFFFAOYSA-N 485.690 5.229 5 20 JKBD CSc1ccc([N+](=O)[O-])c(C(=O)OCc2csc(N(C(C)=O)c3cccc(C)c3C)n2)c1 16196865 VJJGUCXRWHIIPM-UHFFFAOYSA-N 471.560 5.432 5 20 JKBD C[C@@H](c1cccc(NC(=O)c2ccccc2)c1)N(C)C(=O)COc1ccc([N+](=O)[O-])cc1Cl 22556101 WNVAVGZOWBHNFX-INIZCTEOSA-N 467.909 5.099 5 20 JKBD O=C(CSc1nc2scc(-c3ccc(F)cc3)c2c(=O)[nH]1)Nc1ccc(Cl)c([N+](=O)[O-])c1 26701692 PCFSUFGOIPIHSQ-UHFFFAOYSA-N 490.925 5.083 5 20 JKBD Cc1c(Cl)cccc1Nc1nnc(SCc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)s1 27817128 UHKDOAZHHDOYOI-UHFFFAOYSA-N 460.928 5.494 5 20 JKBD COc1ccccc1Oc1ccc(N[C@@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)cc1F 72030938 SQWYOFVHNQSBLI-ZDUSSCGKSA-N 459.861 5.627 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1C(=O)c1ccccc1)c1cccc(OCc2cccnc2)c1 195621476 KWGGWHUUVCQFJJ-UHFFFAOYSA-N 453.454 5.052 5 20 JKBD COc1cc2c(cc1OC)[C@@H](c1cccs1)N(C(=O)c1cc([N+](=O)[O-])ccc1Cl)CC2 301148595 UBDROQLIIOAXER-NRFANRHFSA-N 458.923 5.115 5 20 JKBD COc1cc(C)ccc1Oc1ccc(F)cc1NCc1nc(-c2ccc([N+](=O)[O-])cc2)no1 302940638 ABFKMVCDJVWLJP-UHFFFAOYSA-N 450.426 5.505 5 20 JKBD O=C(CCCn1c(=O)oc2cc([N+](=O)[O-])ccc21)Nc1ccc(F)cc1-c1ccc(Cl)cc1 485724906 SWJXMICRMAKTOY-UHFFFAOYSA-N 469.856 5.381 5 20 JKBD COc1ccc([C@H]2Nc3ccccc3C(=O)N2Cc2cccnc2)cc1OCc1ccc([N+](=O)[O-])cc1 489304402 HSNXMCROLVCAAG-MHZLTWQESA-N 496.523 5.344 5 20 JKBD CCCN(CC(=O)Nc1cc(Cl)ccc1Cl)C(=O)c1csc(-c2cccc([N+](=O)[O-])c2)n1 496358502 JUBAIBMSPJPIET-UHFFFAOYSA-N 493.372 5.516 5 20 JKBD COc1ccc([C@@H]2CCN(C(=O)c3ccc(Sc4nc(C)cs4)c([N+](=O)[O-])c3)C2)cc1 504946870 BXNYKDNKYBPXEM-QGZVFWFLSA-N 455.561 5.149 5 20 JKBD CC(C)N(CC(=O)Nc1ccccc1C(F)(F)F)C(=O)c1csc(-c2cccc([N+](=O)[O-])c2)n1 505242903 QTOAGQYOMNSTGO-UHFFFAOYSA-N 492.479 5.226 5 20 JKBD O=C(Nc1cccc(NC(=O)c2ccc(Cl)cc2[N+](=O)[O-])c1)c1cccc(C(F)(F)F)c1 505733950 PGDQXTCFKHJWQS-UHFFFAOYSA-N 463.799 5.772 5 20 JKBD COc1cc(CN[C@@H]2CCSc3c(F)cccc32)c([N+](=O)[O-])cc1OCc1ccccc1 509611116 ZFLBBYNHPVVUDE-HXUWFJFHSA-N 454.523 5.648 5 20 JKBD CCOc1cc(C(=O)Nc2ccc(Oc3ccccc3OC)c(F)c2)c([N+](=O)[O-])cc1OC 510229850 QQPIZIZLQAOCSF-UHFFFAOYSA-N 456.426 5.194 5 20 JKBD Cc1nc(-c2cccc(NC(=O)N[C@@H](CC(=O)OC(C)C)c3ccccc3[N+](=O)[O-])c2)oc1C 510655642 BMFKUZKSVSZKIU-FQEVSTJZSA-N 466.494 5.071 5 20 JKBD COc1cc(C(=O)Nc2ccc(Oc3ccc(C)cc3)cc2)c([N+](=O)[O-])cc1OCc1cscn1 511631711 VZPZRQVPHCVFTC-UHFFFAOYSA-N 491.525 5.992 5 20 JKBD COc1cc(C(=O)Nc2nc(-c3ccc(OC(F)F)cc3OC(F)F)cs2)ccc1[N+](=O)[O-] 512619985 RNICYDYJFRGDNA-UHFFFAOYSA-N 487.387 5.182 5 20 JKBD Cc1ccc(Sc2ccc(CNC3CCC(C(=O)N4CCSCC4)CC3)cc2[N+](=O)[O-])cc1 518278962 NLPVZYWCENLCEA-UHFFFAOYSA-N 485.675 5.278 5 20 JKBD CN(Cc1ccccc1F)C(=O)C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1 518299630 UKKVWVVSFATLKZ-RGEXLXHISA-N 461.518 5.933 5 20 JKBD COc1cc(OCC(=O)Nc2nc(-c3cc(Cl)sc3Cl)cs2)ccc1[N+](=O)[O-] 519016630 JOLWKMJCLBNYPG-UHFFFAOYSA-N 460.320 5.113 5 20 JKBD COc1cc(C(=O)Nc2ccc(-c3cc(O)n[nH]3)cc2)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 603879456 YREMXLMYNHZTMB-UHFFFAOYSA-N 480.864 5.397 5 20 JKBD CC[C@@H](C)Sc1ccc(NC(=O)[C@@H]2CCCN2C(=O)c2ccc([N+](=O)[O-])c(C)c2)c(C)c1 608806142 OBHOPPGUGOQCRS-VGSWGCGISA-N 455.580 5.346 5 20 JKBD C[C@@H](Nc1ccc(C(=O)Nc2cc(F)ccc2N2CCCCC2)cc1[N+](=O)[O-])c1ccccn1 608874412 NZZVZCGJFOSWIC-QGZVFWFLSA-N 463.513 5.545 5 20 JKBD C[C@H](Nc1ccc(C(=O)N[C@H](CN2CCCCC2)c2ccccc2)cc1[N+](=O)[O-])c1ccccn1 609018438 ZMWKDIAUTINCMD-NBGIEHNGSA-N 473.577 5.120 5 20 JKBD CCCOc1cc(NC(=O)N2CCC[C@@H]2c2ccccc2OC)c([N+](=O)[O-])cc1OCCC 609046552 FLKSGBAOKNTRMY-LJQANCHMSA-N 457.527 5.550 5 20 JKBD O=C(Nc1ccc(Oc2cccc(F)c2)c2ccncc12)c1cc2c(cc1[N+](=O)[O-])OCCO2 609105574 NSCTVAGVSKWWIQ-UHFFFAOYSA-N 461.405 5.098 5 20 JKBD Cc1ccc([N+](=O)[O-])cc1NC(=O)[C@H](C)SCc1nc(O)c2c(-c3ccccc3)csc2n1 610842030 BDHZLJVLEPGILG-AWEZNQCLSA-N 480.571 5.541 5 20 JKBD COc1ccc(C(NCc2ccc(Br)c([N+](=O)[O-])c2)c2ccc(OC)cc2)cc1 725848309 PDYYXURHQXFIKJ-UHFFFAOYSA-N 457.324 5.254 5 20 JKBD COc1cc(COC(=O)c2csc(-c3ccccc3Cl)n2)c([N+](=O)[O-])cc1OC(F)F 727562909 AWOIKZDFPJQSAJ-UHFFFAOYSA-N 470.837 5.339 5 20 JKBD Cc1nn(Cc2ccc(Cl)cc2)c2sc(C(=O)Nc3cc([N+](=O)[O-])c(F)cc3F)cc12 825487369 BPRQIIVZVOMNSI-UHFFFAOYSA-N 462.865 5.547 5 20 JKBD Cc1cc(C)c(NC(=O)[C@H](C)OC(=O)c2ccc(Sc3nc(C)cs3)c([N+](=O)[O-])c2)c(C)c1 849119968 GDCFEIPWZGSYNZ-INIZCTEOSA-N 485.587 5.620 5 20 JKBD CC(C)N(Cc1nnc(-c2cccc([N+](=O)[O-])c2)o1)C(=O)c1ccc(-c2ccc(Cl)cc2)s1 864244570 COHLMSKWQUBGCK-UHFFFAOYSA-N 482.949 6.078 5 20 JKBD C[C@H](OC(=O)[C@H]1CCCN(C(=O)c2ccc(Cl)c(Cl)c2)C1)c1cccc([N+](=O)[O-])c1 915020429 RJOCIRFQOLIYRO-BBRMVZONSA-N 451.306 5.058 5 20 JKBD O=C(Nc1ccc(Cl)c([N+](=O)[O-])c1)C(=O)N[C@@H](c1ccc2c(c1)CCCC2)c1cccs1 915754436 FWXGKRNRTRDVAX-NRFANRHFSA-N 469.950 5.033 5 20 JKBD C[C@H](Nc1ccc(C(=O)OCC(=O)N(C)[C@H](C)c2ccc(Cl)cc2)cc1[N+](=O)[O-])c1ccccn1 920544224 JUBABFMPHCCPMM-DLBZAZTESA-N 496.951 5.193 5 20 JKBD C[C@H](OC(=O)CCCOc1cccc(Cl)c1Cl)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 921225257 QNELXAOTIQQKOD-LBPRGKRZSA-N 466.277 5.415 5 20 JKBD CC1=CC[C@@H](C(=O)NC2(c3ccc(NC(=O)Cn4ccc5ccc([N+](=O)[O-])cc54)cc3)CCC2)CC1 1786277782 UFTXWIGVPVRQJS-OAQYLSRUSA-N 486.572 5.430 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)c3cc4cc([N+](=O)[O-])ccc4s3)CCC2)cc1)c1ccccn1 1787297286 XYDFQBSHAOEWGP-UHFFFAOYSA-N 472.526 5.266 5 20 JKBD Cc1c(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2ccc(Cl)c(Cl)c2)cc(Cl)cc1[N+](=O)[O-] 1799624817 FIETXHYZNZEVCW-MUJYYYPQSA-N 496.778 5.429 5 20 JKBD O=C(NC[C@@H]1CCN(C(=O)CCC2CCC2)[C@H]1c1cccnc1)c1cc2cc([N+](=O)[O-])ccc2s1 1812304929 XIZGORJOABCZFK-DFBJGRDBSA-N 492.601 5.104 5 20 JKBD C[C@H](C(=O)N1CCCC[C@H]1c1cc(NC(=O)Cc2cccc([N+](=O)[O-])c2)n[nH]1)c1ccc(Cl)cc1 1814372769 CVBZVRDRWPZIMR-AOMKIAJQSA-N 495.967 5.010 5 20 JKBD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2ccc([N+](=O)[O-])cc2F)[nH]n1)c1cccc2ccccc12 1818454005 GUBUEYZDOJAZNR-QHCPKHFHSA-N 487.491 5.230 5 20 JKBD O=C(c1cc2cc([N+](=O)[O-])ccc2s1)N1CCC([C@@H]2CCCCN2C(=O)Cc2cccs2)CC1 1827160170 MSVZNBVHEGUDFZ-NRFANRHFSA-N 497.642 5.347 5 20 JKBD O=C(c1ccc(O)c([N+](=O)[O-])c1)N1CCC([C@H]2CCCCN2C(=O)c2cc3sccc3s2)CC1 1828553995 QYUJQCCVQBBRED-QGZVFWFLSA-N 499.614 5.124 5 20 JKBD C[C@H](C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)CC1)n1cccc1 1832112700 AFZCHYXALQBWAF-GCJKJVERSA-N 494.617 5.106 5 20 JKBD Cc1cc(Cl)cc(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3cccc(F)c3[N+](=O)[O-])CC2)c1 1832610482 OTWIEAYXWUNXJR-JOCHJYFZSA-N 487.959 5.243 5 20 JKBD COc1cc(C(=O)Nc2ncc(Cc3cc(Cl)ccc3Cl)s2)c([N+](=O)[O-])cc1OC 11520432 XKCGWFVSYHDGDI-UHFFFAOYSA-N 468.318 5.218 5 20 JKBD COc1cc(C(=O)NCCc2cnn(-c3ccccc3)c2)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 11531528 WQAVMMFYSMTFKJ-UHFFFAOYSA-N 492.919 5.207 5 20 JKBD CN(Cc1cnn(C)c1)C(=O)c1c2c(nc3ccccc13)/C(=C/c1cccc([N+](=O)[O-])c1)CCC2 24479604 VAJQCMIEAACDDP-DEDYPNTBSA-N 467.529 5.026 5 20 JKBD COc1ccc(NC(=O)c2ccc(C(C)(C)C)c([N+](=O)[O-])c2)cc1NC(=O)c1cccc(F)c1 482492322 IGMPMWITJMAVRS-UHFFFAOYSA-N 465.481 5.545 5 20 JKBD C[C@@H](Nc1ccc(C(=O)NCc2cccc(CN3CCCCCC3)c2)cc1[N+](=O)[O-])c1ccccn1 489653132 YCSALKZKGPFWHS-OAQYLSRUSA-N 487.604 5.469 5 20 JKBD O=C(Nc1ccccc1OC[C@H]1CCCCO1)c1ccc(NCc2ccccc2)c([N+](=O)[O-])c1 510019844 PDLSFLJQOOLCSU-OAQYLSRUSA-N 461.518 5.407 5 20 JKBD CCCN(Cc1nnc(-c2ccccc2Cl)o1)C(=O)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-] 515156298 ZKSRTOBKZIQQOZ-UHFFFAOYSA-N 498.845 5.292 5 20 JKBD COCCN(C(=O)[C@H](C)Sc1ccc(C)cc1)c1nc(-c2ccc([N+](=O)[O-])cc2)cs1 517303159 KEYCNDXYXPCRSN-INIZCTEOSA-N 457.577 5.187 5 20 JKBD O=[N+]([O-])c1ccc(-c2ccc(CNCc3nc4cc(Cl)ccc4s3)o2)c(Br)c1 521830542 HJKONHLRFPYCRR-UHFFFAOYSA-N 478.755 6.170 5 20 JKBD O=C(Nc1cc(C(=O)N(Cc2ccccc2[N+](=O)[O-])CC(F)(F)F)ccc1Cl)c1cccs1 524472924 QUCBQSSHDDUODL-UHFFFAOYSA-N 497.882 5.767 5 20 JKBD C[C@@H](Nc1ccc(C(=O)N2CCOCC2)cc1[N+](=O)[O-])c1ccc(Oc2ccccc2)c(F)c1 603871467 ACXHSUNVKIITFG-QGZVFWFLSA-N 465.481 5.172 5 20 JKBD CC(C)OC(=O)C[C@H](NC(=O)Nc1ccc(Cl)c2ncccc12)c1ccccc1[N+](=O)[O-] 604125572 ZLQRRGNECFDASF-SFHVURJKSA-N 456.886 5.001 5 20 JKBD O=C(Nc1ccc2oc3ccccc3c2c1)c1ccc([N+](=O)[O-])cc1I 604565991 ZTLKQXINRXHXSE-UHFFFAOYSA-N 458.211 5.351 5 20 JKBD O=[N+]([O-])c1ccc(-c2nn(-c3ccccc3)cc2CN[C@@H](c2ccccc2)c2ccccn2)cc1 608841061 JKBYLQLTMHCHHS-NDEPHWFRSA-N 461.525 5.722 5 20 JKBD COc1ccc(NC(=O)c2ccc(N3C[C@@H](C)C[C@@H](C)C3)c([N+](=O)[O-])c2)c(Br)c1 608901026 QXEPZWPTJJMBGH-OKILXGFUSA-N 462.344 5.101 5 20 JKBD C[C@@H](c1cccs1)N(Cc1ccccc1)C(=O)Cn1c2ccccc2c(=O)c2ccccc21 642073105 IDHMYFITYKOVNG-FQEVSTJZSA-N 452.579 6.006 5 20 JKBD C[C@H](C(=O)O[C@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F)c1c(Cl)cccc1Cl 726029446 QHIQNGOKCVAAOQ-VHSXEESVSA-N 479.238 5.594 5 20 JKBD O=C(CCc1nc(-c2cccs2)no1)Nc1cc(Cl)c([N+](=O)[O-])cc1OCc1ccccc1 727963413 RIJJFEMVIIODOA-UHFFFAOYSA-N 484.921 5.510 5 20 JKBD O=C(O[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1)[C@@H]1CCOc2ccccc21 728355778 DXSWNEXOTQUKAC-XMSQKQJNSA-N 466.877 5.038 5 20 JKBD Cc1nc(CSc2ccc(C(=O)OC[C@@H]3CCCN3C(=O)c3ccccc3[N+](=O)[O-])cc2)cs1 730708102 MVKPFIXFVYNFSO-IBGZPJMESA-N 497.598 5.114 5 20 JKBD CCN(C(C)=O)c1nc(COC(=O)c2cc([N+](=O)[O-])ccc2Sc2ccc(Cl)cc2)cs1 780413498 RZUNLKNDLKJYFE-UHFFFAOYSA-N 491.978 5.586 5 20 JKBD CC(=O)N(c1nc(COC(=O)CSc2ccccc2[N+](=O)[O-])cs1)c1cccc(C)c1C 819010988 JTNUJWVZMHKJJS-UHFFFAOYSA-N 471.560 5.188 5 20 JKBD O=[N+]([O-])c1ccc(-c2nc(-c3ccc(Oc4ccccc4)nc3)no2)c(I)c1 904454811 SBTAQTVEXMVNBN-UHFFFAOYSA-N 486.225 5.104 5 20 JKBD CC(=O)Nc1ccc(N[C@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Br)c2ccccc2)cc1C 913095727 XVTRDEOYKCTZEX-QFIPXVFZSA-N 497.349 5.416 5 20 JKBD O=C(NC1(c2ccc(NC(=O)c3ccc([N+](=O)[O-])o3)cc2)CCC1)c1c[nH]c(-c2ccc(F)cc2)c1 1785748548 TVGQKWYLKGTQBF-UHFFFAOYSA-N 488.475 5.384 5 20 JKBD C[C@H](Cc1ccco1)C(=O)NC1(c2ccc(NC(=O)CCc3cccc([N+](=O)[O-])c3)cc2)CCC1 1786601421 MKFXMOHHMROPNS-LJQANCHMSA-N 475.545 5.133 5 20 JKBD Cc1ccoc1C(=O)Nc1ccc(C2(NC(=O)c3c(F)ccc([N+](=O)[O-])c3C)CCC2)cc1 1788692913 GEHXBKHQBJTIIJ-UHFFFAOYSA-N 451.454 5.005 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)c3cc4sccn4c3)CCC2)cc1)c1cc(F)cc([N+](=O)[O-])c1 1790696626 PGYFJMCOPOBPHN-UHFFFAOYSA-N 478.505 5.110 5 20 JKBD CC[C@@H](C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cc(Cl)cc([N+](=O)[O-])c1C)C2)c1ccccc1 1795457876 NBIBHEORLGQRNX-PLACYPQZSA-N 469.969 5.002 5 20 JKBD O=C(Nc1cc([C@H]2CCCCN2C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)[nH]n1)c1ccccc1F 1820412206 QIEQGRZYZSHCPI-LJQANCHMSA-N 493.520 5.291 5 20 JKBD CC1(C)CC(C(=O)N2CCCC[C@H]2c2cc(NC(=O)c3cc4cc([N+](=O)[O-])ccc4s3)n[nH]2)C1 1821611681 WARFZBVRHBIMQD-SFHVURJKSA-N 481.578 5.275 5 20 JKBD Cc1ccc(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)Cc3cccc([N+](=O)[O-])c3)CC2)cc1Cl 1823906554 YYRINCBLCXQIGO-XMMPIXPASA-N 483.996 5.033 5 20 JKBD O=C(c1ccc(C2CC2)cc1)N1CCC([C@@H]2CCCCN2C(=O)/C=C/c2ccc([N+](=O)[O-])o2)CC1 1824276317 QHHDIJMITYDHHA-YKATVRGKSA-N 477.561 5.012 5 20 JKBD CC(C)(C)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)CC1 1826405489 AHYSRKNZVAJJFN-LJQANCHMSA-N 457.596 5.089 5 20 JKBD O=C(c1cc(F)cc([N+](=O)[O-])c1)N1CCC([C@H]2CCCCN2C(=O)/C=C/C2CCCCC2)CC1 1830355663 KVYJFJONBODRHQ-HBRDYDSTSA-N 471.573 5.104 5 20 JKBD O=C(NCCNc1ccc(C(F)(F)F)cc1[N+](=O)[O-])N(Cc1ccco1)Cc1cccs1 9878724 LREYDBPKCHPYOP-UHFFFAOYSA-N 468.457 5.092 5 20 JKBD O=C(CNc1cc([N+](=O)[O-])ccc1Nc1cccc(C(F)(F)F)c1)Nc1c(F)cccc1F 11725301 WRKZFNCLJYGLLF-UHFFFAOYSA-N 466.366 5.686 5 20 JKBD COc1cc(C(=O)Nc2cc(OC)c(OC)c(OC)c2)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 16643052 VIZJAXRBSZXFHQ-UHFFFAOYSA-N 488.880 5.327 5 20 JKBD COc1ccccc1NC(=O)[C@H](C)OC(=O)c1ccc(NCc2ccccc2Cl)c([N+](=O)[O-])c1 21452003 RQNFFCYBZRZMLZ-HNNXBMFYSA-N 483.908 5.053 5 20 JKBD COc1ccccc1-c1nnc(SCC(=O)Nc2ccc(F)c([N+](=O)[O-])c2)n1-c1ccc(C)cc1 21673739 BJOLLYCXLGFAOT-UHFFFAOYSA-N 493.520 5.029 5 20 JKBD O=C(CCCn1c(=O)oc2cc([N+](=O)[O-])ccc21)N[C@@H](Cc1ccc(Cl)cc1)c1ccccc1 68740246 YXUZLEMDKDRSOW-NRFANRHFSA-N 479.920 5.037 5 20 JKBD Cc1ccc(Sc2ccc(C(=O)Nc3cccc(C(=O)N4CCCC4)c3C)cc2[N+](=O)[O-])cc1 499557648 LHZGASIMOAEAIZ-UHFFFAOYSA-N 475.570 5.851 5 20 JKBD O=C(Nc1cccc(NC(=O)c2ccc(NCc3ccccc3)c([N+](=O)[O-])c2)c1)c1ccoc1 499878973 ZLHNHDSAWIOYTI-UHFFFAOYSA-N 456.458 5.305 5 20 JKBD COCCN(C(=O)[C@H]1C[C@@H]1c1cccc2ccccc12)c1nc(-c2ccc([N+](=O)[O-])cc2)cs1 503087461 RWNBQZNKSJLJLJ-PKTZIBPZSA-N 473.554 5.655 5 20 JKBD C[C@H](Nc1ccc(C(=O)N2CCC[C@H]2c2nc3ccccc3n2C)cc1[N+](=O)[O-])c1ccccn1 503153291 DKKFYQVBIOZKOT-SBUREZEXSA-N 470.533 5.027 5 20 JKBD C[C@H](Nc1ccc(C(=O)N2CC=C(c3c[nH]c4cc(F)ccc34)CC2)cc1[N+](=O)[O-])c1ccccn1 507374750 ZHBSYPRVUWCXCL-KRWDZBQOSA-N 485.519 5.713 5 20 JKBD C[C@@H](Nc1cccc(NC(=O)c2cccc(C(F)(F)F)c2)c1)C(=O)Nc1ccccc1[N+](=O)[O-] 507538987 SJHPOGDXGSNRDS-CQSZACIVSA-N 472.423 5.305 5 20 JKBD Cc1cccc(-c2nc(C(C)C)no2)c1NC(=O)c1ccc(N2C[C@H](C)C[C@@H](C)C2)c([N+](=O)[O-])c1 508754769 AHRDHGDCXUMIAJ-IAGOWNOFSA-N 477.565 5.811 5 20 JKBD O=C(Nc1ccccc1CN1CCc2ccccc21)c1ccc([N+](=O)[O-])cc1I 508967216 ZCNJLXOUMPPSLM-UHFFFAOYSA-N 499.308 5.014 5 20 JKBD O=C(C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)Nc1nnc(C(F)(F)F)s1 516137924 BRJOHQDQRHREGN-FMIVXFBMSA-N 491.476 5.644 5 20 JKBD COc1cc(C(=O)Nc2ccc(C)c(C(=O)NC(C)C)c2)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 518184289 FWLGPSFCUNDXII-UHFFFAOYSA-N 497.935 5.748 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Cl)[C@@H](Nc1cccc(OC[C@H]2CCCO2)c1)c1ccccc1 518994340 BGZGVPYXQSCNPG-QPPBQGQZSA-N 481.936 5.598 5 20 JKBD COc1ccc(C(=O)N2CCCC2)cc1NC(=O)c1cc([N+](=O)[O-])ccc1Sc1ccccc1 519876532 QHGYBZWTLNTQOF-UHFFFAOYSA-N 477.542 5.243 5 20 JKBD Cc1c(NC(=O)c2ccccc2)cccc1NC(=O)[C@H](C)Oc1ccc(Cl)cc1[N+](=O)[O-] 521250925 VMESLUGCNAUYJK-HNNXBMFYSA-N 453.882 5.215 5 20 JKBD CC(C)(C)c1ccc(C(=O)N2CCC[C@H](c3nc(-c4cccc(F)c4)no3)C2)cc1[N+](=O)[O-] 522570808 AJOSIOAROYYPGV-KRWDZBQOSA-N 452.486 5.101 5 20 JKBD CCOc1cc([N+](=O)[O-])c(C(=O)Nc2ccc(OCc3cccc(C(F)(F)F)c3)cc2)cc1OC 524386460 BBUHWIXMZNXUQE-UHFFFAOYSA-N 490.434 5.852 5 20 JKBD CN1CCC2(CC1)C[C@H](NC(=O)c1cc([N+](=O)[O-])ccc1Sc1ccccc1)c1ccccc1O2 603821191 HLBPLAPPTGNCEO-QHCPKHFHSA-N 489.597 5.464 5 20 JKBD CCOc1cc(NC(=O)c2sc(-c3ccc(C)cc3C)nc2C)c([N+](=O)[O-])cc1OCC 604490360 JLGGXUWZWIOYDN-UHFFFAOYSA-N 455.536 5.693 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1F)c1sc(-c2ccccc2)cc1OCC(=O)N1CCCCC1 608871756 ZSWPODDSDRCJKB-UHFFFAOYSA-N 483.521 5.106 5 20 JKBD Cc1ccc(NC(=O)c2ccc(N3CCC(NC(=O)Nc4ccc(F)cc4)CC3)c([N+](=O)[O-])c2)cc1 608972763 LYKFZFFNMVIMDL-UHFFFAOYSA-N 491.523 5.085 5 20 JKBD O=C(Cn1c2ccccc2c(=O)c2ccccc21)N1CCC[C@H]1c1cccc(Br)c1 614973580 WZDCEXAKOAFRPF-NRFANRHFSA-N 461.359 5.281 5 20 JKBD Cc1cc(C(=O)O[C@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)c2cc(Br)ccc2n1 725975949 VZPUGOHNEQKJOL-GFCCVEGCSA-N 483.278 5.182 5 20 JKBD COc1cc(C(=O)N(CC2CC2)c2ccc(Cl)c([N+](=O)[O-])c2)cc(OC)c1OCc1ccccc1 728167326 STRFKBUUWJMLJY-UHFFFAOYSA-N 496.947 5.901 5 20 JKBD O=C(OCC1CCN(c2ncccc2[N+](=O)[O-])CC1)/C(=C/c1ccc(F)cc1)c1cccs1 729193555 UPJJLBDNFAAVLM-HMMYKYKNSA-N 467.522 5.191 5 20 JKBD O=C(N[C@@H](c1ccc(Cl)cc1)c1ccsc1)c1cc([N+](=O)[O-])ccc1Br 751106583 AJOJVSQGKLTEQD-KRWDZBQOSA-N 451.729 5.592 5 20 JKBD CCOC(=O)c1c(-c2ccc(C)s2)csc1NC(=O)c1cc(OCC)c(OC)cc1[N+](=O)[O-] 812270236 ZPWYFSKRRCMVFB-UHFFFAOYSA-N 490.559 5.530 5 20 JKBD O=C(COc1ccc(Cl)cc1C1CCCCC1)OCc1nnc(-c2ccc([N+](=O)[O-])cc2)o1 917280414 CJZPASKTCUKJGX-UHFFFAOYSA-N 471.897 5.468 5 20 JKBD O=C(/C=C/c1cc(Br)ccc1F)N(Cc1ccccc1[N+](=O)[O-])CC(F)(F)F 918611585 GSCATNHUVCLKDJ-VMPITWQZSA-N 461.209 5.101 5 20 JKBD Cc1cccc(NC(=O)Nc2cccc(CNC(=O)c3cc([N+](=O)[O-])ccc3N3CCCC3)c2)c1 918646273 NCTIHOWZBLURCP-UHFFFAOYSA-N 473.533 5.077 5 20 JKBD COc1cc(/C=C\C(=O)O[C@@H](C)c2ccccc2[N+](=O)[O-])ccc1OCc1c(C)noc1C 920267581 MGIXXKUPAPVPTG-DMIOIOJGSA-N 452.463 5.105 5 20 JKBD C[C@@H](Nc1ccc(C(=O)OCc2coc(-c3ccc(Cl)cc3)n2)cc1[N+](=O)[O-])c1ccccn1 920549087 VJGFNJUQOONUON-OAHLLOKOSA-N 478.892 5.828 5 20 JKBD CSc1ccc(C(=O)c2ccccc2C(=O)Nc2cc(NC(C)=O)c(F)cc2F)cc1[N+](=O)[O-] 921156128 GQHJIONVPUJZQL-UHFFFAOYSA-N 485.468 5.037 5 20 JKBD O=Cc1ccc(C(=O)NC2(c3ccc(NC(=O)Cc4ccc(Cl)cc4[N+](=O)[O-])cc3)CCC2)s1 1786116206 HWLLZIVSQVROKR-UHFFFAOYSA-N 497.960 5.113 5 20 JKBD Cc1cc(CCCC(=O)Nc2ccc(C3(NC(=O)c4ncoc4C)CCC3)cc2)c([N+](=O)[O-])cc1F 1786274637 JCBYNGBYDBWKOX-UHFFFAOYSA-N 494.523 5.109 5 20 JKBD CC(C)CC(=O)Nc1ccc(C2(NC(=O)c3ccc(Br)c([N+](=O)[O-])c3)CCC2)cc1 1787663935 QMOIBNBPOXRANK-UHFFFAOYSA-N 474.355 5.151 5 20 JKBD O=C(/C=C/c1ccc([N+](=O)[O-])o1)NC1(c2ccc(NC(=O)c3cccc(-c4cnco4)c3)cc2)CCC1 1790707002 AMIAFSMUUSTQAD-PKNBQFBNSA-N 498.495 5.304 5 20 JKBD CC[C@@H](C)[C@H](C(=O)N1CCCC2(CCN(C(=O)c3cc(F)cc([N+](=O)[O-])c3)CC2)C1)c1ccccc1 1809163531 RTMZIXUTDPUPOS-NLFFAJNJSA-N 495.595 5.409 5 20 JKBD O=C(NC[C@H]1CCN(C(=O)CCC2CCC2)[C@@H]1c1cccnc1)c1cc2cc([N+](=O)[O-])ccc2s1 1812304930 XIZGORJOABCZFK-KBMIEXCESA-N 492.601 5.104 5 20 JKBD CC1(C)CCC(CC(=O)N2CCCC[C@H]2c2cc(NC(=O)Cc3cc([N+](=O)[O-])ccc3F)n[nH]2)CC1 1815646095 YORNJPLNOIFZPW-QFIPXVFZSA-N 499.587 5.298 5 20 JKBD CCCCC[C@H](C)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)CSc2ccccc2[N+](=O)[O-])[nH]n1 1822004991 HKSWIKOXTOXQGM-HKUYNNGSSA-N 487.626 5.319 5 20 JKBD Cc1cc(Cl)cc(C(=O)N2CCC([C@H]3CCCCN3C(=O)Cc3cccc([N+](=O)[O-])c3)CC2)c1 1823684279 UNHNRFDLNHDCNN-XMMPIXPASA-N 483.996 5.033 5 20 JKBD O=C(c1cc(Cl)ccc1F)N1CCC([C@H]2CCCCN2C(=O)c2ccc([N+](=O)[O-])cc2F)CC1 1830492915 QJTVSCZNJVCRDW-JOCHJYFZSA-N 491.922 5.074 5 20 JKBD O=C(CSc1ccccc1[N+](=O)[O-])N1CCC([C@H]2CCCCN2C(=O)C[C@@H]2C[C@@H]3CC[C@H]2C3)CC1 1831484137 VQMSSSBBQMDXRB-YPIGPJMWSA-N 499.677 5.133 5 20 JKBD Cc1ccc(CC(=O)N2CCC([C@H]3CCCCN3C(=O)C[C@@H](C)c3ccccc3)CC2)cc1[N+](=O)[O-] 1831506578 JIDPBPUKUXBPIO-ATIYNZHBSA-N 491.632 5.259 5 20 JKBD Cc1ccc([N+](=O)[O-])cc1NC(=O)CSc1nc2ccccc2c(=O)n1Cc1ccc(Cl)cc1 8749950 UTKVQFIDSUWOMX-UHFFFAOYSA-N 494.960 5.046 5 20 JKBD COc1ccc([N+](=O)[O-])cc1NC(=O)[C@@H](C)Sc1nnc(-c2ccco2)n1C1CCCCC1 10014902 IRIDXLARRSYCHF-CQSZACIVSA-N 471.539 5.079 5 20 JKBD Cc1csc(Sc2ccc(C(=O)Nc3nnc(-c4ccccc4)s3)cc2[N+](=O)[O-])n1 18702969 MENFGMCVNGDANQ-UHFFFAOYSA-N 455.546 5.282 5 20 JKBD CC(=O)N(c1cccc(C(F)(F)F)c1)c1nc(COC(=O)c2ccc([N+](=O)[O-])c(C)c2)cs1 21330935 LQSCGDWYWLXYLE-UHFFFAOYSA-N 479.436 5.420 5 20 JKBD CC(=O)N(c1ccc(Cl)c(Cl)c1)c1nc(COC(=O)c2c(C)cccc2[N+](=O)[O-])cs1 26118821 RNOYLAVEFXJWCE-UHFFFAOYSA-N 480.329 5.708 5 20 JKBD COc1ccc(NC(=O)c2cc(-c3ccc(C)s3)nc3c2cnn3C(C)C)c([N+](=O)[O-])c1 58513436 XLKWIFVQEKUTNM-UHFFFAOYSA-N 451.508 5.218 5 20 JKBD CCOc1cc(C(=O)N(C2CC2)[C@@H](C)c2cccc(C(F)(F)F)c2)c([N+](=O)[O-])cc1OC 220026978 WEQMALBNRFTCHT-ZDUSSCGKSA-N 452.429 5.387 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)Nc2ccc(N[C@H](C)c3ccccc3)c(Cl)c2)cc1SC 303232048 YTLSBJMZJOCXRR-CQSZACIVSA-N 471.966 6.404 5 20 JKBD CC1CCN(c2ccc(C(=O)Nc3ccccc3NC(=O)C[C@@H]3C=CCC3)cc2[N+](=O)[O-])CC1 409980129 NQJFELNAHUHHDD-LJQANCHMSA-N 462.550 5.378 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)Nc2cc(-c3ccccc3OC)nn2-c2ccccc2)cc1SC 482870040 PSTDPPSPJTXFED-UHFFFAOYSA-N 490.541 5.439 5 20 JKBD CCc1cc(O)nc(-c2cccc(NC(=O)c3ccc(N4C[C@@H](C)C[C@H](C)C4)c([N+](=O)[O-])c3)c2)n1 485759686 DIXHBFPSHVCVES-IRXDYDNUSA-N 475.549 5.054 5 20 JKBD O=C(Cc1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1)Nc1ccnn1Cc1ccc(F)cc1 486856589 XFZNXCWOWOWZFC-UHFFFAOYSA-N 496.502 5.013 5 20 JKBD CCCN(C(=O)CCn1cc([N+](=O)[O-])nc1C)c1nc(-c2ccc(Cl)cc2Cl)cs1 488382883 JCWLRDMCGHVSRI-UHFFFAOYSA-N 468.366 5.363 5 20 JKBD Cc1ccc2c(C3=CCN(C(=O)c4ccc(N[C@@H](C)c5ccccn5)c([N+](=O)[O-])c4)CC3)c[nH]c2c1 507408639 YTSXJYUAZNJTEQ-IBGZPJMESA-N 481.556 5.882 5 20 JKBD O=C(C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)Nc1nc(C2CC2)cs1 509408152 OVFPANBFELYOJW-LFIBNONCSA-N 462.556 6.108 5 20 JKBD O=C(Nc1ccc(I)cc1Cl)c1cc2cc([N+](=O)[O-])ccc2s1 512518077 FJXWYHNIUFVVET-UHFFFAOYSA-N 458.664 5.320 5 20 JKBD Cc1cc(NC(=O)C/C(=C\c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)ccc1-n1cnnn1 514528492 NZFYQEDFWBZODU-QGOAFFKASA-N 497.540 5.058 5 20 JKBD O=C(CN1CCC[C@@H]1c1cccs1)Nc1cc(N2CCC[C@@H]2c2cccs2)ccc1[N+](=O)[O-] 514884971 QAVYPUZPXDGSOA-NHCUHLMSSA-N 482.631 5.835 5 20 JKBD CCOc1ccc(C(=O)N2CCC(NCc3ccc(-c4ccccc4[N+](=O)[O-])s3)CC2)cc1 517550964 XSUSHYJSWGLGON-UHFFFAOYSA-N 465.575 5.116 5 20 JKBD O=C(Nc1cc(-c2nnc3n2CCCCC3)ccc1F)c1cc([N+](=O)[O-])ccc1Oc1ccccc1 518176932 IPKPLBJHVFQWJJ-UHFFFAOYSA-N 487.491 5.763 5 20 JKBD COc1cc(C)ccc1Oc1ccc(NC(=O)c2csc(-c3ccc([N+](=O)[O-])cc3)n2)cn1 523301562 KDGSUSOUUVULMN-UHFFFAOYSA-N 462.487 5.475 5 20 JKBD O=C(NCCNc1ccc(C(F)(F)F)cc1[N+](=O)[O-])Nc1cccc(NC(=O)c2ccccc2)c1 603696357 ADDCOPDCKMQEQJ-UHFFFAOYSA-N 487.438 5.100 5 20 JKBD CC[C@H](C)c1ccc([C@@H](NC(=O)C(=O)Nc2ccc(C)c([N+](=O)[O-])c2)c2cccs2)cc1 603706232 OZQOPAMPKGFPHS-OYHNWAKOSA-N 451.548 5.323 5 20 JKBD O=C(N[C@H](c1ccccc1)C1CC1)c1ccc(C(=O)N[C@@H](c2ccccc2)C2CC2)c([N+](=O)[O-])c1 609043632 FXGOZQVVSASPEU-FTJBHMTQSA-N 469.541 5.357 5 20 JKBD Cc1ccc(-c2nnc(-c3ccc(C(=O)OCC4CCN(c5ncccc5[N+](=O)[O-])CC4)cc3)o2)cc1 729192258 JTXMSTSENGZDDL-UHFFFAOYSA-N 499.527 5.089 5 20 JKBD CCOC(=O)/C=C\c1ccc(NC(=O)C2CCN(c3ccc(C(F)(F)F)cc3[N+](=O)[O-])CC2)cc1 759307942 YLNADFNCWLZKIJ-YHYXMXQVSA-N 491.466 5.045 5 20 JKBD COc1cccc(CCC(=O)O[C@@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2ccccc2)c1 792724189 VPUGJVPCQOKJAX-HSZRJFAPSA-N 468.893 5.113 5 20 JKBD CCCn1c(C)c(C(=O)O[C@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)c2cc(OC)ccc21 792729217 QUYDTZPMTMJEAB-OAHLLOKOSA-N 464.478 5.245 5 20 JKBD O=C(c1ccccc1)c1ccc(Sc2nnc(-c3ccncc3)n2Cc2ccccc2)c([N+](=O)[O-])c1 799770056 LCNWUYPDOZTDIE-UHFFFAOYSA-N 493.548 5.679 5 20 JKBD Cc1cc(-c2cc(C(=O)O[C@H](C)c3nnc(-c4ccc([N+](=O)[O-])cc4)o3)c3c(C)noc3n2)c(C)o1 813320336 RVPRNIQHWFDCBM-CQSZACIVSA-N 489.444 5.284 5 20 JKBD CC1=C(C(=O)Nc2cccc(C)c2C)[C@H](c2ccc(-c3ccc([N+](=O)[O-])cc3)s2)NC(=S)N1 818329456 XFMVENLAZSASQY-QFIPXVFZSA-N 478.599 5.372 5 20 JKBD COc1ccc(-c2nn(Cc3ccccc3)cc2C(=O)Nc2cc([N+](=O)[O-])c(F)cc2F)cc1OC 897513345 ODAWGXCXTGCXBF-UHFFFAOYSA-N 494.454 5.054 5 20 JKBD COc1ccc(-c2nc(Cc3noc([C@H](C)Oc4ccc(Cl)cc4[N+](=O)[O-])n3)co2)cc1 904330991 AUJGBRDZAPWEIQ-LBPRGKRZSA-N 456.842 5.026 5 20 JKBD Cc1c(Br)cc([N+](=O)[O-])cc1-c1nc(-c2cccnc2Oc2ccccc2)no1 904454013 XCDFMULQFCURRY-UHFFFAOYSA-N 453.252 5.570 5 20 JKBD Cc1nn(Cc2ccc(-c3nc(-c4cccc(OCc5cccnc5)c4)no3)cc2)c(C)c1[N+](=O)[O-] 904499710 FFCZPNQTKZLKFV-UHFFFAOYSA-N 482.500 5.147 5 20 JKBD Cc1ccc(C(=O)O[C@@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)cc1NC(=O)c1ccccc1F 915515181 RMAPPLWBBYLQIG-HNNXBMFYSA-N 490.447 5.263 5 20 JKBD Cc1cccc(-n2ncc(C(=O)N(C)Cc3cc([N+](=O)[O-])ccc3Cl)c2C(F)(F)F)c1 917068992 GBIJMWZLKIKUSI-UHFFFAOYSA-N 452.820 5.033 5 20 JKBD CC(=O)N(c1ccc(C)cc1)c1nc(/C=C2\C(=O)Nc3cc(Cl)c([N+](=O)[O-])cc32)cs1 917560372 MMWDLXFLUICOCC-APSNUPSMSA-N 454.895 5.190 5 20 JKBD COc1ccc(N[C@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2)cc1NC(=O)c1ccc(Cl)cc1F 917937047 AECWTRKVYACMFH-CYBMUJFWSA-N 486.887 5.087 5 20 JKBD C[C@H](NC(=O)c1cccc(Cl)c1Cl)C(=O)OCc1nc2ccccc2c2ccccc12 919210331 SAHAQKXHHXZGNM-AWEZNQCLSA-N 453.325 5.557 5 20 JKBD O=C(CCCC(F)(F)F)Nc1ccc(C2(NC(=O)Cc3cccc([N+](=O)[O-])c3)CCC2)cc1 1786619761 FNHSCDXZZHXYDK-UHFFFAOYSA-N 463.456 5.004 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)c3c[nH]c4cc(Cl)ccc34)CCC2)cc1)c1ccc([N+](=O)[O-])[nH]1 1790186438 UMOLBNSCHBGTMA-UHFFFAOYSA-N 477.908 5.119 5 20 JKBD O=C(Cn1ccc2ccc([N+](=O)[O-])cc21)NC1(c2ccc(NC(=O)C3CC4(CCC4)C3)cc2)CCC1 1792037463 GXKWXEMCDIWPBN-UHFFFAOYSA-N 486.572 5.264 5 20 JKBD CC(C)c1ccc(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)c3ccc([N+](=O)[O-])cc3F)[nH]n2)cc1 1820591793 LYJAYCBFIGOBKM-QFIPXVFZSA-N 479.512 5.200 5 20 JKBD C/C(=C\c1cccs1)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cccc(F)c2[N+](=O)[O-])CC1 1823718081 AFYAJGLXEGBDGQ-NBRGKURFSA-N 485.581 5.132 5 20 JKBD COc1cc(C(=O)N2CCC([C@H]3CCCCN3C(=O)c3cccc(Cl)c3C)CC2)ccc1[N+](=O)[O-] 1823918347 HZSRZASGQIOHKL-JOCHJYFZSA-N 499.995 5.112 5 20 JKBD C[C@H](C(=O)N1CCCC[C@@H]1C1CCN(C(=O)Cc2cccc([N+](=O)[O-])c2)CC1)c1ccc(Cl)cc1 1823972393 YVDZIVSNGQKORI-UQBPGWFLSA-N 498.023 5.214 5 20 JKBD CCCCC[C@@H](C)C(=O)N1CCC([C@@H]2CCCCN2C(=O)Cc2cc([N+](=O)[O-])ccc2F)CC1 1824950086 XALBWJZINLCRTQ-DVECYGJZSA-N 475.605 5.113 5 20 JKBD Cc1ccnc(C(=O)N2CCC([C@H]3CCCCN3C(=O)c3cc4cc([N+](=O)[O-])ccc4s3)CC2)c1 1831060825 HBLIEQPCBWUDJL-JOCHJYFZSA-N 492.601 5.060 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)N1CCC([C@@H]2CCCCN2C(=O)[C@H](C)c2ccccc2)CC1 1832897996 PJFVOKQTQJYLEX-KOSHJBKYSA-N 481.568 5.079 5 20 JKBD O=C(c1cc2cc([N+](=O)[O-])ccc2s1)N1CCC(OC2CCN(C(=O)C3CCCCC3)CC2)CC1 1837620933 BQTFLDONJIVQID-UHFFFAOYSA-N 499.633 5.002 5 20 JKBD COc1cc(-c2nnc(SCc3cccc([N+](=O)[O-])c3)n2-c2ccccc2F)cc(OC)c1OC 8622118 VPIHDWRCWGXDOQ-UHFFFAOYSA-N 496.520 5.300 5 20 JKBD Cc1ccc(NC(=O)[C@@H](OC(=O)c2nc(Cl)ccc2Cl)c2ccccc2)c([N+](=O)[O-])c1 9644928 HVCVGNLKQJPWLG-IBGZPJMESA-N 460.273 5.142 5 20 JKBD COc1ccc(Br)cc1-c1nc(COC(=O)c2ccc([N+](=O)[O-])cc2Cl)cs1 11029108 XJWJDSCNRQVXCH-UHFFFAOYSA-N 483.727 5.500 5 20 JKBD Cc1ccc(Oc2ccccc2NC(=O)COC(=O)Cn2c3ccccc3c(=O)c3ccccc32)cc1 11279013 IHBAILBXDWBEHS-UHFFFAOYSA-N 492.531 5.437 5 20 JKBD COc1ccc(C(=O)Nc2nnc(SCc3c(Cl)cccc3Cl)s2)cc1[N+](=O)[O-] 14582320 RJARCZKUCUZXHX-UHFFFAOYSA-N 471.347 5.306 5 20 JKBD CSc1ccc(C(=O)c2ccccc2C(=O)OCc2cc(-c3ccco3)on2)cc1[N+](=O)[O-] 19015455 BFIUXQMBOWUDSX-UHFFFAOYSA-N 464.455 5.153 5 20 JKBD Cn1c(SCC(=O)Nc2ccccc2-c2ccccc2)nc2cc3ccccc3cc2c1=O 22253338 QOCNSBACEVNYMU-UHFFFAOYSA-N 451.551 5.485 5 20 JKBD Cn1ccnc1[C@H](NC(=O)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1)c1cccc(F)c1 23779663 FNSAHWVQIVOLIJ-JOCHJYFZSA-N 480.883 5.433 5 20 JKBD CCn1c(S[C@H](C(=O)Nc2cccc(NC(C)=O)c2)C(C)C)nc2cc3ccccc3cc2c1=O 31747500 KGKIDJKLNMVOGI-DEOSSOPVSA-N 488.613 5.283 5 20 JKBD COCCOc1ccc(C(F)(F)F)cc1NC(=O)c1csc(-c2cccc([N+](=O)[O-])c2)n1 303025027 MRZKMHVJOVTBQH-UHFFFAOYSA-N 467.425 5.015 5 20 JKBD COCc1ccccc1NC(=O)C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1 481880442 UQFSHLZGGDJNSO-RGEXLXHISA-N 459.527 5.920 5 20 JKBD Cc1cc(NC(=O)c2ccc(N3CCC[C@@H](C)C3)c([N+](=O)[O-])c2)ccc1NC(=O)c1ccco1 490141095 CGLJHCLKAAUWRA-MRXNPFEDSA-N 462.506 5.237 5 20 JKBD CS(=O)(=O)c1ccc(C(=O)Nc2ccc(Sc3ccc(Cl)cc3)cc2)cc1[N+](=O)[O-] 490182978 UBQLPTAIAZYMGF-UHFFFAOYSA-N 462.936 5.055 5 20 JKBD O=C(Nc1cccc(C(=O)N2CCc3ccccc32)c1)c1csc(-c2ccc([N+](=O)[O-])cc2)n1 499667865 AUFVWIWFSNARQY-UHFFFAOYSA-N 470.510 5.174 5 20 JKBD O=C([C@@H]1CCC[C@@H](C(F)(F)F)C1)N1CCN(Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)CC1 500725793 PAVNRQAPPJUCIL-IAGOWNOFSA-N 481.540 5.336 5 20 JKBD CCOc1cc(C(=O)N[C@H](C)c2sc(-c3ccc(C)cc3)nc2C)c([N+](=O)[O-])cc1OC 502538294 BIDGYEJOBLPSHP-CQSZACIVSA-N 455.536 5.233 5 20 JKBD CCOc1cc(-c2nc3cc(F)ccc3n2C)ccc1OCc1cc([N+](=O)[O-])cc2c1OCOC2 513857495 MMEOKTGOAZHSMQ-UHFFFAOYSA-N 479.464 5.132 5 20 JKBD COc1ccc(F)cc1[C@@H](C)N[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1 515525474 RXEVYWZOIJPKHU-PEBXRYMYSA-N 457.889 5.427 5 20 JKBD C[C@H](Nc1ccc(C(=O)N2CCC[C@@H](c3nc4ccccc4s3)C2)cc1[N+](=O)[O-])c1ccccn1 518421825 XMTPNLWMLHIVTF-PKOBYXMFSA-N 487.585 5.792 5 20 JKBD COc1cc(/C=C(\CC(=O)O)c2nc3ccccc3s2)c([N+](=O)[O-])cc1OCC(F)(F)F 519054337 NVLFSGQNOOQZTN-WUXMJOGZSA-N 468.409 5.170 5 20 JKBD Cc1nc(-c2ccc(F)cc2)sc1[C@H](C)NC(=O)Cn1c2ccccc2c(=O)c2ccccc21 520540937 YKNRUBKWDSDUQG-INIZCTEOSA-N 471.557 5.603 5 20 JKBD O=C(Nc1ccccc1C(=O)N1CC2(CCC2)c2c(F)cccc21)c1ccc([N+](=O)[O-])cc1Cl 522383199 JDBFRHZAQSYHAI-UHFFFAOYSA-N 479.895 5.722 5 20 JKBD O=C(NCc1cc2ccccc2s1)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 552535264 FAQCEFSYIOOHAK-UHFFFAOYSA-N 463.481 5.361 5 20 JKBD Cc1cc(C)c(S(=O)(=O)Nc2cc(C(=O)Nc3cccc([N+](=O)[O-])c3C)ccc2C)c(C)c1 603499943 OKFMIJNHJLAZDC-UHFFFAOYSA-N 467.547 5.190 5 20 JKBD O=C(Nc1ccc(NC(=O)c2ccc([N+](=O)[O-])cc2Cl)c(C(F)(F)F)c1)c1ccoc1 603761501 HSDPSVKUODFCMD-UHFFFAOYSA-N 453.760 5.365 5 20 JKBD C[C@H](Nc1ccc(C(=O)N2CCC[C@@H](c3cc4ccccc4[nH]3)C2)cc1[N+](=O)[O-])c1ccccn1 604336878 KBQNKAXPEQTRNZ-GHTZIAJQSA-N 469.545 5.664 5 20 JKBD CC(C)CCSc1ccc(C(=O)N(C)C[C@@H]2CCCO[C@@H]2c2ccccc2)cc1[N+](=O)[O-] 604519187 RCNPWOPRMCZRMO-XUZZJYLKSA-N 456.608 5.973 5 20 JKBD C[C@H](Nc1ccc(C(=O)N[C@@H](CN2CCCCC2)c2ccccc2)cc1[N+](=O)[O-])c1ccccn1 609018437 ZMWKDIAUTINCMD-CPJSRVTESA-N 473.577 5.120 5 20 JKBD Cc1nc(-c2ccc(C(F)(F)F)cc2)sc1C(=O)Nc1n[nH]c(-c2cccc([N+](=O)[O-])c2)n1 609135957 NWZDOXRERBBZJA-UHFFFAOYSA-N 474.424 5.083 5 20 JKBD O=C(Nc1ccc(N2CCN(Cc3ccccc3)CC2)c(Cl)c1)c1cc(F)c(F)cc1[N+](=O)[O-] 727710371 JKRJLOAGAOSLKW-UHFFFAOYSA-N 486.906 5.101 5 20 JKBD C[C@H](NC(=O)COC(=O)c1csc(-c2ccc([N+](=O)[O-])cc2)n1)c1ccc(Cl)c(Cl)c1 747958422 LVRVARDKWQBTEM-NSHDSACASA-N 480.329 5.059 5 20 JKBD C[C@H](Nc1ccc(C(=O)Nc2cccc(Cl)c2SC(F)F)cc1[N+](=O)[O-])c1ccccn1 751229641 YFOHWKKJYRAFQV-LBPRGKRZSA-N 478.908 6.383 5 20 JKBD CC1=C(C(=O)Nc2cccc(Cl)c2)[C@H](c2ccc([N+](=O)[O-])o2)NC(=O)N1Cc1ccccc1 812507061 JPAVADFMLGQVPN-NRFANRHFSA-N 466.881 5.020 5 20 JKBD Cc1noc2nc(-c3ccccc3)cc(C(=O)N(Cc3nnc(-c4cccc([N+](=O)[O-])c4)o3)C(C)C)c12 836299128 ZQDCERODDWULEC-UHFFFAOYSA-N 498.499 5.207 5 20 JKBD Cc1cc(C)n(-c2ccc(-c3noc(-c4ccn(-c5c(Cl)cc([N+](=O)[O-])cc5Cl)n4)n3)cn2)n1 904522324 RGDCLKNGGUYOKX-UHFFFAOYSA-N 497.302 5.002 5 20 JKBD Cc1nc(-c2cccc(Cl)c2)sc1C(=O)OCc1nc(-c2cccc([N+](=O)[O-])c2)no1 914798276 DQOGRNOREROWAC-UHFFFAOYSA-N 456.867 5.087 5 20 JKBD COc1cc(COC(=O)c2ccc(C)c(NC(=O)c3ccccc3)c2)c([N+](=O)[O-])cc1OC(F)F 915019054 IKPXJSRJOAWLJI-UHFFFAOYSA-N 486.427 5.123 5 20 JKBD CC(=O)N1CCc2cc(NC(=O)c3cc([N+](=O)[O-])ccc3N3CCC(Cc4ccccc4)CC3)ccc21 917512716 OYXWKMHFTPWKFI-UHFFFAOYSA-N 498.583 5.215 5 20 JKBD CC(=O)N(c1ccc(Cl)cc1)c1nc(COC(=O)c2ccc([N+](=O)[O-])cc2Cl)cs1 918855364 MFESULNPRLWARK-UHFFFAOYSA-N 466.302 5.400 5 20 JKBD CC(=O)N(c1ccc(Cl)cc1)c1nc(COC(=O)c2ccc(Cl)cc2[N+](=O)[O-])cs1 919039322 AUTBGLWPXTZQDF-UHFFFAOYSA-N 466.302 5.400 5 20 JKBD Cc1ccc(/C(O)=C(/C(=S)Nc2ccc3c(c2)CCC3)[n+]2ccc3c(c2)CCCC3)cc1[N+](=O)[O-] 920395730 KYRXNUPSRGFTCC-UHFFFAOYSA-O 486.617 5.882 5 20 JKBD O=C(OCc1nnc(C2CC2)o1)c1c2c(nc3ccccc13)/C(=C/c1cccc([N+](=O)[O-])c1)CCC2 920499702 SWTURIBSMCZNPB-QGOAFFKASA-N 482.496 5.637 5 20 JKBD Cc1ccc(C(=O)N(C)c2ccc(OC(=O)[C@@H](C)Oc3ccc(Cl)cc3[N+](=O)[O-])cc2)cc1 920791689 CFKJVWHSYIGNOD-MRXNPFEDSA-N 468.893 5.206 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)[C@@H]3C[C@H]3c3ccc(F)c(F)c3)CCC2)cc1)c1ccc([N+](=O)[O-])o1 1785748803 RUMZMDUKPGMIPW-ZWKOTPCHSA-N 481.455 5.017 5 20 JKBD Cc1nc(C(=O)Nc2ccc(C3(NC(=O)CCCc4cc(C)c(F)cc4[N+](=O)[O-])CCC3)cc2)co1 1787393943 LMBDADPBNMLNJZ-UHFFFAOYSA-N 494.523 5.109 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)NC1(c2ccc(NC(=O)c3ccc4ncncc4c3)cc2)CCC1 1789324958 SPEYVBUHVWISPF-UHFFFAOYSA-N 499.502 5.047 5 20 JKBD Cc1[nH]ccc1C(=O)NC1(c2ccc(NC(=O)C3(c4cccc([N+](=O)[O-])c4)CCC3)cc2)CCC1 1790475783 BTOCWRXVBBGBIG-UHFFFAOYSA-N 472.545 5.101 5 20 JKBD COc1cc(CC(=O)Nc2ccc(C3(NC(=O)[C@@]4(F)CCCC=C4F)CCC3)cc2)ccc1[N+](=O)[O-] 1790480263 NVGVUTHAAAUQQV-AREMUKBSSA-N 499.514 5.026 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)c3cccc4cccnc34)CCC2)cc1)c1cc(F)cc([N+](=O)[O-])c1 1790696438 FIQGRFSCVHSZFX-UHFFFAOYSA-N 484.487 5.344 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)Nc1ccc(C2(NC(=O)c3cc(C)n(C)c3C)CCC2)cc1 1790772397 LZZNYDVSAHZTOS-UHFFFAOYSA-N 478.524 5.059 5 20 JKBD O=C(/C=C/c1ccc([N+](=O)[O-])o1)NC1(c2ccc(NC(=O)c3ccc(-c4ncc[nH]4)cc3)cc2)CCC1 1792152175 VNFDXHKLEGTALH-ZRDIBKRKSA-N 497.511 5.039 5 20 JKBD COc1cc(C(=O)Nc2ccc(C3(NC(=O)c4ccc5occc5c4)CCC3)cc2)ccc1[N+](=O)[O-] 1792164433 CIWUDIFDWAEJOX-UHFFFAOYSA-N 485.496 5.411 5 20 JKBD CC(C)(C)CCCCCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)Cn1ccc2ccc([N+](=O)[O-])cc21 1793409536 SVBFIQCZFFIGFY-KOUNCHBCSA-N 482.625 5.184 5 20 JKBD Cc1ccccc1CCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cc3cc([N+](=O)[O-])ccc3s1)C2 1801770267 AXXINGQBMQSBBX-WKCHPHFGSA-N 477.586 5.003 5 20 JKBD CC[C@@H](C)[C@H](C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CSc1ccccc1[N+](=O)[O-])c1ccccc1 1802183277 PPZLZUDFMNEIDO-ZQATVHPOSA-N 495.645 5.155 5 20 JKBD Cc1c(Cl)ccc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)/C=C/c2ccccc2[N+](=O)[O-])C3)c1Cl 1803539526 ZOYDDNOSTQEMKY-SJXSPGMASA-N 488.371 5.175 5 20 JKBD CC(C)c1ccc(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)Cc3cc(F)ccc3[N+](=O)[O-])[nH]n2)cc1 1820593764 JSRZBELIFDWNPX-QHCPKHFHSA-N 493.539 5.129 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cccc3ccoc23)[nH]n1 1821286238 RHFFGUWMJBOFLT-FQEVSTJZSA-N 491.479 5.131 5 20 JKBD O=C(c1cc2cc([N+](=O)[O-])ccc2s1)N1CCC([C@H]2CCCCN2C(=O)C2CC(F)(F)C2)CC1 1823855751 REGJXQQKTSKCGK-LJQANCHMSA-N 491.560 5.088 5 20 JKBD Cc1cc(CCCC(=O)N2CCCC[C@@H]2C2CCN(C(=O)[C@@H]3C[C@H]3C3CC3)CC2)c([N+](=O)[O-])cc1F 1824370365 VVVWFSUECPKPIA-JBRSBNLGSA-N 499.627 5.031 5 20 JKBD O=C(c1ccccc1F)N1CCC([C@@H]2CCCCN2C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)CC1 1831061805 ZIKOHPRVJNOKTI-QFIPXVFZSA-N 495.576 5.496 5 20 JKBD C[C@H]1CC[C@H](C(=O)N2CCCC[C@H]2C2CCN(C(=O)CSc3ccccc3[N+](=O)[O-])CC2)CC1 1832373569 SVSGWGUAFYABBZ-BVSLBCMMSA-N 487.666 5.133 5 20 JKBD O=[N+]([O-])c1cc2c(Nc3ccc(F)c(Cl)c3)nccc2cc1Nc1ccc(F)c(Cl)c1 2048529536 MJQXWPYGTXWQAG-UHFFFAOYSA-N 461.255 7.215 5 20 JKBD CC(=O)N(c1ccccc1)c1nc(COC(=O)c2ccc(N3CCC(C)CC3)c([N+](=O)[O-])c2)cs1 10209978 XUFQQWWSNFUODU-UHFFFAOYSA-N 494.573 5.329 5 20 JKBD COc1ccc(C)cc1NC(=O)c1cc2ccccc2cc1OCC(=O)N(C)c1ccc([N+](=O)[O-])cc1 10254705 TYLAHODLDNOZGA-UHFFFAOYSA-N 499.523 5.359 5 20 JKBD Cc1nn(Cc2ccc(C(=O)N[C@@H](C)c3cccc(NC(=O)c4ccccc4)c3)cc2)c(C)c1[N+](=O)[O-] 69605920 OBBPGEDLUIMPCP-SFHVURJKSA-N 497.555 5.200 5 20 JKBD O=C1CCCN1C[C@@H](NCc1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1)c1ccccc1 302923991 BCPMHUQTWDIZOH-JOCHJYFZSA-N 465.937 5.494 5 20 JKBD COc1ccc(C(=O)Nc2ccc(NC(=O)c3ccccc3F)cc2C(F)(F)F)cc1[N+](=O)[O-] 302953947 OOWMYXYAZOPLRS-UHFFFAOYSA-N 477.370 5.266 5 20 JKBD Cc1c(NC(=O)c2ccc(NC(=O)c3ccc(Br)cc3)cc2)cccc1[N+](=O)[O-] 410150175 AWKPNMRQEDWTOO-UHFFFAOYSA-N 454.280 5.170 5 20 JKBD CCS(=O)(=O)c1ccc2oc(/C=C/c3ccc(OC)c(OCc4ccc([N+](=O)[O-])cc4)c3)nc2c1 483468572 KRGYZBKTZRLRDJ-NTUHNPAUSA-N 494.525 5.288 5 20 JKBD C[C@@H](Nc1ccc(C(=O)Nc2ccc(CS(=O)(=O)C(C)(C)C)cc2)cc1[N+](=O)[O-])c1ccccn1 497782752 MHRLHSCWTUYHMN-QGZVFWFLSA-N 496.589 5.129 5 20 JKBD COc1ccc(Oc2ccc([N+](=O)[O-])cc2C(=O)Nc2cccc(C(=O)Nc3ccccc3)c2C)cc1 498435110 KIEYLVAUDQDXBB-UHFFFAOYSA-N 497.507 6.209 5 20 JKBD CC[C@H](C)Sc1ccc(NC(=O)c2ccc(N[C@H](C)c3ccccn3)c([N+](=O)[O-])c2)c(C)c1 498446361 SQUMFIDFEUNVPJ-ZWKOTPCHSA-N 464.591 6.614 5 20 JKBD O=C(CSc1ccc([N+](=O)[O-])cc1)Nc1nc(-c2sccc2Br)cs1 500726984 CMHWBPVIUGDCIB-UHFFFAOYSA-N 456.368 5.273 5 20 JKBD C[C@@H](Nc1ccc(C(=O)NC[C@H](c2cccc(Cl)c2)N2CCCC2)cc1[N+](=O)[O-])c1ccccn1 507050987 HEHULGHZQZJWQS-IQGLISFBSA-N 493.995 5.383 5 20 JKBD C[C@H](Nc1ccc(C(=O)Nc2ccc(OC(F)F)cc2OC(F)F)cc1[N+](=O)[O-])c1ccccn1 507052656 MGTDXPKHADCHFE-LBPRGKRZSA-N 494.401 5.618 5 20 JKBD COc1cc(CNCc2ccc(Br)s2)ccc1OCc1ccc([N+](=O)[O-])cc1 507931898 MLBGIWDDWQSWOV-UHFFFAOYSA-N 463.353 5.296 5 20 JKBD COc1ccc(Oc2cc(CNC(=O)c3ccc(N[C@H](C)c4ccccn4)c([N+](=O)[O-])c3)ccn2)cc1 508961200 CYNLOVSXYLNMII-GOSISDBHSA-N 499.527 5.289 5 20 JKBD COc1cc(C(=O)N2CCCc3cc(C(F)(F)F)ccc32)c([N+](=O)[O-])cc1OCc1cscn1 512416443 UCXJYSOEPQOZFH-UHFFFAOYSA-N 493.463 5.251 5 20 JKBD O=C(NCc1ccco1)c1cccc(CNCc2ccc(Oc3ccc(F)cc3)c([N+](=O)[O-])c2)c1 513069009 JMUCEKRNUGAZFR-UHFFFAOYSA-N 475.476 5.339 5 20 JKBD CN(C[C@@H]1CCCOC1)C(=O)c1c2c(nc3ccccc13)/C(=C\c1cccc([N+](=O)[O-])c1)CCC2 518083088 KXJAVGJNWYBYNW-RLKVQFJASA-N 471.557 5.519 5 20 JKBD CC[C@@H](C)N(C(=O)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])c(OC)c1)c1ccc(C(N)=O)cc1 519899363 XPVVVJRVFHFAFI-OAHLLOKOSA-N 497.935 5.593 5 20 JKBD COc1cc(C(=O)NCC(C)(C)c2c(Cl)cccc2Cl)c([N+](=O)[O-])cc1OC(F)F 520538526 DBHHDKVXLXFVTC-UHFFFAOYSA-N 463.264 5.219 5 20 JKBD COc1ccc(-c2ccc(CN[C@@H](C)c3ccc(OCC(F)(F)F)cc3)o2)c([N+](=O)[O-])c1 520961981 LNDTVCBYTPCKCW-AWEZNQCLSA-N 450.413 5.655 5 20 JKBD Cc1cc(C)c(NC(=O)CN[C@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2ccccc2)c(C)c1 603744580 TZRMOWCSPNKXAO-DEOSSOPVSA-N 480.952 5.082 5 20 JKBD Cc1occc1C(=O)Nc1cc(NC(=O)c2ccc(N3C[C@@H](C)C[C@@H](C)C3)c([N+](=O)[O-])c2)ccc1F 603896575 IWMPWVHYLVTUHN-IYBDPMFKSA-N 494.523 5.622 5 20 JKBD Cc1sc(NC(=O)[C@@H]2CCCN(c3ncccc3C(F)(F)F)C2)nc1-c1cccc([N+](=O)[O-])c1 603997893 XIYLUIMLMIIJNF-OAHLLOKOSA-N 491.495 5.296 5 20 JKBD O=C(c1ccc(Nc2ccccc2)c([N+](=O)[O-])c1)N1C[C@@H](C(F)(F)F)C[C@H](C(F)(F)F)C1 604262455 JNOJCQOLKOVXIA-KBPBESRZSA-N 461.362 5.541 5 20 JKBD Cc1cc(N2CCCC2)ccc1NC(=O)Cc1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1 604563599 BKOCOCPWAANJDI-UHFFFAOYSA-N 481.556 5.537 5 20 JKBD CCOc1cc([N+](=O)[O-])c(C(=O)Nc2ccc(Oc3ccc(C(F)(F)F)cc3)nc2)cc1OC 609177887 WZUSKGNEGPURDF-UHFFFAOYSA-N 477.395 5.461 5 20 JKBD CC(C)OC(=O)C[C@H](NC(=O)c1ccc(-c2nc3ccccc3s2)o1)c1ccccc1[N+](=O)[O-] 610925528 XAACBVNJVUGCCZ-KRWDZBQOSA-N 479.514 5.277 5 20 JKBD Cc1csc(Sc2ccc(C(=O)N3CCC([C@@H](O)c4ccc(F)cc4)CC3)cc2[N+](=O)[O-])n1 731054081 CEHXBJZSFBGUSU-NRFANRHFSA-N 487.578 5.236 5 20 JKBD COc1ccc(Br)cc1[C@H]1CCCN1C(=O)c1ccc(Br)c([N+](=O)[O-])c1 751153350 RXANMBCRGLMMLQ-OAHLLOKOSA-N 484.144 5.106 5 20 JKBD Cc1ccc(Sc2ncccc2C(=O)OCc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)cc1C 776826074 KQTGOSGGKRCDBO-UHFFFAOYSA-N 462.487 5.165 5 20 JKBD O=C1C[C@H](C(=O)Nc2cc(Cl)c([N+](=O)[O-])cc2OCc2ccccc2)c2ccc(F)cc2N1 824659287 CHPQMEBWQFXZBT-INIZCTEOSA-N 469.856 5.031 5 20 JKBD O=C(COC(=O)c1ccc(NCc2ccccc2)c([N+](=O)[O-])c1)Nc1c(Cl)cccc1Cl 846720368 BLMOXFNSHPGLNI-UHFFFAOYSA-N 474.300 5.309 5 20 JKBD COc1ccc(CNc2cc(C(=O)N(C)C(C)C)ccc2Cl)cc1OCc1ccc([N+](=O)[O-])cc1 864004152 VLFAIJRPPWKUQP-UHFFFAOYSA-N 497.979 5.928 5 20 JKBD CCOc1ccc(-c2nc(C(=O)O[C@@H](C)c3nnc(-c4ccc([N+](=O)[O-])cc4)o3)cs2)cc1 914991966 KCTWZEGEVFHVHM-ZDUSSCGKSA-N 466.475 5.085 5 20 JKBD C[C@H](Oc1cccc(Cl)c1Cl)C(=O)O[C@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 915496473 GDSGLMILMHYGHP-ZJUUUORDSA-N 495.237 5.258 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)c3n[nH]cc3[N+](=O)[O-])CCC2)cc1)c1ccc(-c2ccccc2)cc1 1792166289 JVIUPRISKKCLQG-UHFFFAOYSA-N 481.512 5.046 5 20 JKBD Cc1cc(Cl)c(Cl)cc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)/C=C/c1ccccc1[N+](=O)[O-])C2 1800790439 XZBCFTDPJVEPCX-RGKVLUKRSA-N 488.371 5.175 5 20 JKBD O=C(Nc1cc([C@H]2CCCCN2C(=O)c2ccc([N+](=O)[O-])cc2F)[nH]n1)c1cccc2ccccc12 1818454003 GUBUEYZDOJAZNR-HSZRJFAPSA-N 487.491 5.230 5 20 JKBD CC1(C)CC(C(=O)N2CCC([C@H]3CCCCN3C(=O)C3(c4cccc([N+](=O)[O-])c4)CCC3)CC2)C1 1830295089 IPKGXZWHJLNIJP-XMMPIXPASA-N 481.637 5.072 5 20 JKBD CC(C)(C)c1ccc(C(=O)N2CCC([C@@H]3CCCCN3C(=O)c3ccc(O)c([N+](=O)[O-])c3)CC2)s1 1830488243 KOMNTUSUFSCOHQ-IBGZPJMESA-N 499.633 5.207 5 20 JKBD O=C(c1cccc2ccoc12)N1CCC([C@@H]2CCCCN2C(=O)c2cccc(F)c2[N+](=O)[O-])CC1 1830621618 NKICBSPDHXRFBM-QFIPXVFZSA-N 479.508 5.027 5 20 JKBD O=C(c1cccc(F)c1[N+](=O)[O-])N1CCC([C@@H]2CCCCN2C(=O)c2ccc(C3CC3)cc2)CC1 1830750455 VSUATGBKIKHGTN-DEOSSOPVSA-N 479.552 5.158 5 20 JKBD Cc1ccc([C@H](C)C(=O)N2CCC([C@H]3CCCCN3C(=O)Cc3ccc([N+](=O)[O-])cc3F)CC2)cc1 1831293751 HLBRDEIVUFXSGV-RXFWQSSRSA-N 495.595 5.008 5 20 JKBD Cc1oc(-c2ccccc2)nc1C(=O)O[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1 9717709 QKFFGZLCYQVPOA-JOCHJYFZSA-N 491.887 5.748 5 20 JKBD CCc1ccc(N(C(C)=O)c2nc(COC(=O)/C=C/c3ccc([N+](=O)[O-])cc3)cs2)cc1 10757765 ZBCJOHDFALYHOB-MDWZMJQESA-N 451.504 5.055 5 20 JKBD CCCn1c(C)cc(-c2csc(NC(=O)c3ccc(Sc4nncn4C)c([N+](=O)[O-])c3)n2)c1C 15651863 YVZSERAVIXFBRT-UHFFFAOYSA-N 497.606 5.079 5 20 JKBD C[C@@H](Sc1nnc(-c2c[nH]c3ccccc23)n1C1CC1)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl 17881932 VGIUPSHSGGVKAQ-GFCCVEGCSA-N 482.953 5.442 5 20 JKBD COCCN(C(=O)c1cc2cc(Cl)ccc2o1)c1nc(-c2ccc([N+](=O)[O-])cc2)cs1 19203142 NTXOQDMARCUZQX-UHFFFAOYSA-N 457.895 5.411 5 20 JKBD COC(=O)c1ccc2c(O)nc(/C(Cl)=C/c3ccc(-c4ccc([N+](=O)[O-])cc4)s3)nc2c1 23606348 GDXSYRGMLMJVPX-BOPFTXTBSA-N 467.890 5.496 5 20 JKBD O=C(/C=C/c1cnc2ccccc2n1)O[C@H](C(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1)c1ccccc1 23647903 MGKLZYRNWNVPSO-CWSBKQHBSA-N 488.887 5.128 5 20 JKBD O=C(OCc1coc(-c2cccs2)n1)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 24894375 LMUUFORNAWOZLF-UHFFFAOYSA-N 481.452 5.290 5 20 JKBD Cn1c(SCC(=O)Nc2cc(Cl)ccc2[N+](=O)[O-])nc2scc(-c3cccs3)c2c1=O 28607669 ZXLXLZKMTVKFPE-UHFFFAOYSA-N 492.991 5.016 5 20 JKBD O=C(CCc1nc(-c2ccco2)no1)Nc1cc([N+](=O)[O-])ccc1Nc1cccc(C(F)(F)F)c1 29600067 AODWMGCPXMTQOV-UHFFFAOYSA-N 487.394 5.572 5 20 JKBD CCn1c(S[C@@H](C)C(=O)Nc2ccccc2[N+](=O)[O-])nnc1-c1ccc(C(C)(C)C)cc1 60383428 ULYAKHYSNRUYHT-HNNXBMFYSA-N 453.568 5.290 5 20 JKBD O=C(COc1ccc([N+](=O)[O-])cc1)Nc1ccc(NC(=O)c2ccc(F)cc2)cc1C(F)(F)F 69611228 SAPLGWBAWYDRAL-UHFFFAOYSA-N 477.370 5.023 5 20 JKBD CCN(c1ccccc1)S(=O)(=O)c1ccc(Cl)c(C(=O)Nc2ccc(C)c([N+](=O)[O-])c2)c1 104737115 XJHMLEJTLBVXQE-UHFFFAOYSA-N 473.938 5.024 5 20 JKBD COc1ccc(CSCC(=O)Nc2cc(NC(=O)Nc3ccccc3)ccc2C)cc1[N+](=O)[O-] 107802220 CPIXOWVJQMYCLO-UHFFFAOYSA-N 480.546 5.428 5 20 JKBD C[C@H](Nc1ccc(C(=O)Nc2ccc(Cl)cc2C(=O)N2CCCC2)cc1[N+](=O)[O-])c1ccccn1 116667311 IBZILEKHLYVUKJ-INIZCTEOSA-N 493.951 5.305 5 20 JKBD O=C(O)c1ccc(/C=C/c2c3ccccc3c(/C=C/c3ccc(C(=O)O)cc3)c3ccccc23)cc1 216573225 ATNHSEKOZXABDI-IWGRKNQJSA-N 470.524 7.730 5 20 JKBD Cc1ccc(NC(=O)[C@@H](Sc2ccc(Br)cn2)c2ccccc2)c([N+](=O)[O-])c1 302960435 GIVPLOZKRNMCMA-IBGZPJMESA-N 458.337 5.533 5 20 JKBD COc1cccc(/C=C(\CC(=O)N2CCc3cc([N+](=O)[O-])ccc32)c2nc3ccccc3s2)c1 478111348 MWXITQMKIGSZFW-CPNJWEJPSA-N 471.538 5.733 5 20 JKBD COCCN(C(=O)[C@@H]1C[C@H]1c1cccc(Cl)c1)c1nc(-c2ccc([N+](=O)[O-])cc2)cs1 494100609 PDKYZUAKTXJYDA-RBUKOAKNSA-N 457.939 5.155 5 20 JKBD O=C(Nc1ccc(Cl)c(C(=O)NC2CCCCC2)c1)c1csc(-c2cccc([N+](=O)[O-])c2)n1 496609801 FNCJGXQWKTYIOO-UHFFFAOYSA-N 484.965 5.687 5 20 JKBD C[C@@H](Nc1ccc(C(=O)N[C@H](C)c2nc3ccccc3n2C(F)F)cc1[N+](=O)[O-])c1ccccn1 506069140 HXIFRFXWIAKKJU-HUUCEWRRSA-N 480.475 5.399 5 20 JKBD CC(=O)Nc1ccc(F)c(C(=O)Nc2cc([N+](=O)[O-])ccc2Nc2cccc(C(F)(F)F)c2)c1 512543570 GOBJGXKTTRYLNV-UHFFFAOYSA-N 476.386 5.707 5 20 JKBD COc1cc(C(=O)N2CCCc3c(NC(C)=O)cccc32)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 515586079 IJMRDRRVBNIDPJ-UHFFFAOYSA-N 495.919 5.601 5 20 JKBD CCOC(=O)c1sc(-c2cccc([N+](=O)[O-])c2)cc1NC(=O)c1cc2cnn(C(C)C)c2nc1C 516070215 JKZDCTUTUJNLBZ-UHFFFAOYSA-N 493.545 5.386 5 20 JKBD Cc1ccc(Sc2ccc(CNC3CCN(C(=O)c4ccoc4)CC3)cc2[N+](=O)[O-])cc1 518768330 QSBDSYNRGFEYNI-UHFFFAOYSA-N 451.548 5.042 5 20 JKBD CCN(C(=O)Cn1c2ccccc2c(=O)c2ccccc21)[C@H](c1cccnc1)c1ccc(F)c(C)c1 521453927 NZJLMXBZLIWXBC-LJAQVGFWSA-N 479.555 5.635 5 20 JKBD COc1cc(C(=O)Nc2cc(C(F)(F)F)ccc2N2CCCCC2)c([N+](=O)[O-])cc1OC(F)F 585698734 BELXHVLHDYVQAG-UHFFFAOYSA-N 489.397 5.466 5 20 JKBD O=C(C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)N1CCC[C@@H]1c1ccc(F)cc1 592950227 QZKQKOGPDIURPY-ODSHTMMISA-N 487.556 6.638 5 20 JKBD CC[C@H](C)c1ccc([C@H](NC(=O)C(=O)Nc2cc([N+](=O)[O-])ccc2C)c2cccs2)cc1 603706152 IKZZOWJRVZMMKB-NYHFZMIOSA-N 451.548 5.323 5 20 JKBD CN(Cc1ccc2ccccc2c1)C(=O)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 603820848 WCXVSOKEQZPQOH-UHFFFAOYSA-N 471.479 5.642 5 20 JKBD CC(C)Oc1ccccc1CN[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Br)c1ccccc1 604047335 PCJBSJNFFYROAX-HSZRJFAPSA-N 498.377 5.614 5 20 JKBD C[C@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)N[C@@H](C)c1ccc(NC(=O)c2ccc(F)cc2)cc1 604443825 QHTFAMPJJWYBOS-GJZGRUSLSA-N 485.899 5.284 5 20 JKBD C[C@@H]1C[C@@H](C)CN(c2ccc(C(=O)Nc3ccc4nc([C@@H]5CCCO5)[nH]c4c3)cc2[N+](=O)[O-])C1 604480819 LXNQBPDYUDOBHT-LNPFQXMTSA-N 463.538 5.057 5 20 JKBD O=C(CCc1ccc(OC(F)(F)F)cc1)N(Cc1ccccc1[N+](=O)[O-])CC(F)(F)F 608937414 WGHSRWFZTFYAMB-UHFFFAOYSA-N 450.335 5.017 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)OCC(=O)Nc2ccccc2Oc2ccc(C)cc2)cc1SC 728648854 AFJYQVCVROJNTP-UHFFFAOYSA-N 482.514 5.222 5 20 JKBD O=C(Nc1ccc(Oc2ccc(C(F)(F)F)cc2)nc1)c1cc([N+](=O)[O-])ccc1Br 729658427 ZSBPIBZLQGRZIJ-UHFFFAOYSA-N 482.212 5.816 5 20 JKBD Cc1c(OC(=O)c2cnn(-c3ncc(C(F)(F)F)cc3Cl)c2C(F)F)cccc1[N+](=O)[O-] 730964361 UGTJKVPBGFILOT-UHFFFAOYSA-N 476.745 5.313 5 20 JKBD Cc1ccc(OC[C@@H](C)NC(=O)c2ccccc2NC(=O)c2ccc([N+](=O)[O-])cc2Cl)cc1 742433723 QYWFCWXKZSVKJN-MRXNPFEDSA-N 467.909 5.006 5 20 JKBD O=C(OCc1nnc(-c2ccc([N+](=O)[O-])cc2)o1)C1(c2cccc(C(F)(F)F)c2)CCCC1 792714818 MJDNXIRDJGXBAZ-UHFFFAOYSA-N 461.396 5.219 5 20 JKBD Cc1ccc(C(C)C)c(Oc2ccc(CNc3ccc([C@@H]4CC(=O)NC(=O)N4)cc3)cc2[N+](=O)[O-])c1 864044841 MMQOUASPPUDQOW-QFIPXVFZSA-N 488.544 5.702 5 20 JKBD O=[N+]([O-])c1cc(C(F)(F)F)ccc1N1CCC(c2nc(-c3nccc4ccccc34)no2)CC1 904594252 RSLQYAALOBGDFW-UHFFFAOYSA-N 469.423 5.596 5 20 JKBD O=C(Nc1cccc(N2CCOC2=O)c1)c1cc([N+](=O)[O-])ccc1Sc1ccc(Cl)cc1 914726943 LQQGLXGDENPWBO-UHFFFAOYSA-N 469.906 5.608 5 20 JKBD O=C(COC(c1ccccc1)c1ccccc1)Oc1ccc(NC(=O)c2cccc([N+](=O)[O-])c2)cc1 916553843 YRFDLWZAHDUYEQ-UHFFFAOYSA-N 482.492 5.559 5 20 JKBD CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)c1ccc(NS(=O)(=O)/C=C/c2ccccc2)cc1 919867666 LLVGFAYPWCZOAA-WUKNDPDISA-N 479.558 5.058 5 20 JKBD C[C@H](OC(=O)[C@@H](C)Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)Nc1c(Cl)cc(Cl)cc1Cl 920778705 LRVATWLKJJIKKM-DTWKUNHWSA-N 496.130 5.546 5 20 JKBD Cc1onc(-c2ccccc2)c1C(=O)NC1(c2ccc(NC(=O)c3ccc([N+](=O)[O-])o3)cc2)CCC1 1785747856 FTTRNYKDLZRQDZ-UHFFFAOYSA-N 486.484 5.213 5 20 JKBD Cc1cc(C(=O)Nc2ccc(C3(NC(=O)c4cc5cc([N+](=O)[O-])ccc5s4)CCC3)cc2)no1 1787468021 IPTVQDHTJAKOEX-UHFFFAOYSA-N 476.514 5.167 5 20 JKBD Cc1ccoc1C(=O)Nc1ccc(C2(NC(=O)c3cc(Br)ccc3[N+](=O)[O-])CCC2)cc1 1788693153 RBEAVVMIBPMSNO-UHFFFAOYSA-N 498.333 5.320 5 20 JKBD Cc1ccncc1C(=O)NC1(c2ccc(NC(=O)C3(c4cccc([N+](=O)[O-])c4)CCC3)cc2)CCC1 1790475969 OFGNLLYVRNJINK-UHFFFAOYSA-N 484.556 5.168 5 20 JKBD O=C(c1c(Cl)cccc1Cl)N1CCC([C@H]2CCCCN2C(=O)c2ccc([N+](=O)[O-])o2)CC1 1823613950 OGJNHKKAUSBYEM-QGZVFWFLSA-N 480.348 5.042 5 20 JKBD Cc1c(C(=O)N2CCC([C@H]3CCCCN3C(=O)[C@@H]3CC=CCC3)CC2)cc(Cl)cc1[N+](=O)[O-] 1824106288 WQNVNSQYRIZJDU-DENIHFKCSA-N 474.001 5.146 5 20 JKBD O=C([C@@H]1CCC[C@@H]2CCCC[C@H]21)N1CCC([C@H]2CCCCN2C(=O)c2cc(O)cc([N+](=O)[O-])c2)CC1 1830705188 UVTZVJOEWYQEKW-HCRCJJAXSA-N 497.636 5.140 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)N1CCCC[C@H]1C1CCN(C(=O)[C@H]2CCc3ccccc32)CC1 1830729762 XDSRABAHQQJBGQ-DHLKQENFSA-N 493.579 5.006 5 20 JKBD Cc1cnc(C(=O)N2CCC([C@@H]3CCCCN3C(=O)c3cc4cc([N+](=O)[O-])ccc4s3)CC2)s1 1831059538 IHVVAKGXHYNKOC-IBGZPJMESA-N 498.630 5.122 5 20 JKBD Cc1cc([N+](=O)[O-])ccc1NC(=O)CSc1nnc(Cc2cccs2)n1CCc1ccccc1 12743875 BJCOIBAMIOTYON-UHFFFAOYSA-N 493.614 5.121 5 20 JKBD COc1cc(CN[C@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2ccccc2)ccc1OC(F)F 15499595 HNEJGCOOISHEIE-NRFANRHFSA-N 491.878 5.328 5 20 JKBD Cc1ccc(NC(=O)[C@H](C)OC(=O)c2cc3cc([N+](=O)[O-])ccc3s2)c(Br)c1 16800365 BAHSHMYMQRWDPM-NSHDSACASA-N 463.309 5.064 5 20 JKBD C[C@@H](OC(=O)c1ccc2c(c1)C[C@@H](c1ccccc1)OC2=O)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 17899407 TWPWDMLZHMUXBK-QRQCRPRQSA-N 485.452 5.017 5 20 JKBD Cc1cccc([N+](=O)[O-])c1NC(=O)COC(=O)C1(Cc2nc3ccccc3s2)CCCCC1 19172320 PURONLHMLSUNAC-UHFFFAOYSA-N 467.547 5.188 5 20 JKBD CN(Cc1ccc(Cl)c(Cl)c1)C(=O)CSc1nc2cc3ccccc3cc2c(=O)n1C 19417845 SFZGIXWTZMOZRM-UHFFFAOYSA-N 472.397 5.144 5 20 JKBD Cc1cc(NC(=O)COC(=O)c2c3c(nc4ccccc24)/C(=C/c2cccc([N+](=O)[O-])c2)CCC3)no1 23544350 FVMRFOLQZTWQJJ-QGOAFFKASA-N 498.495 5.112 5 20 JKBD CCc1ccc(N(C(C)=O)c2nc(COC(=O)/C=C\c3cccc([N+](=O)[O-])c3)cs2)cc1 96477229 CAUKVABWYVESKX-XFXZXTDPSA-N 451.504 5.055 5 20 JKBD CC(=O)Nc1ccc(F)c(NC(=O)C/C(=C\c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)c1 484372104 MCVCBQWDQBMJPY-SFQUDFHCSA-N 490.516 5.871 5 20 JKBD O=C(c1cc2cc(Br)cc(Br)c2o1)N1CCc2ccc([N+](=O)[O-])cc21 494084143 WWUSOUJTHPJOPT-UHFFFAOYSA-N 466.085 5.069 5 20 JKBD Cc1cc(C(=O)N2CCCC[C@H]2C)ccc1NC(=O)c1csc(-c2ccc([N+](=O)[O-])cc2)n1 495495075 LZIGSQVDEPCTQS-MRXNPFEDSA-N 464.547 5.294 5 20 JKBD C[C@@H]1Cc2cc([N+](=O)[O-])ccc2N1C(=O)c1ccc2c(c1)C(=O)N(c1ccc(Cl)c(Cl)c1)C2=O 504334024 GMVVATXSTXQAAK-GFCCVEGCSA-N 496.306 5.294 5 20 JKBD CC(C)(C)c1ccc(C(=O)N2CCC(C(=O)Nc3ccc(Br)cc3)CC2)cc1[N+](=O)[O-] 504968617 GXAWURQQBUSDPM-UHFFFAOYSA-N 488.382 5.146 5 20 JKBD COc1ccc(C[C@@H](NC(=O)N(Cc2ccc([N+](=O)[O-])cc2)C(C)C)c2ccc(OC)cc2)cc1 509374844 WRAOBEOMOJATTE-AREMUKBSSA-N 477.561 5.516 5 20 JKBD COCCOc1ccccc1NC(=O)C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1 512146087 GDEQSBFGWAWVRW-KNTRCKAVSA-N 489.553 5.799 5 20 JKBD O=C(C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)Nc1nnc(C(F)(F)F)s1 516137925 BRJOHQDQRHREGN-XFXZXTDPSA-N 491.476 5.644 5 20 JKBD COc1cc(CNCc2ccc(-c3ccccc3[N+](=O)[O-])s2)cc(Br)c1OC 517549108 ZHYYNNVEHXZXKC-UHFFFAOYSA-N 463.353 5.393 5 20 JKBD Cc1occc1-c1cc(NCc2ccc(Oc3ccccc3Cl)c([N+](=O)[O-])c2)n(CCO)n1 518278806 HDXVIMARKPSTGP-UHFFFAOYSA-N 468.897 5.410 5 20 JKBD Cc1ccc(C(C)C)c(Oc2ccc(CNC3CCN(C(=O)C4CC4)CC3)cc2[N+](=O)[O-])c1 520951627 DOIZUVHRCRVBSI-UHFFFAOYSA-N 451.567 5.310 5 20 JKBD COc1cc(C(=O)Nc2ccc(C(=O)NC(C)C)c(C)c2)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 521276260 SWNNKLVVIUDICV-UHFFFAOYSA-N 497.935 5.748 5 20 JKBD Cc1csc(Sc2ccc(C(=O)Nc3n[nH]c(C)c3-c3ccccc3)cc2[N+](=O)[O-])n1 522813661 YNXCRFQUEOZDEE-UHFFFAOYSA-N 451.533 5.462 5 20 JKBD O=C(C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)NC[C@@H]1COc2ccccc2O1 603461307 SNEWFTWAEPTVOU-MTGKDYNDSA-N 487.537 5.091 5 20 JKBD O=C(C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)Nc1ccc(Cn2cncn2)cc1 603569352 KJMWUGRATZHUED-DEDYPNTBSA-N 496.552 5.414 5 20 JKBD COc1cc([N+](=O)[O-])ccc1NC(=O)CN[C@@H](c1ccccc1)c1ccc(Cl)c(Cl)c1 604011092 VQFDKESIIMJFSR-QFIPXVFZSA-N 460.317 5.228 5 20 JKBD O=c1c(Cl)c(N[C@@H](c2ccccc2)c2ccc(F)cc2)cnn1-c1ccc([N+](=O)[O-])cc1 608830908 HCTYGCXMOVDCMS-QFIPXVFZSA-N 450.857 5.135 5 20 JKBD CC(C)C[C@H](NC(=O)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1cccc(C(F)(F)F)c1 608864892 FLZATVBPQOEZCN-KRWDZBQOSA-N 457.836 5.109 5 20 JKBD O=C(Nc1cc(Cl)ccc1C(=O)N1CCCCC1)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-] 609057168 BAOAHBLPRIIDIB-UHFFFAOYSA-N 485.846 5.068 5 20 JKBD CC(C)(C)c1ccccc1NC(=O)N1CCN(c2ccc([N+](=O)[O-])cc2C(F)(F)F)CC1 727586348 NGKWPZOVDXPVAX-UHFFFAOYSA-N 450.461 5.265 5 20 JKBD O=C(OCc1csc([N+](=O)[O-])c1)c1cnn(-c2ncc(C(F)(F)F)cc2Cl)c1C(F)F 731099723 KLDHHLDFHGRECN-UHFFFAOYSA-N 482.774 5.204 5 20 JKBD COc1ccc(-c2nc(COC(=O)c3csc(-c4cccc([N+](=O)[O-])c4)n3)cs2)cc1 747960825 CFMVTXPUUMIUKA-UHFFFAOYSA-N 453.501 5.207 5 20 JKBD O=C(Nc1cccc(C(F)(F)F)c1)c1cccc(NC(=O)c2cc(F)c(F)cc2[N+](=O)[O-])c1 750564868 YDHCUSJYOBWEIU-UHFFFAOYSA-N 465.334 5.396 5 20 JKBD O=C(Nc1ccccc1SCc1ccccc1)c1ccc([N+](=O)[O-])cc1I 751060532 DPEZNCRNEOMONF-UHFFFAOYSA-N 490.322 5.744 5 20 JKBD Cc1cccc(C(C)C)c1NC(=O)c1ccc(NS(=O)(=O)c2ccc(Cl)c([N+](=O)[O-])c2)cc1 790245889 FMAGKXLSMNUAJT-UHFFFAOYSA-N 487.965 5.733 5 20 JKBD O=C(Nc1ccc(OC(=O)c2csc(COc3ccc(F)cc3)n2)cc1)c1cccc([N+](=O)[O-])c1 824013353 BTTQPKLUQGXCQK-UHFFFAOYSA-N 493.472 5.241 5 20 JKBD C[C@H](Nc1ccc(-c2nc([C@H]3CCC(=O)N(CC4CCCC4)C3)no2)cc1[N+](=O)[O-])c1ccccn1 856577520 IARIZVKKLGPONK-PXNSSMCTSA-N 490.564 5.109 5 20 JKBD CC1=C(C(=O)Nc2ccc(C)cc2C)[C@@H](c2ccc([N+](=O)[O-])cc2)NC(=S)N1c1ccccc1 916160679 YNYMSYAPIHNGFL-XMMPIXPASA-N 472.570 5.560 5 20 JKBD O=C(Nc1nnc(SCc2c(Cl)cccc2Cl)s1)c1cc([N+](=O)[O-])ccc1F 919679893 OMKRXZGLFGPDEL-UHFFFAOYSA-N 459.311 5.437 5 20 JKBD O=C(/C=C/c1ccsc1)NC1(c2ccc(NC(=O)Cc3cccc([N+](=O)[O-])c3)cc2)CCC1 1785791622 DVMNNXXEQFLDKL-BJMVGYQFSA-N 461.543 5.046 5 20 JKBD COc1cc(C(=O)NC2(c3ccc(NC(=O)CSC4CCCC4)cc3)CCC2)ccc1[N+](=O)[O-] 1786349782 IXDSVBXIFPEPRQ-UHFFFAOYSA-N 483.590 5.027 5 20 JKBD O=C(Cc1ccc(Cl)s1)Nc1ccc(C2(NC(=O)c3ccc(O)c([N+](=O)[O-])c3)CCC2)cc1 1786734495 MDLPACPOZVMORA-UHFFFAOYSA-N 485.949 5.006 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)c3cccc(Br)c3[N+](=O)[O-])CCC2)cc1)c1ccco1 1787271196 FFMZARPZTPHEGI-UHFFFAOYSA-N 484.306 5.012 5 20 JKBD O=C(NC1(c2ccc(NC(=O)c3nccs3)cc2)CCC1)c1cc2cc([N+](=O)[O-])ccc2s1 1787517446 YIUBJHCFKJSHGE-UHFFFAOYSA-N 478.555 5.328 5 20 JKBD O=C(Cc1ccsc1)Nc1ccc(C2(NC(=O)Cc3ccc(Cl)cc3[N+](=O)[O-])CCC2)cc1 1788237190 QQUAUYGHUYQXTN-UHFFFAOYSA-N 483.977 5.229 5 20 JKBD C[C@H](C(=O)NC1(c2ccc(NC(=O)c3cc4cc([N+](=O)[O-])ccc4s3)cc2)CCC1)n1ccnc1 1791009916 CHFAPKJIFVNDMW-MRXNPFEDSA-N 489.557 5.015 5 20 JKBD CC(C)(C)CCCCCC(=O)NC[C@H]1CCN(C(=O)Cc2cccc([N+](=O)[O-])c2)[C@H]1c1cccnc1 1812804685 SEAZHXIRIAUQCR-KCWPFWIISA-N 494.636 5.235 5 20 JKBD Cc1c(Cl)cccc1C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2ccc([N+](=O)[O-])cc2F)n[nH]1 1821049041 DIXBLIMQAYWVDH-FQEVSTJZSA-N 485.903 5.039 5 20 JKBD Cc1csc(CCC(=O)N2CCC([C@@H]3CCCCN3C(=O)CCc3cccc([N+](=O)[O-])c3)CC2)c1 1824838676 OCLHHRMHPLLMQX-VWLOTQADSA-N 497.661 5.150 5 20 JKBD Cc1cc(C(=O)N2CCC([C@@H]3CCCCN3C(=O)[C@@H]3CCC[C@@H]4CCCC[C@@H]43)CC2)ncc1[N+](=O)[O-] 1828459446 CTQGNOOVDRMJOB-ITAIVJFTSA-N 496.652 5.138 5 20 JKBD C[C@@H](CC(=O)N1CCCC[C@H]1C1CCN(C(=O)Cc2ccc([N+](=O)[O-])cc2F)CC1)c1ccccc1 1831510408 SWZPETLNHHUSQO-FNZWTVRRSA-N 495.595 5.090 5 20 JKBD O=C(Cc1cc([N+](=O)[O-])ccc1F)N1CCC([C@@H]2CCCCN2C(=O)c2ccccc2C2CC2)CC1 1832554986 YLKITANVHHQNLD-SANMLTNESA-N 493.579 5.087 5 20 JKBD CCc1ccc(N(C(=O)CSc2ccc(C(N)=O)cc2[N+](=O)[O-])c2nc3ccccc3s2)cc1 14373494 PNSZAVNBAIUYPC-UHFFFAOYSA-N 492.582 5.323 5 20 JKBD COc1cccc(Nc2nnc(S[C@@H](C)c3nnc(-c4ccc([N+](=O)[O-])cc4)o3)s2)c1 17741444 FVEBMUPZFYUNPP-NSHDSACASA-N 456.509 5.102 5 20 JKBD C[C@@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccc(NC(=O)c2ccco2)cc1C(F)(F)F 22182074 QVXNMJIOVGCPPE-GFCCVEGCSA-N 479.436 5.578 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Cl)[C@H](Nc1cccc(N2CCCCC2=O)c1)c1ccccc1 27048294 YDWJAOISYRZPLT-XMMPIXPASA-N 478.936 5.557 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Cl)[C@@H](c1ccccc1)N1CCO[C@H](c2ccc(F)cc2)C1 29537987 AHXIMDJPWGBEAI-XZOQPEGZSA-N 469.900 5.141 5 20 JKBD CCc1cc(Sc2nnc(COc3cc(C)ccc3C)o2)nc(-c2ccc([N+](=O)[O-])cc2)n1 59577600 WKMVPFZWIGKCRU-UHFFFAOYSA-N 463.519 5.344 5 20 JKBD C[C@@H](OC(=O)c1cn(Cc2ccccc2)c2ccccc12)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 105220067 YWLFVXVIISJEFF-QGZVFWFLSA-N 468.469 5.566 5 20 JKBD COc1cc2c(cc1OC)[C@H](c1ccccc1)N(C(=O)c1cc(SC)c(OC)cc1[N+](=O)[O-])CC2 481919595 KVEYXXAGGIIMGB-VWLOTQADSA-N 494.569 5.130 5 20 JKBD Cc1c(NC(=O)[C@H](C)Oc2ccc(Cl)cc2[N+](=O)[O-])cccc1C(=O)Nc1ccccc1 498463990 NIYMABBGUBXFKX-HNNXBMFYSA-N 453.882 5.215 5 20 JKBD CC[C@H](C)Sc1ccc(NC(=O)C(=O)N[C@H](C)c2cccc([N+](=O)[O-])c2)c(C(F)(F)F)c1 501442867 UREXANNUXAHROT-QWHCGFSZSA-N 469.485 5.320 5 20 JKBD CCOc1cc([N+](=O)[O-])c(C(=O)Nc2cc(CC(C)(C)C)nn2-c2ccccc2)cc1OC 503424526 FTENLILAFAEHIF-UHFFFAOYSA-N 452.511 5.029 5 20 JKBD Cc1csc(Sc2ccc(C(=O)Nc3cccc(OCc4cscn4)c3)cc2[N+](=O)[O-])n1 505028342 CBZFPUWBFIWMRT-UHFFFAOYSA-N 484.584 5.799 5 20 JKBD CC[C@H](NCc1cc(OC)c(OCc2ccccc2)cc1[N+](=O)[O-])c1ccc2c(c1)OCCO2 509582489 HKRZOFWXZWTFLD-NRFANRHFSA-N 464.518 5.195 5 20 JKBD COc1cc(C(=O)Nc2ccc(Br)cc2Cl)c([N+](=O)[O-])cc1OCc1cscn1 512384762 VYYGHUCKVLBMPS-UHFFFAOYSA-N 498.742 5.307 5 20 JKBD Cc1csc(Sc2ccc(C(=O)N[C@H](c3nc(-c4ccncc4)no3)C(C)C)cc2[N+](=O)[O-])n1 522507242 DNRJLBKGTOJVRR-SFHVURJKSA-N 496.574 5.083 5 20 JKBD CC(C)CCN1Cc2cccc(N[C@H](C)C(=O)Nc3ccc([N+](=O)[O-])cc3C(F)(F)F)c2C1 524405174 FPWGPHFBBXVUGY-OAHLLOKOSA-N 464.488 5.414 5 20 JKBD COc1ccc(CSCC(=O)N2CCC(Oc3ccc(C(C)C)cc3)CC2)cc1[N+](=O)[O-] 603814602 YBHOMSUBQMJLDB-UHFFFAOYSA-N 458.580 5.030 5 20 JKBD O=C(Nc1nc(-c2ccc3c(c2)Cc2ccccc2-3)cs1)c1ccc(-n2cncn2)c([N+](=O)[O-])c1 603965939 SBPAOXJBZWZXEQ-UHFFFAOYSA-N 480.509 5.123 5 20 JKBD O=C(OC[C@H]1CCCN1C(=O)c1ccccc1[N+](=O)[O-])c1nc(-c2ccccc2)oc1-c1ccccc1 731414492 UEIAMWYQXZDVTG-OAQYLSRUSA-N 497.507 5.378 5 20 JKBD Cc1ccc(-c2nc(C)c(C(=O)OCc3nc(-c4cccc([N+](=O)[O-])c4)no3)s2)c(C)c1 746595505 FCDUOMJONXXMMQ-UHFFFAOYSA-N 450.476 5.051 5 20 JKBD Cc1ccc(-c2nc(C)c(C(=O)OCC(=O)Nc3ccc([N+](=O)[O-])cc3C(F)(F)F)s2)c(C)c1 746596812 JESGGBIVMUKYKT-UHFFFAOYSA-N 493.463 5.458 5 20 JKBD O=C1/C(=C\c2ccc(-c3cccc([N+](=O)[O-])c3)o2)NC(=S)N1c1ccccc1C(F)(F)F 747970844 UNMXHQLYQHCCQQ-LFIBNONCSA-N 459.405 5.136 5 20 JKBD CC[C@H](C)NC(=S)/C(=C(/O)c1ccc(C)c([N+](=O)[O-])c1)[n+]1ccc(Cc2ccccc2)cc1 749885128 FGHAFMYPYWQESC-IBGZPJMESA-O 462.595 5.381 5 20 JKBD CC(C)(C)OC(=O)N1CCC[C@H](CNC(=O)c2cc([N+](=O)[O-])ccc2Sc2ccccc2)C1 751162069 HVYDZITXPCRGNM-QGZVFWFLSA-N 471.579 5.123 5 20 JKBD CN(Cc1cc([N+](=O)[O-])ccc1Cl)C(=O)COc1ccc(C2SCCCS2)cc1 758851236 IOASWWWBADAHIR-UHFFFAOYSA-N 452.985 5.154 5 20 JKBD CCOc1ccc(-c2nc(COC(=O)Cn3c4ccccc4c(=O)c4ccccc43)cs2)cc1 841979188 PHFLKVHYFKWQTH-UHFFFAOYSA-N 470.550 5.420 5 20 JKBD C[C@@H](Nc1ccc(-c2nc(C3(NC(=O)OC(C)(C)C)CCCC3)no2)cc1[N+](=O)[O-])c1ccccn1 904416817 WGLIYODXCXAKER-MRXNPFEDSA-N 494.552 5.507 5 20 JKBD Cc1cc([N+](=O)[O-])nn1Cc1cccc(-c2nc(-c3cccnc3Oc3ccccc3)no2)c1 904453607 FQFSFWCCMBEOJU-UHFFFAOYSA-N 454.446 5.052 5 20 JKBD COc1cccc(CO[C@H](C)C(=O)Oc2ccc(NC(=O)c3cc([N+](=O)[O-])ccc3Cl)cc2)c1 915274998 QLYUHSMTZSJZPI-OAHLLOKOSA-N 484.892 5.020 5 20 JKBD Cc1cccc(-c2noc(COC(=O)c3ccccc3NC(=O)c3ccc([N+](=O)[O-])cc3Cl)n2)c1 915377103 QFZSISGSRDVOEW-UHFFFAOYSA-N 492.875 5.216 5 20 JKBD COc1cc(OC)cc(C(=O)N2CCC(C(=O)OCc3nc4ccccc4c4ccccc34)CC2)c1 915527815 CAPUBCDQWXUYMS-UHFFFAOYSA-N 484.552 5.001 5 20 JKBD CCOc1ccc(-n2c(SCc3cc(F)ccc3[N+](=O)[O-])nnc2-c2ccncc2)cc1 915792495 INEWFGTUCGCKFH-UHFFFAOYSA-N 451.483 5.068 5 20 JKBD Cc1nc2cc(F)cc(C(=O)Oc3ccc(NC(=O)c4cc([N+](=O)[O-])ccc4Cl)cc3)c2nc1C 916950711 AOIXOPQDFBVSHE-UHFFFAOYSA-N 494.866 5.419 5 20 JKBD CC(C)N(Cc1nnc(-c2cccc([N+](=O)[O-])c2)o1)C(=O)c1ccc(NC(=O)c2cccs2)cc1 917513262 USZQTQYKJDFJTJ-UHFFFAOYSA-N 491.529 5.009 5 20 JKBD C[C@H](NC(=O)c1cc([N+](=O)[O-])ccc1N1CCC(Cc2ccccc2)CC1)c1ccc2c(c1)CC(=O)N2 918634878 UDPKVKHTKVRXCK-IBGZPJMESA-N 498.583 5.040 5 20 JKBD C[C@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)OCc1nnc(-c2ccc(Cl)cc2Cl)o1 920498827 DOGKTEFXAAEYJQ-JTQLQIEISA-N 454.291 5.176 5 20 JKBD Cc1cccc(C(C)C)c1NC(=O)[C@H](C)OC(=O)c1ccc(N[C@H](C)c2ccccn2)c([N+](=O)[O-])c1 920544878 MYLADRKKTAHFFN-MOPGFXCFSA-N 490.560 5.779 5 20 JKBD CC1=C(C(=O)Nc2cccc([N+](=O)[O-])c2)[C@H](c2ccc(O)c(Cl)c2)NC(=S)N1c1ccccc1 921294341 HGHSHMOFYYMSME-QFIPXVFZSA-N 494.960 5.302 5 20 JKBD CCOc1ccsc1C(=O)Nc1ccc(C2(NC(=O)/C=C/c3ccc([N+](=O)[O-])o3)CCC2)cc1 1785770728 NIYPVXBATSPILS-CSKARUKUSA-N 481.530 5.109 5 20 JKBD Cc1c[nH]cc1C(=O)NC1(c2ccc(NC(=O)c3cccc(Br)c3[N+](=O)[O-])cc2)CCC1 1790751928 PQNXAEXULLTYEK-UHFFFAOYSA-N 497.349 5.055 5 20 JKBD O=C(Cc1cccc([N+](=O)[O-])c1)NC1(c2ccc(NC(=O)c3cc4ccsc4[nH]3)cc2)CCC1 1790876194 XRNONTASXYOFME-UHFFFAOYSA-N 474.542 5.128 5 20 JKBD Cc1cc(O)c([N+](=O)[O-])cc1C(=O)NC1(c2ccc(NC(=O)C[C@H]3C[C@@H]4CC[C@H]3C4)cc2)CCC1 1791325626 QMDVQFXPHOTLOS-CEXWTWQISA-N 477.561 5.183 5 20 JKBD CCC[C@H]1CC[C@H](C(=O)N2CCC3(CCCN(C(=O)/C=C/c4ccc([N+](=O)[O-])o4)C3)CC2)CC1 1805685631 LPLHHTCYTIPAKU-NTPWCUEWSA-N 471.598 5.039 5 20 JKBD C[C@H](Sc1nnc(-c2ccccc2Cl)n1C)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 9810102 ZAIRDXDFXMSFSH-JTQLQIEISA-N 485.875 5.182 5 20 JKBD CC(=O)Nc1ccc(-c2csc(NC(=O)c3cc4cc([N+](=O)[O-])ccc4s3)n2)c(F)c1 10994071 NSSJSGZUQBJJCG-UHFFFAOYSA-N 456.480 5.283 5 20 JKBD Cc1ccc(C)c(Sc2ccc(NC(=O)c3ccc(S(C)(=O)=O)c([N+](=O)[O-])c3)cc2)c1 14820185 WHIZWZLRRFESFT-UHFFFAOYSA-N 456.545 5.019 5 20 JKBD O=[N+]([O-])c1cccc(OC[C@H](O)CSc2nnc(-c3ccccc3Cl)n2C2CCCC2)c1 15237021 CYOVSTAGVSKURO-KRWDZBQOSA-N 474.970 5.154 5 20 JKBD CC(=O)CCc1ccc2oc(C(=O)O[C@@H](C)c3nnc(-c4ccc([N+](=O)[O-])cc4)o3)c(C)c2c1 17662586 MLYJWWJRPFWROQ-HNNXBMFYSA-N 463.446 5.139 5 20 JKBD Cc1cccc([N+](=O)[O-])c1NC(=O)CSc1nnc(-c2ccccc2Cl)n1Cc1ccccc1 20888805 HWLUMBDFBMEPCI-UHFFFAOYSA-N 493.976 5.594 5 20 JKBD Cn1cnnc1Sc1ccc(C(=O)Nc2ccccc2SC2CCCC2)cc1[N+](=O)[O-] 25268159 AQKWZODXPVWBBX-UHFFFAOYSA-N 455.565 5.162 5 20 JKBD NC(=O)c1cc(NC(=O)c2ccccc2Sc2ccc(C(F)(F)F)cc2[N+](=O)[O-])ccc1Cl 29018065 FUUMJXSWSSZVPN-UHFFFAOYSA-N 495.866 5.769 5 20 JKBD O=C(Nc1ccc(NC(=O)[C@H]2CCCO2)cc1)c1cc([N+](=O)[O-])ccc1Sc1ccc(Cl)cc1 30507299 UOXCBBZNECGIPQ-OAQYLSRUSA-N 497.960 5.769 5 20 JKBD O=C(Nc1cccc(C(F)(F)F)c1)c1cccc(NC(=O)c2cnn(-c3ccc([N+](=O)[O-])cc3)c2)c1 107513625 BYYFPJDJMABHRW-UHFFFAOYSA-N 495.417 5.304 5 20 JKBD C[C@H]1CCCN(c2ccc(C(=O)Nc3ccc(Sc4nncs4)cc3)cc2[N+](=O)[O-])C1 117352945 GECJYTFAWKWPOI-AWEZNQCLSA-N 455.565 5.086 5 20 JKBD C[C@H](NCc1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1)c1ccc2c(c1)OCCO2 215863385 LGDZMEPLNFXDGY-SFHVURJKSA-N 456.502 5.070 5 20 JKBD COCCSc1ccc([C@H](C)Nc2ccc(S(=O)(=O)Nc3ccccc3)cc2[N+](=O)[O-])cc1 505615300 SNAKQGNJBBQOGY-KRWDZBQOSA-N 487.603 5.307 5 20 JKBD CCc1ccc(Cl)c(CC)c1NC(=O)c1ccc([N+](=O)[O-])cc1I 508927413 YRQHRGHYJXSKJI-UHFFFAOYSA-N 458.683 5.230 5 20 JKBD Cn1ccnc1[C@@H](NCc1ccc(Oc2ccccc2Cl)c([N+](=O)[O-])c1)c1ccccc1F 509599005 DSKWRMUWOFLCGX-QHCPKHFHSA-N 466.900 5.792 5 20 JKBD CN(C)C(=O)c1ccc(NC(=O)c2ccc(NCc3ccccc3Cl)c([N+](=O)[O-])c2)cc1Cl 510176496 PGOCSXIVSDULOZ-UHFFFAOYSA-N 487.343 5.468 5 20 JKBD CCOc1cc(C(=O)Nc2ccc(N(C)C(=O)c3ccc(Cl)cc3)cc2)c([N+](=O)[O-])cc1OC 512839554 SKVRVGQCVLMSOF-UHFFFAOYSA-N 483.908 5.184 5 20 JKBD O=C(Nc1cc(-c2nnc3n2CCCCC3)ccc1Cl)c1cc2cc([N+](=O)[O-])ccc2o1 514432107 VGVCCUCRAOQRRG-UHFFFAOYSA-N 451.870 5.232 5 20 JKBD COc1ccc([N+](=O)[O-])cc1NC(=O)[C@@H](Oc1ccc(Br)cc1)c1ccccc1 515160472 RRORGPYUEXMZCX-FQEVSTJZSA-N 457.280 5.125 5 20 JKBD CCN(CC)C(=O)c1ccc(CNCc2ccc(Sc3ccc(C)cc3)c([N+](=O)[O-])c2)cc1 521821908 DUGMCUNJGLXJBQ-UHFFFAOYSA-N 463.603 5.826 5 20 JKBD COc1cc(CNC[C@H]2CCCO[C@@H]2c2ccccc2)ccc1OCc1ccc([N+](=O)[O-])cc1 524680560 GATUSBNBWTZRJG-YIXXDRMTSA-N 462.546 5.440 5 20 JKBD Cc1ccc([C@H](C)N[C@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Br)c2ccccc2)cc1 604047596 KLNDJLPDYRTALK-AOMKIAJQSA-N 468.351 5.696 5 20 JKBD COc1ccc(N(C)C(=O)C/C(=C\c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)cc1OC 604440206 YHAAJHABIJABAV-NBVRZTHBSA-N 489.553 5.815 5 20 JKBD COc1cc(C(=O)N[C@H]2CCOc3c(OC)cccc32)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 604570644 GTSRCSGJVZNBPZ-KRWDZBQOSA-N 484.892 5.311 5 20 JKBD C[C@H](Nc1ccc(C(=O)N2CCO[C@H](c3ccc(F)c(Cl)c3)C2)cc1[N+](=O)[O-])c1ccccn1 608963059 OPOISHSSGSBTGI-WNSKOXEYSA-N 484.915 5.169 5 20 JKBD Cc1ccccc1[C@@H]1CCN(C(=O)c2ccc(C(=O)N3CC[C@@H](c4ccccc4C)C3)c([N+](=O)[O-])c2)C1 609044646 JWXNEVDVXYRJMY-DNQXCXABSA-N 497.595 5.471 5 20 JKBD COc1ccc(C[C@H](N[C@@H](C)C(=O)Nc2cc([N+](=O)[O-])ccc2Cl)c2ccccc2)cc1OC 727464517 TYVWSALCLNAARL-KKSFZXQISA-N 483.952 5.166 5 20 JKBD O=C(Nc1cccc(C(=O)N(CC2CC2)c2ccc(Cl)c([N+](=O)[O-])c2)c1)c1ccc(F)cc1 728165676 OXMMHJUEZLXDLN-UHFFFAOYSA-N 467.884 5.696 5 20 JKBD O=C(Nc1cc(Cl)c([N+](=O)[O-])cc1OCc1ccccc1)c1cnc(-c2ccco2)s1 728804837 BZRGQQVCFYMSHA-UHFFFAOYSA-N 455.879 5.796 5 20 JKBD O=C(N[C@@H](c1ccccc1)c1ccc2c(c1)CCCO2)c1cc([N+](=O)[O-])ccc1Br 730504650 ZYRUHIODNXGSDK-QFIPXVFZSA-N 467.319 5.202 5 20 JKBD CC(=O)N(c1ccc(Cl)cc1)c1nc(COC(=O)Cn2ccc3cc([N+](=O)[O-])ccc32)cs1 744614645 LYDQIIZRCWUQBO-UHFFFAOYSA-N 484.921 5.087 5 20 JKBD Cc1cc(SC(C)(C)C)ccc1NC(=O)c1ccc(Sc2nncn2C)c([N+](=O)[O-])c1 751255283 OIZWJMLIAADHDT-UHFFFAOYSA-N 457.581 5.326 5 20 JKBD NC(=O)c1ccc(COC(=O)c2c3c(nc4ccccc24)/C(=C\c2cccs2)CC3)c([N+](=O)[O-])c1 784775187 VXIMWJBUXNOTIY-QINSGFPZSA-N 485.521 5.147 5 20 JKBD CC(C)Cn1cc([C@H]2N(c3ccc([N+](=O)[O-])c(-c4ccc(F)cc4)n3)CC23CCOCC3)cn1 849478309 ICYKHRHOQMVFGK-XMMPIXPASA-N 465.529 5.007 5 20 JKBD COc1cc(CNc2cc(C(=O)N(C)C)ccc2Cl)ccc1OCc1ccc([N+](=O)[O-])cc1 863995936 KSFONRJSNLAICB-UHFFFAOYSA-N 469.925 5.150 5 20 JKBD C[C@@H](Oc1ccc(Cl)cc1[N+](=O)[O-])c1nc(-c2ccc(OCc3cccnc3)cc2)no1 904466498 RXCNYLLURZJFAS-CQSZACIVSA-N 452.854 5.412 5 20 JKBD O=C(Nc1cccc(COCC(F)(F)C(F)F)c1)c1ccc(Br)c([N+](=O)[O-])c1 916476494 IHKWAGHVCKLSJC-UHFFFAOYSA-N 465.197 5.027 5 20 JKBD C[C@@H](OC(=O)CCn1c2ccccc2c2ccccc21)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 919301145 ZAZKXGRGCLVWCZ-MRXNPFEDSA-N 456.458 5.447 5 20 JKBD O=C(Nc1ccc(OC(=O)C2(c3ccc(F)cc3)CCOCC2)cc1)c1cc([N+](=O)[O-])ccc1Cl 919976356 KVFRDAFUIURGFC-UHFFFAOYSA-N 498.894 5.293 5 20 JKBD O=C(/C=C/c1ccc([N+](=O)[O-])o1)NC1(c2ccc(NC(=O)c3ccnc4ccccc34)cc2)CCC1 1788888136 GSNXAOMDQGLXDB-ZRDIBKRKSA-N 482.496 5.197 5 20 JKBD COc1ccccc1C(=O)Nc1ccc(C2(NC(=O)CSc3ccccc3[N+](=O)[O-])CCC2)cc1 1790232319 PKPSITUBBMAOFM-UHFFFAOYSA-N 491.569 5.143 5 20 JKBD O=C(/C=C/c1ccc([N+](=O)[O-])o1)NC1(c2ccc(NC(=O)C[C@H]3C[C@@H]4CC[C@H]3C4)cc2)CCC1 1791320271 FOFHPMNPOUGOFY-LMMUQKOOSA-N 463.534 5.161 5 20 JKBD CC(C)Cc1ccc(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)/C=C/c3ccc([N+](=O)[O-])o3)n[nH]2)cc1 1814969139 ABHKRWSMYIFRQO-RSNBEDGSSA-N 491.548 5.129 5 20 JKBD O=C(Cc1ccsc1)Nc1cc([C@@H]2CCCCN2C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)[nH]n1 1817586798 VHQMDLGMCXGQPR-SFHVURJKSA-N 495.586 5.143 5 20 JKBD O=C(c1cccc2ccoc12)N1CCC([C@H]2CCCCN2C(=O)CCc2cccc([N+](=O)[O-])c2)CC1 1824843126 OTCQXLUGSYUECS-RUZDIDTESA-N 489.572 5.207 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)N1CCC([C@@H]2CCCCN2C(=O)CCCC(F)(F)F)CC1 1824874050 NUHGITJPBXOTIB-IBGZPJMESA-N 487.494 5.008 5 20 JKBD C[C@@H]1CCC[C@@H]1C(=O)N1CCC([C@H]2CCCCN2C(=O)C2(c3cccc([N+](=O)[O-])c3)CCC2)CC1 1830293228 WVVBIWGOGLJLQV-DCEDVJGZSA-N 481.637 5.072 5 20 JKBD O=C(Cc1ccccc1)N1CCC([C@@H]2CCCCN2C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)CC1 1831061785 ZFUWSFZDJOQDDW-QHCPKHFHSA-N 491.613 5.286 5 20 JKBD O=C(c1cccc(F)c1[N+](=O)[O-])N1CCC([C@@H]2CCCCN2C(=O)c2ccccc2C2CC2)CC1 1832556160 TYDHQEYBDSQJHK-DEOSSOPVSA-N 479.552 5.158 5 20 JKBD O=C(/C=C/c1ccccc1[N+](=O)[O-])N1CCC([C@H]2CCCCN2C(=O)c2ccccc2C2CC2)CC1 1832558161 RURCKGHGFFXSAD-ZUSJUXBOSA-N 487.600 5.419 5 20 JKBD Cn1c(SCC(=O)Nc2cc([N+](=O)[O-])ccc2Cl)nnc1-c1ccc(C(C)(C)C)cc1 14101421 YCWKMZXPZBBFGD-UHFFFAOYSA-N 459.959 5.072 5 20 JKBD O=C(Nc1cccc(S(=O)(=O)Nc2cccc(C(F)(F)F)c2)c1)c1ccc(Cl)cc1[N+](=O)[O-] 15437831 DXLOZBXLZKIFJG-UHFFFAOYSA-N 499.854 5.320 5 20 JKBD Cc1nc(CSc2ccc(C(=O)O[C@@H](C)C(=O)Nc3cccc([N+](=O)[O-])c3C)cc2)cs1 28895283 XVIHGGGFOUCQSY-AWEZNQCLSA-N 471.560 5.144 5 20 JKBD CCOc1cc(C(=O)Nc2ccccc2NC(=O)c2ccc(C(C)(C)C)cc2)c([N+](=O)[O-])cc1OC 107743916 OJWYJBKMSXRHQQ-UHFFFAOYSA-N 491.544 5.804 5 20 JKBD COC(=O)c1cc(C(=O)Nc2ccccc2Oc2ncc(Cl)cc2Cl)cc([N+](=O)[O-])c1 107810332 SEJJUZZOLCDHFZ-UHFFFAOYSA-N 462.245 5.128 5 20 JKBD Cc1cc(NC(=O)c2sc3nc(C(F)(F)F)ccc3c2C)n(-c2ccc([N+](=O)[O-])cc2)n1 195531836 QWEABXJTXBCYTC-UHFFFAOYSA-N 461.425 5.278 5 20 JKBD O=C(Nc1cccc(N2CCNC2=O)c1)c1ccc(Sc2nc3ccccc3s2)c([N+](=O)[O-])c1 482364567 KXDGADMDHNAWKL-UHFFFAOYSA-N 491.554 5.138 5 20 JKBD C[C@@H](NC(=O)c1cc([N+](=O)[O-])ccc1Sc1ccccc1)c1ccc(NC(=O)NC2CC2)cc1 483265965 GXXIBYZTZAXBDZ-MRXNPFEDSA-N 476.558 5.521 5 20 JKBD CCN(C(=O)c1cc(OC)c(OC)cc1[N+](=O)[O-])[C@H]1CCSc2ccc(Br)cc21 504650453 OGVNXMXNCNKGIU-HNNXBMFYSA-N 481.368 5.074 5 20 JKBD O=C(CCc1ccccc1)N1CCC(NCc2ccc(Oc3ccccc3Cl)c([N+](=O)[O-])c2)CC1 507923044 LXFKDFAHHGSHLL-UHFFFAOYSA-N 493.991 5.754 5 20 JKBD CCc1oc2ccccc2c1CN(C)C(=O)c1cc(OC)c(OCc2cscn2)cc1[N+](=O)[O-] 509863395 JKWJDNYAPGUBQP-UHFFFAOYSA-N 481.530 5.220 5 20 JKBD C[C@H](NC(=O)Nc1cc([N+](=O)[O-])ccc1OC(F)F)c1cccc(OCc2ccccn2)c1 510865614 JTFCNBYJTBXECZ-AWEZNQCLSA-N 458.421 5.053 5 20 JKBD O=C(NCc1cccc(COCc2ccccc2)c1)Nc1cc([N+](=O)[O-])ccc1OC(F)F 510867896 JSZSONKCDQEVTQ-UHFFFAOYSA-N 457.433 5.235 5 20 JKBD COc1cc(C(=O)N(Cc2ccc3ccccc3c2)C2CC2)c([N+](=O)[O-])cc1OCc1cscn1 512405361 YYOBPSSDTUCXSI-UHFFFAOYSA-N 489.553 5.597 5 20 JKBD CC(C)OCc1cccc(N[C@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Br)c2ccccc2)c1 516378666 SSAUXKFPWCXPHT-QHCPKHFHSA-N 498.377 6.074 5 20 JKBD CCCS(=O)(=O)Nc1cccc(NC(=O)c2ccc(Sc3ccc(C)cc3)c([N+](=O)[O-])c2)c1C 518863045 MBPUWOFTOOATEP-UHFFFAOYSA-N 499.614 5.767 5 20 JKBD Cc1sc(NC(=O)Cn2c3ccccc3c(=O)c3ccccc32)nc1-c1cccc(Cl)c1 567068395 YCIXTUWUAZBEPF-UHFFFAOYSA-N 459.958 5.879 5 20 JKBD COc1ccc(C(=O)Nc2nc(C)c(-c3nc4ccccc4n3C(F)F)s2)cc1[N+](=O)[O-] 591545541 QOHFOLRDHYVVTD-UHFFFAOYSA-N 459.434 5.032 5 20 JKBD O=C1CCCN1C[C@H](NCc1ccc(-c2ccccc2[N+](=O)[O-])s1)c1cccc(C(F)(F)F)c1 608835978 DTNCTQUHUOVFOP-FQEVSTJZSA-N 489.519 5.795 5 20 JKBD O=C(Nc1ccccc1C(=O)Nc1ccc(Cl)cn1)c1cc2cc([N+](=O)[O-])ccc2s1 726530455 KBPOXWDAJBHLCI-UHFFFAOYSA-N 452.879 5.363 5 20 JKBD C[C@H]1CN(c2ccc(NC(=O)c3ccc([N+](=O)[O-])cc3Cl)cc2C(F)(F)F)C[C@H](C)O1 728010744 JSUQUKZNPLVWBW-RYUDHWBXSA-N 457.836 5.133 5 20 JKBD CC(C)N(Cc1nnc(-c2ccccc2Cl)o1)C(=O)c1cc([N+](=O)[O-])ccc1Br 751053441 BHTMOSQVMDDOEY-UHFFFAOYSA-N 479.718 5.112 5 20 JKBD COc1cccc(-c2cc(NC(=O)c3cc([N+](=O)[O-])ccc3Br)n(-c3ccccc3)n2)c1 751087018 NUWFRGICIJKFSX-UHFFFAOYSA-N 493.317 5.471 5 20 JKBD COC1(c2noc(C/C(=C/c3ccc([N+](=O)[O-])cc3)c3nc4ccccc4s3)n2)CCCC1 904832793 BHKNOOGCBHSBKW-VKAVYKQESA-N 462.531 5.787 5 20 JKBD O=[N+]([O-])c1cc(C(F)(F)F)cc([N+](=O)[O-])c1NCc1ccc(COCC(F)(F)F)cc1 917034915 NQQFYWAWPCZZJV-UHFFFAOYSA-N 453.295 5.213 5 20 JKBD O=C(Nc1cccc(Cl)c1)c1ccccc1NC(=O)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-] 918551109 ZJQTYAWVRYTBFC-UHFFFAOYSA-N 493.825 5.694 5 20 JKBD O=C(Nc1ccccc1C(=O)NCc1cc(Br)cs1)c1ccc([N+](=O)[O-])cc1Cl 918603831 RJLMDOGJKHYPCT-UHFFFAOYSA-N 494.754 5.255 5 20 JKBD O=C(Nc1ccc(OC[C@@H](O)c2ccccc2C(F)(F)F)cc1)c1cc([N+](=O)[O-])ccc1Cl 918750096 IMRNTXNFMHDNBC-HXUWFJFHSA-N 480.826 5.632 5 20 JKBD CC(C)c1ccccc1NC(=O)[C@H](C)OC(=O)c1ccc(N[C@H](C)c2ccccn2)c([N+](=O)[O-])c1 920548785 SQEFVXMHZIKGAI-MSOLQXFVSA-N 476.533 5.470 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)[C@H]3CC[C@H](C(F)(F)F)CC3)CCC2)cc1)c1ccc([N+](=O)[O-])o1 1785752778 NUAGWHHVHXSLPZ-KOMQPUFPSA-N 479.455 5.304 5 20 JKBD O=C(/C=C/c1ccccc1[N+](=O)[O-])NC1(c2ccc(NC(=O)c3ccc(Cl)cn3)cc2)CCC1 1789735821 SXNRSDPSMBARKR-AWNIVKPZSA-N 476.920 5.104 5 20 JKBD Cc1ccc(SCC(=O)NC2(c3ccc(NC(=O)c4cc(O)cc([N+](=O)[O-])c4)cc3)CCC2)cc1 1790756140 OEYVBEDGTVRQCJ-UHFFFAOYSA-N 491.569 5.149 5 20 JKBD Cc1c(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2ccc(Cl)c(Cl)c2)C3)cc(Cl)cc1[N+](=O)[O-] 1800711698 QFUKNQLDABNZGW-MUJYYYPQSA-N 496.778 5.429 5 20 JKBD CC(C)(C)CCCCCC(=O)N1CC[C@H](CNC(=O)/C=C/c2ccc([N+](=O)[O-])o2)[C@@H]1c1cccnc1 1803263572 CCDXQMFRKNSIRX-FOVHPINOSA-N 496.608 5.299 5 20 JKBD Cc1c(C(=O)N2CC[C@H](CNC(=O)CCC3CCCC3)[C@@H]2c2cccnc2)cc(Cl)cc1[N+](=O)[O-] 1806207071 OLZJWPOLUUBFTG-NLFFAJNJSA-N 499.011 5.242 5 20 JKBD Cc1ccc(C(=O)N2CCC([C@H]3CCCCN3C(=O)CCCc3cc(C)c(F)cc3[N+](=O)[O-])CC2)o1 1824369852 AOYOXAULQGCWTE-HSZRJFAPSA-N 499.583 5.200 5 20 JKBD Cc1ccc(C(=O)N2CCC([C@@H]3CCCCN3C(=O)c3ccc([N+](=O)[O-])cc3F)CC2)c(Cl)c1 1830497259 BYNCRMFUVYDRSS-QHCPKHFHSA-N 487.959 5.243 5 20 JKBD O=C(c1cccc(F)c1[N+](=O)[O-])N1CCCC[C@@H]1C1CCN(C(=O)C2(c3ccccc3)CCC2)CC1 1830622820 OBLXHLVCRBQDIQ-XMMPIXPASA-N 493.579 5.089 5 20 JKBD Cc1cc(O)c([N+](=O)[O-])cc1C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2ccccc2C2CC2)CC1 1830792247 KBMJJHYDOJMCSL-DEOSSOPVSA-N 491.588 5.033 5 20 JKBD CC[C@H](C(=O)N1CCC([C@@H]2CCCCN2C(=O)Cc2ccc([N+](=O)[O-])cc2F)CC1)c1ccccc1 1831290789 HKDPTULKHATOKF-AHWVRZQESA-N 495.595 5.090 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)N1CCC([C@H]2CCCCN2C(=O)[C@H]2CCc3ccccc32)CC1 1831980471 LHAIJQVUQYMEMU-WIOPSUGQSA-N 493.579 5.006 5 20 JKBD O=C(c1cc2sccc2[nH]1)N1CCC([C@H]2CCCCN2C(=O)/C=C/c2ccccc2[N+](=O)[O-])CC1 1832903638 FKIDQVMYAIPRBT-HYGBKTPJSA-N 492.601 5.084 5 20 JKBD CCn1c(S[C@@H](C(=O)Nc2ccc(C)cc2[N+](=O)[O-])c2ccccc2)nnc1-c1ccco1 8619978 HCBDAPJHSURGKT-HXUWFJFHSA-N 463.519 5.247 5 20 JKBD C[C@H](OC(=O)Cn1c2ccccc2c(=O)c2ccccc21)C(=O)N[C@@H](C)c1ccc(Cl)cc1Cl 10722923 RGMZHLQTSCSZMI-HOTGVXAUSA-N 497.378 5.271 5 20 JKBD C[C@@H](OC(=O)c1ccccc1Cc1ccccc1)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 11399154 YUJSKMJAQGCWTO-OAHLLOKOSA-N 472.419 5.388 5 20 JKBD COc1cc(C(=O)N(C)Cc2ccc3c(c2)OCCO3)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 15620298 GHHDMPICAFTYIC-UHFFFAOYSA-N 484.892 5.093 5 20 JKBD Cc1nc(-c2cccc(NC(=O)CSc3nc4cc5ccccc5cc4c(=O)n3C)c2)cs1 22254731 OHJANNFUPOTTEM-UHFFFAOYSA-N 472.595 5.249 5 20 JKBD O=C(c1cc([N+](=O)[O-])ccc1Sc1ccc(Cl)cc1)N1CCC(c2nnc3ccccn23)CC1 28734675 RCBLUPJZVKRBLM-UHFFFAOYSA-N 493.976 5.462 5 20 JKBD O=C(Nc1ccc(Cl)c(-c2nnc3n2CCCCC3)c1)C1CCN(c2ccccc2[N+](=O)[O-])CC1 29710883 SJJBDLQFELFNEG-UHFFFAOYSA-N 494.983 5.088 5 20 JKBD CCCCCNC(=O)C1CCN(C(=O)c2ccc(Sc3ccc(C)cc3)c([N+](=O)[O-])c2)CC1 32706598 SYBQIADHQTVCTH-UHFFFAOYSA-N 469.607 5.213 5 20 JKBD Cc1cc(C)n(-c2ccc(C(F)(F)F)cc2NC(=O)Cn2c3ccccc3c(=O)c3ccccc32)n1 69623215 DHAHBRYWASCGKF-UHFFFAOYSA-N 490.485 5.615 5 20 JKBD CN(C)C(=O)Sc1ccccc1NC(=O)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 110645911 IVWJMVUJSASJGX-UHFFFAOYSA-N 496.511 5.242 5 20 JKBD Cc1nccc(-c2cccc(NC(=O)c3ccc(N[C@@H](C)c4ccccn4)c([N+](=O)[O-])c3)c2)n1 115711314 LLQBDHQMOHROKT-INIZCTEOSA-N 454.490 5.181 5 20 JKBD C[C@H](Nc1ccc(C(=O)Nc2ncc(Cc3ccc(F)cc3)s2)cc1[N+](=O)[O-])c1ccccn1 410016149 QSFNWKCQLAPYAQ-HNNXBMFYSA-N 477.521 5.602 5 20 JKBD COc1ccc(CSCC(=O)N[C@H](c2ccccc2)c2ccc3c(c2)CCCO3)cc1[N+](=O)[O-] 410036959 FHBDILVOPXDBJS-AREMUKBSSA-N 478.570 5.067 5 20 JKBD Cc1cc(NC(=O)c2cc([N+](=O)[O-])ccc2NCc2ccccc2)ccc1NC(=O)c1ccco1 490182550 PIIJYGDIJNEWIB-UHFFFAOYSA-N 470.485 5.613 5 20 JKBD Cc1nn(C(C)(C)C)c2nc(C(C)C)cc(C(=O)Nc3cc(-c4cccc([N+](=O)[O-])c4)[nH]n3)c12 499020755 SIMYBFPTBFWRAW-UHFFFAOYSA-N 461.526 5.169 5 20 JKBD CC(C)c1ccc(-c2nc(C[S@](=O)Cc3cc([N+](=O)[O-])cc4c3OCOC4)cs2)cc1 501258952 ADBORXCPLQGRSD-WJOKGBTCSA-N 458.561 5.157 5 20 JKBD CCCN(C(=O)c1ccc(Sc2nc(C)cs2)c([N+](=O)[O-])c1)[C@@H](C)C(=O)Nc1ccccc1 502711643 JAGMZQHYHAYTSN-INIZCTEOSA-N 484.603 5.390 5 20 JKBD O=C(Cn1c2ccccc2c(=O)c2ccccc21)Nc1cc(C(=O)Nc2ccccc2)ccc1Cl 502713011 UDXSIPBMKRFZHP-UHFFFAOYSA-N 481.939 5.699 5 20 JKBD Cn1cc(C(=O)Nc2ccc(-c3nc4ccccc4s3)cc2)c(-c2ccc([N+](=O)[O-])cc2)n1 506016558 IXPFPJJQAMSLTN-UHFFFAOYSA-N 455.499 5.524 5 20 JKBD COc1cc([C@H](C)NC(=O)c2ccc(N[C@@H](C)c3ccccn3)c([N+](=O)[O-])c2)ccc1OC(C)C 506249148 RJOYMHOVZMDDND-ROUUACIJSA-N 478.549 5.450 5 20 JKBD O=C(NCC1(c2cccc(C(F)(F)F)c2)CCOCC1)c1cc2cc([N+](=O)[O-])ccc2s1 507901406 IGHSNKNROGGHBP-UHFFFAOYSA-N 464.465 5.307 5 20 JKBD CC[C@H](C)n1ncc2c(C(=O)Nc3nc(-c4cccc([N+](=O)[O-])c4)c(C)s3)cc(C)nc21 508953198 WTWNWFVILJNAHC-ZDUSSCGKSA-N 450.524 5.303 5 20 JKBD CC(C)NC(=O)Nc1ccc(CNCc2ccc(Oc3ccccc3Cl)c([N+](=O)[O-])c2)cc1 509604411 YSPWBSQMBWIWRK-UHFFFAOYSA-N 468.941 5.860 5 20 JKBD COc1cc(C(=O)N(C)Cc2ccc(Cl)c(Cl)c2)c([N+](=O)[O-])cc1OCc1cscn1 509866018 PTSNSLRWEOFNCV-UHFFFAOYSA-N 482.345 5.218 5 20 JKBD Cc1cc(C(=O)N2CCC[C@H](C)C2)ccc1NC(=O)c1ccc(N2CCC[C@H](C)C2)c([N+](=O)[O-])c1 519023871 MHHFIURXNKGTMY-OALUTQOASA-N 478.593 5.264 5 20 JKBD CCOc1cc(NC(=O)c2sc(-c3ccc(Cl)s3)nc2C)c([N+](=O)[O-])cc1OCC 519974698 QGHBWYYATLKMIX-UHFFFAOYSA-N 467.956 5.791 5 20 JKBD O=C(Nc1ccc(Oc2ccccc2C(F)(F)F)cc1)c1cc2c(cc1[N+](=O)[O-])OCCO2 519976949 RUTXKGLOHLCUFL-UHFFFAOYSA-N 460.364 5.429 5 20 JKBD Cc1cc([N+](=O)[O-])ccc1NC(=O)CCSc1nnc([C@H](C)N2CCCCC2)n1-c1ccccc1 602216942 JWUOPNCHZGSSPX-IBGZPJMESA-N 494.621 5.152 5 20 JKBD COc1cc([C@H]2Nc3ccccc3C(=O)N2Cc2ccccc2)c([N+](=O)[O-])cc1OCC(F)F 602756539 ACSCBPWKROCIHI-QHCPKHFHSA-N 469.444 5.014 5 20 JKBD C[C@H](c1ccccc1)n1c(SCc2nc(-c3ccc([N+](=O)[O-])cc3)no2)nnc1-c1ccccc1 603917231 HRKFDGFPINUUTG-QGZVFWFLSA-N 484.541 5.805 5 20 JKBD C[C@H]1CCCCN1Cc1ccccc1CN[C@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 604045292 MSCQUZCOMJTKPY-DLBZAZTESA-N 478.515 5.105 5 20 JKBD Cn1ccnc1[C@@H](NCc1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1)c1ccc(F)cc1 608835750 MUKBQMOEFZIHGV-SANMLTNESA-N 482.519 5.199 5 20 JKBD Cc1ccc(NC(=O)c2ccc(Sc3nc4ccccc4s3)c([N+](=O)[O-])c2)cc1C(N)=O 608947857 CBUAWFPOKSHSBN-UHFFFAOYSA-N 464.528 5.015 5 20 JKBD O=C(Nc1ccccc1C(=O)Nc1ccc(-n2ccnc2)c(Cl)c1)c1ccc([N+](=O)[O-])cc1Cl 726162972 LDRFJNMVSFSYIC-UHFFFAOYSA-N 496.310 5.592 5 20 JKBD Cc1cc[n+](/C(C(=S)NCc2cccc(C(F)(F)F)c2)=C(/O)c2ccc([N+](=O)[O-])cc2)cc1 726570046 ILOYWIPDHCXLII-UHFFFAOYSA-O 474.484 5.211 5 20 JKBD C[C@H](Nc1ccc(OCc2cccc(F)c2)c(F)c1)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 728592387 DYTONFVNUJHERD-ZDUSSCGKSA-N 495.404 5.910 5 20 JKBD C[C@H](SCc1ncc(-c2ccc(Cl)cc2)o1)C(=O)OCc1c(F)cccc1[N+](=O)[O-] 728994200 LEWDYVYAOWQDOK-LBPRGKRZSA-N 450.875 5.407 5 20 JKBD Cc1ccc(OCc2nc(COC(=O)c3csc(-c4ccc([N+](=O)[O-])cc4)n3)cs2)cc1 747957734 SDHMNDFFNKXPRX-UHFFFAOYSA-N 467.528 5.419 5 20 JKBD C[C@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)O[C@H](C)c1ccccc1NC(=O)c1ccccc1 748019697 CDXQJJQAQVGQMO-SJORKVTESA-N 450.516 5.632 5 20 JKBD CSc1ccc(C(=O)c2ccccc2C(=O)Nc2ccc(-n3cncn3)c(Cl)c2)cc1[N+](=O)[O-] 749145168 YOYASWQUCVHHAK-UHFFFAOYSA-N 493.932 5.034 5 20 JKBD CC(C)(C)OC(=O)N1CCC[C@@H]1[C@@H]1CCCN(C(=O)c2ccc(C(C)(C)C)c([N+](=O)[O-])c2)C1 749644118 BETQVMKYYPRKSU-UYAOXDASSA-N 459.587 5.144 5 20 JKBD Cc1ccc(C(=O)O[C@@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2ccccc2)cc1[N+](=O)[O-] 848943789 OFIZEDCDTTYIIH-HXUWFJFHSA-N 469.837 5.002 5 20 JKBD COc1cccc(C(=O)O[C@H](C(=O)Nc2ccc(C)cc2[N+](=O)[O-])c2ccccc2)c1OC(F)F 849195768 PCMOWFXLYAGHLE-FQEVSTJZSA-N 486.427 5.050 5 20 JKBD Cc1ccc(Sc2ccc(-c3nc([C@@H]4CCC(=O)N(CC5CCC5)C4)no3)cc2[N+](=O)[O-])cc1 856563991 ABISSWHHBWROFA-LJQANCHMSA-N 478.574 5.611 5 20 JKBD Cc1ccc(/C(O)=C(/C(=S)Nc2ccc(Cl)cc2)[n+]2ccc3c(c2)CCCC3)cc1[N+](=O)[O-] 916204534 YZMLZCCCIXJKGI-UHFFFAOYSA-O 480.997 6.046 5 20 JKBD CCCOc1ccc([C@@H](C)Nc2cc([N+](=O)[O-])c(OC)c(Br)c2[N+](=O)[O-])cc1OC 917077649 OHNRGBWSCNVLQA-LLVKDONJSA-N 484.303 5.245 5 20 JKBD CN(CCCCc1ccccc1)C(=O)c1ccccc1NC(=O)c1ccc([N+](=O)[O-])cc1Cl 918618890 DWJRSTZXYMYVTK-UHFFFAOYSA-N 465.937 5.595 5 20 JKBD Cc1nn(C(C)(C)C)c2nc(C(C)C)cc(C(=O)O[C@@H](C)c3nnc(-c4ccc([N+](=O)[O-])cc4)o3)c12 919206180 XWWCSYRASVNEIP-HNNXBMFYSA-N 492.536 5.494 5 20 JKBD C[C@@H](OC(=O)CSc1ccccc1[N+](=O)[O-])c1nc(-c2cccc(C(F)(F)F)c2)no1 923401208 RYCWAEGLWNGBFR-LLVKDONJSA-N 453.398 5.060 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)c3c(F)ccc(Cl)c3F)CCC2)cc1)c1ccc([N+](=O)[O-])o1 1785751416 CIGIYTQJTHYNFH-UHFFFAOYSA-N 475.835 5.181 5 20 JKBD Cc1oc2cc(O)ccc2c1C(=O)Nc1ccc(C2(NC(=O)Cc3cccc([N+](=O)[O-])c3)CCC2)cc1 1789020688 WCOAEAUZDBSFNY-UHFFFAOYSA-N 499.523 5.345 5 20 JKBD Cc1cc2[nH]c(C(=O)Nc3ccc(C4(NC(=O)c5cc(C)c([N+](=O)[O-])cn5)CCC4)cc3)cc2s1 1790879814 OTRRBQJSYYPRKX-UHFFFAOYSA-N 489.557 5.211 5 20 JKBD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)/C=C/c1ccc([N+](=O)[O-])o1)c1ccc(-c2ccc(Cl)cc2)o1 1793271359 RJWKKDPCWGGGQH-AGDBNRHRSA-N 495.919 5.066 5 20 JKBD CC(C)[C@@H](C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2ccc([N+](=O)[O-])cc2F)[nH]n1)c1ccccc1 1814932101 WGLZIFLUZRXWPB-LADGPHEKSA-N 493.539 5.203 5 20 JKBD Cc1c(C(=O)Nc2cc([C@H]3CCCCN3C(=O)c3ccc(F)s3)[nH]n2)cc(Cl)cc1[N+](=O)[O-] 1821291586 YXIGPTHJPYVBIO-OAHLLOKOSA-N 491.932 5.100 5 20 JKBD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2ccc(F)cc2)[nH]n1)c1cc2cc([N+](=O)[O-])ccc2s1 1821610049 SVZHDIIJGQKZEY-IBGZPJMESA-N 493.520 5.291 5 20 JKBD CC[C@@H](C(=O)N1CCCC[C@@H]1C1CCN(C(=O)Cc2cc([N+](=O)[O-])ccc2F)CC1)c1ccccc1 1826309446 BYWJSMGWUGDFHD-AOYPEHQESA-N 495.595 5.090 5 20 JKBD Cc1ccc(CC(=O)N2CCC([C@@H]3CCCCN3C(=O)c3cc4ccccc4o3)CC2)cc1[N+](=O)[O-] 1828188425 DCNFZWCUWPPYFN-QHCPKHFHSA-N 489.572 5.125 5 20 JKBD CSc1cccc(NC(=O)COc2ccc3c(-c4ccc([N+](=O)[O-])cc4)cc(=O)oc3c2)c1 21027924 CRVVJAZMBSQJTJ-UHFFFAOYSA-N 462.483 5.108 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Br)[C@@H](NCc1ccc(Cl)s1)c1ccccc1 28374244 UVAOCTZHZUZHHQ-SFHVURJKSA-N 480.771 5.542 5 20 JKBD O=C(C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)N(Cc1ccco1)Cc1ccco1 30469841 MABUAKXTQMEKNA-HKWRFOASSA-N 499.548 6.550 5 20 JKBD COc1ccccc1NS(=O)(=O)c1ccc(O)c(NC(=O)c2cc3ccccc3c3cccnc23)c1 69611664 NRFCILMMUVVHDO-UHFFFAOYSA-N 499.548 5.155 5 20 JKBD Cc1ccc(NC(=O)c2ccc(N[C@H](C)c3ccccn3)c([N+](=O)[O-])c2)c(OCC(F)(F)F)c1 108913531 UCCJMEQZZAKZPQ-OAHLLOKOSA-N 474.439 5.665 5 20 JKBD Cc1ccc(CN2CCSCC2)cc1NC(=O)c1ccc(NCc2ccccc2)c([N+](=O)[O-])c1 116437410 UCVPIUDDONRUES-UHFFFAOYSA-N 476.602 5.316 5 20 JKBD O=C(Nc1ccc(-n2cccn2)nc1)c1cc([N+](=O)[O-])ccc1Sc1ccc(Cl)cc1 477206648 OISMAUHYDCWSJE-UHFFFAOYSA-N 451.895 5.232 5 20 JKBD Cc1nc([N+](=O)[O-])cn1CCC(=O)N1C[C@H](c2ccccc2Cl)c2c([nH]c3ccccc23)[C@H]1C 488805041 LIVKCNZVUGYVDR-DNVCBOLYSA-N 477.952 5.360 5 20 JKBD COc1ccccc1N1CCC(NCc2ccc(Oc3ccc(F)cc3)c([N+](=O)[O-])c2)CC1 507912133 FCCJRVUCZJVHJP-UHFFFAOYSA-N 451.498 5.293 5 20 JKBD CSCC[C@@H](NC(=O)c1ccc([N+](=O)[O-])o1)C(=O)Nc1ccc(Oc2cc(C)cc(C)c2)cc1 508356848 ZGKWVIDGOUOMRZ-HXUWFJFHSA-N 483.546 5.087 5 20 JKBD COc1ccc2[nH]cc(C3CCN(C(=O)c4ccc(N5CCC[C@H](C)C5)c([N+](=O)[O-])c4)CC3)c2c1 509078724 BIXDWLPUTCDURV-SFHVURJKSA-N 476.577 5.341 5 20 JKBD CC(=O)Nc1ccc(NC(=O)c2ccc(Nc3ccccc3)c([N+](=O)[O-])c2)c(C(F)(F)F)c1 514346500 CROJCGILNZBJOJ-UHFFFAOYSA-N 458.396 5.568 5 20 JKBD COCCOc1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2Sc2ccc(Cl)cc2)c(C)c1 515615445 VZXVXPKXGBJPJG-UHFFFAOYSA-N 472.950 5.985 5 20 JKBD C[C@@H](NC(=O)c1ccc(N[C@H](C)c2ccccn2)c([N+](=O)[O-])c1)c1ccc(OCC(F)(F)F)cc1 516322280 DHHVWSMDPTWFQC-HZPDHXFCSA-N 488.466 5.595 5 20 JKBD CN(Cc1ccccc1)c1ccccc1NC(=O)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-] 520092810 YXFKGWZVTJMPLT-UHFFFAOYSA-N 459.424 5.425 5 20 JKBD O=C(Nc1ccc(Oc2ccccc2)cc1C(F)(F)F)c1ccn(-c2ccc([N+](=O)[O-])cc2)n1 520648579 AGESKIKWQOEWCI-UHFFFAOYSA-N 468.391 5.844 5 20 JKBD CC(C)(C)[C@@H](NC(=O)C(=O)Nc1cc([N+](=O)[O-])ccc1OC(F)F)c1cccc(C(F)(F)F)c1 524048281 FVYRMSXFOZSCHQ-INIZCTEOSA-N 489.397 5.057 5 20 JKBD C[C@H](C1CC1)N(C(=O)CCCn1c(=O)oc2cc([N+](=O)[O-])ccc21)c1cccc(C(F)(F)F)c1 603965079 XMPXPRHTWIYUKC-CQSZACIVSA-N 477.439 5.133 5 20 JKBD O=[N+]([O-])c1ccc(S(=O)(=O)Nc2nc3nc(-c4cccs4)cc(C(F)(F)F)c3s2)cc1 608929311 VRWCWLPSXXPDNY-UHFFFAOYSA-N 486.478 5.148 5 20 JKBD C[C@H](OC(=O)c1cc([N+](=O)[O-])ccc1Br)C(=O)N[C@@H](C)c1ccc(Cl)cc1Cl 725984996 NIKPSAZGAOUIPR-UWVGGRQHSA-N 490.137 5.087 5 20 JKBD C[C@@H](NCc1ccc(-c2ccc([N+](=O)[O-])cc2Br)o1)c1ccc2c(c1)CCC(=O)N2 726606868 DYAHJGBVRRQENZ-CYBMUJFWSA-N 470.323 5.353 5 20 JKBD C[C@@H](OC(=O)c1ccn(-c2ccc([N+](=O)[O-])cc2)n1)C(=O)N1c2ccccc2Sc2ccccc21 743123184 WXKRAUROKKJLFJ-MRXNPFEDSA-N 486.509 5.155 5 20 JKBD Cc1cccc(C(C)C)c1NC(=O)COC(=O)c1cc([N+](=O)[O-])ccc1N1CCC(C)CC1 772479331 OYSVGCZKDCUDAT-UHFFFAOYSA-N 453.539 5.058 5 20 JKBD COc1ccc(-c2csc(NC(=O)CSc3nc4ccc([N+](=O)[O-])cc4s3)n2)c(OC)c1 787994797 GJOQSWHDDVRMKK-UHFFFAOYSA-N 488.572 5.076 5 20 JKBD CCOC(=O)c1c(NC(=O)c2cc(OC)c(OC)cc2[N+](=O)[O-])sc(C)c1-c1ccc(F)cc1 829935985 BLSJXBWJGSWNKC-UHFFFAOYSA-N 488.493 5.217 5 20 JKBD O=[N+]([O-])c1cc(-c2nc(-c3ccc(-n4cnc5ccccc54)nc3)no2)cc(C(F)(F)F)c1 904488299 USYJSZCGQBVSIQ-UHFFFAOYSA-N 452.352 5.065 5 20 JKBD C[C@@H](Nc1ccc(-c2nc(-c3sccc3Br)no2)cc1[N+](=O)[O-])c1ccccn1 904889941 NEKLWISKQGABEW-LLVKDONJSA-N 472.324 5.704 5 20 JKBD C[C@@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)OCC(=O)N1c2ccccc2Sc2ccccc21 916523264 YQUAOZKMXISZDV-OAHLLOKOSA-N 466.540 5.448 5 20 JKBD CC1CCN(c2ccc([N+](=O)[O-])cc2C(=O)N2C[C@@H](C(F)(F)F)C[C@H](C(F)(F)F)C2)CC1 918673540 YUYQMHNFXPCOTG-KBPBESRZSA-N 467.410 5.034 5 20 JKBD C[C@H](OC(=O)[C@H](C)Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)Nc1ccc(Cl)cc1C(F)(F)F 920777753 GCCFZJQLBNGFJX-UWVGGRQHSA-N 495.237 5.258 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)c3cc(F)cc([N+](=O)[O-])c3)CCC2)cc1)c1cc2sccn2c1 1788412014 ICJWSHVXTMTKIB-UHFFFAOYSA-N 478.505 5.110 5 20 JKBD Cn1ccc2cccc(C(=O)Nc3ccc(C4(NC(=O)/C=C/c5ccc([N+](=O)[O-])o5)CCC4)cc3)c21 1789061264 WMUMLZYYJJDTPB-ZRDIBKRKSA-N 484.512 5.141 5 20 JKBD O=C(CSc1ccccc1[N+](=O)[O-])NC1(c2ccc(NC(=O)c3cnccc3Cl)cc2)CCC1 1789681762 RVQXGEHBFCDYCB-UHFFFAOYSA-N 496.976 5.183 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)c3cccc4ncccc34)CCC2)cc1)c1ccc([N+](=O)[O-])cc1F 1790621827 KKRWXTRZFHDSNM-UHFFFAOYSA-N 484.487 5.344 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1ccc3occ(Cl)c3c1)C2 1800700090 XPFNUJVJFGJSAS-MUJYYYPQSA-N 485.899 5.008 5 20 JKBD CC[C@@H](C)[C@H](C(=O)N1CCCC2(CCN(C(=O)/C=C/c3ccc([N+](=O)[O-])o3)CC2)C1)c1ccccc1 1809152828 GXFKNYHIGDKNQY-FOVHPINOSA-N 493.604 5.262 5 20 JKBD O=C(CCC1CCC1)N1CCCC[C@H]1c1cc(NC(=O)C2(c3cccc([N+](=O)[O-])c3)CCC2)n[nH]1 1820840348 BBQAOSHWHNACJK-QFIPXVFZSA-N 479.581 5.012 5 20 JKBD Cc1c(Cl)ccc(C(=O)Nc2cc([C@H]3CCCCN3C(=O)c3ccc([N+](=O)[O-])o3)[nH]n2)c1Cl 1823139004 JKXNBCAMBUDLTK-OAHLLOKOSA-N 492.319 5.146 5 20 JKBD Cc1cc(Cl)ccc1C(=O)N1CCC([C@H]2CCCCN2C(=O)/C=C/c2ccc([N+](=O)[O-])o2)CC1 1824276077 OLAVAFXSYUFGCF-MECCDNJOSA-N 485.968 5.096 5 20 JKBD O=C([C@@H]1C[C@@H]1C1CC1)N1CCC([C@H]2CCCCN2C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)CC1 1831060296 QSDHATZFFUXHFS-YPAWHYETSA-N 481.618 5.089 5 20 JKBD COc1cc(C(=O)OCC(=O)N[C@@H](C)c2cccs2)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 10911430 MQDBTFBSMCIBHN-ZDUSSCGKSA-N 490.921 5.145 5 20 JKBD CCOc1ccc(NC(=O)[C@@H](C)OC(=O)c2ccccc2C(=O)c2ccc(Cl)c([N+](=O)[O-])c2)cc1 15710216 DVGIVWWCIAZTGY-OAHLLOKOSA-N 496.903 5.062 5 20 JKBD O=c1c2ccc(C(F)(F)F)cc2nc2n1CC/C2=C\c1ccc(-c2cccc([N+](=O)[O-])c2)o1 16386211 PMOBZBCQLUNKKV-SDNWHVSQSA-N 453.376 5.528 5 20 JKBD CCOc1cc(C(=O)Nc2ccc(Cc3nc4ccccc4s3)cc2)c([N+](=O)[O-])cc1OC 17589378 ITPXLBZUARHBFR-UHFFFAOYSA-N 463.515 5.455 5 20 JKBD C[C@H](OC(=O)c1csc(-c2ccccc2)n1)C(=O)Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1 17984238 CUJOERVPBKGDQZ-ZDUSSCGKSA-N 480.527 5.026 5 20 JKBD C[C@@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)N(Cc1cccs1)c1ccc2c(c1)OCCO2 32480179 MYNUSHAILZIGCT-OAHLLOKOSA-N 456.545 5.142 5 20 JKBD CC1(C)CC(=O)c2sc(NC(=O)c3ccc(NCc4ccccc4)c([N+](=O)[O-])c3)nc2C1 78960117 PVUUFSMFCWMLQW-UHFFFAOYSA-N 450.520 5.071 5 20 JKBD CCOc1c(Br)cc(CN[C@H](C)c2cccc([N+](=O)[O-])c2)cc1Br 324401417 SNQUXRJIIZDDJA-LLVKDONJSA-N 458.150 5.369 5 20 JKBD Cc1c(NC(=O)c2ccccc2)cccc1NC(=O)c1ccc(N2C[C@@H](C)C[C@@H](C)C2)c([N+](=O)[O-])c1 409453740 PUFZTPYRRXZJQY-KDURUIRLSA-N 486.572 5.890 5 20 JKBD COc1ccc([C@@H](C)N(C)C(=O)C/C(=C/c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)cc1 483220134 KAKYASQYGZSEDZ-TVJQZGFISA-N 487.581 6.363 5 20 JKBD CCn1c(-c2ccccc2)c(C(=O)Cn2nc(-c3cccc([N+](=O)[O-])c3)ccc2=O)c2ccccc21 489155091 QKVMHWZEEZVCAS-UHFFFAOYSA-N 478.508 5.343 5 20 JKBD Cc1ccsc1CN(C(=O)CSc1ccc(C(N)=O)cc1[N+](=O)[O-])c1ccc(F)c(Cl)c1 490842873 BKYLOPPBGXOJQY-UHFFFAOYSA-N 493.969 5.182 5 20 JKBD CC(=O)N1CCc2cc(NC(=O)C/C(=C\c3ccc([N+](=O)[O-])cc3)c3nc4ccccc4s3)ccc21 492419686 RJNASKUDMJRRNR-XSFVSMFZSA-N 498.564 5.683 5 20 JKBD CCC(=O)Nc1ccc(Cl)c(NC(=O)c2ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])cc2)c1 500906211 JLXUBRDECXPRKH-UHFFFAOYSA-N 474.300 6.295 5 20 JKBD COc1ccc(Oc2ccc([N+](=O)[O-])cc2C(=O)NCCCc2nc(-c3ccncc3)cs2)cc1 503107274 HFPPIZBXDLPZCW-UHFFFAOYSA-N 490.541 5.277 5 20 JKBD C[C@@H](Nc1ccc(C(=O)NCc2ccnc(Oc3ccc(F)cc3)c2)cc1[N+](=O)[O-])c1ccccn1 503358485 VTAVECLPAVTHNE-QGZVFWFLSA-N 487.491 5.419 5 20 JKBD C[C@H](Nc1ccc(C(=O)N(C)c2ccc(Br)cc2Cl)cc1[N+](=O)[O-])c1ccccn1 508155935 CCNQNQQLCHRARU-ZDUSSCGKSA-N 489.757 5.855 5 20 JKBD CCOc1cc([N+](=O)[O-])c(C(=O)Nc2cc(-c3ccccc3)nn2-c2ccccc2)cc1OC 514740718 HDDKAUAWSBQJRL-UHFFFAOYSA-N 458.474 5.107 5 20 JKBD CC(C)(C)C(=O)N1CCOc2ccc(NC(=O)c3cc([N+](=O)[O-])ccc3Sc3ccccc3)cc21 515729686 SMXOMEFIBURJAG-UHFFFAOYSA-N 491.569 5.770 5 20 JKBD Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)c1ccccc1Sc1ccc(Br)cn1 518227963 BKAHLSISECSAHH-UHFFFAOYSA-N 458.337 5.773 5 20 JKBD CC[C@@H](NCc1ccc(-c2ccc([N+](=O)[O-])cc2)s1)c1ccccc1OCC(=O)N1CCCC1 518759749 HEFBXAFZXOHHFL-HSZRJFAPSA-N 479.602 5.565 5 20 JKBD O=C(Nc1nc2cc(C(F)(F)F)ccc2n1Cc1ccco1)c1ccn(-c2ccc([N+](=O)[O-])cc2)n1 519137406 WZIWHPSGZNVAIA-UHFFFAOYSA-N 496.405 5.043 5 20 JKBD Cc1csc(Sc2ccc(C(=O)NCCc3ccc4ccccc4n3)cc2[N+](=O)[O-])n1 520772435 VZMREYUIEGHXCS-UHFFFAOYSA-N 450.545 5.032 5 20 JKBD O=C(C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)Nc1ccc2nc[nH]c2c1 521580716 UGQSCVYWVIRKEQ-LFIBNONCSA-N 455.499 5.650 5 20 JKBD O=C(Nc1ccc2nc(Cc3ccccc3F)[nH]c2c1)C1CCN(c2ccccc2[N+](=O)[O-])CC1 603934882 KWPFGUCEPILDOK-UHFFFAOYSA-N 473.508 5.056 5 20 JKBD Cn1cnnc1Sc1ccc(C(=O)N[C@H](c2ccc(C(C)(C)C)cc2)C(F)(F)F)cc1[N+](=O)[O-] 604257521 QRMKSGIBOSPPNY-GOSISDBHSA-N 493.511 5.205 5 20 JKBD C[C@H]1C[C@@H](C)CN(c2ccc(C(=O)N(C)C[C@H]3CCCO[C@H]3c3ccccc3)cc2[N+](=O)[O-])C1 604519062 HJGXFQNCADGILO-XKCHLWDXSA-N 465.594 5.317 5 20 JKBD COc1cc(C(=O)N[C@@H](c2ccc(Cl)cc2)C2CCCC2)c([N+](=O)[O-])cc1OC(F)F 609218516 OGZBTQRVCZYGIF-LJQANCHMSA-N 454.857 5.520 5 20 JKBD C[C@@H]1CCCCN1CC(=O)Nc1ccc(F)c(NC(=O)c2cc3ccccc3c3cccnc23)c1 614671621 TYYAKYAYKFIPSP-GOSISDBHSA-N 470.548 5.592 5 20 JKBD C[C@H](c1nnc(Sc2ccc([N+](=O)[O-])c3cnccc23)n1-c1ccc(Cl)cc1)N(C)C 619714739 DMLWLCGINACEFU-CYBMUJFWSA-N 454.943 5.151 5 20 JKBD O=C1Nc2cc(Cl)ccc2C1=C1CCN(C(=O)c2cc([N+](=O)[O-])ccc2Oc2ccccc2)CC1 726377745 DQBQGNJZAGVLHE-UHFFFAOYSA-N 489.915 5.682 5 20 JKBD C[C@H]1CN(c2ccc(NC(=O)c3ccc([N+](=O)[O-])cc3Cl)cc2C(F)(F)F)C[C@@H](C)O1 728010745 JSUQUKZNPLVWBW-TXEJJXNPSA-N 457.836 5.133 5 20 JKBD O=C(Nc1ccc(Sc2nncs2)c(Cl)c1)c1cc([N+](=O)[O-])ccc1N1CCCC1 728193931 BLSHJKBXXIBUEF-UHFFFAOYSA-N 461.956 5.103 5 20 JKBD C[C@H](OC(=O)c1csc(-c2ccc([N+](=O)[O-])cc2)n1)C(=O)Nc1cc(Cl)ccc1Cl 747954775 FWQULRDKAPIXTR-JTQLQIEISA-N 466.302 5.209 5 20 JKBD C[C@@H](OC(=O)c1csc(-c2ccc([N+](=O)[O-])cc2)n1)C(=O)Nc1cccc(Cl)c1Cl 747956741 YZDZSRLAASYHCC-SNVBAGLBSA-N 466.302 5.209 5 20 JKBD CCOc1ccc([C@@H](CNC(=O)c2cc(F)ccc2[N+](=O)[O-])c2c[nH]c3ccccc23)cc1OC 751062028 IREGREWRDWEJRQ-HXUWFJFHSA-N 477.492 5.184 5 20 JKBD Cc1ccc(NC(=O)Nc2ccccc2)cc1NC(=O)c1cc([N+](=O)[O-])ccc1Br 751088692 NHXWDBBXVDMESJ-UHFFFAOYSA-N 469.295 5.562 5 20 JKBD C[C@H](c1ccccc1)n1c(SCC(=O)Nc2cc([N+](=O)[O-])ccc2F)nnc1-c1ccccc1 917254621 RCZZPYNKJOYXHW-MRXNPFEDSA-N 477.521 5.333 5 20 JKBD CC(=O)N(c1ccc(C)c(C)c1)c1nc(COC(=O)c2cc3cccc([N+](=O)[O-])c3[nH]2)cs1 919523473 WXIPVUDJBGYAQO-UHFFFAOYSA-N 464.503 5.191 5 20 JKBD COc1cc(C(=O)Oc2ccc(N3CCOC3=O)cc2)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 919668544 LZFOBSFRJYNDIC-UHFFFAOYSA-N 484.848 5.225 5 20 JKBD O=C(Oc1ccc(-c2ccccc2)cc1[N+](=O)[O-])C1CCN(C(=O)CCc2ccccc2)CC1 920330434 DGEMLLRACSMNLD-UHFFFAOYSA-N 458.514 5.039 5 20 JKBD Cc1cc(C(=O)Nc2ccc(C3(NC(=O)c4ccc([N+](=O)[O-])cc4F)CCC3)cc2)c(C)o1 1787346159 NJLAZZYAPMRTKV-UHFFFAOYSA-N 451.454 5.005 5 20 JKBD O=C(Cc1cccc2ncccc12)NC1(c2ccc(NC(=O)c3ccc([N+](=O)[O-])cc3F)cc2)CCC1 1790621246 UAUWWCMBLYBFEW-UHFFFAOYSA-N 498.514 5.273 5 20 JKBD O=C(Cc1ccc(Cl)cc1[N+](=O)[O-])N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H]1CCC[C@@H]2CCCC[C@@H]21 1797869607 MYTRCMBBQRYNOZ-WABZUUDDSA-N 488.028 5.035 5 20 JKBD O=C(NC[C@@H]1CCN(C(=O)CC2CCCC2)[C@H]1c1cccnc1)c1cc2cc([N+](=O)[O-])ccc2s1 1812304457 IXYAXMXPJNMOQS-DFBJGRDBSA-N 492.601 5.104 5 20 JKBD C[C@@H](C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2ccc([N+](=O)[O-])cc2F)n[nH]1)c1ccc(Cl)cc1 1821049310 JMDXTGZJJFFQJH-SZNDQCEHSA-N 499.930 5.220 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)N1CCCC[C@@H]1C1CCN(C(=O)/C=C/c2cccs2)CC1 1830730013 SKELDSKWZPDMBM-HWWNHIDJSA-N 485.581 5.051 5 20 JKBD O=C(/C=C/c1ccc([N+](=O)[O-])o1)N1CCC([C@H]2CCCCN2C(=O)c2ccc(C3CC3)cc2)CC1 1830745889 SVPHLVQTPDJJQE-IYNHSRRRSA-N 477.561 5.012 5 20 JKBD O=C(CSc1nnc(COc2ccccc2Cl)n1C1CC1)Nc1cc([N+](=O)[O-])ccc1Cl 9414994 VIDDLDIHSTUDBC-UHFFFAOYSA-N 494.360 5.138 5 20 JKBD O=C(COC(=O)Cc1ccc(-c2ccccc2)cc1)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 10715762 QHTIFPYUXGPRNT-UHFFFAOYSA-N 458.392 5.005 5 20 JKBD Cc1cc(C)c(NC(=O)CN(C)C(=O)c2cc([N+](=O)[O-])ccc2Sc2ccccc2)c(C)c1 14392013 STJVOSREDKLAKK-UHFFFAOYSA-N 463.559 5.382 5 20 JKBD CCOc1ccccc1NC(=O)[C@@H](C)Oc1ccc2c(-c3ccc([N+](=O)[O-])cc3)cc(=O)oc2c1 15370871 CPZCXJSSIYAIKX-MRXNPFEDSA-N 474.469 5.173 5 20 JKBD O=C(CCCn1c(=O)oc2cc([N+](=O)[O-])ccc21)Nc1ccccc1SCc1ccccc1 15825005 OHCWDHCIXKUHOA-UHFFFAOYSA-N 463.515 5.214 5 20 JKBD CC(=O)N[C@H](CC(=O)Nc1cc([N+](=O)[O-])ccc1Nc1cccc(C(F)(F)F)c1)c1cccs1 21441517 SHVBQBJXHQWGRG-LJQANCHMSA-N 492.479 5.625 5 20 JKBD O=C(Cn1c2ccccc2c(=O)c2ccccc21)Nc1ccccc1NC12CC3CC(CC(C3)C1)C2 72039151 BDGZREJTGCYLOJ-UHFFFAOYSA-N 477.608 6.174 5 20 JKBD COc1ccc(OC)c([C@@H](C)NC(=O)c2ccccc2NC(=O)c2ccc([N+](=O)[O-])cc2Cl)c1 104916873 UBPZWVYTTYRXMA-CQSZACIVSA-N 483.908 5.009 5 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454.486 5.433 5 20 JKBD O=C(Nc1ccc(NC(=O)c2cc3cc([N+](=O)[O-])ccc3o2)c(C(F)(F)F)c1)c1ccccc1 514566346 NGOLKVKVQXJVDT-UHFFFAOYSA-N 469.375 5.864 5 20 JKBD Cc1csc(Sc2ccc(C(=O)N[C@@H](C)c3ccc(NC(=O)NC4CC4)cc3)cc2[N+](=O)[O-])n1 515161669 PVPASDBIHFOORY-AWEZNQCLSA-N 497.602 5.286 5 20 JKBD Cc1ccc(C(=O)N(Cc2ccccc2[N+](=O)[O-])CC(F)(F)F)cc1NC(=O)c1ccccc1 515295839 MZQZASCBYGIVKP-UHFFFAOYSA-N 471.435 5.360 5 20 JKBD O=C(C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)Nc1ccc2nccnc2c1 518283745 BUNPLMSEVHRROO-LGMDPLHJSA-N 467.510 5.717 5 20 JKBD Cc1cc(C)n([C@@H](C)C(=O)Nc2ccc(NC(=O)c3cc4cc([N+](=O)[O-])ccc4o3)cc2Cl)n1 520956057 QFFPPMAWRONCRO-AWEZNQCLSA-N 481.896 5.260 5 20 JKBD C[C@@H](CC(=O)Nc1cccc(N2CCCC2)c1)NC(=O)c1cc2ccccc2c2cccnc12 523555944 FKCFGWCYJVZRIR-IBGZPJMESA-N 452.558 5.135 5 20 JKBD C[C@H](Sc1nnc(-c2ccccc2)n1[C@@H](C)c1ccccc1)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 603917264 LBJHUBLQGJVRTH-ROUUACIJSA-N 498.568 6.366 5 20 JKBD COc1ccc(Oc2ccc([N+](=O)[O-])cc2C(=O)N2CCC(c3n[nH]c(-c4ccccc4)n3)CC2)cc1 608891067 QEZBDQOFBYAARB-UHFFFAOYSA-N 499.527 5.201 5 20 JKBD COc1ccc(CNC(=O)Nc2ccc(NC(=O)OC(C)(C)C)cc2C(F)(F)F)cc1[N+](=O)[O-] 729571761 OQBLPNABINNXQE-UHFFFAOYSA-N 484.431 5.291 5 20 JKBD O=C(COC(=O)c1cc(-c2cccnc2)nc2ccccc12)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 793109930 IKNWQEFDUZEHJM-UHFFFAOYSA-N 496.401 5.019 5 20 JKBD O=C(OCc1csc(-c2ccc(Cl)cc2)n1)C1CCN(c2ccccc2[N+](=O)[O-])CC1 844241149 SSEGTWLYULFCNK-UHFFFAOYSA-N 457.939 5.332 5 20 JKBD Cc1ccc(-c2csc(NC(=O)Cn3c(-c4ccc(F)cc4)c(C)sc3=O)n2)cc1[N+](=O)[O-] 915833575 GVXOXOCMAGLTLV-UHFFFAOYSA-N 484.534 5.003 5 20 JKBD Cc1ccc(C(C)C)cc1O[C@@H](C)C(=O)N(Cc1nnc(-c2cccc([N+](=O)[O-])c2)o1)C(C)C 916036402 PCVRKUXIMJCQFY-SFHVURJKSA-N 466.538 5.281 5 20 JKBD O=C(/C=C/C1CC1)Nc1ccc(C2(NC(=O)c3cccc([N+](=O)[O-])c3Br)CCC2)cc1 1786160631 APGVZUFFMZKJFQ-KPKJPENVSA-N 484.350 5.071 5 20 JKBD O=C(/C=C/c1ccc([N+](=O)[O-])o1)Nc1ccc(C2(NC(=O)c3ccc4ccoc4c3)CCC2)cc1 1786207717 INQRQZQVPWUCHM-CSKARUKUSA-N 471.469 5.395 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)c3cc4cc([N+](=O)[O-])ccc4s3)CCC2)cc1)C1=CCCS1 1786414027 UATMGHLOQGDBKB-UHFFFAOYSA-N 479.583 5.578 5 20 JKBD O=C(Cc1cc([N+](=O)[O-])ccc1F)NC1(c2ccc(NC(=O)c3ccc4cc[nH]c4c3)cc2)CCC1 1788912690 XJBLHQWEFVOLGF-UHFFFAOYSA-N 486.503 5.206 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)Nc1ccc(C2(NC(=O)c3ccc(Cl)o3)CCC2)cc1 1790771384 YRRNILXXRQONLO-UHFFFAOYSA-N 471.872 5.350 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)Nc1ccc(C2(NC(=O)CCCn3cccc3)CCC2)cc1 1790772672 ZTICMPMCVNMQPJ-UHFFFAOYSA-N 478.524 5.072 5 20 JKBD CC1=C(C(=O)NC2(c3ccc(NC(=O)c4cc5cc([N+](=O)[O-])ccc5s4)cc3)CCC2)CCO1 1791010961 KLGFCWQSNBEHII-UHFFFAOYSA-N 477.542 5.252 5 20 JKBD O=C(CCC1CCCC1)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc2cc([N+](=O)[O-])ccc2s1 1801206885 BIIFTLCPEVMTBG-REPLKXPHSA-N 455.580 5.032 5 20 JKBD O=C(Nc1cc([C@@H]2CCCCN2C(=O)/C=C/c2ccccc2[N+](=O)[O-])[nH]n1)c1cc(Cl)ccc1F 1814624033 BWHHDSPHQJQBRJ-MAIVGLDJSA-N 497.914 5.130 5 20 JKBD CC(C)[C@H]1CC[C@H](C(=O)Nc2cc([C@@H]3CCCCN3C(=O)Cc3ccc([N+](=O)[O-])cc3F)[nH]n2)CC1 1822104913 QLADCRGEPZBTQL-BSRJHKFKSA-N 499.587 5.154 5 20 JKBD O=C(c1ccc(Cl)cc1)N1CCC([C@@H]2CCCCN2C(=O)CCc2cccc([N+](=O)[O-])c2)CC1 1824842386 WOMHJWJFJPLNGL-DEOSSOPVSA-N 483.996 5.114 5 20 JKBD O=C(CSc1ccccc1[N+](=O)[O-])N1CCC([C@@H]2CCCCN2C(=O)[C@@H](F)c2ccccc2)CC1 1824862393 YQDLHYOARLKAEC-OFVILXPXSA-N 499.608 5.017 5 20 JKBD Cc1c(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)[C@@H]3CC=CCC3)CC2)cc(Cl)cc1[N+](=O)[O-] 1830734347 IBYYYQFNPUADGS-DENIHFKCSA-N 474.001 5.146 5 20 JKBD O=C(/C=C/c1ccccc1[N+](=O)[O-])N1CCC([C@@H]2CCCCN2C(=O)[C@@H]2C[C@H]2c2ccccc2)CC1 1831790029 FZVFBHMLMYEUIM-NQXHXMBISA-N 487.600 5.031 5 20 JKBD CC(C)(C)c1cc(C(=O)N2CCC([C@H]3CCCCN3C(=O)/C=C/c3ccccc3[N+](=O)[O-])CC2)c[nH]1 1832903232 WIAYMLWNKHWIRK-HRBBJJPOSA-N 492.620 5.167 5 20 JKBD O=C(CCC1CCC1)N1CCC(OC2CCN(C(=O)c3cc4cc([N+](=O)[O-])ccc4s3)CC2)CC1 1836797711 DXMIFEYPWCHOSX-UHFFFAOYSA-N 499.633 5.002 5 20 JKBD COc1cc(C(=O)NCCC(c2ccccc2)c2ccccc2)c([N+](=O)[O-])cc1OC(F)F 11775925 ULPKFZPKQLRDRG-UHFFFAOYSA-N 456.445 5.157 5 20 JKBD Cc1csc(Sc2ccc(C(=O)NCC(=O)Nc3cc(Cl)ccc3Cl)cc2[N+](=O)[O-])n1 15477744 KGQZIURYOMSHET-UHFFFAOYSA-N 497.385 5.186 5 20 JKBD CC[C@@H]1c2ccsc2CCN1C(=O)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 16779047 BQOZBKWMZRTVSD-QGZVFWFLSA-N 467.513 5.428 5 20 JKBD C[C@@H](OC(=O)c1csc(-c2cccc(Cl)c2)n1)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl 17980710 VRMHFXZRDFXZSP-SNVBAGLBSA-N 466.302 5.209 5 20 JKBD COc1cc2c(cc1OC)[C@@H](c1cccs1)N(C(=O)[C@H](C)Sc1ccc([N+](=O)[O-])cc1)CC2 24445912 CVHNENBBKUFTCK-WNSKOXEYSA-N 484.599 5.328 5 20 JKBD COC(=O)c1ccc(COC(=O)C/C(=C/c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)o1 27251983 JHBABFRVDDFLBR-VBKFSLOCSA-N 478.482 5.258 5 20 JKBD COc1ccc(C(=O)Nc2ccc(NC(=O)c3ccc(F)cc3)cc2C(F)(F)F)cc1[N+](=O)[O-] 69611187 WNESNGVQWYYVGG-UHFFFAOYSA-N 477.370 5.266 5 20 JKBD O=C(C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1)N1CCC[C@H]1c1cccc2ccccc12 72024367 BGANZORFSXZVTI-QHCPKHFHSA-N 497.517 6.347 5 20 JKBD O=C(Nc1ccc(Oc2ccccc2C(F)(F)F)cc1)c1ccc(-n2cncn2)c([N+](=O)[O-])c1 195704476 PFTURGWKDJLMCS-UHFFFAOYSA-N 469.379 5.239 5 20 JKBD CCOc1cc(CN[C@H]2CCCc3ccccc32)ccc1OCc1cc([N+](=O)[O-])cc2c1OCOC2 409479031 JGOPABBBOHKOMT-VWLOTQADSA-N 490.556 5.606 5 20 JKBD CN(Cc1ccccn1)C(=O)c1c2c(nc3ccccc13)/C(=C\c1ccc([N+](=O)[O-])cc1)CCC2 488612154 UGYKQTYIBAVMHJ-JZJYNLBNSA-N 464.525 5.687 5 20 JKBD CCOC(=O)c1sc(-c2cccc([N+](=O)[O-])c2)cc1NC(=O)Cc1csc(-c2cccnc2)n1 500302973 LWUJCOQMJIFFIP-UHFFFAOYSA-N 494.554 5.200 5 20 JKBD CCOc1ccc(C2(CNC(=O)c3cc([N+](=O)[O-])ccc3Sc3ccccc3)CCOCC2)cc1 510094441 VOWVBCVJYQFFEM-UHFFFAOYSA-N 492.597 5.623 5 20 JKBD CC(C)NC(=O)c1ccc(N[C@@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2ccccc2)cc1 511019293 VRRZIBWSCHQLMJ-JOCHJYFZSA-N 466.925 5.178 5 20 JKBD O=C(Nc1cccc(OCC(=O)N2CCCC2)c1)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1 512441407 NWBFSCGUWZODGP-UHFFFAOYSA-N 495.919 5.294 5 20 JKBD Cc1ccc([C@H](NC(=O)C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2ccc(F)cc2Cl)cc1 517468479 OJDWXBKGTXAMPE-FQEVSTJZSA-N 476.291 5.193 5 20 JKBD O=C(C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)NCc1cc(F)ccc1F 517833820 KYQDUZHNTKDAGX-WJDWOHSUSA-N 465.481 5.730 5 20 JKBD CCCC(=O)Nc1cccc(NC(=O)c2ccc(N3C[C@H](C)C[C@@H](C)C3)c([N+](=O)[O-])c2)c1C 517906115 QZGUNOVRWZJMDU-IAGOWNOFSA-N 452.555 5.376 5 20 JKBD O=C(CSc1ccc(C(F)(F)F)cc1[N+](=O)[O-])Nc1ccc(OCC(F)(F)F)cc1 589264440 RAQDTVISTRJBLA-UHFFFAOYSA-N 454.348 5.286 5 20 JKBD Cc1ccc(S(=O)(=O)Nc2ccc(NC(=O)c3cccc(Cl)c3Cl)cc2)cc1[N+](=O)[O-] 603501802 JMJIUMBEEXRZIN-UHFFFAOYSA-N 480.329 5.263 5 20 JKBD CC(C)N(Cc1ccc(F)cc1)C(=O)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 603524731 KZQLVTUJCNHQGK-UHFFFAOYSA-N 467.463 5.406 5 20 JKBD O=C(Nc1cccc(N2CCNC2=O)c1)c1cc([N+](=O)[O-])ccc1Sc1ccc(Cl)cc1 603759857 XSIORUXQEFYNTR-UHFFFAOYSA-N 468.922 5.181 5 20 JKBD C[C@@H]1CN(C(=O)c2c3c(nc4ccccc24)/C(=C/c2ccc([N+](=O)[O-])cc2)CCC3)CCCO1 608946518 QLUBEKASFGPBAC-RILMWAFASA-N 457.530 5.271 5 20 JKBD COc1ccc(Oc2ccc([N+](=O)[O-])cc2C(=O)Nc2cccc([C@@H](C)N3CCOCC3)c2)cc1 609183083 MJNQSYFHDIVXJN-GOSISDBHSA-N 477.517 5.041 5 20 JKBD COc1ccc(C(=O)N2CCC(Nc3cc(Cl)c(C(F)(F)F)cc3[N+](=O)[O-])CC2)c(OC)c1 726968545 YFHIVTLLCYSJJC-UHFFFAOYSA-N 487.862 5.001 5 20 JKBD NC(=O)c1ccc(SCC(=O)Oc2ccc(-c3nc4ccccc4s3)cc2Cl)c([N+](=O)[O-])c1 858121326 BZNGAOIOOFMAOM-UHFFFAOYSA-N 499.957 5.322 5 20 JKBD O=C1c2ccccc2NC2(CCN(c3ccc([N+](=O)[O-])cc3)CC2)N1c1ccc(F)cc1Cl 877846891 JRNOQGXBSUUFSN-UHFFFAOYSA-N 466.900 5.456 5 20 JKBD CC1=C(C(=O)Nc2ccccc2C)[C@@H](c2ccc([N+](=O)[O-])cc2)NC(=S)N1c1cccc(Cl)c1 901414822 VYTZOTOIQZQYHN-HSZRJFAPSA-N 492.988 5.905 5 20 JKBD O=C(/C=C\c1ccc([N+](=O)[O-])cc1)Nc1ccc(NC(=O)c2ccccc2)cc1C(F)(F)F 915870770 QFVWJYYCRJNGIC-JYRVWZFOSA-N 455.392 5.518 5 20 JKBD O=C(Nc1cc([N+](=O)[O-])c(F)cc1F)c1ccc(COc2ccc(Br)cc2)o1 916042491 BJHMAXHRDZPODJ-UHFFFAOYSA-N 453.195 5.060 5 20 JKBD Cc1ccccc1OCCCC(=O)Nc1ccc(CNC(=O)c2cc(Cl)ccc2[N+](=O)[O-])cc1 916076969 GGCKREQZCLIJRO-UHFFFAOYSA-N 481.936 5.284 5 20 JKBD CCc1cccc[n+]1/C(C(=S)Nc1cccc(C(C)C)c1)=C(/O)c1ccc(C)c([N+](=O)[O-])c1 917615398 NTJPFLJSPHHFDF-UHFFFAOYSA-O 462.595 6.200 5 20 JKBD CC(=O)N(c1nc(COC(=O)c2cc3cc([N+](=O)[O-])ccc3o2)cs1)c1c(C)cc(C)cc1Cl 919215189 YHFWKFXFYBOWAC-UHFFFAOYSA-N 499.932 6.109 5 20 JKBD O=C(/C=C/c1ccc([N+](=O)[O-])o1)Nc1ccc(C2(NC(=O)c3csc4c3CCCO4)CCC2)cc1 1786205020 YNBFTDSUCANKME-CSKARUKUSA-N 493.541 5.035 5 20 JKBD O=C(/C=C/c1cccs1)Nc1ccc(C2(NC(=O)c3cc([N+](=O)[O-])cc4c3OCC4)CCC2)cc1 1788163715 NPAXXTYZDVXUHV-CMDGGOBGSA-N 489.553 5.052 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)c3ccc([N+](=O)[O-])[nH]3)CCC2)cc1)c1ccc(C(F)(F)F)cc1 1790312320 QQPCQQMZPNDKDD-UHFFFAOYSA-N 472.423 5.003 5 20 JKBD Cc1c(C(=O)NC2(c3ccc(NC(=O)[C@@H]4[C@H]5C=CS[C@@H]54)cc3)CCC2)cc(Cl)cc1[N+](=O)[O-] 1791090120 AUUDHZQMZQDOKU-UIFIKXQLSA-N 483.977 5.179 5 20 JKBD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2cc3sccc3s2)[nH]n1)c1cccc(F)c1[N+](=O)[O-] 1821169885 KRPRMAOSWGJCBP-HNNXBMFYSA-N 499.549 5.353 5 20 JKBD Cc1cc2cc(C(=O)Nc3cc([C@H]4CCCCN4C(=O)/C=C/c4ccccc4[N+](=O)[O-])[nH]n3)ccc2[nH]1 1821585922 JHROPJMVWMBVFG-IYNHSRRRSA-N 498.543 5.127 5 20 JKBD C[C@H](C(=O)N1CCC([C@H]2CCCCN2C(=O)Cc2cccc([N+](=O)[O-])c2)CC1)c1ccc(Cl)cc1 1823676999 MRQRZKFFVWJXGH-UQBPGWFLSA-N 498.023 5.214 5 20 JKBD Cc1cc2cccc(C(=O)N3CCCC[C@@H]3C3CCN(C(=O)c4ccc([N+](=O)[O-])cc4F)CC3)c2[nH]1 1828215708 XPILEOUYOLWNKL-XMMPIXPASA-N 492.551 5.071 5 20 JKBD COc1cc(C(=O)Nc2nc(-c3cc(C)c(C)cc3C)cs2)c([N+](=O)[O-])cc1OC(F)F 10962768 NEMHSHQPOYKOOV-UHFFFAOYSA-N 463.462 5.506 5 20 JKBD COc1cc(CCNC(=O)c2sc3cc(Cl)ccc3c2Cl)c([N+](=O)[O-])cc1OC 11081399 PUVBHVXHOMHDGD-UHFFFAOYSA-N 455.319 5.106 5 20 JKBD C[C@H](OC(=O)c1sc2cc(F)ccc2c1Cl)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl 11443872 XSAGLYYETKJRAK-QMMMGPOBSA-N 457.266 5.439 5 20 JKBD O=C1c2ccccc2N[C@H](c2ccc(-c3ccc([N+](=O)[O-])cc3Br)o2)N1C[C@H]1CCCO1 15503674 HFIAFUHIUQWFMA-QRQCRPRQSA-N 498.333 5.363 5 20 JKBD O=C(Cn1c(SC(F)F)nc2ccccc21)Oc1ccc(NC(=O)c2cccc([N+](=O)[O-])c2)cc1 15603918 OJYBGEDZDYWHHY-UHFFFAOYSA-N 498.467 5.117 5 20 JKBD C[C@H](OC(=O)c1ccc(C2SCCCS2)cc1)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 17936950 DNJLYQOJKBTSSE-ZDUSSCGKSA-N 457.533 5.432 5 20 JKBD Cn1ccnc1[C@@H](NC(=O)c1ccc(NCc2ccccc2Cl)c([N+](=O)[O-])c1)c1cccc(F)c1 24015987 PQVGYYNMDUMXKQ-QHCPKHFHSA-N 493.926 5.252 5 20 JKBD CCCn1c(SCCC(=O)Nc2ccc([N+](=O)[O-])cc2OC)nnc1-c1ccc(Cl)cc1 26224680 LUOQVWYOMHVWBQ-UHFFFAOYSA-N 475.958 5.046 5 20 JKBD C[C@H](OC(=O)Cc1csc(-c2ccccc2Cl)n1)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl 26674596 DXUXUOXPWCJDGI-NSHDSACASA-N 480.329 5.138 5 20 JKBD Cc1csc(Sc2ccc(C(=O)Nc3ccc(C(=O)NC(C)(C)C)cc3)cc2[N+](=O)[O-])n1 31071640 NUDYBSDWGGZUHG-UHFFFAOYSA-N 470.576 5.292 5 20 JKBD O=[N+]([O-])c1cccc(-c2noc(CSc3nnc(-c4ccc(F)cc4)c4ccccc34)n2)c1 31838829 GJAVYSCECHTJBH-UHFFFAOYSA-N 459.462 5.686 5 20 JKBD COc1c(C)ccc(NC(=O)Cc2cn(-c3ccccc3)nc2-c2ccc([N+](=O)[O-])cc2)c1C 33049541 PKQHLXXNEHFYRY-UHFFFAOYSA-N 456.502 5.254 5 20 JKBD O=C(Cn1c2ccccc2c(=O)c2ccccc21)Nc1ccc(NC(=O)c2cccs2)cc1 303150036 VPGKPYRUVILXCF-UHFFFAOYSA-N 453.523 5.107 5 20 JKBD C[C@H](Nc1ccc(C(=O)NC[C@H]2CCCO[C@@H]2c2ccccc2)cc1[N+](=O)[O-])c1ccccn1 409571667 QZTKDGLXUHGTFL-NXQMDHLFSA-N 460.534 5.061 5 20 JKBD Cc1ccc2c(c1C)OC[C@@H]2N[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Br)c1ccccc1 477036354 UHGOJOOXHVAVMD-VXKWHMMOSA-N 496.361 5.377 5 20 JKBD CCCn1c2ccccc2c2nnc(S[C@@H](C)c3nnc(-c4ccc([N+](=O)[O-])cc4)o3)nc21 495479669 KJFQHCCTFRDWMN-ZDUSSCGKSA-N 461.507 5.201 5 20 JKBD COCCN(C(=O)c1cc(-c2cccc(Cl)c2)no1)c1nc(-c2ccc([N+](=O)[O-])cc2)cs1 499316505 OFJFXZNIVCIILT-UHFFFAOYSA-N 484.921 5.320 5 20 JKBD CCCCOc1ccc([C@H](C)NC(=O)Cn2c3ccccc3c(=O)c3ccccc32)cc1OC 501485053 ZOZVFCBXKALQLI-IBGZPJMESA-N 458.558 5.220 5 20 JKBD C[C@H](Nc1ccc(C(=O)Nc2cccc(-c3nnc4n3CCCCC4)c2)cc1[N+](=O)[O-])c1ccccn1 505981494 KQTRVHUZJJVWKP-SFHVURJKSA-N 497.559 5.400 5 20 JKBD COc1ccccc1Oc1ccc(NC(=O)c2ccc(N[C@H](C)c3ccccn3)c([N+](=O)[O-])c2)cc1 506073308 VTNGGGDEOBULLR-GOSISDBHSA-N 484.512 6.216 5 20 JKBD C[C@@H](Nc1ccc(C(=O)Nc2ccccc2Oc2cccc(F)c2)cc1[N+](=O)[O-])c1ccccn1 509139116 OFTSCIZNEINJEF-QGZVFWFLSA-N 472.476 6.347 5 20 JKBD COc1ccc(NC(=O)c2cc3ccccc3c3cccnc23)cc1NC(=O)c1ccc(Cl)cc1F 515687429 QANMBOQUKLIIOU-UHFFFAOYSA-N 499.929 6.694 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Cl)[C@H](NCc1ccccc1Br)c1ccccc1 520154711 RLBOQYGRWAMVAU-HXUWFJFHSA-N 474.742 5.480 5 20 JKBD CC[C@H](C)Sc1ccc(NC(=O)c2ccc(-n3ccnc3)c([N+](=O)[O-])c2)c(C(F)(F)F)c1 556564355 BOJWHEMDILJOBY-ZDUSSCGKSA-N 464.469 5.942 5 20 JKBD Cc1ccc(NC(=O)c2cc3cccc([N+](=O)[O-])c3[nH]2)cc1S(=O)(=O)Nc1ccccc1Cl 604036824 VTJMARYXTWGZKZ-UHFFFAOYSA-N 484.921 5.091 5 20 JKBD CSCc1ccc(NC(=O)c2ccc(C(=O)Nc3ccc(CSC)cc3)c([N+](=O)[O-])c2)cc1 609044800 HDSLOAVYQFSGMW-UHFFFAOYSA-N 481.599 5.825 5 20 JKBD COc1ccc(-c2nnc(Sc3ccc(C(C)=O)cc3[N+](=O)[O-])n2C2CCCCC2)cc1OC 619672856 PUUVPSDLWAZNDM-UHFFFAOYSA-N 482.562 5.730 5 20 JKBD CC(C)(C)c1cc[n+](/C(C(=S)NCCc2cccs2)=C(/O)c2ccc([N+](=O)[O-])cc2)cc1 727812385 OZXVWAAHYQRWFK-UHFFFAOYSA-O 468.624 5.285 5 20 JKBD Cc1c(C(=O)Nc2ncc(Cc3ccc(C(F)(F)F)cc3)s2)cc([N+](=O)[O-])c(C)c1[N+](=O)[O-] 748626075 SSGGYQONGJQMEM-UHFFFAOYSA-N 480.424 5.438 5 20 JKBD CC(=O)Nc1ccc(OC(=O)C/C(=C/c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)cc1 909669994 JZVAAKRTQDRZHP-JXAWBTAJSA-N 473.510 5.699 5 20 JKBD O=C(C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1)N(CCc1ccccc1)C1CC1 914488043 AKQLXVKHIDNKQC-UHFFFAOYSA-N 461.484 5.064 5 20 JKBD CCn1c(S[C@H](C(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)c2ccccc2)nnc1-c1cccnc1 916664910 WIZQRYCWYVLCTN-FQEVSTJZSA-N 494.964 5.394 5 20 JKBD COc1cc(C(=O)Nc2ccc3c(c2)oc2ccccc23)c([N+](=O)[O-])cc1OCc1cscn1 919882766 OJGXYEAHFUIOPV-UHFFFAOYSA-N 475.482 5.791 5 20 JKBD CCCc1noc2nc(-c3ccco3)cc(C(=O)O[C@H](C)c3nnc(-c4ccc([N+](=O)[O-])cc4)o3)c12 920682824 SQKWMSOXMFALFN-CYBMUJFWSA-N 489.444 5.312 5 20 JKBD O=C(NC1(c2ccc(NC(=O)c3ccc([N+](=O)[O-])o3)cc2)CCC1)c1ccc(Cl)c(F)c1 1785751048 KHFCXZBRACIFMY-UHFFFAOYSA-N 457.845 5.042 5 20 JKBD C[C@H](C(=O)NC1(c2ccc(NC(=O)/C=C/c3ccc([N+](=O)[O-])o3)cc2)CCC1)c1ccccc1 1786208053 HYVNVHLEWKFQQP-SZEUEKNRSA-N 459.502 5.139 5 20 JKBD COc1cc(C(=O)NC2(c3ccc(NC(=O)c4cscc4C)cc3)CCC2)cc([N+](=O)[O-])c1OC 1788746662 MZMCBQAPSHDGAL-UHFFFAOYSA-N 495.557 5.043 5 20 JKBD O=C(Cc1cc([N+](=O)[O-])ccc1F)NC1(c2ccc(NC(=O)c3ccc4ncccc4c3)cc2)CCC1 1788906889 SQFUXXAIKWRKKX-UHFFFAOYSA-N 498.514 5.273 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)c3c4ccccc4n4ccsc34)CCC2)cc1)c1ccc([N+](=O)[O-])[nH]1 1790186949 WWVHAQWSQFCCJF-UHFFFAOYSA-N 499.552 5.452 5 20 JKBD O=C(CCc1cccc([N+](=O)[O-])c1)NC1(c2ccc(NC(=O)c3onc4ccccc34)cc2)CCC1 1790902944 RHZGGHQXMDKWBL-UHFFFAOYSA-N 484.512 5.117 5 20 JKBD O=C(Cc1ccc([N+](=O)[O-])cc1F)Nc1ccc(C2(NC(=O)c3cc4sccn4c3)CCC2)cc1 1791183436 JQIYHXISWYDCNZ-UHFFFAOYSA-N 492.532 5.039 5 20 JKBD O=C(Cc1cc(F)ccc1[N+](=O)[O-])Nc1ccc(C2(NC(=O)[C@H](F)c3ccccc3)CCC2)cc1 1792308506 WVAKRCVTPKISFO-XMMPIXPASA-N 479.483 5.121 5 20 JKBD Cc1cc(Cl)c(Cl)cc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CCc1cccc([N+](=O)[O-])c1 1793940734 PBYLXTTVDZKGPD-BCDXTJNWSA-N 490.387 5.095 5 20 JKBD CC[C@@H](C)[C@H](C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CSc1ccccc1[N+](=O)[O-])C2)c1ccccc1 1795572706 MBBXKSMOAFOZIP-ZQATVHPOSA-N 495.645 5.155 5 20 JKBD O=C(c1ccc([N+](=O)[O-])o1)N1CCCC2(CCN(C(=O)c3cccc4c3oc3ccccc34)CC2)C1 1804654255 QDRCXKXJVXSTPU-UHFFFAOYSA-N 487.512 5.246 5 20 JKBD O=C(CSc1ccccc1[N+](=O)[O-])N1CCC([C@@H]2CCCCN2C(=O)CCC2CCCC2)CC1 1826272408 XTQSRMNSNVEAPB-QFIPXVFZSA-N 487.666 5.277 5 20 JKBD O=C(c1cc(F)ccc1Cl)N1CCC([C@@H]2CCCCN2C(=O)c2ccc([N+](=O)[O-])cc2F)CC1 1830498765 JFQMQIIPCKLAIF-QFIPXVFZSA-N 491.922 5.074 5 20 JKBD Cc1ccc(/C=C/C(=O)N2CCC([C@@H]3CCCCN3C(=O)c3cc(F)cc([N+](=O)[O-])c3)CC2)s1 1830615618 MWBLBXDKNQGXOI-MNQSQUENSA-N 485.581 5.051 5 20 JKBD COc1cc(C(=O)Nc2c(C)nn(-c3ccccc3)c2C)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 10540046 SAUPFFNYUOLEJX-UHFFFAOYSA-N 492.919 6.104 5 20 JKBD COc1cc(CSc2nnc(-c3ccncc3)n2Cc2ccccc2)c([N+](=O)[O-])cc1OC(F)F 12724551 RQSJLAHPPZHDFU-UHFFFAOYSA-N 499.499 5.199 5 20 JKBD Cc1cccc(NC(=O)CN(C)C(=O)c2ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])cc2)c1C 14080265 LJEODUHTBDAUIH-UHFFFAOYSA-N 467.909 5.368 5 20 JKBD CCOc1ccc([C@H](CNC(=O)c2ccc([N+](=O)[O-])cc2Cl)c2c[nH]c3ccccc23)cc1OC 18136636 ZCKBHNZJZLAABF-FQEVSTJZSA-N 493.947 5.699 5 20 JKBD CSc1ccc([N+](=O)[O-])c(C(=O)Nc2sc(-c3ccccc3)c(C)c2C(=O)N2CCOCC2)c1 18184635 QRQZHTVBOQZODG-UHFFFAOYSA-N 497.598 5.078 5 20 JKBD C[C@H](OC(=O)c1occc1COc1ccccc1)C(=O)Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1 21704014 NRMFENLZWFXTFK-HNNXBMFYSA-N 493.497 5.074 5 20 JKBD CCOc1ccccc1Nc1nnc(S[C@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2C)s1 23378857 LOTMSSIQARUYPV-CYBMUJFWSA-N 459.553 5.016 5 20 JKBD O=C(Nc1ccc(NC(=O)[C@@H]2CCCO2)cc1)c1cc([N+](=O)[O-])ccc1Sc1ccc(Cl)cc1 30507294 UOXCBBZNECGIPQ-NRFANRHFSA-N 497.960 5.769 5 20 JKBD Cc1nc(CCNC(=O)c2ccccc2Sc2ccc(C(F)(F)F)cc2[N+](=O)[O-])cs1 30993096 RDFASYXEMOIBTO-UHFFFAOYSA-N 467.494 5.502 5 20 JKBD O=C(Nc1cc(C(F)(F)F)ccc1N1CCCCC1)c1ccc(-n2ccnc2)c([N+](=O)[O-])c1 60387656 GRMLPEDVPXMDPV-UHFFFAOYSA-N 459.428 5.042 5 20 JKBD C[C@@H](Nc1ccc(C(=O)N(Cc2ccc(F)cc2F)C2CC2)cc1[N+](=O)[O-])c1ccccn1 108785254 FOKONNVUCRBPFJ-OAHLLOKOSA-N 452.461 5.246 5 20 JKBD CC(C)[C@H](NC(=O)c1ccc(N[C@H](C)c2ccccn2)c([N+](=O)[O-])c1)c1ccc2c(c1)OCCO2 108787328 QQAITVJJONCDMY-NSYGIPOTSA-N 476.533 5.061 5 20 JKBD C[C@H](Sc1ncc(-c2ccccc2)n1CC(F)(F)F)C(=O)Nc1ccc(F)c([N+](=O)[O-])c1 109622840 VZCUVIPONOFFIC-LBPRGKRZSA-N 468.432 5.279 5 20 JKBD O=C(c1cc2ccccc2c2cccnc12)N1CCC[C@H](c2nc(-c3ccc(Cl)cc3)no2)C1 116669457 DVFQLGLXWNUCAN-IBGZPJMESA-N 468.944 6.111 5 20 JKBD C[C@H]1CCCN(Cc2ccccc2CNC(=O)c2ccc(N[C@H](C)c3ccccn3)c([N+](=O)[O-])c2)C1 247925846 PFKHRIJOGHHWEE-LEWJYISDSA-N 487.604 5.325 5 20 JKBD Cc1ccc(-n2ncc(C(=O)N(C)Cc3cc([N+](=O)[O-])ccc3Cl)c2C(F)(F)F)cc1 248096715 ZQTNGUWDKURBHJ-UHFFFAOYSA-N 452.820 5.033 5 20 JKBD C[C@H](NC(=O)[C@@H](C)Sc1ccc([N+](=O)[O-])cc1)c1cccc(NC(=O)Cc2ccccc2F)c1 483238466 KICFRBBIAOYJKD-DLBZAZTESA-N 481.549 5.273 5 20 JKBD Cc1csc(Sc2ccc(C(=O)N[C@@H](c3ccccc3)c3cccnc3)cc2[N+](=O)[O-])n1 485507506 BZSTUIFGVHDWPP-NRFANRHFSA-N 462.556 5.425 5 20 JKBD CSc1ccc(C(=O)c2ccccc2C(=O)N(C)Cc2ccc(F)c(F)c2)cc1[N+](=O)[O-] 489197191 MVNXYVZMRFFCLS-UHFFFAOYSA-N 456.470 5.098 5 20 JKBD O=C(Nc1ccc(C(=O)N2CCCCCC2)cc1)c1ccc(NCc2ccccc2)c([N+](=O)[O-])c1 489327793 KRYZBMBKLZFTDV-UHFFFAOYSA-N 472.545 5.475 5 20 JKBD Cc1cccc(C(=O)Nc2ccc(CNC(=O)c3ccc(C(F)(F)F)cc3)cc2)c1[N+](=O)[O-] 502439186 BBWUZUQAUYVZMQ-UHFFFAOYSA-N 457.408 5.104 5 20 JKBD COc1cc(C(=O)N[C@@H](C)c2sc(-c3ccc(C)cc3)nc2C)c([N+](=O)[O-])cc1OC(F)F 502469660 CZANVOPAZJYLPA-LBPRGKRZSA-N 477.489 5.436 5 20 JKBD CCCCc1ccc([C@H](NC(=O)c2cc(OC)c(OC)cc2[N+](=O)[O-])c2cccs2)cc1 503185878 CTRLIZAGHZNGPW-QHCPKHFHSA-N 454.548 5.536 5 20 JKBD CC(C)c1cccc(C(C)C)c1NC(=O)c1ccc([N+](=O)[O-])cc1I 508867738 CXQGRSYGWRNXRX-UHFFFAOYSA-N 452.292 5.699 5 20 JKBD CC1CCN(c2ccc(C(=O)Nc3ccc(N(C)C)cc3C(F)(F)F)cc2[N+](=O)[O-])CC1 509162567 DLZPAFJAKRPNNC-UHFFFAOYSA-N 450.461 5.168 5 20 JKBD Cc1nc(-c2ccc(F)cc2)sc1[C@@H](C)Nc1ccc(C(=O)c2nccn2C)cc1[N+](=O)[O-] 511428263 XJXAIPHSXXUYKY-CYBMUJFWSA-N 465.510 5.303 5 20 JKBD Cc1c(NC(=O)c2ccc3c(c2)C(=O)N(c2cc(Cl)ccc2Cl)C3=O)cccc1[N+](=O)[O-] 512215666 VLJASMRXXGOWTD-UHFFFAOYSA-N 470.268 5.263 5 20 JKBD CCn1c(SCC(=O)N(Cc2ccco2)c2ccccc2)nc2cc3ccccc3cc2c1=O 514841415 NANNDJSYOVQKSN-UHFFFAOYSA-N 469.566 5.488 5 20 JKBD CCOc1ccc(NC(=O)c2ccc(NC(=O)c3ccc(N4CCCC4)c([N+](=O)[O-])c3)cc2)cc1 515314424 ANBHLTPRENMVFC-UHFFFAOYSA-N 474.517 5.098 5 20 JKBD C[C@@H]1C[C@@H](C)CN(c2ccc(C(=O)Nc3ccc(NC(=O)NCc4ccco4)cc3)cc2[N+](=O)[O-])C1 515545481 YBENLLMELPJWDC-QZTJIDSGSA-N 491.548 5.244 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)Nc2ccc(-c3nc4ccccc4s3)cn2)cc1SC 518174084 SUIGTOIJQTXKSD-UHFFFAOYSA-N 452.517 5.249 5 20 JKBD CC[C@H](C)N(C(=O)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])c(OC)c1)c1ccc(C(N)=O)cc1 519899362 XPVVVJRVFHFAFI-HNNXBMFYSA-N 497.935 5.593 5 20 JKBD C[C@H](c1cccnc1)N(C)C(=O)c1ccc(Sc2nc3ccccc3s2)c([N+](=O)[O-])c1 520963916 MCLSVESLNNONMT-CQSZACIVSA-N 450.545 5.584 5 20 JKBD COCCN(C(=O)c1csc(Cc2ccc(F)cc2)n1)c1nc(-c2ccc([N+](=O)[O-])cc2)cs1 524028667 VDYOXKVCJWXOLJ-UHFFFAOYSA-N 498.561 5.198 5 20 JKBD CS(=O)(=O)c1cc(NCc2ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])cc2)ccc1F 600850547 CMSHLYGDLOVHNE-UHFFFAOYSA-N 450.875 5.195 5 20 JKBD COc1ccc(CSc2nnc(Cc3cccs3)n2CCc2ccccc2)cc1[N+](=O)[O-] 603721956 IRQPINSQGSNMAY-UHFFFAOYSA-N 466.588 5.382 5 20 JKBD O=C(Nc1cc(N2CCCC2=O)ccc1Cl)c1cc([N+](=O)[O-])ccc1Oc1ccccc1 603739801 FBVTYUCDUSMRLN-UHFFFAOYSA-N 451.866 5.420 5 20 JKBD O=C(c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1)N1CCC(N2CCc3ccccc3C2)CC1 604482548 OKPKIRQDGXOWKV-UHFFFAOYSA-N 491.975 5.703 5 20 JKBD COc1ccc(NC(=O)c2cnn(-c3ccc([N+](=O)[O-])cc3)c2)cc1OCc1ccc2ccccc2n1 609066120 IYHSABMVWMRSFM-UHFFFAOYSA-N 495.495 5.169 5 20 JKBD COc1ccc(CCC2CCN(C(=O)Cn3c4ccccc4c(=O)c4ccccc43)CC2)cc1 645090322 OTZAVKOJURROQJ-UHFFFAOYSA-N 454.570 5.035 5 20 JKBD CNC(=O)c1cc(NC(=O)CCC(=O)c2ccc3ccc4cccc5ccc2c3c45)ccc1Cl 727755322 SFICXJORZGCODH-UHFFFAOYSA-N 468.940 6.199 5 20 JKBD Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)CCCCCC(=O)Nc1cc([N+](=O)[O-])c(C)cc1C 729826926 PROBOWFPHMGKMN-UHFFFAOYSA-N 456.499 5.264 5 20 JKBD CCc1ccccc1NC(=S)Nc1ccc(NS(=O)(=O)c2ccc(C)c([N+](=O)[O-])c2)cc1 730592586 UUZGFUMUEPBMBP-UHFFFAOYSA-N 470.576 5.075 5 20 JKBD COc1ccc(-c2nnc(Sc3nc4ccc([N+](=O)[O-])cc4s3)n2Cc2ccco2)cc1 731209178 VUXDBHVGQVXAAH-UHFFFAOYSA-N 465.516 5.264 5 20 JKBD CCOc1ccc([C@@H](CNC(=O)c2cc(Cl)ccc2[N+](=O)[O-])c2c[nH]c3ccccc23)cc1OC 747709951 SBUTZZPMPQKQGH-HXUWFJFHSA-N 493.947 5.699 5 20 JKBD COc1cc(C(=O)OCc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)ccc1OCc1ccccc1Cl 768236122 FKUGAJYISBXGDK-UHFFFAOYSA-N 495.875 5.243 5 20 JKBD C[C@@H](OC(=O)c1sc(-c2ccco2)nc1-c1ccccc1)C(=O)Nc1ccccc1[N+](=O)[O-] 900281587 HUBIIHBVEFMSIO-CQSZACIVSA-N 463.471 5.162 5 20 JKBD CN(C)C(=O)c1ccccc1NC(=O)C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1 914737884 IPYGSFTVLQIGFL-OBGWFSINSA-N 486.553 5.476 5 20 JKBD O=[N+]([O-])c1ccc(F)cc1CSc1nnc(-c2cccnc2)n1-c1ccc(Br)cc1 915794542 QPZHKVNNZWUERG-UHFFFAOYSA-N 486.326 5.431 5 20 JKBD Cc1cccc(C)c1NC(=O)CCCOC(=O)c1ccc(N2CCC[C@H](C)C2)c([N+](=O)[O-])c1 916590148 BVCDDSCUTUVHHE-KRWDZBQOSA-N 453.539 5.024 5 20 JKBD CC(=O)N(c1ccc(Cl)cc1)c1nc(/C=C/c2ccnc(-c3cccc([N+](=O)[O-])c3)[n+]2[O-])cs1 917560162 IFIOCHHGJUFOAL-JXMROGBWSA-N 493.932 5.255 5 20 JKBD C[C@H](OC(=O)c1cc([N+](=O)[O-])ccc1Oc1ccccc1)C(=O)Nc1c(F)c(F)c(F)c(F)c1F 919191550 GKUAYBAUIGVKOD-JTQLQIEISA-N 496.344 5.267 5 20 JKBD C[C@@H](Nc1ccc(C(=O)OCc2nc(-c3cccc(Cl)c3)no2)cc1[N+](=O)[O-])c1ccccn1 920543806 ANFVRIZKKLUMSB-CQSZACIVSA-N 479.880 5.223 5 20 JKBD O=C(CCCc1ccccc1F)NC1(c2ccc(NC(=O)c3ccc([N+](=O)[O-])o3)cc2)CCC1 1785748731 NFZAOMJAFQTQGP-UHFFFAOYSA-N 465.481 5.098 5 20 JKBD O=C(/C=C/c1ccc([N+](=O)[O-])o1)NC1(c2ccc(NC(=O)c3ccoc3C(F)(F)F)cc2)CCC1 1788721380 FYGMWIQWUOURQT-SOFGYWHQSA-N 489.406 5.261 5 20 JKBD O=C(NC1(c2ccc(NC(=O)c3cccc(C(F)(F)F)c3F)cc2)CCC1)c1ccc([N+](=O)[O-])o1 1790650108 GCSPRJVSGLUWMU-UHFFFAOYSA-N 491.397 5.407 5 20 JKBD CN(C)c1ccc([N+](=O)[O-])cc1C(=O)Nc1ccc(C2(NC(=O)C[C@H]3C[C@@H]4CC[C@H]3C4)CCC2)cc1 1790793294 SZNJMXINDYZEON-HSALFYBXSA-N 490.604 5.235 5 20 JKBD Cc1c(C(=O)NC2(c3ccc(NC(=O)[C@H]4C[C@]4(F)Cl)cc3)CCC2)cc(Cl)cc1[N+](=O)[O-] 1791675852 BUWKKBAIQXRGLV-VGOFRKELSA-N 480.323 5.229 5 20 JKBD Cc1c(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)[C@@H](c2ccccc2)C(C)C)cc(Cl)cc1[N+](=O)[O-] 1793208849 WUTXEXFHAYCOOZ-OOICKAIWSA-N 483.996 5.248 5 20 JKBD Cc1cc(C(=O)N2CCCC[C@H]2c2cc(NC(=O)CCCCCC(C)(C)C)n[nH]2)ncc1[N+](=O)[O-] 1822114298 ALTWRBRUNUFZTK-FQEVSTJZSA-N 484.601 5.324 5 20 JKBD C/C(=C\c1ccc(C)o1)C(=O)N1CCCC[C@H]1C1CCN(C(=O)/C=C/c2ccccc2[N+](=O)[O-])CC1 1829011486 OWYIPKNXXWGJOB-UBSRADMLSA-N 491.588 5.233 5 20 JKBD O=C(Nc1cc2c(cc1Br)OCCO2)c1ccc(Nc2ccccc2)c([N+](=O)[O-])c1 24946928 ZAVSLUZMFLFSDW-UHFFFAOYSA-N 470.279 5.124 5 20 JKBD O=C(CSc1nc(-c2ccccc2)c(-c2ccccc2)o1)Nc1cc2c(cc1[N+](=O)[O-])OCO2 26437524 PCSIDRQZJQDGAD-UHFFFAOYSA-N 475.482 5.376 5 20 JKBD CCN(c1ccccc1)S(=O)(=O)c1cc(NC(=O)c2ccc([N+](=O)[O-])cc2Cl)ccc1Cl 28604843 ZHQGWPOEWPCYTA-UHFFFAOYSA-N 494.356 5.369 5 20 JKBD O=C(CSc1ccc(C(F)(F)F)cc1[N+](=O)[O-])Nc1c(F)cc(F)cc1-c1ccccc1 108315835 ATOHWXQBDWRRHL-UHFFFAOYSA-N 468.403 6.290 5 20 JKBD O=C(Nc1cc([N+](=O)[O-])ccc1OC(F)F)c1cnn(-c2cccc(C(F)(F)F)c2)c1C1CC1 195574257 BHLIMEKBLJTSDK-UHFFFAOYSA-N 482.365 5.530 5 20 JKBD Cc1cc(C)c2sc(N(Cc3ccccc3)C(=O)c3ccc(-n4cncn4)c([N+](=O)[O-])c3)nc2c1 496751626 FPKYXVCFGXVREI-UHFFFAOYSA-N 484.541 5.249 5 20 JKBD Cc1sc(NC(=O)c2nnn(-c3cccc(F)c3)c2C(F)(F)F)nc1-c1cccc([N+](=O)[O-])c1 499784485 WBJKWHIFOFPOJU-UHFFFAOYSA-N 492.414 5.018 5 20 JKBD Cc1csc(Sc2ccc(C(=O)NCC3(c4ccc(F)cc4)CCOCC3)cc2[N+](=O)[O-])n1 507887764 LAMYHNHJNMRRKY-UHFFFAOYSA-N 487.578 5.128 5 20 JKBD COc1ccc(-c2[nH]c3ccccc3c2CCC(=O)N[C@H](C)c2cccc([N+](=O)[O-])c2)c(OC)c1 512810943 AOUJBRHZKKHAOD-QGZVFWFLSA-N 473.529 5.570 5 20 JKBD C[C@H]1CN(c2ccccc2NC(=O)c2ccc(NCc3ccccc3)c([N+](=O)[O-])c2)C[C@H](C)O1 515926156 IVTVPDFAQUDZIB-OALUTQOASA-N 460.534 5.073 5 20 JKBD O=C(Nc1ccc(CN2C(=O)Cc3ccc(Cl)cc32)cc1)c1ccc(N2CCCC2)c([N+](=O)[O-])c1 519494537 DEDQYZIJIQTZIN-UHFFFAOYSA-N 490.947 5.190 5 20 JKBD COc1cc([C@H](C)NCc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)ccc1OCc1ccncc1 520210983 JSFLEZZPNFXYMH-SFHVURJKSA-N 459.502 5.688 5 20 JKBD C[C@@H](NC(=O)C(=O)Nc1ccc(OCc2cccc(C(F)(F)F)c2)cc1)c1cccc([N+](=O)[O-])c1 524423060 USATYFZAKOTKKA-OAHLLOKOSA-N 487.434 5.009 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Cl)[C@H](Nc1ccc(CN2CCCC2=O)cc1)c1ccccc1 604045792 WZDABJSINFUATB-XMMPIXPASA-N 478.936 5.163 5 20 JKBD CNS(=O)(=O)Cc1ccc(CNCc2ccc(Oc3ccc(C(C)(C)C)cc3)c([N+](=O)[O-])c2)cc1 604417947 TUCZMNICPJIIBB-UHFFFAOYSA-N 497.617 5.024 5 20 JKBD CC[C@H](N[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Br)c1ccccc1)c1nc(C)cs1 609221513 JLZCZUZYVIXRFL-HKUYNNGSSA-N 489.395 5.543 5 20 JKBD NC(=O)CCN(C(=O)C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)c1ccccc1 613342206 ZIODFPCKZUOOKX-KNTRCKAVSA-N 486.553 5.044 5 20 JKBD Cc1ccc(Sc2ccc(C(=O)Nc3cc(-c4ccoc4C)nn3CCO)cc2[N+](=O)[O-])cc1 727316535 FVSAKCITPWLTPE-UHFFFAOYSA-N 478.530 5.064 5 20 JKBD COc1ccc([N+](=O)[O-])cc1NC(=O)[C@@H](C)Sc1nc2cc(C(F)(F)F)ccc2s1 753854902 RLTZXYNSSUJTKR-SECBINFHSA-N 457.455 5.351 5 20 JKBD Cc1nc2ccccc2c(-c2ccccc2)c1CC(=O)OCc1nnc(-c2ccc([N+](=O)[O-])cc2)o1 800368872 DKJPJFWYUYAIJV-UHFFFAOYSA-N 480.480 5.454 5 20 JKBD Cc1nc(COc2ccc(Cl)cc2)sc1C(=O)O[C@H](C)C(=O)Nc1cccc([N+](=O)[O-])c1C 857838457 SSVWAJNBLWSYRK-CQSZACIVSA-N 489.937 5.085 5 20 JKBD Cc1ncsc1CCOC(=O)C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1 912720255 GYDWALYOYAPVOZ-ATVHPVEESA-N 465.556 5.686 5 20 JKBD CC(C)NC(=O)Nc1ccc(C(=O)Oc2ccc(NC(=O)c3cc([N+](=O)[O-])ccc3Cl)cc2)cc1 916951800 IILWMRALGWBDEA-UHFFFAOYSA-N 496.907 5.250 5 20 JKBD Cc1ccc(C(=O)N2C[C@@H](C)C[C@H](C)C2)cc1NC(=O)c1cc([N+](=O)[O-])ccc1N1CCCCC1 917742048 OSSKRGHIAWWKNT-OALUTQOASA-N 478.593 5.264 5 20 JKBD O=C(OCC[C@H]1CCCCN1C(=O)c1ccc(Oc2ccccc2)nc1)c1cccc([N+](=O)[O-])c1 918327668 XYJZWONGRYMZKQ-OAQYLSRUSA-N 475.501 5.024 5 20 JKBD CCc1ccccc1N(C(C)=O)c1nc(COC(=O)c2cc3cc([N+](=O)[O-])ccc3[nH]2)cs1 919515991 KWNBJHGXSGJDPX-UHFFFAOYSA-N 464.503 5.137 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Cl)[C@@H](NCc1ccc(N2CCCCC2=O)cc1)c1ccccc1 920062091 BDSVUDYWQTWTTC-VWLOTQADSA-N 492.963 5.235 5 20 JKBD O=C(Oc1cc(Cl)ccc1[N+](=O)[O-])[C@@H]1CCCN(C(=O)c2ccc(Cl)c(Cl)c2)C1 921134034 LVZKIVVLJQBNLL-GFCCVEGCSA-N 457.697 5.013 5 20 JKBD COc1ccc(-c2nnc(SCC(=O)OCc3nc4ccccc4c4ccccc34)o2)cc1 921250508 PAQVOTXDURCTFG-UHFFFAOYSA-N 457.511 5.282 5 20 JKBD Cc1cc2cc(C(=O)NC3(c4ccc(NC(=O)/C=C/c5ccc([N+](=O)[O-])o5)cc4)CCC3)ccc2[nH]1 1786207689 DBNGPEKADKOEFV-DHZHZOJOSA-N 484.512 5.439 5 20 JKBD O=C(/C=C/c1ccc([N+](=O)[O-])o1)NC1(c2ccc(NC(=O)c3ccc4cc[nH]c4c3)cc2)CCC1 1788911913 CHQKNWQKYQAYAM-CSKARUKUSA-N 470.485 5.130 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)NC1(c2ccc(NC(=O)c3ccc4c(c3)COC4)cc2)CCC1 1789035199 CALXPNROHHBFLC-UHFFFAOYSA-N 489.503 5.134 5 20 JKBD Cc1ccc2oc(C(=O)NC3(c4ccc(NC(=O)c5cccc(F)c5[N+](=O)[O-])cc4)CCC3)cc2n1 1790698579 BOWAKUSHEKOVPW-UHFFFAOYSA-N 488.475 5.245 5 20 JKBD Cc1cccc(/C=C/C(=O)NC2(c3ccc(NC(=O)c4c(F)ccc([N+](=O)[O-])c4C)cc3)CCC2)n1 1790773985 HKMTXVHEBOVDTK-SDNWHVSQSA-N 488.519 5.207 5 20 JKBD CCCCCc1ccc(CC(=O)N2CCCC[C@H]2c2cc(NC(=O)c3ccc([N+](=O)[O-])o3)n[nH]2)cc1 1814312248 KZWAPJCTFCZQRE-NRFANRHFSA-N 493.564 5.192 5 20 JKBD O=C(Nc1cc([C@H]2CCCCN2C(=O)/C=C/c2ccccc2[N+](=O)[O-])[nH]n1)c1sccc1Cl 1819958937 INVRJSJTZHGGCP-GFOMBABLSA-N 485.953 5.052 5 20 JKBD CC1(C)CCC(CC(=O)Nc2cc([C@H]3CCCCN3C(=O)/C=C/c3ccc([N+](=O)[O-])o3)[nH]n2)CC1 1820974627 BMBDSFGYZXSZFX-CPSHHHPTSA-N 483.569 5.223 5 20 JKBD C[C@@H](C(=O)N1CCC([C@H]2CCCCN2C(=O)CCc2cccc([N+](=O)[O-])c2)CC1)c1cccs1 1824842961 LNXZIGGAQJWQMI-AUSIDOKSSA-N 483.634 5.012 5 20 JKBD CCC[C@H]1CC[C@H](C(=O)N2CCC([C@H]3CCCCN3C(=O)c3cc(C)c([N+](=O)[O-])cn3)CC2)CC1 1827832427 JSFOODUCIBBOBE-KIFXHHALSA-N 484.641 5.138 5 20 JKBD Cc1cc(F)cc(C(=O)N2CCCC[C@H]2C2CCN(C(=O)CSc3ccccc3[N+](=O)[O-])CC2)c1 1830508580 MRAYSDCWQXYUQO-QFIPXVFZSA-N 499.608 5.068 5 20 JKBD Cc1cc(C)c(C(=O)N2CCCC[C@H]2C2CCN(C(=O)/C=C/c3ccc([N+](=O)[O-])o3)CC2)c(C)c1 1832574360 YBGFPYPDMACJQF-WCYCAPIHSA-N 479.577 5.060 5 20 JKBD Cc1cc(CCCC(=O)N2CCC([C@H]3CCCCN3C(=O)CC3CCC3)CC2)c([N+](=O)[O-])cc1F 1832830372 FRMUHGYKZXHBHX-XMMPIXPASA-N 487.616 5.175 5 20 JKBD O=C(O[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1)c1ccc(F)cc1Cl 11445443 ZQOQEEPYUPMWSS-IBGZPJMESA-N 463.248 5.578 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Cl)[C@H](NCc1coc(-c2cccs2)n1)c1ccccc1 11723079 JMVDHTCJEYJURZ-HXUWFJFHSA-N 468.922 5.434 5 20 JKBD Cc1nn(Cc2ccc(C(=O)O[C@H](C)C(=O)Nc3ccccc3-c3ccccc3)cc2)c(C)c1[N+](=O)[O-] 17158868 CTVKOBFRRKIRJB-HXUWFJFHSA-N 498.539 5.307 5 20 JKBD CSc1cccc(NC(=O)[C@@H](C)OC(=O)c2ccccc2C(=O)c2ccc(Cl)c([N+](=O)[O-])c2)c1 22669802 QCSUNTUXGGTXMY-CQSZACIVSA-N 498.944 5.385 5 20 JKBD COc1ccc(-c2nnc(SCc3ccccc3[N+](=O)[O-])n2C2CCCCC2)cc1OC 25114874 LMQKHMJFVYXEMQ-UHFFFAOYSA-N 454.552 5.668 5 20 JKBD O=C(Nc1ccccc1C(=O)N1CCC(C(=O)c2ccccc2)CC1)c1ccc([N+](=O)[O-])cc1Cl 26129324 MKDCJPCZVMAUPG-UHFFFAOYSA-N 491.931 5.236 5 20 JKBD C[C@@H](NC(=O)c1cc([N+](=O)[O-])ccc1NCc1ccccc1)c1ccc(NC(=O)C2CC2)cc1 27299349 AWTUZISDANAYSI-QGZVFWFLSA-N 458.518 5.046 5 20 JKBD Cc1ccc(NC(=O)[C@H](Sc2nn(-c3ccccc3)c(=S)s2)c2ccccc2)c([N+](=O)[O-])c1 36186299 VKYYBMOVYSKTOE-HXUWFJFHSA-N 494.623 6.352 5 20 JKBD CCOc1ccc(C(=O)Nc2ccc3c(c2)CCC(=O)N3Cc2ccc(Cl)cc2)cc1[N+](=O)[O-] 195721926 NMXDODVFMMOHMT-UHFFFAOYSA-N 479.920 5.379 5 20 JKBD Cc1ccc(NS(=O)(=O)c2ccc(Sc3nnc(-c4ccoc4C)o3)c([N+](=O)[O-])c2)c(C)c1 484096716 JVTLKDFSWHUYEY-UHFFFAOYSA-N 486.531 5.115 5 20 JKBD CC(=O)Nc1cc(NC(=O)C/C(=C\c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)ccc1C 484263728 FVDOQGOMGCWWPL-CPNJWEJPSA-N 486.553 6.041 5 20 JKBD Cc1[nH]c2ccccc2c1C1CCN(C(=O)c2cc(OCC(F)(F)F)ccc2[N+](=O)[O-])CC1 490399996 LTNJDARENQGUAX-UHFFFAOYSA-N 461.440 5.345 5 20 JKBD C[C@@H]1CCCN(c2ccc(C(=O)N[C@H](C)c3nc4ccccc4n3C(F)F)cc2[N+](=O)[O-])C1 491396872 QMTDDJVOOBHUFC-HUUCEWRRSA-N 457.481 5.067 5 20 JKBD O=C(Nc1cc(C(F)(F)F)ccc1N1CCCC1)C1CCN(c2ccccc2[N+](=O)[O-])CC1 498723972 CRRBARJGPYDYCT-UHFFFAOYSA-N 462.472 5.069 5 20 JKBD CC[C@@H](C)Sc1ccc(NC(=O)c2cc(OCC(F)(F)F)ccc2[N+](=O)[O-])c(C(F)(F)F)c1 499532281 IAPFIDFIJMSJLE-LLVKDONJSA-N 496.429 6.698 5 20 JKBD O=C(C1CCN(c2ccccc2[N+](=O)[O-])CC1)N(Cc1ccc(F)cc1)c1nc2ccccc2s1 501774164 UBZADRVWEBGJDW-UHFFFAOYSA-N 490.560 5.793 5 20 JKBD O=C(Nc1ccc(OC[C@H]2CCCO2)cc1)c1cc([N+](=O)[O-])ccc1Sc1ccccc1 502043098 SGHKRCFJORMSEL-HXUWFJFHSA-N 450.516 5.556 5 20 JKBD O=C(NC1CC1)c1cccc(CNCc2ccc(Oc3ccccc3Cl)c([N+](=O)[O-])c2)c1 507905462 TXCZBQPSHRFRKP-UHFFFAOYSA-N 451.910 5.223 5 20 JKBD CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)C1CCN(c2ncc(C(F)(F)F)cc2Cl)CC1 509720792 SJBJMBLPIHQGDU-UHFFFAOYSA-N 484.906 5.316 5 20 JKBD CCN(C(=O)c1cc(OC)c(OCc2cscn2)cc1[N+](=O)[O-])c1cccc(Br)c1 512254164 UFDHNIZSSCHWBE-UHFFFAOYSA-N 492.351 5.068 5 20 JKBD CCOc1cc(C(=O)Nc2ccc(Oc3ccc(C(F)(F)F)cc3)nc2)c([N+](=O)[O-])cc1OC 520534654 RBAJMENLSHIZNU-UHFFFAOYSA-N 477.395 5.461 5 20 JKBD CN(CCCCCc1cc(-c2cccc(F)c2)no1)C(=O)Cn1c2ccccc2c(=O)c2ccccc21 521009956 JNSKGNFBPDEWPP-UHFFFAOYSA-N 497.570 5.820 5 20 JKBD O=C(NCc1ccccc1COCc1ccccc1)Nc1cc([N+](=O)[O-])ccc1OC(F)F 521184355 PIVJLBZXSOVOOP-UHFFFAOYSA-N 457.433 5.235 5 20 JKBD O=C(Nc1ccccc1OCc1ncc(-c2cccc(Cl)c2)o1)c1c[nH]c2ccc([N+](=O)[O-])cc12 524224956 PCOOTLRFOHKDID-UHFFFAOYSA-N 488.887 6.216 5 20 JKBD CN1C/C(=C\c2ccc(-c3ccc([N+](=O)[O-])cc3)s2)c2nc3ccccc3c(C(=O)O)c2C1 591631560 WNUFXBJPDQRFRB-FOWTUZBSSA-N 457.511 5.556 5 20 JKBD CCOc1ccc(C(=O)Nc2cc(-c3ccccc3OC)nn2-c2ccccc2)cc1[N+](=O)[O-] 603760681 QOMFDJWIVZIYSE-UHFFFAOYSA-N 458.474 5.107 5 20 JKBD O=C(C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)NCCc1ccccc1F 603820730 WWHOCYBAUVZAMY-XDJHFCHBSA-N 461.518 5.633 5 20 JKBD C[C@H](Sc1nc2ccc(C(F)(F)F)cc2[nH]1)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 603938222 NYDLPGGDDPWVRO-QMMMGPOBSA-N 478.374 5.628 5 20 JKBD C[C@@H](CNC(=O)C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)CN1CCCCC1 604441495 GMZVHHIRKKYNAC-QTKYHAHDSA-N 478.618 5.373 5 20 JKBD O=C(Nc1ccc(OC(=O)c2csc(Cc3ccc(F)cc3)n2)cc1)c1cccc([N+](=O)[O-])c1 726910638 HWOLZCBNNOXQFJ-UHFFFAOYSA-N 477.473 5.253 5 20 JKBD O=C(O[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Br)c1ccccc1)c1ccc2ncoc2c1 727194939 WANTVRIDXRWJCJ-FQEVSTJZSA-N 496.273 5.035 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)Nc2ccc(N3CCC(OC)CC3)c(C(F)(F)F)c2)cc1SC 728475071 JGMXRWZDQPLORF-UHFFFAOYSA-N 499.511 5.212 5 20 JKBD CC(C)N(CC(=O)Nc1ccc(Cl)cc1C(F)(F)F)C(=O)c1ccc(Cl)c([N+](=O)[O-])c1 728838560 SBSRBLRCSHNTRV-UHFFFAOYSA-N 478.254 5.410 5 20 JKBD CSc1ccc(C(=O)Nc2ccc(NC(=O)OC(C)(C)C)cc2C(F)(F)F)cc1[N+](=O)[O-] 729655074 FHYXXNCWGPKTDG-UHFFFAOYSA-N 471.457 5.935 5 20 JKBD COc1ccc(C(=O)O[C@@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2ccccc2)c(Cl)c1 731089563 SMMFXEGQUSOZRH-HXUWFJFHSA-N 475.284 5.447 5 20 JKBD O=C(OCC1CCN(c2ncccc2[N+](=O)[O-])CC1)c1nc(-c2ccccc2)oc1-c1ccccc1 731416016 ICVKJVRQFNVKHJ-UHFFFAOYSA-N 484.512 5.385 5 20 JKBD Cc1oc2nc(S[C@@H](C)C(=O)Nc3cccc([N+](=O)[O-])c3)nc(NC(=O)c3ccccc3)c2c1C 878923290 YCIKLBMADRBIAP-HNNXBMFYSA-N 491.529 5.119 5 20 JKBD Cc1ncsc1CCOC(=O)C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1 912720256 GYDWALYOYAPVOZ-SFQUDFHCSA-N 465.556 5.686 5 20 JKBD COc1ccc(Oc2ccc([N+](=O)[O-])cc2C(=O)O[C@@H](C)C(=O)Nc2c(C)cccc2C(C)C)cc1 915442663 ONORYSXFSBAZBF-SFHVURJKSA-N 492.528 6.012 5 20 JKBD C[C@@H](NCc1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1)c1ccc2c(c1)CCC(=O)N2 915683206 PDEPYZMLFUDEMZ-OAHLLOKOSA-N 451.910 5.776 5 20 JKBD Cc1ccc(NC(=O)[C@@H](OC(=O)c2cc(C)nc3onc(C(C)C)c23)c2ccccc2)c([N+](=O)[O-])c1 920897519 ZZNVMNFUHXYIGM-QHCPKHFHSA-N 488.500 5.408 5 20 JKBD O=C(Cc1cccc([N+](=O)[O-])c1)Nc1ccc(C2(NC(=O)c3cccc4nscc34)CCC2)cc1 1785795207 BRSSOUJIFGURHE-UHFFFAOYSA-N 486.553 5.195 5 20 JKBD O=C(/C=C/C1CC1)Nc1ccc(C2(NC(=O)c3ccc(Br)c([N+](=O)[O-])c3)CCC2)cc1 1786160741 JCPBCBYRYXIOQL-NYYWCZLTSA-N 484.350 5.071 5 20 JKBD C[C@H]1CCC[C@@H]1C(=O)NC1(c2ccc(NC(=O)Cn3ccc4ccc([N+](=O)[O-])cc43)cc2)CCC1 1786277846 WWQHDBYTJWULJW-MBSDFSHPSA-N 474.561 5.120 5 20 JKBD O=C(Cc1cc([N+](=O)[O-])ccc1F)Nc1ccc(C2(NC(=O)c3cc4ccccc4o3)CCC2)cc1 1786671150 LZQKWBXIZRQHPY-UHFFFAOYSA-N 487.487 5.471 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)c3cc(F)cc([N+](=O)[O-])c3)CCC2)cc1)c1ccc2scnc2c1 1789340611 CGKMSLBYAWEYGG-UHFFFAOYSA-N 490.516 5.405 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)c3cc4cccnc4s3)CCC2)cc1)c1cc(F)cc([N+](=O)[O-])c1 1790696379 AGHDUNVDXSVBBR-UHFFFAOYSA-N 490.516 5.405 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)c3cccc4ncsc34)CCC2)cc1)c1cc(F)cc([N+](=O)[O-])c1 1790697313 AEPYJGHAFQGIKU-UHFFFAOYSA-N 490.516 5.405 5 20 JKBD CCN1CCC(C(=O)NC2(c3ccc(NC(=O)c4cc(Cl)cc([N+](=O)[O-])c4C)cc3)CCC2)CC1 1790773879 IWJVYOUCLKQVDR-UHFFFAOYSA-N 499.011 5.036 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)c3sccc3Cl)CCC2)cc1)c1nc2cc([N+](=O)[O-])ccc2[nH]1 1790828097 XTSJPXRKTWWNBQ-UHFFFAOYSA-N 495.948 5.248 5 20 JKBD COc1ccc(C(=O)Nc2ccc(C3(NC(=O)c4cc(O)cc([N+](=O)[O-])c4)CCC3)cc2)c(Cl)c1 1792141875 ZIWPMRRJAZIDAN-UHFFFAOYSA-N 495.919 5.024 5 20 JKBD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CCc1cccc([N+](=O)[O-])c1)c1cc2c(Cl)cccc2s1 1793939720 ZKHVGILBFVUFMH-BCDXTJNWSA-N 498.004 5.348 5 20 JKBD C/C(=C\c1cccs1)C(=O)N1CCCC2(CCN(C(=O)c3c(F)ccc([N+](=O)[O-])c3C)CC2)C1 1804812602 GQCBJCXRTLKNJD-BMRADRMJSA-N 485.581 5.052 5 20 JKBD O=C(c1cccc2ccccc12)N1CCC([C@H]2CCCCN2C(=O)/C=C/c2ccc([N+](=O)[O-])o2)CC1 1824276390 GUSSFNUELQYSKZ-CVJKAFSHSA-N 487.556 5.288 5 20 JKBD Cc1cc(C(=O)N2CCC([C@@H]3CCCCN3C(=O)c3cc(C(C)(C)C)oc3C)CC2)ncc1[N+](=O)[O-] 1825950149 IWIGJKVTEXFNHD-QFIPXVFZSA-N 496.608 5.044 5 20 JKBD Cc1ccc(CC(=O)N2CCC([C@@H]3CCCCN3C(=O)c3cccc(Cl)c3)CC2)cc1[N+](=O)[O-] 1829975018 BVZZXTIECAFUNW-QHCPKHFHSA-N 483.996 5.033 5 20 JKBD Cc1cc(O)c([N+](=O)[O-])cc1C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2ccc(C3CC3)cc2)CC1 1830750301 QMUIIILXUKIVCD-DEOSSOPVSA-N 491.588 5.033 5 20 JKBD Cc1ccc(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3cccc(F)c3[N+](=O)[O-])CC2)c(Cl)c1 1832607350 IDTIRSKACHKWHC-JOCHJYFZSA-N 487.959 5.243 5 20 JKBD O=C(c1cccc(F)c1[N+](=O)[O-])N1CC2(CCCN2C(=O)C2CCC(c3ccc(Cl)cc3)CC2)C1 1841409404 OBEFETNBYFUCCM-UHFFFAOYSA-N 499.970 5.178 5 20 JKBD CCC[C@H]1CC[C@H](C(=O)N2CC3(CCCN3C(=O)c3cc4cc([N+](=O)[O-])ccc4s3)C2)CC1 1845739454 ADGWXZAJEMGBLR-IYARVYRRSA-N 469.607 5.233 5 20 JKBD COc1cc([N+](=O)[O-])ccc1NC(=O)CSc1nnc(-c2ccccc2Cl)n1C1CCCC1 8989071 ZMOXLAAJYFHHSL-UHFFFAOYSA-N 487.969 5.361 5 20 JKBD CCn1c(SCC(=O)Nc2ccc(F)c([N+](=O)[O-])c2)nnc1-c1ccc(Cl)cc1Cl 9848714 TYDSCDRJPBPYFQ-UHFFFAOYSA-N 470.313 5.050 5 20 JKBD CC[C@H](C)c1ccc([C@H](NC(=O)c2ccc(S(C)(=O)=O)c([N+](=O)[O-])c2)c2cccs2)cc1 14316086 DYLABGJUFCWIRI-NYHFZMIOSA-N 472.588 5.093 5 20 JKBD Cn1cnnc1Sc1ccc(C(=O)Nc2cc(Cl)ccc2Oc2ccccc2)cc1[N+](=O)[O-] 14623209 TVTYKFFOQZKUMH-UHFFFAOYSA-N 481.921 5.573 5 20 JKBD CN(Cc1nc2ccccc2s1)[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1 15515058 WIWVQZHAFLCNPE-QFIPXVFZSA-N 466.950 5.670 5 20 JKBD Cc1ccc(-c2nnc([C@@H](C)OC(=O)c3ccccc3C(=O)c3ccc(Cl)c([N+](=O)[O-])c3)o2)cc1 17528580 BIAVWIPMJNAHRA-OAHLLOKOSA-N 491.887 5.756 5 20 JKBD Cc1ccc(N(CC(=O)Nc2ccccc2C)S(=O)(=O)c2ccc(Cl)c([N+](=O)[O-])c2)c(C)c1 20923395 QCKUCAYYKPAJMF-UHFFFAOYSA-N 487.965 5.007 5 20 JKBD Cc1sc2ncnc(SCC(=O)Nc3nc(-c4cccc([N+](=O)[O-])c4)cs3)c2c1C 23560003 JODXCJSVYATTGI-UHFFFAOYSA-N 457.562 5.071 5 20 JKBD C[C@@H](OC(=O)Cc1coc2ccc3ccccc3c12)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl 28937214 MHIQWVPVVMNTFQ-CYBMUJFWSA-N 452.850 5.261 5 20 JKBD Cc1ccnn1-c1ccc(C(=O)Oc2ccc(NC(=O)c3cc([N+](=O)[O-])ccc3Cl)cc2)cc1 29472572 LNGKXIYOLQEQEW-UHFFFAOYSA-N 476.876 5.214 5 20 JKBD CCc1cc(Sc2nnc(-c3ccccc3OC)n2CC)nc(-c2ccc([N+](=O)[O-])cc2)n1 108850307 JPKNJBGMKPXIPL-UHFFFAOYSA-N 462.535 5.052 5 20 JKBD CCCNC(=O)c1ccc(NC(=O)c2ccc(Nc3ccccc3)c([N+](=O)[O-])c2)cc1Cl 108874429 SRRFACHCXOBDAB-UHFFFAOYSA-N 452.898 5.384 5 20 JKBD O=C(Cn1c2ccccc2c(=O)c2ccccc21)Nc1nc(-c2cc3ccccc3o2)cs1 247716083 NIVNYXZBXRREAY-UHFFFAOYSA-N 451.507 5.663 5 20 JKBD Cc1c(C(=O)N[C@@H](c2ccccc2)c2ccc3nc(C(F)(F)F)[nH]c3c2)cc([N+](=O)[O-])cc1[N+](=O)[O-] 247987987 KPOSWBVIIFDJFZ-FQEVSTJZSA-N 499.405 5.226 5 20 JKBD Cc1ccc(-c2csc(NC(=O)CSc3nnc(-c4ccc(Cl)cc4)o3)n2)cc1[N+](=O)[O-] 302922608 VPSQFTWNOKIPHW-UHFFFAOYSA-N 487.950 5.461 5 20 JKBD C[C@H](Nc1ccc(C(=O)NCCOc2cccc3ccccc23)cc1[N+](=O)[O-])c1ccccn1 410089174 RRNKWRGCKRGAFQ-SFHVURJKSA-N 456.502 5.125 5 20 JKBD O=C(N[C@@H](c1ccc(Cl)cc1)c1cccs1)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-] 488509680 AEJHNJXUYSMOSM-SFHVURJKSA-N 470.856 5.770 5 20 JKBD CCOc1cc(C(=O)N(Cc2ccco2)C23CC4CC(CC(C4)C2)C3)c([N+](=O)[O-])cc1OC 498916225 DABKDJDYXNMPBV-UHFFFAOYSA-N 454.523 5.206 5 20 JKBD C[C@H](Nc1ccc(NC(=O)c2cccs2)cc1)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 501989294 NEWZMBYTRFFUOF-LBPRGKRZSA-N 478.452 5.367 5 20 JKBD CSc1ccc(C(=O)c2ccccc2C(=O)Nc2ccc(-c3ncc[nH]3)cc2)cc1[N+](=O)[O-] 502529127 KFGDBASWHZJFDM-UHFFFAOYSA-N 458.499 5.190 5 20 JKBD Cc1ccc(-c2csc(NC(=O)c3cnn(-c4ncccc4Cl)c3C(F)F)n2)cc1[N+](=O)[O-] 503136060 JHXKJBZZULBGIQ-UHFFFAOYSA-N 490.879 5.451 5 20 JKBD O=C(NCCCc1ccc(Cl)cc1)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 503354962 WEQXNBQCAVGKGA-UHFFFAOYSA-N 469.891 5.232 5 20 JKBD Cc1ccc(C(=O)N2c3ccc([N+](=O)[O-])cc3C[C@@H]2C)cc1NC(=O)c1ccc(Br)cc1 504334143 INQMFCNDXGWABV-HNNXBMFYSA-N 494.345 5.509 5 20 JKBD CC(C)N(C)C(=O)c1ccc(Cl)c(NC(=O)CSc2ccc(C(F)(F)F)cc2[N+](=O)[O-])c1 508505733 BUZYLOZOTYCPDZ-UHFFFAOYSA-N 489.903 5.478 5 20 JKBD O=C(Nc1cccc(S(=O)(=O)Nc2ccc(Cl)cc2)c1)c1cc2cc([N+](=O)[O-])ccc2o1 508726375 IMRAWRNBURWTDI-UHFFFAOYSA-N 471.878 5.048 5 20 JKBD CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)N[C@H](c1ccccc1)c1nc2ccccc2n1C 509684924 BIXRXHSERSILBK-XMMPIXPASA-N 457.534 5.191 5 20 JKBD O=C(c1ccc(Sc2nc3ccccc3s2)c([N+](=O)[O-])c1)N1CCCC[C@H]1c1ncc[nH]1 509952022 LFNPRVPEGMCCEW-INIZCTEOSA-N 465.560 5.446 5 20 JKBD Cc1ccc(CN(C(=O)Cn2c3ccccc3c(=O)c3ccccc32)c2ccc3c(c2)OCCO3)s1 512403335 AYGRXBJAFZDWIE-UHFFFAOYSA-N 496.588 5.529 5 20 JKBD CCCC(=O)Nc1cccc(NC(=O)Cc2cn(-c3ccccc3)nc2-c2ccc([N+](=O)[O-])cc2)c1 515613291 HBLAQQWBSBCSHT-UHFFFAOYSA-N 483.528 5.367 5 20 JKBD O=C(Nc1cccc(NC(=O)c2cc3c(cc2[N+](=O)[O-])OCO3)c1)Nc1cccc(C(F)(F)F)c1 516659192 MQUILBSQIJLHTE-UHFFFAOYSA-N 488.378 5.239 5 20 JKBD CCCN(C(=O)c1ccc(N[C@@H](C)c2ccccn2)c([N+](=O)[O-])c1)[C@H](C)c1ccccc1OC 519887096 RUAKLEQEEFYYTE-RBUKOAKNSA-N 462.550 5.785 5 20 JKBD O=C(c1ccc([N+](=O)[O-])s1)N(C[C@@H]1CCCO1)c1nc(-c2ccc(Cl)cc2Cl)cs1 603463243 ULXGVIZQPRPIPG-LBPRGKRZSA-N 484.386 5.912 5 20 JKBD COc1ccc(-c2nn(Cc3ccccc3)cc2C(=O)N[C@H](C)c2cccc([N+](=O)[O-])c2)cc1 603966196 FCPKZHRUIOWIKH-GOSISDBHSA-N 456.502 5.006 5 20 JKBD O=[N+]([O-])c1cnc2ccc(Br)cc2c1N1C[C@@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1 604270715 NNUWBPDTSSIKNQ-DTORHVGOSA-N 472.183 5.473 5 20 JKBD O=C(C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)Nc1cnn(Cc2ccccn2)c1 604549070 ZQXGKKVARYTUBT-CPNJWEJPSA-N 496.552 5.414 5 20 JKBD COc1ccc(NC(=O)c2ccc(N3CCCC3)c([N+](=O)[O-])c2)cc1OCc1ccc2ccccc2n1 609066079 GBVNCSWAJBADFD-UHFFFAOYSA-N 498.539 5.583 5 20 JKBD O=[N+]([O-])c1cc(C(F)(F)F)c(Cl)cc1N1CCC(c2nc(-c3ccccn3)no2)CC1 726593839 AQSYDFIKTRGRNZ-UHFFFAOYSA-N 453.808 5.096 5 20 JKBD O=C(CCC(=O)c1ccc2ccc3cccc4ccc1c2c34)NCCCN1CCCCCC1=O 727753093 JYBDRRAIDRYZLX-UHFFFAOYSA-N 454.570 5.456 5 20 JKBD NC(=O)c1oc2ccccc2c1NC(=O)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1 728303393 PWUFAVRCXFHRNG-UHFFFAOYSA-N 451.822 5.138 5 20 JKBD CN(C(=O)c1sc2cccc(Cl)c2c1Cl)S(=O)(=O)c1ccc(Cl)c([N+](=O)[O-])c1 916992976 AKDILKFDQOSQCS-UHFFFAOYSA-N 479.750 5.231 5 20 JKBD O=C(CCc1ccc2ccccc2n1)O[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1 917236488 SBNUKIOQRZEQCZ-RUZDIDTESA-N 489.915 5.652 5 20 JKBD CN(c1ccccc1)c1ccccc1C(=O)OCC(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 919295822 CCWQAVTUYGSDII-UHFFFAOYSA-N 473.407 5.177 5 20 JKBD Cc1cc(CCCC(=O)Nc2ccc(C3(NC(=O)[C@@H]4CC4(F)F)CCC3)cc2)c([N+](=O)[O-])cc1F 1786274644 JTAHDIDFWFCRLO-IBGZPJMESA-N 489.494 5.154 5 20 JKBD COc1ccc2oc(C(=O)Nc3ccc(C4(NC(=O)c5ccc([N+](=O)[O-])o5)CCC4)cc3)cc2c1 1789238151 HUYRTMBZKQAVEU-UHFFFAOYSA-N 475.457 5.004 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)c3cc4cc([N+](=O)[O-])ccc4s3)CCC2)cc1)C1=COCCC1 1791639463 OGNWMFLLNISFFW-UHFFFAOYSA-N 477.542 5.252 5 20 JKBD CC[C@H](C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cc3cc([N+](=O)[O-])ccc3s1)C2)c1ccccc1 1795457120 BKTHMRSBJWPAAB-IIZPIQPGSA-N 477.586 5.255 5 20 JKBD Cc1cccc(Cl)c1C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2ccc([N+](=O)[O-])cc2F)[nH]n1 1821144700 RIDJKCMQKBIECP-LJQANCHMSA-N 485.903 5.039 5 20 JKBD O=C(/C=C/c1ccccc1[N+](=O)[O-])N1CCC([C@H]2CCCCN2C(=O)c2c(F)cccc2Cl)CC1 1829901223 XAKODAZGVRWVIK-VDZCTEQFSA-N 499.970 5.334 5 20 JKBD CC(C)=CCCC(=O)N1CCCC[C@H]1C1CCN(C(=O)c2c(F)ccc([N+](=O)[O-])c2C)CC1 1830257778 WXRZBPSKJGIMEH-QFIPXVFZSA-N 459.562 5.022 5 20 JKBD CC(C)[C@H]1CC[C@H](C(=O)N2CCCC[C@H]2C2CCN(C(=O)Cc3cccc([N+](=O)[O-])c3)CC2)CC1 1831562251 LVLNXNALHMBLRH-GVUKDKGQSA-N 483.653 5.219 5 20 JKBD O=C(C[C@H]1C[C@@H]2CC[C@H]1C2)N1CCC([C@@H]2CCCCN2C(=O)/C=C/c2ccccc2[N+](=O)[O-])CC1 1832903820 LHYNSIRJXJTKJR-RSRHMREQSA-N 479.621 5.054 5 20 JKBD O=C(/C=C/c1ccccc1[N+](=O)[O-])N1CCCC[C@@H]1C1CCN(C(=O)C23CCC(CC2)CC3)CC1 1832904214 PCEFRAVMJYJIKC-DVWLEDAASA-N 479.621 5.198 5 20 JKBD CSc1ccc(C(=O)c2ccccc2C(=O)OCC(=O)c2c[nH]c3ccccc23)cc1[N+](=O)[O-] 10154572 JOTREOFBQKBPCR-UHFFFAOYSA-N 474.494 5.069 5 20 JKBD COc1cc(CSc2nnc(-c3ccco3)n2CC(C)C)c([N+](=O)[O-])cc1OC(F)F 12465003 GZMLDRLPEOOQHH-UHFFFAOYSA-N 454.455 5.005 5 20 JKBD Cc1ccc([N+](=O)[O-])cc1NC(=O)c1cccc(NS(=O)(=O)c2ccc(Cl)c(Cl)c2)c1 15410363 WFZLAVMQJGZVON-UHFFFAOYSA-N 480.329 5.263 5 20 JKBD COc1ccc(N2C(=O)/C(=C/c3cccs3)N=C2SCc2csc([N+](=O)[O-])c2)cc1Cl 71937537 ZEFPYTKWWGJLSO-SXGWCWSVSA-N 492.003 6.057 5 20 JKBD O=C(CN(Cc1ccco1)C(=O)Cc1ccccc1[N+](=O)[O-])Nc1ccc(Cl)c(C(F)(F)F)c1 255943336 JPCDCGVCQXYRRH-UHFFFAOYSA-N 495.841 5.070 5 20 JKBD O=C(Nc1ccc(Oc2ncc(Cl)cc2Cl)cc1)C1CCN(c2ccccc2[N+](=O)[O-])CC1 485793129 VWHIGKWKJOQFAV-UHFFFAOYSA-N 487.343 5.944 5 20 JKBD CCC(=O)N[C@H]1CCCN(C(=O)c2c3c(nc4ccccc24)/C(=C\c2ccc([N+](=O)[O-])cc2)CCC3)C1 499569396 FOTWAFYBEFZGFZ-ZOECDYFQSA-N 498.583 5.151 5 20 JKBD C[C@H](NC(=O)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1)c1ccc2c(c1)CC(=O)N2 501052215 ODEBAIOPCDHBBC-ZDUSSCGKSA-N 451.866 5.026 5 20 JKBD CN(C)Cc1cccc(NC(=O)c2ccccc2Sc2ccc(C(F)(F)F)cc2[N+](=O)[O-])c1 506773090 DKLZCTSDCGRHDX-UHFFFAOYSA-N 475.492 6.079 5 20 JKBD CCCOc1ccccc1NC(=O)Cc1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1 506965476 WBMMQMNMLZKABU-UHFFFAOYSA-N 456.502 5.418 5 20 JKBD O=C(Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1)C1(c2ccc(Br)cc2)CCOCC1 508912542 AGGSOVNLOGCWRY-UHFFFAOYSA-N 488.363 5.168 5 20 JKBD C[C@H]1CN(Cc2cccc(CNCc3ccc(Oc4ccccc4Cl)c([N+](=O)[O-])c3)c2)CCO1 509618427 MSSASJYXCAURIE-IBGZPJMESA-N 481.980 5.551 5 20 JKBD COc1ccc(C)cc1C1(CNC(=O)c2ccc(NCc3ccccc3)c([N+](=O)[O-])c2)CCOCC1 510155089 VECZBSMHPBJDNE-UHFFFAOYSA-N 489.572 5.002 5 20 JKBD CCOc1cc(NC(=O)N2CCC[C@@H]2c2nc3ccccc3n2CC)c([N+](=O)[O-])cc1OCC 513953198 KZQMQYWXSBBWEB-LJQANCHMSA-N 467.526 5.131 5 20 JKBD C[C@@H]([C@@H]1C[C@H]2CC[C@H]1C2)n1c(SCc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)nnc1-c1ccco1 514298532 PHGCLEVBYBGRMU-MRHSLFKSSA-N 492.561 5.786 5 20 JKBD C[C@@H](NC(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccc(NC(=O)c2ccc(F)cc2)cc1 518522541 DMUZWELHDJCNSV-CYBMUJFWSA-N 456.861 5.522 5 20 JKBD O=C(Nc1ccc(-n2cnc3ccccc32)cc1)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-] 603732554 UWNPZWSPBVNWJC-UHFFFAOYSA-N 456.380 5.127 5 20 JKBD Cc1ccc(C(=O)Nc2cccc(C(F)(F)F)c2)cc1NC(=O)c1ccc(Cl)cc1[N+](=O)[O-] 604451416 UUYLOJCUOPCZGG-UHFFFAOYSA-N 477.826 6.080 5 20 JKBD O=[N+]([O-])c1cccc(-c2ccc(CNCc3cn(-c4ccccc4)nc3-c3ccncc3)o2)c1 608836901 PTASVHJTPLEGRZ-UHFFFAOYSA-N 451.486 5.392 5 20 JKBD C[C@@H](Nc1ccc(C(=O)Nc2cc(Br)ccc2Cl)cc1[N+](=O)[O-])c1ccccn1 608946035 VPQHSBMOZYRDCM-GFCCVEGCSA-N 475.730 5.831 5 20 JKBD Cc1ccccc1[C@H](OC[C@H](O)Cn1cnc2cc3ccccc3cc2c1=O)c1ccccc1 636935166 SWZDBHTWZJKJEE-UFHPHHKVSA-N 450.538 5.025 5 20 JKBD Cc1cc[n+](/C(C(=S)N[C@@H](C)c2ccc(Cl)cc2Cl)=C(/O)c2cccc([N+](=O)[O-])c2)cc1 726571696 XCBSGQLMTVOWGO-HNNXBMFYSA-O 489.404 6.060 5 20 JKBD O=[N+]([O-])c1ccc(NC(=S)Nc2ccccc2OCc2ncc(-c3cccc(Cl)c3)o2)cc1 726751053 SSYSJFDSFVKPBE-UHFFFAOYSA-N 480.933 6.291 5 20 JKBD Cc1ccc(/C(O)=C(/C(=S)Nc2ccc(Cl)nc2)[n+]2ccc3c(c2)CCCC3)cc1[N+](=O)[O-] 727159512 HRPOBEYTVQSQFQ-UHFFFAOYSA-O 481.985 5.441 5 20 JKBD COC(=O)Nc1cc(N[C@@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2ccccc2)ccc1F 727465159 UUQIOKQDWMBPLX-HXUWFJFHSA-N 472.860 5.358 5 20 JKBD CC(C)c1c(C(=O)Nc2ccc([N+](=O)[O-])c(Cl)c2)cnn1-c1ccc(C(F)(F)F)cn1 727710514 WDUDCJNGDPULGC-UHFFFAOYSA-N 453.808 5.223 5 20 JKBD Cc1cccc(C(C)C)c1NC(=O)[C@@H](C)OC(=O)c1ccc(N2CCC[C@@H](C)C2)c([N+](=O)[O-])c1 783460929 KNFIOKSFENEFTJ-IEBWSBKVSA-N 467.566 5.447 5 20 JKBD O=C(CSc1nc2ccc([N+](=O)[O-])cc2s1)Nc1ccccc1C(=O)Nc1ccccc1 788007270 UTHHMHFBFSRMCD-UHFFFAOYSA-N 464.528 5.188 5 20 JKBD CN(C(=O)COC(=O)c1c2c(nc3ccccc13)/C(=C/c1ccco1)CC2)c1ccc([N+](=O)[O-])cc1 799715264 CHDZAJGZSJMQPR-BMRADRMJSA-N 483.480 5.043 5 20 JKBD C[C@H](Nc1ccc(-c2nc(-c3ccc(Oc4ccccc4)nc3)no2)cc1[N+](=O)[O-])c1ccccn1 904447903 MYUJGNRTBKCZBG-KRWDZBQOSA-N 480.484 6.067 5 20 JKBD O=[N+]([O-])c1ccc(-c2nc(-c3cccc(Cn4cnc5ccccc54)c3)no2)c(Br)c1 904492659 MWPFBQXJAASLEW-UHFFFAOYSA-N 476.290 5.472 5 20 JKBD COc1ccccc1[C@@H]1[C@H](C(=O)N(C)Cc2ccccc2[N+](=O)[O-])CCC(=O)N1c1ccc(C)cc1 914728686 GZKDIJNQHVIJHY-YIXXDRMTSA-N 487.556 5.055 5 20 JKBD O=C(Cn1c2ccccc2c(=O)c2ccccc21)OCC(=O)c1ccc(Oc2ccccc2)cc1 914900861 MSSFLWSBYIYZFY-UHFFFAOYSA-N 463.489 5.373 5 20 JKBD O=C(CCCc1nc(O)c2ccccc2n1)Nc1cc(Cl)c([N+](=O)[O-])cc1OCc1ccccc1 916827470 JZYHJCRRNRNUGL-UHFFFAOYSA-N 492.919 5.437 5 20 JKBD Cc1cc([N+](=O)[O-])c(S(=O)(=O)Oc2ccc3c(=O)c(-c4ccccc4)c(C)oc3c2)cc1C 918741778 BWXSMSXTXKCRSX-UHFFFAOYSA-N 465.483 5.061 5 20 JKBD C[C@H](Nc1ccc(C(=O)NCCc2ccc(N3CCCCC3)cc2)cc1[N+](=O)[O-])c1ccccn1 919748346 YBYXZUABKXAGJK-FQEVSTJZSA-N 473.577 5.126 5 20 JKBD C[C@H](OC(=O)c1ccc(N[C@@H](C)c2ccccn2)c([N+](=O)[O-])c1)C(=O)Nc1cc(Cl)ccc1F 920544002 BOVUBACSRJLWFA-KBPBESRZSA-N 486.887 5.139 5 20 JKBD C[C@H](Nc1ccc(C(=O)O[C@H](C)C(=O)Nc2ccc(F)cc2Cl)cc1[N+](=O)[O-])c1ccccn1 920544570 CVHQYVLLXYFGNK-UONOGXRCSA-N 486.887 5.139 5 20 JKBD COc1ccc2c(-c3ccccc3)c(C(=O)OCc3nnc(-c4ccc([N+](=O)[O-])cc4)o3)oc2c1 920643500 AZBZMSVCRBCSBF-UHFFFAOYSA-N 471.425 5.424 5 20 JKBD O=C(Cc1cc2ccccc2o1)O[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1 920657045 QKRMENGMBFFGJZ-QHCPKHFHSA-N 464.861 5.460 5 20 JKBD O=C(/C=C\c1ccc([N+](=O)[O-])cc1)Oc1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2Cl)cc1 923477576 RHQSLJYKROYMJM-BASWHVEKSA-N 467.821 5.028 5 20 JKBD C[C@H](C(=O)NC1(c2ccc(NC(=O)/C=C/c3ccc([N+](=O)[O-])o3)cc2)CCC1)c1cccs1 1786208080 JHTSPCWDVBXNLA-SOGBHIHOSA-N 465.531 5.200 5 20 JKBD O=C(NC1(c2ccc(NC(=O)C3CCC(F)(F)CC3)cc2)CCC1)c1cc(F)cc([N+](=O)[O-])c1 1786244928 WXNIPRKNCTVZQH-UHFFFAOYSA-N 475.467 5.307 5 20 JKBD CCOc1ccccc1C(=O)NC1(c2ccc(NC(=O)Cc3cc([N+](=O)[O-])ccc3F)cc2)CCC1 1786672682 KCEXWDLHHFSVIR-UHFFFAOYSA-N 491.519 5.123 5 20 JKBD O=C(/C=C/c1ccc([N+](=O)[O-])o1)NC1(c2ccc(NC(=O)CCc3cccs3)cc2)CCC1 1786948407 SLCFUPNCTFEAPL-DHZHZOJOSA-N 465.531 5.029 5 20 JKBD CCc1oncc1C(=O)Nc1ccc(C2(NC(=O)c3cc4cc([N+](=O)[O-])ccc4s3)CCC2)cc1 1787556646 AXTBQYVLSNVPAN-UHFFFAOYSA-N 490.541 5.421 5 20 JKBD O=C(Cc1cccc([N+](=O)[O-])c1)NC1(c2ccc(NC(=O)c3cc(-c4ccccc4)no3)cc2)CCC1 1789781211 ALGILHDNOOWBHH-UHFFFAOYSA-N 496.523 5.240 5 20 JKBD C[C@@H](C(=O)NC1(c2ccc(NC(=O)c3nc4cc([N+](=O)[O-])ccc4[nH]3)cc2)CCC1)c1cccs1 1790827222 AMAJGURKILLLSS-OAHLLOKOSA-N 489.557 5.084 5 20 JKBD O=C(c1ccc(-c2ccccc2)cc1)N1CCC2(CCCN(C(=O)c3ccc([N+](=O)[O-])o3)C2)CC1 1804650103 VJLHYKFTBTVMNO-UHFFFAOYSA-N 473.529 5.013 5 20 JKBD CC(C)=CCCC(=O)NC[C@H]1CCN(C(=O)c2cc(Cl)cc([N+](=O)[O-])c2C)[C@@H]1c1cccnc1 1807987125 FJRUMVVOONXTPV-NTKDMRAZSA-N 484.984 5.018 5 20 JKBD Cc1ccc(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3cc(F)cc([N+](=O)[O-])c3)CC2)cc1Cl 1823910252 KROYTEFVTFEHAQ-HSZRJFAPSA-N 487.959 5.243 5 20 JKBD CC[C@@H](C(=O)N1CCCC[C@@H]1C1CCN(C(=O)Cc2ccc([N+](=O)[O-])cc2F)CC1)c1ccccc1 1826317283 SFRVZBUYLPTYSN-AOYPEHQESA-N 495.595 5.090 5 20 JKBD CC1=CC[C@@H](C(=O)N2CCCC[C@H]2C2CCN(C(=O)Cc3ccc(Cl)cc3[N+](=O)[O-])CC2)CC1 1828343609 IPKDVCXPKHJDAV-OFNKIYASSA-N 488.028 5.157 5 20 JKBD CC(C)c1ccc(C(=O)N2CCCC[C@H]2C2CCN(C(=O)/C=C/c3ccc([N+](=O)[O-])o3)CC2)cc1 1830055104 NIBVNQUJKCRLOW-YKATVRGKSA-N 479.577 5.258 5 20 JKBD Cc1cc(O)c([N+](=O)[O-])cc1C(=O)N1CCCC[C@@H]1C1CCN(C(=O)C[C@@H](C)c2ccccc2)CC1 1830789355 GWYXQORIOSOCAY-NTKDMRAZSA-N 493.604 5.036 5 20 JKBD O=C(COC(=O)[C@@H](Sc1ccccc1)c1ccccc1)Nc1ccc([N+](=O)[O-])cc1Cl 10588813 JFBZDVGGSKYVEZ-NRFANRHFSA-N 456.907 5.264 5 20 JKBD CCC1=C(C)c2cc3[nH]c(cc4nc(cc5[nH]c(cc1n2)c(C)c5CC)C(CC)=C4C)c(C)c3CC 13470892 RKKIUOCKADNTCD-UHFFFAOYSA-N 478.684 8.738 5 20 JKBD O=C(NCCc1nccn1Cc1ccccc1)c1cc([N+](=O)[O-])ccc1Sc1ccc(Cl)cc1 26214668 CGAZXXHWJHDRKT-UHFFFAOYSA-N 492.988 5.617 5 20 JKBD Cc1ccc(NC(=O)[C@H](Sc2nnc(C3CC3)n2-c2ccccc2)c2ccccc2)c([N+](=O)[O-])c1 28797817 PELTWCAYSDNHCI-HSZRJFAPSA-N 485.569 5.833 5 20 JKBD O=C(Cc1ccccc1[N+](=O)[O-])Nc1ccc(NC(=O)c2ccccc2F)cc1C(F)(F)F 59253994 UTNUGUXFBLBULK-UHFFFAOYSA-N 461.371 5.186 5 20 JKBD O=C(CSc1nnc(-c2cccs2)n1Cc1ccccc1)Nc1ccc(Cl)c([N+](=O)[O-])c1 97601245 VZAQIIGLSKCRRR-UHFFFAOYSA-N 485.978 5.347 5 20 JKBD COc1ccc(C2(CNC(=O)c3ccc(Oc4ccc(Cl)cc4[N+](=O)[O-])cc3)CCOCC2)cc1 108899931 PUXQCRUYLPUKHQ-UHFFFAOYSA-N 496.947 5.527 5 20 JKBD CCOc1cc(NC(=O)c2c[nH]c3ccc([N+](=O)[O-])cc23)c(OCC)cc1NC(=O)c1ccccc1 109846986 XPZROFRRKGCRIK-UHFFFAOYSA-N 488.500 5.378 5 20 JKBD COc1ccccc1C[C@@H]1CCCN1C(=O)c1ccc(N[C@@H](C)c2ccccn2)c([N+](=O)[O-])c1 302981612 KMYIAKZNPVVQBU-RXVVDRJESA-N 460.534 5.019 5 20 JKBD Cc1ccccc1-c1nnc(SCc2nc(-c3ccc([N+](=O)[O-])cc3)no2)n1Cc1ccco1 302982039 VKZUGCVEULCFEL-UHFFFAOYSA-N 474.502 5.145 5 20 JKBD Cc1csc(Sc2ccc(C(=O)N3CCC(c4c[nH]c5ncccc45)CC3)cc2[N+](=O)[O-])n1 410055409 QWNJRSRVNYAXMO-UHFFFAOYSA-N 479.587 5.407 5 20 JKBD O=C(Cn1c2ccccc2c(=O)c2ccccc21)NC(c1ccc(F)cc1)c1ccc(F)cc1 508028822 UZTKTARBHOHPQG-UHFFFAOYSA-N 454.476 5.339 5 20 JKBD O=C(N[C@@H](c1ccc(Cl)cc1)c1ccsc1)c1ccc([N+](=O)[O-])cc1I 508590042 UERIMFLYUZJUBN-KRWDZBQOSA-N 498.729 5.434 5 20 JKBD COc1cc(CNCc2c(C)nn(-c3ccccc3)c2C)c([N+](=O)[O-])cc1OCc1ccccc1 509605434 YTSHMZFRDMKHCW-UHFFFAOYSA-N 472.545 5.275 5 20 JKBD Cc1nn(-c2ccc(F)cc2)c2sc(C(=O)Nc3cc([N+](=O)[O-])ccc3OC(F)F)cc12 515216294 LINWZRNLVYNURS-UHFFFAOYSA-N 462.409 5.296 5 20 JKBD Cc1cc(O[C@@H](C)c2ccccc2)ccc1NC(=O)CNC(=O)c1c(Cl)cccc1[N+](=O)[O-] 520822746 GGOREKBBVNQYCR-INIZCTEOSA-N 467.909 5.065 5 20 JKBD Cc1cc(C)n([C@H](C)C(=O)Nc2ccc(NC(=O)c3ccc(NC4CC4)c([N+](=O)[O-])c3)cc2Cl)n1 521537144 MXMZXRUDQQMFTM-OAHLLOKOSA-N 496.955 5.088 5 20 JKBD O=C(CSc1ccccc1C(=O)Nc1ccc([N+](=O)[O-])cc1F)NC12CC3CC(CC(C3)C1)C2 521736318 LBFTXMSXTJYLNH-UHFFFAOYSA-N 483.565 5.163 5 20 JKBD COc1cc(C(=O)N[C@@H](CC2CCCCC2)c2ccccc2)c([N+](=O)[O-])cc1OCc1cscn1 523567781 GHIHRKBYTBPCPA-QFIPXVFZSA-N 495.601 6.080 5 20 JKBD Cc1ccc(NC(=O)C2CC2)cc1NC(=O)c1cc([N+](=O)[O-])ccc1Sc1ccc(Cl)cc1 603757849 KYMIDKMKFJINKV-UHFFFAOYSA-N 481.961 6.309 5 20 JKBD O=C(C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1)N1CCCCC[C@H]1c1ccccc1 603969378 OENABVLLTKPPLY-NRFANRHFSA-N 475.511 5.974 5 20 JKBD Cc1nn(CCC(=O)N(c2ccc(C(C)C)cc2)c2nc3ccccc3s2)c(C)c1[N+](=O)[O-] 608802652 NHBGCZJMEAEIFP-UHFFFAOYSA-N 463.563 5.896 5 20 JKBD O=C(c1ccc(C(F)F)cc1)N1CCN(Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)CC1 608804516 MSSQHLOZIHRNRB-UHFFFAOYSA-N 457.502 5.219 5 20 JKBD COc1ccccc1[C@H](NC(=O)c1ccc(N[C@H](C)c2ccccn2)c([N+](=O)[O-])c1)c1ccccc1 609373912 AGZQFZTYFWXCDP-XHCCPWGMSA-N 482.540 5.691 5 20 JKBD C[C@H](OC(=O)c1csc(-c2cccc(C(F)(F)F)c2)n1)C(=O)Nc1ccc(F)c([N+](=O)[O-])c1 725994715 JOPRCVCMJXNEFE-JTQLQIEISA-N 483.399 5.060 5 20 JKBD O=C(OCC[C@H]1CCCCN1C(=O)c1csc(Cc2ccc(F)cc2)n1)c1cccc([N+](=O)[O-])c1 726936880 PXSVOELLRAQHKW-HXUWFJFHSA-N 497.548 5.023 5 20 JKBD Nc1cc(C(=O)OCc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)ccc1Oc1ccc(Cl)cc1 727528861 JEPORAPNWJJJDT-UHFFFAOYSA-N 466.837 5.030 5 20 JKBD COC1CCN(c2ccc(NC(=O)c3ccc(SC)c([N+](=O)[O-])c3)cc2C(F)(F)F)CC1 728011667 OGBGJKZQFCDWQB-UHFFFAOYSA-N 469.485 5.203 5 20 JKBD C[C@H](NC(=O)[C@@H](C)OC(=O)c1csc(-c2ccc([N+](=O)[O-])cc2)n1)c1ccc(Cl)cc1Cl 747955571 AUXRBLCQZVTFTH-NWDGAFQWSA-N 494.356 5.448 5 20 JKBD COc1cc(C(=O)NC2(c3ccc(NC(=O)c4cccc5cc(C)[nH]c45)cc3)CCC2)ccc1[N+](=O)[O-] 1789019260 KIIDXLBOLMQBOU-UHFFFAOYSA-N 498.539 5.455 5 20 JKBD O=C(CCC1CCC1)NC[C@H]1CCN(C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)[C@H]1c1cccnc1 1803377058 BAVKMMLZGYQOJR-CLOONOSVSA-N 492.601 5.104 5 20 JKBD Cc1c(C(=O)N2CC[C@H](CNC(=O)CCC3CCCC3)[C@H]2c2cccnc2)cc(Cl)cc1[N+](=O)[O-] 1806207061 OLZJWPOLUUBFTG-CJFMBICVSA-N 499.011 5.242 5 20 JKBD O=C(NC[C@H]1CCN(C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)[C@@H]1c1cccnc1)C1CCCCC1 1806231968 YOCGZCXPROBAQD-NTKDMRAZSA-N 492.601 5.104 5 20 JKBD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2ccc([N+](=O)[O-])[nH]2)[nH]n1)c1sc2ccccc2c1Cl 1818606723 BXPHTJGRNDEIPK-HNNXBMFYSA-N 498.952 5.134 5 20 JKBD Cc1cccc2[nH]c(C(=O)Nc3cc([C@@H]4CCCCN4C(=O)/C=C/c4ccccc4[N+](=O)[O-])[nH]n3)cc12 1819056398 JYPDBEXBYFRTOE-BYUVYSIJSA-N 498.543 5.127 5 20 JKBD Cc1cccc2[nH]c(C(=O)N3CCCC[C@@H]3C3CCN(C(=O)c4cc(F)cc([N+](=O)[O-])c4)CC3)cc12 1828578112 ZIGXFHWHGLVUPD-RUZDIDTESA-N 492.551 5.071 5 20 JKBD CC(C)(C)c1ccc(C(=O)N2CCC([C@@H]3CCCCN3C(=O)c3cc(O)cc([N+](=O)[O-])c3)CC2)s1 1830704431 LDZQAQCTMRRDHJ-NRFANRHFSA-N 499.633 5.207 5 20 JKBD O=C(c1cc(Cl)sc1Cl)N1CC2(CCCN2C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)C1 1845739318 ITVQVVFYQJVWAC-UHFFFAOYSA-N 496.397 5.309 5 20 JKBD COc1cc(CNC(=O)c2ccc(Sc3nc(C)cs3)c([N+](=O)[O-])c2)ccc1OC(F)F 10440759 ZKKGEWXOXDJHJC-UHFFFAOYSA-N 481.502 5.051 5 20 JKBD CC(=O)c1sc(NC(=O)c2ccc(Cn3nc(C)c([N+](=O)[O-])c3C)cc2)nc1-c1ccccc1 20004883 LXUMVOWCVSYLPZ-UHFFFAOYSA-N 475.530 5.035 5 20 JKBD Cc1sc2nc(S[C@H](C)C(=O)Nc3cc([N+](=O)[O-])ccc3Cl)n(C(C)C)c(=O)c2c1C 36818471 FIIOESIDLKGQDA-GFCCVEGCSA-N 480.999 5.337 5 20 JKBD Cc1ccc(-c2n[nH]c(S[C@@H](C(=O)Nc3ccc(C)cc3[N+](=O)[O-])c3ccccc3)n2)cc1 45252163 DQLLNRBPCNGVDT-OAQYLSRUSA-N 459.531 5.469 5 20 JKBD Cc1ccc(N2C(=O)/C(=C/c3ccc4c(c3)OCO4)N=C2S/C=C\c2ccc([N+](=O)[O-])o2)cc1 96936375 CASIEQPJIOCHID-FAYSWJFSSA-N 475.482 5.373 5 20 JKBD COc1ccc(OC)c([C@H](C)NC(=O)c2ccccc2NC(=O)c2ccc([N+](=O)[O-])cc2Cl)c1 104916868 UBPZWVYTTYRXMA-AWEZNQCLSA-N 483.908 5.009 5 20 JKBD O=C(Nc1ccc(F)c(NC(=O)C2CCCCC2)c1)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-] 107865863 IFGVGGKSIMMLAQ-UHFFFAOYSA-N 483.418 5.446 5 20 JKBD COc1ccc(Oc2ccc([N+](=O)[O-])cc2C(=O)N2CCC(C(=O)c3ccc(C)cc3)CC2)cc1 108578956 VNBHSWQTKAKGQB-UHFFFAOYSA-N 474.513 5.439 5 20 JKBD COc1ccc(NC(C)=O)c(NC(=O)c2ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])c(OC)c2)c1 108875264 HVDUXQXOOSOICS-UHFFFAOYSA-N 485.880 5.268 5 20 JKBD Cc1cc(Oc2ncccn2)ccc1NC(=O)c1ccc(N[C@H](C)c2ccccn2)c([N+](=O)[O-])c1 109182602 XBYSZZNKCAMCRP-QGZVFWFLSA-N 470.489 5.306 5 20 JKBD Cc1sc(NC(=O)Cc2csc(-n3c(C)ccc3C)n2)nc1-c1cccc([N+](=O)[O-])c1 195704355 WQOKAZCDKAOOCK-UHFFFAOYSA-N 453.549 5.072 5 20 JKBD Cc1ccccc1-c1nnc(SCc2nc(-c3cccc([N+](=O)[O-])c3)no2)n1Cc1ccco1 302978084 SNVQYSPQPNZUFW-UHFFFAOYSA-N 474.502 5.145 5 20 JKBD COCCOc1ccc(NC(=O)c2ccc(N[C@@H](C)c3ccccn3)c([N+](=O)[O-])c2)cc1Cl 410088009 JJWDTVXQSXVIQG-HNNXBMFYSA-N 470.913 5.094 5 20 JKBD O=C(Nc1cccc(-c2cccs2)c1)c1ccc([N+](=O)[O-])cc1I 505854791 KOLFEQDFROLSKI-UHFFFAOYSA-N 450.257 5.180 5 20 JKBD C[C@H](Nc1ccc(C(=O)N[C@H](C)COc2ccccc2C(F)(F)F)cc1[N+](=O)[O-])c1ccccn1 507980563 SKJOOEQDMLPVMR-CVEARBPZSA-N 488.466 5.379 5 20 JKBD CC[C@@H](C)NC(=O)c1cccc(CNCc2ccc(Oc3ccc(F)cc3)c([N+](=O)[O-])c2)c1 518764218 BXRITZVJECCJTK-QGZVFWFLSA-N 451.498 5.344 5 20 JKBD CCOCc1cccc(NC(=O)C/C(=C\c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)c1 522566109 AOMNNHMHOQWGKX-XSFVSMFZSA-N 473.554 6.310 5 20 JKBD CN(Cc1ccccc1[N+](=O)[O-])C(=O)N[C@H](c1ccccc1)c1ccc(Br)cc1F 604127709 HDDPXCZQVVQALT-OAQYLSRUSA-N 472.314 5.427 5 20 JKBD COc1ccccc1-c1nc(C(=O)Nc2nc(-c3cccc([N+](=O)[O-])c3)c(C)s2)cs1 604504236 BNQOAUYLDICAAK-UHFFFAOYSA-N 452.517 5.411 5 20 JKBD COCCn1ncc2ccc(NC(=O)c3ccc(NCc4ccccc4Cl)c([N+](=O)[O-])c3)cc21 604509220 RHCFJWPIPTWRAN-UHFFFAOYSA-N 479.924 5.109 5 20 JKBD O=C(C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)N1CCC(n2ccnc2)CC1 608787602 ZBSNOXVGHZPKIK-XDJHFCHBSA-N 473.558 5.195 5 20 JKBD O=C(CSc1ccc([N+](=O)[O-])cc1)Nc1ccccc1OCc1ncc(-c2cccc(Cl)c2)o1 608850654 KAYBGYYPHHHAAQ-UHFFFAOYSA-N 495.944 6.213 5 20 JKBD O=C(c1ccc(NCc2ccccc2Cl)c([N+](=O)[O-])c1)N1CCO[C@H](c2ccc(F)c(F)c2)C1 608964962 PGXJGFQZJPGRMO-QHCPKHFHSA-N 487.890 5.352 5 20 JKBD O=C1Nc2cc(Cl)ccc2[C@H]1C1CCN(C(=O)c2ccc(Nc3ccccc3)c([N+](=O)[O-])c2)CC1 608971032 GZWUMKRKNWMFHN-XMMPIXPASA-N 490.947 5.580 5 20 JKBD C[C@H]1CSc2ccc(Br)cc2[C@H]1NC(=O)C1CCN(c2ccccc2[N+](=O)[O-])CC1 609192179 AVWKHUQSLABMFN-QKKBWIMNSA-N 490.423 5.173 5 20 JKBD O=[N+]([O-])c1ccc(Sc2nnc(-c3c[nH]c4ccccc34)n2C[C@H]2CCCO2)c(Cl)c1 619671162 IBNGFKKISRBTJU-CQSZACIVSA-N 455.927 5.318 5 20 JKBD O=C(Cc1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1)Nc1cccc(C(F)(F)F)n1 726147943 HKAQHDSSMCWUFL-UHFFFAOYSA-N 467.407 5.043 5 20 JKBD Cc1sc(NC(=O)c2ccc(F)c(NC(=O)OC(C)(C)C)c2)nc1-c1cccc([N+](=O)[O-])c1 730481641 KHGNISLBCCONDC-UHFFFAOYSA-N 472.498 5.765 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Cl)[C@H](c1ccccc1)N1CCC([C@@H](O)c2ccc(F)cc2)CC1 731037818 LKNMBTLHOLICOO-DQEYMECFSA-N 497.954 5.513 5 20 JKBD Cc1cc(C(=O)[C@@H](C)OC(=O)c2csc(-c3cccc([N+](=O)[O-])c3)n2)c(C)n1Cc1ccco1 747964456 ZFOPTRIPWVMGKA-MRXNPFEDSA-N 479.514 5.206 5 20 JKBD CC(C)(C)c1ccc(C(=O)OCC(=O)Nc2ccc(NC(=O)c3cccs3)cc2)cc1[N+](=O)[O-] 750114643 DRHITVMFVLSVPD-UHFFFAOYSA-N 481.530 5.002 5 20 JKBD COC(=O)c1ccc2c(=O)nc(/C(Cl)=C\c3ccc(-c4ccc([N+](=O)[O-])cc4)s3)[nH]c2c1 818215694 GDXSYRGMLMJVPX-GZTJUZNOSA-N 467.890 5.083 5 20 JKBD CC1=C(C(=O)Nc2cccc([N+](=O)[O-])c2)[C@H](c2ccc3ncccc3c2)NC(=O)N1Cc1cccs1 840195888 FOJSFKYYBWTDII-DEOSSOPVSA-N 499.552 5.384 5 20 JKBD CC1=C(C(=O)Nc2ccccc2)[C@@H](c2cc([N+](=O)[O-])c(F)cc2F)NC(=O)N1CCc1cccs1 916726000 NTENOTRUTPDIIC-JOCHJYFZSA-N 498.511 5.156 5 20 JKBD COc1c([N+](=O)[O-])cc(N[C@H](C)c2cccc(OC(C)C)c2)c([N+](=O)[O-])c1Br 917073842 DALXTLMJWOCQOH-LLVKDONJSA-N 454.277 5.234 5 20 JKBD COc1cc(NC(=O)c2cc([N+](=O)[O-])ccc2N2CCCCC2)ccc1NC(=O)OC(C)(C)C 917336061 SDCBUECPKBKFIX-UHFFFAOYSA-N 470.526 5.193 5 20 JKBD CC1CCN(c2ccc([N+](=O)[O-])cc2C(=O)Nc2ccc(NC(=O)c3ccco3)c(Cl)c2)CC1 918174653 VCYQQFKHQUZILO-UHFFFAOYSA-N 482.924 5.582 5 20 JKBD O=C(Nc1ccccc1C(=O)Nc1ccc2ncsc2c1)c1ccc([N+](=O)[O-])cc1Cl 918576030 IGAQVMYCVDANLQ-UHFFFAOYSA-N 452.879 5.363 5 20 JKBD CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)CSc1ccc(C(F)(F)F)cc1[N+](=O)[O-] 919867725 NLOWSKLSBJGIHM-UHFFFAOYSA-N 457.430 5.051 5 20 JKBD COC(=O)N(C)c1ccc(NC(=O)c2ccc(NCc3ccccc3Cl)c([N+](=O)[O-])c2)cc1 919891986 BOQKTRHGGDLTBU-UHFFFAOYSA-N 468.897 5.315 5 20 JKBD O=C(/C=C/c1ccc([N+](=O)[O-])o1)NC1(c2ccc(NC(=O)[C@@H]3C[C@@H]3c3ccc(F)cc3)cc2)CCC1 1786028295 DTHROLALASKNPC-GVMLUBPESA-N 489.503 5.278 5 20 JKBD O=C(/C=C/c1ccc([N+](=O)[O-])o1)NC1(c2ccc(NC(=O)[C@@H]3CCCCC3(F)F)cc2)CCC1 1786461337 FABNQKGUURFEPH-JARZOMNASA-N 473.476 5.161 5 20 JKBD O=C(NC1(c2ccc(NC(=O)c3ccc([N+](=O)[O-])[nH]3)cc2)CCC1)c1c[nH]c(-c2ccc(F)cc2)c1 1790184320 FFRDDUFJOYBVKW-UHFFFAOYSA-N 487.491 5.119 5 20 JKBD COc1ccc(CC(=O)Nc2ccc(C3(NC(=O)/C=C/C4CCCC4)CCC3)cc2)c([N+](=O)[O-])c1 1790572390 YEKBELBVWJSORF-VGOFMYFVSA-N 477.561 5.026 5 20 JKBD O=C(NC1(c2ccc(NC(=O)c3ccc([N+](=O)[O-])cc3F)cc2)CCC1)c1ccc2ncccc2c1 1790622312 UINCOLTVXAPGAK-UHFFFAOYSA-N 484.487 5.344 5 20 JKBD CCCc1onc(C)c1C(=O)NC1(c2ccc(NC(=O)c3cc(F)cc([N+](=O)[O-])c3)cc2)CCC1 1790696389 ATTACHGFCMNJEY-UHFFFAOYSA-N 480.496 5.044 5 20 JKBD Cc1ccc(CC(=O)NC2(c3ccc(NC(=O)c4ccc5occc5c4O)cc3)CCC2)cc1[N+](=O)[O-] 1790931134 NVTXADRPAQZZFK-UHFFFAOYSA-N 499.523 5.345 5 20 JKBD COc1ccsc1C(=O)NC1(c2ccc(NC(=O)CSc3ccccc3[N+](=O)[O-])cc2)CCC1 1791522057 AAPLXGCFXIUXPE-UHFFFAOYSA-N 497.598 5.205 5 20 JKBD Cc1c(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)[C@@H](C)c2ccc(Cl)cc2)cc(Cl)cc1[N+](=O)[O-] 1792821124 LVZQFQGOXAASJB-JZOCTASASA-N 490.387 5.266 5 20 JKBD O=C(/C=C/c1ccc([N+](=O)[O-])o1)N1CCCC2(CCN(C(=O)[C@@H]3CCC[C@@H]4CCCC[C@H]43)CC2)C1 1805684166 FQGOVSGHTAFORD-PJJXJKPBSA-N 483.609 5.039 5 20 JKBD Cc1cc(Cl)ccc1C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cc(F)cc([N+](=O)[O-])c2)n[nH]1 1821163575 SSEHUSUMHUQCTQ-FQEVSTJZSA-N 485.903 5.039 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cccc3ccoc23)[nH]n1 1821286239 RHFFGUWMJBOFLT-HXUWFJFHSA-N 491.479 5.131 5 20 JKBD CC[C@H]1CC[C@H](C(=O)N2CCCC[C@@H]2c2cc(NC(=O)CSc3ccccc3[N+](=O)[O-])n[nH]2)CC1 1822312941 HJWGSFUVZIYNQS-QWFCFKBJSA-N 499.637 5.319 5 20 JKBD Cc1ccc(C(=O)Nc2cc([C@H]3CCCCN3C(=O)c3ccc([N+](=O)[O-])cc3F)[nH]n2)c(Cl)c1 1823186346 JUKFWNUUMHQTTG-HXUWFJFHSA-N 485.903 5.039 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)N1CCC([C@@H]2CCCCN2C(=O)[C@H]2CC[C@H](C)CC2)CC1 1832372636 CPVSUHLKRQMMJL-NYDSKATKSA-N 473.589 5.102 5 20 JKBD Cc1c(C(=O)N2CCC([C@H]3CCCCN3C(=O)/C=C/c3ccccc3[N+](=O)[O-])CC2)ccc(F)c1F 1832904770 WNNYOVZISBRWLQ-JYLQPTBZSA-N 497.542 5.128 5 20 JKBD CN(Cc1nc2ccccc2s1)C(=O)Cc1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1 10287945 AUMFHLPTRKYXHF-UHFFFAOYSA-N 483.553 5.258 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Cl)[C@H](NCc1ccccc1CN1CCCCC1)c1ccccc1 15507403 RTLJURNXHOQEOO-AREMUKBSSA-N 493.007 5.704 5 20 JKBD C[C@@H](OC(=O)c1ccccc1C(=O)c1ccc(Cl)c([N+](=O)[O-])c1)C(=O)Nc1ccccc1Cl 15710195 OMDUERREXBRYPA-CYBMUJFWSA-N 487.295 5.317 5 20 JKBD Cc1ccc(C)c(NC(=O)[C@@H](C)OC(=O)c2ccc(Sc3nc(C)cs3)c([N+](=O)[O-])c2)c1 16903558 SZPKEEVDUBRPCL-OAHLLOKOSA-N 471.560 5.312 5 20 JKBD O=C(Nc1cccc(-c2nnco2)c1)c1cc([N+](=O)[O-])ccc1Sc1ccc(Cl)cc1 24696656 KXBBSUZPXZLGBF-UHFFFAOYSA-N 452.879 5.702 5 20 JKBD C[C@@H](OC(=O)C1CCN(c2ccccc2[N+](=O)[O-])CC1)C(=O)Nc1ccccc1-c1ccccc1 24761866 QLMBLFOGAUKFAV-LJQANCHMSA-N 473.529 5.049 5 20 JKBD O=C(CCSc1nnc(COc2ccccc2F)n1-c1ccccc1)Nc1ccccc1[N+](=O)[O-] 26368973 ACJIGRPDPDXVME-UHFFFAOYSA-N 493.520 5.015 5 20 JKBD CC(C)NC(=O)Cc1ccc(N[C@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2ccccc2)cc1 27007238 HTZHFFFHQZTCQE-DEOSSOPVSA-N 480.952 5.107 5 20 JKBD COc1cc([C@@H](C)NC(=O)Cn2c3ccccc3c(=O)c3ccccc32)ccc1OCC(C)C 106085458 RIFOXNGMIDSQRT-LJQANCHMSA-N 458.558 5.076 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)N(Cc2cc(Br)ccc2F)C(C)C)cc1SC 482491888 GZOIJBRWXKOKGV-UHFFFAOYSA-N 471.348 5.278 5 20 JKBD C[C@@H](N[C@@H](Cc1cccc(F)c1)c1cccc(F)c1)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 488009030 SVGOUNLBAKYAQU-QRQCRPRQSA-N 450.445 5.558 5 20 JKBD COc1cc(CN[C@@H](c2ccccc2)c2ccncc2)ccc1OCc1ccc([N+](=O)[O-])cc1 488532989 XVDXDKHJUWXVFR-MHZLTWQESA-N 455.514 5.457 5 20 JKBD Cc1c(NC(=O)c2ccc(NCc3ccccc3)c([N+](=O)[O-])c2)cccc1C(=O)N1CCCC1 499898665 XYYMTROAHQFKTM-UHFFFAOYSA-N 458.518 5.004 5 20 JKBD COc1cc(C)ccc1Oc1ccc(NC(=O)c2cc(OC)c(OC(F)F)cc2[N+](=O)[O-])cc1F 510257097 WDVFRUSTGQBRQD-UHFFFAOYSA-N 492.406 5.706 5 20 JKBD COc1cc(C(=O)N2CCCCC[C@H]2c2ccccc2)c([N+](=O)[O-])cc1OCc1cscn1 512318964 FABOQIJJPQQSHV-FQEVSTJZSA-N 467.547 5.396 5 20 JKBD O=C(c1cnn(-c2ccc([N+](=O)[O-])cc2)c1)C(c1nc2ccccc2s1)c1nc2ccccc2s1 513686852 HDWLRVNTSFZMEG-UHFFFAOYSA-N 497.561 6.015 5 20 JKBD CSc1ccc(C(=O)c2ccccc2C(=O)N2C[C@H](c3ccccc3)O[C@H](C)C2)cc1[N+](=O)[O-] 516322348 JDHWXNLPXWLFEW-UZUQRXQVSA-N 476.554 5.150 5 20 JKBD C[C@@H](Nc1ccc(C(=O)Nc2ccc(NC(=O)Nc3ccccc3)cc2)cc1[N+](=O)[O-])c1ccccn1 516573597 XYJRUUDPCGUAKF-GOSISDBHSA-N 496.527 6.059 5 20 JKBD CCOc1cc(C(=O)N[C@H](c2ccccc2)c2ccc(Br)cc2)c([N+](=O)[O-])cc1OC 519954588 DVYMUYDDMIEBNG-JOCHJYFZSA-N 485.334 5.284 5 20 JKBD O=C(Cn1c2ccccc2c(=O)c2ccccc21)Nc1ccccc1NC(=O)c1cccs1 523271789 NIIDGBWSYANFAI-UHFFFAOYSA-N 453.523 5.107 5 20 JKBD O=C(Nc1cc([N+](=O)[O-])ccc1OC(F)F)c1cn(Cc2ccccc2)nc1-c1cccs1 603638869 IUTXYXZRQLGBAF-UHFFFAOYSA-N 470.457 5.422 5 20 JKBD COc1ccccc1NC(=O)c1cc2ccccc2cc1OCc1ccc(OC)c([N+](=O)[O-])c1 603934231 WYQJIQLJBBEIJY-UHFFFAOYSA-N 458.470 5.597 5 20 JKBD Cc1sc(NC(=O)c2cc(Cl)ccc2Br)nc1-c1cccc([N+](=O)[O-])c1 603996745 AYTQREPDYUUPBU-UHFFFAOYSA-N 452.717 5.695 5 20 JKBD Cc1ccc(CN[C@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Br)c2ccccc2)c(C)c1 604045915 KBLGCDAEAUKQMY-QFIPXVFZSA-N 468.351 5.444 5 20 JKBD O=C(Nc1ccc(C(=O)Nc2cccnc2)c(Cl)c1)c1csc(-c2ccc([N+](=O)[O-])cc2)n1 608874467 HLSLRZNFDSWUFN-UHFFFAOYSA-N 479.905 5.271 5 20 JKBD O=C(c1ccc(Sc2nc3ccccc3s2)c([N+](=O)[O-])c1)N1CCC[C@H](n2ccnc2)C1 609130988 FHGBAMISNDIUKO-INIZCTEOSA-N 465.560 5.030 5 20 JKBD Cc1ccc(C(C)C)c(Oc2ccc(CNCc3ccnc(-n4ccnc4)c3)cc2[N+](=O)[O-])c1 725849144 TVQUWCLLHOSTKQ-UHFFFAOYSA-N 457.534 5.689 5 20 JKBD CC(=O)N1CCC(COC(=O)c2c3c(nc4ccccc24)/C(=C\c2ccc([N+](=O)[O-])cc2)CCC3)CC1 727768624 IMMVITMSRVQORA-XLNRJJMWSA-N 499.567 5.435 5 20 JKBD Cc1ccc(C(C)C)c(Oc2ccc(CN[C@@H](C)c3ccc4c(c3)CC(=O)N4C)cc2[N+](=O)[O-])c1 728302541 UDSPPIGUYRRQBB-IBGZPJMESA-N 473.573 6.189 5 20 JKBD O=C(Nc1cc(Cl)c([N+](=O)[O-])cc1OCc1ccccc1)c1cc(F)c(Cl)nc1Cl 728805104 GNKNNNUCYPDLBX-UHFFFAOYSA-N 470.671 5.920 5 20 JKBD C[C@@H]1Cc2cc([N+](=O)[O-])ccc2N1C(=O)c1cc(-c2ccncc2)nc2ccc(Br)cc12 728809730 LJNHYBJLARAQEK-CQSZACIVSA-N 489.329 5.559 5 20 JKBD O=C(NO[C@@H]1CCCCO1)c1c2c(nc3ccccc13)/C(=C/c1cccc([N+](=O)[O-])c1)CCC2 749620359 RFDSUFBWZAHRCX-KEWFZMHCSA-N 459.502 5.208 5 20 JKBD O=C(Nc1ccc(S(=O)(=O)C(F)F)cc1)c1cc([N+](=O)[O-])ccc1Sc1ccc(Cl)cc1 863498162 KJVYCYDGEQOSBR-UHFFFAOYSA-N 498.916 5.648 5 20 JKBD O=C(O[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1)c1sccc1Br 917272927 DCERTJHDDAVMGK-INIZCTEOSA-N 495.738 5.609 5 20 JKBD CC1CCN(c2ccc([N+](=O)[O-])cc2C(=O)Nc2nc(-c3ccc4c(c3)CCC(=O)N4)cs2)CC1 917369024 SHQLOTPXSUYJNP-UHFFFAOYSA-N 491.573 5.092 5 20 JKBD Cc1c([N+](=O)[O-])cc(C(=O)Nc2ccccc2SC[C@H]2CC2(Cl)Cl)cc1[N+](=O)[O-] 917750708 IHVQMNKWXFPQRC-GFCCVEGCSA-N 456.307 5.350 5 20 JKBD O=C(Cc1csc(-c2ccc(C(F)(F)F)cc2)n1)OCc1nc(-c2ccc([N+](=O)[O-])cc2)no1 919050035 BPKWABJAEBEIQI-UHFFFAOYSA-N 490.419 5.073 5 20 JKBD C[C@H](OC(=O)c1ccc(O[C@H](C)c2ccccc2)nc1)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 919214990 OLDLSYFZCDZTNK-CVEARBPZSA-N 460.446 5.098 5 20 JKBD C[C@@H](OC(=O)CCOc1cccc(Cl)c1Cl)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 919412621 CXOXBYVUDJZXSQ-LLVKDONJSA-N 452.250 5.025 5 20 JKBD COc1cc(C(=O)Nc2cccc(C3SCCS3)c2)c([N+](=O)[O-])cc1OCc1cscn1 919882933 HQKCTNRBYNJBFS-UHFFFAOYSA-N 489.600 5.370 5 20 JKBD COc1cscc1C(=O)Nc1ccc(C2(NC(=O)/C=C/c3ccccc3[N+](=O)[O-])CCC2)cc1 1788829103 RGSLMHANCNORFL-KPKJPENVSA-N 477.542 5.126 5 20 JKBD CN(C)c1ccc([N+](=O)[O-])c(C(=O)Nc2ccc(C3(NC(=O)c4ccc5cc[nH]c5c4)CCC3)cc2)c1 1790055765 OPPYJOYPBWOJSK-UHFFFAOYSA-N 497.555 5.204 5 20 JKBD Cc1ccoc1C(=O)NC1(c2ccc(NC(=O)CSc3ccccc3[N+](=O)[O-])cc2)CCC1 1791522495 YOTPDWOERWWIED-UHFFFAOYSA-N 465.531 5.036 5 20 JKBD O=C(NC1(c2ccc(NC(=O)[C@]3(F)CCCC=C3F)cc2)CCC1)c1cccc(F)c1[N+](=O)[O-] 1792378926 FRCXZBYJAWSXQR-DEOSSOPVSA-N 473.451 5.227 5 20 JKBD CCCCC[C@H](C)C(=O)NC[C@H]1CCN(C(=O)CSc2ccccc2[N+](=O)[O-])[C@H]1c1cccnc1 1812699621 BDOOEWRZVCNIMC-HWHXTQLESA-N 498.649 5.004 5 20 JKBD Cc1cscc1C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)[nH]n1 1818242196 JOQMVQXAVHTNBY-SFHVURJKSA-N 495.586 5.522 5 20 JKBD Cc1cc(Cl)ccc1C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2ccc([N+](=O)[O-])cc2F)CC1 1823911572 CUWNOGMIBALVTQ-QHCPKHFHSA-N 487.959 5.243 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)N1CCC([C@H]2CCCCN2C(=O)[C@@]2(F)CCCC=C2F)CC1 1832983369 GZLVKJDAOSHPHI-CJFMBICVSA-N 493.526 5.021 5 20 JKBD O=C([C@@H]1C[C@@H]1c1ccc(Cl)cc1)N1CC2(CCCN2C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)C1 1845739217 YADWYXBREMAXFU-WOJBJXKFSA-N 495.988 5.084 5 20 JKBD C[C@@H](Sc1nnc(-c2c[nH]c3ccccc23)o1)C(=O)Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1 11346961 ONOPZEURBXGVNZ-GFCCVEGCSA-N 492.542 5.369 5 20 JKBD Cc1ccc(-c2nc(C)sc2CC(=O)N[C@H](CC(=O)OC(C)C)c2ccccc2[N+](=O)[O-])cc1 14377445 MBKXZALTUILSPH-HXUWFJFHSA-N 481.574 5.077 5 20 JKBD C[C@@H](OC(=O)c1ccc(NCc2ccccc2)c([N+](=O)[O-])c1)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 17656704 QMGFCWPMPFPKFV-OAHLLOKOSA-N 489.444 5.083 5 20 JKBD C[C@@H](Sc1nnc(Cc2cccs2)n1-c1ccccc1)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 17758960 WFILUXKVYQKVPS-OAHLLOKOSA-N 490.570 5.731 5 20 JKBD C[C@@H](OC(=O)CCCOc1ccc(Cl)cc1Cl)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 17838587 ODJJINZKEUUCAB-GFCCVEGCSA-N 466.277 5.415 5 20 JKBD Cc1nc(-c2cccc(Cl)c2)sc1C(=O)O[C@@H](C)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 17956184 MDHGZTGBZODPJT-LBPRGKRZSA-N 470.894 5.648 5 20 JKBD C[C@@H](Sc1nn(-c2ccccc2)c(=S)s1)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 21365990 QYQCSZGLGFZOPL-SNVBAGLBSA-N 486.522 5.710 5 20 JKBD CC1CCN([C@@H](CNC(=O)c2ccc(N[C@H](C)c3ccccn3)c([N+](=O)[O-])c2)c2cccs2)CC1 108751800 YWQJZKCEUVSKAU-DVECYGJZSA-N 493.633 5.427 5 20 JKBD COc1ccc([N+](=O)[O-])cc1CSC1=N/C(=C/c2ccccc2)C(=O)N1c1ccc(F)cc1 207432162 SUPXUMLBGIVPBQ-FYJGNVAPSA-N 463.490 5.420 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)Nc2sc3c(c2C(=O)c2cccs2)CCCC3)cc1SC 482043809 YGGJKFYETLUSNB-UHFFFAOYSA-N 488.612 5.810 5 20 JKBD Cc1csc(N(C)C(=O)c2ccccc2Sc2ccc(C(F)(F)F)cc2[N+](=O)[O-])n1 488514745 NZCMDYNKHKYOOQ-UHFFFAOYSA-N 453.467 5.806 5 20 JKBD Cc1csc(Sc2ccc(C(=O)Nc3ccc(OC[C@@H]4CCCO4)cc3)cc2[N+](=O)[O-])n1 502030938 WKVYLTISLRKSOU-SFHVURJKSA-N 471.560 5.321 5 20 JKBD COc1ccccc1-c1nnc(SCc2c(F)cccc2[N+](=O)[O-])n1CCc1ccccc1 504536411 NBTPFGBSAMPOQZ-UHFFFAOYSA-N 464.522 5.536 5 20 JKBD Cc1nnc(Sc2ccc(NC(=O)c3cc(OCC(F)(F)F)ccc3[N+](=O)[O-])c(C)c2)s1 509282821 DKDPLVGHSFJUTN-UHFFFAOYSA-N 484.481 5.408 5 20 JKBD O=C(Cn1c2ccccc2c(=O)c2ccccc21)NCc1ccccc1Oc1cccc(F)c1 517440632 WVLVOFIOAZASCP-UHFFFAOYSA-N 452.485 5.403 5 20 JKBD COc1ccc(CC[C@@H]2CCCCN2C(=O)c2csc(-c3ccc([N+](=O)[O-])cc3)n2)cc1OC 523559622 DVQFAGYTXXJQGK-IBGZPJMESA-N 481.574 5.363 5 20 JKBD O=C(C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)NCc1cn2ccccc2n1 582679897 XTCAFLVZZDTXDL-QGOAFFKASA-N 469.526 5.099 5 20 JKBD COC1CCN(C(=O)c2c3c(nc4ccccc24)/C(=C\c2ccc([N+](=O)[O-])cc2)CCC3)CC1 590946097 FJESERMQHQAFPW-ZPHPHTNESA-N 457.530 5.271 5 20 JKBD COc1cc(C(=O)Nc2ccc(F)c(NC(C)=O)c2)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 602030714 NTNDFSYRUWBOJO-UHFFFAOYSA-N 473.844 5.399 5 20 JKBD COc1cccc([C@@H](C)NC(=O)C/C(=C\c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)c1 603518386 NYRNNQVIADAGCO-HDAKKWKLSA-N 473.554 6.021 5 20 JKBD CC(C)c1ccc(-c2noc(CCC(=O)N(Cc3ccccc3[N+](=O)[O-])CC(F)(F)F)n2)cc1 603742231 QWEQOZNPHOAZKA-UHFFFAOYSA-N 476.455 5.292 5 20 JKBD COc1cccc(OC)c1Oc1ccc(CNc2ccc(C(=O)c3ccccc3)cc2[N+](=O)[O-])cn1 603869535 QVOIRZDCFXMVSA-UHFFFAOYSA-N 485.496 5.642 5 20 JKBD C[C@H](Nc1ccccc1COCc1ccccc1)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 603954648 ASPGNFZATGHKRF-INIZCTEOSA-N 473.451 5.770 5 20 JKBD CCOc1cc([N+](=O)[O-])c(C(=O)N(c2cccc(C(F)(F)F)c2)[C@H](C)C2CC2)cc1OC 603964309 CAWNEIOTSSWDNO-CYBMUJFWSA-N 452.429 5.466 5 20 JKBD O=[N+]([O-])c1ccc(S(=O)(=O)N2CCC(c3nc4cc(Cl)ccc4s3)CC2)c(Cl)c1 604023124 NNSJYEFUMLASJY-UHFFFAOYSA-N 472.375 5.080 5 20 JKBD Cc1ccc(C(=O)N2CCSCC2)cc1NC(=O)c1cc([N+](=O)[O-])ccc1Sc1ccccc1 608945937 JGJHFKDUBLBLFN-UHFFFAOYSA-N 493.610 5.496 5 20 JKBD C[C@@H]1CO[C@H](c2ccccc2)CN1C(=O)C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1 608966520 PCMJOFQBGSFRJL-XNZRPZTCSA-N 499.592 6.124 5 20 JKBD CN(Cc1cccc(Cl)c1)C(=O)c1ccc(C(=O)N(C)Cc2cccc(Cl)c2)c([N+](=O)[O-])c1 609043144 AWQVIYWRMUYVLE-UHFFFAOYSA-N 486.355 5.446 5 20 JKBD Cn1ccc2c(NC(=O)c3ccc(C(=O)Nc4cccc5c4ccn5C)c([N+](=O)[O-])c3)cccc21 609044988 IPTRMQOAMWEQFL-UHFFFAOYSA-N 467.485 5.083 5 20 JKBD C[C@@H](Nc1ccc(C(=O)N(Cc2ccc3c(c2)CCO3)C2CCCC2)cc1[N+](=O)[O-])c1ccccn1 609064523 BWGVXQXDNFIDFL-LJQANCHMSA-N 486.572 5.683 5 20 JKBD CCOCCOc1ccc(Cl)cc1NC(=O)c1ccc(N2CCC[C@@H](C)C2)c([N+](=O)[O-])c1 609103690 SHPVRDJIBIPCDB-MRXNPFEDSA-N 461.946 5.152 5 20 JKBD O=C(c1ccc(Sc2nc3ccccc3s2)c([N+](=O)[O-])c1)N1CCCO[C@H](c2ccccc2)C1 609230941 STZLOSGOLURBCV-NRFANRHFSA-N 491.594 5.960 5 20 JKBD CCCC(=O)Nc1nc2ccc(NC(=O)Cn3c4ccccc4c(=O)c4ccccc43)cc2s1 615948499 FRSOBNQKDRMZDT-UHFFFAOYSA-N 470.554 5.142 5 20 JKBD O=C(CSc1ccc(Cl)c(C(F)(F)F)c1)Nc1cc2c(cc1[N+](=O)[O-])OCCCO2 619675185 KNDBZDZZGKWBMS-UHFFFAOYSA-N 462.833 5.159 5 20 JKBD CCOc1ccc(OCC)c(NC(=S)/C(=C(/O)c2cccc([N+](=O)[O-])c2)[n+]2cccc(C)c2)c1 726964139 UASJJIAGHKYFOY-UHFFFAOYSA-O 480.566 5.311 5 20 JKBD O=C(CCC(=O)c1ccc2ccc3cccc4ccc1c2c34)Nc1cccc(CN2C(=O)CNC2=O)c1 727754998 MYGNPBZLGUUQMR-UHFFFAOYSA-N 489.531 5.237 5 20 JKBD Cc1cc(OCc2cccc(Cl)c2)ccc1NC(=O)Cn1ncc2ccc([N+](=O)[O-])cc21 727999204 JHLDVDOEKXHZHH-UHFFFAOYSA-N 450.882 5.124 5 20 JKBD Cc1cc(NC(=O)c2ccco2)sc1C(=O)N(CC1CC1)c1ccc(Cl)c([N+](=O)[O-])c1 728165988 TZZSPKQHUZBOCW-UHFFFAOYSA-N 459.911 5.520 5 20 JKBD CC(C)(C)OC(=O)Nc1ccc(NC(=O)CSc2ccc([N+](=O)[O-])cc2)c(C(F)(F)F)c1 729657639 OFYQEIJSQVOVAL-UHFFFAOYSA-N 471.457 5.691 5 20 JKBD Cc1c(C(C)(C)C)nn(-c2ccccc2)c1NC(=O)c1cc([N+](=O)[O-])ccc1Br 730504951 UTFIMHKJRMSFMT-UHFFFAOYSA-N 457.328 5.401 5 20 JKBD CC(=O)N(c1nc(COC(=O)/C=C\c2ccc([N+](=O)[O-])cc2)cs1)c1c(C)cc(C)cc1Cl 798128139 OWZQZBMJYQXPKO-TWGQIWQCSA-N 485.949 5.763 5 20 JKBD O=c1c2ccccc2[nH]c2ccc(-c3nc(-c4ccc(Cn5cnc6ccccc65)cc4)no3)cc12 904474431 QILIZYUNAJURHM-UHFFFAOYSA-N 469.504 5.796 5 20 JKBD C[C@@H](OC(=O)c1sc2cccc(Cl)c2c1Cl)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 913326830 GCEYDFASRKIMES-SECBINFHSA-N 464.286 6.084 5 20 JKBD COc1cc(C(=O)Oc2cc(C(=O)N(C)C)ccc2C)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 916065523 NAMQWKYPQBXQDA-UHFFFAOYSA-N 484.892 5.279 5 20 JKBD O=C(Oc1ccc(NC(=O)c2ccccc2Br)cc1)c1cc2cccc([N+](=O)[O-])c2[nH]1 916952788 SWPYTBBUOWOHQU-UHFFFAOYSA-N 480.274 5.310 5 20 JKBD CC(=O)Nc1cccc([C@H](C)N(Cc2ccccc2)C(=O)CCOc2ccccc2[N+](=O)[O-])c1 917631648 SCWFSMCNTGKZCT-IBGZPJMESA-N 461.518 5.112 5 20 JKBD O=C(OCc1nc2ccccc2c2ccccc12)[C@H]1CS[C@@]2(c3ccc(F)cc3)CCC(=O)N12 921265327 WPJFIDVNKALFQW-SHQCIBLASA-N 472.541 5.161 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)c3cc4cc(F)ccc4s3)CCC2)cc1)c1ccc([N+](=O)[O-])o1 1785750422 IKMPZURVYHLABV-UHFFFAOYSA-N 479.489 5.603 5 20 JKBD O=C(NC1(c2ccc(NC(=O)c3cc4ccccc4o3)cc2)CCC1)c1nc2cc([N+](=O)[O-])ccc2[nH]1 1789004736 XVJKDWQMSIHWPH-UHFFFAOYSA-N 495.495 5.279 5 20 JKBD Cc1cccc2[nH]c(C(=O)Nc3ccc(C4(NC(=O)c5cc(O)cc([N+](=O)[O-])c5)CCC4)cc3)cc12 1789274203 FRLOTSGDUWSOAJ-UHFFFAOYSA-N 484.512 5.152 5 20 JKBD O=C(Cc1cccc([N+](=O)[O-])c1)NC1(c2ccc(NC(=O)c3cccc4ccoc34)cc2)CCC1 1790952832 PDOJPPJGRFAFMM-UHFFFAOYSA-N 469.497 5.331 5 20 JKBD COc1cc(C(=O)NC2(c3ccc(NC(=O)[C@@H]4C[C@H]4c4ccccc4)cc3)CCC2)ccc1[N+](=O)[O-] 1791531608 HVWJIZLKWZKAAT-XZOQPEGZSA-N 485.540 5.155 5 20 JKBD CCCCC[C@H](C)C(=O)N1CCC2(CCCN(C(=O)Cc3ccc(Cl)cc3[N+](=O)[O-])C2)CC1 1805485006 MYZQYELWEVFCIZ-IBGZPJMESA-N 478.033 5.238 5 20 JKBD CC(C)=CCCC(=O)NC[C@@H]1CCN(C(=O)c2cc(Cl)cc([N+](=O)[O-])c2C)[C@H]1c1cccnc1 1807987118 FJRUMVVOONXTPV-CYFREDJKSA-N 484.984 5.018 5 20 JKBD Cc1c(Cl)cccc1C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cc(F)cc([N+](=O)[O-])c2)n[nH]1 1821163558 SHBISVWGHVRBRX-FQEVSTJZSA-N 485.903 5.039 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)N1CCCC[C@@H]1C1CCN(C(=O)[C@@]2(C)CC=CCC2)CC1 1830729738 VTORSHKSMCGJFZ-GJZUVCINSA-N 471.573 5.022 5 20 JKBD O=C(c1cccc(F)c1)N1CCC([C@@H]2CCCCN2C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)CC1 1831060688 FJIYPLNXIBMSBO-QFIPXVFZSA-N 495.576 5.496 5 20 JKBD CCCCC[C@@H](C)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)Cc2ccc([N+](=O)[O-])cc2F)CC1 1831467724 YIMMRINHZDMNPR-NTKDMRAZSA-N 475.605 5.113 5 20 JKBD CCc1nnc(NC(=O)c2ccccc2Sc2ccc(C(F)(F)F)cc2[N+](=O)[O-])s1 15963476 FYIZFCASQHADAV-UHFFFAOYSA-N 454.455 5.431 5 20 JKBD CSc1ccc([N+](=O)[O-])c(C(=O)O[C@H](C)C(=O)Nc2c(Cl)cc(Cl)cc2Cl)c1 16196520 XIQCUBSJEVZXEF-MRVPVSSYSA-N 463.726 5.461 5 20 JKBD CC1=C(C(=O)Nc2ccccc2C)[C@H](c2ccc([N+](=O)[O-])cc2)NC(=S)N1c1ccc(C)c(F)c1 16504371 DDKJGBVQRZLQSV-DEOSSOPVSA-N 490.560 5.699 5 20 JKBD Cc1ccc(CN[C@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Br)c2ccccc2)cc1 21820046 GKFHTAQGZBPSQT-NRFANRHFSA-N 454.324 5.135 5 20 JKBD C[C@@H](Sc1nnc(-c2ccc(C(C)(C)C)cc2)o1)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl 22249693 BEWOHRVOOGRSJK-GFCCVEGCSA-N 460.943 5.715 5 20 JKBD CC(=O)N(c1nc(COC(=O)c2c(C)cccc2[N+](=O)[O-])cs1)c1c(C)cc(C)cc1C 26119232 DQUPMMFLLVNGED-UHFFFAOYSA-N 453.520 5.327 5 20 JKBD Cc1csc(Sc2ccc(C(=O)OCC(=O)Nc3ccccc3C(C)C)cc2[N+](=O)[O-])n1 28831678 RDTUIVNIFLQVHR-UHFFFAOYSA-N 471.560 5.430 5 20 JKBD C[C@H](Nc1ccc(C(=O)N(C)Cc2ccccc2C(F)(F)F)cc1[N+](=O)[O-])c1ccccn1 108768088 DOWYEANRYINFNO-HNNXBMFYSA-N 458.440 5.454 5 20 JKBD C[C@H](NC(=O)c1ccc(N[C@H](C)c2ccccn2)c([N+](=O)[O-])c1)c1cccc(OC(F)F)c1 108832729 PDFKOPHJFYRBGA-LSDHHAIUSA-N 456.449 5.255 5 20 JKBD Cc1nc(NC(=O)c2ccc(N[C@@H](C)c3ccccn3)c([N+](=O)[O-])c2)sc1Cc1ccc(F)cc1 108833681 XFIQLUAUQGLVRI-HNNXBMFYSA-N 491.548 5.910 5 20 JKBD COc1cc(C(=O)NCc2cccc(Oc3ccccc3)c2)c([N+](=O)[O-])cc1OCc1cscn1 108905740 HWOQUTHRLJWBPX-UHFFFAOYSA-N 491.525 5.361 5 20 JKBD C[C@H](Nc1ccc(C(=O)N2CCC[C@@H]2c2ccc(Cl)cc2)cc1[N+](=O)[O-])c1ccccn1 115710369 WOXZYCHFOVVTQP-KSFYIVLOSA-N 450.926 5.794 5 20 JKBD Cc1cc(-c2cc(C(=O)N3c4ccc([N+](=O)[O-])cc4C[C@@H]3C)c3cnn(C(C)C)c3n2)c(C)o1 504319106 VFSLLTDZIHGNFO-AWEZNQCLSA-N 459.506 5.389 5 20 JKBD C[C@H](Nc1ccc(C(=O)Nc2ccccc2COCc2ccccc2)cc1[N+](=O)[O-])c1ccccn1 507366492 GQVILOSUPZYEMT-FQEVSTJZSA-N 482.540 6.132 5 20 JKBD CCN(C(=O)NCc1ccc(OC)c([N+](=O)[O-])c1)[C@H]1CCSc2ccc(Br)cc21 508131850 LJQCBNYWGXQSBM-INIZCTEOSA-N 480.384 5.135 5 20 JKBD CCN(C(=O)c1cc(OC)c(OCc2cscn2)cc1[N+](=O)[O-])c1ccc(Br)cc1 512245497 RLGUELRRQJGGCP-UHFFFAOYSA-N 492.351 5.068 5 20 JKBD COC(=O)c1ccc([N+](=O)[O-])c(OCc2csc(N(C(C)=O)c3c(C)cc(C)cc3Cl)n2)c1 515288817 BNQPOAOTORTTHH-UHFFFAOYSA-N 489.937 5.372 5 20 JKBD Cc1ccc(NC(=O)C(=O)NC(c2ccc(Cl)cc2)c2ccc(Cl)cc2)cc1[N+](=O)[O-] 516439910 BXQHDESARPMWBM-UHFFFAOYSA-N 458.301 5.054 5 20 JKBD O=C(Nc1cc(C(F)(F)F)ccc1N1CCCCC1)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-] 516471632 GDYAVWRNFXBZKU-UHFFFAOYSA-N 491.388 5.797 5 20 JKBD C[C@@H](NCc1ccc(-c2ccc([N+](=O)[O-])cc2Br)o1)c1cccc(OC(F)F)c1 520949696 MGBPBVRDGAXPIU-GFCCVEGCSA-N 467.266 6.070 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1F)[C@@H]1C[C@@H]2CCCC[C@@H]2N1C(=O)c1ccc2ccccc2c1 524164151 NSJDMPFDFGVZAQ-NWVWQQAFSA-N 461.493 5.299 5 20 JKBD C[C@@H](NCc1ccccc1CN1CCCC[C@H]1C)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 604045293 MSCQUZCOMJTKPY-IAGOWNOFSA-N 478.515 5.105 5 20 JKBD CC(C)(C)C(=O)N1CCC(NC(=O)c2ccc(Sc3nc4ccccc4s3)c([N+](=O)[O-])c2)CC1 604236533 KLLVWJQKDLTZII-UHFFFAOYSA-N 498.630 5.123 5 20 JKBD C[C@H](NC(=O)[C@@H](C)Oc1ccc(Cl)cc1[N+](=O)[O-])c1cccc(NC(=O)c2ccccc2)c1 604442732 QOOMEGVWTXROAN-JKSUJKDBSA-N 467.909 5.145 5 20 JKBD O=C(CSc1ccc(C(F)(F)F)cc1[N+](=O)[O-])N(CCc1ccccn1)Cc1ccc(F)cc1 608881463 YTNBFWKLAGZJPS-UHFFFAOYSA-N 493.482 5.511 5 20 JKBD O=C1OCCN1c1cccc(CNCc2ccc(Oc3ccccc3Cl)c([N+](=O)[O-])c2)c1 727468568 MPZOLUKXFWGOHX-UHFFFAOYSA-N 453.882 5.287 5 20 JKBD O=C(Cc1csc(-c2cccnc2)n1)Nc1cc(Cl)c([N+](=O)[O-])cc1OCc1ccccc1 743853401 FVWPUFMBEDBYIV-UHFFFAOYSA-N 480.933 5.527 5 20 JKBD COc1ccc(NC(=O)[C@@H](C)OC(=O)c2csc(-c3ccc(Cl)c(Cl)c3)n2)c([N+](=O)[O-])c1 744604764 JROSNSZAQISSEP-SNVBAGLBSA-N 496.328 5.218 5 20 JKBD C[C@@H](OC(=O)c1csc(-c2ccc([N+](=O)[O-])cc2)n1)C(=O)Nc1cc(Cl)ccc1Cl 747954776 FWQULRDKAPIXTR-SNVBAGLBSA-N 466.302 5.209 5 20 JKBD O=[N+]([O-])c1ccccc1C1=NO[C@H](c2nc(-c3cc(Br)cc(Br)c3)no2)C1 904914257 LLYIIVUHDPFVPU-HNNXBMFYSA-N 494.099 5.036 5 20 JKBD C[C@H](NC(=O)c1ccccc1NC(=O)c1cccc(Br)c1)c1cccc([N+](=O)[O-])c1 918136476 LNTOZQKZFGYIMU-AWEZNQCLSA-N 468.307 5.101 5 20 JKBD Cc1ccc(NC(=O)Nc2ccccc2)cc1NC(=O)c1cc([N+](=O)[O-])ccc1N1CCCCC1 918613820 XKOYUVIZNUFMAA-UHFFFAOYSA-N 473.533 5.790 5 20 JKBD Cc1c(C(=O)NC2(c3ccc(NC(=O)c4coc(Cl)n4)cc3)CCC2)cc(Cl)cc1[N+](=O)[O-] 1787108530 MPZJAYIKSBGTPO-UHFFFAOYSA-N 489.315 5.260 5 20 JKBD CCn1nccc1C(=O)Nc1ccc(C2(NC(=O)c3cc4cc([N+](=O)[O-])ccc4s3)CCC2)cc1 1787506685 GHHSEDGZMQWKJK-UHFFFAOYSA-N 489.557 5.087 5 20 JKBD O=C(NC1(c2ccc(NC(=O)[C@H]3CCC=CO3)cc2)CCC1)c1cc2cc([N+](=O)[O-])ccc2s1 1789503530 SWLQYVKUOBZDKX-HXUWFJFHSA-N 477.542 5.250 5 20 JKBD CCCCC[C@H](C)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cc3cc([N+](=O)[O-])ccc3s1)C2 1801716341 UNIVQCYHDFDASD-KANFNMMFSA-N 457.596 5.278 5 20 JKBD CC(C)=CCCC(=O)N1CC[C@H](CNC(=O)c2cc3cc([N+](=O)[O-])ccc3s2)[C@@H]1c1cccnc1 1812303820 ORHPPBGOGJBNHS-CLOONOSVSA-N 492.601 5.271 5 20 JKBD O=C(CCc1cccc([N+](=O)[O-])c1)Nc1cc([C@H]2CCCCN2C(=O)c2ccccc2C2CC2)[nH]n1 1815538600 BZZMHPGKNWYWIS-XMMPIXPASA-N 487.560 5.134 5 20 JKBD O=C(c1cc2cc([N+](=O)[O-])ccc2s1)N1CCC([C@@H]2CCCCN2C(=O)/C=C/C2CC2)CC1 1824215989 WJNGVHRQBMAWTM-JLXBBBJOSA-N 467.591 5.009 5 20 JKBD O=C(c1cc2cc([N+](=O)[O-])ccc2s1)N1CCC([C@H]2CCCCN2C(=O)Cc2ccccc2)CC1 1826466161 ZEBZEVUEAPBFBX-HSZRJFAPSA-N 491.613 5.286 5 20 JKBD COc1cc(C(=O)N2CCC([C@@H]3CCCCN3C(=O)c3ccc(C(C)C)cc3)CC2)ccc1[N+](=O)[O-] 1830061293 WLKAWNOUHNFGCM-DEOSSOPVSA-N 493.604 5.274 5 20 JKBD COc1ccc(C(=O)N2CCC([C@@H]3CCCCN3C(=O)c3cc(Cl)cc([N+](=O)[O-])c3C)CC2)cc1 1830736327 WAVLJHMZUBAHES-QHCPKHFHSA-N 499.995 5.112 5 20 JKBD O=C(c1cc2cc([N+](=O)[O-])ccc2s1)N1CC2(CCCN2C(=O)c2ccc(-c3cccnc3)cc2)C1 1845278207 BBYPJABWLVWUNX-UHFFFAOYSA-N 498.564 5.002 5 20 JKBD Cc1c(-c2ccccc2)oc2c(C(=O)OCC(=O)Nc3ccc(Cl)cc3[N+](=O)[O-])cccc2c1=O 9487068 BLOJLCJVRPWHMK-UHFFFAOYSA-N 492.871 5.126 5 20 JKBD C[C@H](NC(=O)c1ccccc1NC(=O)c1ccc(Br)c([N+](=O)[O-])c1)c1ccccc1 14792779 NPYGVHZEOJBQFF-AWEZNQCLSA-N 468.307 5.101 5 20 JKBD Cc1c(-c2ccccc2)oc2c(C(=O)O[C@@H](C)c3nnc(-c4ccc([N+](=O)[O-])cc4)o3)cccc2c1=O 17672520 VVHKMIKVQWAEGQ-INIZCTEOSA-N 497.463 5.645 5 20 JKBD C[C@H](NC[C@H](c1ccccc1)c1c[nH]c2ccccc12)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl 19623281 ZEAXLOZOUSTQJP-OXJNMPFZSA-N 462.937 5.478 5 20 JKBD COc1ccccc1NC(=O)[C@H](C)OC(=O)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1 21258426 XTNCDNRWAMLWKQ-AWEZNQCLSA-N 470.865 5.233 5 20 JKBD C[C@H](Sc1nccn1-c1cccc(Cl)c1)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 21422375 NELAVFNNTIKPMX-NSHDSACASA-N 470.860 5.572 5 20 JKBD CCn1c(S[C@H](C)C(=O)Nc2c(C)cc(C)cc2Cl)nc2cc3ccccc3cc2c1=O 26581057 FXZZGYBXHCSPLW-MRXNPFEDSA-N 466.006 5.959 5 20 JKBD COc1ccc(-c2nnc(SCC(=O)Nc3ccc(F)c([N+](=O)[O-])c3)n2C2CCCCC2)cc1 28606462 PICITPICEKURMU-UHFFFAOYSA-N 485.541 5.237 5 20 JKBD O=[N+]([O-])c1ccc(-c2nnc(CSc3nnc(COc4ccccc4Cl)n3C3CC3)o2)cc1 29809685 LFJGHZGKAIBSCN-UHFFFAOYSA-N 484.925 5.096 5 20 JKBD CCOc1cc([N+](=O)[O-])c(C(=O)NC[C@@H]2CC3c4ccccc4C2c2ccccc23)cc1OC 45452534 BKDAUQKZKUIRNW-WAFXNIOSSA-N 458.514 5.029 5 20 JKBD Cc1ccc(-c2csc(NC(=O)Cn3c(C(F)(F)F)nc4ccccc43)n2)cc1[N+](=O)[O-] 105356333 DIJXPUTYFRIAKX-UHFFFAOYSA-N 461.425 5.034 5 20 JKBD Cc1nc([N+](=O)[O-])cn1CC(=O)Nc1cc(Cl)ccc1Oc1ccc(C(=O)c2ccccc2)cc1 303073984 QKLNYJHFLASBEZ-UHFFFAOYSA-N 490.903 5.415 5 20 JKBD CCCOc1cc(NC(=O)c2cnn(-c3cccc(C)c3)c2C)c([N+](=O)[O-])cc1OCCC 478152177 YEDOYSDGQLYJSP-UHFFFAOYSA-N 452.511 5.227 5 20 JKBD Cc1cc(NC(=O)CCNc2ccc(C(F)(F)F)cc2[N+](=O)[O-])ccc1NC(=O)c1ccco1 490137156 UIGUHAZRWUTULP-UHFFFAOYSA-N 476.411 5.208 5 20 JKBD O=C(Nc1cccc(Cl)c1Oc1cccnc1)c1csc(-c2ccc([N+](=O)[O-])cc2)n1 496613167 UAGLWQIEJCIYCX-UHFFFAOYSA-N 452.879 5.811 5 20 JKBD Cc1ccccc1-c1ccc(CN(C(=O)c2ccc(S(C)(=O)=O)c([N+](=O)[O-])c2)C(C)C)s1 498410135 QFHUNMPFUKZPJM-UHFFFAOYSA-N 472.588 5.086 5 20 JKBD COc1cc([C@@H](C)NC(=O)c2csc(-c3ccc([N+](=O)[O-])cc3)n2)ccc1OCc1ccncc1 498601430 SHDDLXVGERSHSP-MRXNPFEDSA-N 490.541 5.192 5 20 JKBD CSc1ccc(C(=O)c2ccccc2C(=O)N2CC[C@@H](c3ccccc3C)C2)cc1[N+](=O)[O-] 504926161 TXULPVLFNPPDGA-LJQANCHMSA-N 460.555 5.486 5 20 JKBD C[C@H](Nc1ccc(C(=O)N(C)Cc2c(Cl)cccc2Cl)cc1[N+](=O)[O-])c1ccccn1 506205510 RUWAMCGJUKYXSO-AWEZNQCLSA-N 459.333 5.742 5 20 JKBD Cn1cc(C(=O)Nc2ccc(NC(=O)c3ccc(Cl)cc3)cc2)c(-c2ccc([N+](=O)[O-])cc2)n1 507613377 QVVYSQAVEOIHFX-UHFFFAOYSA-N 475.892 5.153 5 20 JKBD CCOc1cc(CN[C@@H]2CCc3cc(C)ccc32)ccc1OCc1cc([N+](=O)[O-])cc2c1OCOC2 507940667 KUSIVBLLKQQKOO-RUZDIDTESA-N 490.556 5.525 5 20 JKBD O=C(c1ccc([N+](=O)[O-])cc1I)N1CCc2sccc2[C@@H]1c1cccs1 508795479 MHZLZLHJCUCPMI-QGZVFWFLSA-N 496.351 5.110 5 20 JKBD COc1ccccc1Oc1ccc(NC(=O)c2ccc(Sc3nncn3C)c([N+](=O)[O-])c2)cc1F 509007681 IWEKECRNQAVYQT-UHFFFAOYSA-N 495.492 5.067 5 20 JKBD COc1cc(C(=O)N(Cc2ccccc2)C2CCCCC2)c([N+](=O)[O-])cc1OCc1cscn1 512308175 DZZRUSVVYQZJDR-UHFFFAOYSA-N 481.574 5.614 5 20 JKBD COc1ccc([C@@H](C)NC(=O)CSc2ccc(C(F)(F)F)cc2[N+](=O)[O-])cc1Br 515201781 QGHLOVROSDYTTQ-SNVBAGLBSA-N 493.301 5.354 5 20 JKBD CCOc1ccc([C@@H](CNC(=O)c2ccc([N+](=O)[O-])cc2F)c2c[nH]c3ccccc23)cc1OC 515586225 YNINNCURHRDHMC-HXUWFJFHSA-N 477.492 5.184 5 20 JKBD O=[N+]([O-])c1ccccc1-c1ccc(CNCc2cn(-c3ccccc3)nc2-c2ccncc2)s1 518280507 SLFLWQVDJCYODE-UHFFFAOYSA-N 467.554 5.861 5 20 JKBD COc1ccccc1CN(Cc1cccs1)C(=O)[C@H](C)Oc1ccc(Cl)cc1[N+](=O)[O-] 518823579 XWENMFDJANDDBG-HNNXBMFYSA-N 460.939 5.315 5 20 JKBD CCc1c(-c2ccncc2)n[nH]c1NC(=O)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])c(OC)c1 524486027 AISZTDDFFMEURJ-UHFFFAOYSA-N 493.907 5.649 5 20 JKBD Cc1ccc(Cn2nccc2NC(=O)C/C(=C\c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)o1 524577030 AOAYQPKLIDVEOV-XMHGGMMESA-N 499.552 5.920 5 20 JKBD CCN(Cc1ccc(OCc2cccs2)c(OC)c1)C(=O)Nc1cc([N+](=O)[O-])ccc1OC 603642904 HFTFUYMJLJJROR-UHFFFAOYSA-N 471.535 5.307 5 20 JKBD O=[N+]([O-])c1cc(CSc2nnc(CN3CCCCC3)n2-c2ccc(OC(F)F)cc2)cs1 603938108 SNJFJJCATSBVJU-UHFFFAOYSA-N 481.550 5.117 5 20 JKBD Cc1cc(NC(=O)c2ccccc2Cl)sc1C(=O)Nc1cc([N+](=O)[O-])ccc1OC(F)F 603961142 IIBAMVNRKFKLJF-UHFFFAOYSA-N 481.864 5.724 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Cl)[C@@H](Nc1cccc(COCc2ccco2)c1)c1ccccc1 604045988 NQVVJKLVHSOXCN-VWLOTQADSA-N 491.931 6.350 5 20 JKBD CCOc1cc([N+](=O)[O-])c(C(=O)Nc2ccc(N[C@H](C)c3ccccc3)c(Cl)c2)cc1OC 609072167 KARUYGJAXIMHME-OAHLLOKOSA-N 469.925 6.081 5 20 JKBD COc1cc(C(=O)N2CCCO[C@H](c3ccccc3)C2)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 609231339 YMRCQUWLPQPJPR-DEOSSOPVSA-N 482.920 5.653 5 20 JKBD Cc1ccc(-c2nnc(S[C@H](C(=O)Nc3ccc(C)cc3[N+](=O)[O-])c3ccccc3)o2)cc1 619647574 MDGPHBGOVUXELJ-NRFANRHFSA-N 460.515 5.734 5 20 JKBD Cc1ccc[n+](/C(C(=S)Nc2ccccc2-c2ccccc2)=C(/O)c2ccc(C)c([N+](=O)[O-])c2)c1 725764164 RRFKVQYVAJEUSO-UHFFFAOYSA-O 482.585 6.489 5 20 JKBD O=C(Nc1nc(C2CC2)c(Cc2ccc(F)cc2)s1)c1cc([N+](=O)[O-])ccc1Br 727097174 KEYGYCGQTTULCD-UHFFFAOYSA-N 476.327 5.673 5 20 JKBD Cc1ccc(NC(=O)N2CCN(c3ccc([N+](=O)[O-])cc3C(F)(F)F)CC2)c(Br)c1 727585781 HSNMKLZDVBSSJB-UHFFFAOYSA-N 487.276 5.039 5 20 JKBD O=C(OCC(=O)N1N=C(c2ccc(Cl)cc2)C[C@@H]1c1ccco1)c1c(Cl)cccc1[N+](=O)[O-] 730643414 BOIGYIBMUUTCHZ-GOSISDBHSA-N 488.283 5.029 5 20 JKBD C[C@@H](OC(=O)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-])c1ccccc1NC(=O)c1ccccc1 748018083 DHSWHTSDFYPYDB-OAHLLOKOSA-N 488.418 5.706 5 20 JKBD O=C(O[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1)c1c[nH]c2cc([N+](=O)[O-])ccc12 756767851 ZODGWKGFFUWBIN-NRFANRHFSA-N 494.847 5.175 5 20 JKBD O=C(NCc1ccccc1F)c1ccc(NCc2c(Br)cccc2[N+](=O)[O-])cc1 863999844 JDBRCTLMSVNWEZ-UHFFFAOYSA-N 458.287 5.039 5 20 JKBD O=C(Nc1cc(Cl)c([N+](=O)[O-])cc1OCc1ccccc1)c1ccc2c(c1)OCCCO2 916831576 NISKZMAWOHPPHO-UHFFFAOYSA-N 454.866 5.241 5 20 JKBD CC(C)Oc1ccc(C(=O)NC2(c3ccc(NC(=O)c4ccc([N+](=O)[O-])o4)cc3)CCC2)c(F)c1 1785751027 HXEUTVGRGANFPP-UHFFFAOYSA-N 481.480 5.176 5 20 JKBD CC(C)[C@H](C(=O)Nc1ccc(C2(NC(=O)c3nc[nH]c3[N+](=O)[O-])CCC2)cc1)c1ccc(Cl)cc1 1786184493 GVUBZEJEWSCFIY-FQEVSTJZSA-N 495.967 5.159 5 20 JKBD O=C(/C=C/c1ccccc1[N+](=O)[O-])NC1(c2ccc(NC(=O)CCC(F)(F)F)cc2)CCC1 1787873794 QYYSYMQHRHURLX-IZZDOVSWSA-N 461.440 5.085 5 20 JKBD CCn1nc(C(=O)Nc2ccc(C3(NC(=O)/C=C/c4ccc([N+](=O)[O-])o4)CCC3)cc2)c2ccccc21 1788364490 ADTXYKGGMOAWRW-WYMLVPIESA-N 499.527 5.019 5 20 JKBD Cc1c(C(=O)NC[C@H]2CCN(C(=O)CCC3CCCC3)[C@@H]2c2cccnc2)cc(Cl)cc1[N+](=O)[O-] 1811794272 MMCIBIWZFOJZOX-CJFMBICVSA-N 499.011 5.242 5 20 JKBD O=C(CCc1cccc([N+](=O)[O-])c1)Nc1cc([C@@H]2CCCCN2C(=O)c2cc3ccoc3s2)[nH]n1 1815537870 XPNBSWJRWIUYRF-IBGZPJMESA-N 493.545 5.064 5 20 JKBD CC(C)c1ccc(C(=O)N2CCCC[C@H]2c2cc(NC(=O)Cc3cc([N+](=O)[O-])ccc3F)n[nH]2)cc1 1815644553 QOHJSLQDKZSWDY-QHCPKHFHSA-N 493.539 5.129 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2ccc(Cl)s2)[nH]n1 1821283760 ZICPLYOPXYLVBP-HNNXBMFYSA-N 491.932 5.100 5 20 JKBD CC(C)[C@H]1CC[C@H](C(=O)Nc2cc([C@H]3CCCCN3C(=O)Cc3cc(F)ccc3[N+](=O)[O-])[nH]n2)CC1 1822103841 ANGHJTOTOBIMRD-PMAPCBKXSA-N 499.587 5.154 5 20 JKBD CC(=O)Nc1c(C)cccc1C(=O)O[C@H](C(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1)c1ccccc1 11811518 IRJFDZAUANHKLY-QFIPXVFZSA-N 481.892 5.052 5 20 JKBD O=C(Nc1ccccc1-c1ccccc1)c1ccc(OS(=O)(=O)c2cccc([N+](=O)[O-])c2)cc1 15643207 JYNLAPCSFUGJPX-UHFFFAOYSA-N 474.494 5.282 5 20 JKBD C[C@@H](OC(=O)CCC(=O)c1ccc(-c2ccccc2)cc1)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 18959417 QLDNJMXMZWCERQ-QGZVFWFLSA-N 471.469 5.579 5 20 JKBD O=C(OCC(=O)N1N=C(c2cc3ccccc3o2)C[C@@H]1c1ccco1)c1ccc(Cl)cc1[N+](=O)[O-] 24459346 QBCQHDGJFCPXTQ-LJQANCHMSA-N 493.859 5.122 5 20 JKBD C[C@@H]1CCc2[nH]c3ccc(C(=O)OCC(=O)Nc4ccc([N+](=O)[O-])cc4C(F)(F)F)cc3c2C1 28811675 WGFNWVTYXXLUBH-GFCCVEGCSA-N 475.423 5.015 5 20 JKBD COc1ccccc1-c1nnc(SCCC(=O)Nc2ccccc2[N+](=O)[O-])n1-c1ccc(C)cc1 45894893 XFQCLZRUYABSKB-UHFFFAOYSA-N 489.557 5.280 5 20 JKBD CCOc1ccc(C(=O)NC[C@@H](c2ccc(OC)cc2)c2c[nH]c3ccccc23)cc1[N+](=O)[O-] 104794989 YJXMUQMBFKDFPX-NRFANRHFSA-N 459.502 5.045 5 20 JKBD C[C@H](Nc1ccc(C(=O)NCc2cccc(NC(=O)C3CCCC3)c2)cc1[N+](=O)[O-])c1ccccn1 108855825 MJAWDOKQJNVHSN-SFHVURJKSA-N 487.560 5.222 5 20 JKBD CC(C)OC(=O)C[C@@H](NC(=O)Cc1csc(-c2ccc(Cl)s2)n1)c1ccccc1[N+](=O)[O-] 108955182 ONFOJNCUFWSQEF-OAHLLOKOSA-N 493.994 5.175 5 20 JKBD CC(C)N(C)C(=O)c1ccc(Cl)c(NC(=O)c2ccc(N3CCC[C@@H](C)C3)c([N+](=O)[O-])c2)c1 116560746 PKKABLVPZMFONS-MRXNPFEDSA-N 472.973 5.217 5 20 JKBD Cc1ccsc1CN(C(=O)c1cc([N+](=O)[O-])cc(S(C)(=O)=O)c1)c1ccc(F)c(Cl)c1 195663872 IXRGIKNDCBRUJH-UHFFFAOYSA-N 482.942 5.008 5 20 JKBD COc1cc(CNCc2ccc(N3CCC(C)CC3)nc2)ccc1OCc1ccc([N+](=O)[O-])cc1 302944645 MCLLBRKBDXXDFS-UHFFFAOYSA-N 476.577 5.104 5 20 JKBD O=C(Nc1cccc(CNC(=O)c2csc(-c3cccc([N+](=O)[O-])c3)n2)c1)c1cccc(F)c1 496594827 SSRNIQSDJJBVOJ-UHFFFAOYSA-N 476.489 5.040 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Br)[C@@H](NCCc1cc(F)cc(F)c1)c1ccccc1 500388005 TWBNAHYUUZRYEB-NRFANRHFSA-N 490.304 5.148 5 20 JKBD O=C(Nc1cc([N+](=O)[O-])ccc1Nc1cccc(C(F)(F)F)c1)c1cnc(-c2ncccn2)s1 503236718 VGGGSXKJXSNDOU-UHFFFAOYSA-N 486.435 5.523 5 20 JKBD CCOc1cc([N+](=O)[O-])c(C(=O)Nc2ccc(N(C)C(=O)c3ccc(Cl)cc3)cc2)cc1OC 511587961 MZCCRMIHZIEZEH-UHFFFAOYSA-N 483.908 5.184 5 20 JKBD CCOc1ccc(CN[C@@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Br)c2ccccc2)cc1 516835326 GMDDYEVMXNQZKO-JOCHJYFZSA-N 484.350 5.226 5 20 JKBD O=C(Nc1cc(C2CC2)nn1-c1ncccn1)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1 517484943 PXRLEFDPKCXTGI-UHFFFAOYSA-N 476.880 5.146 5 20 JKBD Cc1nc(-c2ccc(Cl)s2)sc1C(=O)Nc1cc2c(cc1[N+](=O)[O-])OCCCO2 519020161 HTNSXFFOHYEWAJ-UHFFFAOYSA-N 451.913 5.155 5 20 JKBD COc1cc(C(=O)Nc2ccc(-c3nncn3C)cc2)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 603598670 GLQYCFKLSSZOIR-UHFFFAOYSA-N 479.880 5.097 5 20 JKBD C[C@H](C(=O)Nc1cccc(NC(=O)c2cc([N+](=O)[O-])ccc2Oc2ccccc2)c1)n1cccn1 603739478 MTPIIFRIHGLCSP-QGZVFWFLSA-N 471.473 5.036 5 20 JKBD O=C(Cc1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1)N[C@H](CC(F)(F)F)c1ccccc1 604009182 DKLPKXSSHYRUIZ-HSZRJFAPSA-N 494.473 5.800 5 20 JKBD Cc1ccc(NC(=O)c2ccc(N[C@H](C)c3nc4ccccc4n3C(F)F)c([N+](=O)[O-])c2)cc1 608972396 GBEGUHXAYWCGMV-OAHLLOKOSA-N 465.460 6.073 5 20 JKBD CC(C)(C)c1csc(CNC(=O)C/C(=C\c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)n1 609190570 GWCPNQGXSMNXNR-SFQUDFHCSA-N 492.626 6.206 5 20 JKBD CC(C)n1ncc2c(C(=O)N(CC3CC3)c3ccc(Cl)c([N+](=O)[O-])c3)cc(C3CC3)nc21 728166688 MEUFRVAHOOWJHN-UHFFFAOYSA-N 453.930 5.508 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)O[C@H](C(=O)Nc2ccc(C)cc2)c2ccccc2)cc1SC 728649271 ILUGSJHVNHWITF-QFIPXVFZSA-N 466.515 5.171 5 20 JKBD C[C@@H](SCc1nc(O)c2c(-c3ccccc3)csc2n1)C(=O)OCc1c(F)cccc1[N+](=O)[O-] 728987761 CLXHDOOBMCSOLK-CYBMUJFWSA-N 499.545 5.476 5 20 JKBD O=C(COC(=O)c1nc(-c2ccccc2)oc1-c1ccccc1)Nc1ccc([N+](=O)[O-])cc1Cl 731377041 LQIRJWYRQXFAFQ-UHFFFAOYSA-N 477.860 5.366 5 20 JKBD CC1=C(C(=O)Nc2cccc(C)c2C)[C@@H](c2ccc([N+](=O)[O-])cc2)NC(=O)N1Cc1cccs1 732038532 JXHBWACRCDNFQL-HSZRJFAPSA-N 476.558 5.452 5 20 JKBD C[C@@H](OC(=O)CCOc1ccc(Cl)cc1Br)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 743002165 URBDTECSIAZSHG-LLVKDONJSA-N 496.701 5.134 5 20 JKBD CCCN(C(=O)c1ccc([N+](=O)[O-])cc1C)c1cccc(NC(=O)c2ccc([N+](=O)[O-])cc2C)c1 751092292 CBWZBPPTZKLKPT-UHFFFAOYSA-N 476.489 5.429 5 20 JKBD Cc1nc(NC(=O)c2cc([N+](=O)[O-])ccc2Br)sc1Cc1cccc(F)c1 751093710 QFHOXCYXZNVUFT-UHFFFAOYSA-N 450.289 5.104 5 20 JKBD Cc1c(C(=O)OCC(=O)N2c3ccccc3Sc3ccc(Cl)cc32)cccc1[N+](=O)[O-] 765873253 YBXHOQFWERWQNN-UHFFFAOYSA-N 454.891 5.543 5 20 JKBD C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc(-c2ccc(N3CCN(c4ccc(F)cc4)CC3)nc2)no1 904643351 YDEWSQKFBWZMIA-FBMGVBCBSA-N 486.507 5.066 5 20 JKBD Cc1ccc(C(=O)Nc2ccccc2)cc1NC(=O)c1cc([N+](=O)[O-])ccc1N1CCCCC1 916071986 NBSMNZYBLBPCNN-UHFFFAOYSA-N 458.518 5.398 5 20 JKBD O=C(CSc1nc2ccc([N+](=O)[O-])cc2s1)N1CCc2sccc2[C@H]1c1ccccc1 917170981 KMMRQNXKTZAMPG-OAQYLSRUSA-N 467.597 5.532 5 20 JKBD CC(C)(C)OC(=O)NC[C@@H]1CCCN(C(=O)c2ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])cc2)C1 920748393 IOIPDJCMNGYVKA-INIZCTEOSA-N 489.956 5.417 5 20 JKBD CC(C)[C@H](OC(=O)[C@H](C)Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)Nc1ccccc1C(F)(F)F 920778145 KDJNYPAESFLTBH-SGTLLEGYSA-N 488.846 5.241 5 20 JKBD Cc1cc(C(=O)NC2(c3ccc(NC(=O)CCc4c[nH]c5ccccc45)cc3)CCC2)ncc1[N+](=O)[O-] 1788243676 HZNMXEAQNOKQEB-UHFFFAOYSA-N 497.555 5.160 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)c3cccc(F)c3[N+](=O)[O-])CCC2)cc1)c1ccc2ncccc2c1 1788908533 WROZABAEDJLBKZ-UHFFFAOYSA-N 484.487 5.344 5 20 JKBD Cc1ccc(CC(=O)N2CCC3(CCCN(C(=O)[C@H](C)c4ccc(Cl)cc4)C3)CC2)cc1[N+](=O)[O-] 1805198253 KSOIVUIYVVGODA-HXUWFJFHSA-N 498.023 5.134 5 20 JKBD CC(C)=CCCC(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)[nH]n1 1820805641 RIIZDUPIZTTZRZ-LJQANCHMSA-N 481.578 5.585 5 20 JKBD O=C(c1cccc(Cl)c1)N1CCC([C@@H]2CCCCN2C(=O)CCc2cccc([N+](=O)[O-])c2)CC1 1824841241 FUGCXAHIJZAVNJ-DEOSSOPVSA-N 483.996 5.114 5 20 JKBD CC1(C)CCC(CC(=O)N2CCC([C@H]3CCCCN3C(=O)c3cc(O)cc([N+](=O)[O-])c3)CC2)CC1 1830707794 XHMWEGCTXOHDJN-XMMPIXPASA-N 485.625 5.140 5 20 JKBD O=C(Cc1ccccc1)N1CCC([C@H]2CCCCN2C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)CC1 1831061782 ZFUWSFZDJOQDDW-HSZRJFAPSA-N 491.613 5.286 5 20 JKBD C[C@H](C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)CC1)n1cccc1 1832112707 AFZCHYXALQBWAF-XMSQKQJNSA-N 494.617 5.106 5 20 JKBD Cc1cccc(C(C)C)c1NC(=O)COC(=O)c1ccccc1C(=O)c1ccc(Cl)c([N+](=O)[O-])c1 11029372 KMXXRVAXEKJDMC-UHFFFAOYSA-N 494.931 5.707 5 20 JKBD CC(C)CCn1c(S[C@@H](C)C(=O)Nc2cc([N+](=O)[O-])ccc2Cl)nc2ccccc2c1=O 11207371 INHCGROYQSEVRB-AWEZNQCLSA-N 474.970 5.124 5 20 JKBD O=C(O[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1)c1ccc(Cn2cccn2)cc1 14149645 LSZMDEVADRGRFP-QHCPKHFHSA-N 490.903 5.030 5 20 JKBD Cc1nn(-c2ccc(F)cc2)c2sc(C(=O)O[C@H](C)c3nnc(-c4ccc([N+](=O)[O-])cc4)o3)cc12 17530781 ZYSUTQYPSQQFMY-CYBMUJFWSA-N 493.476 5.411 5 20 JKBD Cc1csc(Sc2ccc(C(=O)Nc3nc(CN4CCCCC4)cs3)cc2[N+](=O)[O-])n1 22238319 JCTVJJKYJHHZNT-UHFFFAOYSA-N 475.621 5.206 5 20 JKBD O=C(COc1ccc(C(=O)Nc2cc([N+](=O)[O-])ccc2F)cc1)Nc1cccc(C(F)(F)F)c1 104740038 YTBAXGLHDCNTKR-UHFFFAOYSA-N 477.370 5.023 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)Nc2ccc(-c3nc4ccccc4s3)cc2)cc1SC 112529965 HLLJLJHOHYGPLD-UHFFFAOYSA-N 451.529 5.854 5 20 JKBD COc1cc2c(cc1OC)[C@@H](c1ccccc1)N(C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)CC2 195580052 WXWZXKJCPVNJLR-HSZRJFAPSA-N 467.909 5.445 5 20 JKBD CSc1ccc([N+](=O)[O-])c(C(=O)Nc2ccc3c(c2)CCC(=O)N3Cc2ccc(Cl)cc2)c1 303058081 KYLJIDGXKRLFMG-UHFFFAOYSA-N 481.961 5.702 5 20 JKBD CC(=O)Nc1ccc(CNC(=O)C/C(=C/c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)cc1 476573828 XXQCHURMERLZQA-ZHZULCJRSA-N 486.553 5.410 5 20 JKBD Cc1occc1C(=O)Nc1cc(NC(=O)c2cc([N+](=O)[O-])ccc2Oc2ccccc2)ccc1F 479781403 KZNNUPHCKREUHL-UHFFFAOYSA-N 475.432 5.932 5 20 JKBD O=C(Nc1ccc(CNC(=O)c2cc([N+](=O)[O-])ccc2Sc2ccccc2)cc1)c1ccncc1 501706947 NMMLOUZYHMRGOR-UHFFFAOYSA-N 484.537 5.323 5 20 JKBD COc1ccc(Oc2ccc([N+](=O)[O-])cc2C(=O)Nc2ccccc2OC[C@H]2CCCCO2)cc1 511384333 PBHQLPGRVBLOLL-OAQYLSRUSA-N 478.501 5.596 5 20 JKBD O=C(C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)N[C@H](c1cccs1)C1CC1 515008690 IFXKMIRZABWUAX-KPUQOTSHSA-N 475.595 6.464 5 20 JKBD Cc1nn(Cc2ccc(C(=O)N(C3CC3)[C@@H](C)c3ccc(Cl)cc3)cc2)c(C)c1[N+](=O)[O-] 515589575 DXFIHYMOSKBPSC-INIZCTEOSA-N 452.942 5.476 5 20 JKBD CCCOc1cc(NC(=O)c2cnc3onc(C(C)(C)C)c3c2)c([N+](=O)[O-])cc1OCCC 516056239 ZSMWIKDIINNZPV-UHFFFAOYSA-N 456.499 5.258 5 20 JKBD Cc1csc(Sc2ccc(C(=O)NCc3cccc(NC(=O)N4CCCC4)c3)cc2[N+](=O)[O-])n1 516631754 GOOHCLTZSRARET-UHFFFAOYSA-N 497.602 5.069 5 20 JKBD C[C@@H](Nc1cc(Cl)ccc1OC[C@H]1CCCO1)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 518012788 CKDLOSRAUALADN-IUODEOHRSA-N 487.862 5.264 5 20 JKBD C[C@@H](c1cccnc1)N(C)C(=O)c1ccc(Sc2nc3ccccc3s2)c([N+](=O)[O-])c1 520963915 MCLSVESLNNONMT-AWEZNQCLSA-N 450.545 5.584 5 20 JKBD C[C@@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)NCc1cccc(NC(=O)Nc2ccccc2)c1 522508776 WKCZBTQEDNVVPF-MRXNPFEDSA-N 450.520 5.036 5 20 JKBD O=[N+]([O-])c1cc(Br)ccc1Sc1nnc(-c2ccccc2)n1Cc1ccco1 524265516 QCAJQTJZUOSNEV-UHFFFAOYSA-N 457.309 5.408 5 20 JKBD COc1cc(C(=O)Nc2cccc3c2OCCO3)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 569479347 FJQVWBOAVQWOMX-UHFFFAOYSA-N 456.838 5.073 5 20 JKBD Cc1ccc(C(=O)N(C[C@@H]2CCCO2)c2nc(-c3cccc(C(F)(F)F)c3)cs2)cc1[N+](=O)[O-] 592950479 PKAKFQXPVKLWIC-SFHVURJKSA-N 491.491 5.871 5 20 JKBD C[C@H](NC(=O)N[C@H](C)c1cccc(NC(=O)Cc2ccccc2F)c1)c1cccc([N+](=O)[O-])c1 604131129 VRWLMTKKOSQLJZ-SJORKVTESA-N 464.497 5.037 5 20 JKBD Cc1ccc(NC(=O)c2cccc(C(F)(F)F)c2)cc1NC(=O)c1ccc([N+](=O)[O-])c(C)c1 604449386 JZMRGICFBNAGBB-UHFFFAOYSA-N 457.408 5.735 5 20 JKBD C[C@@H](NC(=O)c1cccc([N+](=O)[O-])c1)C(=O)Nc1ccc(N[C@H](C)c2ccccc2)c(Cl)c1 609072006 CEJLXKBIOXEUDI-HZPDHXFCSA-N 466.925 5.178 5 20 JKBD Cc1ccc(NC(=O)[C@H](Sc2nnc(-c3ccccc3)n2C)c2ccccc2)c([N+](=O)[O-])c1 619853368 KSLHQXRFQGYQCM-OAQYLSRUSA-N 459.531 5.171 5 20 JKBD O=C(COC(=O)c1csc(-c2ccc(Cl)c(Cl)c2)n1)Nc1cc([N+](=O)[O-])ccc1Cl 744604402 FLPIAKJDEOVENU-UHFFFAOYSA-N 486.720 5.474 5 20 JKBD CS(=O)(=O)c1ccc(S[C@H](C(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)c2ccccc2)cc1 749751675 KKJZRKBYZNPVGB-FQEVSTJZSA-N 476.963 5.124 5 20 JKBD COc1ccc(NC(=O)c2ccccc2NC(=O)Cn2c3ccccc3c(=O)c3ccccc32)cc1 836758660 QBUFOMINPFNUBH-UHFFFAOYSA-N 477.520 5.054 5 20 JKBD O=C(Oc1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2Cl)cc1)c1ccc(C(F)(F)F)cn1 844259181 HLNWOJCPHGHUGZ-UHFFFAOYSA-N 465.771 5.134 5 20 JKBD CSc1ccc(NC(=O)[C@H](C)Oc2ccc3c(-c4ccc([N+](=O)[O-])cc4)cc(=O)oc3c2)cc1 851958916 KXBUCKNKOMYXBJ-HNNXBMFYSA-N 476.510 5.496 5 20 JKBD CCOC(=O)c1c(-c2ccc(OC)c(OC)c2)csc1NC(=O)c1cc([N+](=O)[O-])ccc1Cl 863982392 HVZKSIQNWNXBGG-UHFFFAOYSA-N 490.921 5.423 5 20 JKBD O=C(Nc1ccc(-n2ccnc2)nc1)c1cc([N+](=O)[O-])ccc1Sc1ccc(Cl)cc1 914451979 BSJAHHSKNREXEM-UHFFFAOYSA-N 451.895 5.232 5 20 JKBD O=C(Nc1ccc(OC[C@H](O)CO[C@@H]2CCCc3ccccc32)cc1)c1cc([N+](=O)[O-])ccc1Cl 914794873 CSBMNWOMRYCNQX-NBGIEHNGSA-N 496.947 5.334 5 20 JKBD Cc1ccc(-n2ncc(C(=O)O[C@H](C)c3nnc(-c4ccc([N+](=O)[O-])cc4)o3)c2C(C)C)cc1 914977548 ZFSYPDQAVQHZRS-MRXNPFEDSA-N 461.478 5.180 5 20 JKBD COc1ccc(Oc2ccc([N+](=O)[O-])cc2C(=O)O[C@@H](C)c2nnc(-c3cccs3)o2)cc1 915443004 WHEDAZSZILVBLW-ZDUSSCGKSA-N 467.459 5.425 5 20 JKBD O=C(CCc1nc2ccccc2o1)O[C@@H](C(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1)c1ccccc1 917234221 ZQRSEUAWGLPQEF-HSZRJFAPSA-N 479.876 5.245 5 20 JKBD O=[N+]([O-])c1ccc(OC(F)F)c([C@@H]2NC(=S)NC(c3cccs3)=C2c2nc3ccccc3[nH]2)c1 920847003 AOZHGHFFQOVNEL-SFHVURJKSA-N 499.524 5.221 5 20 JKBD O=C(CCC1CCC1)Nc1ccc(C2(NC(=O)Cn3ccc4ccc([N+](=O)[O-])cc43)CCC2)cc1 1786259725 WNQOHVHPSFPPEZ-UHFFFAOYSA-N 474.561 5.264 5 20 JKBD CC(F)(F)C(C)(C)C(=O)Nc1ccc(C2(NC(=O)Cc3cc([N+](=O)[O-])ccc3F)CCC2)cc1 1786452279 FFNCAIBWTKBTFA-UHFFFAOYSA-N 477.483 5.092 5 20 JKBD Cc1ccc(C(=O)Nc2ccc(C3(NC(=O)C4(c5cccc([N+](=O)[O-])c5)CCC4)CCC3)cc2)cn1 1787300112 AJEKBSAMQSROLB-UHFFFAOYSA-N 484.556 5.168 5 20 JKBD O=Cc1ccc(C(=O)Nc2ccc(C3(NC(=O)Cc4ccc(Cl)cc4[N+](=O)[O-])CCC3)cc2)s1 1788150401 WIXRVUWZVWIRRC-UHFFFAOYSA-N 497.960 5.113 5 20 JKBD COc1cc(CC(=O)Nc2ccc(C3(NC(=O)C[C@H]4C[C@@H]5CC[C@H]4C5)CCC3)cc2)ccc1[N+](=O)[O-] 1790479503 OIYLQUQJFLDEDI-HLAWJBBLSA-N 491.588 5.106 5 20 JKBD CC[C@H](C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cccc(F)c2[N+](=O)[O-])CC1)c1ccccc1 1826316431 GGEIKNFUDCLSAI-URXFXBBRSA-N 481.568 5.161 5 20 JKBD Cc1ccc(CC(=O)N2CCCC[C@H]2C2CCN(C(=O)c3ccc4occc4c3)CC2)cc1[N+](=O)[O-] 1830367517 YLBBTQJXAQSPGC-DEOSSOPVSA-N 489.572 5.125 5 20 JKBD Cc1ccc([C@@H](C)C(=O)N2CCC([C@@H]3CCCCN3C(=O)c3cccc(F)c3[N+](=O)[O-])CC2)cc1 1830623633 XGJLPVOYPGWXJW-DVECYGJZSA-N 481.568 5.079 5 20 JKBD CCN1C/C(=C/c2ccc(-c3ccccc3[N+](=O)[O-])o2)c2nc3ccccc3c(C(=O)O)c2C1 13299654 JRQFHCDGMWXQSQ-SSZFMOIBSA-N 455.470 5.477 5 20 JKBD CC(=O)Nc1cccc(NC(=O)C/C(=C/c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)c1 14492019 YMPDEHBYYNYWDG-AQTBWJFISA-N 472.526 5.732 5 20 JKBD O=C(Nc1ccccc1C(=O)NCCSc1ccccc1)c1ccc([N+](=O)[O-])cc1Cl 15372889 QQSHYXFRLBTONB-UHFFFAOYSA-N 455.923 5.023 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Cl)[C@@H](Nc1cccc(N2CCCC2=O)c1)c1ccccc1 15506837 OEUBVYJZCJRCES-QHCPKHFHSA-N 464.909 5.167 5 20 JKBD O=[N+]([O-])c1cccc(N(Cc2ncc(-c3ccc(F)cc3)o2)S(=O)(=O)c2ccc(F)c(F)c2)c1 15555388 XKTOAMRIGDYOMB-UHFFFAOYSA-N 489.431 5.063 5 20 JKBD COc1ccc(NC(=O)CCSc2nnc(-c3ccc(F)cc3)n2-c2ccccc2)c([N+](=O)[O-])c1 26368882 QHYBHZDSUAEZHK-UHFFFAOYSA-N 493.520 5.111 5 20 JKBD CCn1c(SCCC(=O)Nc2cc([N+](=O)[O-])ccc2OC)nnc1-c1ccc(C(C)(C)C)cc1 26371479 XRNTXWODCIJZQI-UHFFFAOYSA-N 483.594 5.300 5 20 JKBD Cc1csc(Sc2ccc(C(=O)N(C)Cc3ccc(OC(F)F)cc3)cc2[N+](=O)[O-])n1 27597430 PBWNOQGIEZEPOA-UHFFFAOYSA-N 465.503 5.385 5 20 JKBD C[C@H](Nc1ccc(OCc2ccccn2)c(Cl)c1)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl 109355296 KAXCIIGYNHYIQG-ZDUSSCGKSA-N 461.305 5.315 5 20 JKBD CC(C)c1c(C(=O)Nc2cc(-c3cccc([N+](=O)[O-])c3)n[nH]2)cnn1-c1cccc(Cl)c1 303200875 HMICATIVRLNCSJ-UHFFFAOYSA-N 450.886 5.200 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)Nc2sc3c(c2C(=O)OC(C)C)CC[C@H](C)C3)cc1SC 482868434 LWNQZYFAVWKPJT-LBPRGKRZSA-N 478.592 5.329 5 20 JKBD CC(=O)Nc1ccc(C)c(NC(=O)c2cc([N+](=O)[O-])ccc2Sc2ccc(Cl)cc2)c1 486071632 HMEKFVYWVJJXRX-UHFFFAOYSA-N 455.923 5.919 5 20 JKBD C[C@H](Nc1ccc(C(=O)N[C@@H]2C[C@H]2c2ccccc2C(F)(F)F)cc1[N+](=O)[O-])c1ccccn1 505564226 DDFIQUALOYVRPR-XXHMAFKTSA-N 470.451 5.468 5 20 JKBD Cc1ccc(Sc2ccc(CNC3CCN(C(=O)c4ccccc4F)CC3)cc2[N+](=O)[O-])cc1 509583843 DZMRYRHBZMBSHC-UHFFFAOYSA-N 479.577 5.588 5 20 JKBD COc1cc(C(=O)Nc2cc(C(C)(C)C)nn2C(C)(C)C)c([N+](=O)[O-])cc1OCc1cscn1 516240970 VERNYGSSCJVOBL-UHFFFAOYSA-N 487.582 5.140 5 20 JKBD CC(=O)N(c1ccc(F)cc1)c1nc(COc2ccc(-c3ccccc3)cc2[N+](=O)[O-])cs1 517912471 MMIDERZJMVTAMG-UHFFFAOYSA-N 463.490 6.121 5 20 JKBD Cc1nn(Cc2ccccc2)c(C)c1CNCc1ccc(Oc2ccc(F)cc2)c([N+](=O)[O-])c1 518271611 CJZACKTYZLLLGX-UHFFFAOYSA-N 460.509 5.678 5 20 JKBD COc1ccc(-c2cnc(CCC(=O)Nc3ccc([N+](=O)[O-])cc3C(=O)c3ccccc3)o2)cc1 520081271 PCKFTAJQGWOKIU-UHFFFAOYSA-N 471.469 5.061 5 20 JKBD CCOc1cc(NC(=O)N2CCCC[C@H]2c2cc3ccccc3[nH]2)c([N+](=O)[O-])cc1OCC 521253492 CCOVWRDFDTUALG-FQEVSTJZSA-N 452.511 5.633 5 20 JKBD O=C(Nc1cccc(C(=O)Nc2ccc([N+](=O)[O-])cc2F)c1)c1cccc(Br)c1 524228977 AUOVIMSHOSTXNG-UHFFFAOYSA-N 458.243 5.001 5 20 JKBD O=C(Nc1ccccc1)Nc1ccc(NC(=O)C2CCN(c3ccccc3[N+](=O)[O-])CC2)cc1 591275054 FVEILRLFPRYTLZ-UHFFFAOYSA-N 459.506 5.094 5 20 JKBD CCOc1ccc([C@@H](CNC(=O)c2csc([N+](=O)[O-])c2)c2c[nH]c3ccccc23)cc1OC 603752252 DFRWWMSJJZWVBC-GOSISDBHSA-N 465.531 5.107 5 20 JKBD Cc1cc(NC(=O)c2ccc(F)cc2Cl)sc1C(=O)Nc1cc([N+](=O)[O-])ccc1OC(F)F 603961513 ZPRTXOFARFOJEH-UHFFFAOYSA-N 499.854 5.863 5 20 JKBD CCN(C[C@H]1CCOC1)C(=O)c1c2c(nc3ccccc13)/C(=C\c1cccc([N+](=O)[O-])c1)CCC2 604431432 HNUJIWWXSBCFHZ-YLCCHKQJSA-N 471.557 5.519 5 20 JKBD COc1cc(C(=O)N[C@H](c2cccc(C(F)(F)F)c2)C(C)C)c([N+](=O)[O-])cc1OC(F)F 608810262 GQKHTFFZAJSWHK-KRWDZBQOSA-N 462.371 5.351 5 20 JKBD COc1cc(C(=O)N2C[C@H](c3ccccc3)OC[C@@H]2C)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 608966340 IXMKDHFJUQAVDD-UPCLLVRISA-N 482.920 5.651 5 20 JKBD Cc1cc(O[C@H](C)c2ccccc2)ccc1NC(=O)N1CCN(C(=O)c2ccc([N+](=O)[O-])s2)CC1 609080066 AQJQKIZNIVUCRD-GOSISDBHSA-N 494.573 5.095 5 20 JKBD COc1ccc(-c2nc(CSCc3cc(OC)c(OC(F)F)cc3[N+](=O)[O-])co2)cc1 609236361 SVMWOFYSRXVVTI-UHFFFAOYSA-N 452.435 5.302 5 20 JKBD COc1cc(-c2noc(COc3ccc([N+](=O)[O-])cc3-c3cccs3)n2)ccc1OC(F)F 611192029 JJAUDVQGSUVTMA-UHFFFAOYSA-N 475.429 5.562 5 20 JKBD O=C(CSc1ccccc1C(=O)Nc1ccc([N+](=O)[O-])c(Cl)c1)Nc1ccc(F)cc1 727712102 QDMZILIFBPAIAH-UHFFFAOYSA-N 459.886 5.370 5 20 JKBD O=C1/C(=C/c2ccccc2)N=C(SCc2c(F)cccc2[N+](=O)[O-])N1c1ccc(F)cc1 728787496 TUIFLCSAVVOQGR-MOSHPQCFSA-N 451.454 5.550 5 20 JKBD Cc1ccc(-c2nc(C)sc2CC(=O)O[C@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)cc1 763720207 BLFZDPQMUAGQJG-CQSZACIVSA-N 464.503 5.232 5 20 JKBD Cc1cc(C)c(/C=C\C(=O)O[C@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2C(F)(F)F)cc1C 915494198 ZVQZAYNGQZYNCM-GTBONMDNSA-N 450.413 5.122 5 20 JKBD Cc1cc(NC(=O)c2ccccc2Cl)sc1C(=O)OCc1cc([N+](=O)[O-])cc2c1OCOC2 915580548 PICNJOBPOYTIBB-UHFFFAOYSA-N 488.905 5.094 5 20 JKBD CCCc1cc[n+](/C(C(=S)Nc2cccc(C(C)C)c2)=C(/O)c2cccc([N+](=O)[O-])c2)cc1 917615862 RVJSANGVCXGZHZ-UHFFFAOYSA-O 462.595 6.282 5 20 JKBD O=C(Nc1ccccc1SC[C@@H]1CC1(Cl)Cl)c1ccc(-n2ccnc2)c([N+](=O)[O-])c1 917750201 PSVWIXWKDXRHMR-AWEZNQCLSA-N 463.346 5.319 5 20 JKBD O=C(/C=C/c1ccc([N+](=O)[O-])o1)Nc1ccc(C2(NC(=O)[C@@H]3CCc4ccccc43)CCC2)cc1 1786208286 XBVQLKORRPGZEN-RBNVVWFDSA-N 471.513 5.065 5 20 JKBD O=C(/C=C/c1ccc([N+](=O)[O-])o1)NC1(c2ccc(NC(=O)c3ccc(Cl)s3)cc2)CCC1 1787325658 ANFQJXWMDRAZMP-UXBLZVDNSA-N 471.922 5.364 5 20 JKBD Cc1cc(C(=O)Nc2ccc(C3(NC(=O)CCc4c[nH]c5ccccc45)CCC3)cc2)ncc1[N+](=O)[O-] 1788766489 VWBDATNUULODGH-UHFFFAOYSA-N 497.555 5.160 5 20 JKBD COc1ccc(C(=O)Nc2ccc(C3(NC(=O)Cn4ccc5ccc([N+](=O)[O-])cc54)CCC3)cc2)cc1 1790299693 PJTLJSYRNSYSAJ-UHFFFAOYSA-N 498.539 5.006 5 20 JKBD O=C(Nc1cc([C@H]2CCCCN2C(=O)/C=C/c2ccccc2[N+](=O)[O-])[nH]n1)c1ccc2ccoc2c1 1821461492 KDNJOHPJQKNFAM-NELJVSICSA-N 485.500 5.083 5 20 JKBD O=C(/C=C/c1ccccc1[N+](=O)[O-])Nc1cc([C@H]2CCCCN2C(=O)c2ccc(Cl)cc2F)[nH]n1 1823501843 WUUIZICIRDWBDO-OGECGYFKSA-N 497.914 5.130 5 20 JKBD Cc1ccc(C(=O)N2CCC([C@H]3CCCCN3C(=O)CCc3cccc([N+](=O)[O-])c3)CC2)c(F)c1F 1824843102 OCEMYIONWFFNNF-HSZRJFAPSA-N 499.558 5.048 5 20 JKBD CCC(C)(C)C(=O)N1CCC([C@H]2CCCCN2C(=O)c2ccc(Br)c([N+](=O)[O-])c2)CC1 1830522269 BFULRINZBDQLLI-LJQANCHMSA-N 494.430 5.027 5 20 JKBD Cc1ccc(CCC(=O)N2CCC([C@@H]3CCCCN3C(=O)c3cc(F)cc([N+](=O)[O-])c3)CC2)cc1F 1830612684 HZBVYUXOJOJNEG-VWLOTQADSA-N 499.558 5.048 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)N1CCCC[C@@H]1C1CCN(C(=O)CCc2ccccc2F)CC1 1830728484 DITQHXCHBBTMRD-XMMPIXPASA-N 499.558 5.048 5 20 JKBD O=C(c1cccc2cccnc12)N1CCC([C@@H]2CCCCN2C(=O)/C=C/c2ccccc2[N+](=O)[O-])CC1 1832907524 XBBCLQAOZOUHBV-AAJFVQQISA-N 498.583 5.090 5 20 JKBD C[C@@H](Sc1nnc(-c2ccccc2Cl)n1C1CCCC1)C(=O)Nc1cccc([N+](=O)[O-])c1 8988486 DHGINEVYZMWQTL-CQSZACIVSA-N 471.970 5.741 5 20 JKBD O=C(COC(=O)[C@H](Sc1ccccc1)c1ccccc1)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 10589807 FFTMRWPQOSBIGK-OAQYLSRUSA-N 490.459 5.629 5 20 JKBD C[C@](CC(=O)Nc1cc(Cl)c([N+](=O)[O-])cc1OCc1ccccc1)(C(=O)O)c1ccccc1 13467807 MSCRGUBNXXPMAM-XMMPIXPASA-N 468.893 5.198 5 20 JKBD CC(C)N(Cc1nnc(-c2cccc([N+](=O)[O-])c2)o1)C(=O)COc1ccccc1Cc1ccccc1 16014899 BCUOWSNGDGHOAY-UHFFFAOYSA-N 486.528 5.052 5 20 JKBD Cc1nc(-c2cccs2)sc1C(=O)O[C@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 17831170 YPCBKEJIENJCBY-SNVBAGLBSA-N 485.465 5.291 5 20 JKBD C[C@@H](OC(=O)c1ccc(Br)c([N+](=O)[O-])c1)C(=O)Nc1ccccc1-c1ccccc1 22833652 WIEZOZNBHMPZBM-CQSZACIVSA-N 469.291 5.208 5 20 JKBD Cc1nn(Cc2ccccc2)c2sc(C(=O)Nc3cc([N+](=O)[O-])ccc3OC(F)F)cc12 195574275 UIXWKHLZBSOPOF-UHFFFAOYSA-N 458.446 5.216 5 20 JKBD O=C(Nc1ccc(Cl)cc1)c1nnc(/C(Cl)=C\c2ccc(Cl)c([N+](=O)[O-])c2)s1 209131524 PRASBLDOKDLNQH-NTUHNPAUSA-N 455.710 5.742 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)Nc2ccc(Cl)c(-c3nnc4n3CCCCC4)c2)cc1SC 482437791 PKRBUACHPUSWGX-UHFFFAOYSA-N 487.969 5.216 5 20 JKBD Cc1ccc(-c2csc(NC(=O)c3nnn(-c4ccc(F)cc4)c3C(F)(F)F)n2)cc1[N+](=O)[O-] 498308545 CMODPYRNWLIHOC-UHFFFAOYSA-N 492.414 5.018 5 20 JKBD O=C(Nc1ccc(CC(=O)N2CCc3ccccc32)cc1)c1cc2cc([N+](=O)[O-])ccc2s1 501749621 UIMYBHBDEOEWFM-UHFFFAOYSA-N 457.511 5.194 5 20 JKBD O=C(c1csc(-c2cccc([N+](=O)[O-])c2)n1)N1CCCC[C@@H]1c1nc(-c2ccccc2)no1 505312584 AHYWMFLDRDTKJR-LJQANCHMSA-N 461.503 5.136 5 20 JKBD Cn1cc(C(=O)Nc2nc(-c3ccc4ccccc4c3)cs2)c(-c2ccc([N+](=O)[O-])cc2)n1 506215501 BMFFDNMSQVUPOZ-UHFFFAOYSA-N 455.499 5.524 5 20 JKBD C[C@H](Nc1ccc(C(=O)N(C)Cc2cc(Br)cs2)cc1[N+](=O)[O-])c1ccccn1 507337523 CULKHXCFAGAZLD-ZDUSSCGKSA-N 475.368 5.259 5 20 JKBD C[C@H](Nc1cccc(NC(=O)c2cccc(C(F)(F)F)c2)c1)C(=O)Nc1ccccc1[N+](=O)[O-] 507538983 SJHPOGDXGSNRDS-AWEZNQCLSA-N 472.423 5.305 5 20 JKBD C[C@H](Nc1ccc(C(=O)Nc2ccc(C(=O)NCc3ccccc3)cc2)cc1[N+](=O)[O-])c1ccccn1 509092012 BVZFVJDTSSSPIY-IBGZPJMESA-N 495.539 5.345 5 20 JKBD COc1cc(C(=O)N(C)[C@H](C)c2cccc(C(F)(F)F)c2)c([N+](=O)[O-])cc1OCc1cscn1 512404819 VFVXEMJQEXHYIW-CYBMUJFWSA-N 495.479 5.491 5 20 JKBD C[C@@H](Cc1ccsc1)NC(=O)C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1 516538415 PHSSWCYUZZPLQX-UEIJICEPSA-N 463.584 5.944 5 20 JKBD CN(C)C[C@H]1CCCCN1C(=O)C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1 517861744 LHQXEMGGDNYUPN-JENJNIGESA-N 464.591 5.078 5 20 JKBD CC(C)c1cc(NC(=O)c2ccc(NCc3ccccc3Cl)c([N+](=O)[O-])c2)n(-c2ncccn2)n1 520874551 GKKUOJJAWPYYAV-UHFFFAOYSA-N 491.939 5.212 5 20 JKBD COc1cc(C(=O)NCc2noc(-c3cccs3)n2)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 553935770 NCLKGJJYKNTCTK-UHFFFAOYSA-N 486.893 5.091 5 20 JKBD CC(=O)Nc1cccc2c1CCN(C(=O)c1ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])cc1)C2 604258420 SMTLQTXFOCFYDO-UHFFFAOYSA-N 465.893 5.197 5 20 JKBD Cc1cccc(C(=O)Nc2nc3ccccc3n2Cc2cccc(C(F)(F)F)c2)c1[N+](=O)[O-] 609062813 HVHXJGSSBVADKJ-UHFFFAOYSA-N 454.408 5.572 5 20 JKBD COCCN(C(=O)CCc1ccc(C)c(Cl)c1)c1nc(-c2ccc([N+](=O)[O-])cc2)cs1 619130673 DMWNFWOTKQDVSU-UHFFFAOYSA-N 459.955 5.292 5 20 JKBD O=C(NCc1cn(-c2ccccc2)nc1-c1ccc(F)cc1)c1cc(Cl)ccc1[N+](=O)[O-] 728208771 SHPKWRRJMMWSDX-UHFFFAOYSA-N 450.857 5.170 5 20 JKBD CC(=O)N(c1cccc(Cl)c1)c1nc(COC(=O)Cn2ccc3cc([N+](=O)[O-])ccc32)cs1 744616157 LVMRQYMWQLJJDH-UHFFFAOYSA-N 484.921 5.087 5 20 JKBD CCCCSc1ccc([N+](=O)[O-])cc1C(=O)N1CC2(CCOCC2)[C@@H]1c1cnn(CC(C)C)c1 849538717 MRUYMHLBQJRZTE-QHCPKHFHSA-N 486.638 5.333 5 20 JKBD C[C@@H](OC(=O)c1ccc(Br)c([N+](=O)[O-])c1)C(=O)N1c2ccccc2Sc2ccccc21 853789224 NTSBPUPCMYOAAI-CYBMUJFWSA-N 499.342 5.732 5 20 JKBD COc1cc(CCNC(=O)c2ccsc2NC(=O)c2ccc(C(C)C)cc2)c([N+](=O)[O-])cc1OC 918218952 ZCTUKWUKJLHWQB-UHFFFAOYSA-N 497.573 5.022 5 20 JKBD O=C(Cc1cccc([N+](=O)[O-])c1)Nc1ccc(C2(NC(=O)C3CCC(F)(F)CC3)CCC2)cc1 1785792630 ZOEMWNVMEYJOCT-UHFFFAOYSA-N 471.504 5.097 5 20 JKBD O=C(/C=C/c1ccc([N+](=O)[O-])o1)Nc1ccc(C2(NC(=O)COc3cccc(Cl)c3)CCC2)cc1 1786205571 HRMBRUDKPWACFZ-PKNBQFBNSA-N 495.919 5.068 5 20 JKBD O=C(CSC1CCCC1)Nc1ccc(C2(NC(=O)c3cccc(F)c3[N+](=O)[O-])CCC2)cc1 1786348574 UAQIBEQFILHTPR-UHFFFAOYSA-N 471.554 5.157 5 20 JKBD O=C(CCc1cccc([N+](=O)[O-])c1)Nc1ccc(C2(NC(=O)c3ccc4c(c3)COC4)CCC2)cc1 1786599838 BEIACQPTBGFSPI-UHFFFAOYSA-N 485.540 5.006 5 20 JKBD Cc1cc(C(=O)Nc2ccc(C3(NC(=O)C4(c5cccc([N+](=O)[O-])c5)CCC4)CCC3)cc2)c[nH]1 1788815775 QMPSYCWSBUYWHL-UHFFFAOYSA-N 472.545 5.101 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)c3cc4cc([N+](=O)[O-])ccc4s3)CCC2)cc1)c1cc(F)c[nH]1 1791473803 FPUSPTUTJJWKEU-UHFFFAOYSA-N 478.505 5.338 5 20 JKBD O=C(CSc1ccccc1[N+](=O)[O-])Nc1ccc(C2(NC(=O)c3ccncc3Cl)CCC2)cc1 1791522371 MFDKPLBPPAWLQS-UHFFFAOYSA-N 496.976 5.183 5 20 JKBD O=C(/C=C/c1ccccc1[N+](=O)[O-])Nc1ccc(C2(NC(=O)c3ccc(Cl)o3)CCC2)cc1 1792317698 GSJQWOZUDYVBTM-AWNIVKPZSA-N 465.893 5.302 5 20 JKBD O=C(CCCc1ccccc1F)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc2cc([N+](=O)[O-])ccc2s1 1801206160 RMGDIZJXLUZVLT-ACDBMABISA-N 495.576 5.223 5 20 JKBD CC(C)c1ccc(C(=O)N2CC[C@@H](CNC(=O)/C=C/c3ccccc3[N+](=O)[O-])[C@@H]2c2cccnc2)cc1 1814194139 LNNSALBZMVBJOX-OXXBRZMLSA-N 498.583 5.146 5 20 JKBD C[C@H](Sc1ccccc1)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cc(F)cc([N+](=O)[O-])c2)CC1 1824393153 YCCVTUDQXQCJGR-MHECFPHRSA-N 499.608 5.148 5 20 JKBD O=C(c1ccc(O)c([N+](=O)[O-])c1)N1CCC([C@H]2CCCCN2C(=O)c2cccc3ccccc23)CC1 1828009982 SBEOLZSUVDZBOT-XMMPIXPASA-N 487.556 5.001 5 20 JKBD CC(C)c1ccc(C(=O)N2CCCC[C@H]2C2CCN(C(=O)Cc3cccc([N+](=O)[O-])c3)CC2)cc1 1830055330 SNBIPGRQJFORLV-SANMLTNESA-N 477.605 5.194 5 20 JKBD Cc1cc(C(=O)N2CCC([C@@H]3CCCCN3C(=O)CC3CCC(C)(C)CC3)CC2)ncc1[N+](=O)[O-] 1830421485 LDWQPDFJDPEOGM-QHCPKHFHSA-N 484.641 5.138 5 20 JKBD O=C(Cn1c2ccccc2c(=O)c2ccccc21)Nc1ccc(-c2nnc3n2CCCCCC3)cc1 14729771 UGQNRAXEKSOMPE-UHFFFAOYSA-N 477.568 5.168 5 20 JKBD Cc1cc(C)cc(-c2nnc(S[C@@H](C)C(=O)Nc3ccc([N+](=O)[O-])cc3C(F)(F)F)o2)c1 22237317 ZDLUPXJLLIWXOZ-LBPRGKRZSA-N 466.441 5.400 5 20 JKBD COCc1cccc(C(=O)O[C@@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Br)c2ccccc2)c1 26165774 ACXYITZWGJWWEM-OAQYLSRUSA-N 499.317 5.041 5 20 JKBD O=C(Nc1ccccc1C(=O)NCc1ccc(F)cc1C(F)(F)F)c1ccc([N+](=O)[O-])cc1Cl 72009638 IZMWMCXCLCVCDW-UHFFFAOYSA-N 495.816 5.588 5 20 JKBD O=C(c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1)N1CCCN(c2ccccc2)CC1 195710315 QBEAKZWYGJWOFT-UHFFFAOYSA-N 451.910 5.393 5 20 JKBD CN(Cc1cccc(C(F)(F)F)c1)C1CCN(C(=O)c2cc3ccccc3c3cccnc23)CC1 195723417 ZGYVUNAPTITRBE-UHFFFAOYSA-N 477.530 6.143 5 20 JKBD O=C(Nc1cccc(NC(=O)c2cc([N+](=O)[O-])ccc2Sc2ccccc2)c1)c1ccoc1 499615142 KJWLBWGGOUEGBJ-UHFFFAOYSA-N 459.483 5.844 5 20 JKBD COc1ccc([C@@H]2CCCN2C(=O)c2ccc(N[C@@H](C)c3ccccn3)c([N+](=O)[O-])c2)c(OC)c1 506069044 DIYIVHPVCQCAFZ-SBUREZEXSA-N 476.533 5.157 5 20 JKBD COc1cc([C@@H](C)NC(=O)c2ccc(N[C@H](C)c3ccccn3)c([N+](=O)[O-])c2)ccc1OC(C)C 506249147 RJOYMHOVZMDDND-QZTJIDSGSA-N 478.549 5.450 5 20 JKBD CN(CCC(F)(F)F)C(=O)c1c2c(nc3ccccc13)/C(=C\c1cccc([N+](=O)[O-])c1)CCC2 511377600 KOBMUODWFXDKEP-VKAVYKQESA-N 469.463 6.044 5 20 JKBD C[C@@H](Nc1ccc(C(=O)N2CC=C(c3c[nH]c4ccccc34)CC2)cc1[N+](=O)[O-])c1ccccn1 518424262 MYDXIPLQZDIJGW-GOSISDBHSA-N 467.529 5.574 5 20 JKBD COc1cc(OCC(=O)C(c2nc3ccccc3s2)c2nc3ccccc3s2)ccc1[N+](=O)[O-] 520006713 JDEYXGWZCYCFQK-UHFFFAOYSA-N 491.550 5.603 5 20 JKBD COc1ccc(Cl)c(NC(=O)C/C(=C\c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)c1 520414708 LUYPKZNGTOPHFH-FOWTUZBSSA-N 479.945 6.436 5 20 JKBD Cc1cc(Sc2ccccc2)ccc1NC(=O)[C@@H]1CCCN1C(=O)c1ccc([N+](=O)[O-])c(C)c1 523272627 YVVNNFFIJUMAKB-DEOSSOPVSA-N 475.570 5.606 5 20 JKBD CCOc1cc(NC(=O)c2cc(-c3ccccc3)nc3onc(C)c23)c([N+](=O)[O-])cc1OCC 590851842 DSNWFAPUYMSLGT-UHFFFAOYSA-N 462.462 5.156 5 20 JKBD Cc1csc(CCNC(=O)c2ccccc2Sc2ccc(C(F)(F)F)cc2[N+](=O)[O-])n1 603558618 BQACFPYZUCCNGU-UHFFFAOYSA-N 467.494 5.502 5 20 JKBD CCCOc1cc(NC(=O)N2CCC(C(=O)c3ccccc3)CC2)c([N+](=O)[O-])cc1OCCC 603652453 BTXLHCAOMNYZBD-UHFFFAOYSA-N 469.538 5.299 5 20 JKBD O=C(c1cc(NC2C[C@@H](C(F)(F)F)C[C@H](C(F)(F)F)C2)ccc1[N+](=O)[O-])N1CCCC1 603943524 MXJICEHWGUAMSW-RYUDHWBXSA-N 453.383 5.152 5 20 JKBD COc1cc(C(=O)N2CCC(OCC(C)C)CC2)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 604013480 NPKKWKLBNHOUKQ-UHFFFAOYSA-N 462.930 5.326 5 20 JKBD CC(C)n1ncc2c(C(=O)Nc3ccnn3-c3ccc([N+](=O)[O-])cc3)cc(-c3ccccc3)nc21 609151643 KOEBZXQIMLFBOW-UHFFFAOYSA-N 467.489 5.025 5 20 JKBD C[C@H](OC(=O)c1csc(-c2cccc(C(F)(F)F)c2)n1)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl 725997726 QGCQGYKBJUUITP-JTQLQIEISA-N 499.854 5.575 5 20 JKBD O=C(c1ccc(C2SCCS2)cc1)N1CCN(c2ccc([N+](=O)[O-])cc2C(F)(F)F)CC1 727329617 LIQOZLDWKXVXJN-UHFFFAOYSA-N 483.537 5.055 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)O[C@H](C(=O)Nc2cc(Cl)ccc2Cl)C(C)C)cc1SC 728649848 SDKJYMLWWPOKBV-SFHVURJKSA-N 487.361 5.452 5 20 JKBD O=C(CC1(CC(=O)Nc2cc([N+](=O)[O-])ccc2F)CCCCC1)Nc1cc([N+](=O)[O-])ccc1F 729824944 GTZFULVNMLCXQA-UHFFFAOYSA-N 476.436 5.089 5 20 JKBD Cc1ccc(-c2ncc(C(=O)O[C@@H](C)c3nnc(-c4ccc([N+](=O)[O-])cc4)o3)s2)c(C)c1 747262684 FQICUQVIOQZABP-AWEZNQCLSA-N 450.476 5.303 5 20 JKBD O=C(COC(=O)C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)NC1CCCCC1 748579205 KEDOBDGRIOTOEK-NBVRZTHBSA-N 479.558 5.127 5 20 JKBD Cc1ccccc1NC(=O)COC(=O)C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1 748579229 KYUBGNABKQLJQA-XMHGGMMESA-N 487.537 5.626 5 20 JKBD CCOc1ccc(-c2nc(NC(=O)c3cc([N+](=O)[O-])c(C)c([N+](=O)[O-])c3C)sc2C)cc1 748604171 CMZPTFUHIWBVOA-UHFFFAOYSA-N 456.480 5.203 5 20 JKBD CC(C)Cn1cc([C@@H]2N(c3ccc(C(=O)c4ccccc4)cc3[N+](=O)[O-])CC23CCOCC3)cn1 849477782 ATQXWYWNWZWLLM-SANMLTNESA-N 474.561 5.036 5 20 JKBD CC(=O)N(c1ccc(F)cc1)c1nc(/C=C2/C(=O)Nc3cc(Cl)c([N+](=O)[O-])cc32)cs1 917560747 YIIUKEJLDKVICN-GIDUJCDVSA-N 458.858 5.021 5 20 JKBD CC(C)CCSc1ccc(C(=O)N2CCC[C@H](CNC(=O)OC(C)(C)C)C2)cc1[N+](=O)[O-] 920473799 HEFXTCINLFNWMR-QGZVFWFLSA-N 465.616 5.110 5 20 JKBD CC(C)(C)c1ncc(C(=O)O[C@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2ccccc2)s1 920692210 OSPBODYBRWTWPO-SFHVURJKSA-N 473.938 5.539 5 20 JKBD CCSc1cccnc1C(=O)Nc1ccc(C2(NC(=O)c3cccc(F)c3[N+](=O)[O-])CCC2)cc1 1790210225 JORPGBJCFYKKDB-UHFFFAOYSA-N 494.548 5.302 5 20 JKBD CC(C)=CCCC(=O)Nc1ccc(C2(NC(=O)c3cc(N(C)C)ccc3[N+](=O)[O-])CCC2)cc1 1790451694 GAJLWOIVOSMFQI-UHFFFAOYSA-N 464.566 5.155 5 20 JKBD CC1=CC[C@H](C(=O)NC2(c3ccc(NC(=O)c4cccc(F)c4[N+](=O)[O-])cc3)CCC2)CC1 1790701648 ZWPXCSTZFQKHMZ-KRWDZBQOSA-N 451.498 5.228 5 20 JKBD C[C@@H](C(=O)Nc1ccc(C2(NC(=O)CSc3ccccc3[N+](=O)[O-])CCC2)cc1)c1ccccn1 1791943497 FTNGIGUTQCCZJT-GOSISDBHSA-N 490.585 5.020 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)Nc1cc([C@H]2CCCCN2C(=O)C23CCC(CC2)CC3)[nH]n1 1821285410 DDEOBAXMPHBSMS-RKLYKTOLSA-N 483.544 5.042 5 20 JKBD Cc1ccc(CCC(=O)N2CCC([C@H]3CCCCN3C(=O)c3ccc([N+](=O)[O-])cc3F)CC2)cc1F 1830492423 GBGVQEHLQNOPRB-RUZDIDTESA-N 499.558 5.048 5 20 JKBD O=C(CC1CCCC1)N1CCC(OC2CCN(C(=O)c3cc4cc([N+](=O)[O-])ccc4s3)CC2)CC1 1837610651 VMNMVSDDLLJPJS-UHFFFAOYSA-N 499.633 5.002 5 20 JKBD O=C(c1cc2cc([N+](=O)[O-])ccc2s1)N1CC2(CCCN2C(=O)c2cccnc2-c2ccccc2)C1 1843499345 LFLMFLVNYVQXNA-UHFFFAOYSA-N 498.564 5.002 5 20 JKBD C[C@@H](Sc1nnc(Nc2ccccc2F)s1)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl 10316321 QTRAXHGQMVMYOV-SECBINFHSA-N 453.908 5.102 5 20 JKBD CCN(CC)C(=O)Cc1ccc(N[C@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2ccccc2)cc1 27038966 JKWSFRGTKBOFPQ-VWLOTQADSA-N 494.979 5.451 5 20 JKBD COc1ccc(NC(=O)c2ccccc2NC(=O)c2ccc([N+](=O)[O-])cc2Cl)cc1Cl 29600863 COLLRSDEGPQENN-UHFFFAOYSA-N 460.273 5.415 5 20 JKBD O=C(Nc1cccc(NS(=O)(=O)c2ccccc2)c1)c1cc2ccccc2c2cccnc12 71958338 PLPBRIHXWHZZQX-UHFFFAOYSA-N 453.523 5.441 5 20 JKBD O=C(CCNc1ccc(C(F)(F)F)cc1[N+](=O)[O-])Nc1ccccc1OC[C@@H]1CCCCO1 108914997 XUUYAAOZKICSQO-INIZCTEOSA-N 467.444 5.002 5 20 JKBD O=C(Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1)c1cc(Cl)ccc1I 327863933 PFDFUWCFKXHVPC-UHFFFAOYSA-N 485.690 5.229 5 20 JKBD CCOc1cc2c(cc1[C@@H]1C[C@H]1C(=O)N(Cc1ccccc1[N+](=O)[O-])CC(F)(F)F)O[C@@H](C)C2 409796357 XUBAEKLHUNJKAF-UCLAIMLFSA-N 478.467 5.012 5 20 JKBD Cc1noc(C)c1CCNC(=O)c1c2c(nc3ccccc13)/C(=C\c1cccc([N+](=O)[O-])c1)CCC2 410303762 SKFONUMMUIISMI-HKWRFOASSA-N 482.540 5.597 5 20 JKBD CC(C)Cc1ccc(C(=O)C2CCN(C(=O)[C@@H](C)Sc3ccc([N+](=O)[O-])cc3)CC2)cc1 479857487 PJJCUXCQCWODEU-GOSISDBHSA-N 454.592 5.395 5 20 JKBD Cc1nn(C)c2nc(-c3ccccc3)cc(C(=O)N(Cc3ccccc3[N+](=O)[O-])CC(F)(F)F)c12 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Cc1ccc(Sc2ccc(C(=O)N3CCC(C(=O)N4CCC(C)CC4)CC3)cc2[N+](=O)[O-])cc1 515994229 HOQUNJHQDUGGJQ-UHFFFAOYSA-N 481.618 5.165 5 20 JKBD Cc1cc(CNC(=O)c2c3c(nc4ccccc24)/C(=C\c2ccc([N+](=O)[O-])cc2)CCC3)no1 517906700 LWOXYSOMCKOHQS-JXAWBTAJSA-N 454.486 5.246 5 20 JKBD C[C@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)NCc1cccc(COCc2ccccc2)c1 520387928 VRNPCDFRFSHLRY-KRWDZBQOSA-N 454.910 5.049 5 20 JKBD Cc1ccc(NC(=O)c2cccc(C(F)(F)F)c2)cc1NC(=O)c1cccc([N+](=O)[O-])c1C 520446521 LCKROFIQSVZPSS-UHFFFAOYSA-N 457.408 5.735 5 20 JKBD CC(=O)Nc1ccc(C(F)(F)F)cc1NC(=O)c1ccc(N2CCC[C@H](C)C2)c([N+](=O)[O-])c1 521239301 IRYDCLGSRZDIAT-ZDUSSCGKSA-N 464.444 5.061 5 20 JKBD O=C(N[C@@H](c1ccc(F)cc1)[C@@H]1CCCO1)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 521388186 SILTYUXAFUVNAC-VXKWHMMOSA-N 495.473 5.006 5 20 JKBD COc1cc(C(=O)NCCc2csc(C(C)C)n2)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 522546119 XBOXTWDSUWEWTH-UHFFFAOYSA-N 475.954 5.602 5 20 JKBD CCOc1cc(C(=O)Nc2c(-c3ccc(Cl)cc3)c(C(F)(F)F)nn2C)c([N+](=O)[O-])cc1OC 556326681 KHFYAYDEDRPBLM-UHFFFAOYSA-N 498.845 5.327 5 20 JKBD CC(=O)Nc1cccc([C@@H](C)N(Cc2ccccc2)C(=O)CCNc2ccccc2[N+](=O)[O-])c1 591757331 OCAFRSAZDBEJQY-LJQANCHMSA-N 460.534 5.145 5 20 JKBD O=C(CSc1ccc(C(F)(F)F)cc1[N+](=O)[O-])N(C[C@@H]1CCCO1)c1nc2ccccc2s1 602760075 WXZVIYCPXKLVOS-AWEZNQCLSA-N 497.520 5.528 5 20 JKBD O=C(Nc1nnc(SCc2c(Cl)cccc2Cl)s1)c1ccc(Cl)cc1[N+](=O)[O-] 603440988 YCVOLEPZNRMXPS-UHFFFAOYSA-N 475.766 5.951 5 20 JKBD COc1cc([C@@H](C)NC(=O)c2ccc(N3CCCC3)c([N+](=O)[O-])c2)ccc1OC1CCCC1 603904101 IWAWFPYBTWXNJA-QGZVFWFLSA-N 453.539 5.016 5 20 JKBD C[C@@H]1CCN(C(=O)C2CCN(c3ccc(C(F)(F)F)cc3[N+](=O)[O-])CC2)[C@@H]2CCCC[C@H]12 604102554 JGMOPYMWZAWOEI-ATZDWAIDSA-N 453.505 5.257 5 20 JKBD CC[C@@H](NCc1ccc(-c2ccc([N+](=O)[O-])cc2)o1)c1ccccc1OCC(=O)N1CCCC1 608836116 NUMPMHKDLAMFNK-HSZRJFAPSA-N 463.534 5.097 5 20 JKBD COc1cc(C(=O)N(c2cc(C)ccc2C)C(C)C)c([N+](=O)[O-])cc1OCc1cscn1 609100136 OAVIVAKORGEJLW-UHFFFAOYSA-N 455.536 5.311 5 20 JKBD COc1cc(C(=O)OCc2csc(N(C(C)=O)c3cccc(C(F)(F)F)c3)n2)ccc1[N+](=O)[O-] 725944822 DFGMOPAMIXULHQ-UHFFFAOYSA-N 495.435 5.120 5 20 JKBD CCOc1cccc([C@H](C)NC(=O)c2ccccc2NC(=O)c2ccc([N+](=O)[O-])cc2Cl)c1 745123337 KHOOWRMIFKPXCV-HNNXBMFYSA-N 467.909 5.390 5 20 JKBD COc1cc(C(=O)N(C)Cc2cc([N+](=O)[O-])ccc2Cl)cc(OC)c1OCc1ccccc1 758863907 CMCOEANEEXYDBR-UHFFFAOYSA-N 470.909 5.117 5 20 JKBD O=C(Nc1nc2cc(C(F)(F)F)ccc2n1Cc1ccco1)c1ccc(Cl)c([N+](=O)[O-])c1 790904467 BAGWBAVOGQIIAF-UHFFFAOYSA-N 464.787 5.510 5 20 JKBD Cc1ccc(NC(=O)[C@H](OC(=O)/C=C/c2nc3ccccc3s2)c2ccccc2)c([N+](=O)[O-])c1 849190032 VEYJZRGFWOFZSH-XIQMRYHBSA-N 473.510 5.449 5 20 JKBD O=C(c1cc([N+](=O)[O-])ccc1N1CCCCC1)N1CCC(C(O)(c2ccccc2)c2ccccc2)CC1 856830978 XWJGDAWPMNSDOO-UHFFFAOYSA-N 499.611 5.373 5 20 JKBD Cc1sc2ncnc(Sc3ccccc3C(=O)Nc3ccc(F)c([N+](=O)[O-])c3)c2c1C 916667094 PJLBHIPBGVHLNA-UHFFFAOYSA-N 454.508 5.759 5 20 JKBD Cc1nn(-c2ccccc2)c(Cl)c1C(=O)Nc1nc(-c2cccc([N+](=O)[O-])c2)c(C)s1 917790159 AIFZIRICYBZMFN-UHFFFAOYSA-N 453.911 5.427 5 20 JKBD C[C@@H](OC(=O)C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)c1nc(C2CC2)no1 919013578 ZVSDPHDDOJSDED-RFRKOGIWSA-N 476.514 5.700 5 20 JKBD O=C(CC1CCOCC1)Nc1ccc(C2(NC(=O)c3cc4cc([N+](=O)[O-])ccc4s3)CCC2)cc1 1787922492 FUTOOOCLYASVPC-UHFFFAOYSA-N 493.585 5.374 5 20 JKBD COc1ccc(CC(=O)NC2(c3ccc(NC(=O)c4sccc4Cl)cc3)CCC2)c([N+](=O)[O-])c1 1789903353 YOPSTBSHODGHSV-UHFFFAOYSA-N 499.976 5.309 5 20 JKBD C[C@@H](C(=O)Nc1ccc(C2(NC(=O)/C=C/c3ccc([N+](=O)[O-])o3)CCC2)cc1)c1ccccc1 1792309723 JLZGXMVQEGRSJV-QIXNEVBVSA-N 459.502 5.139 5 20 JKBD Cc1cc(CCCC(=O)N2CCCC3(CCN(C(=O)CCC4CCC4)CC3)C2)c([N+](=O)[O-])cc1F 1805820767 JHKNPPQWRGUOBJ-UHFFFAOYSA-N 487.616 5.177 5 20 JKBD CC1(C)CCC(CC(=O)N2CCC3(CCCN(C(=O)CCc4cccc([N+](=O)[O-])c4)C3)CC2)CC1 1806492814 IUAHCLXBHKNBMC-UHFFFAOYSA-N 483.653 5.365 5 20 JKBD O=C(Nc1cc([C@@H]2CCCCN2C(=O)Cc2cccc([N+](=O)[O-])c2)[nH]n1)c1cc2sccc2s1 1819026756 UNONQNNBMOGKST-KRWDZBQOSA-N 495.586 5.143 5 20 JKBD Cc1c(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)c3ccoc3Cl)n[nH]2)cc(Cl)cc1[N+](=O)[O-] 1820395183 STEQTIHQQGOYJR-MRXNPFEDSA-N 492.319 5.146 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)N1CCCC[C@H]1c1cc(NC(=O)C[C@H](C)c2ccccc2)n[nH]1 1822045941 QTIMNLBEFWJCPM-AOMKIAJQSA-N 493.539 5.265 5 20 JKBD C[C@H](CC(=O)N1CCC([C@@H]2CCCCN2C(=O)CCc2cccc([N+](=O)[O-])c2)CC1)c1ccccc1 1824843643 QXPMTNBNQBDQOD-AMGIVPHBSA-N 491.632 5.341 5 20 JKBD O=C(c1ccc([N+](=O)[O-])cc1F)N1CCC([C@@H]2CCCCN2C(=O)/C=C/C2CCCCC2)CC1 1830356215 ZNPJZHRDYOSRRC-LUFJGRFYSA-N 471.573 5.104 5 20 JKBD Cc1ccc2[nH]c(C(=O)N3CCC([C@H]4CCCCN4C(=O)c4cccc(F)c4[N+](=O)[O-])CC3)cc2c1 1830620747 FILAWYTXJSLSQI-XMMPIXPASA-N 492.551 5.071 5 20 JKBD Cc1ccc(CC(=O)N2CCC([C@H]3CCCCN3C(=O)C3(C)CCCCC3)CC2)cc1[N+](=O)[O-] 1831797820 GMCMFIKOKKYOIC-HSZRJFAPSA-N 469.626 5.036 5 20 JKBD C[C@H](OC(=O)Cc1ccc(Cl)cc1Cl)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 11482245 NNXRLQRYUQAEBF-VIFPVBQESA-N 465.211 5.033 5 20 JKBD COc1cc(C(=O)Nc2nc(-c3c(C)cc(C)cc3C)cs2)c([N+](=O)[O-])cc1OC(F)F 11916179 SPSWSOGQHIIJBK-UHFFFAOYSA-N 463.462 5.506 5 20 JKBD Cc1ccc(NC(=O)[C@@H](C)OC(=O)c2cc3cc([N+](=O)[O-])ccc3s2)c(Br)c1 16800364 BAHSHMYMQRWDPM-LLVKDONJSA-N 463.309 5.064 5 20 JKBD C[C@@H](OC(=O)C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)C(=O)NC1CCCC1 18494241 JVNAGQRAWCGNDC-VVZNPABPSA-N 479.558 5.126 5 20 JKBD CCN(Cc1ccccc1NC(=O)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1)C(C)=O 27367445 HPBSFAITHJYHON-UHFFFAOYSA-N 467.909 5.661 5 20 JKBD O=C(Nc1ccc(Cl)c(C(=O)NC2CCCCC2)c1)c1ccc(NC2CC2)c([N+](=O)[O-])c1 71990291 LIKQOUBSJXOTJJ-UHFFFAOYSA-N 456.930 5.137 5 20 JKBD COc1ccc(Sc2ccc(NC(=O)Cn3c4ccccc4c(=O)c4ccccc43)cc2)cc1 97544334 LPQRSXHFGSEKPH-UHFFFAOYSA-N 466.562 5.953 5 20 JKBD Cc1onc(-c2c(F)cccc2Cl)c1C(=O)Nc1nc(-c2cccc([N+](=O)[O-])c2)c(C)s1 195703927 ONTSJUYLLCDYMK-UHFFFAOYSA-N 472.885 6.035 5 20 JKBD COc1cc(C(=O)N2CCCN(c3ccccc3)CC2)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 195710402 JCNRTYAGVCCCFJ-UHFFFAOYSA-N 481.936 5.402 5 20 JKBD Cc1cc(C(=O)NC2CCCC2)ccc1NC(=O)c1cc([N+](=O)[O-])ccc1Oc1ccccc1 303010351 JKQVWZWMPQALJZ-UHFFFAOYSA-N 459.502 5.620 5 20 JKBD C[C@@H](Nc1ccc(C(=O)N(C)Cc2ccc(Cl)c(Cl)c2)cc1[N+](=O)[O-])c1ccccn1 303058578 ZTEOXZUZVSMJJU-CQSZACIVSA-N 459.333 5.742 5 20 JKBD CO[C@@H](C)c1cccc(NC(=O)C2CCN(c3ccc(C(F)(F)F)cc3[N+](=O)[O-])CC2)c1 303153784 NGYZKEWLEVMOGT-AWEZNQCLSA-N 451.445 5.176 5 20 JKBD O=C(Nc1cc([N+](=O)[O-])ccc1OC(F)F)[C@H](Oc1ccc(F)c(F)c1)c1ccccc1 409798974 YWYLRSGOVVMDKO-LJQANCHMSA-N 450.344 5.233 5 20 JKBD O=C(C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)Nc1cccc(N2CCNC2=O)c1 482418123 ZZKZECGDLDXLQR-JXAWBTAJSA-N 499.552 5.304 5 20 JKBD COCCN(C(=O)c1ccc(-c2ccc(F)cc2)s1)c1nc(-c2ccc([N+](=O)[O-])cc2)cs1 483266500 HNBAZDNWXNXQOJ-UHFFFAOYSA-N 483.546 5.879 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)N[C@H](C)c2ccc(NC(=O)c3ccc(F)cc3)cc2)cc1SC 483406187 GDCBFNJGSSSCOE-CQSZACIVSA-N 483.521 5.208 5 20 JKBD CSc1ccc(C(=O)c2ccccc2C(=O)N2CCC[C@@H](CN3CCCCCC3)C2)cc1[N+](=O)[O-] 487870522 HPXFZDVDNPMDET-FQEVSTJZSA-N 495.645 5.276 5 20 JKBD CCN(Cc1cccs1)C(=O)C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1 493050066 WVHSJMIMKGIDQJ-NBVRZTHBSA-N 463.584 6.245 5 20 JKBD C[C@@H](NC(=O)c1ccc(Sc2nc3ccccc3s2)c([N+](=O)[O-])c1)c1ccc2c(c1)CC(=O)N2 501054858 ONMOMAWOUXEVCI-CYBMUJFWSA-N 490.566 5.341 5 20 JKBD CC(C)(C)NS(=O)(=O)Cc1cccc(NC(=O)c2cc([N+](=O)[O-])ccc2Sc2ccccc2)c1 511536063 HUHICBWEVJUNBX-UHFFFAOYSA-N 499.614 5.216 5 20 JKBD COc1cc(C(=O)N(Cc2ccco2)C[C@H]2CCCO2)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 511603335 AKEUKCACWPXRKG-LJQANCHMSA-N 486.908 5.464 5 20 JKBD CC(C)OCc1ccc(NC(=O)c2ccccc2C(=O)c2ccc(N(C)C)c([N+](=O)[O-])c2)cc1 512130098 NDSVTOVCTLSPLW-UHFFFAOYSA-N 461.518 5.069 5 20 JKBD COc1cc(C(=O)N(Cc2ccc(C(C)C)cc2)C2CC2)c([N+](=O)[O-])cc1OCc1cscn1 512300586 RSBHWUYFRADACP-UHFFFAOYSA-N 481.574 5.567 5 20 JKBD CC[C@@H](C)NC(=O)c1ccc(NC(=O)c2ccc(N3C[C@@H](C)C[C@@H](C)C3)c([N+](=O)[O-])c2)c(C)c1 520557694 FXAZQJKLDUGFDL-ZIFCJYIRSA-N 466.582 5.166 5 20 JKBD O=C(C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)N1CCc2[nH]c3ccccc3c2C1 603460908 OVNRVXFELONYLA-XDJHFCHBSA-N 494.576 6.201 5 20 JKBD CC[C@H](C)c1ccc([C@H](NC(=O)C(=O)Nc2ccc(C)c([N+](=O)[O-])c2)c2cccs2)cc1 603706231 OZQOPAMPKGFPHS-NYHFZMIOSA-N 451.548 5.323 5 20 JKBD C[C@@H](Nc1nc(CN2CCOCC2)nc2scc(-c3ccccc3)c12)c1cccc([N+](=O)[O-])c1 603867238 GJKCHIXVQJTZSE-QGZVFWFLSA-N 475.574 5.272 5 20 JKBD O=C(c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-])N1CC=C(c2c[nH]c3cc(F)ccc23)CC1 603901732 XKATYEUZMKEDQP-UHFFFAOYSA-N 463.387 5.086 5 20 JKBD Cc1ccc(Sc2ccc(C(=O)N3C[C@@H](C(F)(F)F)C[C@H](C(F)(F)F)C3)cc2[N+](=O)[O-])cc1 604258210 VKCSPUMIROJMSM-GJZGRUSLSA-N 492.441 6.257 5 20 JKBD Cc1ccc(NC(=O)c2ccc(N3C[C@@H](C(F)(F)F)C[C@H](C(F)(F)F)C3)c([N+](=O)[O-])c2)cc1 608974489 ATEHOIRDPAKWIS-GJZGRUSLSA-N 475.389 5.723 5 20 JKBD O=[N+]([O-])c1ccc(Sc2nnc(-c3c[nH]c4ccccc34)n2C[C@@H]2CCCO2)c(Cl)c1 619671161 IBNGFKKISRBTJU-AWEZNQCLSA-N 455.927 5.318 5 20 JKBD Cc1ccc[n+](/C(C(=S)NCc2cccc(C(F)(F)F)c2)=C(/O)c2cccc([N+](=O)[O-])c2)c1 726571170 RYPXULAUGLKFEM-UHFFFAOYSA-O 474.484 5.211 5 20 JKBD CCOc1cccc(NC(=S)/C(=C(/O)c2ccc(C)c([N+](=O)[O-])c2)[n+]2ccc(C)cc2)c1 743052596 OPHJBGUYZWFDGI-UHFFFAOYSA-O 450.540 5.221 5 20 JKBD CCOc1cc(C(=O)O[C@H](C)c2ccccc2NC(=O)c2ccccc2)c([N+](=O)[O-])cc1OC 748015073 MRRMHHJQKUGCJJ-MRXNPFEDSA-N 464.474 5.172 5 20 JKBD Cc1oc(-c2ccco2)nc1CC(=O)O[C@H](C(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1)c1ccccc1 750191576 SSTUBKSNSGYDIK-QFIPXVFZSA-N 495.875 5.270 5 20 JKBD CC(C)n1ncc2c(C(=O)OCc3nc(-c4cccc([N+](=O)[O-])c4)no3)cc(-c3cccs3)nc21 914888567 JVDSCBADFWPZKK-UHFFFAOYSA-N 490.501 5.056 5 20 JKBD Cc1ccc(SCCC(=O)N(Cc2nnc(-c3cccc([N+](=O)[O-])c3)o2)C(C)C)cc1C 916550731 GMAIWPSEZSZCMG-UHFFFAOYSA-N 454.552 5.181 5 20 JKBD C[C@H](OC(=O)C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)c1nc(C2CC2)no1 919013575 ZVSDPHDDOJSDED-IQGJIOQQSA-N 476.514 5.700 5 20 JKBD Cc1ccc(NC(=O)[C@@H](OC(=O)c2sccc2Br)c2ccccc2)c([N+](=O)[O-])c1 919343949 RMCCVSQJXBVNMA-KRWDZBQOSA-N 475.320 5.264 5 20 JKBD C[C@H](OC(=O)[C@H](C)Oc1cccc(C(C)(C)C)c1)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 919407278 JIPHHTBWINRVDS-KBPBESRZSA-N 482.455 5.249 5 20 JKBD COc1cc(-c2ccccc2)sc1C(=O)O[C@H](C)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 919459349 SEPXFEMUUJXOPD-CYBMUJFWSA-N 451.460 5.300 5 20 JKBD COc1cccc([C@@H](C)C(=O)Oc2ccc(NC(=O)c3cc([N+](=O)[O-])ccc3Cl)cc2)c1 919679028 MEUGARCZVJQDCD-CQSZACIVSA-N 454.866 5.218 5 20 JKBD O=C(Nc1ccc(OC(=O)C23CC4CC(CC(C4)C2)C3)cc1)c1cc([N+](=O)[O-])ccc1Cl 923481422 YQTHEESKWMDNFC-UHFFFAOYSA-N 454.910 5.622 5 20 JKBD CCOc1ccc(Cl)cc1C(=O)NC1(c2ccc(NC(=O)c3ccc([N+](=O)[O-])o3)cc2)CCC1 1785750940 AUTFXFNCJPUZGE-UHFFFAOYSA-N 483.908 5.301 5 20 JKBD CCC[C@H](C(=O)NC1(c2ccc(NC(=O)/C=C/c3ccc([N+](=O)[O-])o3)cc2)CCC1)n1cccc1 1786205034 ZEEITGPZJOAYBJ-UFSNDUKISA-N 476.533 5.178 5 20 JKBD Cc1cc(C(=O)Nc2ccc(C3(NC(=O)Cc4ccc(C)c([N+](=O)[O-])c4)CCC3)cc2)c(C)o1 1787345921 JBAVEYQGSCDDQL-UHFFFAOYSA-N 461.518 5.103 5 20 JKBD COc1c(Cl)cccc1C(=O)NC1(c2ccc(NC(=O)c3ccc(O)c([N+](=O)[O-])c3)cc2)CCC1 1790620669 INYBHRSRZYIBSQ-UHFFFAOYSA-N 495.919 5.024 5 20 JKBD C[C@]1(C(=O)Nc2ccc(C3(NC(=O)c4cc([N+](=O)[O-])cc5c4OCC5)CCC3)cc2)CC=CCC1 1791991872 NNXVXKVUDMRPLB-SANMLTNESA-N 475.545 5.024 5 20 JKBD Cc1ccc2cc(C(=O)N3[C@H]4CC[C@@H]3C[C@H](NC(=O)CSc3ccccc3[N+](=O)[O-])C4)sc2c1 1801085207 KMOSHSGCIYJQON-REPLKXPHSA-N 495.626 5.162 5 20 JKBD CC(C)(C)CCCCCC(=O)NC[C@H]1CCN(C(=O)c2cc(F)cc([N+](=O)[O-])c2)[C@@H]1c1cccnc1 1812808279 GNTCMAYFKFEWDI-CJFMBICVSA-N 498.599 5.445 5 20 JKBD CCCCC[C@@H](C)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)CSc2ccccc2[N+](=O)[O-])[nH]n1 1822004993 HKSWIKOXTOXQGM-MJGOQNOKSA-N 487.626 5.319 5 20 JKBD O=C(c1cc2cc([N+](=O)[O-])ccc2s1)N1CCC([C@@H]2CCCCN2C(=O)c2ccc(O)cc2)CC1 1830043936 OXDNGYVHNSLIPP-QFIPXVFZSA-N 493.585 5.062 5 20 JKBD C[C@@H](C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)CC1)n1cccc1 1831062630 WJPSQOZDAKHVKT-AVRDEDQJSA-N 494.617 5.106 5 20 JKBD CC(C)N(C(=O)COC(=O)c1ccccc1C(=O)c1ccc(Cl)c([N+](=O)[O-])c1)c1ccccc1 11029317 RNXDZHCZDRNPKM-UHFFFAOYSA-N 480.904 5.078 5 20 JKBD C[C@@H](OC(=O)C1CCN(c2ccccc2[N+](=O)[O-])CC1)c1nc(-c2cccc(C(F)(F)F)c2)no1 11221652 ZYSUDBUUUCCTIY-CQSZACIVSA-N 490.438 5.184 5 20 JKBD COc1ccc(NC(=O)[C@@H](C)OC(=O)c2ccccc2-c2ncc(-c3ccccc3)o2)c([N+](=O)[O-])c1 11506967 PACMEMMJQZWNCL-MRXNPFEDSA-N 487.468 5.109 5 20 JKBD O=C1c2ccccc2N[C@@H](c2ccc(-c3ccc([N+](=O)[O-])cc3Br)o2)N1C[C@@H]1CCCO1 15503668 HFIAFUHIUQWFMA-OYHNWAKOSA-N 498.333 5.363 5 20 JKBD O=C(Cc1csc(-c2ccccn2)n1)Oc1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2Cl)cc1 15516087 PEBBTCNDWGLGJO-UHFFFAOYSA-N 494.916 5.167 5 20 JKBD Cc1nn(Cc2ccc(C(=O)N3CCC[C@H]3c3nc4ccccc4s3)cc2)c(C)c1[N+](=O)[O-] 15600567 NOZTVOJXWFIJJZ-FQEVSTJZSA-N 461.547 5.043 5 20 JKBD C[C@@H](Sc1nnc(-c2cccc(Br)c2)o1)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 17665768 INBLQSSMRVENSQ-SNVBAGLBSA-N 474.296 5.311 5 20 JKBD COc1cc(C(=O)N2CCC[C@H]2c2cccnc2)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 27163544 MCMHWDQSSIEOTJ-SFHVURJKSA-N 453.882 5.421 5 20 JKBD Cc1ccsc1CN[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Br)c1ccccc1 28383758 AUFSARYNPJFRDW-IBGZPJMESA-N 460.353 5.197 5 20 JKBD O=C(Nc1nc(-c2ccc(Cl)cc2)cs1)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-] 107762263 QCUHNOCPNQTERK-UHFFFAOYSA-N 457.817 5.565 5 20 JKBD Cc1nn(Cc2ccc(C(=O)Nc3ccc(N[C@H](C)c4ccccc4)cc3)cc2)c(C)c1[N+](=O)[O-] 108707795 JKZKLAKCXOLZEZ-GOSISDBHSA-N 469.545 5.882 5 20 JKBD C[C@H]1CCCN(c2ccc(C(=O)N(Cc3nnc(-c4ccc(Cl)cc4)o3)C3CC3)cc2[N+](=O)[O-])C1 115056698 RIPFQQCLHRZBOI-INIZCTEOSA-N 495.967 5.339 5 20 JKBD COc1ccccc1-c1csc(NC(=O)c2ccc(N[C@@H](C)c3ccccn3)c([N+](=O)[O-])c2)n1 195609371 LMRKYSSGYXIBQW-HNNXBMFYSA-N 475.530 5.547 5 20 JKBD CC1CCN(C(=O)c2ccccc2NC(=O)c2ccc(N[C@H](C)c3ccccn3)c([N+](=O)[O-])c2)CC1 195628170 LDVIKNJYCYIHAA-LJQANCHMSA-N 487.560 5.287 5 20 JKBD C[C@@H](Nc1ccc(C(=O)N(CCN(C)C)Cc2cccc(Cl)c2)cc1[N+](=O)[O-])c1ccccn1 303046502 IERQKURDMDBEKO-GOSISDBHSA-N 481.984 5.020 5 20 JKBD O=C(NCc1nccs1)c1c2c(nc3ccccc13)/C(=C/c1ccc([N+](=O)[O-])cc1)CCC2 483642075 LTURLVYDORMUCF-SAPNQHFASA-N 456.527 5.406 5 20 JKBD O=C(N[C@H](c1ccc(F)cc1)c1ccccc1Cl)C1CCN(c2ccccc2[N+](=O)[O-])CC1 486605630 MXYDWFYEOAGZML-XMMPIXPASA-N 467.928 5.510 5 20 JKBD O=[N+]([O-])c1ccc(-c2nn(-c3ccccc3)cc2CN[C@@H](c2ccccc2)c2ccncc2)cc1 488493571 MYTQLPGSZNMNLP-MHZLTWQESA-N 461.525 5.722 5 20 JKBD CCOc1cc(CN[C@H](C)c2cc(C)cc(C)c2)ccc1OCc1cc([N+](=O)[O-])cc2c1OCOC2 500477414 VJRYFZPMMAXBME-HXUWFJFHSA-N 492.572 5.907 5 20 JKBD COc1cc(C(=O)N(C2CC2)[C@H](C)c2cccc(C(F)(F)F)c2)c([N+](=O)[O-])cc1OC(F)F 502887653 MYBMFANCLTUEHD-LLVKDONJSA-N 474.382 5.589 5 20 JKBD CC[C@@H](C)n1ncc2c(C(=O)Nc3nc(-c4cccc([N+](=O)[O-])c4)c(C)s3)cc(C)nc21 508953193 WTWNWFVILJNAHC-CYBMUJFWSA-N 450.524 5.303 5 20 JKBD COc1cc(C(=O)Nc2ccc(CN3CCC[C@H](C)C3)cc2)c([N+](=O)[O-])cc1OCc1cscn1 509970125 PZGUDTTUXYDTOQ-KRWDZBQOSA-N 496.589 5.123 5 20 JKBD O=C(Nc1ccc(CCC(=O)N2CCCC2)cc1)c1ccc(NCc2ccccc2)c([N+](=O)[O-])c1 510191414 JPQFTVZXCBWODA-UHFFFAOYSA-N 472.545 5.014 5 20 JKBD CSc1ccc(C(=O)c2ccccc2C(=O)N2CCC(n3c(C)ccc3C)CC2)cc1[N+](=O)[O-] 512593460 VFVYCOBBNDJJIH-UHFFFAOYSA-N 477.586 5.443 5 20 JKBD C[C@@H](NCC1(c2ccc(Cl)cc2Cl)CCOCC1)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl 513181441 AVPRDTFLKGVJIA-CYBMUJFWSA-N 486.783 5.220 5 20 JKBD CNC(=O)c1ccc(C)c(NC(=O)C/C(=C\c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)c1 514403781 PQMWALLRXYBESY-CPNJWEJPSA-N 486.553 5.442 5 20 JKBD CN(Cc1cscn1)C(=O)c1c2c(nc3ccccc13)/C(=C/c1ccc([N+](=O)[O-])cc1)CCC2 516336937 WKBFXIOYNXDCKD-QGOAFFKASA-N 470.554 5.749 5 20 JKBD Cc1nc([N+](=O)[O-])cn1CCC(=O)Nc1ccc(Oc2ccccc2Br)c(Cl)c1 521713604 ZAOJAIJEEQQFPD-UHFFFAOYSA-N 479.718 5.337 5 20 JKBD CC(=O)N1CCc2c(sc3nc(-c4cccc([N+](=O)[O-])c4)c(C)c(-c4ccc(C)cc4)c23)C1 544405346 RLMYMKCHHRUPPB-UHFFFAOYSA-N 457.555 6.060 5 20 JKBD O=C(NCCNc1ccc(C(F)(F)F)cc1[N+](=O)[O-])Nc1cccc(NC(=O)c2cccs2)c1 603653918 KYLLPHMKNGGLJF-UHFFFAOYSA-N 493.467 5.161 5 20 JKBD CCOc1cc(NC(=O)N2CC=C(c3c[nH]c4cc(C)ccc34)CC2)c([N+](=O)[O-])cc1OCC 603682972 WWINYQRJVSWCRW-UHFFFAOYSA-N 464.522 5.503 5 20 JKBD C[C@@H](NC(=O)Nc1cc(OCC(F)(F)F)cc(OCC(F)(F)F)c1)c1cccc([N+](=O)[O-])c1 603827159 CXIVKESEEYPRHS-LLVKDONJSA-N 481.349 5.360 5 20 JKBD CCN(Cc1cccc(Nc2ccc(S(=O)(=O)Nc3ccc(C)cc3C)cc2[N+](=O)[O-])c1)C(C)=O 603851581 KVLNAVQCGWJWET-UHFFFAOYSA-N 496.589 5.124 5 20 JKBD CCC[C@H](NC(=O)c1cc(OC)c(OC(F)F)cc1[N+](=O)[O-])c1ccc(Cl)c(Cl)c1 604498365 VXETZGQTGGLMHV-AWEZNQCLSA-N 463.264 5.783 5 20 JKBD CN1CCN(c2ccc(NC(=O)c3ccc(Nc4ccccc4)c([N+](=O)[O-])c3)c(C(F)(F)F)c2)CC1 609099895 XDGKHLORGLOAID-UHFFFAOYSA-N 499.493 5.361 5 20 JKBD CC(=O)N(c1ccc(C(F)(F)F)cc1)c1nc(COC(=O)c2ccc([N+](=O)[O-])cc2C)cs1 725987530 JFUDTGCLABMVLU-UHFFFAOYSA-N 479.436 5.420 5 20 JKBD O=C1c2c(Cl)c(Cl)c(Cl)c(Cl)c2C(=O)N1Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1 727486694 JTLILVOEWLINRO-UHFFFAOYSA-N 488.070 5.055 5 20 JKBD Cc1ncc(CN(c2cccc(C(F)(F)F)c2)S(=O)(=O)c2ccc(Cl)c([N+](=O)[O-])c2)s1 744180634 WIFHGNBLTMQHSN-UHFFFAOYSA-N 491.900 5.427 5 20 JKBD C[C@@H](NC(=O)COC(=O)c1csc(-c2ccc([N+](=O)[O-])cc2)n1)c1ccc(Cl)c(Cl)c1 747958421 LVRVARDKWQBTEM-LLVKDONJSA-N 480.329 5.059 5 20 JKBD C[C@@H](OC(=O)c1ccc(Cl)c([N+](=O)[O-])c1)C(=O)N1c2ccccc2Sc2ccccc21 821470245 USVTXUCGSUJUHT-CYBMUJFWSA-N 454.891 5.623 5 20 JKBD CC(=O)Nc1cccc([C@@H](C)N(Cc2ccccc2)C(=O)c2cc([N+](=O)[O-])c(C)c([N+](=O)[O-])c2)c1 841837866 ZSWMQRQFJNVERK-QGZVFWFLSA-N 476.489 5.173 5 20 JKBD O=C(C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)OCCCc1ccncc1 863949573 RDPBCRVKLHWUGS-CAPFRKAQSA-N 459.527 5.706 5 20 JKBD CC(C)Oc1ccc([C@@H](C)NC(=O)c2ccccc2NC(=O)c2ccc([N+](=O)[O-])cc2Cl)cc1 914487343 IBHVGQZTTKDJNW-MRXNPFEDSA-N 481.936 5.779 5 20 JKBD COc1ccc(Oc2ccc([N+](=O)[O-])cc2C(=O)OCC(=O)Nc2ccc(C)cc2Cl)cc1 915442069 LPRWQQQQIJMKAX-UHFFFAOYSA-N 470.865 5.153 5 20 JKBD O=C(O[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Br)c1ccccc1)c1ccc2cc[nH]c2c1 915491204 AXOQTBUIJNWRQS-NRFANRHFSA-N 494.301 5.375 5 20 JKBD C[C@H](OC(=O)CCSc1ccccc1Br)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 915589990 IJCAWCGCFCEOIU-LBPRGKRZSA-N 478.324 5.194 5 20 JKBD O=C(Cn1ncc2ccc([N+](=O)[O-])cc21)Nc1ccccc1Oc1ncc(Cl)cc1Cl 915870346 MCQDSZXYMRWUNL-UHFFFAOYSA-N 458.261 5.077 5 20 JKBD COc1cccc(/C=C(\CC(=O)Nc2cc([N+](=O)[O-])ccc2F)c2nc3ccccc3s2)c1 916667105 RODAFLRQDLKSBD-LFIBNONCSA-N 463.490 5.922 5 20 JKBD CN(Cc1ccccc1)c1ccc(NC(=O)c2cc(OCC(F)(F)F)ccc2[N+](=O)[O-])cc1 917822865 CWAHFLXQRSRHQY-UHFFFAOYSA-N 459.424 5.425 5 20 JKBD COc1ccc(COC(=O)[C@@H](C)SCc2ncc(-c3ccc(Cl)cc3)o2)cc1[N+](=O)[O-] 920670313 FGMPBNHLDJLAFI-CYBMUJFWSA-N 462.911 5.277 5 20 JKBD CC(=O)N(c1nc(COC(=O)[C@H](C)Oc2ccc(Cl)cc2[N+](=O)[O-])cs1)c1ccccc1F 920778234 LKRIJVDHVQWJMV-LBPRGKRZSA-N 493.900 5.039 5 20 JKBD O=[N+]([O-])c1ccc2nc(/C(Cl)=C\c3cc(Br)c4c(c3)OCCCO4)[nH]c2c1 921265471 GSUNKULEGWWABI-NTUHNPAUSA-N 450.676 5.132 5 20 JKBD O=C(NC1(c2ccc(NC(=O)c3ccc([N+](=O)[O-])o3)cc2)CCC1)c1cc2c(F)cc(F)cc2[nH]1 1785748996 VUSVYDBZICVPIJ-UHFFFAOYSA-N 480.427 5.009 5 20 JKBD CC(C)[C@@H](C(=O)Nc1ccc(C2(NC(=O)c3ccc([N+](=O)[O-])[nH]3)CCC2)cc1)c1ccccc1 1786184523 YPSMXGTVNBOMBK-HSZRJFAPSA-N 460.534 5.110 5 20 JKBD Cc1ccc(C(=O)Nc2ccc(C3(NC(=O)CSc4ccccc4[N+](=O)[O-])CCC3)cc2)nc1C 1787172259 REQVNMLDTKMJAX-UHFFFAOYSA-N 490.585 5.147 5 20 JKBD Cc1cc(C(=O)Nc2ccc(C3(NC(=O)c4cc(Br)ccc4[N+](=O)[O-])CCC3)cc2)c[nH]1 1788815915 VXFIFPBWFAYHEX-UHFFFAOYSA-N 497.349 5.055 5 20 JKBD Cc1cc(F)cc(C(=O)Nc2ccc(C3(NC(=O)/C=C/c4ccc([N+](=O)[O-])o4)CCC3)cc2)c1 1790633182 KYLZBNSIAUXART-VQHVLOKHSA-N 463.465 5.096 5 20 JKBD O=C(NC1(c2ccc(NC(=O)c3cccc(F)c3[N+](=O)[O-])cc2)CCC1)c1ccc(-c2ncc[nH]2)cc1 1790702635 STLRXKVPWBZTSB-UHFFFAOYSA-N 499.502 5.186 5 20 JKBD Cc1c(C(=O)Nc2ccc(C3(NC(=O)c4nccs4)CCC3)cc2)cc(Cl)cc1[N+](=O)[O-] 1790774458 NSUCYIPODRIKHB-UHFFFAOYSA-N 470.938 5.075 5 20 JKBD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc2cc([N+](=O)[O-])ccc2s1)[C@@H]1CCC[C@@H]2CCCC[C@H]21 1801207375 MECSINWLJLZJTL-ORIMILDESA-N 495.645 5.668 5 20 JKBD Cc1cc(Cl)cc(C(=O)Nc2cc([C@H]3CCCCN3C(=O)c3cc(F)cc([N+](=O)[O-])c3)[nH]n2)c1 1823192354 VRSBNZMBTIMAQU-HXUWFJFHSA-N 485.903 5.039 5 20 JKBD O=C(c1cc2cccc(F)c2s1)N1CCC([C@H]2CCCCN2C(=O)c2ccc([N+](=O)[O-])o2)CC1 1823614209 HVZPGPIAUQMQBJ-GOSISDBHSA-N 485.537 5.089 5 20 JKBD Cc1c(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)Cc3ccsc3)CC2)cc(Cl)cc1[N+](=O)[O-] 1830736260 UPNRWNKQRDMVAV-OAQYLSRUSA-N 490.025 5.094 5 20 JKBD Cc1c(C(=O)N2CCCC[C@H]2C2CCN(C(=O)c3ccccc3F)CC2)cc(Cl)cc1[N+](=O)[O-] 1830736281 UWUNDVQDLZJFSE-QFIPXVFZSA-N 487.959 5.243 5 20 JKBD COc1cc(C(=O)N2CCCC[C@H]2C2CCN(C(=O)[C@H]3CC[C@H](C(C)C)CC3)CC2)ccc1[N+](=O)[O-] 1832697793 QWSULHGTNZECRB-SSPYTLHUSA-N 499.652 5.299 5 20 JKBD CC(=O)N(c1nc(COC(=O)COc2ccc([N+](=O)[O-])cc2)cs1)c1c(C)cc(C)cc1Cl 9606849 YZGFUTDJVXKLMM-UHFFFAOYSA-N 489.937 5.128 5 20 JKBD CSc1ccc([N+](=O)[O-])c(C(=O)NC[C@@H](c2ccccc2Cl)c2c[nH]c3ccccc23)c1 16205576 ZTAIELCTCDAAKA-IBGZPJMESA-N 465.962 6.013 5 20 JKBD Cn1cnnc1Sc1ccc(C(=O)Nc2ccc(Oc3ccccc3Cl)cc2)cc1[N+](=O)[O-] 18238665 IBDAEYLLYGXLRH-UHFFFAOYSA-N 481.921 5.573 5 20 JKBD Cc1cc(C(=O)CSc2nc3cc4ccccc4cc3c(=O)n2C)c(C)n1Cc1ccco1 22253490 XQUGZXUYICQLHQ-UHFFFAOYSA-N 457.555 5.121 5 20 JKBD COc1ccc(CSc2nnc(S[C@H](C)C(=O)Nc3cccc([N+](=O)[O-])c3C)s2)cc1 24002406 FACOAXWLNZWPFU-CYBMUJFWSA-N 476.605 5.175 5 20 JKBD C[C@H](OC(=O)c1cc2c(F)cccc2s1)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 25035714 XTHHLTAYLRTKGI-VIFPVBQESA-N 456.373 5.151 5 20 JKBD Cc1ccc(S(=O)(=O)Oc2ccc(NC(=O)c3cc([N+](=O)[O-])ccc3Cl)cc2)c(Cl)c1 25372087 ZUWRHPOUIUTUKQ-UHFFFAOYSA-N 481.313 5.230 5 20 JKBD O=c1c2ccccc2nc(SCc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)n1-c1ccc(Cl)cc1 28614727 FHEXWJQHOQUDRL-UHFFFAOYSA-N 491.916 5.290 5 20 JKBD Cc1csc(Sc2ccc(C(=O)N[C@H](c3ccccc3)c3ccccn3)cc2[N+](=O)[O-])n1 29711821 UVKQMHOOODCYBB-OAQYLSRUSA-N 462.556 5.425 5 20 JKBD O=C(Nc1ccccc1N1CCOC1=O)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1 110024584 RTXFMHMBTDPXQT-UHFFFAOYSA-N 453.838 5.249 5 20 JKBD O=C(N[C@@H]1CCN2CCC[C@H]2C1)c1c2c(nc3ccccc13)/C(=C/c1ccc([N+](=O)[O-])cc1)CCC2 485014291 OGIAHCLCNJPCAE-OHDUUZMQSA-N 482.584 5.377 5 20 JKBD Cc1nc(-c2ccc([C@@H](C)NC(=O)c3ccc(N[C@@H](C)c4ccccn4)c([N+](=O)[O-])c3)cc2)cs1 506163487 KJBNUAPVNMBSIN-SJORKVTESA-N 487.585 6.086 5 20 JKBD Cc1csc(Sc2ccc(C(=O)Nc3ccc(NC(=O)c4cnoc4C)cc3)cc2[N+](=O)[O-])n1 512551951 HWKGKNUUPLISBW-UHFFFAOYSA-N 495.542 5.312 5 20 JKBD Cc1ccc(-c2ccc(CN(C(=O)c3ccc(S(C)(=O)=O)c([N+](=O)[O-])c3)C(C)C)s2)cc1 516372550 IKRPQUOPMOCUFR-UHFFFAOYSA-N 472.588 5.086 5 20 JKBD O=[N+]([O-])c1cc(S(=O)(=O)N2CCCCCC2)ccc1SCc1csc(-c2ccoc2)n1 517451547 NLAIJUDWKNJVFP-UHFFFAOYSA-N 479.605 5.168 5 20 JKBD O=[N+]([O-])c1cc(C(F)(F)F)ccc1CNc1ccc(CCn2cc(Br)cn2)cc1 600852208 NJHBALQOTFRPGL-UHFFFAOYSA-N 469.261 5.427 5 20 JKBD O=C(Nc1nnc(SCc2c(Cl)cccc2Cl)s1)c1cc2c(cc1[N+](=O)[O-])OCO2 603941353 GOQRWEZZTCKYFG-UHFFFAOYSA-N 485.330 5.026 5 20 JKBD O=C(Nc1cc([N+](=O)[O-])ccc1OC(F)F)[C@@H]1CCC(=O)N(Cc2ccccc2)[C@@H]1c1ccccc1 603961484 XDGGCVXAFHVDSC-HYBUGGRVSA-N 495.482 5.315 5 20 JKBD CC1(C)CN(C(=O)C2CCN(c3ccc(C(F)(F)F)cc3[N+](=O)[O-])CC2)[C@@H]1c1ccccc1 604332398 PJFHFFCMIUCSQB-OAQYLSRUSA-N 461.484 5.440 5 20 JKBD Cc1ccc(NC(=O)c2ccc(N[C@@H](c3ccc(F)cc3)c3nccn3C)c([N+](=O)[O-])c2)cc1 608971133 AYFRNXHGFYQEAB-QHCPKHFHSA-N 459.481 5.230 5 20 JKBD O=C(CCC(=O)N1CCC(C(=O)N2CCCCC2)CC1)c1ccc2ccc3cccc4ccc1c2c34 729257527 JLYGXPBLAOMZNF-UHFFFAOYSA-N 480.608 5.798 5 20 JKBD CC(=O)N(c1nc(COC(=O)c2cc([N+](=O)[O-])cnc2C)cs1)c1c(C)cc(C)cc1Cl 730014409 ABETUHWUNIFAKZ-UHFFFAOYSA-N 474.926 5.067 5 20 JKBD C[C@@H](Nc1ccc(C(=O)Nc2ccc(N3CCCC3)c(Cl)c2)cc1[N+](=O)[O-])c1ccccn1 730841074 ZAVVLEIEZBUOKO-MRXNPFEDSA-N 465.941 5.669 5 20 JKBD CC1=C(C(=O)Nc2cccc(C)c2)[C@H](c2ccc([N+](=O)[O-])cc2)NC(=O)N1Cc1cccs1 732031671 FUPSXQQEXOCMQC-QFIPXVFZSA-N 462.531 5.144 5 20 JKBD O=C(COC(=O)c1csc(-c2cccc([N+](=O)[O-])c2)n1)Nc1ccc(Cl)c(C(F)(F)F)c1 747963671 NWMSJECDPKSRGH-UHFFFAOYSA-N 485.827 5.186 5 20 JKBD CCc1ccc(N(C(C)=O)c2nc(CSc3nc4ccc([N+](=O)[O-])cc4s3)cs2)cc1 787995966 OTJIXPMRLCLTNX-UHFFFAOYSA-N 470.601 6.200 5 20 JKBD Cc1cc(C)n(Cc2cccc(-c3noc(Cn4c5ccccc5c(=O)c5ccccc54)n3)c2)n1 904528589 NQDTVIHGHKPLJY-UHFFFAOYSA-N 461.525 5.115 5 20 JKBD COc1cccc([C@H](CNC(=O)c2cc([N+](=O)[O-])ccc2Cl)c2c[nH]c3ccccc23)c1OC 912664094 QHZVWGLKNJEGJV-FQEVSTJZSA-N 479.920 5.309 5 20 JKBD CCCOc1cc(NC(=O)N2CCC([C@H](O)c3ccccc3)CC2)c([N+](=O)[O-])cc1OCCC 915334023 AIQCPLPCAWWOFL-XMMPIXPASA-N 471.554 5.150 5 20 JKBD Cc1oc(-c2cccs2)nc1C(=O)O[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1 915565288 OTIJOLJZGLHWKR-HXUWFJFHSA-N 497.916 5.810 5 20 JKBD Cc1nn(C(C)(C)C)c(C)c1C(=O)Oc1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2Cl)cc1 916951833 KDXLWTNBASDEKW-UHFFFAOYSA-N 470.913 5.288 5 20 JKBD O=C(COC(=O)c1csc(-c2ccc(Cl)s2)n1)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 920675679 AYVXZZQKFLZGGF-UHFFFAOYSA-N 491.856 5.248 5 20 JKBD Cc1cc(O)c([N+](=O)[O-])cc1C(=O)NC1(c2ccc(NC(=O)c3cc4[nH]ccc4s3)cc2)CCC1 1789104600 SHCYTDQYFLFPDL-UHFFFAOYSA-N 490.541 5.213 5 20 JKBD CC(C)[C@H](C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(F)cc([N+](=O)[O-])c1)c1ccc(Cl)cc1 1800520323 KYVYRSKBOMZJKT-KGSLCBSSSA-N 487.959 5.079 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2ccc3occc3c2)n[nH]1 1818707618 NDCNSARWEPOKDN-HXUWFJFHSA-N 491.479 5.131 5 20 JKBD Cc1cc(CCCC(=O)N2CCCC[C@@H]2C2CCN(C(=O)[C@H]3C[C@H]3C3CC3)CC2)c([N+](=O)[O-])cc1F 1824370367 VVVWFSUECPKPIA-SONWIMMPSA-N 499.627 5.031 5 20 JKBD Cc1ccc(CC(=O)N2CCCC[C@@H]2C2CCN(C(=O)C34CCC(CC3)CC4)CC2)cc1[N+](=O)[O-] 1830364052 HYHXHYQRBNBVPQ-MKNZIIIOSA-N 481.637 5.036 5 20 JKBD CC1=CC[C@@H](C(=O)N2CCC([C@H]3CCCCN3C(=O)c3cc(Cl)cc([N+](=O)[O-])c3C)CC2)CC1 1830735724 LEYYOUVYNCLASF-NFBKMPQASA-N 488.028 5.536 5 20 JKBD Cc1cc(O)c([N+](=O)[O-])cc1C(=O)N1CCC([C@H]2CCCCN2C(=O)C[C@H](C)c2ccccc2)CC1 1831510063 QFBVEVNQFZBDIS-YADARESESA-N 493.604 5.036 5 20 JKBD O=C(COC(=O)c1sc2cc(F)ccc2c1Cl)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 11444024 BOUNGMRQUQUPOL-UHFFFAOYSA-N 476.791 5.416 5 20 JKBD Cc1cc(CN[C@@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Br)c2ccccc2)ccc1F 11715550 IVGYEPVMVJGADK-OAQYLSRUSA-N 472.314 5.274 5 20 JKBD C[C@@H](OC(=O)c1csc(-c2ccccc2)n1)C(=O)Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1 17984236 CUJOERVPBKGDQZ-CYBMUJFWSA-N 480.527 5.026 5 20 JKBD COc1cccc(NCc2nnc(S[C@H](C)c3cccc([N+](=O)[O-])c3)n2C2CCCCC2)c1 21605361 OQNUTFHFUMGBKY-QGZVFWFLSA-N 467.595 6.166 5 20 JKBD Cn1c(SCC(=O)Nc2cc(C(F)(F)F)ccc2Cl)nc2cc3ccccc3cc2c1=O 22252729 NHVOIYYEJSZXSF-UHFFFAOYSA-N 477.895 5.490 5 20 JKBD COc1cccc(NCc2nnc(SCc3ccc([N+](=O)[O-])cc3)n2C2CCCCC2)c1 22718851 BFRCWUZIOUGOGD-UHFFFAOYSA-N 453.568 5.605 5 20 JKBD COc1ccc([C@H](C)NC(=O)Cc2cn(-c3ccccc3)nc2-c2ccc([N+](=O)[O-])cc2)cc1F 24208875 DSEQCUBMRBXCDY-KRWDZBQOSA-N 474.492 5.015 5 20 JKBD Cc1c(NC(=O)[C@H](C)Sc2nnc([C@H](C)N3CCCCC3)n2-c2ccccc2)cccc1[N+](=O)[O-] 25002312 ARZUFLXLJRGSKH-OALUTQOASA-N 494.621 5.150 5 20 JKBD COc1ccc([N+](=O)[O-])cc1NC(=O)[C@@H](C)OC(=O)c1ccc(COc2ccc3ccccc3c2)o1 25049836 WGBAXDSCVGFTSV-MRXNPFEDSA-N 490.468 5.113 5 20 JKBD Cc1nn(Cc2ccc(C(=O)Nc3ccnn3Cc3c(Cl)cccc3Cl)cc2)c(C)c1[N+](=O)[O-] 31772597 XAFONBMUVIJFAB-UHFFFAOYSA-N 499.358 5.260 5 20 JKBD CC(=O)Nc1ccc(-c2csc(NC(=O)CSc3ccc(C(F)(F)F)cc3[N+](=O)[O-])n2)cc1 36783841 QXPZVYMGEYSSTJ-UHFFFAOYSA-N 496.492 5.426 5 20 JKBD COCCn1c(S[C@@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)nc2cc(Cl)ccc21 57853076 IUBAAOVGMSDFLJ-LBPRGKRZSA-N 459.915 5.148 5 20 JKBD C[C@H](Nc1ccc(C(=O)NCc2ccc(Oc3cccnc3)c(F)c2)cc1[N+](=O)[O-])c1ccccn1 108997882 MATZVGFRDWSYKE-KRWDZBQOSA-N 487.491 5.419 5 20 JKBD C[C@H](Nc1ccc(C(=O)Nc2ncc(Cc3ccc(F)cc3F)s2)cc1[N+](=O)[O-])c1ccccn1 303001817 NAUYRWLZRWJZBB-AWEZNQCLSA-N 495.511 5.741 5 20 JKBD C[C@@H](Nc1ccc(C(=O)NCc2ccc(CN3CCCCCC3)cc2)cc1[N+](=O)[O-])c1ccccn1 303030045 XAYWEEZRADAJKP-OAQYLSRUSA-N 487.604 5.469 5 20 JKBD O=C(CCNc1ccc(C(F)(F)F)cc1[N+](=O)[O-])N1CCCC[C@@H]1c1nc(-c2ccccc2)no1 303146124 BXSULZJZBJDTKL-GOSISDBHSA-N 489.454 5.219 5 20 JKBD COc1cc(C(=O)N[C@H](C)c2oc3ccccc3c2C)c([N+](=O)[O-])cc1OCc1cscn1 409550623 AULFDVAKSAKYOS-CQSZACIVSA-N 467.503 5.185 5 20 JKBD Cc1ccccc1-c1nn(-c2ccccc2)cc1C(=O)Nc1cc([N+](=O)[O-])ccc1OC(F)F 485869282 KNCINCUMXRHIRJ-UHFFFAOYSA-N 464.428 5.610 5 20 JKBD COc1ccc(NC(=O)c2ccc(N3C[C@@H](C)C[C@H](C)C3)c([N+](=O)[O-])c2)c(C(F)(F)F)c1 488512752 IMCNDBGXKACJCG-KBPBESRZSA-N 451.445 5.357 5 20 JKBD CC(C)CCSc1ccc(C(=O)Nc2ccccc2OCc2cscn2)cc1[N+](=O)[O-] 503449105 PYGPMCRUDTVHBA-UHFFFAOYSA-N 457.577 6.021 5 20 JKBD COc1ccc(NC(=O)c2ccc(N[C@H](C)c3ccccn3)c([N+](=O)[O-])c2)cc1OCC(F)(F)F 506177405 ZWWISBMHDRMQAG-CQSZACIVSA-N 490.438 5.365 5 20 JKBD CC(=O)Nc1cc(F)c(F)cc1NC(=O)c1ccc(NCc2ccccc2Cl)c([N+](=O)[O-])c1 506543823 XKYFUONLRAJSBB-UHFFFAOYSA-N 474.851 5.349 5 20 JKBD CC(C)(C)c1ccc(Oc2ccc(CNCc3cccc(CS(C)(=O)=O)c3)cc2[N+](=O)[O-])cc1 507915003 RYBYJFFTKYBDLK-UHFFFAOYSA-N 482.602 5.519 5 20 JKBD CCCN(C(=O)c1ccc([N+](=O)[O-])c(OC)c1)c1nc(-c2ccc(Cl)cc2Cl)cs1 508908427 SKQGKARKVRJLMM-UHFFFAOYSA-N 466.346 6.091 5 20 JKBD CCN(CC)C(=O)c1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2Sc2ccccc2)cc1Cl 512427768 XDGQMHPRUCBRJI-UHFFFAOYSA-N 483.977 6.134 5 20 JKBD CCOC(=O)c1sc(-c2cccc([N+](=O)[O-])c2)cc1NC(=O)c1oc2c(c1C)C(=O)CCC2 514559654 ADZPYESBUFYADK-UHFFFAOYSA-N 468.487 5.173 5 20 JKBD COc1ccc(CSCC(=O)N(Cc2cccnc2)c2ccc(Cl)cc2)cc1[N+](=O)[O-] 515450051 KXRCRZOZFNJQCE-UHFFFAOYSA-N 457.939 5.118 5 20 JKBD COc1ccc([C@H](CNC(=O)N[C@@H](C)c2cccc([N+](=O)[O-])c2)c2c[nH]c3ccccc23)cc1 515840020 DNAYMKWFKDPTHC-SBUREZEXSA-N 458.518 5.277 5 20 JKBD CCCC(=O)Nc1cccc(NC(=O)C2CCN(c3ccc(C(F)(F)F)cc3[N+](=O)[O-])CC2)c1C 516780037 KLMPOIXGOIQDKV-UHFFFAOYSA-N 492.498 5.516 5 20 JKBD CO[C@@H](CNC(=O)C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)c1ccccc1 518330641 DVKUWLVXWJHRTF-WNPPMXKSSA-N 473.554 5.639 5 20 JKBD Cc1ccc(NC(=O)c2cccc(C(F)(F)F)c2)cc1NC(=O)NCc1ccccc1[N+](=O)[O-] 518952325 UHMGGNLRWANZTP-UHFFFAOYSA-N 472.423 5.496 5 20 JKBD CN(CCCCCc1cc(-c2cccc(F)c2)no1)C(=O)c1cn(C)nc1-c1ccc([N+](=O)[O-])cc1 521601856 PCXWKIVOXYWQMN-UHFFFAOYSA-N 491.523 5.274 5 20 JKBD O=C(Nc1ccc(F)cc1)C1CCN(C(=O)c2ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])cc2)CC1 522378547 XNWCQOFPSKANOZ-UHFFFAOYSA-N 497.910 5.671 5 20 JKBD CC1CCN(c2ccc(C(=O)N3CCC[C@H]3c3nc4ccccc4s3)cc2[N+](=O)[O-])CC1 598672616 CHVWBUCRDYQIQA-FQEVSTJZSA-N 450.564 5.418 5 20 JKBD COC(=O)c1ccc([N+](=O)[O-])c(Oc2nc(-c3cccnc3)nc3sc4c(c23)CCCC4)c1 603859878 GWPYNYJZZDOIAI-UHFFFAOYSA-N 462.487 5.119 5 20 JKBD COc1cc(C(=O)N[C@H](c2ccccc2)c2ccc(Cl)c(Cl)c2)c([N+](=O)[O-])cc1OC 604006887 YRXDCHZFFXOUOL-OAQYLSRUSA-N 461.301 5.438 5 20 JKBD O=C(c1ccc(N[C@@H](c2ccccc2)c2ccc(Br)cc2)c([N+](=O)[O-])c1)N1CCOCC1 604451562 PTCBBOREMCTDCA-QHCPKHFHSA-N 496.361 5.031 5 20 JKBD COc1c(C)cc(CN(C)C(=O)c2ccccc2NC(=O)c2ccc([N+](=O)[O-])cc2Cl)cc1C 725745885 AOYBUZOADDVIJF-UHFFFAOYSA-N 481.936 5.398 5 20 JKBD Cc1nc(C)c(COC(=O)C/C(=C/c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)s1 729654437 NBHUFRUEGHODGZ-BOPFTXTBSA-N 465.556 5.952 5 20 JKBD Cc1csc(SCc2ccccc2C(=O)OC[C@@H]2CCCN2C(=O)c2ccccc2[N+](=O)[O-])n1 730702740 CXIHSGDVSJGFDK-SFHVURJKSA-N 497.598 5.114 5 20 JKBD CC(C)(C)C[C@@H](NC(=O)COC(=O)c1csc(-c2cccc([N+](=O)[O-])c2)n1)c1ccc(F)cc1 747954577 AXGJIQPSPWCOFF-LJQANCHMSA-N 485.537 5.308 5 20 JKBD O=C(Nc1ccccc1Cl)C(=Cc1ccc([N+](=O)[O-])c(O)c1)C(=O)Nc1ccccc1Cl 748149402 XIBSYYBXBIHGED-UHFFFAOYSA-N 472.284 5.268 5 20 JKBD O=C(/C=C\c1ccc([N+](=O)[O-])cc1)O[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1 798128086 MLMREOSKVBZGHO-NGHDKMLMSA-N 481.848 5.093 5 20 JKBD O=[N+]([O-])c1cccc(Br)c1CNc1ccc(Oc2nncc3ccccc23)c(Cl)c1 864009863 ZUWXQPAZHZTCOQ-UHFFFAOYSA-N 485.725 6.358 5 20 JKBD COc1ccc(NC(=O)c2nnc(/C(Cl)=C\c3ccc(-c4cccc([N+](=O)[O-])c4)o3)s2)cc1 912963680 TXJHXDIUCKLBTE-LDADJPATSA-N 482.905 5.704 5 20 JKBD CC1=NN(c2ccc(C(=O)O[C@H](C(=O)Nc3ccc([N+](=O)[O-])cc3Cl)c3ccccc3)cc2)CC1 919143075 XPYGYUOKXNMKDD-QHCPKHFHSA-N 492.919 5.371 5 20 JKBD Cc1ccc(NC(=O)[C@@H](OC(=O)c2cccn2Cc2cccs2)c2ccccc2)c([N+](=O)[O-])c1 919624875 LMTFWYVWLFTRCI-QHCPKHFHSA-N 475.526 5.351 5 20 JKBD O=C(Cc1ccc(Cl)cc1[N+](=O)[O-])Nc1ccc(C2(NC(=O)[C@H]3CCC(F)(F)C3)CCC2)cc1 1786114941 PVGAADBFVQMTFA-INIZCTEOSA-N 491.922 5.360 5 20 JKBD O=C(CCc1ccsc1)Nc1ccc(C2(NC(=O)CSc3ccccc3[N+](=O)[O-])CCC2)cc1 1788186814 GZKNEWUOWRUTDF-UHFFFAOYSA-N 495.626 5.515 5 20 JKBD Cc1cc(C(=O)Nc2ccc(C3(NC(=O)c4ccccc4Cl)CCC3)cc2)ncc1[N+](=O)[O-] 1788766667 AIOSXLCQGNPXIP-UHFFFAOYSA-N 464.909 5.013 5 20 JKBD Cc1cc(CCCC(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2ccccc2C2CC2)c([N+](=O)[O-])cc1F 1803514657 HYRIPINBPRMZSW-KOUNCHBCSA-N 493.579 5.194 5 20 JKBD CC(C)[C@@H](C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cc(F)cc([N+](=O)[O-])c2)[nH]n1)c1ccccc1 1814931312 HNDPQUYUVMIITJ-ISKFKSNPSA-N 493.539 5.203 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cc3ccoc3s2)n[nH]1 1817827397 ZATXCCOZNGUPRO-QGZVFWFLSA-N 497.508 5.193 5 20 JKBD Cc1ccc(C(=O)N2CCCC[C@H]2c2cc(NC(=O)CSc3ccccc3[N+](=O)[O-])n[nH]2)cc1C 1822312611 BYXFTCXWQXCDDQ-FQEVSTJZSA-N 493.589 5.033 5 20 JKBD C/C(=C\c1cccs1)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)/C=C/c2ccccc2[N+](=O)[O-])n[nH]1 1823501171 OOSUITXCIUQLNN-BKDQMDBWSA-N 491.573 5.188 5 20 JKBD Cc1oc(C(C)(C)C)cc1C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cc(O)cc([N+](=O)[O-])c2)CC1 1825951453 QRRGNZSPPYJAPG-QHCPKHFHSA-N 497.592 5.046 5 20 JKBD Cc1ccc([C@@H](C)C(=O)N2CCC([C@H]3CCCCN3C(=O)c3ccc([N+](=O)[O-])cc3F)CC2)cc1 1830498491 XIQIHKOBUKCTEI-KBMIEXCESA-N 481.568 5.079 5 20 JKBD Cc1ccc([C@H](C)C(=O)N2CCCC[C@H]2C2CCN(C(=O)Cc3cc([N+](=O)[O-])ccc3F)CC2)cc1 1831525651 VLFPAIOOTFFUGM-FNZWTVRRSA-N 495.595 5.008 5 20 JKBD COc1cc(C(=O)N2CCC([C@@H]3CCCCN3C(=O)c3ccccc3C3CC3)CC2)ccc1[N+](=O)[O-] 1832556717 ACYAOGMYWIXQNI-DEOSSOPVSA-N 491.588 5.028 5 20 JKBD O=C([C@@H]1C[C@@H]1c1ccccc1)N1CCC([C@H]2CCCCN2C(=O)/C=C/c2ccccc2[N+](=O)[O-])CC1 1832904231 PUUVUANDPFPEBB-MUNLLTBKSA-N 487.600 5.031 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)N1CCCC12CN(C(=O)c1ccc(-c3ccc(Cl)cc3)o1)C2 1845493127 DEQXXUDPEAJZBB-UHFFFAOYSA-N 497.910 5.087 5 20 JKBD O=C(COC(=O)c1c2c(nc3ccccc13)/C(=C/c1ccco1)CC2)Nc1cc([N+](=O)[O-])ccc1F 8620859 UQKYMYWXCQLBBW-NTCAYCPXSA-N 487.443 5.157 5 20 JKBD CCn1c(SCC(=O)Nc2cc([N+](=O)[O-])ccc2C)nc2scc(-c3cccs3)c2c1=O 9750697 WHWMWURPLMKILG-UHFFFAOYSA-N 486.600 5.154 5 20 JKBD O=C(c1cc2cc([N+](=O)[O-])ccc2s1)N1CCC(c2nc3cc(Cl)ccc3s2)CC1 10235769 FNLQIMGQTOUHCK-UHFFFAOYSA-N 457.964 6.092 5 20 JKBD O=C(CCNc1ccc(C(F)(F)F)cc1[N+](=O)[O-])Nc1cccc(-c2nnc3n2CCCCC3)c1 10421907 BMBNOQOIFPLSEF-UHFFFAOYSA-N 488.470 5.039 5 20 JKBD COc1ccc(OC)c(NC(=O)C/C(=C/c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)c1 15083209 UBULATPKIOTYGV-LGMDPLHJSA-N 475.526 5.791 5 20 JKBD O=C(Nc1ccc(Cl)c(S(=O)(=O)Nc2ccccc2Cl)c1)c1ccc([N+](=O)[O-])s1 15501136 KTTLUDMFEYHPFL-UHFFFAOYSA-N 472.331 5.016 5 20 JKBD Cc1cccc(-c2nnc([C@@H](C)OC(=O)c3ccc(Sc4nc(C)cs4)c([N+](=O)[O-])c3)o2)c1 17715738 AZWIMKFNLKEICD-CQSZACIVSA-N 482.543 5.787 5 20 JKBD COc1ccc(/C=C2\CCn3c2nc2sc(C)c(C)c2c3=O)cc1OCc1ccc([N+](=O)[O-])cc1 20620789 ZMUYYQXTFRHEBJ-XDHOZWIPSA-N 489.553 5.515 5 20 JKBD CN(Cc1ccc(Cl)c(Cl)c1)C(=O)c1ccccc1NC(=O)c1ccc([N+](=O)[O-])cc1Cl 23003305 HUCGHHRZVAUXDY-UHFFFAOYSA-N 492.746 6.080 5 20 JKBD O=c1c2ccccc2nc(SCc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)n1CCCc1ccccc1 25212861 YBOLVNNTMUUEKP-UHFFFAOYSA-N 499.552 5.280 5 20 JKBD CCOc1ccc(NC(=O)C2CCN(c3ccc(C(F)(F)F)cc3[N+](=O)[O-])CC2)cc1F 59811494 KZLGYGBWNZYYKF-UHFFFAOYSA-N 455.408 5.007 5 20 JKBD O=C(Nc1ccccc1C(=O)Nc1ccc(OCC(F)(F)F)nc1)c1ccc([N+](=O)[O-])cc1Cl 108599741 DQBDPHAXEJXRTG-UHFFFAOYSA-N 494.813 5.089 5 20 JKBD CCNC(=O)c1cccc(CNC(=O)c2cc([N+](=O)[O-])ccc2Sc2ccc(Cl)cc2)c1 481477040 GEPNKXQUFBXIOS-UHFFFAOYSA-N 469.950 5.079 5 20 JKBD CCOC(=O)c1c(NC(=O)c2cc(SC)c(OC)cc2[N+](=O)[O-])sc2c1CCCCC2 482868112 LQRVVVQFQGXKAY-UHFFFAOYSA-N 464.565 5.085 5 20 JKBD COc1ccc(Oc2ccc([N+](=O)[O-])cc2C(=O)N[C@H](C)c2ccc(NC(=O)NC3CC3)cc2)cc1 483270788 NWUMULQWGOIOOL-MRXNPFEDSA-N 490.516 5.171 5 20 JKBD O=[N+]([O-])c1cccc(OC[C@H](O)CSc2nnc(SCc3cccc4ccccc34)s2)c1 508373041 WZLGYLDNVAWCNM-SFHVURJKSA-N 485.612 5.424 5 20 JKBD O=C(Nc1ccc(-n2cncn2)c(F)c1)c1cc([N+](=O)[O-])ccc1Sc1ccc(Cl)cc1 509481051 RZBROUWMLPHRTR-UHFFFAOYSA-N 469.885 5.372 5 20 JKBD O=C(Nc1nc(-c2c(F)cccc2F)cs1)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-] 514559291 XUQOVONLRLRIGO-UHFFFAOYSA-N 459.352 5.190 5 20 JKBD CC[C@H](NCc1ccc(Oc2ccccc2Cl)c([N+](=O)[O-])c1)c1nnc2n1CCCCC2 518279201 ZWQOVEJMHTXTIJ-SFHVURJKSA-N 455.946 5.599 5 20 JKBD CCCN(C(=O)c1ccc(N[C@H](C)c2ccccn2)c([N+](=O)[O-])c1)[C@@H](C)c1ccccc1OC 519887094 RUAKLEQEEFYYTE-MOPGFXCFSA-N 462.550 5.785 5 20 JKBD COc1ccc(Br)c(NC(=O)c2ccc(N3C[C@H](C)C[C@@H](C)C3)c([N+](=O)[O-])c2)c1 523356347 AKDSSSRUZFADKB-ZIAGYGMSSA-N 462.344 5.101 5 20 JKBD CC(C)N(Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1)Cc1ccc(-c2cccc(F)c2)s1 552952665 GHWPTKHSKBNAGP-UHFFFAOYSA-N 452.511 5.923 5 20 JKBD C[C@H](Cc1nnc(SCC(=O)Nc2nc(-c3cccc([N+](=O)[O-])c3)cs2)o1)c1ccccc1 594639279 WLNJNQIYKCEMBD-CQSZACIVSA-N 481.559 5.178 5 20 JKBD COc1ccc(-c2csc(NC(=O)c3cc(OCC(F)(F)F)ccc3[N+](=O)[O-])n2)cc1F 603732311 JUEBGQNXMGTEFI-UHFFFAOYSA-N 471.388 5.059 5 20 JKBD COc1ccc([C@H](CNC(=O)N(C)Cc2ccccc2[N+](=O)[O-])c2c[nH]c3ccccc23)cc1 603745905 ANZRPHRGQWQPBF-QFIPXVFZSA-N 458.518 5.058 5 20 JKBD CN(C(=O)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1)[C@H]1CCCc2ccccc21 603820538 NWAFCSXTFIASJW-FQEVSTJZSA-N 461.484 5.366 5 20 JKBD Cc1ccc(-n2ncc(C(=O)Nc3nc(-c4cccc([N+](=O)[O-])c4)c(C)s3)c2C(F)(F)F)cc1 603997205 CQYGXZPPIMMUKD-UHFFFAOYSA-N 487.463 5.792 5 20 JKBD COc1ccccc1[C@H]1CCCN1C(=O)Cc1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1 609036628 JTZXBPRMLRWGCR-RUZDIDTESA-N 482.540 5.362 5 20 JKBD C[C@@H](Nc1ccc(C(=O)O[C@@H](c2ccccc2)c2cccnc2)cc1[N+](=O)[O-])c1ccccn1 728419537 UUUQCVVNEZOIHR-CJAUYULYSA-N 454.486 5.504 5 20 JKBD O=C(Cc1csc(-c2ccc(Cl)cc2Cl)n1)OCc1nc(-c2ccc([N+](=O)[O-])cc2)no1 747259860 VKOBVPSNQKKVKX-UHFFFAOYSA-N 491.312 5.361 5 20 JKBD Cc1csc(Sc2ccc([N+](=O)[O-])cc2C(=O)O[C@H](C)C(=O)Nc2ccc(F)cc2Cl)n1 849132402 IOOBPFCFQNNFQI-LLVKDONJSA-N 495.941 5.487 5 20 JKBD O=C(COc1ccc2c(-c3ccc([N+](=O)[O-])cc3)cc(=O)oc2c1)N[C@@H](c1ccccc1)C1CC1 851958378 BZDNIOSULQVRJQ-MHZLTWQESA-N 470.481 5.015 5 20 JKBD CC1CCN(c2ccc([N+](=O)[O-])cc2C(=O)N[C@@H]2C[C@@H](C(F)(F)F)C[C@@H](C(F)(F)F)C2)CC1 914743479 AMXSINVTGWDUTE-FICVDOATSA-N 481.437 5.470 5 20 JKBD Cc1ccccc1-n1ncc(C(=O)N(C)Cc2cc([N+](=O)[O-])ccc2Cl)c1C(F)(F)F 917069012 HEFIYHQYODCNAQ-UHFFFAOYSA-N 452.820 5.033 5 20 JKBD CC1=C(C(=O)Nc2cccc(C)c2C)[C@@H](c2ccc(Cl)c([N+](=O)[O-])c2)NC(=O)N1CC1CC1 918075470 SNBVGFVQWWLUMK-JOCHJYFZSA-N 468.941 5.254 5 20 JKBD CCC(CC)(Cc1nc2ccccc2s1)C(=O)OCc1nc(-c2ccc([N+](=O)[O-])cc2)no1 919108974 ASCGUSBODFVYGA-UHFFFAOYSA-N 466.519 5.347 5 20 JKBD O=Cc1ccc(C(=O)Nc2ccc(C3(NC(=O)CSc4ccccc4[N+](=O)[O-])CCC3)cc2)s1 1788154547 RFMBYVKGFOHSQQ-UHFFFAOYSA-N 495.582 5.009 5 20 JKBD Cc1ccc(CC(=O)Nc2ccc(C3(NC(=O)c4cc(F)cnc4Cl)CCC3)cc2)cc1[N+](=O)[O-] 1790523888 ANGNYQANVARTMQ-UHFFFAOYSA-N 496.926 5.081 5 20 JKBD Cc1ccc(CC(=O)NC2(c3ccc(NC(=O)[C@@]4(F)CCCC=C4F)cc3)CCC2)cc1[N+](=O)[O-] 1792379545 KXGCXFFLDAJGJN-AREMUKBSSA-N 483.515 5.325 5 20 JKBD O=C(c1cccc2ccccc12)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)C1(c3cccc([N+](=O)[O-])c3)CCC1)C2 1797298249 MZPOBQMHFRGYDW-NUNAXRQHSA-N 483.568 5.122 5 20 JKBD O=C(/C=C/c1ccsc1)N1CCCC2(CCN(C(=O)C3(c4cccc([N+](=O)[O-])c4)CCC3)CC2)C1 1807203834 UVSLOKDWSHLBIK-VOTSOKGWSA-N 493.629 5.023 5 20 JKBD Cc1scc(C(=O)N2CCCC3(CCN(C(=O)Cc4ccc(Cl)cc4[N+](=O)[O-])CC3)C2)c1C 1808782214 ZLBSEKBCZKTJJN-UHFFFAOYSA-N 490.025 5.014 5 20 JKBD Cc1c(C(=O)Nc2cc([C@H]3CCCCN3C(=O)CC3CCCC3)[nH]n2)cc(Cl)cc1[N+](=O)[O-] 1821290464 DJXWQMVAWMSRDS-LJQANCHMSA-N 473.961 5.166 5 20 JKBD Cc1cccc(Cl)c1C(=O)N1CCC([C@H]2CCCCN2C(=O)Cc2cccc([N+](=O)[O-])c2)CC1 1823679467 HJKILOOXBBLVKJ-HSZRJFAPSA-N 483.996 5.033 5 20 JKBD O=C(c1cc(F)cc(Cl)c1)N1CCC([C@H]2CCCCN2C(=O)c2cc(F)cc([N+](=O)[O-])c2)CC1 1830616075 DOYBETREAPOVMO-JOCHJYFZSA-N 491.922 5.074 5 20 JKBD Cc1cccc(C(=O)N2CCC([C@H]3CCCCN3C(=O)c3cc4cc([N+](=O)[O-])ccc4s3)CC2)n1 1831060354 UJDACTSKYGLIHA-JOCHJYFZSA-N 492.601 5.060 5 20 JKBD Cc1ccc(CSCCC(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3ccc([N+](=O)[O-])o3)CC2)cc1 1831747046 NSCHRHQLMOHYRP-JOCHJYFZSA-N 499.633 5.053 5 20 JKBD O=C(Nc1ccc(N[C@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2ccccc2)cc1)C1CC1 10768789 NUEKREPNHUJHAW-QFIPXVFZSA-N 464.909 5.389 5 20 JKBD C[C@H](OC(=O)c1sc2cc(F)ccc2c1Cl)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl 11443772 KSBGQDMLKPWULC-QMMMGPOBSA-N 457.266 5.439 5 20 JKBD C[C@H](OC(=O)COc1ccc(Cl)c2ccccc12)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 19486790 UMOFPLKHTIHBRW-ZDUSSCGKSA-N 453.838 5.135 5 20 JKBD Cc1ccccc1-n1c(S[C@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)nnc1-c1ccncc1 20789050 KQRIDUJNPSDMFA-OAHLLOKOSA-N 494.964 5.319 5 20 JKBD O=C(COC(=O)/C(=C/c1ccc(F)cc1)c1cccs1)Nc1cc([N+](=O)[O-])ccc1Cl 28302674 JTWMOSGFPGJUOR-MHWRWJLKSA-N 460.870 5.171 5 20 JKBD O=C(Nc1ccc(NC(=O)[C@@H]2CCCO2)cc1)c1cc([N+](=O)[O-])ccc1Sc1ccccc1 30503131 SULXDWNOYVJBFN-NRFANRHFSA-N 463.515 5.116 5 20 JKBD O=C(c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1)N1CCN(c2ncccc2Cl)CC1 109441370 KSSGBJZKUSGHRH-UHFFFAOYSA-N 473.316 5.051 5 20 JKBD O=C(/C=C\c1ccc2ccccc2n1)O[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1 207428157 MJOAWYMIZUHBKZ-LGQLLILUSA-N 487.899 5.733 5 20 JKBD COc1cc(C(=O)N(C)CCc2cccc3ccccc23)c([N+](=O)[O-])cc1OCc1cscn1 303101539 HWTIZYBOUIOOKQ-UHFFFAOYSA-N 477.542 5.107 5 20 JKBD O=C(C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1)N1CCCCC[C@H]1c1ccncc1 479160985 JKHSOTVAOCCXQB-FQEVSTJZSA-N 476.499 5.369 5 20 JKBD CCOc1cc([N+](=O)[O-])c(C(=O)Nc2ccc(OCc3cccc(F)c3)c(F)c2)cc1OC 483795293 DNQXXHUZQCOAJT-UHFFFAOYSA-N 458.417 5.112 5 20 JKBD O=C(Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1)c1cnn(-c2ccccc2F)c1C(F)(F)F 486224290 RTDVFTQTCMVFDC-UHFFFAOYSA-N 477.399 5.314 5 20 JKBD O=C(Nc1cc(-c2nnc3n2CCCCC3)ccc1Cl)c1csc(-c2cccc([N+](=O)[O-])c2)n1 496352269 YOBVDFBOBXTWCZ-UHFFFAOYSA-N 494.964 5.609 5 20 JKBD C[C@@H](NCc1ccc(-c2ccc([N+](=O)[O-])cc2Br)o1)c1nc(-c2ccccc2)cs1 501349678 UQYSESYDYPYGMH-CQSZACIVSA-N 484.375 6.592 5 20 JKBD Cc1ccc(C)c(N2C(=O)c3ccc(C(=O)N(Cc4ccc([N+](=O)[O-])cc4)C(C)C)cc3C2=O)c1 509694137 CXHSWBMFGIOXNS-UHFFFAOYSA-N 471.513 5.063 5 20 JKBD COc1cc(C(=O)Nc2ccc(Oc3ccccc3)cc2)c([N+](=O)[O-])cc1OCc1cscn1 509892101 BFAKHOXIUBNRGA-UHFFFAOYSA-N 477.498 5.684 5 20 JKBD CC[C@H](C)c1ccc([C@H](NC(=O)C(=O)Nc2cc([N+](=O)[O-])ccc2OC)c2cccs2)cc1 515140875 APCUQJMFWFLENO-NYHFZMIOSA-N 467.547 5.023 5 20 JKBD CC[C@@H](NCc1ccc(-c2ccccc2[N+](=O)[O-])s1)c1ccccc1OCC(=O)N(C)C 549558501 OTSWURLVGOUXPN-HXUWFJFHSA-N 453.564 5.031 5 20 JKBD Cc1cc(Sc2ncccn2)ccc1NC(=O)CSc1ccc(C(F)(F)F)cc1[N+](=O)[O-] 555716161 MFSRUXUTHDMQQL-UHFFFAOYSA-N 480.493 5.594 5 20 JKBD Cc1ccc(-c2csc(NC(=O)c3cnn(-c4ccc(F)cc4)c3C(F)(F)F)n2)cc1[N+](=O)[O-] 603445523 NAUMZVBBTMDZKF-UHFFFAOYSA-N 491.426 5.623 5 20 JKBD CC1(C)CC(NC(=O)C/C(=C/c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)CC(C)(C)N1 603466530 GMIGMOHYZOVKFJ-AQTBWJFISA-N 478.618 5.561 5 20 JKBD C[C@H]1C[C@H]1c1ccc(CNC(=O)Cc2cn(-c3ccccc3)nc2-c2ccc([N+](=O)[O-])cc2)o1 603971440 LCKJUUMOHMMGFQ-GAJHUEQPSA-N 456.502 5.023 5 20 JKBD CNC(=O)c1ccc(NC(=O)c2ccc(Sc3ccc(C)cc3)c([N+](=O)[O-])c2)cc1Cl 604013621 XKUCYMMKULWFGC-UHFFFAOYSA-N 455.923 5.320 5 20 JKBD O=C(C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)Nc1cnn(C[C@@H]2CCCO2)c1 604243790 HVBUIBKNILOQQV-CNEDASOKSA-N 489.557 5.149 5 20 JKBD O=[N+]([O-])c1ccc(-c2ccc(CNCCCn3cnc4ccccc43)o2)c(Br)c1 608835880 UKAJXKAMUQYIIU-UHFFFAOYSA-N 455.312 5.147 5 20 JKBD CC[C@H](NC(=O)Cc1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2[nH]1 608950509 ZYKPPKZWEPJUJW-QFIPXVFZSA-N 480.528 5.134 5 20 JKBD O=C(Nc1ccnn1Cc1ccccc1Br)c1cc2cc([N+](=O)[O-])ccc2s1 612653361 HSSJQWGPTYTWFQ-UHFFFAOYSA-N 457.309 5.069 5 20 JKBD CCOc1ccc(C(=O)Nc2nc3cc(C(F)(F)F)ccc3n2Cc2ccco2)cc1[N+](=O)[O-] 619219528 DLVDKYCNYODKSW-UHFFFAOYSA-N 474.395 5.256 5 20 JKBD COc1cc(CSc2n[nH]c(-c3ccccc3Br)n2)c([N+](=O)[O-])cc1OC(F)F 619253805 HQVDIMKCKACZPU-UHFFFAOYSA-N 487.282 5.045 5 20 JKBD O=C(COC(=O)c1csc(-c2cccc(C(F)(F)F)c2)n1)Nc1cc(Cl)ccc1[N+](=O)[O-] 725996347 ILYZHJOTAIKXKT-UHFFFAOYSA-N 485.827 5.186 5 20 JKBD O=C(Nc1cccc(C2SCCS2)c1)N1CCN(c2ccc([N+](=O)[O-])cc2C(F)(F)F)CC1 727587922 SGEIKJURAIYMHT-UHFFFAOYSA-N 498.552 5.446 5 20 JKBD Cc1ccc2c(Cl)c(C(=O)O[C@H](C)C(=O)Nc3ccc([N+](=O)[O-])cc3C(F)(F)F)sc2c1 729728360 LBADBMOOUUBMHR-SNVBAGLBSA-N 486.855 5.974 5 20 JKBD CC(=O)c1cccc(O[C@@H](C)C(=O)O[C@@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2ccccc2)c1 745231459 YFDQUYJYPFUTAB-QMHKHESXSA-N 496.903 5.141 5 20 JKBD COc1cc(C(=O)N(C)c2ccc([N+](=O)[O-])cc2)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 754320593 PZAJQFMODMTGJC-UHFFFAOYSA-N 457.826 5.234 5 20 JKBD Cc1cccc([N+](=O)[O-])c1NC(=O)COC(=O)c1cc2c(C)nn(-c3ccccc3Cl)c2s1 762930210 SESDDVMZECKLRK-UHFFFAOYSA-N 484.921 5.061 5 20 JKBD O=C(COC(=O)c1cc(-c2ccccn2)nc2ccccc12)Nc1ccc(C(F)(F)F)cc1[N+](=O)[O-] 793171962 GSDQABGNXVBRNU-UHFFFAOYSA-N 496.401 5.019 5 20 JKBD CCc1cccc(C)c1NC(=O)COC(=O)c1ccc(Sc2nc(C)cs2)c([N+](=O)[O-])c1 849119984 HOWMNIHYBSKTIZ-UHFFFAOYSA-N 471.560 5.177 5 20 JKBD COC1(c2noc(C/C(=C/c3ccc([N+](=O)[O-])cc3)c3nc4ccccc4s3)n2)CCOCC1 904816770 PPURGNHKKFSHQU-VKAVYKQESA-N 478.530 5.023 5 20 JKBD Cc1ccc(-n2ncc(C(=O)O[C@@H](C)c3nnc(-c4ccc([N+](=O)[O-])cc4)o3)c2C(F)(F)F)cc1 915528442 CZMIPYNJAFWBMU-ZDUSSCGKSA-N 487.394 5.076 5 20 JKBD Cc1ccc(Sc2ccc(C(=O)Nc3ccc(N4CCC(O)CC4)cc3)cc2[N+](=O)[O-])cc1 915644338 YYTMTDPFEUBBMS-UHFFFAOYSA-N 463.559 5.268 5 20 JKBD COc1ccccc1N(Cc1csc(C(C)(C)C)n1)S(=O)(=O)c1cc([N+](=O)[O-])ccc1Cl 915670800 GCYULYLRYUEGRQ-UHFFFAOYSA-N 496.010 5.406 5 20 JKBD Cc1ccc(C(=O)O[C@@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2ccccc2)c(Cl)n1 919252572 ZBAYXJXLVVKKSW-GOSISDBHSA-N 460.273 5.142 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)c3cc(Cl)c(F)cc3F)CCC2)cc1)c1ccc([N+](=O)[O-])o1 1785751011 DYUAFBMZDVKIPK-UHFFFAOYSA-N 475.835 5.181 5 20 JKBD O=C(/C=C/c1ccc([N+](=O)[O-])o1)Nc1ccc(C2(NC(=O)c3ccc4ncccc4c3)CCC2)cc1 1786204387 BWHYSGLHQCSOPY-FMIVXFBMSA-N 482.496 5.197 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)NC1(c2ccc(NC(=O)c3cc(C(F)F)no3)cc2)CCC1 1788308780 IETWMSPHECTYPN-UHFFFAOYSA-N 488.422 5.029 5 20 JKBD Cc1nc2cc(C(=O)N[C@@H]3C[C@@H]4CC[C@H](C3)N4C(=O)c3cc(Cl)cc([N+](=O)[O-])c3C)ccc2s1 1800711354 KPZOWPHQSYFHRY-BCDXTJNWSA-N 498.992 5.040 5 20 JKBD CC[C@@H](C)[C@H](C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)/C=C/c1ccccc1[N+](=O)[O-])c1ccccc1 1804338112 CFQAEBKAFCMULJ-QRFUWWTNSA-N 475.589 5.076 5 20 JKBD Cc1c(C(=O)NC[C@H]2CCN(C(=O)[C@H]3CC[C@H](C)CC3)[C@@H]2c2cccnc2)cc(Cl)cc1[N+](=O)[O-] 1811796077 CTXIAYLNILNXAQ-UKWAKIAUSA-N 499.011 5.098 5 20 JKBD CC1(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)CSc3ccccc3[N+](=O)[O-])n[nH]2)CCCCC1 1822313519 SCPOFDJUKMLJNQ-GOSISDBHSA-N 485.610 5.073 5 20 JKBD O=C(c1cc2cc([N+](=O)[O-])ccc2s1)N1CCC([C@H]2CCCCN2C(=O)c2ccc(O)cc2)CC1 1830043933 OXDNGYVHNSLIPP-JOCHJYFZSA-N 493.585 5.062 5 20 JKBD Cc1ccc(F)cc1C(=O)N1CCC([C@@H]2CCCCN2C(=O)CSc2ccccc2[N+](=O)[O-])CC1 1831775235 IQODLNZWZVQNOL-QFIPXVFZSA-N 499.608 5.068 5 20 JKBD O=C(c1cc2cc([N+](=O)[O-])ccc2s1)N1CC2(CCCN2C(=O)c2cc(Cl)sc2Cl)C1 1844566502 IYVIVCWCRHMIHR-UHFFFAOYSA-N 496.397 5.309 5 20 JKBD O=C(Nc1ccc(Cl)c([N+](=O)[O-])c1)[C@@H](Sc1ncnc2sccc12)c1ccccc1 15277176 HNOYUKYDALCVMH-KRWDZBQOSA-N 456.936 5.725 5 20 JKBD Cc1cc(CSc2ccccc2C(=O)O[C@H](C)C(=O)Nc2cc([N+](=O)[O-])ccc2Cl)on1 16542529 CRBGAXJDFRNCHI-CYBMUJFWSA-N 475.910 5.021 5 20 JKBD Cc1occc1-c1nnc(S[C@@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2C)n1Cc1ccccc1 23607457 FRNHJKXDKFFJTC-KRWDZBQOSA-N 477.546 5.231 5 20 JKBD COC(=O)c1ccc(OCc2csc(N(C(C)=O)c3cccc(C(F)(F)F)c3)n2)c([N+](=O)[O-])c1 26270741 LCYRZVKEQKECKW-UHFFFAOYSA-N 495.435 5.120 5 20 JKBD O=C(NCc1ccco1)Nc1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2Sc2ccccc2)cc1 26835269 AGZOVBIYGBBWPN-UHFFFAOYSA-N 488.525 5.913 5 20 JKBD CC(=O)Nc1ccc(NC(=O)COc2ccc([N+](=O)[O-])cc2Cc2ccccc2)c(C(F)(F)F)c1 28168781 VNADBMQZYZASNL-UHFFFAOYSA-N 487.434 5.180 5 20 JKBD Cc1cc(Cc2cnc(NC(=O)c3ccc(Cl)cc3[N+](=O)[O-])s2)ccc1Br 71960558 CNTHGFPABBBITH-UHFFFAOYSA-N 466.744 5.619 5 20 JKBD CCCOc1ccc(NC(=O)c2ccc([N+](=O)[O-])cc2I)cc1OCCC 72068497 ODKMNIIXTXFVNU-UHFFFAOYSA-N 484.290 5.029 5 20 JKBD O=C(Cc1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1)Nc1cc(F)c(F)cc1F 78509448 FNXWXHYWFUOQEH-UHFFFAOYSA-N 452.392 5.046 5 20 JKBD O=C(CSc1ccc(C(F)(F)F)cc1[N+](=O)[O-])N[C@H](C(=O)Nc1ccccc1)c1ccccc1 107644706 UAQZDVIFOYHOMW-NRFANRHFSA-N 489.475 5.202 5 20 JKBD Cn1ccnc1C(=O)c1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2Sc2ccc(Cl)cc2)cc1 491256192 RCCNRKRVYCLQSB-UHFFFAOYSA-N 492.944 5.616 5 20 JKBD Cc1cc(SC2CCCCC2)ccc1NC(=O)N1CCN(C(=O)c2ccc([N+](=O)[O-])s2)CC1 498919262 OCFDHZCRUJUDKC-UHFFFAOYSA-N 488.635 5.379 5 20 JKBD CCOC(=O)CC1CCN(C(=O)C/C(=C\c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)CC1 502905535 YNTITZAEHXHZPZ-HMMYKYKNSA-N 493.585 5.327 5 20 JKBD C[C@H](Nc1ccc(C(=O)N2CCC(Cc3ccc(F)cc3)CC2)cc1[N+](=O)[O-])c1ccccn1 504928509 CTEBQHHNALPULZ-SFHVURJKSA-N 462.525 5.397 5 20 JKBD CN1CCC(N(Cc2ccco2)C(=O)c2ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])cc2)CC1 505886056 YPAKJSNALCKMIE-UHFFFAOYSA-N 469.925 5.370 5 20 JKBD CC(C)Oc1ccc(NC(=O)c2ccc(N[C@H](C)c3ccccn3)c([N+](=O)[O-])c2)cc1Cl 506176742 AZHQNHIHQVTHDH-OAHLLOKOSA-N 454.914 5.856 5 20 JKBD CCN(C(=O)c1cc(OC)c(OCc2cscn2)cc1[N+](=O)[O-])c1cccc2ccccc12 512349877 BXYKKPHNLGKXDU-UHFFFAOYSA-N 463.515 5.459 5 20 JKBD COc1ccc(Cl)cc1-c1cc(NC(=O)c2ccc(N[C@H](C)c3ccccn3)c([N+](=O)[O-])c2)n[nH]1 512847633 XXPKBVJUNAFNQZ-CQSZACIVSA-N 492.923 5.467 5 20 JKBD O=C(Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1)[C@@H]1CCCN(C(=O)c2cccc3ccccc23)C1 514312744 OFVVNJLIYRLIJR-LJQANCHMSA-N 486.553 5.362 5 20 JKBD Cc1csc(-c2cccc(NC(=O)c3ccc(NS(=O)(=O)c4cccc([N+](=O)[O-])c4)cc3)c2)n1 522604986 HXFFNJNWBSOEBS-UHFFFAOYSA-N 494.554 5.080 5 20 JKBD CSc1ccc(C(=O)c2ccccc2C(=O)Nc2cccc(OC[C@@H]3CCCO3)c2)cc1[N+](=O)[O-] 603496579 YNDYDBSWIFFDGA-FQEVSTJZSA-N 492.553 5.358 5 20 JKBD CN(Cc1ccccc1[N+](=O)[O-])C(=O)NCc1ccccc1-c1ccc(CN2CCCC2)cc1 603807159 VJPSPOMZGXTMJW-UHFFFAOYSA-N 458.562 5.199 5 20 JKBD C[C@H](N[C@@H](C)c1ccc(NC(=O)c2ccc(F)cc2)cc1)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl 604047832 WVOOXLBYAVXPHS-GJZGRUSLSA-N 484.915 5.317 5 20 JKBD O=C(NCc1cc2c(s1)CCCC2)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 604099082 QVIRSILNBOEEIR-UHFFFAOYSA-N 467.513 5.087 5 20 JKBD C[C@@H]1C[C@@H](C)CN(c2ccc(C(=O)Nc3ccc(Sc4nncs4)cc3)cc2[N+](=O)[O-])C1 604119625 XHMMNUHSNMLTGI-HUUCEWRRSA-N 469.592 5.332 5 20 JKBD O=C(Nc1ccc2ncccc2c1)c1ccc(C(=O)Nc2ccc3ncccc3c2)c([N+](=O)[O-])c1 609044483 IXBWCUCZJQYQFL-UHFFFAOYSA-N 463.453 5.196 5 20 JKBD CN(CCCCCc1cc(-c2cccc(F)c2)no1)C(=O)c1cc([N+](=O)[O-])ccc1N1CCCC1 746018283 OUWZLAJYECDZLP-UHFFFAOYSA-N 480.540 5.474 5 20 JKBD O=C(/C=C\c1ccc([N+](=O)[O-])cc1)O[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1 798128087 MLMREOSKVBZGHO-NSDWXSQCSA-N 481.848 5.093 5 20 JKBD Cc1cc(C)n([C@H](C)C(=O)Nc2ccc(NCc3ccc(Cl)cc3[N+](=O)[O-])cc2Cl)n1 864007293 FTSQZBMURHRSCI-CQSZACIVSA-N 462.337 5.527 5 20 JKBD CC1=C(C(=O)Nc2ccccc2C)[C@@H](c2ccc([N+](=O)[O-])cc2)NC(=S)N1c1ccccc1Cl 887932423 GAPXFQJCNSSTOH-HSZRJFAPSA-N 492.988 5.905 5 20 JKBD CN(C(=O)COC(=O)c1cc(-c2nc3ccccc3s2)nc2ccccc12)c1ccc([N+](=O)[O-])cc1 899923336 IHORHKMAWPQWRW-UHFFFAOYSA-N 498.520 5.240 5 20 JKBD Cc1csc(Sc2ccc(-c3nc(C4(NC(=O)OC(C)(C)C)CCC4)no3)cc2[N+](=O)[O-])n1 904558206 VRNPZLZTWQJDTJ-UHFFFAOYSA-N 489.579 5.465 5 20 JKBD COc1cc(C(=O)OCc2nc(C(C)(C)C)no2)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 906824283 YVUMREFSOMGQEY-UHFFFAOYSA-N 461.858 5.087 5 20 JKBD COc1ccc2ccccc2c1CNc1cc([N+](=O)[O-])c(OC)c(Br)c1[N+](=O)[O-] 913047327 VDKWUAAJIZTLHV-UHFFFAOYSA-N 462.256 5.048 5 20 JKBD C[C@H](OC(=O)[C@H](C)Sc1ccccc1Cl)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 919507669 VKPYOMHESHSLDT-QWRGUYRKSA-N 476.860 5.318 5 20 JKBD Cc1cccc2cc(C(=O)NC3(c4ccc(NC(=O)c5ccc([N+](=O)[O-])o5)cc4)CCC3)[nH]c12 1785750858 XYGIUMQEQVVNQE-UHFFFAOYSA-N 458.474 5.039 5 20 JKBD O=C(NC1(c2ccc(NC(=O)c3cc4cc[nH]c4cc3Cl)cc2)CCC1)c1ccc([N+](=O)[O-])[nH]1 1789073660 FYXILGQMTIEROK-UHFFFAOYSA-N 477.908 5.119 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)C3CC(F)(F)C3)CCC2)cc1)c1cc2cc([N+](=O)[O-])ccc2s1 1791008974 YLNCBLGSGWIUSY-UHFFFAOYSA-N 485.512 5.603 5 20 JKBD Cc1cc(CCCC(=O)N2CCCC[C@H]2c2cc(NC(=O)[C@@H]3CC=CCC3)n[nH]2)c([N+](=O)[O-])cc1F 1814788596 IECPUYXRLWMKHP-GCJKJVERSA-N 497.571 5.137 5 20 JKBD O=C(Cc1ccccc1)Nc1cc([C@H]2CCCCN2C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)[nH]n1 1816892830 PLZBNRQVXUSKEJ-HXUWFJFHSA-N 489.557 5.081 5 20 JKBD Cc1c(C(=O)N2CCC([C@@H]3CCCCN3C(=O)c3ccccc3F)CC2)cc(Cl)cc1[N+](=O)[O-] 1829879882 VUGTZMXASHPPNM-QFIPXVFZSA-N 487.959 5.243 5 20 JKBD Cc1c(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)CCC(F)(F)F)CC2)cc(Cl)cc1[N+](=O)[O-] 1830736379 WEUBRWNDKOVBFP-GOSISDBHSA-N 489.922 5.132 5 20 JKBD O=C(c1cc(F)cc([N+](=O)[O-])c1)N1CCC([C@@H]2CCCCN2C(=O)c2ccccc2C2CC2)CC1 1832556078 NYANWASJRJPKMF-VWLOTQADSA-N 479.552 5.158 5 20 JKBD CCCCCc1ncc(C(=O)N2CC3(CCCN3C(=O)c3cc4cc([N+](=O)[O-])ccc4s3)C2)s1 1845739537 KFGJXRYDPRBMBZ-UHFFFAOYSA-N 498.630 5.130 5 20 JKBD Cc1cc(Cl)ccc1NC(=O)COC(=O)c1ccccc1C(=O)c1ccc(Cl)c([N+](=O)[O-])c1 11029146 PZYYCTXBDJUKJT-UHFFFAOYSA-N 487.295 5.237 5 20 JKBD COC(=O)c1ccc(C)c(NC(=O)c2ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])c(OC)c2)c1 14662991 SCBMOGMPBGOLQY-UHFFFAOYSA-N 470.865 5.396 5 20 JKBD O=C1c2ccccc2N[C@H](c2ccc(Oc3ccc(F)cc3)c([N+](=O)[O-])c2)N1C[C@@H]1CCCO1 15503686 HXHFMWFSIUEVIB-CYFREDJKSA-N 463.465 5.272 5 20 JKBD Cc1cccc([N+](=O)[O-])c1NC(=O)COC(=O)c1ccccc1-c1ncc(-c2ccccc2)o1 19164881 UANLSZUSPMLYLO-UHFFFAOYSA-N 457.442 5.021 5 20 JKBD Cc1ccc(NC(=O)[C@@H](OC(=O)c2cc(Cl)ccc2[N+](=O)[O-])c2ccccc2)c([N+](=O)[O-])c1 23515082 PBXNMVZXFNQCES-FQEVSTJZSA-N 469.837 5.002 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Cl)[C@H](Nc1ccc(N2CCCC2=O)c(Cl)c1)c1ccccc1 25211141 CMPPVVHNNGISDG-HSZRJFAPSA-N 499.354 5.820 5 20 JKBD CC(C)C(=O)Nc1cccc(N[C@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2ccccc2)c1 27003025 TVRFSDQVZRMUOS-QFIPXVFZSA-N 466.925 5.635 5 20 JKBD O=C(NC1C[C@@H](C(F)(F)F)C[C@H](C(F)(F)F)C1)c1cc([N+](=O)[O-])ccc1NCc1ccccc1 32041669 DGSASVVIMJUNPR-GJZGRUSLSA-N 489.416 5.846 5 20 JKBD Cc1csc(Sc2ccc(NC(=O)C3CCN(c4ccccc4[N+](=O)[O-])CC3)c(C)c2)n1 303100608 HMSASCIXKXPJGT-UHFFFAOYSA-N 468.604 5.674 5 20 JKBD Cc1ccc(NC(=O)c2ccc(N[C@H](C)c3ccccn3)c([N+](=O)[O-])c2)cc1OCC(F)F 303205472 YSGVIEYNRSZINM-OAHLLOKOSA-N 456.449 5.368 5 20 JKBD CC(C)CCOC1CCN(C(=O)c2ccccc2NC(=O)c2ccc([N+](=O)[O-])cc2Cl)CC1 485756849 UUTKYGGRUUOYHO-UHFFFAOYSA-N 473.957 5.168 5 20 JKBD Cc1csc(Sc2ccc(C(=O)N(C)CCCc3cc(-c4ccccc4)n[nH]3)cc2[N+](=O)[O-])n1 486661784 DULSLLVMDSACSB-UHFFFAOYSA-N 493.614 5.606 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Cl)[C@H](N[C@@H](CN1CCCC1)c1ccccc1)c1ccccc1 493536739 LVMURQOGZQUUNO-LOSJGSFVSA-N 478.980 5.355 5 20 JKBD CC(=O)Nc1cccc(Nc2nnc(S[C@H](C)c3nnc(-c4ccc([N+](=O)[O-])cc4)o3)s2)c1 497330537 ZYKVAWLKWOTGKO-LLVKDONJSA-N 483.535 5.052 5 20 JKBD COc1ccc(N(C(=O)c2cc(OC)c(OCc3cscn3)cc2[N+](=O)[O-])[C@@H](C)C2CC2)cc1 499585722 JNERYWZVKOWCEV-HNNXBMFYSA-N 483.546 5.093 5 20 JKBD C[C@@H]1Cc2cc([N+](=O)[O-])ccc2N1C(=O)Cc1ccc(NC(=O)c2ccc(Br)cc2)cc1 504305547 WCCDWQPTZJUNOV-OAHLLOKOSA-N 494.345 5.130 5 20 JKBD COc1ccc(-c2[nH]c3ccccc3c2CCC(=O)N2c3ccc([N+](=O)[O-])cc3C[C@@H]2C)c(OC)c1 504376306 ITRYNODPKYPEJR-KRWDZBQOSA-N 485.540 5.671 5 20 JKBD CN(c1ccccc1)c1ccc(CNCc2ccc(NC(=O)c3cccnc3)cc2)cc1[N+](=O)[O-] 507952759 GJVXZQUAVZYOOS-UHFFFAOYSA-N 467.529 5.300 5 20 JKBD O=C(N[C@@H](c1ccc(Cl)cc1)c1cccs1)c1ccc([N+](=O)[O-])cc1I 508957628 CCYHPCAFZSNVRC-KRWDZBQOSA-N 498.729 5.434 5 20 JKBD COc1cc(C(=O)N(Cc2ccccc2C(F)(F)F)C2CCCC2)c([N+](=O)[O-])cc1OC 511878835 ZAALUNQHUBAXTF-UHFFFAOYSA-N 452.429 5.216 5 20 JKBD Cc1ccc(C(=O)Nc2nc(-c3cccc([N+](=O)[O-])c3)cs2)cc1NC(=O)c1ccccc1F 515215978 AKVJWCWXACWMSX-UHFFFAOYSA-N 476.489 5.670 5 20 JKBD CCCNC(=O)c1ccc(NC(=O)c2ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])cc2)cc1 515667004 ANQAHPHXDOJMLH-UHFFFAOYSA-N 453.882 5.433 5 20 JKBD O=C(C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)Nc1ccc(NC(=O)C2CC2)nc1 518743057 KLVDENBQPIGWPZ-AQTBWJFISA-N 499.552 5.517 5 20 JKBD Cc1ccc(-c2nc(C)c([C@H](C)Nc3cnn(-c4ccc([N+](=O)[O-])cc4)c(=O)c3Cl)s2)cc1 520754764 CZDKACMJOLNFOK-AWEZNQCLSA-N 481.965 5.708 5 20 JKBD C[C@@H](NCc1ccc(Oc2ccccc2Cl)c([N+](=O)[O-])c1)c1cccc(S(=O)(=O)N(C)C)c1 520963652 WFYMQMSNTWYRMW-MRXNPFEDSA-N 489.981 5.142 5 20 JKBD CCOc1cc(NC(=O)N2CCCC[C@@H]2c2cc3ccccc3[nH]2)c([N+](=O)[O-])cc1OCC 521253499 CCOVWRDFDTUALG-HXUWFJFHSA-N 452.511 5.633 5 20 JKBD Cc1ccc(NC(=O)[C@@H]2CCc3ccccc3N2C(=O)c2cc3cc([N+](=O)[O-])ccc3o2)cc1 524034600 NWTUZUQGZJIURV-QFIPXVFZSA-N 455.470 5.250 5 20 JKBD CCOc1ccc(CN(C)C(=O)c2ccccc2C(=O)c2ccc(SC)c([N+](=O)[O-])c2)cc1 603467120 OHGIJMLJDRRNGT-UHFFFAOYSA-N 464.543 5.219 5 20 JKBD COc1cc(C(=O)N[C@@H](C)c2ccc3nc(O)[nH]c3c2)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 603919019 OGBSOIPYCOQFMO-LBPRGKRZSA-N 482.880 5.122 5 20 JKBD CCOC1CCN(C(=O)c2c3c(nc4ccccc24)/C(=C\c2ccc([N+](=O)[O-])cc2)CCC3)CC1 604255731 GDFSBYDGMCRVOR-ZZEZOPTASA-N 471.557 5.661 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Cl)[C@H](Nc1cccc(OCC(F)(F)F)c1)c1ccccc1 604469133 JMIKLGVVSRHQNX-HXUWFJFHSA-N 479.842 5.981 5 20 JKBD Cc1cc([N+](=O)[O-])ccc1C(=O)Nc1nc(-c2ccc(OC(F)F)cc2OC(F)F)cs1 604567542 IUHYRJLZEKJMHP-UHFFFAOYSA-N 471.388 5.482 5 20 JKBD COc1cccc(N2CC[C@@H](CNC(=O)c3ccc(Oc4ccc(Cl)cc4[N+](=O)[O-])cc3)C2)c1 608826136 CIDAAHSALHPAGP-KRWDZBQOSA-N 481.936 5.305 5 20 JKBD COc1cc(C(=O)Nc2ccc(Oc3cccc(F)c3)c3ccncc23)c([N+](=O)[O-])cc1OC 609105949 RCCAEIVCOHQQHX-UHFFFAOYSA-N 463.421 5.344 5 20 JKBD CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccc(N2CCc3sccc3C2)nc1 609147711 OZDPWKUFHKNUIQ-UHFFFAOYSA-N 451.552 5.057 5 20 JKBD CC(C)n1ncc2cc(NC(=O)c3cc([N+](=O)[O-])ccc3Sc3ccc(Cl)cc3)cnc21 610912633 PPDDSPRPVNVVRE-UHFFFAOYSA-N 467.938 5.977 5 20 JKBD C[C@@H](OC(=O)c1cc([N+](=O)[O-])ccc1Br)c1cccc(NC(=O)c2ccccc2)c1 725984844 CIOPJQNIIDCMMW-CQSZACIVSA-N 469.291 5.528 5 20 JKBD CC(=O)c1cc(Br)ccc1OC(=O)c1ccc(N[C@H](C)c2ccccn2)c([N+](=O)[O-])c1 727965507 PKARJMYPFAIAJL-CYBMUJFWSA-N 484.306 5.347 5 20 JKBD O=C(COc1ccc([N+](=O)[O-])c(F)c1)N(Cc1ccc(Cl)c(Cl)c1)Cc1ccccn1 748641671 WYMJNWPFLAWHQT-UHFFFAOYSA-N 464.280 5.044 5 20 JKBD COc1ccc(CSc2nnc(SCC(=O)Nc3cc(Cl)ccc3[N+](=O)[O-])s2)cc1 799666076 WFJQAFYMVONJIT-UHFFFAOYSA-N 482.996 5.131 5 20 JKBD CCOC(=O)Nc1ccc(NC(=O)Cc2cn(-c3ccccc3)nc2-c2ccc([N+](=O)[O-])cc2)cc1 916069594 TXMQXHPKLONOKO-UHFFFAOYSA-N 485.500 5.197 5 20 JKBD C[C@H](Sc1cc(Cl)ccc1Cl)C(=O)OCc1nnc(-c2ccc([N+](=O)[O-])cc2)o1 917327023 DSZWOAMLIBAJGD-JTQLQIEISA-N 454.291 5.176 5 20 JKBD Cc1cc(Cl)ccc1NC(=O)[C@H](C)OC(=O)c1ccc(N[C@H](C)c2ccccn2)c([N+](=O)[O-])c1 920548157 QEVMJDFUGPZTCU-CVEARBPZSA-N 482.924 5.309 5 20 JKBD Cc1ccc(NC(=O)c2cccc(C(F)(F)F)c2)cc1NS(=O)(=O)c1cc(F)ccc1[N+](=O)[O-] 920834822 YTTXJKSEXBMZHV-UHFFFAOYSA-N 497.426 5.114 5 20 JKBD O=C(/C=C/c1ccc([N+](=O)[O-])o1)Nc1ccc(C2(NC(=O)Cc3c[nH]c4ccccc34)CCC2)cc1 1786207746 LPVJMQWKCLYTKQ-ZRDIBKRKSA-N 484.512 5.059 5 20 JKBD O=C(CCc1cccc([N+](=O)[O-])c1)Nc1ccc(C2(NC(=O)c3scnc3C3CC3)CCC2)cc1 1786602571 STUCGNBOTMEZRP-UHFFFAOYSA-N 490.585 5.309 5 20 JKBD C[C@@H](Nc1ccccc1)C(=O)Nc1ccc(C2(NC(=O)CCc3cccc([N+](=O)[O-])c3)CCC2)cc1 1789467588 WXKMHIHIQVOVGY-HXUWFJFHSA-N 486.572 5.162 5 20 JKBD O=C(/C=C/c1ccc([N+](=O)[O-])o1)NC1(c2ccc(NC(=O)c3ccc(-c4cc[nH]n4)cc3)cc2)CCC1 1790737447 UUNYTEKUMYNOJL-ZRDIBKRKSA-N 497.511 5.039 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)[C@@H]3C[C@@H]3c3ccccc3)CCC2)cc1)c1nc2cc([N+](=O)[O-])ccc2[nH]1 1790827803 SGLLGVNSKZVTFM-FGZHOGPDSA-N 495.539 5.023 5 20 JKBD Cc1c(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)Cc2ccc(C(C)C)cc2)C3)cc(Cl)cc1[N+](=O)[O-] 1800711876 CJOQVQRFGGECCM-KOUNCHBCSA-N 483.996 5.175 5 20 JKBD C[C@H](C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc2cc([N+](=O)[O-])ccc2s1)c1ccc(Cl)cc1 1801206183 TUKSSSNMTKWUKZ-GAZPGATBSA-N 498.004 5.518 5 20 JKBD O=C(Nc1cc([C@@H]2CCCCN2C(=O)[C@@H]2CC=CCC2)[nH]n1)c1cc2cc([N+](=O)[O-])ccc2s1 1821610866 IYCJZDSHJCYJND-BEFAXECRSA-N 479.562 5.195 5 20 JKBD O=C(/C=C/c1ccccc1[N+](=O)[O-])Nc1cc([C@@H]2CCCCN2C(=O)c2cc3ccccc3o2)[nH]n1 1823505084 UYXPIQLWHOKGGO-IWGBCORSSA-N 485.500 5.083 5 20 JKBD CC1(C)CCC(CC(=O)N2CCC([C@H]3CCCCN3C(=O)c3ccc([N+](=O)[O-])o3)CC2)CC1 1823615610 UBLSKHZDBNYGJP-HXUWFJFHSA-N 459.587 5.028 5 20 JKBD Cc1cccc(C(=O)N2CCC([C@H]3CCCCN3C(=O)Cc3cccc([N+](=O)[O-])c3)CC2)c1Cl 1823683759 MACODOHBEAQDDT-HSZRJFAPSA-N 483.996 5.033 5 20 JKBD Cc1c(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)CC3CCCC3)CC2)cc(Cl)cc1[N+](=O)[O-] 1830736728 ZDDABFGZBKOULJ-JOCHJYFZSA-N 476.017 5.370 5 20 JKBD COc1ccccc1-c1nc(COC(=O)Cn2c3ccccc3c(=O)c3ccccc32)cs1 10722953 DLFZJNCGMMKRSB-UHFFFAOYSA-N 456.523 5.030 5 20 JKBD C[C@@H](OC(=O)COc1ccc(C2SCCCS2)cc1)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl 17268162 GHQUQJMSHMGMJX-CYBMUJFWSA-N 496.994 5.066 5 20 JKBD CCOc1ccccc1-c1nnc(S[C@H](C(=O)Nc2ccc(C)cc2[N+](=O)[O-])c2ccccc2)o1 21545521 JHHLAIIJSDWUGM-QFIPXVFZSA-N 490.541 5.824 5 20 JKBD COc1cccc(N[C@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Br)c2ccccc2)c1 21818481 KCQNGZMLOGJNOV-FQEVSTJZSA-N 456.296 5.158 5 20 JKBD C[C@@H](OC(=O)c1ccc(NCc2ccccc2)c([N+](=O)[O-])c1)C(=O)N1CCC[C@H]1c1cccs1 23768368 WVNBTQIPLQFBHO-UTKZUKDTSA-N 479.558 5.177 5 20 JKBD Cc1c(NC(=O)[C@@H](C)OC(=O)c2ccc(Oc3ccc(C(F)(F)F)cn3)cc2)cccc1[N+](=O)[O-] 28396525 YSMWCAWYYQPVNS-CQSZACIVSA-N 489.406 5.293 5 20 JKBD O=C(Cc1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1)Nc1nc(-c2ccc[nH]2)cs1 29352821 ZWAJNRRALCBELB-UHFFFAOYSA-N 470.514 5.080 5 20 JKBD Cc1ccc(N(C(=O)Cn2c3ccccc3c(=O)c3ccccc32)c2nc3ccccc3s2)c(C)c1 115919046 UYDQYGCGRPBPKE-UHFFFAOYSA-N 489.600 6.746 5 20 JKBD C[C@H]1CCCCN1CC(=O)Nc1ccc(F)c(NC(=O)c2cc3cc([N+](=O)[O-])ccc3s2)c1 117336018 LRHIBMFTWLPAEL-AWEZNQCLSA-N 470.526 5.014 5 20 JKBD CN(C(=O)c1cccc(NC(=O)c2csc(-c3cccc([N+](=O)[O-])c3)n2)c1)c1ccccc1 303039889 PQPUNEYYZXGRQQ-UHFFFAOYSA-N 458.499 5.247 5 20 JKBD C[C@@H]1CCCN(c2ccc(C(=O)Nc3ccccc3NC(=O)C[C@@H]3C=CCC3)cc2[N+](=O)[O-])C1 410092983 FXWSKFWVSIAGEI-RTBURBONSA-N 462.550 5.378 5 20 JKBD O=C(Nc1cccc([N+](=O)[O-])c1)c1cnn(-c2ncc(C(F)(F)F)cc2Cl)c1C(F)(F)F 503139785 NJUYCLMUIBVDIP-UHFFFAOYSA-N 479.724 5.119 5 20 JKBD C[C@@H]1C[C@@H](C)CN(c2ccc(C(=O)N[C@@H](c3ccccc3)c3nccs3)cc2[N+](=O)[O-])C1 505052921 AAGLBHAKCGGFKP-YVHKJVDXSA-N 450.564 5.053 5 20 JKBD Cc1nn(Cc2ccc(C(=O)Nc3cccc(CSc4ccccn4)c3)cc2)c(C)c1[N+](=O)[O-] 512612281 FISJFWYXJBVYGU-UHFFFAOYSA-N 473.558 5.396 5 20 JKBD O=[N+]([O-])c1ccc(Sc2nnc(CN3CCCCC3)n2-c2ccc(OC(F)F)cc2)c(F)c1 513107416 FUTLDTLRFKPOTP-UHFFFAOYSA-N 479.484 5.053 5 20 JKBD O=C(c1ccc(-n2ccnc2)c([N+](=O)[O-])c1)C(c1nc2ccccc2s1)c1nc2ccccc2s1 513692139 JOWVXUQDKRIOHM-UHFFFAOYSA-N 497.561 6.015 5 20 JKBD O=[N+]([O-])c1cc(C(F)(F)F)ccc1Sc1nnc(-c2cccnc2)n1Cc1ccccc1 515164041 LSYZCJIWJVVFHV-UHFFFAOYSA-N 457.437 5.467 5 20 JKBD C[C@H](Nc1ccc(C(=O)N2CC=C(c3c[nH]c4ccccc34)CC2)cc1[N+](=O)[O-])c1ccccn1 518424268 MYDXIPLQZDIJGW-SFHVURJKSA-N 467.529 5.574 5 20 JKBD C[C@@H](N[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1)c1ccc2c(c1)CCC(=O)N2 518472661 UKTLYDTWQWLYOH-MYYSRTQBSA-N 478.936 5.164 5 20 JKBD C[C@@H]1CN(C(=O)C/C(=C/c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)CC(C)(C)O1 518929462 UWRIXCMIVUBXOQ-UWCCDQBKSA-N 451.548 5.161 5 20 JKBD COc1cc(F)cc2sc(NC(=O)c3ccc(N[C@H](C)c4ccccn4)c([N+](=O)[O-])c3)nc12 520468935 OFPSSZKXAHYXOG-GFCCVEGCSA-N 467.482 5.173 5 20 JKBD CN(CCc1ccccn1)C(=O)c1c2c(nc3ccccc13)/C(=C\c1ccc([N+](=O)[O-])cc1)CCC2 565789348 VAZAYGBUJYDMNL-VZCXRCSSSA-N 478.552 5.730 5 20 JKBD O=C(NCCc1ccc(C(F)(F)F)cc1)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 598746557 UVRBNBXCGJCRTJ-UHFFFAOYSA-N 489.416 5.208 5 20 JKBD O=[N+]([O-])c1cc(C(F)(F)F)ccc1CNc1cccc(CS(=O)(=O)Cc2ccccc2)c1 600853520 JKPPRLKXNHNKTC-UHFFFAOYSA-N 464.465 5.341 5 20 JKBD O=C(Nc1ccc(Cl)cc1Cl)[C@@H]1CCCCN1C(=O)c1ccc(NC2CC2)c([N+](=O)[O-])c1 603620290 QNIWYQVMVOXCSJ-IBGZPJMESA-N 477.348 5.109 5 20 JKBD Cc1ccc([N+](=O)[O-])cc1NC(=O)N(CCO)Cc1cccc(OCc2ccccc2Cl)c1 603643150 OUUIANWETMDDMD-UHFFFAOYSA-N 469.925 5.162 5 20 JKBD Cc1c(NC(=O)Cc2ccc(NC(=O)c3cccc(Br)c3)cc2)cccc1[N+](=O)[O-] 603751494 AIDCNVOVEFRQJT-UHFFFAOYSA-N 468.307 5.099 5 20 JKBD CCOc1cc([N+](=O)[O-])c(C(=O)Nc2cc(C(F)(F)F)ccc2-n2nc(C)cc2C)cc1OC 603756474 QZLIYHXIZXALPX-UHFFFAOYSA-N 478.427 5.076 5 20 JKBD O=[N+]([O-])c1cnc2ccc(Br)cc2c1N1CCC(c2nc3ccccc3[nH]2)CC1 603847144 RBMXCGGJXIXIPC-UHFFFAOYSA-N 452.312 5.166 5 20 JKBD Cc1nc(Cc2ccccc2)sc1C(=O)Nc1nc(-c2cccc([N+](=O)[O-])c2)c(C)s1 603997888 WUAGVBRSAVRSEW-UHFFFAOYSA-N 450.545 5.635 5 20 JKBD COc1cc(C(=O)N2CCc3c(cccc3NC(C)=O)C2)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 604192157 NSEIVODDABWWEQ-UHFFFAOYSA-N 495.919 5.206 5 20 JKBD Cc1ccc(C(=O)Nc2ccc([N+](=O)[O-])cc2F)cc1NC(=O)c1ccc(Br)cc1 608871451 SCOSIAIFFGRJCA-UHFFFAOYSA-N 472.270 5.309 5 20 JKBD COc1cc(CNCc2ccc(-c3csc(C)n3)cc2)ccc1OCc1ccc([N+](=O)[O-])cc1 610721801 UUSHYUMJIBJMPI-UHFFFAOYSA-N 475.570 5.904 5 20 JKBD O=C(OCC[C@@H]1CCCCN1C(=O)c1cnc(Cc2ccc(F)cc2)s1)c1cccc([N+](=O)[O-])c1 727102305 ZATPHLUJOUPHQK-FQEVSTJZSA-N 497.548 5.023 5 20 JKBD Cc1cc(OCc2cccc(F)c2)ccc1NC(=O)c1cc([N+](=O)[O-])c(C)c([N+](=O)[O-])c1C 728007015 XYCFYPRLLSAKDY-UHFFFAOYSA-N 453.426 5.399 5 20 JKBD C[C@@H]1CN(c2ccc(NC(=O)c3cc(Cl)ccc3[N+](=O)[O-])cc2C(F)(F)F)C[C@@H](C)O1 728010932 KQAHANCWFXUXIM-VXGBXAGGSA-N 457.836 5.133 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)O[C@@H](C)C(=O)Nc2ccccc2Cc2ccccc2)cc1SC 728658755 WTXZNAAUISXRQP-INIZCTEOSA-N 480.542 5.100 5 20 JKBD O=C(NCc1ccc(NC(=S)Nc2ccc([N+](=O)[O-])cc2)cc1)c1ccc(C(F)(F)F)cc1 730738150 ZVBSEBPQDNJJIP-UHFFFAOYSA-N 474.464 5.353 5 20 JKBD Cc1csc(Sc2ccc(C(=O)N3CCC([C@H](O)c4ccc(F)cc4)CC3)cc2[N+](=O)[O-])n1 731054083 CEHXBJZSFBGUSU-OAQYLSRUSA-N 487.578 5.236 5 20 JKBD O=C(COC(=O)[C@H]1C[C@H]1c1ccc2ccccc2c1)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 731279258 XJSVSJOAYKLXBE-ROUUACIJSA-N 458.392 5.052 5 20 JKBD C[C@H](OC(=O)c1csc(-c2ccc([N+](=O)[O-])cc2)n1)c1nc(-c2cccc(C(F)(F)F)c2)no1 747957704 QEAMPABZXZYMII-NSHDSACASA-N 490.419 5.705 5 20 JKBD Cc1cc(C)c(NC(=O)[C@H](C)OC(=O)c2csc(-c3ccc([N+](=O)[O-])cc3)n2)c(Cl)c1 747958447 NOLBAFMKBAREKQ-ZDUSSCGKSA-N 459.911 5.173 5 20 JKBD COc1ccc(-c2cc(NC(=O)c3cc([N+](=O)[O-])c(C)c([N+](=O)[O-])c3C)ccc2OC(F)F)cc1 748609337 DGGPVJLOXDFFEX-UHFFFAOYSA-N 487.415 5.649 5 20 JKBD Cc1noc(C)c1CN(C)C(=O)c1c2c(nc3ccccc13)/C(=C\c1cccc([N+](=O)[O-])c1)CCC2 915195367 WVLOAMIHMAAVRM-ZHZULCJRSA-N 482.540 5.897 5 20 JKBD C[C@H](Oc1cccc(Cl)c1Cl)C(=O)O[C@@H](C)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 915496603 XPWYFKMTAIKYMP-QWRGUYRKSA-N 452.250 5.023 5 20 JKBD O=C(/C=C/c1ccc([N+](=O)[O-])cc1)Nc1ccc(NC(=O)c2ccccc2)cc1C(F)(F)F 915870772 QFVWJYYCRJNGIC-MDWZMJQESA-N 455.392 5.518 5 20 JKBD CC(=O)N(c1ccc(C)cc1)c1nc(/C=C(/Cl)c2nc3cc([N+](=O)[O-])ccc3[nH]2)cs1 917559654 MDLKASRQWJWSTI-RQZCQDPDSA-N 453.911 5.658 5 20 JKBD O=C(Nc1ccccc1SC[C@@H]1CC1(Cl)Cl)c1ccc(N2CCCC2)c([N+](=O)[O-])c1 917749018 HHPZOTJQWHNRFP-HNNXBMFYSA-N 466.390 5.733 5 20 JKBD Cc1ccc(NC(=O)c2cccc(C(F)(F)F)c2)cc1NS(=O)(=O)c1cccc(F)c1[N+](=O)[O-] 920834674 NXHMGPQELFYSID-UHFFFAOYSA-N 497.426 5.114 5 20 JKBD C[C@H](NC(=O)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1)c1ccc(N2CCOC2=O)cc1 920952712 QTOXMFZKBJYPDO-HNNXBMFYSA-N 481.892 5.488 5 20 JKBD O=C(/C=C/c1cccnc1)Nc1ccc(C2(NC(=O)C3(c4cccc([N+](=O)[O-])c4)CCC3)CCC2)cc1 1786926225 DSNKHIGFXJUVFB-MDWZMJQESA-N 496.567 5.259 5 20 JKBD CCc1cc(C(=O)Nc2ccc(C3(NC(=O)CCc4cccc([N+](=O)[O-])c4)CCC3)cc2)cc(C)n1 1788835960 QQUZRRLFMOHVNZ-UHFFFAOYSA-N 486.572 5.241 5 20 JKBD COc1cc(C(=O)Nc2ccc(C3(NC(=O)c4cc5ccccc5n4C)CCC3)cc2)ccc1[N+](=O)[O-] 1792164700 RFYPPHQGJBVOPX-UHFFFAOYSA-N 498.539 5.157 5 20 JKBD Cc1ccc(CCC(=O)Nc2ccc(C3(NC(=O)c4nc[nH]c4[N+](=O)[O-])CCC3)cc2)c2ccccc12 1792388842 ZEZZVECCGHULHX-UHFFFAOYSA-N 497.555 5.160 5 20 JKBD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1sc2ccccc2c1Cl)c1ccc([N+](=O)[O-])cc1F 1797463478 YYFCFIVMOPBOON-BTTYYORXSA-N 487.940 5.168 5 20 JKBD CCC1(C(=O)N2CC[C@@H](CNC(=O)c3cc4cc([N+](=O)[O-])ccc4s3)[C@H]2c2cccnc2)CCC1 1812303980 SYNQOORFPZIQBB-FDDCHVKYSA-N 492.601 5.104 5 20 JKBD O=C(Nc1cc([C@@H]2CCCCN2C(=O)/C=C/c2ccc([N+](=O)[O-])o2)[nH]n1)c1cccc2ccccc12 1818450708 KQABMFCHRIOXGH-SDNYCIMKSA-N 485.500 5.083 5 20 JKBD CCC1(C(=O)Nc2cc([C@H]3CCCCN3C(=O)C3(c4cccc([N+](=O)[O-])c4)CCC3)[nH]n2)CCC1 1818950242 DGMNAJNVMYCFER-OAQYLSRUSA-N 479.581 5.012 5 20 JKBD CC(C)[C@@H](C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cccc(F)c2[N+](=O)[O-])n[nH]1)c1ccccc1 1821167215 FRCLYXBNQVQWSQ-JTHBVZDNSA-N 493.539 5.203 5 20 JKBD O=C(c1cc2cc([N+](=O)[O-])ccc2s1)N1CCC([C@@H]2CCCCN2C(=O)CCc2ccco2)CC1 1825251699 YYJQVPMNGJGJEZ-QFIPXVFZSA-N 495.601 5.269 5 20 JKBD Cc1c(C(=O)N2CCCC[C@H]2C2CCN(C(=O)/C=C/c3ccc([N+](=O)[O-])o3)CC2)oc2ccccc12 1828125587 VDVBWIWSDYOKBG-CRWWQRIJSA-N 491.544 5.189 5 20 JKBD COc1ccccc1C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cc(Cl)cc([N+](=O)[O-])c2C)CC1 1829909716 SLKPLPQSJUAGFQ-JOCHJYFZSA-N 499.995 5.112 5 20 JKBD Cc1cc(O)c([N+](=O)[O-])cc1C(=O)N1CCC([C@@H]2CCCCN2C(=O)CC2CCC(C)(C)CC2)CC1 1830423087 FYVKELIGFFZXEM-QHCPKHFHSA-N 499.652 5.449 5 20 JKBD O=C(c1ccccc1)N1CCC([C@@H]2CCCCN2C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)CC1 1831060609 AHBVQEOUEZJQOK-QFIPXVFZSA-N 477.586 5.357 5 20 JKBD O=C(c1cc2cc([N+](=O)[O-])ccc2s1)N1CC2(CCCN2C(=O)[C@H]2C[C@H]2c2ccc(Cl)cc2)C1 1843876920 SYJZOMJKPBKDPO-PMACEKPBSA-N 495.988 5.084 5 20 JKBD C[C@@H](Sc1nnc(-c2c[nH]c3ccccc23)n1C1CC1)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl 17882240 PGZLYEFCXGQXND-GFCCVEGCSA-N 482.953 5.442 5 20 JKBD COCCN(C(=O)Cc1csc(-c2ccc(C)cc2)n1)c1nc(-c2ccc([N+](=O)[O-])cc2)cs1 20006489 ZQVOQPAQGTTYII-UHFFFAOYSA-N 494.598 5.372 5 20 JKBD CCS(=O)(=O)c1ccc(NC(=O)c2ccc(Sc3nc4ccccc4s3)c([N+](=O)[O-])c2)cc1 21691949 GETMNIOUFHOZAL-UHFFFAOYSA-N 499.595 5.402 5 20 JKBD O=C(Nc1ccccc1C(=O)NCc1csc(-c2ccccc2)n1)c1ccc([N+](=O)[O-])cc1Cl 23009130 YXKXOINGMYJYQT-UHFFFAOYSA-N 492.944 5.554 5 20 JKBD Cc1ccc(-c2nnc3n2CCCCC3)cc1NC(=O)[C@@H](C)Sc1ccc([N+](=O)[O-])cc1 25849623 PPKFQNXAPUTKGJ-MRXNPFEDSA-N 451.552 5.007 5 20 JKBD O=C(OCc1nnc(-c2ccc([N+](=O)[O-])cc2)o1)/C(=C\c1ccc(F)cc1)c1cccs1 207959435 PRFVHLWCYYLZQN-PDGQHHTCSA-N 451.435 5.129 5 20 JKBD Cc1ccc(-c2nnc(S[C@@H](C)C(=O)Nc3nc(-c4cccc([N+](=O)[O-])c4)cs3)o2)cc1 255941430 MCJDMMSMIBJZOP-ZDUSSCGKSA-N 467.532 5.196 5 20 JKBD O=C(Cc1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1)N1CC[C@@H](c2ccccc2)C1 303033493 XVFWIDXHLNGRAV-JOCHJYFZSA-N 452.514 5.006 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)Nc2ccc(C(=O)N3CCCC[C@H]3C)c(Cl)c2)cc1SC 483446356 ZJSKRHMDMGTOBJ-CYBMUJFWSA-N 477.970 5.246 5 20 JKBD O=c1c2ccc(Cl)cc2nc(Sc2ccc([N+](=O)[O-])c3cnccc23)n1Cc1ccco1 497756916 AFZCNRGRFKMPCL-UHFFFAOYSA-N 464.890 5.299 5 20 JKBD O=C(Cc1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1)Nc1ccc(F)cc1Br 500065011 AKSBWVOLCZTJSN-UHFFFAOYSA-N 495.308 5.530 5 20 JKBD O=C(NC1CCN(CC(F)(F)F)CC1)c1ccc(Sc2nc3ccccc3s2)c([N+](=O)[O-])c1 501220113 YPNRKXQXSGTVLC-UHFFFAOYSA-N 496.536 5.112 5 20 JKBD O=C(Cc1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1)Nc1ccc(OC[C@@H]2CCCO2)cc1 502049819 MLWHRYIJDLMCGS-SANMLTNESA-N 498.539 5.187 5 20 JKBD C[C@H]1Cc2cc([N+](=O)[O-])ccc2N1C(=O)Cc1csc(-c2cc(Br)cs2)n1 504401564 PLXAICOQLKKQCN-JTQLQIEISA-N 464.366 5.063 5 20 JKBD C[C@@H](Nc1ccc(C(=O)N(Cc2cccs2)C[C@@H]2CCCO2)cc1[N+](=O)[O-])c1ccccn1 506164523 SKKOCUWVDNZJLL-MJGOQNOKSA-N 466.563 5.046 5 20 JKBD C[C@H](Nc1ccc(C(=O)Nc2cccc(NC(=O)c3ccncc3)c2)cc1[N+](=O)[O-])c1ccccn1 506205481 RLXNYCYCFRPKMI-KRWDZBQOSA-N 482.500 5.063 5 20 JKBD CN(C(=O)c1ccc(Cl)cc1)c1ccc(NC(=O)c2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)cc1 511604317 FOIOZKSJESYELX-UHFFFAOYSA-N 489.919 5.178 5 20 JKBD Cc1c(NC(=O)[C@@H](C)Sc2nnc(-c3ccccc3)n2[C@@H](C)c2ccccc2)cccc1[N+](=O)[O-] 515574036 CQTXNBRBKJMRKZ-RBUKOAKNSA-N 487.585 5.890 5 20 JKBD COc1ccc(CCCN(C)C(=O)Cc2cn(-c3ccccc3)nc2-c2ccc([N+](=O)[O-])cc2)cc1 515985897 NJRIRVYCJKZWOJ-UHFFFAOYSA-N 484.556 5.090 5 20 JKBD Cc1nn(Cc2ccc(C(=O)Nc3ccc(F)c(NC(=O)C4CCCCC4)c3)cc2)c(C)c1[N+](=O)[O-] 603672228 NWYTZGCBAVOASR-UHFFFAOYSA-N 493.539 5.367 5 20 JKBD Cc1nn(-c2ccc(Cl)cc2Cl)c(C)c1CC(=O)Nc1cc2c(cc1[N+](=O)[O-])OCCCO2 603733611 GYSSKSJACUFPGY-UHFFFAOYSA-N 491.331 5.047 5 20 JKBD C[C@@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)Nc1c(-c2ccc(Cl)cc2)c(C(F)(F)F)nn1C 609026500 IBOPPQVBWKOMKE-LLVKDONJSA-N 484.887 5.787 5 20 JKBD CC(C)Oc1ccc(NC(=S)/C(=C(/O)c2ccc([N+](=O)[O-])cc2)[n+]2ccc(C(C)(C)C)cc2)cc1 726574835 UDQIHBROCYQKIN-UHFFFAOYSA-O 492.621 6.290 5 20 JKBD O=[N+]([O-])c1ccc(S(=O)(=O)Nc2nc3ccc(SC(F)F)cc3s2)cc1Br 727242611 DULGDKJTKDKTKZ-UHFFFAOYSA-N 496.336 5.083 5 20 JKBD Cc1ccc(OCc2nc(CC(=O)N(CC3CC3)c3ccc(Cl)c([N+](=O)[O-])c3)cs2)cc1 745344432 CIRSHWWQDCNGLL-UHFFFAOYSA-N 471.966 5.578 5 20 JKBD O=C(Nc1ccccc1C(=O)OCc1ncc(-c2ccc(F)cc2)o1)c1ccc([N+](=O)[O-])cc1Cl 746127040 CXNOJMONGDWQSL-UHFFFAOYSA-N 495.850 5.652 5 20 JKBD CC1=C(C(=O)Nc2ccc(F)cc2)[C@@H](c2ccc([N+](=O)[O-])o2)NC(=S)N1c1cc(C)ccc1C 812731674 QHZUELNPTKLBFE-JOCHJYFZSA-N 480.521 5.292 5 20 JKBD Cc1cc[n+](/C(C(=S)Nc2ccccc2C(F)(F)F)=C(/O)c2ccc([N+](=O)[O-])cc2)cc1 912791439 OQIGRNIMGKGHIX-UHFFFAOYSA-O 460.457 5.533 5 20 JKBD O=C(Nc1cc([N+](=O)[O-])c(F)cc1F)[C@H](Oc1ccccc1Br)c1ccccc1 916042967 OQOKUVNVMSWKDL-LJQANCHMSA-N 463.234 5.394 5 20 JKBD COc1ccccc1NC(=O)c1cc2ccccc2cc1OC(=O)Cc1ccccc1[N+](=O)[O-] 916879163 OJORKUWDKOCFNS-UHFFFAOYSA-N 456.454 5.157 5 20 JKBD Cc1cc(C)c2cc(C(=O)O[C@H](C)C(=O)Nc3ccc([N+](=O)[O-])cc3C(F)(F)F)sc2n1 917351422 VBCWGOGSEHYNTA-LLVKDONJSA-N 467.425 5.024 5 20 JKBD O=C(NCc1ccc([N+](=O)[O-])cc1)c1ccccc1Sc1ccc(C(F)(F)F)cc1[N+](=O)[O-] 917790709 SGOWTOJZGVHUQQ-UHFFFAOYSA-N 477.420 5.603 5 20 JKBD Cc1ccc(C(C)C)c(O[C@H](C)C(=O)O[C@@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2C(F)(F)F)c1 919446681 HIZSQMXXSYLDEK-LSDHHAIUSA-N 482.455 5.383 5 20 JKBD O=C(Nc1ccc(-c2nnco2)cc1)c1cc([N+](=O)[O-])ccc1N1CCC(Cc2ccccc2)CC1 920470585 HMBNCOSUFFTYPI-UHFFFAOYSA-N 483.528 5.356 5 20 JKBD O=C(Cn1ccc2ccc([N+](=O)[O-])cc21)Nc1ccc(C2(NC(=O)CC3CCCC3)CCC2)cc1 1786277024 AEPANKKJENNNSJ-UHFFFAOYSA-N 474.561 5.264 5 20 JKBD O=C(NC1(c2ccc(NC(=O)c3ccnc4ccccc34)cc2)CCC1)c1cc(F)cc([N+](=O)[O-])c1 1788891239 WHABGNGBBQMRNR-UHFFFAOYSA-N 484.487 5.344 5 20 JKBD O=C(CSc1ccccc1[N+](=O)[O-])NC1(c2ccc(NC(=O)c3ccncc3Cl)cc2)CCC1 1789731697 ZQTFHTUMQFKOIC-UHFFFAOYSA-N 496.976 5.183 5 20 JKBD CCOc1cccc(C(=O)Nc2ccc(C3(NC(=O)c4ccc([N+](=O)[O-])c(OC)c4)CCC3)cc2)c1 1790342977 SVFAHICAOBSTMP-UHFFFAOYSA-N 489.528 5.064 5 20 JKBD O=C(NC1(c2ccc(NC(=O)c3cccc(F)c3[N+](=O)[O-])cc2)CCC1)c1cc(-c2ccco2)no1 1790698678 JCSQOCFEPBIIEQ-UHFFFAOYSA-N 490.447 5.043 5 20 JKBD O=C(/C=C/c1ccc([N+](=O)[O-])o1)NC1(c2ccc(NC(=O)CCc3ccccc3F)cc2)CCC1 1791981913 YGJQGRVGDPPBTK-SDNWHVSQSA-N 477.492 5.107 5 20 JKBD CC(C)[C@@H](C(=O)N1CCC2(CCCN(C(=O)CCc3cccc([N+](=O)[O-])c3)C2)CC1)c1ccccc1 1806486714 VRRWPOOJGBRHLR-HHHXNRCGSA-N 491.632 5.198 5 20 JKBD CCCCC[C@H](C)C(=O)N1CC[C@@H](CNC(=O)CSc2ccccc2[N+](=O)[O-])[C@@H]1c1cccnc1 1812985158 HTLYDQKYXYGYFY-OWHZGTRUSA-N 498.649 5.004 5 20 JKBD C[C@@H](C(=O)N1CCCC[C@H]1c1cc(NC(=O)/C=C/c2ccc([N+](=O)[O-])o2)n[nH]1)c1ccc(Cl)cc1 1814964875 QBLWMZLVSOEGDK-AZJMGTQTSA-N 497.939 5.074 5 20 JKBD CC1(C(=O)Nc2cc([C@H]3CCCCN3C(=O)CSc3ccccc3[N+](=O)[O-])[nH]n2)CCCCC1 1822337694 WLDKGEDGVPFYSB-GOSISDBHSA-N 485.610 5.073 5 20 JKBD O=C(/C=C/c1ccccc1[N+](=O)[O-])N1CCC([C@H]2CCCCN2C(=O)c2cccc3cc[nH]c23)CC1 1828320430 SERRVISZCQWOIO-UWHSVAFCSA-N 486.572 5.023 5 20 JKBD O=C(c1cc(O)cc([N+](=O)[O-])c1)N1CCC([C@H]2CCCCN2C(=O)c2cc3sccc3s2)CC1 1828553839 NSOQESFSXKUGSE-LJQANCHMSA-N 499.614 5.124 5 20 JKBD O=C(Cc1cc([N+](=O)[O-])ccc1F)N1CCC([C@H]2CCCCN2C(=O)/C=C/C2CCCCC2)CC1 1830355050 LMTYOPFXSQEOMV-QXJBOHEXSA-N 485.600 5.033 5 20 JKBD O=C(CSc1ccccc1[N+](=O)[O-])N1CCC([C@@H]2CCCCN2C(=O)/C=C/C2CCCCC2)CC1 1830355903 SULYBMXDJVLJCR-ZVQQDINOSA-N 499.677 5.443 5 20 JKBD O=C(c1cc(Cl)ccc1F)N1CCC([C@@H]2CCCCN2C(=O)c2cccc(F)c2[N+](=O)[O-])CC1 1830617583 WXPZNSGAJYFYBC-NRFANRHFSA-N 491.922 5.074 5 20 JKBD O=C(CCc1ccco1)N1CCC([C@@H]2CCCCN2C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)CC1 1831059443 FYCVRNJCYZIHFR-QFIPXVFZSA-N 495.601 5.269 5 20 JKBD O=C(CC1CCCC1)N1CCC([C@@H]2CCCCN2C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)CC1 1831061492 SYTGURDGFARYGJ-QFIPXVFZSA-N 483.634 5.623 5 20 JKBD CCN(c1ccccc1)S(=O)(=O)c1cc(NC(=O)c2cccc([N+](=O)[O-])c2C)ccc1Cl 26774739 LACJKLFOCDEZKN-UHFFFAOYSA-N 473.938 5.024 5 20 JKBD COc1ccc(Oc2ccc([N+](=O)[O-])cc2C(=O)N2CCC[C@H](c3nc4ccccc4o3)C2)cc1 27383102 OODISGOACPWTHT-KRWDZBQOSA-N 473.485 5.557 5 20 JKBD Cc1cc(-c2cc(C(=O)O[C@H](C)C(=O)Nc3cccc([N+](=O)[O-])c3C)c3c(C)noc3n2)c(C)s1 28672958 TVQMBGNGVWDBKR-CQSZACIVSA-N 494.529 5.277 5 20 JKBD CCn1c(S[C@@H](C)C(=O)Nc2cccc3ncccc23)nc2cc3ccccc3cc2c1=O 31747410 XNSSVPQFOACLGV-INIZCTEOSA-N 454.555 5.237 5 20 JKBD COc1ccc([C@H](CNC(=O)c2cc3cccc([N+](=O)[O-])c3[nH]2)c2c[nH]c3ccccc23)cc1 71946044 KIAPUJBEOIQRKG-FQEVSTJZSA-N 454.486 5.128 5 20 JKBD C[C@H](Nc1ccc(C(=O)N2CCC[C@H]2Cc2ccccc2Cl)cc1[N+](=O)[O-])c1ccccn1 108892946 BNDOLXCSFGNQBJ-PXNSSMCTSA-N 464.953 5.664 5 20 JKBD O=C(c1csc(-c2cccc([N+](=O)[O-])c2)n1)N1CCN(C(c2ccccc2)c2ccccc2)CC1 215788205 ZFRDJQBHFJWBDG-UHFFFAOYSA-N 484.581 5.266 5 20 JKBD O=C(CCNc1ccc(C(F)(F)F)cc1[N+](=O)[O-])NCc1ccc(Oc2cccnc2)c(F)c1 302959995 DQXBKYZETATACX-UHFFFAOYSA-N 478.402 5.058 5 20 JKBD CSc1cc2c(cc1NC(=O)c1ccccc1C(=O)c1ccc(SC)c([N+](=O)[O-])c1)OCCO2 509299952 HFTFCLQZUMRRJR-UHFFFAOYSA-N 496.566 5.293 5 20 JKBD C[C@@H]1CCCN(c2ccc(C(=O)Nc3cccc(C(=O)N(C)c4ccccc4)c3)cc2[N+](=O)[O-])C1 515705958 VBJOLXBQSMYXAZ-LJQANCHMSA-N 472.545 5.360 5 20 JKBD CC(C)[C@@H](NC(=O)c1ccc(N[C@@H](C)c2ccccn2)c([N+](=O)[O-])c1)c1nc2ccccc2[nH]1 516178554 JHPYDPUNGWQYMK-QMHKHESXSA-N 458.522 5.166 5 20 JKBD O=C(c1cnn(-c2ccc([N+](=O)[O-])cc2)c1)N(CCc1ccccc1)c1nc2ccccc2s1 516464090 MSYASTLJAFHSCC-UHFFFAOYSA-N 469.526 5.280 5 20 JKBD COc1cc(CN(C)C(=O)c2ccc(N[C@@H](C)c3ccccn3)c([N+](=O)[O-])c2)ccc1OC(F)F 517539093 BPEPICIMTMSGKI-HNNXBMFYSA-N 486.475 5.045 5 20 JKBD O=[N+]([O-])c1cc(CNCc2ccc(CN3CCOCC3)cc2)ccc1Oc1ccccc1Cl 521821171 BJELTUBDIDIIGI-UHFFFAOYSA-N 467.953 5.163 5 20 JKBD O=C(c1cc2cc([N+](=O)[O-])ccc2s1)N1CCC[C@H](c2nc(-c3ccc(F)cc3)no2)C1 523282552 SBHAYHCEYJUPBH-AWEZNQCLSA-N 452.467 5.018 5 20 JKBD Cn1c(SCc2nc(-c3ccc([N+](=O)[O-])cc3)no2)nnc1-c1ccc(C(C)(C)C)cc1 603748172 DHHOIRDHHYIPCL-UHFFFAOYSA-N 450.524 5.030 5 20 JKBD COc1ccc(NC(=O)CSc2nnc(-c3ccccc3)n2[C@H](C)c2ccccc2)c([N+](=O)[O-])c1 603917197 ADICCLGWUDDEPT-QGZVFWFLSA-N 489.557 5.202 5 20 JKBD Cc1ccccc1NC(=O)[C@@H]1CSCN1C(=O)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1 608799784 JAVIUHSJEJTAEJ-NRFANRHFSA-N 497.960 5.503 5 20 JKBD O=C(CSc1ccc(C(F)(F)F)cc1[N+](=O)[O-])Nc1c(N2CCCC2)cccc1N1CCCC1 609026745 FWVDZZRJKBKPOY-UHFFFAOYSA-N 494.539 5.545 5 20 JKBD Cc1ccc(-c2csc(NC(=O)Cc3coc(-c4ccc(Cl)cc4)n3)n2)cc1[N+](=O)[O-] 609215730 LUGWQFFWDZLUNI-UHFFFAOYSA-N 454.895 5.516 5 20 JKBD Cc1ccc(-c2csc(NC(=O)c3cn(C)nc3-c3ccccc3Cl)n2)cc1[N+](=O)[O-] 609407479 KEOASKQSZQDXBV-UHFFFAOYSA-N 453.911 5.333 5 20 JKBD CCC(CC)c1cc[n+](/C(C(=S)Nc2ccc(OC)c(F)c2)=C(/O)c2ccc([N+](=O)[O-])cc2)cc1 726575395 HAAHGZICEBAOCK-UHFFFAOYSA-O 496.584 6.257 5 20 JKBD CC(C)(C)OC(=O)N1CCN(C(=O)c2csc(-c3cccc([N+](=O)[O-])c3)n2)c2ccccc2C1 728003017 LYWDCXANFDMUBI-UHFFFAOYSA-N 480.546 5.116 5 20 JKBD CN(C)C(=O)Sc1ccc(NC(=O)CSc2ccc(C(F)(F)F)cc2[N+](=O)[O-])cc1 729242350 PIKFJMYFYXZHPN-UHFFFAOYSA-N 459.471 5.118 5 20 JKBD CC(C)N(Cc1nnc(-c2cccc([N+](=O)[O-])c2)o1)C(=O)[C@@H]1C[C@@H]1c1ccc(Cl)cc1Cl 730449096 AWAXRJJTTOYLEB-QZTJIDSGSA-N 475.332 5.492 5 20 JKBD COc1cc(C(=O)N[C@H](c2ccc(CC(C)C)cc2)c2cccs2)c([N+](=O)[O-])cc1OC 747657774 XMTGBFGPEYBEGK-HSZRJFAPSA-N 454.548 5.391 5 20 JKBD Cc1cc2oc(=O)cc(COC(=O)c3csc(-c4ccc([N+](=O)[O-])cc4)n3)c2cc1C(C)C 747958646 QZOIGZHMQWIUMF-UHFFFAOYSA-N 464.499 5.614 5 20 JKBD COc1ccc([C@@H](CNC(=O)c2cc([N+](=O)[O-])c(C)c([N+](=O)[O-])c2C)c2c[nH]c3ccccc23)cc1 748701462 XSLZEVBGZMCTTD-OAQYLSRUSA-N 488.500 5.172 5 20 JKBD C[C@H](OC(=O)c1ccc(Br)c([N+](=O)[O-])c1)C(=O)N1c2ccccc2Sc2ccccc21 853789225 NTSBPUPCMYOAAI-ZDUSSCGKSA-N 499.342 5.732 5 20 JKBD O=C1CC[C@@H](c2noc(-c3ccc(Oc4ccc(Cl)cc4[N+](=O)[O-])cc3)n2)CN1CC1CCC1 856565793 MILGPKJTULZEPE-QGZVFWFLSA-N 482.924 5.597 5 20 JKBD CCOC(=O)c1c(-c2ccc(C)cc2C)csc1NC(=O)c1cc(OC)c(OC)cc1[N+](=O)[O-] 903200177 PRQLEMLRQCHQCC-UHFFFAOYSA-N 484.530 5.386 5 20 JKBD C[C@H]1Cc2cc([N+](=O)[O-])ccc2N1Cn1nc(-c2c[nH]c3ccccc23)n(C[C@H]2CCCO2)c1=S 915205126 JDVITUCDSGOBPL-QFBILLFUSA-N 490.589 5.058 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Cl)[C@@H](Nc1ccc(N2C(=O)CCCC2=O)cc1)c1ccccc1 917932771 IKJZMRISASKHFT-DEOSSOPVSA-N 492.919 5.084 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Cl)[C@@H](Nc1ccc(OC[C@@H]2CCCO2)cc1)c1ccccc1 917937296 DAMAFYNIHLTSNU-URXFXBBRSA-N 481.936 5.598 5 20 JKBD CCOc1cccc(C(=O)NC2(c3ccc(NC(=O)c4cccc(F)c4[N+](=O)[O-])cc3)CCC2)c1 1790698839 PYSGCZCBYUPYKL-UHFFFAOYSA-N 477.492 5.194 5 20 JKBD Cc1cc(C(=O)NC2(c3ccc(NC(=O)c4c(F)ccc([N+](=O)[O-])c4C)cc3)CCC2)cnc1C 1790771099 PGWLOUGQQGAKJY-UHFFFAOYSA-N 476.508 5.116 5 20 JKBD O=C(NC1(c2ccc(NC(=O)C3CC4(CCC4)C3)cc2)CCC1)c1cc(F)cc([N+](=O)[O-])c1 1792040191 RSLPKILZTGLMCF-UHFFFAOYSA-N 451.498 5.062 5 20 JKBD Cc1c(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2c(Cl)cccc2Cl)C3)cc(Cl)cc1[N+](=O)[O-] 1800711680 PQZRUVWXIBVANE-QDMKHBRRSA-N 496.778 5.429 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2sccc2Cl)[nH]n1 1821287099 LRRONXZPHKIPIG-MRXNPFEDSA-N 491.932 5.100 5 20 JKBD CC(C)/C=C/C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cc3cc([N+](=O)[O-])ccc3s2)n[nH]1 1821611153 OKRWDHOTTWGJLC-YOCVDRLZSA-N 467.551 5.051 5 20 JKBD O=C(c1cc(F)cc([N+](=O)[O-])c1)N1CCC([C@H]2CCCCN2C(=O)c2ccc(Cl)cc2F)CC1 1823898200 AXVOXWYTOISNGT-JOCHJYFZSA-N 491.922 5.074 5 20 JKBD O=C(CSc1ccccc1[N+](=O)[O-])N1CCC([C@H]2CCCCN2C(=O)/C=C/C2CCCCC2)CC1 1830355901 SULYBMXDJVLJCR-YAOQVBECSA-N 499.677 5.443 5 20 JKBD Cc1cncc(C(=O)N2CCC([C@@H]3CCCCN3C(=O)c3cc4cc([N+](=O)[O-])ccc4s3)CC2)c1 1831060080 OCZLXXUEFIERKZ-QFIPXVFZSA-N 492.601 5.060 5 20 JKBD Cc1cc(CCCC(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)[C@@H]2CCC[C@H]3CCCC[C@@H]32)c([N+](=O)[O-])cc1F 1847713851 DEVAVTINQKERPB-ORYNDBQLSA-N 499.627 5.173 5 20 JKBD C[C@H](OC(=O)c1ccccc1OCc1ccccc1)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 10863984 BTYWQNWBVLOYQO-HNNXBMFYSA-N 488.418 5.377 5 20 JKBD CC(C)c1ccc(CSc2nnc(SCC(=O)N(C)c3ccc([N+](=O)[O-])cc3)s2)cc1 10964489 WPULSRARPPIGMP-UHFFFAOYSA-N 474.633 5.617 5 20 JKBD Cc1cc(C)c(NC(=O)CNC(=O)c2ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])cc2)c(C)c1 15620524 MJNAPJIKYCZADS-UHFFFAOYSA-N 467.909 5.334 5 20 JKBD O=C(CCC(=O)c1ccc2c(c1)CCC2)Oc1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2Cl)cc1 15626420 FOAFWJHFMVMDDR-UHFFFAOYSA-N 492.915 5.558 5 20 JKBD C[C@@H](Sc1nnc(Cc2cccs2)n1-c1ccccc1)C(=O)Nc1ccc(F)c([N+](=O)[O-])c1 17758432 JIBGBNMPDWAJDS-CQSZACIVSA-N 483.550 5.086 5 20 JKBD CCc1ccc(C(=O)COC(=O)c2ccccc2NC(=O)c2ccc([N+](=O)[O-])cc2Cl)cc1 21119839 XYOUCACJZNZEHY-UHFFFAOYSA-N 466.877 5.103 5 20 JKBD Cn1cnnc1Sc1ccc(C(=O)N[C@@H](c2ccccc2)c2ccc(Cl)cc2)cc1[N+](=O)[O-] 21840566 YVZCVNXRURMISY-NRFANRHFSA-N 479.949 5.047 5 20 JKBD CCCn1c(S[C@H](C)C(=O)Nc2cc([N+](=O)[O-])ccc2Cl)nc2sc3c(c2c1=O)CCC3 23558179 NIJBWUDRXOIKGO-LLVKDONJSA-N 493.010 5.038 5 20 JKBD O=C(CSc1nc2scc(-c3ccc(F)cc3)c2c(=O)[nH]1)Nc1cc(Cl)ccc1[N+](=O)[O-] 26701779 BSKVGGQVGCXJTE-UHFFFAOYSA-N 490.925 5.083 5 20 JKBD COc1ccccc1-n1c(SCc2nc(-c3cccc([N+](=O)[O-])c3)no2)nnc1-c1cccs1 31841398 VJKVYYFQEKJLPS-UHFFFAOYSA-N 492.542 5.255 5 20 JKBD CCN(CC)[C@@H](CNC(=O)Cn1c2ccccc2c(=O)c2ccccc21)c1ccccc1Cl 32317708 RUFJHAJLPIZUGL-VWLOTQADSA-N 461.993 5.007 5 20 JKBD COc1cc(C(=O)N[C@H](C)c2nc3ccccc3[nH]2)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 57743931 MBMPTFRUABRXFL-CYBMUJFWSA-N 466.881 5.416 5 20 JKBD Cc1cc(C(=O)N2CCC[C@@H]2C(=O)Nc2cccc(CO[C@H]3CCC[C@H](C)C3)c2)ccc1[N+](=O)[O-] 72080489 NMTVSGYCWLYZKR-VVMVZBAXSA-N 479.577 5.242 5 20 JKBD Cc1sc(NC(=O)Cc2csc(Cc3ccccc3)n2)nc1-c1cccc([N+](=O)[O-])c1 195704310 PPLJACLKPWAFDM-UHFFFAOYSA-N 450.545 5.255 5 20 JKBD Cc1cccc([N+](=O)[O-])c1NC(=O)COC(=O)c1c2c(nc3ccccc13)/C(=C\c1cccs1)CC2 205748119 SWAADBZTOYINPR-VKAVYKQESA-N 499.548 5.795 5 20 JKBD O=C(C[C@@H]1C=CCC1)Nc1ccccc1NC(=O)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-] 409983897 ZAEMCNQKZWYYSX-CQSZACIVSA-N 463.412 5.083 5 20 JKBD CN(C)c1ccc(C(=O)c2ccccc2C(=O)N2CCC(c3c[nH]c4ccccc34)CC2)cc1[N+](=O)[O-] 478115369 AFTQTWTVUPXTLJ-UHFFFAOYSA-N 496.567 5.393 5 20 JKBD COc1cc(C(=O)Nc2cc(C(=O)NC3CC3)ccc2C)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 483725828 KBIHDYFSZYQKKP-UHFFFAOYSA-N 495.919 5.502 5 20 JKBD C[C@@H]1C[C@@H](C)CN(c2ccc(C(=O)Nc3ccc(-n4cccn4)cc3C(F)(F)F)cc2[N+](=O)[O-])C1 484316656 HGVLNFMAWFULIF-HZPDHXFCSA-N 487.482 5.534 5 20 JKBD C[C@@H]1C[C@@H](C)CN(c2ccc(C(=O)Nc3cccc(OCc4cscn4)c3)cc2[N+](=O)[O-])C1 504983456 QSDHYVFCDQGOCG-IAGOWNOFSA-N 466.563 5.365 5 20 JKBD Cc1cccc(CN(Cc2ccco2)C(=O)c2ccc(N[C@H](C)c3ccccn3)c([N+](=O)[O-])c2)c1 506176591 WWCCYSLPQOMBFU-HXUWFJFHSA-N 470.529 5.907 5 20 JKBD O=[N+]([O-])c1cc(CNCc2ccccc2N2CCOCC2)ccc1Oc1ccccc1Cl 507939107 HIRLYPIMYCTQGU-UHFFFAOYSA-N 453.926 5.167 5 20 JKBD CCCOc1ccc(Cl)cc1NC(=O)c1ccc(N[C@H](C)c2ccccn2)c([N+](=O)[O-])c1 512565379 NPECTAIFGDUBKB-OAHLLOKOSA-N 454.914 5.857 5 20 JKBD COc1cc(C(=O)N(Cc2ccc(C)s2)C(C)C)c([N+](=O)[O-])cc1OCc1cscn1 512945435 SGTPEBKXBXCLLV-UHFFFAOYSA-N 461.565 5.060 5 20 JKBD Cc1nc(C2(NCc3ccc(-c4ccc([N+](=O)[O-])cc4Br)o3)CCCCC2)no1 518275444 FNCSCSPAIQZECF-UHFFFAOYSA-N 461.316 5.258 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Br)[C@H](NC[C@H]1CCOc2ccccc21)c1ccccc1 519490724 OLJOBCNGTQNNGF-UZUQRXQVSA-N 496.361 5.193 5 20 JKBD O=C(Nc1ccccc1)[C@H]1CCc2ccccc2N1C(=O)Cn1c2ccccc2c(=O)c2ccccc21 555068311 MIISHLUMCSZJPI-MUUNZHRXSA-N 487.559 5.141 5 20 JKBD O=C(Nc1cccc(CNCc2ccc(Oc3ccc(F)cc3)c([N+](=O)[O-])c2)c1)c1ccncc1 603954787 IAZXGIZXFPRRGP-UHFFFAOYSA-N 472.476 5.463 5 20 JKBD O=C(c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1)N1CCC[C@@H](OCC(F)(F)F)C1 603981478 FVZQZCSFOWHEIN-MRXNPFEDSA-N 458.820 5.224 5 20 JKBD O=C(c1ccc(Sc2nc3ccccc3s2)c([N+](=O)[O-])c1)N1CCC[C@H](c2cc[nH]n2)C1 608813521 ZNDBRJHTFGZOQB-HNNXBMFYSA-N 465.560 5.099 5 20 JKBD CC(C)Oc1ccc(NC(=S)N(Cc2nnc(-c3cccc([N+](=O)[O-])c3)o2)C(C)C)cc1 726448951 LRLOBDGLJWRWQJ-UHFFFAOYSA-N 455.540 5.039 5 20 JKBD C[C@H](OC(=O)c1ccccc1OCc1cccs1)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl 730612975 CEYUWCSHMRWGPA-ZDUSSCGKSA-N 460.895 5.073 5 20 JKBD COc1ccc(C(=O)OCC(=O)N2c3ccccc3Sc3ccc(Cl)cc32)cc1[N+](=O)[O-] 765258218 PAGHGWOMNHFBAB-UHFFFAOYSA-N 470.890 5.243 5 20 JKBD O=C(O[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1)[C@@H]1Cc2ccccc2S1 841978875 UBZVIOMHHAIRCG-SFTDATJTSA-N 468.918 5.188 5 20 JKBD Cc1cccc(NC(=O)[C@H](C)OC(=O)C2CCN(c3ccc(C(F)(F)F)cc3[N+](=O)[O-])CC2)c1C 856393192 NAFYHFMFRPYRHD-INIZCTEOSA-N 493.482 5.017 5 20 JKBD C[C@H](Oc1ccc(Cl)cc1[N+](=O)[O-])c1nc(-c2ccc(-n3cnc4ccccc43)nc2)no1 904488752 RXTMVBWOQGELAW-ZDUSSCGKSA-N 462.853 5.172 5 20 JKBD Cc1cc(C2=N/C(=C/c3cccc(NC(=O)c4ccccc4Cl)c3)C(=O)O2)ccc1[N+](=O)[O-] 912758510 RRFOJJIQTJWJGY-DEDYPNTBSA-N 461.861 5.153 5 20 JKBD Cc1ccc(NC(=O)[C@@H](OC(=O)Cc2csc(-c3ccc(C)o3)n2)c2ccccc2)c([N+](=O)[O-])c1 914966555 JGLGLPHRLRCLCQ-QHCPKHFHSA-N 491.525 5.394 5 20 JKBD O=C(Nc1ccc(F)c([N+](=O)[O-])c1)c1ccc2c(c1)C(=O)N(c1cc(Cl)ccc1Cl)C2=O 915139197 TVVPMHBTDUROQA-UHFFFAOYSA-N 474.231 5.094 5 20 JKBD CC(=O)Nc1cc(C(=O)O[C@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2ccccc2)ccc1C 919177475 RYXLUNGDERFEAX-QFIPXVFZSA-N 481.892 5.052 5 20 JKBD O=C(O[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1)c1cc(-c2ccccc2)no1 919188110 KMNNDQZXAORMIL-JOCHJYFZSA-N 477.860 5.440 5 20 JKBD Cc1cccc([N+](=O)[O-])c1NC(=O)COC(=O)c1ccc(COc2ccccc2Br)cc1 919441746 QNNDFFJZIWOCEF-UHFFFAOYSA-N 499.317 5.040 5 20 JKBD Cc1ccc2cc(C(=O)NC3(c4ccc(NC(=O)Cc5cccc([N+](=O)[O-])c5)cc4)CCC3)ccc2n1 1785791557 DGLCCUFJQRKLNG-UHFFFAOYSA-N 494.551 5.442 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)C3(c4cccc([N+](=O)[O-])c4)CCC3)CCC2)cc1)C1CC(F)(F)C1 1785909564 QPQBIUADTPWSFQ-UHFFFAOYSA-N 483.515 5.196 5 20 JKBD O=C(Cc1cc(F)ccc1[N+](=O)[O-])NC1(c2ccc(NC(=O)c3ccnc4ccccc34)cc2)CCC1 1788890963 LLYKOKIOOYYJJM-UHFFFAOYSA-N 498.514 5.273 5 20 JKBD O=C(CC1CCOCC1)NC1(c2ccc(NC(=O)c3cc4cc([N+](=O)[O-])ccc4s3)cc2)CCC1 1791010960 KJUNERYFNBIDDU-UHFFFAOYSA-N 493.585 5.374 5 20 JKBD O=C(/C=C/c1ccc([N+](=O)[O-])o1)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(Cl)c(Cl)c(Cl)c1 1803893270 INBKFOXPSCMMII-HPLAMEMLSA-N 498.750 5.113 5 20 JKBD O=C(Nc1cc([C@H]2CCCCN2C(=O)/C=C/c2ccccc2[N+](=O)[O-])[nH]n1)c1ccc(Cl)s1 1816400847 LPDKIGXVZRRPMW-VGMNTSGFSA-N 485.953 5.052 5 20 JKBD O=C(Nc1cc([C@@H]2CCCCN2C(=O)[C@@H]2CCC[C@H]3CCCC[C@H]32)[nH]n1)c1cc(F)cc([N+](=O)[O-])c1 1821166456 WRIUUHHFVZZTMN-SUIZVZERSA-N 497.571 5.369 5 20 JKBD Cc1cc(CCCC(=O)N2CCC([C@@H]3CCCCN3C(=O)[C@@H]3C[C@H]3C3CC3)CC2)c([N+](=O)[O-])cc1F 1824066340 VKENPPOQRFMZDT-ARNLJNQMSA-N 499.627 5.031 5 20 JKBD CC[C@H](C)CC(=O)N1CCC([C@@H]2CCCCN2C(=O)c2ccc(Br)c([N+](=O)[O-])c2)CC1 1830522256 AVBREQOVQHBYQA-JXFKEZNVSA-N 494.430 5.027 5 20 JKBD Cc1cc2cc(C(=O)N3CCC([C@@H]4CCCCN4C(=O)c4cc(F)cc([N+](=O)[O-])c4)CC3)ccc2[nH]1 1830616396 ZBWCJNYLAWRGGT-VWLOTQADSA-N 492.551 5.071 5 20 JKBD CC(C)CCC(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)CC1 1831382079 OTMHZSGNOWCQID-NRFANRHFSA-N 471.623 5.479 5 20 JKBD Cc1c(C(=O)N2CCC([C@H]3CCCCN3C(=O)CCC(C)C)CC2)cc(Cl)cc1[N+](=O)[O-] 1831382193 RBSAHSDFDGYASQ-OAQYLSRUSA-N 464.006 5.226 5 20 JKBD O=C([C@@H]1CCCCC1(F)F)N1CCC([C@H]2CCCCN2C(=O)/C=C/c2ccccc2[N+](=O)[O-])CC1 1832899729 FKPUPBZVCGITNZ-QFBGAIGZSA-N 489.563 5.053 5 20 JKBD COc1ccc(C[C@H](NC(=O)Cn2c3ccccc3c(=O)c3ccccc32)c2ccc(OC)cc2)cc1 11250923 YFZMGWVEQLZPGI-MHZLTWQESA-N 492.575 5.272 5 20 JKBD CCOC(=O)c1nc(N(CCc2ccccc2)C(=O)c2ccc([N+](=O)[O-])cc2Cl)sc1C 21825786 PLHJTNCFVGRGTI-UHFFFAOYSA-N 473.938 5.079 5 20 JKBD C[C@@H](Sc1nnc(Nc2cccc(F)c2)s1)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl 22171138 YJGXDUVCHKLEES-SECBINFHSA-N 453.908 5.102 5 20 JKBD CN(CC(=O)Nc1ccccc1C(F)(F)F)C(=O)COC(=O)c1c2ccccc2cc2ccccc12 22673845 PIXVKYGJABGEOV-UHFFFAOYSA-N 494.469 5.266 5 20 JKBD CC(C)CCSc1ccc(C(=O)N[C@H](c2ccc(F)cc2)c2nccn2C)cc1[N+](=O)[O-] 23776843 KAVUMQGNHGCWOW-OAQYLSRUSA-N 456.543 5.125 5 20 JKBD CN(C)c1ccc(CCC(=O)Oc2ccc(NC(=O)c3cc([N+](=O)[O-])ccc3Cl)cc2)cc1 24692936 QJWOHTSNACITPC-UHFFFAOYSA-N 467.909 5.105 5 20 JKBD COc1ccccc1Oc1ccc(N[C@@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2C(F)(F)F)cc1 28912878 KVZRMRODBKKZFR-AWEZNQCLSA-N 475.423 5.854 5 20 JKBD C[C@H](c1nnc(SCc2nc(-c3cccc([N+](=O)[O-])c3)no2)n1-c1ccccc1)N1CCCCC1 31844535 MMHJGVXRQVTJIX-QGZVFWFLSA-N 491.577 5.065 5 20 JKBD Cc1ccc(N2C(=O)/C(=C\c3ccc4c(c3)OCO4)N=C2S/C=C\c2ccc([N+](=O)[O-])o2)cc1 96936374 CASIEQPJIOCHID-KKZMPJRSSA-N 475.482 5.373 5 20 JKBD C[C@@H](Nc1ccc(C(=O)N2CCC(CCc3ccccc3)CC2)cc1[N+](=O)[O-])c1ccccn1 108786029 MSYNMXPWHQWURJ-HXUWFJFHSA-N 458.562 5.648 5 20 JKBD Cc1sc(NC(=O)c2ccc(-c3noc(C(F)(F)F)n3)cc2)nc1-c1cccc([N+](=O)[O-])c1 409812167 NEOZIMMPOLUMTC-UHFFFAOYSA-N 475.408 5.348 5 20 JKBD O=C(C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)Nc1ccc(-c2cnco2)cc1 487562351 HDSZLFJGGQYYQR-UYRXBGFRSA-N 482.521 6.429 5 20 JKBD Cn1c(-c2cccc(NC(=O)c3ccc([N+](=O)[O-])cc3I)c2)nc2ccccc21 508981902 UCTJIHYIDNXPIS-UHFFFAOYSA-N 498.280 5.005 5 20 JKBD CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)c1ccc(S(=O)(=O)Nc2ccccc2Cl)cc1 509720833 SNAXUPIPODAUQE-UHFFFAOYSA-N 487.965 5.100 5 20 JKBD C[C@H](Sc1nc2ccccc2c(=O)n1Cc1ccccc1)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl 513842898 PWSWIOCLPVCTME-HNNXBMFYSA-N 494.960 5.126 5 20 JKBD CN(Cc1ccccc1[N+](=O)[O-])C(=O)Nc1cc2c(cc1Sc1ccccc1)OCCO2 513916822 NMSHVPQGZDGFBR-UHFFFAOYSA-N 451.504 5.181 5 20 JKBD C[C@@H](Nc1ccc(C(=O)NCCOc2cccc(Cl)c2Cl)cc1[N+](=O)[O-])c1ccccn1 516635085 JHXFRALYSDBPOU-CQSZACIVSA-N 475.332 5.279 5 20 JKBD CC[C@H](C)NC(=O)c1cccc(CNCc2cn(-c3ccccc3)nc2-c2ccc([N+](=O)[O-])cc2)c1 520950334 PFVNOTCUJNSFMU-FQEVSTJZSA-N 483.572 5.266 5 20 JKBD Cc1ccc(C[C@H]2CCCN(C(=O)c3ccc(N[C@@H](C)c4ccccn4)c([N+](=O)[O-])c3)C2)cc1 580668699 NFUBVKFRUPMHQD-RBBKRZOGSA-N 458.562 5.566 5 20 JKBD COc1cc(C(=O)Nc2c(C)cc(Br)cc2Cl)c([N+](=O)[O-])cc1OC(F)F 603743493 DELXDVVJXYWORK-UHFFFAOYSA-N 465.634 5.181 5 20 JKBD O=c1c2ccccc2nc(SCc2nc(-c3ccc([N+](=O)[O-])cc3)no2)n1C1CCCCC1 603748357 MFDAKBXRKRCYNH-UHFFFAOYSA-N 463.519 5.152 5 20 JKBD C[C@@H]1C[C@H]1c1ccc(CN[C@@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Br)c2ccccc2)o1 604044522 TUZKRTDILDWIMD-JPEVHGAISA-N 484.350 5.543 5 20 JKBD CCN(Cc1ccc(OC)c(OC)c1)C(=O)c1ccc(Sc2nc(C)cs2)c([N+](=O)[O-])c1 604468805 FIFGEGNEUWBBCS-UHFFFAOYSA-N 473.576 5.190 5 20 JKBD c1ccc2c(c1)nc(CSc1nnc(N3CCCCC3)n1C[C@H]1CCCO1)c1ccccc12 641883280 WGWCAMVHNGJHOG-LJQANCHMSA-N 459.619 5.441 5 20 JKBD CC(C)c1noc2nc(-c3ccco3)cc(C(=O)O[C@@H](C)C(=O)Nc3cc([N+](=O)[O-])ccc3Cl)c12 727919722 WUNICYXHUCYGQR-LBPRGKRZSA-N 498.879 5.352 5 20 JKBD Cc1nn(C)c2nc(-c3cccs3)cc(C(=O)N(CC3CC3)c3ccc(Cl)c([N+](=O)[O-])c3)c12 728165645 NIXQRTMHLKPNKT-UHFFFAOYSA-N 481.965 5.624 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)OCc2nnc(-c3c(Cl)cccc3Cl)o2)cc1SC 728649210 GMAOPZQTOMTCMP-UHFFFAOYSA-N 470.290 5.039 5 20 JKBD CCOc1ccc(N(C(=O)c2ccc(Cl)c([N+](=O)[O-])c2)C2CCN(CC(F)(F)F)CC2)cc1 729241464 KCPQARXNRRGVAG-UHFFFAOYSA-N 485.890 5.320 5 20 JKBD CN(C[C@H]1CCN(C(=O)c2ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])cc2)C1)C(=O)OC(C)(C)C 729388235 QZJUKQRKXHWMAS-MRXNPFEDSA-N 489.956 5.370 5 20 JKBD C[C@@H](OC(=O)c1ccc(CSc2ccccc2)cc1)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 746137830 QTPJWMBMOKRJIP-MRXNPFEDSA-N 461.499 5.855 5 20 JKBD O=C(Nc1nc(-c2ccc(Br)s2)cs1)c1cc([N+](=O)[O-])ccc1Br 751062005 IQFRWWUXLMPSJN-UHFFFAOYSA-N 489.170 5.557 5 20 JKBD C[C@@H](Nc1ccc(C(=O)Nc2cccc(Cl)c2SC(F)F)cc1[N+](=O)[O-])c1ccccn1 751229638 YFOHWKKJYRAFQV-GFCCVEGCSA-N 478.908 6.383 5 20 JKBD Cc1cccc(-c2nnc(-c3ccc(C(=O)Nc4cc5c(cc4[N+](=O)[O-])OCCCO5)cc3)o2)c1 880336860 QIKUPFILPYYQBQ-UHFFFAOYSA-N 472.457 5.034 5 20 JKBD CC1CCN(c2ccc([N+](=O)[O-])cc2C(=O)N2CCC[C@H](c3nc4ccccc4s3)C2)CC1 883989408 TVIGLVFHYMVDMS-SFHVURJKSA-N 464.591 5.461 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Cl)[C@H](Nc1ccc2c(c1)OCCCO2)c1ccccc1 915871322 YFZJCEWEQLUBCI-JOCHJYFZSA-N 453.882 5.201 5 20 JKBD COc1ccccc1NC(=O)Nc1cc(NC(=O)c2cc(Cl)ccc2[N+](=O)[O-])ccc1OC 919854837 VBOBZODSPIFEOK-UHFFFAOYSA-N 470.869 5.162 5 20 JKBD COc1ccc(-c2cnc(COC(=O)c3ccc(N[C@@H](C)c4ccccn4)c([N+](=O)[O-])c3)o2)cc1 920896081 XCKGPWWZPVTEQQ-INIZCTEOSA-N 474.473 5.184 5 20 JKBD Cc1cnc(C(=O)NC2(c3ccc(NC(=O)Cc4ccc(Cl)cc4[N+](=O)[O-])cc3)CCC2)s1 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485.466 5.234 5 20 JKBD CN(C)c1ccccc1NC(=O)C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1 33123603 JKBHMGHCBCTCPB-SDXDJHTJSA-N 458.543 5.840 5 20 JKBD CCNC(=O)c1ccc(C)c(NC(=O)c2ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])cc2)c1 71924876 HMBWEMGPRLCUEI-UHFFFAOYSA-N 453.882 5.351 5 20 JKBD CC(C)CC(=O)Nc1cccc(CNC(=O)c2ccc(N[C@H](C)c3ccccn3)c([N+](=O)[O-])c2)c1 109148384 RQEJSSFXFQUDBX-GOSISDBHSA-N 475.549 5.078 5 20 JKBD CC[C@@H](NC(=O)c1ccc(N[C@H](C)c2ccccn2)c([N+](=O)[O-])c1)c1nc(-c2ccccc2)c[nH]1 109422215 YBCOOWPYFNDTBJ-YLJYHZDGSA-N 470.533 5.434 5 20 JKBD C[C@H](Nc1ccc2nc(C3CC3)sc2c1)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 195733783 FCZMMOVIAMRARZ-JTQLQIEISA-N 450.442 5.540 5 20 JKBD C[C@H](NC(=O)c1csc(-c2cccc([N+](=O)[O-])c2)n1)c1cccc(OCc2ccccn2)c1 215725199 XQGUUWBDPBBTKV-INIZCTEOSA-N 460.515 5.183 5 20 JKBD CCOc1cc([N+](=O)[O-])c(C(=O)Nc2nc3ccccc3n2CCCc2ccccc2)cc1OC 476773242 MNDSULXXVGABGS-UHFFFAOYSA-N 474.517 5.237 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)Nc2nc(-c3ccc4ccccc4c3)cs2)cc1SC 482196125 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Cc1ccc(CN(C)C(=O)C/C(=C/c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)s1 524127931 TYXQSZVKQKJOIN-AQTBWJFISA-N 463.584 6.164 5 20 JKBD C[C@@H]1CCC[C@H](OCc2cccc(N[C@H](C)C(=O)Nc3ccc([N+](=O)[O-])cc3C(F)(F)F)c2)C1 582351544 BMRBJOQYDXFOIK-QINHECLXSA-N 479.499 6.148 5 20 JKBD Cc1nn(C)c2ncc(NC(=O)c3cc([N+](=O)[O-])ccc3Sc3ccc(Cl)cc3)cc12 591687427 FVRWVLIMKVJGPT-UHFFFAOYSA-N 453.911 5.242 5 20 JKBD O=C(C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1)N1CCC[C@@H]1c1ccc(Cl)cc1 603506698 GZMFEJDEBNUDOK-LJQANCHMSA-N 481.902 5.847 5 20 JKBD CSc1ccc([C@@H](CNC(=O)c2cc(SC)ccc2[N+](=O)[O-])N2CCc3sccc3C2)cc1 603669424 IRGBQYPZWZUPJC-JOCHJYFZSA-N 499.683 5.630 5 20 JKBD CSc1ccc(C(=O)c2ccccc2C(=O)N2CCC[C@H](CN3CCC(C)CC3)C2)cc1[N+](=O)[O-] 604525405 BANDNAXMIDTRED-HXUWFJFHSA-N 495.645 5.132 5 20 JKBD Cc1csc(Sc2ccc(C(=O)Nc3c(-c4ccccc4)ncn3C3CC3)cc2[N+](=O)[O-])n1 604537416 WXLMTBNXXAQWIN-UHFFFAOYSA-N 477.571 5.962 5 20 JKBD CC(C)NC(=O)c1ccc(Cl)c(NC(=O)c2ccc(N[C@@H](C)c3ccccn3)c([N+](=O)[O-])c2)c1 608938662 QGFCSKHUNZNGMZ-HNNXBMFYSA-N 481.940 5.207 5 20 JKBD CCC(CC)(NC(=O)c1cc(OC)c(OCc2cscn2)cc1[N+](=O)[O-])c1ccc(Cl)cc1 609021596 XXMGEVIVIPFLPD-UHFFFAOYSA-N 489.981 5.738 5 20 JKBD Cc1ccc[n+](/C(C(=S)Nc2ccc(OC(C)C)cc2)=C(/O)c2ccc([N+](=O)[O-])cc2)c1 726574829 TXWJBVDYMVGJAP-UHFFFAOYSA-O 450.540 5.301 5 20 JKBD C[C@H](Nc1ccc(C(=O)OCc2nnc(-c3ccccc3Cl)o2)cc1[N+](=O)[O-])c1ccccn1 728837203 KLNWCZDVZXWQOQ-AWEZNQCLSA-N 479.880 5.223 5 20 JKBD CC1=C(C(=O)Nc2ccccc2C)[C@@H](c2ccc([N+](=O)[O-])cc2)NC(=O)N1Cc1cccs1 732040748 CLXUGYRWLJAUJG-JOCHJYFZSA-N 462.531 5.144 5 20 JKBD C[C@H](NC(=O)[C@@H](C)OC(=O)c1csc(-c2cccc([N+](=O)[O-])c2)n1)c1ccc(Cl)cc1Cl 747962888 VXOTZWYXLYBHPP-NWDGAFQWSA-N 494.356 5.448 5 20 JKBD O=C(Nc1ncc(S(=O)(=O)c2ccc([N+](=O)[O-])cc2)s1)c1sccc1-c1ccc(F)cc1 748604108 ZWOYSKLHRKUGOB-UHFFFAOYSA-N 489.531 5.004 5 20 JKBD Cc1nnc(SCc2c(C(=O)Nc3ccc(Cl)c([N+](=O)[O-])c3)oc3ccccc23)s1 748610879 SWPXFGJMUSYFAG-UHFFFAOYSA-N 460.924 5.699 5 20 JKBD CC(=O)N(c1nc(COC(=O)/C=C\c2ccc([N+](=O)[O-])cc2)cs1)c1cccc(C)c1C 798127773 DFUAUVFXNFPZJC-XFXZXTDPSA-N 451.504 5.109 5 20 JKBD Cc1csc(Sc2ccc([N+](=O)[O-])cc2C(=O)O[C@H](C)C(=O)Nc2c(C)cccc2C(C)C)n1 849132291 ABJGMXKNLZULFI-MRXNPFEDSA-N 499.614 6.127 5 20 JKBD C[C@@H](Sc1nnc(-c2ccc(OC(F)F)cc2)o1)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl 849205869 WCSWYCRAENSJDC-SECBINFHSA-N 470.841 5.019 5 20 JKBD O=[N+]([O-])c1c(Cl)cc(Cl)cc1CNc1cc(N2CCOCC2)ccc1Br 864014774 TVKJUZAYEYIWFJ-UHFFFAOYSA-N 461.143 5.113 5 20 JKBD Cc1cc(C(=O)N2CCC[C@@H]2c2nc(-c3ccccc3OCc3ccccc3)no2)ccc1[N+](=O)[O-] 904465804 WEQBKJBZJFZUPA-HSZRJFAPSA-N 484.512 5.510 5 20 JKBD O=C(COC(=O)c1[nH]c2ccc(Cl)cc2c1Cl)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 915418892 AVKVKRMVPLMDEN-UHFFFAOYSA-N 476.194 5.197 5 20 JKBD C[C@H](OC(=O)c1cccc(OCc2cccs2)c1)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 915465261 XTNNAFPTJDKBJC-ZDUSSCGKSA-N 494.447 5.438 5 20 JKBD CC(C)(C)c1ccc(C(=O)OCc2nnc(-c3ccccc3Br)o2)cc1[N+](=O)[O-] 917348634 PNGNZYNLJQARNN-UHFFFAOYSA-N 460.284 5.062 5 20 JKBD O=C(CCCNC(=O)c1ccsc1)Nc1cc(Cl)c([N+](=O)[O-])cc1OCc1ccccc1 919657177 PMQRHTVZMQOJQG-UHFFFAOYSA-N 473.938 5.037 5 20 JKBD CC(=O)N(c1ccc(C(F)(F)F)cc1)c1nc(COc2ccc(C=O)cc2[N+](=O)[O-])cs1 919675949 JLPFAMNWXWQTDP-UHFFFAOYSA-N 465.409 5.146 5 20 JKBD CC(C)[C@@H](OC(=O)[C@H](C)Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)Nc1ccccc1C(F)(F)F 920778139 KDJNYPAESFLTBH-KPZWWZAWSA-N 488.846 5.241 5 20 JKBD O=C(CSC1CCCC1)Nc1ccc(C2(NC(=O)CCc3cccc([N+](=O)[O-])c3)CCC2)cc1 1786347450 QZXZHGSXEMSSRC-UHFFFAOYSA-N 481.618 5.337 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)Nc1ccc(C2(NC(=O)[C@@H](C)Cc3ccccn3)CCC2)cc1 1790772302 HTSPOTLSHBZBEW-KRWDZBQOSA-N 490.535 5.064 5 20 JKBD O=C(NC1(c2ccc(NC(=O)[C@@H]3[C@H]4C=CS[C@@H]43)cc2)CCC1)c1cc2cc([N+](=O)[O-])ccc2s1 1791093683 QFWUBXPEGRRQOM-QIJUGHKUSA-N 491.594 5.432 5 20 JKBD Cc1cc(CCCC(=O)N2CCC3(CCCN(C(=O)CCC4CCC4)C3)CC2)c([N+](=O)[O-])cc1F 1805789891 UNWSRSPCVLCQFB-UHFFFAOYSA-N 487.616 5.177 5 20 JKBD Cc1ccc(C(=O)N2CCC([C@H]3CCCCN3C(=O)c3cc(Cl)cc([N+](=O)[O-])c3C)CC2)o1 1830734569 NRSORYHZUOQHRW-HXUWFJFHSA-N 473.957 5.005 5 20 JKBD O=C(C1CC2(CCC2)C1)N1CCC([C@H]2CCCCN2C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)CC1 1831062056 MZJJXUZPFCUTRQ-JOCHJYFZSA-N 495.645 5.623 5 20 JKBD COc1ccc(C)cc1NC(=O)[C@H](Sc1nc2ccc([N+](=O)[O-])cc2s1)c1ccccc1 10592282 JXUZWQKRELNZPS-OAQYLSRUSA-N 465.556 5.994 5 20 JKBD C[C@H](OC(=O)c1ccc(Cl)cc1Cl)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 10729774 MXYGTLVQKPUUBJ-QMMMGPOBSA-N 451.184 5.104 5 20 JKBD Cc1ccc(NC(=O)[C@@H](Sc2nnc(Cc3csc(C)n3)o2)c2ccccc2)c([N+](=O)[O-])c1 11103987 GJSIPWDOAMBIJU-FQEVSTJZSA-N 481.559 5.114 5 20 JKBD O=C(CCCn1c(=O)oc2cc([N+](=O)[O-])ccc21)Nc1ccc(Cc2nc3ccccc3s2)cc1 11710439 UKMSACKWFFJFMX-UHFFFAOYSA-N 488.525 5.122 5 20 JKBD COCCN(C(=O)c1oc2c(Cl)cccc2c1C)c1nc(-c2ccc([N+](=O)[O-])cc2)cs1 14790440 NULDPDUQFFWOGS-UHFFFAOYSA-N 471.922 5.720 5 20 JKBD C[C@H](Sc1ncc(-c2ccc(F)cc2)[nH]1)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 17749972 RXHKCYDSKBUUHC-JTQLQIEISA-N 454.405 5.262 5 20 JKBD CC(=O)Nc1cccc([C@@H](C)N(Cc2ccccc2)C(=O)[C@@H](C)Sc2ccc([N+](=O)[O-])cc2)c1 23193201 JUSXVABBXQVDIT-RTBURBONSA-N 477.586 5.824 5 20 JKBD CC(C)[C@@H](NC(=O)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1)c1nc2ccccc2[nH]1 104723349 IVTXLJQJLOYLKW-OAQYLSRUSA-N 489.498 5.220 5 20 JKBD O=C(C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1)N1CCC[C@@H]1Cc1cccc(F)c1 107986637 SPFAMQYHMUSIQV-HXUWFJFHSA-N 479.474 5.203 5 20 JKBD C[C@H](Nc1ccc(C(=O)N2CCC[C@@H]2c2nc3ccccc3s2)cc1[N+](=O)[O-])c1ccccn1 108753504 JAHUBARREMWZRF-HRAATJIYSA-N 473.558 5.750 5 20 JKBD CCOc1cccc2cc([C@@H](C)NC(=O)c3cc(OC)c(OCc4cscn4)cc3[N+](=O)[O-])oc12 108910061 MRMZXLFZKRQVIS-CQSZACIVSA-N 497.529 5.275 5 20 JKBD O=C(Cc1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1)N1CCC[C@H]1c1ccc2c(c1)OCO2 303192781 MOJLBEUVUIEWTK-DEOSSOPVSA-N 496.523 5.082 5 20 JKBD Cn1cnnc1Sc1ccc(C(=O)Nc2c(Cl)cc(Cl)cc2Cl)cc1[N+](=O)[O-] 481744407 WTUPLPWCEWSTNA-UHFFFAOYSA-N 458.714 5.087 5 20 JKBD Cc1ccc(C(=O)Nc2ccccc2)cc1NC(=O)c1ccc(Cn2nc(C)c([N+](=O)[O-])c2C)cc1 483292879 HXIHCBBMBCJHBU-UHFFFAOYSA-N 483.528 5.269 5 20 JKBD O=C(Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1)c1ccc(NC(=O)c2cccs2)cc1 492245676 HIYIOOIJTPESSM-UHFFFAOYSA-N 450.501 5.284 5 20 JKBD CC[C@@H](C)Sc1ccc(NC(=O)c2cnn(-c3ccc([N+](=O)[O-])cc3)c2)c(C(F)(F)F)c1 499541087 QLDKXLFFLVGFTJ-CYBMUJFWSA-N 464.469 5.942 5 20 JKBD Cc1cc(Cl)ccc1Cc1cnc(NC(=O)c2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)s1 507427238 UQDGXFUJKQJHIS-UHFFFAOYSA-N 467.938 5.257 5 20 JKBD CCOC(=O)c1sc(N(C(=O)C2CCN(c3ccccc3[N+](=O)[O-])CC2)c2ccccc2)nc1C 515172055 QOXQBFSVXQNHSV-UHFFFAOYSA-N 494.573 5.118 5 20 JKBD COc1ccc([N+](=O)[O-])c(C(=O)NCCc2cn(-c3ccccc3)nc2-c2ccc(Cl)cc2)c1 520747046 SACZOAKKKCFEJE-UHFFFAOYSA-N 476.920 5.082 5 20 JKBD Cc1cnn([C@H]2CCCc3ccccc32)c1NC(=O)c1csc(-c2ccc([N+](=O)[O-])cc2)n1 524418375 NPDFBKWCYGCVPN-NRFANRHFSA-N 459.531 5.401 5 20 JKBD COc1ccc([C@H](CNC(=O)c2cc3cc([N+](=O)[O-])ccc3o2)c2c[nH]c3ccccc23)cc1 603779052 DVZULYDZQXTGNT-NRFANRHFSA-N 455.470 5.393 5 20 JKBD O=C(Nc1nc2ccccc2s1)c1ccc(C(=O)Nc2nc3ccccc3s2)c([N+](=O)[O-])c1 603834564 ZCTXOPFKVJLMDY-UHFFFAOYSA-N 475.511 5.319 5 20 JKBD COc1ccc(CN[C@H](c2ccc(Cl)cc2)c2nccn2C)cc1OCc1ccc([N+](=O)[O-])cc1 604417923 PQWGDXVYYCHPTK-RUZDIDTESA-N 492.963 5.449 5 20 JKBD COc1ccc(NC(=O)[C@@H](C)Sc2ccc([N+](=O)[O-])cc2)cc1OCc1ccc2ccccc2n1 609066627 RPAMJOYUZVEASD-QGZVFWFLSA-N 489.553 5.850 5 20 JKBD CC(C)c1noc2nc(-c3ccco3)cc(C(=O)O[C@H](C)C(=O)Nc3ccc([N+](=O)[O-])cc3Cl)c12 727918586 LPGVLJTZWQZCKB-GFCCVEGCSA-N 498.879 5.352 5 20 JKBD COC1CCN(c2ccc(NC(=O)c3cc([N+](=O)[O-])c(C)c([N+](=O)[O-])c3C)cc2C(F)(F)F)CC1 728010661 IEQSFVJGZZNQKP-UHFFFAOYSA-N 496.442 5.006 5 20 JKBD O=C(OCCOC(c1ccccc1)c1ccccc1)c1csc(-c2ccc([N+](=O)[O-])cc2)n1 747958357 ZQXMGBMPNBGLQC-UHFFFAOYSA-N 460.511 5.681 5 20 JKBD C[C@H](OC(=O)c1csc(-c2cccc([N+](=O)[O-])c2)n1)C(=O)Nc1ccc(Cl)c(Cl)c1 747961068 FLGAQIUCKVETSS-JTQLQIEISA-N 466.302 5.209 5 20 JKBD C[C@H](c1ccc(F)cc1)N(C)C(=O)c1ccc(NS(=O)(=O)c2ccc(Cl)c([N+](=O)[O-])c2)cc1 762125760 KNISMWIVMBOREP-CQSZACIVSA-N 491.928 5.021 5 20 JKBD C[C@@H]1C[C@@H](C)CN(c2ccc(C(=O)OCC(=O)Nc3c(Cl)cccc3Cl)cc2[N+](=O)[O-])C1 787458035 ZGNLZNRSRKPDHD-ZIAGYGMSSA-N 480.348 5.179 5 20 JKBD CCc1nc2ccccc2c(C(=O)O[C@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2C(F)(F)F)c1C 787858174 POKDUGJOXIYGDP-CYBMUJFWSA-N 475.423 5.217 5 20 JKBD O=C(CSc1nnc(-c2ccc(F)cc2)n1Cc1ccccc1)Nc1ccc(Cl)c([N+](=O)[O-])c1 843574309 BHVRVTLYSUIWPR-UHFFFAOYSA-N 497.939 5.425 5 20 JKBD CC(C)N(Cc1nnc(-c2cccc([N+](=O)[O-])c2)o1)C(=O)CCOc1cccc(Cl)c1Cl 916036360 NDDBHZNEEMEHMT-UHFFFAOYSA-N 479.320 5.158 5 20 JKBD Cc1csc(Sc2ccc(C(=O)Oc3cccc(NC(=O)C4CC4)c3)cc2[N+](=O)[O-])n1 916422517 WHHVPXLMRNUYRB-UHFFFAOYSA-N 455.517 5.079 5 20 JKBD COC(=O)c1ccc(NC(=O)CSc2ccccc2C(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)cc1 916695516 QAZQSMTZCQOONV-UHFFFAOYSA-N 499.932 5.018 5 20 JKBD Cc1cc(NC(=O)c2ccccc2Cl)sc1C(=O)OCc1nc(-c2ccc([N+](=O)[O-])cc2)no1 919163810 MOAAQZRFNLWNMA-UHFFFAOYSA-N 498.904 5.277 5 20 JKBD O=C(O[C@H](C(=O)Nc1ccccc1)c1ccccc1)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-] 919196349 UDPXLCJTSKBPQI-FQEVSTJZSA-N 474.391 5.073 5 20 JKBD C[C@@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)OCC(=O)N1c2ccccc2Sc2ccccc21 920780005 WVHDYGQRBINPDI-CQSZACIVSA-N 484.917 5.388 5 20 JKBD COc1cc(C(=O)NCc2ccc(-n3ccnc3)cc2)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 921147784 UCVJEMFFAYDSRO-UHFFFAOYSA-N 478.892 5.165 5 20 JKBD Cn1c(C(=O)NC2(c3ccc(NC(=O)Cc4cccc([N+](=O)[O-])c4)cc3)CCC2)cc2ccccc21 1785792074 RIEVOEKKBFTVKX-UHFFFAOYSA-N 482.540 5.077 5 20 JKBD Cc1ccc2[nH]c(C(=O)NC3(c4ccc(NC(=O)c5cc(C)c([N+](=O)[O-])cn5)cc4)CCC3)cc2c1 1788766287 DFCMRLUFBKVFBB-UHFFFAOYSA-N 483.528 5.149 5 20 JKBD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CCc1cccc([N+](=O)[O-])c1)c1ccccc1Oc1ccccc1 1793940120 PZGBUJKSVZDIFY-NUNAXRQHSA-N 499.567 5.272 5 20 JKBD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(-c2ccccc2)c(F)c1)c1cccc(F)c1[N+](=O)[O-] 1799343660 SEDXFKVCQPVHSB-ACDBMABISA-N 491.494 5.106 5 20 JKBD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)[nH]n1)c1cccc(F)c1 1820492342 KSJFHKKKKDEAAD-IBGZPJMESA-N 493.520 5.291 5 20 JKBD CC1=CC[C@@H](C(=O)N2CCCC[C@H]2c2cc(NC(=O)c3cc(Cl)cc([N+](=O)[O-])c3C)n[nH]2)CC1 1821294641 RTCVQLJDCCXSEL-UZLBHIALSA-N 485.972 5.332 5 20 JKBD O=C(CSc1ccccc1[N+](=O)[O-])Nc1cc([C@@H]2CCCCN2C(=O)/C=C/C2CCCCC2)[nH]n1 1822313231 LAWDMZNIKFVSJD-AIGDTVQASA-N 497.621 5.239 5 20 JKBD O=C(Nc1cc([C@@H]2CCCCN2C(=O)/C=C/c2ccccc2[N+](=O)[O-])[nH]n1)c1cc(F)cc(Cl)c1 1823213546 XOMPOQJGNMKWIN-SHBDEGQCSA-N 497.914 5.130 5 20 JKBD O=C(c1cc(Cl)ccc1F)N1CCC([C@H]2CCCCN2C(=O)c2cc(F)cc([N+](=O)[O-])c2)CC1 1830612747 KYWPFZYJFUDESI-JOCHJYFZSA-N 491.922 5.074 5 20 JKBD Cc1cccc(C)c1C(=O)N1CCC([C@@H]2CCCCN2C(=O)CSc2ccccc2[N+](=O)[O-])CC1 1831778007 ZMBPZBMYLWNHHN-QFIPXVFZSA-N 495.645 5.237 5 20 JKBD Cc1ccc(Sc2ccc(C(=O)N3CCC(C(=O)c4ccccc4)CC3)cc2[N+](=O)[O-])cc1 9987124 MXDOJZOBULZDCE-UHFFFAOYSA-N 460.555 5.790 5 20 JKBD Cc1ccccc1NC(=O)c1cc2ccccc2cc1OCc1cc([N+](=O)[O-])cc2c1OCOC2 14736187 GNMYSVPELTVFSX-UHFFFAOYSA-N 470.481 5.754 5 20 JKBD CCOc1cc(/C=C(\Cl)c2nc3cc([N+](=O)[O-])ccc3[nH]2)ccc1OCC(=O)Nc1ccccc1 18064345 MLZLWOBPPCPEBU-UNOMPAQXSA-N 492.919 5.624 5 20 JKBD Cc1cccc(C)c1NC(=O)CNC(=O)c1ccc(Sc2nc3ccccc3s2)c([N+](=O)[O-])c1 24948839 BZNABXGVAFBCQB-UHFFFAOYSA-N 492.582 5.341 5 20 JKBD O=C(c1ccc(NCc2ccccc2)c([N+](=O)[O-])c1)N1CCC[C@@H](c2nc3ccccc3o2)C1 27374566 JULINFVOGITOKK-HXUWFJFHSA-N 456.502 5.368 5 20 JKBD Cc1cccc(C)c1-n1c(SCc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)nc2ccccc2c1=O 28809008 QBIOIJYGPXNYBN-UHFFFAOYSA-N 485.525 5.253 5 20 JKBD CNC(=O)Cc1ccc(NC(=O)C/C(=C/c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)cc1 29360348 GNLSXCCJKADPQW-RGEXLXHISA-N 486.553 5.062 5 20 JKBD Cc1ccc([N+](=O)[O-])cc1NC(=O)c1ccc2c(c1)C(=O)N(c1cc(Cl)ccc1Cl)C2=O 33158629 VXGYJSOCAHQJHX-UHFFFAOYSA-N 470.268 5.263 5 20 JKBD Cc1nc(NC(=O)c2ccc(N3CCCC3)c([N+](=O)[O-])c2)sc1-c1nc2ccccc2n1C(F)F 477589183 IUFFNBNMBXGHJW-UHFFFAOYSA-N 498.515 5.624 5 20 JKBD CN(C(=O)Cc1ccc(NC(=O)c2csc(-c3ccc([N+](=O)[O-])cc3)n2)cc1)c1ccccc1 498732792 FWVBJGMPPDWFKA-UHFFFAOYSA-N 472.526 5.176 5 20 JKBD C[C@H](Nc1ccc(C(=O)Nc2ccc(Cl)c(C(F)(F)F)c2)cc1[N+](=O)[O-])c1ccccn1 506098694 GPUKOSLIMSLHRI-LBPRGKRZSA-N 464.831 6.087 5 20 JKBD CCOc1cc(NC(=O)N2CCN(Cc3ccc(-c4ccccc4[N+](=O)[O-])s3)CC2)ccc1OC 510555980 YLIDJURLLKUOPK-UHFFFAOYSA-N 496.589 5.080 5 20 JKBD COc1ccc([C@@H](C)N[C@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2ccccc2)cc1F 511072378 KAGGKAUJEUSJQK-PEBXRYMYSA-N 457.889 5.427 5 20 JKBD O=C(Nc1ccc(=O)n(Cc2ccc(Cl)c(Cl)c2)c1)c1cc2cc([N+](=O)[O-])ccc2o1 520099366 BBLGPDKBDZWNJX-UHFFFAOYSA-N 458.257 5.110 5 20 JKBD O=C(N[C@H](c1ccc(F)cc1)[C@@H]1CCCO1)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 521388184 SILTYUXAFUVNAC-FCHUYYIVSA-N 495.473 5.006 5 20 JKBD O=C(N[C@H](c1ccccc1)c1ccc2nc(C(F)(F)F)[nH]c2c1)c1c[nH]c2cc([N+](=O)[O-])ccc12 592952590 DUWRKLCLFQZCJU-OAQYLSRUSA-N 479.418 5.491 5 20 JKBD Cc1cc(N2CCN(C)CC2)ccc1NC(=O)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1 602075362 TUJUXCYMRBMSLC-UHFFFAOYSA-N 480.952 5.353 5 20 JKBD O=C(c1ccc(NCc2ccccc2)c([N+](=O)[O-])c1)N1CC=C(c2c[nH]c3ncccc23)CC1 603461054 JFEYPGJCDGTQKM-UHFFFAOYSA-N 453.502 5.013 5 20 JKBD CCOC(=O)C[C@@H](c1ccccc1)C1CCN(C(=O)c2csc(-c3ccc([N+](=O)[O-])cc3)n2)CC1 604519513 BZSRWWJTGVJIFT-QFIPXVFZSA-N 493.585 5.308 5 20 JKBD Cc1ccccc1CC(C)(C)NC(=O)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 609105519 MHPFQFCVPPRJDN-UHFFFAOYSA-N 463.500 5.276 5 20 JKBD C[C@H](Nc1ccc(C(=O)N2CCCC[C@@H]2Cc2ccc(F)cc2)cc1[N+](=O)[O-])c1ccccn1 609187686 UBLIKVTXBZIPKJ-PGRDOPGGSA-N 462.525 5.539 5 20 JKBD O=C(Cn1c2ccccc2c(=O)c2ccccc21)Nc1nc(-c2ccco2)c(-c2ccco2)s1 648022991 AGHKIKOAFSAPMB-UHFFFAOYSA-N 467.506 5.770 5 20 JKBD COc1ccc(NC(=S)/C(=C(/O)c2ccc([N+](=O)[O-])cc2)[n+]2ccc(C(C)(C)C)cc2)cc1Cl 726960896 DPDCUAPXVLRPCX-UHFFFAOYSA-O 499.012 6.165 5 20 JKBD COc1ccccc1[C@@H](C)CC(=O)Oc1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2Cl)cc1 728457309 YKSOUXDETALIPP-HNNXBMFYSA-N 468.893 5.608 5 20 JKBD O=C(COC(=O)c1csc(-c2ccc([N+](=O)[O-])cc2)n1)c1ccc(OCc2ccccc2)cc1 730603523 ZKRYLJKYGPZVLC-UHFFFAOYSA-N 474.494 5.337 5 20 JKBD Cc1cc(COc2ccc(C(=O)O[C@H](C)c3cccc([N+](=O)[O-])c3)cc2Br)on1 742965809 DYWQFEZIAMPWMG-CYBMUJFWSA-N 461.268 5.151 5 20 JKBD COc1cc(-c2cc(C(=O)Nc3ccc([N+](=O)[O-])cc3F)c3ccccc3n2)cc(OC)c1OC 745340566 ONHHMTMRWWZUEV-UHFFFAOYSA-N 477.448 5.227 5 20 JKBD CC(C)(C)OC(=O)N1CCC[C@H]1[C@@H]1CCCN(C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)C1 749658425 DBEUWHFGMSGKHQ-QAPCUYQASA-N 459.568 5.061 5 20 JKBD CN(Cc1cc([N+](=O)[O-])ccc1Cl)C(=O)Cc1csc(-c2cccc(C(F)(F)F)c2)n1 751311059 XWBSKWVOXNZONZ-UHFFFAOYSA-N 469.872 5.592 5 20 JKBD Cn1c(Cl)cnc1COC(=O)C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1 804859666 DCFCKMWOOUTUNI-XNTDXEJSSA-N 468.922 5.266 5 20 JKBD O=C(COC(=O)c1ccccc1NC(=O)c1ccc([N+](=O)[O-])cc1Cl)c1cccc(Cl)c1 847382455 PHXQXTUHDJCVGQ-UHFFFAOYSA-N 473.268 5.194 5 20 JKBD O=[N+]([O-])c1cc(Cl)ccc1OCCc1nc(-c2ccc(Cn3cnc4ccccc43)cc2)no1 904472210 GQQZBKNBFBHISW-UHFFFAOYSA-N 475.892 5.318 5 20 JKBD CCN1C(=S)N[C@H](c2ccc(C)c([N+](=O)[O-])c2)C(C(=O)Nc2ccccc2C(F)(F)F)=C1C 916163367 APJGBEVLHHLIKN-LJQANCHMSA-N 478.496 5.086 5 20 JKBD CSc1ccccc1NC(=O)[C@H](C)OC(=O)c1ccc(N[C@@H](C)c2ccccn2)c([N+](=O)[O-])c1 920544975 ORLKLRDLBWKBNO-HOTGVXAUSA-N 480.546 5.069 5 20 JKBD O=C(CCc1cccc([N+](=O)[O-])c1)NC1(c2ccc(NC(=O)c3ccnc(C(F)F)c3)cc2)CCC1 1787014773 WZFFEYBLAPFGLM-UHFFFAOYSA-N 494.498 5.308 5 20 JKBD Cc1cc(C(=O)Nc2ccc(C3(NC(=O)c4cccc(Cl)c4)CCC3)cc2)ncc1[N+](=O)[O-] 1788766844 UZHGYUNGCVZBHQ-UHFFFAOYSA-N 464.909 5.013 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)c3cccc(F)c3[N+](=O)[O-])CCC2)cc1)c1ccc(Cl)o1 1788881045 VYAQFKRSVQKQOK-UHFFFAOYSA-N 457.845 5.042 5 20 JKBD O=C(NC1(c2ccc(NC(=O)c3ccc4occc4c3O)cc2)CCC1)c1cc(F)cc([N+](=O)[O-])c1 1790930800 HPBVDTCWKJMMRV-UHFFFAOYSA-N 489.459 5.247 5 20 JKBD O=C(C[C@H]1C[C@@H]2CC[C@H]1C2)Nc1ccc(C2(NC(=O)c3cc([N+](=O)[O-])cc4c3OCC4)CCC2)cc1 1791323914 OKRZSJJMJBJUON-WSTZPKSXSA-N 489.572 5.104 5 20 JKBD O=C(Cc1cc(F)ccc1[N+](=O)[O-])Nc1ccc(C2(NC(=O)c3ccc4ccoc4c3)CCC2)cc1 1792309146 CWUAPYKBDRROTC-UHFFFAOYSA-N 487.487 5.471 5 20 JKBD Cc1ccc(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)c3ccc([N+](=O)[O-])cc3F)[nH]n2)cc1Cl 1814590372 DMERNCYNVUNTJU-FQEVSTJZSA-N 485.903 5.039 5 20 JKBD Cc1c(Cl)cccc1C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2ccc([N+](=O)[O-])cc2F)[nH]n1 1814599075 AEBXUSCOZJRJHA-HXUWFJFHSA-N 485.903 5.039 5 20 JKBD CC1=CC[C@H](C(=O)N2CCCC[C@H]2C2CCN(C(=O)Cc3ccc(Cl)cc3[N+](=O)[O-])CC2)CC1 1828343610 IPKDVCXPKHJDAV-REWPJTCUSA-N 488.028 5.157 5 20 JKBD C[C@H](OC(=O)c1ccc(Cl)c(Cl)c1)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 10732011 OIMXAVILIVEGSP-QMMMGPOBSA-N 451.184 5.104 5 20 JKBD O=C(c1ccc([N+](=O)[O-])cc1)N(C[C@H]1CCCO1)c1nc(-c2ccc(Br)cc2)cs1 14819592 ZBKXXHWWYXIBLP-GOSISDBHSA-N 488.363 5.307 5 20 JKBD O=C1/C(=C/c2ccc(-c3ccccc3[N+](=O)[O-])o2)N=C(S)N1c1ccc(OC(F)(F)F)cc1 15260024 LLLJBIQOJANTBF-WJDWOHSUSA-N 475.404 5.427 5 20 JKBD C[C@H](Sc1nc2cc3ccccc3cc2c(=O)n1C)C(=O)Nc1cc(Cl)ccc1Cl 24969950 SXVQMRSLNLIVHM-LBPRGKRZSA-N 458.370 5.513 5 20 JKBD O=[N+]([O-])c1ccc(-c2nnc(CSc3nnc(-c4ccccc4F)n3Cc3ccccc3)o2)cc1 72100224 ADQDYHPRCAPQOE-UHFFFAOYSA-N 488.504 5.383 5 20 JKBD COCCN(Cc1ccc(F)cc1Cl)C(=O)c1ccc(N[C@H](C)c2ccccn2)c([N+](=O)[O-])c1 409965019 WQVLMDOMQBTHER-MRXNPFEDSA-N 486.931 5.244 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)Nc2c(C)c(C(C)(C)C)nn2-c2ccccc2)cc1SC 410024377 ZZANEWOQEMQISL-UHFFFAOYSA-N 454.552 5.369 5 20 JKBD Cc1ccc(NC(=O)Nc2ccccc2)cc1NC(=O)c1csc(-c2ccc([N+](=O)[O-])cc2)n1 496394988 NZRSGJFOSSYSHL-UHFFFAOYSA-N 473.514 5.923 5 20 JKBD Cc1nn(Cc2ccc(C(=O)N[C@H](COc3ccccc3)c3ccccc3)cc2)c(C)c1[N+](=O)[O-] 502346085 NTEPKRVZNDFSSF-RUZDIDTESA-N 470.529 5.007 5 20 JKBD COc1cc(C(=O)Nc2cccc(Oc3ccccc3)c2)c([N+](=O)[O-])cc1OCc1cscn1 509892814 GDSDFBFZFYKKMN-UHFFFAOYSA-N 477.498 5.684 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Br)[C@@H](N[C@@H]1CCc2cc(F)ccc21)c1ccccc1 513182569 HDVNXOBRTUSOEA-IRLDBZIGSA-N 484.325 5.453 5 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HKOYAFYKWPIPHL-LVZFUZTISA-N 470.573 5.186 5 20 JKBD O=C(N[C@@H]1C[C@@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1)c1cc([N+](=O)[O-])ccc1NCc1ccccc1 603572743 DGSASVVIMJUNPR-ZSHCYNCHSA-N 489.416 5.846 5 20 JKBD COCCOc1ccc(NC(=O)c2ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])cc2)c(C)c1 603977089 IOSOOOOWFMLSDZ-UHFFFAOYSA-N 456.882 5.626 5 20 JKBD CC(=O)CCc1ccc(OCc2cccc(C(=O)Nc3cc4c(cc3[N+](=O)[O-])OCCCO4)c2)cc1 608933330 DDTYIRBUIFPFEM-UHFFFAOYSA-N 490.512 5.109 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Cl)[C@@H](c1ccccc1)N1CCO[C@H](c2ccc(F)c(F)c2)C1 608976189 UELWGGKBHHKBQO-XZOQPEGZSA-N 487.890 5.280 5 20 JKBD O=C(Cc1csc(-c2cccc(Br)c2)n1)Nc1ccc([N+](=O)[O-])c(Cl)c1 727710707 AEONOCDDWCLQGZ-UHFFFAOYSA-N 452.717 5.315 5 20 JKBD Cc1cc(C(=O)N(CC2CC2)c2ccc(Cl)c([N+](=O)[O-])c2)c2cnn(Cc3cccs3)c2n1 728166286 ZQSJNEDKQONFOD-UHFFFAOYSA-N 481.965 5.468 5 20 JKBD CC(C)N(Cc1nnc(-c2cccc([N+](=O)[O-])c2)o1)C(=O)[C@H]1C[C@H]1c1ccc2ccccc2c1 731163853 BLOMCWVCTVKNJF-GOTSBHOMSA-N 456.502 5.339 5 20 JKBD C[C@H]1C[C@@H](C)CN(c2ccc(C(=O)O[C@@H](C)c3nnc(-c4cccs4)o3)cc2[N+](=O)[O-])C1 745930538 OPBFYERZOZFJKX-ZNMIVQPWSA-N 456.524 5.107 5 20 JKBD Cc1ccc(NC(=O)Nc2ccccc2)cc1NC(=O)c1cc([N+](=O)[O-])c(C)c([N+](=O)[O-])c1C 748621242 KKDUHAPDDYPMJT-UHFFFAOYSA-N 463.450 5.325 5 20 JKBD COc1c([N+](=O)[O-])cc(NCc2ccc(Oc3cccc(F)c3)nc2)c([N+](=O)[O-])c1Br 749248088 HWVWUTWPBWOSCL-UHFFFAOYSA-N 493.245 5.213 5 20 JKBD COc1cc(C(=O)N2CCC([C@@H](O)c3ccccc3)CC2)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 817877745 DBCCRAZDJDGIMK-VWLOTQADSA-N 496.947 5.635 5 20 JKBD Cc1cc(C(=O)[C@H](C)OC(=O)Cn2c3ccccc3c(=O)c3ccccc32)c(C)n1Cc1ccco1 841980017 VLSIMYYTRVNXNM-FQEVSTJZSA-N 482.536 5.029 5 20 JKBD CC(=O)N(c1ccc(Cl)cc1)c1nc(/C=C2/N=C(c3ccc([N+](=O)[O-])c(C)c3)OC2=O)cs1 917601240 OKPNEUHLTHOWBC-VCHYOVAHSA-N 482.905 5.042 5 20 JKBD Cc1nc(NC(=O)c2cc([N+](=O)[O-])cc([N+](=O)[O-])c2C)sc1Cc1cccc(Br)c1 917736986 ALMHYYRQXGFACE-UHFFFAOYSA-N 491.323 5.182 5 20 JKBD CSc1ccc(C(=O)OCc2csc(N(C(C)=O)c3ccc(Cl)cc3)n2)cc1[N+](=O)[O-] 918816203 MPVWARUUZZZPRA-UHFFFAOYSA-N 477.951 5.468 5 20 JKBD COc1nc(C(=O)O[C@@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2ccccc2)cc2ccccc12 920736652 TWYBADCSZPDJTI-JOCHJYFZSA-N 491.887 5.342 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)c3ccc(C(F)(F)F)cc3F)CCC2)cc1)c1ccc([N+](=O)[O-])o1 1785752793 PPAXAKBCWGDHMO-UHFFFAOYSA-N 491.397 5.407 5 20 JKBD O=C(CCc1cccc([N+](=O)[O-])c1)Nc1ccc(C2(NC(=O)CCCc3cccnc3)CCC2)cc1 1786601434 OBBCHRWSODDOJW-UHFFFAOYSA-N 486.572 5.079 5 20 JKBD COc1ccc(CC(=O)Nc2ccc(C3(NC(=O)CCCC(F)(F)F)CCC3)cc2)c([N+](=O)[O-])c1 1790570684 BBGQJYJNQUFKTG-UHFFFAOYSA-N 493.482 5.013 5 20 JKBD Cc1ccc2cc(C(=O)N3[C@H]4CC[C@@H]3C[C@H](NC(=O)CCc3cccc([N+](=O)[O-])c3)C4)sc2c1 1801082059 SEYIMFLOZOCKKU-WKCHPHFGSA-N 477.586 5.003 5 20 JKBD CC(C)[C@@H](C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cccc(F)c1[N+](=O)[O-])C2)c1ccc(Cl)cc1 1801552218 PJEVSTLTAPUDGQ-VQQMMKBISA-N 487.959 5.079 5 20 JKBD O=C(Cc1ccc(Cl)cc1[N+](=O)[O-])N1CCCC2(CCN(C(=O)c3ccc(C4CC4)cc3)CC2)C1 1805485040 OZAZDOHUQGRYIB-UHFFFAOYSA-N 496.007 5.213 5 20 JKBD C[C@H](C(=O)N1CCC([C@@H]2CCCCN2C(=O)Cc2ccc(Cl)cc2[N+](=O)[O-])CC1)c1ccccc1 1824157705 BERVBUKLANHEAW-CYFREDJKSA-N 498.023 5.214 5 20 JKBD O=C(c1cc(O)cc([N+](=O)[O-])c1)N1CCC([C@@H]2CCCCN2C(=O)[C@@H]2CCC[C@H]3CCCC[C@@H]32)CC1 1828460938 VDAWNHVTCHDFIG-IWRQBJDLSA-N 497.636 5.140 5 20 JKBD Cc1ccc(SCC(=O)N2CCC([C@@H]3CCCCN3C(=O)c3cccc(F)c3[N+](=O)[O-])CC2)cc1 1830621441 KNJBXOMUJJOZSO-QHCPKHFHSA-N 499.608 5.068 5 20 JKBD CCc1ccccc1N(C(C)=O)c1nc(COC(=O)c2ccc(SC)c([N+](=O)[O-])c2)cs1 9620800 NBYJBCFFFUZWTI-UHFFFAOYSA-N 471.560 5.377 5 20 JKBD C[C@H](OC(=O)c1ccccc1C(=O)c1ccccc1)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 11024581 ZADACJGWQHLPOB-AWEZNQCLSA-N 486.402 5.029 5 20 JKBD COc1cc(CCNC(=O)CCc2c(-c3ccccc3)[nH]c3ccc(F)cc23)c([N+](=O)[O-])cc1OC 11208419 VDLWEMDCZZUMGH-UHFFFAOYSA-N 491.519 5.191 5 20 JKBD Cc1ccc(NC(=O)[C@H](OC(=O)/C=C/c2ccc3ccccc3n2)c2ccccc2)c([N+](=O)[O-])c1 20974684 VOFNZMIERVJRSK-ZRVKMLQASA-N 467.481 5.388 5 20 JKBD CCOc1cc(C(=O)Nc2nc(-c3ccc(OC)c(Cl)c3)cs2)c([N+](=O)[O-])cc1OC 26789714 DUHRKBJPPIOJMZ-UHFFFAOYSA-N 463.899 5.040 5 20 JKBD Cc1cc(C)n([C@H](C)C(=O)Nc2ccc(NC(=O)c3cc([N+](=O)[O-])ccc3Cl)cc2Cl)n1 109143673 VXWMQKHBEHDCMQ-CYBMUJFWSA-N 476.320 5.167 5 20 JKBD Cc1ccc(Oc2ccc(Cl)cc2NC(=O)Cn2nc(-c3cccc([N+](=O)[O-])c3)ccc2=O)cc1 195741423 MJSBNFVPGHSZSE-UHFFFAOYSA-N 490.903 5.211 5 20 JKBD CCOc1ccc(Oc2ccc(Cl)cc2NC(=O)c2cc(SC)c(OC)cc2[N+](=O)[O-])cc1 482103049 JDRVAFSPROAOHD-UHFFFAOYSA-N 488.949 6.422 5 20 JKBD CC(=O)N(C)C1CCN(C(=O)c2c3c(nc4ccccc24)/C(=C\c2ccc([N+](=O)[O-])cc2)CCC3)CC1 500026945 CNEQEGGSRKEIGH-UZYVYHOESA-N 498.583 5.103 5 20 JKBD Cc1csc(Sc2ccc(C(=O)Nc3ccccc3-c3nnc(C)o3)cc2[N+](=O)[O-])n1 514449604 AFCVIWKSRJTORL-UHFFFAOYSA-N 453.505 5.122 5 20 JKBD C[C@H]1CCCCN1C(=O)c1ccc(NC(=O)c2ccc(N3CCCC3)c([N+](=O)[O-])c2)cc1Cl 515611673 OFNSKXSQCNXYEM-INIZCTEOSA-N 470.957 5.115 5 20 JKBD Cc1nccn1-c1ccc(CNCc2ccc(Oc3ccc(F)cc3)c([N+](=O)[O-])c2)cc1F 518779450 RZXDQIFQZMVECX-UHFFFAOYSA-N 450.445 5.449 5 20 JKBD COc1cc(OCC(=O)Nc2ccc(Oc3ccccc3)cc2C(F)(F)F)ccc1[N+](=O)[O-] 519094409 LCZMJNGUDRFECP-UHFFFAOYSA-N 462.380 5.432 5 20 JKBD COCCN(C(=O)c1csc2c1CC[C@@H](C)C2)c1nc(-c2ccc([N+](=O)[O-])cc2)cs1 603461405 NHHHGNNEAQQCMU-CQSZACIVSA-N 457.577 5.198 5 20 JKBD O=C(Nc1ncc(Cc2ccccc2Cl)s1)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-] 603733201 QQHYWCVEVARCHB-UHFFFAOYSA-N 471.844 5.489 5 20 JKBD O=C(Nc1nc2cc(C(F)(F)F)ccc2s1)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-] 603737983 CWZVOLXRHVJPED-UHFFFAOYSA-N 465.331 5.417 5 20 JKBD COc1ccc(CNC[C@H]2CCN(c3ccc(F)c(F)c3)C2)cc1OCc1ccc([N+](=O)[O-])cc1 608782083 WFVBMGWDERPLPR-HXUWFJFHSA-N 483.515 5.077 5 20 JKBD CC[C@H](NCc1ccc(-c2ccc([N+](=O)[O-])cc2)o1)c1ccccc1OCC(=O)N1CCCC1 608836117 NUMPMHKDLAMFNK-QHCPKHFHSA-N 463.534 5.097 5 20 JKBD C[C@H](NCc1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1)c1ccc(NC(=O)NC2CC2)cc1 608836273 YRWLEYPPCHGVLV-IBGZPJMESA-N 496.571 5.582 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Cl)[C@H](c1ccccc1)N1CCO[C@H](c2ccc(F)c(F)c2)C1 608976187 UELWGGKBHHKBQO-GOTSBHOMSA-N 487.890 5.280 5 20 JKBD Cc1ccc(NC(=O)CSc2nnc(NC(=O)c3cc4ccccc4c4cccnc34)s2)c(C)c1 613510660 GLVFCYOXUVFNFW-UHFFFAOYSA-N 499.621 5.839 5 20 JKBD Cc1ccc(NC(=O)[C@H](OC(=O)c2csc(-c3ccc(O)cc3)n2)c2ccccc2)c([N+](=O)[O-])c1 726646838 ZPFVLEHCYXWMQY-JOCHJYFZSA-N 489.509 5.269 5 20 JKBD Cc1ccc(Cl)c(NC(=S)N(Cc2nnc(-c3cccc([N+](=O)[O-])c3)o2)C(C)C)c1Cl 728445117 GGCBXSHEJZAGGQ-UHFFFAOYSA-N 480.377 5.867 5 20 JKBD C[C@@H]1CCCN(c2ccc(C(=O)O[C@H](C)C(=O)Nc3ccccc3C(F)(F)F)cc2[N+](=O)[O-])C1 728948768 POSWJEFPUISALV-HUUCEWRRSA-N 479.455 5.034 5 20 JKBD O=C(Nc1ccccc1C(=O)NCCc1ccccc1Cl)c1ccc([N+](=O)[O-])cc1Cl 742428140 JIMDTTSETDUYSI-UHFFFAOYSA-N 458.301 5.126 5 20 JKBD Cc1ccc(-c2ncc(C(=O)O[C@H](C)C(=O)Nc3cc([N+](=O)[O-])ccc3Cl)s2)c(C)c1 747261147 SWJAMIPSSKQUHV-CYBMUJFWSA-N 459.911 5.173 5 20 JKBD C[C@@H](OC(=O)c1cnc(-c2ccccc2Cl)s1)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl 747954912 ONFSBSDPXPXKHF-SNVBAGLBSA-N 466.302 5.209 5 20 JKBD Cc1ccc(-c2noc(CCCOC(=O)c3csc(-c4cccc([N+](=O)[O-])c4)n3)n2)cc1F 747963630 XCJONZUOJUROKF-UHFFFAOYSA-N 468.466 5.005 5 20 JKBD C[C@H](Nc1ccc(-c2nc(-c3ccsc3C(F)(F)F)no2)cc1[N+](=O)[O-])c1ccccn1 904926706 XOZHJXIKLMCXNT-NSHDSACASA-N 461.425 5.960 5 20 JKBD C[C@@H]1Cc2cc([N+](=O)[O-])ccc2N1Cn1nc(-c2c[nH]c3ccccc23)n(C[C@H]2CCCO2)c1=S 915205127 JDVITUCDSGOBPL-VQIMIIECSA-N 490.589 5.058 5 20 JKBD CC[C@H](C)c1ccc([C@@H](NC(=O)C(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)c2cccs2)cc1 915743847 WQKKLACLMQODES-LHSJRXKWSA-N 471.966 5.668 5 20 JKBD CC(C)(C)OC(=O)Nc1ccc(C(F)(F)F)cc1NC(=O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1 918615187 PBDOSCVZRFVDMY-UHFFFAOYSA-N 470.360 5.121 5 20 JKBD CC(C)Sc1ccc(C(=O)O[C@@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2C(F)(F)F)cc1 919503134 SAYHORVXNSQFFW-LBPRGKRZSA-N 456.442 5.298 5 20 JKBD C[C@H](Nc1ccc(C(=O)Oc2ccccc2C(=O)NCc2ccccc2)cc1[N+](=O)[O-])c1ccccn1 919679587 WPTQLDFRMLFTCL-IBGZPJMESA-N 496.523 5.312 5 20 JKBD CCOC(=O)/C(=C\c1ccc(-c2ccc(OC)cc2[N+](=O)[O-])o1)c1nccn1Cc1ccccc1 920068154 KMULXKXVCUYJOQ-JCMHNJIXSA-N 473.485 5.212 5 20 JKBD CC(C)(C)c1cc[n+](/C(C(=S)Nc2ccc3c(c2)CCC3)=C(/O)c2ccc([N+](=O)[O-])cc2)cc1 920396078 PTKWUENHDBLSEC-UHFFFAOYSA-O 474.606 5.992 5 20 JKBD O=C(C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)OCc1noc(C2CC2)n1 920513534 JPMXTIAPWNCFQM-LFIBNONCSA-N 462.487 5.139 5 20 JKBD O=C(/C=C/c1ccccc1[N+](=O)[O-])NC1(c2ccc(NC(=O)C3(C(F)(F)F)CC3)cc2)CCC1 1789200267 XBQQKJRLOPLVJC-IZZDOVSWSA-N 473.451 5.085 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)[C@H]3CCCCC3(F)F)CCC2)cc1)c1ccc([N+](=O)[O-])cc1F 1790622667 PYMGKVULZUSKKH-LJQANCHMSA-N 475.467 5.307 5 20 JKBD COc1cc(F)c(C(=O)Nc2ccc(C3(NC(=O)c4cc(F)cc([N+](=O)[O-])c4)CCC3)cc2)c(F)c1 1790676058 FSRMPRBAMLUFAC-UHFFFAOYSA-N 499.445 5.082 5 20 JKBD CC[C@H]1CC[C@H](C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)CC1 1801208849 SYCHQHJAFGWMGB-FWIIZBITSA-N 469.607 5.278 5 20 JKBD CCc1ccccc1N(C(C)=O)c1nc(COC(=O)CSc2ccc([N+](=O)[O-])cc2)cs1 9352157 WTQGJTKZISRQSE-UHFFFAOYSA-N 471.560 5.134 5 20 JKBD CSc1ccc(C(=O)OCc2csc(N(C(C)=O)c3c(C)cc(C)cc3C)n2)cc1[N+](=O)[O-] 9620839 MWIOGSOSIYJNDR-UHFFFAOYSA-N 485.587 5.740 5 20 JKBD Cc1ccc(-c2nc(C)sc2CC(=O)O[C@H](C)C(=O)Nc2cc([N+](=O)[O-])ccc2Cl)cc1 11216241 JLCLDRDRGKHJQT-CYBMUJFWSA-N 473.938 5.101 5 20 JKBD COc1cc(C)c(NC(=O)c2ccc(NCc3ccccc3Cl)c([N+](=O)[O-])c2)cc1OC 11641239 RTFYGYFBEMQREM-UHFFFAOYSA-N 455.898 5.438 5 20 JKBD COc1ccc([N+](=O)[O-])cc1NC(=O)[C@H](C)Sc1nc(-c2cccs2)nc2ccccc12 12424593 RVINESBRUJUMGN-ZDUSSCGKSA-N 466.544 5.394 5 20 JKBD O=C(COC(=O)c1ccc(Oc2ccc(C(F)(F)F)cn2)cc1)Nc1cc(Cl)ccc1[N+](=O)[O-] 16168991 UWMKFRKEVRSVBL-UHFFFAOYSA-N 495.797 5.250 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Cl)[C@H](NCc1cccc(C(F)(F)F)c1)c1ccccc1 21820181 QMBMGEBWTBDGFG-HXUWFJFHSA-N 463.843 5.737 5 20 JKBD CC(=O)Nc1ccc(NC(=O)c2ccc(N3C[C@H](C)C[C@@H](C)C3)c([N+](=O)[O-])c2)c(C(F)(F)F)c1 21900810 QMPSTCPFFGAEJJ-ZIAGYGMSSA-N 478.471 5.307 5 20 JKBD O=C(CCCn1c(=O)oc2cc([N+](=O)[O-])ccc21)N[C@@H](c1ccc2c(c1)CCCC2)c1cccs1 24659310 DDTGLSIUSKGYKZ-VWLOTQADSA-N 491.569 5.129 5 20 JKBD COc1ccc([C@@H]2[C@@H](C(=O)Nc3cccc([N+](=O)[O-])c3C)CCC(=O)N2c2ccc(OC)cc2)cc1 481380808 LTEZQYBUBQRPAA-BKMJKUGQSA-N 489.528 5.043 5 20 JKBD C[C@H]1CCCN(c2ccc(C(=O)Nc3ccc(-n4cccn4)cc3C(F)(F)F)cc2[N+](=O)[O-])C1 482364744 OGVROKNFYKALMK-HNNXBMFYSA-N 473.455 5.288 5 20 JKBD O=C(N[C@@H](COc1ccccc1)c1ccccc1)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-] 502325280 ILEJQJMXPSAWAN-FQEVSTJZSA-N 460.408 5.086 5 20 JKBD C[C@H](Nc1ccc(C(=O)Nc2nc3c(C(F)(F)F)cccc3s2)cc1[N+](=O)[O-])c1ccccn1 505980389 BAOMEGCLFLJGNY-LBPRGKRZSA-N 487.463 6.044 5 20 JKBD CCOC(=O)c1c(NC(=O)c2ccc(N[C@H](C)c3ccccn3)c([N+](=O)[O-])c2)sc(C)c1C 506219689 RVUFAZALMIVBIW-CQSZACIVSA-N 468.535 5.270 5 20 JKBD Cc1ccc(Sc2ccc(C(=O)Nc3cccc(C(=O)N4CCOCC4)c3C)cc2[N+](=O)[O-])cc1 507444901 YICWOGSRTWLKIT-UHFFFAOYSA-N 491.569 5.088 5 20 JKBD C[C@H](Nc1ccc(C(=O)N[C@H](C)c2cccc(OCc3ccccn3)c2)cc1[N+](=O)[O-])c1ccccn1 509518259 FKENHMHFBHFJLB-UXHICEINSA-N 497.555 5.628 5 20 JKBD COc1cc(C(=O)Nc2ccc(NC(=O)c3ccc(Cl)cc3)cc2)c([N+](=O)[O-])cc1OC(F)F 509818067 FYQSDYMSTQDRGV-UHFFFAOYSA-N 491.834 5.363 5 20 JKBD CC(C)N(Cc1ccccn1)C(=O)C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1 516534192 XDSQPKZNLOBPTE-HMMYKYKNSA-N 472.570 5.967 5 20 JKBD CCOc1ccccc1CN(C)C(=O)c1ccccc1C(=O)c1ccc(SC)c([N+](=O)[O-])c1 518307818 SVUNZOYNAPVRQD-UHFFFAOYSA-N 464.543 5.219 5 20 JKBD C[C@@H](NCc1ccc(N(C)c2ccccc2)c([N+](=O)[O-])c1)c1ccc(NC(=O)NC2CC2)cc1 521818398 KGLZECYSXHTROB-GOSISDBHSA-N 459.550 5.497 5 20 JKBD O=C(c1c2c(nc3ccccc13)/C(=C/c1cccc([N+](=O)[O-])c1)CCC2)N1CCC[C@H](c2ncc[nH]2)C1 524339995 KJHAVUSCYRYGEE-UZLGTAQGSA-N 493.567 5.763 5 20 JKBD Cc1c(NC(=O)[C@@H](C)Sc2nnc(-c3ccc(Cl)cc3Cl)n2C(C)C)cccc1[N+](=O)[O-] 596378645 YVIQVAZKQBHEKT-CYBMUJFWSA-N 494.404 6.169 5 20 JKBD Cc1c(NCc2ccc([N+](=O)[O-])cc2)cccc1NC(=O)c1ccccc1I 604010920 KXCKITQYMJWNAP-UHFFFAOYSA-N 487.297 5.372 5 20 JKBD CCCn1c(C)cc(-c2csc(NC(=O)[C@@H]3CCCN3C(=O)c3ccc([N+](=O)[O-])c(C)c3)n2)c1C 608802217 ZVFYJTNMKXHBAY-QFIPXVFZSA-N 495.605 5.098 5 20 JKBD O=C(C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)NCc1nc(-c2ccccc2)n[nH]1 726776015 YUPIBPLCICAWGX-RGEXLXHISA-N 496.552 5.237 5 20 JKBD COC1CCN(c2ccc(NC(=O)c3cc4cc([N+](=O)[O-])ccc4s3)cc2C(F)(F)F)CC1 728012119 WIVQAFCHFKKKGB-UHFFFAOYSA-N 479.480 5.696 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)OCc2csc(COc3ccc(Cl)cc3)n2)cc1SC 728650055 BILQLIPHXNILGK-UHFFFAOYSA-N 480.951 5.371 5 20 JKBD Cc1ccc2nc(-c3ccc(NC(=O)[C@@H](C)OC(=O)c4cc([N+](=O)[O-])cnc4C)cc3)sc2c1 730011846 DJRMCWFPSKRYSD-OAHLLOKOSA-N 476.514 5.067 5 20 JKBD Cc1ccc([C@H](NC(=O)C(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)c2ccc(F)cc2Cl)cc1 731128580 BNIAQOCDZPQPKV-FQEVSTJZSA-N 476.291 5.193 5 20 JKBD O=C(O[C@H](C(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1)c1ccccc1)c1ccc(Cl)nc1Cl 747937088 YUPYKUYODYGXRX-KRWDZBQOSA-N 480.691 5.487 5 20 JKBD CCn1c(SCC(=O)OCc2cccc([N+](=O)[O-])c2)nnc1-c1ccc(Cl)cc1Cl 771751841 WAGRSYCUBRQQMO-UHFFFAOYSA-N 467.334 5.016 5 20 JKBD C[C@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccc(-c2nnc3n2CCCCCC3)cc1 811388521 SWUVCEKPHMYNRN-INIZCTEOSA-N 451.552 5.089 5 20 JKBD O=C(Nc1cc([N+](=O)[O-])c(F)cc1F)[C@H](Oc1ccc(Br)cc1)c1ccccc1 916043472 ZGJQOJLPTSMTSP-LJQANCHMSA-N 463.234 5.394 5 20 JKBD O=C(Cc1ccc(Cl)cc1[N+](=O)[O-])Nc1ccc(C2(NC(=O)c3cnccc3Cl)CCC2)cc1 1786116087 UMTJBLSWMMAOAU-UHFFFAOYSA-N 499.354 5.287 5 20 JKBD O=C(/C=C\c1c[nH]c2ccccc12)Nc1ccc(C2(NC(=O)c3ccc([N+](=O)[O-])o3)CCC2)cc1 1786778249 WOMIUNWRVQJDQI-SDQBBNPISA-N 470.485 5.130 5 20 JKBD CC(C)CCC(=O)NC1(c2ccc(NC(=O)CSc3ccccc3[N+](=O)[O-])cc2)CCC1 1791523843 WXMGSIUPOZHOHH-UHFFFAOYSA-N 455.580 5.257 5 20 JKBD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H]1CCC[C@H]2CCCC[C@@H]21)c1cc2cc([N+](=O)[O-])ccc2s1 1797878841 WJDSUXQHJMHKHH-RPMOBBQVSA-N 495.645 5.668 5 20 JKBD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C1(c2cccc(Cl)c2)CCCC1)c1cc(F)cc([N+](=O)[O-])c1 1802187667 NAUWPTXRTSVYEQ-KOUNCHBCSA-N 499.970 5.151 5 20 JKBD O=C(CCC1CCC1)N1CCCC2(CCN(C(=O)c3cc4cc([N+](=O)[O-])ccc4s3)CC2)C1 1805796863 QBOXCAXXWTVXQU-UHFFFAOYSA-N 469.607 5.235 5 20 JKBD C[C@H](C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cccc(F)c2[N+](=O)[O-])[nH]n1)c1ccc(Cl)cc1 1814662157 ZKBZNMMYDLEWLK-VBKZILBWSA-N 499.930 5.220 5 20 JKBD Cc1cc(C(=O)N[C@H]2CCc3nc(NC(=O)c4cc5cc([N+](=O)[O-])ccc5s4)sc3C2)c(C)o1 1824426661 NKUYCJWLHQXRSH-AWEZNQCLSA-N 496.570 5.015 5 20 JKBD O=C(c1cc2sccc2s1)N1CCC([C@H]2CCCCN2C(=O)c2cc(O)cc([N+](=O)[O-])c2)CC1 1830703957 BBSJHARAAIJJOF-LJQANCHMSA-N 499.614 5.124 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2ccc(Cl)cc2)CC1 1830733208 IMWUMVVJDKDSOI-JOCHJYFZSA-N 487.959 5.243 5 20 JKBD CCCCCCn1c(SCc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)nc2ccccc2c1=O 9120564 FVSKNNRNMBKKBW-UHFFFAOYSA-N 465.535 5.227 5 20 JKBD CN(Cc1cc([N+](=O)[O-])ccc1Cl)C(=O)Cc1csc(-c2cccc(Br)c2)n1 10901558 LNIWRHFCWQQRJO-UHFFFAOYSA-N 480.771 5.335 5 20 JKBD O=C(N[C@H]1CCSc2c(F)cccc21)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 12621824 USTSJFBZTBPLCB-KRWDZBQOSA-N 483.487 5.322 5 20 JKBD Cc1ccc(SCC(=O)Nc2c(Br)cc([N+](=O)[O-])cc2Br)cc1C 20892371 WNQUMUYQNXCWMQ-UHFFFAOYSA-N 474.174 5.467 5 20 JKBD C[C@H](Sc1nnc(-c2ccccc2)c(-c2ccccc2)n1)C(=O)Nc1ccc([N+](=O)[O-])cc1 36801989 KYVRPULOIFJOMR-INIZCTEOSA-N 457.515 5.233 5 20 JKBD O=C(Cc1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1)Nc1cccc(OC(F)F)c1 107874913 YOVASRISADSIHA-UHFFFAOYSA-N 464.428 5.230 5 20 JKBD C[C@@H](Nc1ccc(C(=O)N2CCC[C@H](c3nc4ccccc4o3)C2)cc1[N+](=O)[O-])c1ccccn1 108781258 WTUWXZGXZIUXMQ-MJGOQNOKSA-N 471.517 5.324 5 20 JKBD CCOC(=O)N(C)c1ccc(NC(=O)c2ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])c(OC)c2)cc1 108804336 ZLRAXYPGLKJOII-UHFFFAOYSA-N 499.907 5.894 5 20 JKBD CC(=O)N(c1ccc(F)cc1)c1nc(/C=C(/c2ccncc2)c2ccc([N+](=O)[O-])cc2)cs1 195690976 FCSGRFLQYHNODK-OEAKJJBVSA-N 460.490 5.859 5 20 JKBD COc1ccc(NC(=O)c2cc(C)cc([N+](=O)[O-])c2)cc1NC(=O)c1ccc(Cl)cc1F 195692599 FLMLSWJMTRMRQI-UHFFFAOYSA-N 457.845 5.209 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)Nc2cc(-c3ccccc3)nn2-c2ccccc2)cc1SC 481993022 QAIVXYZWEQBHNN-UHFFFAOYSA-N 460.515 5.430 5 20 JKBD O=C(CCc1ccc(-c2ccccc2F)o1)N(Cc1ccccc1[N+](=O)[O-])CC(F)(F)F 486069290 LYVLQJGXACJJBI-UHFFFAOYSA-N 450.388 5.518 5 20 JKBD Cc1csc(N(C)C(=O)c2c3c(nc4ccccc24)/C(=C/c2cccc([N+](=O)[O-])c2)CCC3)n1 488525053 CQXBBYMVCIXSGO-QGOAFFKASA-N 470.554 6.061 5 20 JKBD COc1ccc([N+](=O)[O-])cc1NC(=O)c1nn(-c2cc(C(F)(F)F)ccc2Cl)c2c1CCC2 498322706 KFFOAEHVDWYDKF-UHFFFAOYSA-N 480.830 5.202 5 20 JKBD O=C(NC1CCN(Cc2cccc(C(F)(F)F)c2)CC1)c1csc(-c2cccc([N+](=O)[O-])c2)n1 498716978 NJHGWCCKESVXMK-UHFFFAOYSA-N 490.507 5.132 5 20 JKBD Cc1ccccc1-c1nnc(S[C@@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)n1Cc1ccco1 501314973 FAKHJRROZWYITM-INIZCTEOSA-N 488.529 5.706 5 20 JKBD C[C@@H](Nc1ccc(C(=O)N(C)[C@H](C)c2cccc(C(F)(F)F)c2)cc1[N+](=O)[O-])c1ccccn1 506180095 TWXRVDOIVSJPHZ-HZPDHXFCSA-N 472.467 6.015 5 20 JKBD C[C@@H](Nc1ccc(C(=O)NC(C)(C)c2ccc(Br)cc2)cc1[N+](=O)[O-])c1ccccn1 507048189 OTMZAYWIFJNAOE-OAHLLOKOSA-N 483.366 5.591 5 20 JKBD CSc1ccc([N+](=O)[O-])c(C(=O)Nc2cccc(NC(=O)Nc3cccc(C(F)(F)F)c3)c2)c1 510283935 XJFSIYCXPJFKDU-UHFFFAOYSA-N 490.463 6.232 5 20 JKBD O=C(Nc1cc([N+](=O)[O-])ccc1OC(F)F)c1ccccc1Sc1ccc(Br)cn1 512011814 SSQHJEWYZZFHFM-UHFFFAOYSA-N 496.289 5.757 5 20 JKBD Cc1ccc(C(C)C)c(Oc2ccc(CNCc3ccc(CN4CCCC4=O)cc3)cc2[N+](=O)[O-])c1 518265942 JYFHQNXAEVWZAO-UHFFFAOYSA-N 487.600 6.231 5 20 JKBD C[C@H](Nc1ccc(C(=O)Nc2nnc(SCc3cccs3)s2)cc1[N+](=O)[O-])c1ccccn1 518627892 PXMYRIMYEBPPST-ZDUSSCGKSA-N 498.615 5.621 5 20 JKBD CN(C(=O)c1ccc(NC(=O)Cn2ccc3cc([N+](=O)[O-])ccc32)cc1Cl)C1CCCCC1 521550944 DORNVDNJLSFAKX-UHFFFAOYSA-N 468.941 5.246 5 20 JKBD CN(Cc1ccncc1)C(=O)c1c2c(nc3ccccc13)/C(=C\c1ccc([N+](=O)[O-])cc1)CCC2 601966424 DRRXCPLDZPEOSN-FXBPSFAMSA-N 464.525 5.687 5 20 JKBD COc1cc(C(=O)N=c2cc(-c3ccccc3)[nH]c3ccccc23)c([N+](=O)[O-])cc1OC(F)F 603549262 NAPGMYJJTAHNKP-UHFFFAOYSA-N 465.412 5.094 5 20 JKBD Cc1ccc(NC(=O)CSc2nnc(NC(=O)c3cc4cc([N+](=O)[O-])ccc4s3)s2)c(C)c1 603819165 DZDVXXAALUXVOC-UHFFFAOYSA-N 499.599 5.261 5 20 JKBD C[C@@H]1C[C@@H](C)CN(c2nnc(Sc3ccc([N+](=O)[O-])c4cnccc34)n2Cc2ccco2)C1 603846951 MANPUGUBSJMKBS-HZPDHXFCSA-N 464.551 5.009 5 20 JKBD Cc1sc(NC(=O)CSc2ccc(C(F)(F)F)cn2)nc1-c1cccc([N+](=O)[O-])c1 603997037 OHLCCEKFHMFCQX-UHFFFAOYSA-N 454.455 5.171 5 20 JKBD Cn1cc(CCCNC(=O)c2c3c(nc4ccccc24)/C(=C/c2ccc([N+](=O)[O-])cc2)CCC3)cn1 608849549 BNGCMDQPXPSMDB-LTGZKZEYSA-N 481.556 5.116 5 20 JKBD O=C(OCc1nc(Cl)ccc1Cl)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 726371016 NQRWPPMSOHXAPH-UHFFFAOYSA-N 478.254 5.275 5 20 JKBD Cn1cc(CC(=O)Oc2ccc(NC(=O)c3cc([N+](=O)[O-])ccc3Cl)cc2)c2ccccc21 743828047 MUKPXSIUPPSMKZ-UHFFFAOYSA-N 463.877 5.140 5 20 JKBD C[C@H](OC(=O)c1csc(-c2cccc([N+](=O)[O-])c2)n1)C(=O)Nc1cc(Cl)ccc1Cl 747963757 QWBMJOSAJGWTEH-JTQLQIEISA-N 466.302 5.209 5 20 JKBD O=C(Nc1ccccc1C(=O)Nc1cccc(Cl)c1)c1cc([N+](=O)[O-])ccc1Br 751053593 GCNRABIWZTUKHS-UHFFFAOYSA-N 474.698 5.515 5 20 JKBD COc1cc(C(=O)N2CC[C@H](Oc3ccc(C)cn3)C2)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 858064026 IWZZMEVWLRLGJN-SFHVURJKSA-N 483.908 5.046 5 20 JKBD CC(C)N(Cc1nnc(-c2cccc([N+](=O)[O-])c2)o1)C(=O)c1cccc(OCc2cccs2)c1 915135398 IRKBZFYDBGRFAR-UHFFFAOYSA-N 478.530 5.336 5 20 JKBD O=C(CCCc1ncc(-c2ccccc2)o1)Oc1ccc(NC(=O)c2cccc([N+](=O)[O-])c2)cc1 915273912 DZYNTLFCEDOBMW-UHFFFAOYSA-N 471.469 5.430 5 20 JKBD Cc1ccc(NC(=S)Nc2ccc([N+](=O)[O-])cc2)cc1S(=O)(=O)Nc1ccc(Cl)cc1 916111332 JYGPTWYISWSKOC-UHFFFAOYSA-N 476.967 5.166 5 20 JKBD Cn1c(COC(=O)c2ccccc2NC(=O)c2ccc([N+](=O)[O-])cc2Cl)nc2cc(Cl)ccc21 918979804 WLBZEXKBDSUPKI-UHFFFAOYSA-N 499.310 5.398 5 20 JKBD CC(=O)N(c1ccc(Cl)cc1)c1nc(COC(=O)c2cc3cccc([N+](=O)[O-])c3[nH]2)cs1 919522867 OCKNRIBZGPIHIC-UHFFFAOYSA-N 470.894 5.228 5 20 JKBD C[C@H](C(=O)Nc1ccc(C2(NC(=O)c3cc4cc([N+](=O)[O-])ccc4s3)CCC2)cc1)C1(O)CCC1 1785831795 JPTXDELDLKJTSO-MRXNPFEDSA-N 493.585 5.108 5 20 JKBD COc1ccc(C(=O)NC2(c3ccc(NC(=O)CCc4cccc([N+](=O)[O-])c4)cc3)CCC2)s1 1786601693 MJYQPEQJWOUQRF-UHFFFAOYSA-N 479.558 5.045 5 20 JKBD CCCc1onc(C)c1C(=O)Nc1ccc(C2(NC(=O)c3c(F)ccc([N+](=O)[O-])c3C)CCC2)cc1 1788778476 JFCFOEANSZOFHN-UHFFFAOYSA-N 494.523 5.353 5 20 JKBD C/C(=C\c1ccc(C)o1)C(=O)Nc1ccc(C2(NC(=O)c3cc(O)cc([N+](=O)[O-])c3)CCC2)cc1 1789585403 BNBIIKDPCRYVDU-FOWTUZBSSA-N 475.501 5.053 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)c3cccnc3-c3cccc(F)c3)CCC2)cc1)c1ccc([N+](=O)[O-])[nH]1 1790185893 ZJZOKVOMGUJPFX-UHFFFAOYSA-N 499.502 5.186 5 20 JKBD COc1ccc(C2(C(=O)Nc3ccc(C4(NC(=O)c5ccc([N+](=O)[O-])o5)CCC4)cc3)CCC2)cc1 1790481396 ADPFVPCAFACBPM-UHFFFAOYSA-N 489.528 5.066 5 20 JKBD Cc1c(C(=O)Nc2ccc(C3(NC(=O)CC(F)(F)F)CCC3)cc2)cc(Cl)cc1[N+](=O)[O-] 1790774563 RTGAIGLYWNHQBO-UHFFFAOYSA-N 469.847 5.257 5 20 JKBD CO/C=C(\C)C(=O)NC1(c2ccc(NC(=O)c3cc4cc([N+](=O)[O-])ccc4s3)cc2)CCC1 1791009860 ASPBHYVZNWCSAA-CCEZHUSRSA-N 465.531 5.107 5 20 JKBD CC(C)O[C@@H](C)C(=O)NC1(c2ccc(NC(=O)c3cc4cc([N+](=O)[O-])ccc4s3)cc2)CCC1 1791010746 UYKKKJUUCILDSN-INIZCTEOSA-N 481.574 5.371 5 20 JKBD COc1ccc(C(=O)Nc2ccc(C3(NC(=O)c4cc(C)c([N+](=O)[O-])cn4)CCC3)cc2)c(Cl)c1 1792143211 DBVZOLYNVWPECU-UHFFFAOYSA-N 494.935 5.022 5 20 JKBD COc1cc(C(=O)Nc2ccc(C3(NC(=O)[C@H](F)c4ccccc4)CCC3)cc2)ccc1[N+](=O)[O-] 1792164227 VWKLGWJZKCZCGO-HSZRJFAPSA-N 477.492 5.062 5 20 JKBD Cc1cccc(CC(=O)N2CCCC3(CCN(C(=O)c4cc5cc([N+](=O)[O-])ccc5s4)CC3)C2)c1 1809250224 CLLNDWDXIUMEFW-UHFFFAOYSA-N 491.613 5.205 5 20 JKBD CCCCC[C@H](C)C(=O)N1CC[C@H](CNC(=O)CSc2ccccc2[N+](=O)[O-])[C@@H]1c1cccnc1 1812985154 HTLYDQKYXYGYFY-HWHXTQLESA-N 498.649 5.004 5 20 JKBD O=C(Nc1cc([C@@H]2CCCCN2C(=O)CCC2CCC2)[nH]n1)c1cc2cc([N+](=O)[O-])ccc2s1 1821612399 WGDAWMMFYNOSHB-IBGZPJMESA-N 481.578 5.419 5 20 JKBD O=C([C@@H]1CCC[C@@H]2CCCC[C@H]21)N1CCC([C@H]2CCCCN2C(=O)Cc2cccc([N+](=O)[O-])c2)CC1 1823679562 OSZXQUNBTHBQDV-KVVRFYPFSA-N 495.664 5.364 5 20 JKBD CCc1ccc(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3cc(Cl)cc([N+](=O)[O-])c3C)CC2)cn1 1825750917 SLVKDTUDAWVFSX-HSZRJFAPSA-N 499.011 5.061 5 20 JKBD Cc1ccc(CC(=O)N2CCCC[C@@H]2C2CCN(C(=O)C3(C)CCCCC3)CC2)cc1[N+](=O)[O-] 1830364873 WKTBDUJLDFCFMC-HSZRJFAPSA-N 469.626 5.036 5 20 JKBD CCC(C)(C)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cccc([N+](=O)[O-])c2Br)CC1 1831388087 UYUMYUIUQZRWTM-GOSISDBHSA-N 494.430 5.027 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)N1CCC([C@@H]2CCCCN2C(=O)[C@]2(C)CC=CCC2)CC1 1832407570 ZXHPNVTWTZXUEE-BKMJKUGQSA-N 471.573 5.022 5 20 JKBD CC/C=C(\C)C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cc(Cl)cc([N+](=O)[O-])c2C)CC1 1832519635 NTUIPOXXZKQDET-GSWGVQEBSA-N 461.990 5.146 5 20 JKBD C[C@H](OC(=O)/C=C/c1ccc(Cl)s1)C(=O)Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1 11669281 YSFHBEXAUPNARK-IOCXFXADSA-N 463.924 5.017 5 20 JKBD C[C@@H](OC(=O)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1)C(=O)Nc1c(F)cccc1F 16906084 CRLJSHBOIPAWKB-GFCCVEGCSA-N 476.819 5.503 5 20 JKBD O=C(Nc1ccc(OC(=O)C2(c3ccccc3)CCC2)cc1)c1cc([N+](=O)[O-])ccc1Cl 26376275 HOWXNPRTAJFZHK-UHFFFAOYSA-N 450.878 5.528 5 20 JKBD CC(C)CCSc1ccc(C(=O)N2CCC[C@H](c3nc4ccccc4o3)C2)cc1[N+](=O)[O-] 27375319 IVUJWVIPJHHFBN-SFHVURJKSA-N 453.564 5.894 5 20 JKBD O=C(C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)N1CCN(c2ccccc2)CC1 29506811 FGKCGHAXRPJGCM-UZYVYHOESA-N 484.581 5.484 5 20 JKBD C[C@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccc(Cl)c(C(=O)NC2CCCCC2)c1 59827636 CVQUQXBAGPLECB-AWEZNQCLSA-N 461.971 5.430 5 20 JKBD O=C(Cn1c2ccccc2c(=O)c2ccccc21)Nc1cc(Cl)ccc1OC[C@@H]1CCCO1 72023747 UCSKYLMXSOIWKH-SFHVURJKSA-N 462.933 5.005 5 20 JKBD O=C(c1ccccc1Sc1ccc(Br)cn1)N1CCc2ccc([N+](=O)[O-])cc21 108618635 BNYHEWBKLJJLAE-UHFFFAOYSA-N 456.321 5.106 5 20 JKBD C[C@H](Nc1ccc(C(=O)Nc2ccc(Nc3ccccc3)cc2)cc1[N+](=O)[O-])c1ccccn1 108770975 XTZGOBSHJZPKIF-SFHVURJKSA-N 453.502 6.159 5 20 JKBD C[C@H](Sc1ncc(-c2ccccc2)n1CC(F)(F)F)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 109623140 WOOBZHMXUGTWSY-ZDUSSCGKSA-N 475.452 5.924 5 20 JKBD Cc1cc(O[C@@H](C)c2ccccc2)ccc1NC(=O)c1nn(-c2ccccc2[N+](=O)[O-])c(C)cc1=O 303236079 ZLDZSDHFTZYGNI-IBGZPJMESA-N 484.512 5.150 5 20 JKBD Cc1cc(NC(=O)c2c3c(nc4ccccc24)/C(=C\c2cccc([N+](=O)[O-])c2)CCC3)n(C)n1 409713140 VMULQYGJLLKNDE-JXAWBTAJSA-N 453.502 5.314 5 20 JKBD COc1cc(C(=O)Nc2ccc(-c3cn4cccc(C)c4n3)cc2)c([N+](=O)[O-])cc1OC(F)F 485162597 AFTOEVTYDRFBNT-UHFFFAOYSA-N 468.416 5.080 5 20 JKBD CCCCc1ccc(N(C(=O)Cn2cc([N+](=O)[O-])ccc2=O)c2nc3ccccc3s2)cc1 499304795 CRIOZSVFATYWEX-UHFFFAOYSA-N 462.531 5.074 5 20 JKBD C[C@H](NC(=O)c1ccc(N[C@H](C)c2ccccn2)c([N+](=O)[O-])c1)c1ccc(Br)cc1 505981068 HUTPWDQKUHRNKX-LSDHHAIUSA-N 469.339 5.416 5 20 JKBD O=C(c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1)N(Cc1ccco1)C[C@@H]1CCCO1 511607186 SPPWBBIWCPBICB-FQEVSTJZSA-N 456.882 5.455 5 20 JKBD COc1cc(C(=O)N(Cc2cccc(Cl)c2)C(C)C)c([N+](=O)[O-])cc1OCc1cscn1 512404816 VFVJJTHZYIRBCB-UHFFFAOYSA-N 475.954 5.343 5 20 JKBD O=C(N[C@@H](c1ccccc1)c1ccc(Cl)c(Cl)c1)c1ccc(-n2cncn2)c([N+](=O)[O-])c1 515742139 DVKUYZSEMJYUGS-NRFANRHFSA-N 468.300 5.002 5 20 JKBD C[C@@H](NC(=O)N(C)CCCCCc1cc(-c2cccc(F)c2)n[nH]1)c1cccc([N+](=O)[O-])c1 518377674 OVKGKQMYBOYXNN-QGZVFWFLSA-N 453.518 5.239 5 20 JKBD COc1cc(OCC(=O)N(c2cccc(Cl)c2)c2nc3ccccc3s2)ccc1[N+](=O)[O-] 519036195 ZPMOJEHWLUTMQX-UHFFFAOYSA-N 469.906 5.610 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Cl)[C@H](NCCc1ccc2ccccc2n1)c1ccccc1 521667209 MUNJOXWNAVEUFB-XMMPIXPASA-N 460.921 5.309 5 20 JKBD Cc1csc(Sc2ccc(C(=O)N(C)[C@H](c3cccc(F)c3)c3cnn(C)c3)cc2[N+](=O)[O-])n1 523243182 UUWUCJGWIURGBV-OAQYLSRUSA-N 497.577 5.245 5 20 JKBD CCOC(=O)c1sc(N(C(=O)Cn2c3ccccc3c(=O)c3ccccc32)c2ccccc2)nc1C 603600969 SJYPKUYNGLIISK-UHFFFAOYSA-N 497.576 5.461 5 20 JKBD O=C(c1cc2cc([N+](=O)[O-])ccc2o1)N(Cc1ccccn1)c1ccc(Br)cc1 603994313 QOOSRKWURCURTA-UHFFFAOYSA-N 452.264 5.346 5 20 JKBD C[C@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccc(Sc2nncs2)c(Cl)c1 609106933 DFWIMAHEZBFIEK-JTQLQIEISA-N 452.970 5.370 5 20 JKBD C[C@H](OC(=O)c1c(Cl)cccc1[N+](=O)[O-])C(=O)Nc1c(Cl)cc(Cl)cc1Cl 730643456 CFORXAXIPZBRIZ-ZETCQYMHSA-N 452.077 5.392 5 20 JKBD C[C@H](OC(=O)[C@@H]1C[C@@H]1c1ccc2ccccc2c1)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 731272239 BEOPDJGZXGLQMQ-MJXNMMHHSA-N 472.419 5.441 5 20 JKBD CC(C)(C)OC(=O)N1CCC[C@@H]1C1CCN(C(=O)c2cc3ccccc3c3cccnc23)CC1 742496404 KMRAWPNOLJKPCR-XMMPIXPASA-N 459.590 5.640 5 20 JKBD COc1ccc(NC(=O)[C@H](C)OC(=O)c2csc(-c3ccc(Cl)c(Cl)c3)n2)c([N+](=O)[O-])c1 744604763 JROSNSZAQISSEP-JTQLQIEISA-N 496.328 5.218 5 20 JKBD Cc1ccc(-c2ncc(C(=O)N(Cc3nnc(-c4cccc([N+](=O)[O-])c4)o3)C(C)C)s2)c(C)c1 747122314 VSEBWXFNNNQRHN-UHFFFAOYSA-N 477.546 5.436 5 20 JKBD O=C(COC(=O)c1csc(-c2ccc([N+](=O)[O-])cc2)n1)Nc1ccc(OCc2ccccc2)cc1 747956598 WVLYPCZGJIODPX-UHFFFAOYSA-N 489.509 5.093 5 20 JKBD O=C(Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1)c1csc(COc2ccc(F)cc2)n1 821750575 ZMGCZJAZYUFFKU-UHFFFAOYSA-N 456.480 5.145 5 20 JKBD CC(C)(C)c1cc[n+](/C(C(=S)N[C@H]2C[C@H]3CC[C@H]2C3)=C(/O)c2cccc([N+](=O)[O-])c2)cc1 912843471 KCOVCKDRPXZANS-FIKGOQFSSA-O 452.600 5.169 5 20 JKBD Cc1csc(Sc2ccc(C(=O)OCc3cncc(Br)c3)cc2[N+](=O)[O-])n1 915167953 PVPDHRXYNKUEJS-UHFFFAOYSA-N 466.338 5.025 5 20 JKBD Cc1ccc(NS(=O)(=O)c2ccc(N[C@H](C)c3cccc([N+](=O)[O-])c3)c([N+](=O)[O-])c2)c(C)c1 917086456 XYJUMZVXUZWQIH-MRXNPFEDSA-N 470.507 5.094 5 20 JKBD C[C@H](OC(=O)CCOc1cccc(Cl)c1Cl)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 919414166 CHKQBIDHPZCNEC-JTQLQIEISA-N 495.237 5.260 5 20 JKBD COc1ccc(C)cc1NC(=O)[C@@H](OC(=O)[C@H](C)Oc1ccc(Cl)cc1[N+](=O)[O-])c1ccccc1 920778128 IILWPDIYVDOLTK-HJPURHCSSA-N 498.919 5.256 5 20 JKBD O=C(/C=C/c1ccc([N+](=O)[O-])o1)Nc1ccc(C2(NC(=O)C3(c4ccccc4)CC3)CCC2)cc1 1786205889 UVUZJPGHJARRPZ-ACCUITESSA-N 471.513 5.067 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)C3CCC(F)(F)CC3)CCC2)cc1)c1nc2cc([N+](=O)[O-])ccc2[nH]1 1790829861 ZBWWCFHRXFUHCJ-UHFFFAOYSA-N 497.502 5.044 5 20 JKBD CC(C)c1nc(C(=O)NC2(c3ccc(NC(=O)/C=C/c4ccccc4[N+](=O)[O-])cc3)CCC2)co1 1792315746 YDIHBYNJUARPMO-MDWZMJQESA-N 474.517 5.167 5 20 JKBD Cc1csc(CCC(=O)Nc2cc([C@@H]3CCCCN3C(=O)/C=C/c3ccccc3[N+](=O)[O-])[nH]n2)c1 1815897082 JECAEZPCYHPAOR-FQTAANOTSA-N 493.589 5.026 5 20 JKBD CC(C)[C@@H](C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2ccc([N+](=O)[O-])[nH]2)[nH]n1)c1ccc(Cl)cc1 1821856794 IDBHKUSHEQEVND-DENIHFKCSA-N 498.971 5.045 5 20 JKBD O=C(Nc1nc2c(s1)CN(Cc1ccccc1)CC2)c1cc2cc([N+](=O)[O-])ccc2s1 9648827 LJCWCRWZLSUABG-UHFFFAOYSA-N 450.545 5.077 5 20 JKBD COc1cc(CSc2nc3ccccc3c(=O)n2C2CCCC2)c([N+](=O)[O-])cc1OC(F)F 12724529 XNDTWRCHPKTFNO-UHFFFAOYSA-N 477.489 5.322 5 20 JKBD O=C(C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)Nc1ccc2oc(O)nc2c1 482929718 HYRXHBNUONUBLK-PTNGSMBKSA-N 472.482 5.621 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)N[C@H](c2ccc(F)cc2)c2ccccc2Cl)cc1SC 482984879 MFMKFTGPUBIKHI-OAQYLSRUSA-N 460.914 5.637 5 20 JKBD Cc1cc(N2CCSCC2)ccc1NC(=O)c1cc([N+](=O)[O-])ccc1NCc1ccccc1 497308910 BBJRBZLNWNIGES-UHFFFAOYSA-N 462.575 5.321 5 20 JKBD COc1ccc2[nH]cc(C3CCN(C(=O)c4ccc(NCc5ccccc5)c([N+](=O)[O-])c4)CC3)c2c1 509095245 MRWBATOFOVZAFW-UHFFFAOYSA-N 484.556 5.717 5 20 JKBD COC(=O)c1ccccc1C(=O)c1ccc(N[C@H](C)c2ccc(NC(=O)C3CC3)cc2)c([N+](=O)[O-])c1 515363217 VBNNZORJUNPBMN-MRXNPFEDSA-N 487.512 5.134 5 20 JKBD COCc1cccc2sc(NC(=O)Cc3cn(-c4ccccc4)nc3-c3ccc([N+](=O)[O-])cc3)nc12 519132261 NGMVDELXNSVSCV-UHFFFAOYSA-N 499.552 5.385 5 20 JKBD CC(=O)Nc1cccc([C@@H](C)N(Cc2ccccc2)C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)c1 591353866 MLLZPOJXPGGKIN-QGZVFWFLSA-N 473.554 6.172 5 20 JKBD CC(=O)N(c1cccc(C(F)(F)F)c1)c1nc(COc2cc([N+](=O)[O-])ccc2C)cs1 603727259 FSAPYTIEJJRVEU-UHFFFAOYSA-N 451.426 5.642 5 20 JKBD CC(=O)Nc1ccc(C)c(N[C@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2ccccc2)c1 604043756 CZINLCCCUYAQSR-QFIPXVFZSA-N 452.898 5.307 5 20 JKBD CSc1ccc(C(=O)c2ccccc2C(=O)Nc2ccc(OCc3cccnc3)cc2)cc1[N+](=O)[O-] 728496811 WCPABNXHENGGJL-UHFFFAOYSA-N 499.548 5.774 5 20 JKBD CC(C)(CNC(=O)c1ccccc1NC(=O)c1ccc([N+](=O)[O-])cc1Cl)c1ccc(F)cc1 728538622 SHMPCVDVLVHFFR-UHFFFAOYSA-N 469.900 5.347 5 20 JKBD C[C@@H](OC(=O)C[C@H](c1ccccc1)C(F)(F)F)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 728654004 SXIOWKZTMWLFCU-BXUZGUMPSA-N 478.345 5.220 5 20 JKBD O=C(Nc1ccc(OC(=O)c2cccn2Cc2ccccc2)cc1)c1cc([N+](=O)[O-])ccc1Cl 899213895 NOWWQRGOGJRZTH-UHFFFAOYSA-N 475.888 5.570 5 20 JKBD COc1ccc(CSC2=N/C(=C\c3ccccc3)C(=O)N2c2ccc(F)cc2)cc1[N+](=O)[O-] 915792084 KUIDSPBCAVYVPZ-MOSHPQCFSA-N 463.490 5.420 5 20 JKBD C[C@H](Nc1ccc(C(=O)OCC(=O)Nc2ccc(Cl)cc2Cl)cc1[N+](=O)[O-])c1ccccn1 920545755 IZYPZDBNPYUEDE-ZDUSSCGKSA-N 489.315 5.265 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)c3ccc([N+](=O)[O-])o3)CCC2)cc1)c1ccc(Cl)c(F)c1 1790614463 HGFZZUNZJMWSDJ-UHFFFAOYSA-N 457.845 5.042 5 20 JKBD O=C(NC1(c2ccc(NC(=O)c3nc4cc([N+](=O)[O-])ccc4[nH]3)cc2)CCC1)c1cccc(Cl)c1 1790827800 OVGPMSVTMIVKKT-UHFFFAOYSA-N 489.919 5.186 5 20 JKBD O=C(Cc1cccc([N+](=O)[O-])c1)Nc1cc([C@@H]2CCCCN2C(=O)[C@@H]2CCC[C@@H]3CCCC[C@H]32)[nH]n1 1814375048 IOGHMYUSPISFBN-BQUSRXHISA-N 493.608 5.159 5 20 JKBD O=C(/C=C/c1ccccc1[N+](=O)[O-])Nc1cc([C@H]2CCCCN2C(=O)c2ccc(C3CC3)cc2)[nH]n1 1823503017 HMDQDEQCXBKUPU-DKUDOZJNSA-N 485.544 5.215 5 20 JKBD O=C(c1cc2cc([N+](=O)[O-])ccc2s1)N1CCC([C@H]2CCCCN2C(=O)c2ccc(F)cc2)CC1 1830021681 ONBQYTARZWEQFY-JOCHJYFZSA-N 495.576 5.496 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)N1CCC([C@H]2CCCCN2C(=O)[C@@H](C)c2ccccc2)CC1 1832897997 PJFVOKQTQJYLEX-MHECFPHRSA-N 481.568 5.079 5 20 JKBD CC(C)[C@@H](C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)c1cc2cc([N+](=O)[O-])ccc2s1)c1ccccc1 1847619549 RZGAKWPBOZWHSJ-AWRGLXIESA-N 477.586 5.065 5 20 JKBD CC(=O)N(c1ccc(C)c(C)c1)c1nc(COC(=O)c2ccc(NC3CC3)c([N+](=O)[O-])c2)cs1 11226952 OXBHEOYTQFFXDK-UHFFFAOYSA-N 480.546 5.284 5 20 JKBD CC(=O)N(c1nc(COC(=O)Cc2ccccc2[N+](=O)[O-])cs1)c1c(C)cc(C)cc1Cl 11466867 SRYAHRWMWZXPTE-UHFFFAOYSA-N 473.938 5.292 5 20 JKBD CCOc1ccc([C@H](C)N[C@@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2ccccc2)cc1 11708094 GIEKIMWQFJMADS-QMHKHESXSA-N 453.926 5.678 5 20 JKBD CCOc1ccc(Oc2ccc(NC(=O)c3cc(OCC)c(OC)cc3[N+](=O)[O-])cc2)cc1 18083779 BTRDMWCWQHJCMD-UHFFFAOYSA-N 452.463 5.445 5 20 JKBD O=C(COC(=O)c1ccc(COc2ccc3ccccc3c2)o1)Nc1cc([N+](=O)[O-])ccc1Cl 25120162 IVCPVNDZMPYBBV-UHFFFAOYSA-N 480.860 5.369 5 20 JKBD O=C(CSc1nn(-c2ccccc2)c(=S)s1)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 28811678 NAQGFSRXJLZUKV-UHFFFAOYSA-N 472.495 5.321 5 20 JKBD CC(C)CCSc1ccc(C(=O)N[C@@H](c2ccccc2F)c2nccn2C)cc1[N+](=O)[O-] 29999391 WHIYLVALMSHLFF-NRFANRHFSA-N 456.543 5.125 5 20 JKBD CCOc1ccc(CN[C@@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2ccccc2)cc1OC 30514774 AYSCNZXWISTTCN-HSZRJFAPSA-N 469.925 5.125 5 20 JKBD O=C(Nc1cccc(NC(=O)c2ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])cc2)c1)c1ccncc1 32450602 QUSYCLVFQUEWKC-UHFFFAOYSA-N 488.887 5.940 5 20 JKBD C[C@@H](Sc1nc2ccccc2c(=O)n1C1CCCC1)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl 36788031 BEFLNYVMEIWPSS-CYBMUJFWSA-N 472.954 5.193 5 20 JKBD O=[N+]([O-])c1ccc(Nc2c(Br)c(F)nc(F)c2Br)c(C(F)(F)F)c1 98178774 WPYUJENCPSWGCF-UHFFFAOYSA-N 476.981 5.555 5 20 JKBD O=C(COc1ccc([N+](=O)[O-])c(F)c1)NC[C@H](c1ccccc1Cl)c1c[nH]c2ccccc12 109393686 QRINNBKDPICEHZ-GOSISDBHSA-N 467.884 5.196 5 20 JKBD Cc1cc(O[C@H](C)c2ccccc2)ccc1NC(=O)c1nnn(-c2cccc([N+](=O)[O-])c2)c1C 303220949 UVINPEBJDFIIEM-GOSISDBHSA-N 457.490 5.185 5 20 JKBD O=C(c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-])N1CCc2sccc2[C@@H]1c1cccs1 478063572 OUEKVZPVFAQUPM-GOSISDBHSA-N 468.478 5.447 5 20 JKBD C[C@H](NC(=O)c1ccc(NCc2ccccc2Cl)c([N+](=O)[O-])c1)c1ccc2c(c1)CCC(=O)N2 500059182 ZMBDBYBLRFNNMD-HNNXBMFYSA-N 478.936 5.236 5 20 JKBD COc1cc(C(=O)N(C)C2Cc3ccccc3C2)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 507962154 BELMLDCVSPJDRB-UHFFFAOYSA-N 452.894 5.289 5 20 JKBD CC(C)CCSc1ccc(C(=O)NCc2cccc(NC(=O)N3CCCC3)c2)cc1[N+](=O)[O-] 509153256 NQKWBOJOELSOPK-UHFFFAOYSA-N 470.595 5.291 5 20 JKBD Cc1c([C@@H](C)NC(=O)C/C(=C\c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)cnn1C 512792482 KWVGDVVXRBQABU-GYZOOYGHSA-N 461.547 5.055 5 20 JKBD COc1cc(C)ccc1Oc1ccc(F)cc1NC(=O)Cn1c2ccccc2c(=O)c2ccccc21 512812541 VTGQYRKRLDOLOC-UHFFFAOYSA-N 482.511 6.042 5 20 JKBD O=C(Nc1ccccc1)Nc1ccc(NC(=O)c2cc(OCC(F)(F)F)ccc2[N+](=O)[O-])cc1 515510947 YDVBLMKXVRCKSN-UHFFFAOYSA-N 474.395 5.432 5 20 JKBD CC[C@H](C)NC(=O)c1ccc(NC(=O)c2ccc(N[C@H](C)c3ccccn3)c([N+](=O)[O-])c2)c(C)c1 519027629 WVGXDOPTOHVQTR-ZWKOTPCHSA-N 475.549 5.252 5 20 JKBD Cc1ccc(CN2CCSCC2)cc1NC(=O)c1cc([N+](=O)[O-])ccc1Sc1ccccc1 522599956 XYSTUZHAQHMLRC-UHFFFAOYSA-N 479.627 5.856 5 20 JKBD C[C@@H](Nc1ccc(NC(=O)c2ccc(Sc3nncn3C)c([N+](=O)[O-])c2)cc1)c1ccccc1 524421734 HYUMGEZSAQXDDP-MRXNPFEDSA-N 474.546 5.300 5 20 JKBD COc1cc(C(=O)Nc2sc3c(c2-c2nc4ccccc4[nH]2)CCCC3)c([N+](=O)[O-])cc1OC 603451933 MNBOUFDHNKGUEC-UHFFFAOYSA-N 478.530 5.348 5 20 JKBD COc1ccccc1Oc1ccc(NC(=O)c2cc(OCC(F)(F)F)ccc2[N+](=O)[O-])cc1 603734040 WJJQFSQDDZZMFX-UHFFFAOYSA-N 462.380 5.589 5 20 JKBD COc1cc([C@@H]2Nc3ccc(Cl)cc3C(=O)N2C)ccc1OCc1ccc([N+](=O)[O-])cc1 603940645 MKZXRWKKAMKLEE-JOCHJYFZSA-N 453.882 5.032 5 20 JKBD C[C@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)NCc1ccc(COCc2ccccc2)cc1 604442268 DKYVSLBCQROLHU-KRWDZBQOSA-N 454.910 5.049 5 20 JKBD COc1ccc(C(=O)N2CCCCCC2)cc1NC(=O)c1ccc(Nc2ccccc2)c([N+](=O)[O-])c1 604536075 IFFHMKWSTWTHLZ-UHFFFAOYSA-N 488.544 5.616 5 20 JKBD CC(C)C[C@H](NC(=O)C(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1)c1cccc(C(F)(F)F)c1 726854311 KBJCJFKWAJVVNX-INIZCTEOSA-N 457.836 5.109 5 20 JKBD CSCCc1ccc(NC(=O)c2ccccc2NC(=O)c2ccc([N+](=O)[O-])cc2Cl)cc1 727678330 SOVZMQQJTKMICJ-UHFFFAOYSA-N 469.950 5.658 5 20 JKBD O=C(c1ccc(S(=O)(=O)C2CCCC2)cc1)N(CC1CC1)c1ccc(Cl)c([N+](=O)[O-])c1 728165643 NHFYUZFAPSPMLV-UHFFFAOYSA-N 462.955 5.021 5 20 JKBD CC(C)(C)OC(=O)N1CCCc2cc(NC(=O)c3ccc(NC4CC4)c([N+](=O)[O-])c3)ccc21 729413465 VDBLDSDVHJCKGL-UHFFFAOYSA-N 452.511 5.109 5 20 JKBD C[C@H](OC(=O)c1c(Cl)cccc1[N+](=O)[O-])C(=O)Nc1ccc(Cl)c(C(F)(F)F)c1 730644246 KWVNQBZIZKUVCO-QMMMGPOBSA-N 451.184 5.104 5 20 JKBD CC(C)N(Cc1nnc(-c2cccc([N+](=O)[O-])c2)o1)C(=O)[C@@H]1C[C@H]1c1ccc2ccccc2c1 731163855 BLOMCWVCTVKNJF-XZOQPEGZSA-N 456.502 5.339 5 20 JKBD CCC(CC)N(C(=O)c1ccc(Sc2nncn2C)c([N+](=O)[O-])c1)c1ccc(C)c(C)c1 745337986 XMQFJKPFDPKRAI-UHFFFAOYSA-N 453.568 5.327 5 20 JKBD COc1ccccc1-c1nc(C(=O)Oc2ccc(NC(=O)c3cccc([N+](=O)[O-])c3)cc2)cs1 746763061 VUZWLWZYANTXAG-UHFFFAOYSA-N 475.482 5.198 5 20 JKBD CC(C)Oc1ccc(-c2nc(C(=O)O[C@H](C)c3nnc(-c4ccc([N+](=O)[O-])cc4)o3)cs2)cc1 749312179 DDSRZXADKXISJL-CQSZACIVSA-N 480.502 5.474 5 20 JKBD O=C(NC[C@@H](c1ccccc1Cl)c1c[nH]c2ccccc12)c1cc(F)c(F)cc1[N+](=O)[O-] 750562661 RNTLJOOSLWDBBJ-INIZCTEOSA-N 455.848 5.570 5 20 JKBD Cc1cccc([N+](=O)[O-])c1NC(=O)COC(=O)c1cc2c(C)nn(-c3ccc(Cl)cc3)c2s1 761248417 YERXDERILJTSBN-UHFFFAOYSA-N 484.921 5.061 5 20 JKBD C[C@@H](c1ccc(F)cc1)N(C)C(=O)c1ccc(NS(=O)(=O)c2ccc(Cl)c([N+](=O)[O-])c2)cc1 762125759 KNISMWIVMBOREP-AWEZNQCLSA-N 491.928 5.021 5 20 JKBD Cc1cccc([N+](=O)[O-])c1C(=O)OCC(=O)N1c2ccccc2Sc2ccc(Cl)cc21 792687079 VJRJHLGRXAYOBB-UHFFFAOYSA-N 454.891 5.543 5 20 JKBD CC1=C(C(=O)Nc2ccc(F)cc2)[C@H](c2ccc([N+](=O)[O-])o2)NC(=S)N1c1cc(C)ccc1C 812731675 QHZUELNPTKLBFE-QFIPXVFZSA-N 480.521 5.292 5 20 JKBD O=C(Nc1cc([N+](=O)[O-])c(F)cc1F)c1ccc(NCc2ccccc2Cl)c([N+](=O)[O-])c1 897479181 RGDCZEJPEGLJNM-UHFFFAOYSA-N 462.796 5.299 5 20 JKBD C[C@H](Sc1ccc([N+](=O)[O-])cc1)c1nc(-c2ccc(CNC(=O)OC(C)(C)C)cc2)no1 904715311 GMNRBGKHECBEHK-AWEZNQCLSA-N 456.524 5.523 5 20 JKBD CN(C(=O)c1ccc(NC(=O)c2cc(Cl)ccc2[N+](=O)[O-])cc1Cl)C1CCCCC1 917755516 ZPTJXVWCSCKZBQ-UHFFFAOYSA-N 450.322 5.559 5 20 JKBD C[C@H](Oc1ccc(Cl)c(Cl)c1)C(=O)O[C@@H](C)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 919442762 FKXNJLGBXGMARI-QWRGUYRKSA-N 452.250 5.023 5 20 JKBD O=C(OCc1nnc(-c2ccc([N+](=O)[O-])cc2)o1)c1cc(-c2ccccc2)nc2cc(F)ccc12 920586265 MVDIECURBMOWIA-UHFFFAOYSA-N 470.416 5.356 5 20 JKBD Cc1ccc(CC(=O)Nc2ccc(C3(NC(=O)c4nccc5occc45)CCC3)cc2)cc1[N+](=O)[O-] 1790526009 HUUBXKJPNJLYJD-UHFFFAOYSA-N 484.512 5.035 5 20 JKBD O=C(CC1CCCC1)NC[C@@H]1CCN(C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)[C@H]1c1cccnc1 1806196029 WPNXHNXTMUFICH-DFBJGRDBSA-N 492.601 5.104 5 20 JKBD C/C(=C\c1cccs1)C(=O)Nc1cc([C@H]2CCCCN2C(=O)/C=C/c2ccccc2[N+](=O)[O-])[nH]n1 1814413440 FKDFNVLLERMRAC-BKDQMDBWSA-N 491.573 5.188 5 20 JKBD CC(C)(C)CCCCCC(=O)N1CCCC[C@H]1c1cc(NC(=O)/C=C/c2ccc([N+](=O)[O-])o2)n[nH]1 1814970064 OMBGUEWBHMUXPP-RPAADVPWSA-N 485.585 5.613 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)N1CCCC[C@@H]1c1cc(NC(=O)C[C@@H](C)c2ccccc2)n[nH]1 1822045943 QTIMNLBEFWJCPM-OPAMFIHVSA-N 493.539 5.265 5 20 JKBD Cc1ccc2[nH]c(C(=O)N3CCCC[C@H]3C3CCN(C(=O)c4cccc(F)c4[N+](=O)[O-])CC3)cc2c1 1828123581 WSRSHHMUBLSWLS-DEOSSOPVSA-N 492.551 5.071 5 20 JKBD CC(C)C1(C(=O)N2CCC([C@@H]3CCCCN3C(=O)CSc3ccccc3[N+](=O)[O-])CC2)CCC1 1831777158 GMGNCLHGPMQGCL-NRFANRHFSA-N 487.666 5.133 5 20 JKBD Cc1c(C(=O)N2CC3(CCCN3C(=O)c3cc4cc(F)ccc4s3)C2)cc(Cl)cc1[N+](=O)[O-] 1844064728 GEGJSWHJUOCJLT-UHFFFAOYSA-N 487.940 5.041 5 20 JKBD C[C@H](C(=O)N1CC2(CCCN2C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)C1)c1ccc(Cl)cc1 1845738179 IPQTXIMCANGOFN-HNNXBMFYSA-N 483.977 5.084 5 20 JKBD Cc1cccc([N+](=O)[O-])c1NC(=O)COC(=O)c1cc2ccccc2cc1OCc1c(C)noc1C 9800529 GINLVPWROLCBMG-UHFFFAOYSA-N 489.484 5.036 5 20 JKBD C[C@H](OC(=O)c1ccc(SC(F)(F)F)cc1)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 18656634 GLIUMZILXTZDPX-VIFPVBQESA-N 482.358 5.410 5 20 JKBD CCN(c1ccccc1)S(=O)(=O)c1ccc(Sc2nnc(-c3ccc(C)cc3)o2)c([N+](=O)[O-])c1 20667481 OVUJRMUBURUYDZ-UHFFFAOYSA-N 496.570 5.320 5 20 JKBD CCn1cnnc1-c1cccc(NC(=O)c2ccccc2C(=O)c2ccc(SC)c([N+](=O)[O-])c2)c1 25284047 JEEQHTOXGXPANN-UHFFFAOYSA-N 487.541 5.078 5 20 JKBD O=C(Nc1ccccc1)[C@H]1CCCN(C(=O)c2ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])cc2)C1 27243054 RHEYSGKKPJRENZ-SFHVURJKSA-N 479.920 5.531 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Cl)[C@@H](NCc1ccc(Br)s1)c1ccccc1 28373962 BLCFGXZGEUFNNV-SFHVURJKSA-N 480.771 5.542 5 20 JKBD CN(Cc1ccccc1[N+](=O)[O-])C(=O)c1ccc(NC(=O)c2ccc(Cl)c(Cl)c2)cc1O 30640359 CQNRJKXABMQTGN-UHFFFAOYSA-N 474.300 5.132 5 20 JKBD O=C(c1csc(-c2ccc([N+](=O)[O-])cc2)n1)N(C[C@@H]1CCCO1)c1ccc(Br)cc1 496614659 YWZCFPTXACMSCX-SFHVURJKSA-N 488.363 5.307 5 20 JKBD COc1cc(C(=O)Nc2ccc(CN3CCOCC3)cc2)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 497331215 JIHAHZLXQIAHAB-UHFFFAOYSA-N 497.935 5.134 5 20 JKBD O=C(Nc1ccc(NC(=O)N2CCCCCC2)cc1)c1csc(-c2ccc([N+](=O)[O-])cc2)n1 498515836 LLZCAHHTBBCEIX-UHFFFAOYSA-N 465.535 5.379 5 20 JKBD COc1ccc(CN[C@H](c2ccc(F)cc2)[C@@H]2CCCO2)cc1OCc1ccc([N+](=O)[O-])cc1 507915901 WGTUNYINSMFSCJ-AZGAKELHSA-N 466.509 5.331 5 20 JKBD O=C(NC1CCN(c2ccccc2)CC1)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1 509370043 FRCONFPVGSNKRB-UHFFFAOYSA-N 451.910 5.439 5 20 JKBD Cc1cc(Sc2ccccc2)ccc1NC(=O)Cn1c2ccccc2c(=O)c2ccccc21 510230572 SGUHHTXMDBBZAM-UHFFFAOYSA-N 450.563 6.253 5 20 JKBD COc1ccccc1-c1cc(NC(=O)c2ccc(N3CCCC3)c([N+](=O)[O-])c2)n(-c2ccccc2)n1 516521432 XLPCZWWQSJJXKK-UHFFFAOYSA-N 483.528 5.309 5 20 JKBD Cc1ccc(-n2nc(C)c(NC(=O)COc3ccc(-c4ccccc4)cc3[N+](=O)[O-])c2C)cc1 518660782 ICFYXJGZNOGNKZ-UHFFFAOYSA-N 456.502 5.390 5 20 JKBD Cc1ccc([C@@H]2CCCN2C(=O)C2CCN(c3ccc(C(F)(F)F)cc3[N+](=O)[O-])CC2)cc1C 518793089 GHWNOPQRCLGPRD-NRFANRHFSA-N 475.511 5.811 5 20 JKBD COc1ccc(CC[C@H]2CCCCN2C(=O)c2csc(-c3cccc([N+](=O)[O-])c3)n2)cc1OC 523842429 BDXKPXQAQBVIFO-LJQANCHMSA-N 481.574 5.363 5 20 JKBD COc1cc(CNCC2(c3ccccc3)CCOCC2)ccc1OCc1ccc([N+](=O)[O-])cc1 603633183 JQGUZRWYPXEMCC-UHFFFAOYSA-N 462.546 5.020 5 20 JKBD O=C(Nc1ccc(C(=O)N2CCCCCC2)cc1)c1cc([N+](=O)[O-])ccc1Sc1ccccc1 603990406 AMXBHORWZZHHLQ-UHFFFAOYSA-N 475.570 6.015 5 20 JKBD Cc1cc(C(=O)Nc2nc(-c3cccc([N+](=O)[O-])c3)c(C)s2)c2cnn(Cc3cccs3)c2n1 603997933 ZQFSCZVQFWFFHJ-UHFFFAOYSA-N 490.570 5.442 5 20 JKBD O=C(Nc1cccc(-c2n[nH]c(C3CC3)n2)c1)c1cc([N+](=O)[O-])ccc1Sc1ccccc1 608851245 ZJNJZWSCKCNWFF-UHFFFAOYSA-N 457.515 5.661 5 20 JKBD C[C@H]1CCCCN1CC(=O)Nc1ccc(F)c(NC(=O)c2cc3ccccc3c3cccnc23)c1 614671622 TYYAKYAYKFIPSP-SFHVURJKSA-N 470.548 5.592 5 20 JKBD COCCOc1cc([N+](=O)[O-])c(C(=O)Nc2cc(Cl)ccc2Oc2ccccc2)cc1OC 619564519 XLJBNAUBNPNACY-UHFFFAOYSA-N 472.881 5.327 5 20 JKBD CN(C)C1CCN(c2ccc(NC(=O)c3ccc(Nc4ccccc4)c([N+](=O)[O-])c3)cc2F)CC1 728257241 LENHTRJYQGQGQH-UHFFFAOYSA-N 477.540 5.260 5 20 JKBD C[C@@H](OC(=O)c1csc(-c2ccc([N+](=O)[O-])cc2)n1)C(=O)Nc1ccc(Cl)cc1Cl 747954768 FPJHEYNSSCRRKH-SNVBAGLBSA-N 466.302 5.209 5 20 JKBD C[C@H](OC(=O)[C@@H](C)Sc1ccc([N+](=O)[O-])cc1)c1ccccc1NC(=O)c1ccccc1 748019689 CDXQJJQAQVGQMO-DLBZAZTESA-N 450.516 5.632 5 20 JKBD CC1=C(C(=O)Nc2ccc(F)cc2)[C@H](c2ccc([N+](=O)[O-])o2)NC(=S)N1c1cc(C)cc(C)c1 812776225 ADEBDQJTXBSNMW-QFIPXVFZSA-N 480.521 5.292 5 20 JKBD CC(=O)Nc1ccc(NC(=O)C/C(=C\c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)cc1C 893536238 RUZCRHONRTZMOJ-XMHGGMMESA-N 486.553 6.041 5 20 JKBD COc1cc([C@@H](C[N+](=O)[O-])c2c[nH]c3ccccc23)ccc1OS(=O)(=O)c1cc(C)sc1C 917219522 TXLSECVMKBXNDH-LJQANCHMSA-N 486.571 5.031 5 20 JKBD O=[N+]([O-])c1ccccc1-c1ccc(CN2CCN(Cn3nc(C4CC4)n(C4CC4)c3=S)CC2)s1 917464963 FZBQCHMEICELGK-UHFFFAOYSA-N 496.662 5.038 5 20 JKBD Cc1c([N+](=O)[O-])cc(C(=O)Nc2ccccc2SC[C@@H]2CC2(Cl)Cl)cc1[N+](=O)[O-] 917750710 IHVQMNKWXFPQRC-LBPRGKRZSA-N 456.307 5.350 5 20 JKBD C[C@H](Nc1ccc(C(=O)OCc2ccc(C(=O)Nc3ccccc3)cc2)cc1[N+](=O)[O-])c1ccccn1 920546506 YURAQIHCIGFVGW-IBGZPJMESA-N 496.523 5.772 5 20 JKBD Cc1ccc(Cl)cc1NC(=O)[C@H](C)OC(=O)c1ccc(N[C@H](C)c2ccccn2)c([N+](=O)[O-])c1 920548164 QFMLDDQLDSUFCP-CVEARBPZSA-N 482.924 5.309 5 20 JKBD O=C(Cc1cccc([N+](=O)[O-])c1)Nc1ccc(C2(NC(=O)[C@H]3[C@H]4c5ccccc5S[C@H]43)CCC2)cc1 1785793687 UMHHOBRRPMBRQS-UODIDJSMSA-N 499.592 5.159 5 20 JKBD O=C(CSC1CCCC1)Nc1ccc(C2(NC(=O)Cc3cc(F)ccc3[N+](=O)[O-])CCC2)cc1 1786350483 UXJMZSLZSFHBJM-UHFFFAOYSA-N 485.581 5.086 5 20 JKBD O=C(NC1(c2ccc(NC(=O)c3cccc4ccoc34)cc2)CCC1)c1cccc(F)c1[N+](=O)[O-] 1790956860 LQDORLCBANADIZ-UHFFFAOYSA-N 473.460 5.542 5 20 JKBD COc1cc(C(=O)Nc2ccc(C3(NC(=O)c4cc(F)c(F)cc4F)CCC3)cc2)ccc1[N+](=O)[O-] 1792165845 QOGHRSZSMFJSDP-UHFFFAOYSA-N 499.445 5.082 5 20 JKBD Cc1ccc(-c2ccccc2C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cccc(F)c2[N+](=O)[O-])C3)cc1 1800604654 CWQGOSNOBUXYHQ-WKCHPHFGSA-N 487.531 5.275 5 20 JKBD O=C(CCc1cccc([N+](=O)[O-])c1)Nc1cc([C@@H]2CCCCN2C(=O)c2cc(F)cc(Cl)c2)[nH]n1 1815539139 TXJYREICEWOJRE-NRFANRHFSA-N 499.930 5.049 5 20 JKBD Cc1c(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)[C@H]3CCC[C@@H]3C)[nH]n2)cc(Cl)cc1[N+](=O)[O-] 1821293959 MMABIMQTQDBUKE-AXHNFQJDSA-N 473.961 5.022 5 20 JKBD O=C(c1ccccc1Cl)N1CCC([C@H]2CCCCN2C(=O)CCc2cccc([N+](=O)[O-])c2)CC1 1824841818 OTAXYWMILCVKCU-XMMPIXPASA-N 483.996 5.114 5 20 JKBD O=C(c1cc2ccccc2o1)N1CCC([C@H]2CCCCN2C(=O)c2cc(F)cc([N+](=O)[O-])c2)CC1 1830617891 UYEIRIPKPDEGHB-JOCHJYFZSA-N 479.508 5.027 5 20 JKBD O=C(CCc1cccc([N+](=O)[O-])c1)N1CCC([C@H]2CCCCN2C(=O)c2ccccc2C2CC2)CC1 1832554587 NLANVGDVXRSLHX-HHHXNRCGSA-N 489.616 5.338 5 20 JKBD Cc1ccc(-c2nnc(S[C@H](C)C(=O)Nc3ccc([N+](=O)[O-])cc3C(F)(F)F)o2)cc1C 10844702 SJBRFVBBIXRDMZ-GFCCVEGCSA-N 466.441 5.400 5 20 JKBD Cc1cc(C)c(NC(=O)C2=C(c3ccccc3)NC(=S)N[C@H]2c2ccc([N+](=O)[O-])cc2)c(Cl)c1 14878073 YBMPQDCVHKFVFO-QHCPKHFHSA-N 492.988 5.434 5 20 JKBD COc1ccc([N+](=O)[O-])cc1C(=O)OCc1csc(N(C(C)=O)c2c(C)cc(C)cc2C)n1 19285020 OSEMBMXAQHFSSM-UHFFFAOYSA-N 469.519 5.027 5 20 JKBD Cc1c(NC(=O)c2ccccc2SCC(=O)NC2CCCCCCC2)cccc1[N+](=O)[O-] 24068469 KFHMNQWFDSNCCV-UHFFFAOYSA-N 455.580 5.477 5 20 JKBD Cc1occc1C(=O)Nc1cc(NC(=O)c2ccc(N3CCC(C)CC3)c([N+](=O)[O-])c2)ccc1F 46840259 ACNZOHDOVZYFGM-UHFFFAOYSA-N 480.496 5.376 5 20 JKBD O=C(Cn1c2ccccc2c(=O)c2ccccc21)Nc1ccccc1SC[C@H]1CC1(Cl)Cl 302967506 NHZRWFQSINMYJE-MRXNPFEDSA-N 483.420 6.079 5 20 JKBD Cc1ccc(-c2cc(NC(=O)c3cc([N+](=O)[O-])cc(S(C)(=O)=O)c3)nc(-c3ccccc3)c2)cc1 409934411 ZMTCENUYLXBIIC-UHFFFAOYSA-N 487.537 5.288 5 20 JKBD O=C(C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)N1CCO[C@@H](c2ccccc2)C1 485498763 NTPBTLCQJPFKHL-OFVJEAJMSA-N 485.565 5.735 5 20 JKBD O=C(NC1CC1)c1cc(NC(=O)c2cc([N+](=O)[O-])ccc2Sc2ccccc2)ccc1Cl 488478506 DNQSTCXWVVKRTL-UHFFFAOYSA-N 467.934 5.544 5 20 JKBD CC[C@H](C)Sc1ccc(NC(=O)CSc2ccc(C(N)=O)cc2[N+](=O)[O-])c(C(F)(F)F)c1 499576206 XBEHBFCHVONFQO-NSHDSACASA-N 487.525 5.334 5 20 JKBD C[C@H](Nc1ccc(C(=O)N2CCCC[C@@H]2c2nc(-c3ccccc3)no2)cc1[N+](=O)[O-])c1ccccn1 505342004 FHUQGWNCLGQHRX-FDDCHVKYSA-N 498.543 5.580 5 20 JKBD COCCOc1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2Sc2ccc(Cl)cc2)cn1 506775548 IFAZQJHYPGHYQJ-UHFFFAOYSA-N 459.911 5.072 5 20 JKBD CC[C@@H](C)c1ccc([C@H](NC(=O)CNC(=O)c2c(Cl)cccc2[N+](=O)[O-])c2cccs2)cc1 520816610 ZSGWUWBYCYTYPP-CMJOXMDJSA-N 485.993 5.459 5 20 JKBD CC(C)[C@H](NCc1ccc(Oc2ccccc2Cl)c([N+](=O)[O-])c1)c1nnc2ccccn12 520963619 UIBKVRZUSLZQHB-QFIPXVFZSA-N 451.914 5.570 5 20 JKBD COc1ccccc1Nc1nc2sc(C(=O)N(C)Cc3ccccc3[N+](=O)[O-])cc2s1 603873151 MYFRPNLKUGVGKB-UHFFFAOYSA-N 454.533 5.290 5 20 JKBD COc1cc(C(=O)N(Cc2cccs2)c2ccc(F)cc2)c([N+](=O)[O-])cc1OCc1cscn1 604387722 ATTBKOZYVPFNDW-UHFFFAOYSA-N 499.545 5.687 5 20 JKBD O=C(Nc1nc(-c2ccccc2OC(F)F)cs1)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-] 609021870 ULHWZRQGZSGTIZ-UHFFFAOYSA-N 489.378 5.513 5 20 JKBD Cc1ccc(S(=O)(=O)Nc2ccc(NC(=O)Cc3c[nH]c4cc(Cl)ccc34)cc2)cc1[N+](=O)[O-] 609023539 YZOSMQXBPFVRKN-UHFFFAOYSA-N 498.948 5.020 5 20 JKBD Cn1nc(C(F)(F)F)c(-c2ccc(Cl)cc2)c1NC(=O)CCNc1ccccc1[N+](=O)[O-] 609026615 RCHFUDRMZFDHAT-UHFFFAOYSA-N 467.835 5.108 5 20 JKBD CN1CCN(C[C@@H](NCc2ccc(Oc3ccccc3Cl)c([N+](=O)[O-])c2)c2ccccc2)CC1 609042389 UPBCCGOUEZWJPM-HSZRJFAPSA-N 480.996 5.119 5 20 JKBD C[C@H](C(=O)O[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1)c1ccccc1F 731395868 XJZWMLCURDVOGM-LHSJRXKWSA-N 456.857 5.414 5 20 JKBD O=C(COC(=O)c1csc(-c2ccc([N+](=O)[O-])cc2)n1)Nc1ccc(-c2ccccc2)cc1 747955675 KLOQEQRCIFXLKX-UHFFFAOYSA-N 459.483 5.181 5 20 JKBD O=C(OCC(=O)N1c2ccccc2Sc2ccccc21)c1csc(-c2cccc([N+](=O)[O-])c2)n1 747961718 GYRWTPPGOTUUTR-UHFFFAOYSA-N 489.534 5.705 5 20 JKBD CC1CCN(c2ccc([N+](=O)[O-])cc2C(=O)N(C)CCCc2cc(-c3ccc(F)cc3)no2)CC1 751244697 YULXKBMUMOYLNX-UHFFFAOYSA-N 480.540 5.330 5 20 JKBD Cc1csc(Sc2ccc(C(=O)O[C@H](C)C(=O)Nc3c(C)cccc3C(C)C)cc2[N+](=O)[O-])n1 849120034 LVLQHMUMHJOJHX-MRXNPFEDSA-N 499.614 6.127 5 20 JKBD O=[N+]([O-])c1cccc(Br)c1CNc1cccc(Oc2ncc(Br)cn2)c1 864008861 HYPNKNZWHOFBHD-UHFFFAOYSA-N 480.116 5.314 5 20 JKBD O=C(Oc1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2Cl)cc1)c1cc(-c2ccccc2F)on1 914874558 YYEWFIBOSGJMBK-UHFFFAOYSA-N 481.823 5.514 5 20 JKBD COc1cccc2cc(C(=O)Oc3ccc(NC(=O)c4cc([N+](=O)[O-])ccc4Cl)cc3)oc12 915132153 BKSZJKLYRDHXIJ-UHFFFAOYSA-N 466.833 5.475 5 20 JKBD O=C(Nc1ccc(Cl)cc1Cl)[C@@H]1CCCCN1C(=O)c1ccc(Cl)c([N+](=O)[O-])c1 915159407 NVJXXKFVTOXCEN-INIZCTEOSA-N 456.713 5.188 5 20 JKBD O=C(Cc1ccc(-n2cccn2)cc1)Nc1cc(Cl)c([N+](=O)[O-])cc1OCc1ccccc1 915828470 MBTYZHKMQKPOHN-UHFFFAOYSA-N 462.893 5.194 5 20 JKBD COc1ccccc1NC(=O)c1cc2ccccc2cc1OC(=O)Cc1ccc([N+](=O)[O-])cc1 916878943 CIWBYMHQYNHLFN-UHFFFAOYSA-N 456.454 5.157 5 20 JKBD Cc1ccc(S(=O)(=O)Nc2ccc(NC(=S)Nc3cccc(C(C)C)c3)cc2)cc1[N+](=O)[O-] 917570763 JQPVUGFCLLBKHZ-UHFFFAOYSA-N 484.603 5.636 5 20 JKBD O=C(Oc1ccc(-c2ccccc2)cc1[N+](=O)[O-])c1occc1CS(=O)(=O)c1ccccc1 920330419 CTJRQEYUKRYWPG-UHFFFAOYSA-N 463.467 5.048 5 20 JKBD CNC(=O)Nc1cccc(NC(=O)c2cc([N+](=O)[O-])ccc2N2CCC(Cc3ccccc3)CC2)c1 920443119 RKLLQVALTUIPDZ-UHFFFAOYSA-N 487.560 5.058 5 20 JKBD C[C@@H](Nc1ccc(C(=O)OCC(=O)c2ccc(Cl)c(Cl)c2)cc1[N+](=O)[O-])c1ccccn1 920548198 QZBYSOXIKKVGAO-CYBMUJFWSA-N 474.300 5.509 5 20 JKBD CCOc1ccsc1C(=O)Nc1ccc(C2(NC(=O)Cc3ccc([N+](=O)[O-])cc3F)CCC2)cc1 1785773731 SWJNMDITWNDXGG-UHFFFAOYSA-N 497.548 5.185 5 20 JKBD CC(C)c1cc(C(=O)NC2(c3ccc(NC(=O)Cc4ccc(Cl)cc4[N+](=O)[O-])cc3)CCC2)n[nH]1 1786115938 NYDDRSBMNADWKZ-UHFFFAOYSA-N 495.967 5.085 5 20 JKBD O=C(NC1(c2ccc(NC(=O)c3ncccc3-c3ccccc3)cc2)CCC1)c1ccc([N+](=O)[O-])[nH]1 1788803801 UVKFFXLGTSDYFN-UHFFFAOYSA-N 481.512 5.046 5 20 JKBD O=C(/C=C/c1ccc([N+](=O)[O-])o1)NC1(c2ccc(NC(=O)c3ccc4ncccc4c3)cc2)CCC1 1788906419 DTQKVHDPWPNJCQ-FMIVXFBMSA-N 482.496 5.197 5 20 JKBD C[C@H]1CCC[C@@H]1C(=O)Nc1ccc(C2(NC(=O)Cn3ccc4ccc([N+](=O)[O-])cc43)CCC2)cc1 1789205343 HXZDDYIROJLAMZ-MBSDFSHPSA-N 474.561 5.120 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)c3cnc(-c4ccccc4)s3)CCC2)cc1)c1ccc([N+](=O)[O-])[nH]1 1790185683 KADJAMWVFNNTOE-UHFFFAOYSA-N 487.541 5.108 5 20 JKBD Cc1ccc2oc(C(=O)NC3(c4ccc(NC(=O)c5cc(F)cc([N+](=O)[O-])c5)cc4)CCC3)cc2n1 1790696646 SJSVUVDERLRGKF-UHFFFAOYSA-N 488.475 5.245 5 20 JKBD CC(C)c1nc(C(=O)N2CCCC3(CCN(C(=O)c4cc5cc([N+](=O)[O-])ccc5s4)CC3)C2)co1 1807414956 AOFQJABPGSMNEU-UHFFFAOYSA-N 496.589 5.080 5 20 JKBD CCCCC[C@@H](C)C(=O)Nc1cc([C@H]2CCCCN2C(=O)Cn2ccc3ccc([N+](=O)[O-])cc32)[nH]n1 1822003113 YWNJUQOZSMQYBA-XMSQKQJNSA-N 494.596 5.181 5 20 JKBD CC[C@H](C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2ccc([N+](=O)[O-])cc2F)CC1)c1ccccc1 1826316483 HRQWTTJHODLRHJ-WIOPSUGQSA-N 481.568 5.161 5 20 JKBD C[C@H](CC(=O)N1CCC([C@H]2CCCCN2C(=O)c2cccc(F)c2[N+](=O)[O-])CC1)c1ccccc1 1830623458 VEPZITLCLZYRKH-NTKDMRAZSA-N 481.568 5.161 5 20 JKBD Cc1c(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)CCc3ccoc3)CC2)cc(Cl)cc1[N+](=O)[O-] 1830738354 QDBZRUCLCLFARH-JOCHJYFZSA-N 487.984 5.016 5 20 JKBD O=C(c1cccc2ccoc12)N1CCC([C@H]2CCCCN2C(=O)/C=C/c2ccccc2[N+](=O)[O-])CC1 1832903673 HIXGKOWOPVBJGQ-UWHSVAFCSA-N 487.556 5.288 5 20 JKBD C[C@@H](C(=O)N1CCC([C@@H]2CCCCN2C(=O)/C=C/c2ccccc2[N+](=O)[O-])CC1)c1ccccc1 1832906879 NUHVWECKBFRWCN-ALQDDPBUSA-N 475.589 5.031 5 20 JKBD CSc1ccc(C(=O)c2ccccc2C(=O)OCC(=O)N(c2ccccc2)C(C)C)cc1[N+](=O)[O-] 10154908 IRONGGKXQKJVEQ-UHFFFAOYSA-N 492.553 5.146 5 20 JKBD CC(C)c1ccc(CSc2nnc(S[C@@H](C)c3nnc(-c4ccc([N+](=O)[O-])cc4)o3)s2)cc1 17725583 ZDZSWGQLZYNMTQ-AWEZNQCLSA-N 499.643 6.765 5 20 JKBD C[C@H](Sc1nn(-c2ccccc2)c(=S)s1)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 21365995 QYQCSZGLGFZOPL-JTQLQIEISA-N 486.522 5.710 5 20 JKBD C[C@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccc(Cl)c(-c2nnc3n2CCCCC3)c1 29711143 FXKMEUBFNXGDKV-AWEZNQCLSA-N 471.970 5.352 5 20 JKBD COc1ccc(NC(=O)c2ccc(NCc3ccccc3)c([N+](=O)[O-])c2)cc1OCc1cccnc1 31409237 KFUWVWNEKIIPOE-UHFFFAOYSA-N 484.512 5.442 5 20 JKBD CSc1ccc(C(=O)N2CCCC[C@@H]2C(=O)Nc2ccc(Cl)cc2Cl)cc1[N+](=O)[O-] 195562330 UAYWBFQIDNTFPZ-MRXNPFEDSA-N 468.362 5.257 5 20 JKBD COc1cc(F)c(NC(=O)c2ccccc2Sc2ccc(C(F)(F)F)cc2[N+](=O)[O-])cc1OC 409996420 HZFCDVUGZDWYTB-UHFFFAOYSA-N 496.438 6.173 5 20 JKBD COc1ccc(C[C@@H](NC(=O)c2cc(SC)c(OC)cc2[N+](=O)[O-])c2ccc(OC)cc2)cc1 481925670 ZCQNYNMIVLJZMX-OAQYLSRUSA-N 482.558 5.056 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)Nc2ncc(Cc3cccc(C)c3Cl)s2)cc1SC 482463816 LAHFZUHPSBYFBD-UHFFFAOYSA-N 463.968 5.587 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)N[C@H](C)c2ccc(OCc3cccc(C)c3)cc2)cc1SC 484364182 RXPKRIMUUGNDEK-QGZVFWFLSA-N 466.559 5.704 5 20 JKBD Cc1nn(Cc2ccc(C(=O)Nc3cccc(-c4nc5ccccc5[nH]4)c3)cc2)c(C)c1[N+](=O)[O-] 499144365 RESNSIDZSYMAQP-UHFFFAOYSA-N 466.501 5.252 5 20 JKBD C[C@@H](Nc1ccc(C(=O)Nc2ccccc2N2CCCCCC2)cc1[N+](=O)[O-])c1ccccn1 506137545 OKAAQHMLGKHUHP-LJQANCHMSA-N 459.550 5.796 5 20 JKBD CCOC(=O)c1cc(CC)sc1NC(=O)c1ccc(N[C@@H](C)c2ccccn2)c([N+](=O)[O-])c1 512549191 NFGJFDOJPLLGPS-AWEZNQCLSA-N 468.535 5.216 5 20 JKBD O=C(Nc1ccc(Cl)cc1)Nc1ccc(NC(=O)C2CCN(c3ccccc3[N+](=O)[O-])CC2)cc1 516800706 VRJDQIOZFUSGQX-UHFFFAOYSA-N 493.951 5.747 5 20 JKBD O=C(c1cc2ccccc2c2cccnc12)N1CCC[C@H](c2nc(-c3ccc(F)cc3)no2)C1 588107528 OARAQSVJVYPFGY-IBGZPJMESA-N 452.489 5.597 5 20 JKBD O=C(C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)N(Cc1ccco1)Cc1ccco1 603450851 MABUAKXTQMEKNA-HMMYKYKNSA-N 499.548 6.550 5 20 JKBD C[C@H](c1ccccc1)n1c(SCc2cc([N+](=O)[O-])cc3c2OCOC3)nnc1-c1ccccc1 603917274 MHGWZWMQYRBUPQ-QGZVFWFLSA-N 474.542 5.621 5 20 JKBD COc1ccc(CNC(=O)Cc2sc(-c3ccccc3)nc2-c2cccs2)cc1[N+](=O)[O-] 604018928 VYHOHRHDUVNEKO-UHFFFAOYSA-N 465.556 5.314 5 20 JKBD C[C@H](Nc1ccc(C(=O)NC[C@@H]2CCN(c3ccc(Cl)cc3)C2)cc1[N+](=O)[O-])c1ccccn1 604466672 VGTOZHXWLAYZOU-ROUUACIJSA-N 479.968 5.073 5 20 JKBD Cc1csc(Sc2ccc(C(=O)Nc3ccccc3NC(=O)c3cccs3)cc2[N+](=O)[O-])n1 608808804 DGSNHWNGZYGLSZ-UHFFFAOYSA-N 496.595 6.077 5 20 JKBD COc1cc([C@H](C)NCc2ccc(-c3ccccc3[N+](=O)[O-])o2)ccc1OCc1ccncc1 608836259 VWGPKLYGAKUKOD-SFHVURJKSA-N 459.502 5.688 5 20 JKBD COc1ccccc1N1CC[C@H](CNCc2cn(-c3ccccc3)nc2-c2ccc([N+](=O)[O-])cc2)C1 608837072 YFVRNRQJFLPLJT-OAQYLSRUSA-N 483.572 5.072 5 20 JKBD CC(C)OC(=O)c1ccc(Cl)c(NC(=O)c2cc(OCC(F)(F)F)ccc2[N+](=O)[O-])c1 608897627 NFVAWWQGGJXZQU-UHFFFAOYSA-N 460.792 5.007 5 20 JKBD COc1cc(C(=O)NC[C@@H]2COc3ccccc3C2)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 747581604 OONBSXUFSSKXKH-OAHLLOKOSA-N 468.893 5.030 5 20 JKBD COc1c(C)cnc(CNC(=O)C/C(=C\c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)c1C 747675689 UGEYZWQLZVAFAW-XDHOZWIPSA-N 488.569 5.472 5 20 JKBD O=C(COC(=O)c1csc(-c2ccc([N+](=O)[O-])cc2)n1)N[C@H](c1ccc(F)cc1)C1CCCC1 747954796 LFKQEJJTYQEESC-QFIPXVFZSA-N 483.521 5.062 5 20 JKBD O=C(Nc1nc2ccc(SC(F)F)cc2s1)c1cc([N+](=O)[O-])ccc1Br 751044410 VVWLVWZGSIPCCA-UHFFFAOYSA-N 460.281 5.534 5 20 JKBD CC1=C(C(=O)Nc2ccc([N+](=O)[O-])cc2)[C@H](c2ccc3ncccc3c2)NC(=S)N1c1ccccc1 839439979 XEBYRWNUGIYXPF-VWLOTQADSA-N 495.564 5.492 5 20 JKBD COc1ccc(NC(=O)[C@H](C)OC(=O)c2sc(-c3ccco3)nc2-c2ccccc2)c([N+](=O)[O-])c1 900284493 OUMDFOAPZHSWAQ-AWEZNQCLSA-N 493.497 5.171 5 20 JKBD CC(C)COC(=O)Nc1cccc(NC(=O)c2ccc(N[C@@H](C)c3ccccn3)c([N+](=O)[O-])c2)c1 920225613 GRCDCNDKIIAIDF-KRWDZBQOSA-N 477.521 5.620 5 20 JKBD O=C(CCc1cccc([N+](=O)[O-])c1)Nc1ccc(C2(NC(=O)c3ccncc3Cl)CCC2)cc1 1786602784 RQTYHLRVEMCEBA-UHFFFAOYSA-N 478.936 5.024 5 20 JKBD Cc1nc(C)c(C(=O)Nc2ccc(C3(NC(=O)Cc4ccc(Cl)cc4[N+](=O)[O-])CCC3)cc2)s1 1787332958 AWJKKLPSFFAYTR-UHFFFAOYSA-N 498.992 5.312 5 20 JKBD O=C(Cc1ccc(Cl)cc1[N+](=O)[O-])NC1(c2ccc(NC(=O)c3cnoc3C3CC3)cc2)CCC1 1787594638 MCILSWUOLSNSLM-UHFFFAOYSA-N 494.935 5.104 5 20 JKBD O=C(CCc1cccc([N+](=O)[O-])c1)NC1(c2ccc(NC(=O)c3cnccc3Cl)cc2)CCC1 1789677910 ATLVFPXHUWFIFR-UHFFFAOYSA-N 478.936 5.024 5 20 JKBD CC(C)(C)Oc1ccc(C(=O)NC2(c3ccc(NC(=O)c4ccc([N+](=O)[O-])[nH]4)cc3)CCC2)cc1 1790187169 ATANYFZBSJQGCK-UHFFFAOYSA-N 476.533 5.162 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)C3(c4cccc([N+](=O)[O-])c4)CCC3)CCC2)cc1)[C@@H]1[C@H]2C=CS[C@@H]21 1791093622 XURVYZWKVSSURG-ZLNRFVROSA-N 489.597 5.026 5 20 JKBD O=C(CSc1ccccc1[N+](=O)[O-])Nc1ccc(C2(NC(=O)c3ccnc(Cl)c3)CCC2)cc1 1791521309 JDQWTJPVFJNVDL-UHFFFAOYSA-N 496.976 5.183 5 20 JKBD Cc1c(C(=O)N2CCCC[C@H]2c2cc(NC(=O)c3ccc(Cl)o3)n[nH]2)cc(Cl)cc1[N+](=O)[O-] 1818427555 HTRCQXMRLDJHOO-HNNXBMFYSA-N 492.319 5.146 5 20 JKBD Cc1ccc(S/C=C/C(=O)N2CCC([C@H]3CCCCN3C(=O)c3ccc([N+](=O)[O-])o3)CC2)cc1 1823614316 JUTWTGZOYMWRNZ-RYEVTAHJSA-N 483.590 5.036 5 20 JKBD C[C@@H](C(=O)N1CCCC[C@@H]1C1CCN(C(=O)Cc2cccc([N+](=O)[O-])c2)CC1)c1ccc(Cl)cc1 1823972391 YVDZIVSNGQKORI-KBMIEXCESA-N 498.023 5.214 5 20 JKBD O=C(CCc1cccc([N+](=O)[O-])c1)N1CCC([C@@H]2CCCCN2C(=O)c2ccc(Cl)s2)CC1 1825854680 XNZTYOLBLBGKQT-FQEVSTJZSA-N 490.025 5.176 5 20 JKBD Cc1oc(C(C)(C)C)cc1C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2ccc(O)c([N+](=O)[O-])c2)CC1 1830491507 XTXGWQWRNZBIPU-NRFANRHFSA-N 497.592 5.046 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cc3ccoc3s2)CC1 1830730196 YYUQRPHHHQNRQH-HXUWFJFHSA-N 499.564 5.397 5 20 JKBD O=C(c1cc(F)cc([N+](=O)[O-])c1)N1CCC([C@H]2CCCCN2C(=O)c2ccc(C3CC3)cc2)CC1 1830749579 FKLURVQHZLMTPL-RUZDIDTESA-N 479.552 5.158 5 20 JKBD Cc1ccc(C(=O)N2CCC([C@@H]3CCCCN3C(=O)CSc3ccccc3[N+](=O)[O-])CC2)c(F)c1 1831777295 NZRIZEPRBJGKHH-QFIPXVFZSA-N 499.608 5.068 5 20 JKBD COc1cc(C(=O)OCC(=O)Nc2cccc(C(C)=O)c2)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 10911960 PLIXJLXFSCUVIW-UHFFFAOYSA-N 498.875 5.047 5 20 JKBD CC(C)c1cc(C(=O)O[C@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2C(F)(F)F)c2ccccc2n1 18024415 CRABPFFUNGMXBQ-CYBMUJFWSA-N 475.423 5.469 5 20 JKBD Cc1c(NC(=O)[C@@H](C)Sc2nnc(Cc3ccccc3)n2-c2ccccc2)cccc1[N+](=O)[O-] 28785422 SKBJJKDGBGWTRT-GOSISDBHSA-N 473.558 5.194 5 20 JKBD COc1ccc(/C=C2/N=C(S/C=C/c3ccc([N+](=O)[O-])o3)N(c3cccc(OC)c3)C2=O)cc1 214748747 MXJPHGJPOQJMAA-WWKIBXDVSA-N 477.498 5.353 5 20 JKBD Cc1ccc(C(=O)NCC(F)(F)F)cc1NC(=O)c1ccc(SCCC(C)C)c([N+](=O)[O-])c1 484233382 LTNCDJYHIZEMAC-UHFFFAOYSA-N 483.512 5.586 5 20 JKBD COc1ccccc1OCCN(C)C(=O)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])c(OC)c1 490590984 ZICRAEHURAHWCG-UHFFFAOYSA-N 486.908 5.209 5 20 JKBD Cc1ccc(NC(=O)c2csc(-c3cccc([N+](=O)[O-])c3)n2)cc1S(=O)(=O)Nc1ccccc1 497364467 IMUMTEFVPYKYEW-UHFFFAOYSA-N 494.554 5.080 5 20 JKBD CSc1ccc([N+](=O)[O-])c(C(=O)Nc2ccc(Oc3cccc(Br)c3)nc2)c1 503322947 BDBPPLNSIMHKAV-UHFFFAOYSA-N 460.309 5.519 5 20 JKBD CSc1ccc([N+](=O)[O-])c(C(=O)NCc2ccccc2-c2ccc(Cn3ccnc3)cc2)c1 504768234 FUHOZNNFRNJSRX-UHFFFAOYSA-N 458.543 5.159 5 20 JKBD COc1cc(C(=O)Nc2sc(-c3ccccc3)c(C)c2C(=O)N2CCCCC2)ccc1[N+](=O)[O-] 508780669 VJIHRRWWHWQZPD-UHFFFAOYSA-N 479.558 5.519 5 20 JKBD CC(=O)N(c1ccc(C)c(C)c1)c1nc(COc2ccc(-c3ccccc3)cc2[N+](=O)[O-])cs1 516786081 PWSTTZXXXVBOSU-UHFFFAOYSA-N 473.554 6.599 5 20 JKBD C[C@H](Nc1ccc(C(=O)N2CCCC[C@H]2c2cc3ccccc3[nH]2)cc1[N+](=O)[O-])c1ccccn1 520832857 VPJNJMIJOHZKOL-BVZFJXPGSA-N 469.545 6.012 5 20 JKBD C[C@@H](Nc1ccc(S(=O)(=O)Nc2ccccc2)cc1[N+](=O)[O-])c1nc2ccccc2n1C(F)F 590820809 QUZKCFKIKQCMBS-CQSZACIVSA-N 487.488 5.314 5 20 JKBD Cc1csc(Sc2ccc(C(=O)N3C[C@@H]4CCCN4c4ccccc43)cc2[N+](=O)[O-])n1 603739559 BXKSPVCQYHYSNM-INIZCTEOSA-N 452.561 5.140 5 20 JKBD O=C(CCCCC(=O)N1CCN(Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)CC1)c1ccccc1 603918727 VNMYMJRIADJSDL-UHFFFAOYSA-N 491.613 5.411 5 20 JKBD CC(=O)N(c1ccc(C)cc1)c1nc(/C=C(/c2ccncc2)c2ccc([N+](=O)[O-])cc2)cs1 603945582 JAPZPESCQOKOMV-BUVRLJJBSA-N 456.527 6.028 5 20 JKBD CC1CCN(c2ccc(C(=O)N(C)C[C@@H]3CCCO[C@@H]3c3ccccc3)cc2[N+](=O)[O-])CC1 604519163 PJHUSSMDFKMUMM-WIOPSUGQSA-N 451.567 5.071 5 20 JKBD O=C(Nc1cc(Cl)ccc1Cl)[C@@H]1CCCCN1C(=O)c1c[nH]c2ccc([N+](=O)[O-])cc12 604546033 IAZGQIPBHOXNQD-IBGZPJMESA-N 461.305 5.016 5 20 JKBD C[C@@H](NCc1ccc(N(C)c2ccccc2)c([N+](=O)[O-])c1)c1nc2ccccc2n1C(F)F 609006324 AHVZJAUFDJJVRY-MRXNPFEDSA-N 451.477 5.958 5 20 JKBD Cc1ccc(S(=O)(=O)Nc2ccc(NC(=O)c3cc(Cl)sc3Cl)cc2)cc1[N+](=O)[O-] 610861990 XNLMODBDPHQGQJ-UHFFFAOYSA-N 486.358 5.325 5 20 JKBD CCCOc1ccc(NC(=O)N2CCN(c3ccc([N+](=O)[O-])cc3C(F)(F)F)CC2)c(C)c1 727590312 ILTNTICNPBAAHG-UHFFFAOYSA-N 466.460 5.065 5 20 JKBD O=C(c1nc(-c2cccs2)n(-c2ccccc2)n1)N(CC1CC1)c1ccc(Cl)c([N+](=O)[O-])c1 728165623 MERDHHAPASEMLS-UHFFFAOYSA-N 479.949 5.614 5 20 JKBD O=C(OCC(=O)N(Cc1ccc(F)cc1)c1nc(-c2ccccc2)cs1)c1cccc([N+](=O)[O-])c1 747786020 GLVDLLOYGVPEMN-UHFFFAOYSA-N 491.500 5.248 5 20 JKBD Cc1cccc(C(C)C)c1NC(=O)[C@@H](C)OC(=O)c1csc(-c2cccc([N+](=O)[O-])c2)n1 747961835 JTLSDUINFKQMTC-OAHLLOKOSA-N 453.520 5.334 5 20 JKBD C[C@@H](OC(=O)C1(c2ccccc2F)CCCC1)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 755675631 FQGXAAUBVNENAI-CYBMUJFWSA-N 468.403 5.135 5 20 JKBD COc1ccc(-c2noc(Cc3cn(-c4ccccc4)nc3-c3ccc([N+](=O)[O-])cc3)n2)cc1OC 904285423 RSBJTQSLBCYZTQ-UHFFFAOYSA-N 483.484 5.106 5 20 JKBD O=C(Nc1nc(-c2sccc2Br)cs1)c1ccc(Br)c([N+](=O)[O-])c1 916420742 WCAPCSHOQZHFLB-UHFFFAOYSA-N 489.170 5.557 5 20 JKBD O=C(CCCn1c(=O)oc2cc([N+](=O)[O-])ccc21)Nc1ccccc1SC[C@@H]1CC1(Cl)Cl 917750745 IQPULGHQRQFWKY-ZDUSSCGKSA-N 496.372 5.208 5 20 JKBD CN(Cc1cccc(C(N)=O)c1)C(=O)c1ccccc1Sc1ccc(C(F)(F)F)cc1[N+](=O)[O-] 918177228 JYIISIMGWMRWCN-UHFFFAOYSA-N 489.475 5.136 5 20 JKBD COc1cc(Cl)ccc1C(=O)Oc1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2Cl)cc1 921277622 ZUXVHVUPGFZQRX-UHFFFAOYSA-N 461.257 5.382 5 20 JKBD Cc1cc2[nH]c(C(=O)NC3(c4ccc(NC(=O)c5ccc([N+](=O)[O-])o5)cc4)CCC3)cc2s1 1785751243 UPZLJYDRSJLHLS-UHFFFAOYSA-N 464.503 5.101 5 20 JKBD CC(C)(C)c1cc(C(=O)NC2(c3ccc(NC(=O)/C=C/c4ccc([N+](=O)[O-])o4)cc3)CCC2)c[nH]1 1786206378 LWBFHTJCOZVBFQ-PKNBQFBNSA-N 476.533 5.275 5 20 JKBD COc1cc(C(=O)NC2(c3ccc(NC(=O)c4ccc5cc[nH]c5c4)cc3)CCC2)ccc1[N+](=O)[O-] 1788914343 DYNISDSSSIJWFB-UHFFFAOYSA-N 484.512 5.146 5 20 JKBD Cc1nc(C(=O)NC2(c3ccc(NC(=O)C4(c5cccc([N+](=O)[O-])c5)CCC4)cc3)CCC2)cs1 1790475992 QTAINOMPNQHDRT-UHFFFAOYSA-N 490.585 5.229 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)Nc1ccc(C2(NC(=O)[C@H](C)Cc3ccccn3)CCC2)cc1 1790772305 HTSPOTLSHBZBEW-QGZVFWFLSA-N 490.535 5.064 5 20 JKBD Cc1ccc(CCC(=O)NC2(c3ccc(NC(=O)/C=C/c4ccccc4[N+](=O)[O-])cc3)CCC2)c(C)n1 1792319388 PWHXVBXGNCNAHK-LFIBNONCSA-N 498.583 5.387 5 20 JKBD Cc1c(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)[C@@H]2CCC[C@H]3CCCC[C@H]32)cc(Cl)cc1[N+](=O)[O-] 1797875057 OEBZKNHVFXYUPS-MNVGVQDPSA-N 488.028 5.415 5 20 JKBD Cc1cc2cc(C(=O)N3[C@H]4CC[C@@H]3C[C@H](NC(=O)c3cc5cc([N+](=O)[O-])ccc5s3)C4)ccc2[nH]1 1801166337 PEEXWBNTMUCTIQ-ACDBMABISA-N 488.569 5.165 5 20 JKBD CC1=CC[C@@H](C(=O)N2CCCC[C@H]2C2CCN(C(=O)C3(c4cccc([N+](=O)[O-])c4)CCC3)CC2)CC1 1828348982 HZJSOIYDQQRMKT-BVAGGSTKSA-N 493.648 5.383 5 20 JKBD Cc1ccc(C(=O)N2CCC([C@H]3CCCCN3C(=O)c3cc(F)cc([N+](=O)[O-])c3)CC2)c(Cl)c1 1830615324 BMAQHDDVDYSXDV-HSZRJFAPSA-N 487.959 5.243 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)N1CCCC[C@@H]1C1CCN(C(=O)[C@@H]2CCCCC2(F)F)CC1 1830728350 KMVSRIGROVSCRT-GHTZIAJQSA-N 495.542 5.101 5 20 JKBD O=C(/C=C/c1ccoc1)N1CCC([C@H]2CCCCN2C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)CC1 1831060014 MSIWNZITRVQMRA-ZMTJCJBESA-N 493.585 5.349 5 20 JKBD O=C(/C=C/C1CCCC1)N1CCC([C@@H]2CCCCN2C(=O)CSc2ccccc2[N+](=O)[O-])CC1 1831777624 UJMIEFMLCUBKEY-GNNUASRNSA-N 485.650 5.053 5 20 JKBD CCCn1c(S[C@@H](C(=O)Nc2ccc(C)cc2[N+](=O)[O-])c2ccccc2)nnc1-c1ccncc1 11212714 WUTIHNOBHZVZMR-JOCHJYFZSA-N 488.573 5.439 5 20 JKBD O=C1c2ccccc2N[C@H](c2ccc(Oc3ccc(F)cc3)c([N+](=O)[O-])c2)N1C[C@H]1CCCO1 15503690 HXHFMWFSIUEVIB-DVECYGJZSA-N 463.465 5.272 5 20 JKBD C[C@@H](SC1=Nc2ccccc2CS1)C(=O)Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1 22022036 HJGDAFKDKYHZDM-GFCCVEGCSA-N 456.574 5.713 5 20 JKBD CN(Cc1ccc(Cl)cc1Cl)C(=O)c1ccccc1NC(=O)c1ccc([N+](=O)[O-])cc1Cl 23039538 BPCZXVMOVFTZNG-UHFFFAOYSA-N 492.746 6.080 5 20 JKBD O=C(Cc1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1)NCc1ccc(Cl)s1 25523960 JCWKMIHVWFGZKK-UHFFFAOYSA-N 452.923 5.021 5 20 JKBD O=C(CCOc1ccccc1)O[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Br)c1ccccc1 28303750 NCZMKYQMHSGTFL-QFIPXVFZSA-N 499.317 5.049 5 20 JKBD COc1cc2c(cc1OC)[C@@H](c1ccccc1)N(C(=O)[C@@H](C)Sc1ccc([N+](=O)[O-])cc1)CC2 32891786 ZDGFTFCLWDFPEP-CRICUBBOSA-N 478.570 5.267 5 20 JKBD O=[N+]([O-])c1ccccc1OCCSc1nnc(-c2ccc(Cl)cc2)n1Cc1ccco1 71960111 WHEFIYWUZSNOBZ-UHFFFAOYSA-N 456.911 5.319 5 20 JKBD C[C@H](Nc1ccc(C(=O)N[C@@H](c2ccccc2)c2ccncc2)cc1[N+](=O)[O-])c1ccccn1 72016894 KCDVDGZQKVRXRY-BVZFJXPGSA-N 453.502 5.077 5 20 JKBD Cc1ccc(-c2nc(C)c([C@@H](C)NC(=O)[C@H]3CCCN3C(=O)c3ccc([N+](=O)[O-])c(C)c3)s2)cc1 78661116 SCAIPHARFMOHGG-VGOFRKELSA-N 492.601 5.126 5 20 JKBD CCOc1cc(C(=O)N[C@@H](c2ccc3c(c2)CCCC3)c2cccs2)c([N+](=O)[O-])cc1OC 105271974 DKPKVTNWRVLMHA-DEOSSOPVSA-N 466.559 5.462 5 20 JKBD Cc1ccc(-c2csc(NC(=O)c3c(C)nn(Cc4ccccc4)c3Cl)n2)cc1[N+](=O)[O-] 105351757 LNFIZNWLPFFTPG-UHFFFAOYSA-N 467.938 5.486 5 20 JKBD COc1ccc(Oc2ccc([N+](=O)[O-])cc2C(=O)N[C@@H](C)c2ccc(NC(=O)NC3CC3)cc2)cc1 483270787 NWUMULQWGOIOOL-INIZCTEOSA-N 490.516 5.171 5 20 JKBD NC(=O)Nc1ccc(NC(=O)C/C(=C\c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)cc1 485263483 WOUXZIQMTGHHNX-DTQAZKPQSA-N 473.514 5.265 5 20 JKBD COc1cccc([C@@H](CNc2cc3c(cc2[N+](=O)[O-])CCC(=O)N3)c2c[nH]c3ccccc23)c1OC 506819658 BUXNAJTXXBIUND-HXUWFJFHSA-N 486.528 5.222 5 20 JKBD Cc1cccc(Oc2ncccc2NC(=O)c2ccc(N[C@@H](C)c3ccccn3)c([N+](=O)[O-])c2)c1C 512566334 SSCHNRYWXPSHPA-IBGZPJMESA-N 483.528 6.219 5 20 JKBD O=C(Nc1cccc(OCCn2cncn2)c1)c1cc([N+](=O)[O-])ccc1Sc1ccc(Cl)cc1 515680598 VZCIEXKCFLIJIP-UHFFFAOYSA-N 495.948 5.322 5 20 JKBD O=C(CSc1ccc([N+](=O)[O-])cc1)Nc1ccc(NC(=O)Nc2ccc(Cl)cc2)cc1 516357192 LSKIEPYMZRADMA-UHFFFAOYSA-N 456.911 5.623 5 20 JKBD C[C@H](NC(=O)CSc1ccc([N+](=O)[O-])cc1)c1ccc(NC(=O)Nc2ccccc2)cc1 517359042 LNVAKHQXOKTVSM-INIZCTEOSA-N 450.520 5.208 5 20 JKBD CCOCCOc1c(Cl)cccc1NC(=O)c1ccc(Sc2nc(C)cs2)c([N+](=O)[O-])c1 519877183 SUECTKNVXNQTGD-UHFFFAOYSA-N 493.994 5.832 5 20 JKBD O=C(Nc1ccc2nc([C@@H]3CCCO3)[nH]c2c1)c1cc([N+](=O)[O-])ccc1Sc1ccccc1 519931485 ALGYFWCBTCTDQP-NRFANRHFSA-N 460.515 5.726 5 20 JKBD O=C(CSc1ccc(C(F)(F)F)cc1[N+](=O)[O-])Nc1ccc(OCc2ccncc2)cc1 521533852 NBEDCWRDXSMZAK-UHFFFAOYSA-N 463.437 5.318 5 20 JKBD COc1cc(C(=O)N[C@@H](CC(C)C)c2cccc(C(F)(F)F)c2)c([N+](=O)[O-])cc1OC(F)F 524207449 FAYGXMHAAJDSOU-HNNXBMFYSA-N 476.398 5.741 5 20 JKBD CN(C)Cc1ccccc1NC(=O)C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1 560317196 ADFZJQWRDVOCAK-HMMYKYKNSA-N 472.570 5.836 5 20 JKBD COC(=O)c1ccc(F)c(NC(=O)C/C(=C\c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)c1 593271766 QZJFDBYTYNILGS-SFQUDFHCSA-N 491.500 5.700 5 20 JKBD CCCOc1cc(NC(=O)N2CCC[C@H]2c2cccc(OC)c2)c([N+](=O)[O-])cc1OCCC 603652953 QCNGNGQQAHBRRR-FQEVSTJZSA-N 457.527 5.550 5 20 JKBD CCOc1cc(C(=O)Nc2nc(C)c(Cc3cccc(Cl)c3)s2)c([N+](=O)[O-])cc1OC 603973605 SJYNLYJIRPCUEL-UHFFFAOYSA-N 461.927 5.264 5 20 JKBD COc1cc(C(=O)N[C@H](c2ccc(Br)cc2)C2CCC2)c([N+](=O)[O-])cc1OC(F)F 604017604 OPKVDGREYAWFDQ-SFHVURJKSA-N 485.281 5.239 5 20 JKBD Cc1nn(C)c(Oc2cccnc2)c1NC(=O)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1 608961780 JMIAQNCGZHUEAZ-UHFFFAOYSA-N 479.880 5.522 5 20 JKBD COc1cc(CSc2nnc(C[C@H](C)c3ccccc3)o2)c([N+](=O)[O-])cc1OC(F)F 619253886 SGDIKZUDBZRANP-LBPRGKRZSA-N 451.451 5.226 5 20 JKBD O=C(Cn1c2ccccc2c(=O)c2ccccc21)Nc1ccc(NCc2ccccc2)c(Cl)c1 621126566 OQMUMNSYIVXGNH-UHFFFAOYSA-N 467.956 6.059 5 20 JKBD Cc1c(NC(=O)c2cc3ccccc3c3cccnc23)cccc1C(=O)N1CCc2sccc2C1 642518231 XZUDIWFUABOFIS-UHFFFAOYSA-N 477.589 6.209 5 20 JKBD C[C@@H](Nc1ccc(OCc2cccc(F)c2)c(F)c1)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 728592386 DYTONFVNUJHERD-CYBMUJFWSA-N 495.404 5.910 5 20 JKBD CC(C)(C)OC(=O)Nc1ccc(F)c(NC(=O)c2csc(-c3cccc([N+](=O)[O-])c3)n2)c1 747639697 PTYRPEGXSWEPSF-UHFFFAOYSA-N 458.471 5.457 5 20 JKBD Cc1ccc(-c2noc([C@H](C)OC(=O)c3csc(-c4cccc([N+](=O)[O-])c4)n3)n2)cc1F 747961623 GRRGTTOWZUZBOT-LBPRGKRZSA-N 454.439 5.134 5 20 JKBD O=[N+]([O-])c1cc(C(F)(F)F)ccc1NCCc1nc(-c2ccc(-n3cnc4ccccc43)nc2)no1 904487795 CCVAFZFGATZIKY-UHFFFAOYSA-N 495.421 5.052 5 20 JKBD O=C1C[C@@H](C(=O)N(c2ccccc2)c2nc3ccccc3s2)CN1c1ccc(F)c([N+](=O)[O-])c1 913126111 JAFBBLZJGGSIKA-OAHLLOKOSA-N 476.489 5.061 5 20 JKBD C[C@@H](OC(=O)CCSc1ccccc1Br)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 915589989 IJCAWCGCFCEOIU-GFCCVEGCSA-N 478.324 5.194 5 20 JKBD O=C(OCC[C@@H]1CCCCN1C(=O)c1csc(-c2ccc(F)cc2)n1)c1cccc([N+](=O)[O-])c1 918632503 IHVDSHFYZLPTEZ-IBGZPJMESA-N 483.521 5.099 5 20 JKBD Cc1c(COC(=O)[C@@H]2CCC(=O)N(Cc3ccccc3)[C@H]2c2ccccc2)cccc1[N+](=O)[O-] 919531769 DZDAPPJLTSCWMR-BVAGGSTKSA-N 458.514 5.127 5 20 JKBD C[C@@H](Nc1ccc(C(=O)Nc2ccccc2C(=O)NCc2ccccc2)cc1[N+](=O)[O-])c1ccccn1 919699928 QDQJOTPQCQUMGP-LJQANCHMSA-N 495.539 5.345 5 20 JKBD COc1cc(/C=C/C(=O)N(Cc2ccc([N+](=O)[O-])cc2)C(C)C)ccc1OCc1c(C)noc1C 919869252 UVUZCLFERALPEM-UKTHLTGXSA-N 479.533 5.238 5 20 JKBD COc1ccc(-c2nc(COC(=O)c3ccc(N[C@H](C)c4ccccn4)c([N+](=O)[O-])c3)co2)cc1 920548777 SKNAGEWKCSMAFL-MRXNPFEDSA-N 474.473 5.184 5 20 JKBD O=C(/C=C/c1ccc([N+](=O)[O-])o1)Nc1ccc(C2(NC(=O)/C=C/c3cccs3)CCC2)cc1 1786205036 ZHAIPRNZDVUETC-TXSAMIJNSA-N 463.515 5.110 5 20 JKBD O=C(/C=C/c1ccc([N+](=O)[O-])o1)Nc1ccc(C2(NC(=O)c3ccc(Cl)cc3)CCC2)cc1 1786207860 OLFIIHALOPZHNY-ZRDIBKRKSA-N 465.893 5.302 5 20 JKBD Cc1nscc1C(=O)Nc1ccc(C2(NC(=O)Cc3ccc(Cl)cc3[N+](=O)[O-])CCC2)cc1 1787190811 BSYNQJNIWATXRM-UHFFFAOYSA-N 484.965 5.004 5 20 JKBD O=C(NC1(c2ccc(NC(=O)c3ccccc3Cl)cc2)CCC1)c1ccc(O)c([N+](=O)[O-])c1 1790225836 KRRBJCJVOSCYDU-UHFFFAOYSA-N 465.893 5.015 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)[C@H]3C[C@H]3C3CC3)CCC2)cc1)c1cccc([N+](=O)[O-])c1Br 1790636798 SDMLASFZWODYHT-OALUTQOASA-N 498.377 5.151 5 20 JKBD O=C(/C=C\c1c[nH]c2ccccc12)NC1(c2ccc(NC(=O)c3cc(O)cc([N+](=O)[O-])c3)cc2)CCC1 1790754843 GGWNIZNWVYWNTA-WDZFZDKYSA-N 496.523 5.243 5 20 JKBD O=C(NC1(c2ccc(NC(=O)c3cc4cc([N+](=O)[O-])ccc4s3)cc2)CCC1)c1cc(F)c[nH]1 1791009947 FCFGBQUAUXQLCN-UHFFFAOYSA-N 478.505 5.338 5 20 JKBD O=C(/C=C/c1ccccc1[N+](=O)[O-])Nc1ccc(C2(NC(=O)c3ccc4cnccc4c3)CCC2)cc1 1792317715 JAUXBOWFVDVHKH-MDWZMJQESA-N 492.535 5.604 5 20 JKBD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2cc(F)cc([N+](=O)[O-])c2)[nH]n1)c1cccc2ccccc12 1818453797 AGAQPTPUFBQLBT-QHCPKHFHSA-N 487.491 5.230 5 20 JKBD C[C@@H](C(=O)N1CCC([C@@H]2CCCCN2C(=O)/C=C/c2ccc([N+](=O)[O-])o2)CC1)c1ccc(Cl)cc1 1824275528 CNKHYWGQYICINF-YQNRKWKVSA-N 499.995 5.278 5 20 JKBD Cc1cc(CCCC(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3occc3C)CC2)c([N+](=O)[O-])cc1F 1824370099 NCYOWJXYMWWTPX-HSZRJFAPSA-N 499.583 5.200 5 20 JKBD CC[C@H](C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cccc(F)c2[N+](=O)[O-])CC1)c1ccccc1 1830615738 BKEODPZIPKKNQF-XUZZJYLKSA-N 481.568 5.161 5 20 JKBD C/C=C/C=C\C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)CC1 1831363993 CECAOLHGCPXCMX-MESDEOKJSA-N 467.591 5.175 5 20 JKBD C[C@H]1CC[C@H](C(=O)N2CCC([C@H]3CCCCN3C(=O)CSc3ccccc3[N+](=O)[O-])CC2)CC1 1831777171 GOTNPADMKBGBIT-CEMLEFRQSA-N 487.666 5.133 5 20 JKBD O=C(COc1ccccc1Cl)O[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1 10361821 MXQPLVDSAISXIH-OAQYLSRUSA-N 475.284 5.204 5 20 JKBD C[C@@H](NC[C@H](c1ccccc1)c1c[nH]c2ccccc12)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl 19623278 ZEAXLOZOUSTQJP-OXQOHEQNSA-N 462.937 5.478 5 20 JKBD Cc1ccc(CN[C@@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Br)c2ccccc2)cc1 21820044 GKFHTAQGZBPSQT-OAQYLSRUSA-N 454.324 5.135 5 20 JKBD Cc1noc(C)c1CSc1ncccc1C(=O)OCc1nc2ccccc2c2ccccc12 26205286 DDBFVUPBLZXRAJ-UHFFFAOYSA-N 455.539 6.037 5 20 JKBD CCn1c(SCCC(=O)Nc2ccc(OC)cc2[N+](=O)[O-])nnc1-c1ccc(C(C)(C)C)cc1 26371482 HOJLJJOVCRQSTR-UHFFFAOYSA-N 483.594 5.300 5 20 JKBD COc1cc(C(=O)N[C@@H](C)c2cccc(NC(C)=O)c2)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 30276146 ZKXXAIPVBQMLPR-AWEZNQCLSA-N 483.908 5.499 5 20 JKBD CCOC(=O)[C@](F)(c1c(F)cc2c(ccc3c(Br)cccc32)c1F)C(F)(F)F 98178046 ORTKGQBVLXUNMH-GOSISDBHSA-N 465.187 6.324 5 20 JKBD CCC(=O)Nc1ccc(Cl)c(NC(=O)CSc2ccc(C(F)(F)F)cc2[N+](=O)[O-])c1 107960472 FDLBJHHEUZMKBW-UHFFFAOYSA-N 461.849 5.346 5 20 JKBD O=C(Nc1ccccc1C(=O)NCc1csc2ccccc12)c1ccc([N+](=O)[O-])cc1Cl 108616052 IKJMOFKIWOFLRP-UHFFFAOYSA-N 465.918 5.645 5 20 JKBD Cc1ccc(C(C)C)c(Oc2ccc(CNC3CCN(C(=O)c4ccncc4)CC3)cc2[N+](=O)[O-])c1 409715495 HHRSXNWWAKCTKG-UHFFFAOYSA-N 488.588 5.608 5 20 JKBD Cc1c(NC(=O)c2csc(-c3ccc([N+](=O)[O-])cc3)n2)cccc1C(=O)Nc1ccccc1 498464372 IPZFHXFJFDLPPN-UHFFFAOYSA-N 458.499 5.531 5 20 JKBD O=[N+]([O-])c1ccc(S(=O)(=O)N(Cc2ccc(Cl)c(Cl)c2)Cc2ccccn2)c(Cl)c1 500700570 VNSBAGKGMRXYNP-UHFFFAOYSA-N 486.764 5.341 5 20 JKBD COc1ccc(NC(=O)c2ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])cc2)c(C(F)(F)F)c1 500770121 BESJODQLPFZEPG-UHFFFAOYSA-N 466.799 6.320 5 20 JKBD C[C@H]1Cc2cc([N+](=O)[O-])ccc2N1C(=O)c1cccc(NC(=O)c2ccc(Br)cc2)c1 504300893 YWMOBKKNGZWEKB-AWEZNQCLSA-N 480.318 5.201 5 20 JKBD Cc1csc(Sc2ccc(C(=O)N(C)CCCc3cc(-c4ccccc4)no3)cc2[N+](=O)[O-])n1 505430578 DTXYUJQKPMSJME-UHFFFAOYSA-N 494.598 5.871 5 20 JKBD Cc1nn(Cc2ccc(C(=O)NC(c3ccc(F)cc3)c3ccc(F)cc3)cc2)c(C)c1[N+](=O)[O-] 508024570 CWOOEVKVIXIEJQ-UHFFFAOYSA-N 476.483 5.254 5 20 JKBD COc1ccc2c(c1)CN(C(=O)C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc3ccccc3s1)CC2 512829977 YIBKGMCPVWDGFW-ZHZULCJRSA-N 485.565 5.729 5 20 JKBD CN(c1ccccc1)c1ccc(CNCc2cccc(NC(=O)c3ccccn3)c2)cc1[N+](=O)[O-] 513648311 OYOZYBRHWHZDNH-UHFFFAOYSA-N 467.529 5.300 5 20 JKBD O=C(Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1)[C@H]1CCCN1C(=O)c1ccc(Cl)c(Cl)c1 514487904 ZVWCNIGMKJHHHF-GOSISDBHSA-N 491.356 5.268 5 20 JKBD COc1ccc(CSCC(=O)N[C@@H](C)c2ccc(-c3csc(C)n3)cc2)cc1[N+](=O)[O-] 515341161 CDUVYDBOBFMJDH-AWEZNQCLSA-N 457.577 5.146 5 20 JKBD O=C(Nc1ccc(Cl)cc1)Nc1ccc(NC(=O)c2ccn(-c3cccc([N+](=O)[O-])c3)n2)cc1 517935591 CFMFRWLELPUIHQ-UHFFFAOYSA-N 476.880 5.330 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Cl)NC1CCN(Cc2ccc(Cl)c(Cl)c2)CC1 518240400 XSOFQLFIYSLXKD-UHFFFAOYSA-N 457.745 5.341 5 20 JKBD O=C(Nc1ccc(Sc2nncs2)cc1)c1ccc(NCc2ccccc2)c([N+](=O)[O-])c1 518278295 YWMGQXDMMKJIKZ-UHFFFAOYSA-N 463.544 5.462 5 20 JKBD COc1cc(C(=O)N[C@H]2CCSc3ccc(Cl)cc32)c([N+](=O)[O-])cc1OCc1cscn1 520664103 CGDOHJUXOBHJDI-INIZCTEOSA-N 491.978 5.259 5 20 JKBD Cc1nn(C)c2ncc(NC(=O)C/C(=C/c3ccc([N+](=O)[O-])cc3)c3nc4ccccc4s3)cc12 591687431 HCSPHSIABUKQJC-BOPFTXTBSA-N 484.541 5.364 5 20 JKBD COc1cc(C(=O)Nc2ccccc2N2CCc3ccccc32)c([N+](=O)[O-])cc1OC(F)F 603588991 YROCTZMSYIXVOB-UHFFFAOYSA-N 455.417 5.151 5 20 JKBD C[C@H](Nc1ccc(NC(=O)c2cc(OCC(F)(F)F)ccc2[N+](=O)[O-])cc1)c1ccccc1 604445488 JQOHSSUAUMFLIW-HNNXBMFYSA-N 459.424 5.961 5 20 JKBD Cc1ccccc1NC(=O)[C@H]1CCc2ccccc2N1C(=O)c1csc(-c2ccc([N+](=O)[O-])cc2)n1 608873087 VFWWRNNTEGVNOI-XMMPIXPASA-N 498.564 5.627 5 20 JKBD COc1cc(C(=O)Nc2cc(F)ccc2Oc2ccccc2)c([N+](=O)[O-])cc1OCc1cscn1 609022946 VRFKBHHXVMFOTL-UHFFFAOYSA-N 495.488 5.823 5 20 JKBD Cc1nn(Cc2ccc(C(=O)N3CCCC[C@@H]3c3cc4ccccc4[nH]3)cc2)c(C)c1[N+](=O)[O-] 609381589 QPQXCNJPLLWKGJ-XMMPIXPASA-N 457.534 5.305 5 20 JKBD Cc1ccc([C@@H](NCc2nc(-c3cccc([N+](=O)[O-])c3)no2)c2ccc(F)cc2Cl)cc1 609385706 DEFMFURWNNWJCR-JOCHJYFZSA-N 452.873 5.625 5 20 JKBD CC(=O)c1ccc(Sc2nnc(-c3ccc(Br)o3)n2Cc2ccccc2)c([N+](=O)[O-])c1 619693432 PURGKXHSARPXMI-UHFFFAOYSA-N 499.346 5.611 5 20 JKBD Cc1nn(Cc2ccc(C(=O)N3CCC[C@H]3c3ccccc3C(F)(F)F)cc2)c(C)c1[N+](=O)[O-] 728034441 PHZZZMITMCSULQ-NRFANRHFSA-N 472.467 5.453 5 20 JKBD Cc1nc(-c2ccc(F)cc2)sc1[C@@H](C)NC(=O)c1cc([N+](=O)[O-])c(C)c([N+](=O)[O-])c1C 729418645 AMQDFCLDEKISHI-GFCCVEGCSA-N 458.471 5.182 5 20 JKBD CC(C)Cc1ccc([C@H](NC(=O)CNC(=O)c2c(Cl)cccc2[N+](=O)[O-])c2cccs2)cc1 731051016 UDONVVVBHZNDGL-QHCPKHFHSA-N 485.993 5.144 5 20 JKBD C[C@H](OC(=O)c1csc(-c2ccc([N+](=O)[O-])cc2)n1)C(=O)c1ccc(NC(=O)C(C)(C)C)cc1 747958868 YYVBYBBNSQWIQV-AWEZNQCLSA-N 481.530 5.131 5 20 JKBD O=C(Nc1ccccc1C(=O)Nc1ccc2nc(C3CCC3)[nH]c2c1)c1ccc([N+](=O)[O-])cc1Cl 749384030 MTSGFZXHSXXCHV-UHFFFAOYSA-N 489.919 5.897 5 20 JKBD CC[C@@H](C)n1c(S[C@@H](C)C(=O)Nc2cc([N+](=O)[O-])ccc2Cl)nnc1-c1ccccc1 749752022 OKXXTOSSPBOTJZ-KGLIPLIRSA-N 459.959 5.597 5 20 JKBD Cc1ccnn1-c1ccc(C(=O)O[C@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2ccccc2)cc1 749960239 QCYXERGFFXPKPI-QHCPKHFHSA-N 490.903 5.279 5 20 JKBD CC(C)Cc1noc(COC(=O)C/C(=C/c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)n1 863837808 XNDFYKUHIXJIAX-ATVHPVEESA-N 478.530 5.460 5 20 JKBD COc1ccc(NCc2c(Br)cccc2[N+](=O)[O-])cc1NC(=O)OC(C)(C)C 864025357 PPEGQDOWNHSCOD-UHFFFAOYSA-N 452.305 5.325 5 20 JKBD CC1CCN(c2ccc([N+](=O)[O-])cc2C(=O)Nc2cccc(-c3nnc4n3CCCCC4)c2)CC1 912614794 DSDINVGUSGNJEX-UHFFFAOYSA-N 474.565 5.068 5 20 JKBD CC(C)c1cc(C(=O)Oc2ccc(NC(=O)c3cccc([N+](=O)[O-])c3)cc2)nn1C(C)(C)C 916952850 KZZHPESLMOTUPV-UHFFFAOYSA-N 450.495 5.141 5 20 JKBD CCOc1cc([N+](=O)[O-])c(C(=O)O[C@H](C)c2cccc(NC(=O)c3ccccc3)c2)cc1OC 918907279 XTQCYGWPLHEYSJ-MRXNPFEDSA-N 464.474 5.172 5 20 JKBD Cc1ccc(F)cc1C(=O)Nc1ccc(C2(NC(=O)/C=C/c3ccc([N+](=O)[O-])o3)CCC2)cc1 1785939328 MQJCXUSOZVCNTK-PKNBQFBNSA-N 463.465 5.096 5 20 JKBD O=C(CCc1cccc([N+](=O)[O-])c1)Nc1ccc(C2(NC(=O)c3ccnc(C(F)F)c3)CCC2)cc1 1786602398 OARQQKVTFRDKNJ-UHFFFAOYSA-N 494.498 5.308 5 20 JKBD COc1cccc(Cl)c1C(=O)NC1(c2ccc(NC(=O)c3cc(C)c([N+](=O)[O-])cn3)cc2)CCC1 1788767481 SAOZIQJOURTTKP-UHFFFAOYSA-N 494.935 5.022 5 20 JKBD CC1=CC[C@@H](C(=O)Nc2ccc(C3(NC(=O)c4cc(N(C)C)ccc4[N+](=O)[O-])CCC3)cc2)CC1 1789115639 ZZJGFFPLOMWRGH-LJQANCHMSA-N 476.577 5.155 5 20 JKBD Cc1cc(C(=O)Nc2ccc(C3(NC(=O)c4cc5cc([N+](=O)[O-])ccc5s4)CCC3)cc2)ccn1 1789752340 PPVRQIURTZDYNU-UHFFFAOYSA-N 486.553 5.574 5 20 JKBD O=C(/C=C/C1CCCC1)Nc1ccc(C2(NC(=O)c3cc([N+](=O)[O-])cc4c3OCC4)CCC2)cc1 1790515610 SEXAHCGVGFJKPE-IZZDOVSWSA-N 475.545 5.024 5 20 JKBD O=C(CSc1ccccc1[N+](=O)[O-])Nc1ccc(C2(NC(=O)c3sccc3F)CCC2)cc1 1791521273 HCUDAIGAUSWUHD-UHFFFAOYSA-N 485.562 5.335 5 20 JKBD O=C(NC1(c2ccc(NC(=O)C3CCC(O)CC3)cc2)CCC1)c1cc2cc([N+](=O)[O-])ccc2s1 1791708377 WWKOPNZAWRUWKU-UHFFFAOYSA-N 493.585 5.108 5 20 JKBD C[C@H](Cc1ccco1)C(=O)Nc1ccc(C2(NC(=O)CSc3ccccc3[N+](=O)[O-])CCC2)cc1 1791914918 YXMNBVWGCYGAMV-GOSISDBHSA-N 493.585 5.293 5 20 JKBD CC(C)[C@H](C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CCc1cccc([N+](=O)[O-])c1)C2)c1ccc(Cl)cc1 1793223353 BNRPUZXXLVTWIE-LNEBKTTKSA-N 498.023 5.259 5 20 JKBD C[C@@H](Sc1ccccc1)C(=O)N1CCC([C@H]2CCCCN2C(=O)/C=C/c2ccc([N+](=O)[O-])o2)CC1 1824277462 ZBBJENQTYWGPRF-JXAYXJHWSA-N 497.617 5.002 5 20 JKBD Cc1c(F)cccc1C(=O)N1CCC([C@@H]2CCCCN2C(=O)CSc2ccccc2[N+](=O)[O-])CC1 1831775286 KRRQWUVEYVMLQL-QFIPXVFZSA-N 499.608 5.068 5 20 JKBD O=C(c1ccc(NCc2ccccc2)c([N+](=O)[O-])c1)N1CCC(c2c[nH]c3ccccc23)CC1 9896867 ARJPLJRQWGYANO-UHFFFAOYSA-N 454.530 5.708 5 20 JKBD O=C(c1ccc(NC2CC2)c([N+](=O)[O-])c1)N1CCC(c2nc3cc(Cl)ccc3s2)CC1 10235510 XHVOKYUHJZFWQC-UHFFFAOYSA-N 456.955 5.452 5 20 JKBD Cc1nc(CSc2ccc(C(=O)OCC(=O)Nc3ccc(Cl)c([N+](=O)[O-])c3)cc2)cs1 11698364 ARGAVJZCLNPVSE-UHFFFAOYSA-N 477.951 5.101 5 20 JKBD O=C(C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)Nc1ccccc1OC(F)F 15993680 CPUOXTQHJYKEKF-SSZFMOIBSA-N 481.480 6.375 5 20 JKBD COc1ccc(CN(C)[C@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Br)c2ccccc2)cc1 16554751 YUJBNFALOZSMLI-QFIPXVFZSA-N 484.350 5.178 5 20 JKBD CCOc1ccc(Oc2ccccc2NC(=O)c2cc(OC)c(OCC)cc2[N+](=O)[O-])cc1 19358253 WJFOCDYVASORLZ-UHFFFAOYSA-N 452.463 5.445 5 20 JKBD Cc1ccc(Sc2ccc(NC(=O)c3ccc(S(C)(=O)=O)c([N+](=O)[O-])c3)cc2)c(C)c1 21050795 CLTBYUCQCILATN-UHFFFAOYSA-N 456.545 5.019 5 20 JKBD CN(C)c1ccc(C(=O)c2ccccc2C(=O)N2CC=C(c3c[nH]c4ccccc34)CC2)cc1[N+](=O)[O-] 26690484 ABJMODGOZYBXEO-UHFFFAOYSA-N 494.551 5.303 5 20 JKBD CCOc1cc([N+](=O)[O-])c(C(=O)Nc2nc(-c3ccc(C(C)(C)C)cc3)cs2)cc1OC 45452437 WSQNPJAENATJLU-UHFFFAOYSA-N 455.536 5.675 5 20 JKBD Cn1ccnc1Sc1ccc(F)cc1NC(=O)CSc1ccc(C(F)(F)F)cc1[N+](=O)[O-] 68822073 MVTBANGUTQCBIR-UHFFFAOYSA-N 486.472 5.368 5 20 JKBD COc1ccc(-c2noc(CCCC(=O)Nc3nc(-c4cccc([N+](=O)[O-])c4)c(C)s3)n2)cc1 195704317 BAHJOOCQPRWKBU-UHFFFAOYSA-N 479.518 5.047 5 20 JKBD CCOc1cc([N+](=O)[O-])c(C(=O)N(C)Cc2cn(-c3ccccc3)nc2-c2cccs2)cc1OC 248117051 LUSJBDWONJRZLI-UHFFFAOYSA-N 492.557 5.189 5 20 JKBD COc1cc(C(=O)N[C@@H](C)c2ccc(NC(N)=O)cc2)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 480314988 GRESDEHEFBOBCC-ZDUSSCGKSA-N 484.896 5.031 5 20 JKBD O=C(C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)NCCOC1CCCC1 489009559 YSRRANKFYNBXJI-SDXDJHTJSA-N 451.548 5.211 5 20 JKBD CC[C@@H](C(=O)N1CCC(NC(=O)c2ccc(Nc3ccccc3)c([N+](=O)[O-])c2)CC1)c1ccccc1 502046611 TUBOLHHPGKZTNL-XMMPIXPASA-N 486.572 5.253 5 20 JKBD C[C@H]1Cc2cc([N+](=O)[O-])ccc2N1C(=O)c1ccc2c(c1)C(=O)N(c1ccc(Cl)c(Cl)c1)C2=O 504334025 GMVVATXSTXQAAK-LBPRGKRZSA-N 496.306 5.294 5 20 JKBD Cc1nnc(SCc2c(C(=O)N3c4ccc([N+](=O)[O-])cc4C[C@H]3C)oc3ccccc23)s1 504371530 OJDKAYDTYHNHBI-GFCCVEGCSA-N 466.544 5.385 5 20 JKBD C[C@@H](Nc1ccc(NC(=O)c2ccc([N+](=O)[O-])cc2I)cc1)c1ccccc1 511677566 NCVAKIRGYZXHCW-CQSZACIVSA-N 487.297 5.625 5 20 JKBD O=C(Cc1csc(COc2ccc(Cl)cc2)n1)Nc1cc([N+](=O)[O-])ccc1OC(F)F 515096687 TURWWGYIZNLIGS-UHFFFAOYSA-N 469.853 5.066 5 20 JKBD CC(=O)Nc1cc(NC(=O)c2ccc(Sc3ccc(C)cc3)c([N+](=O)[O-])c2)ccc1Cl 516370564 JWXUGIKGYFXZQN-UHFFFAOYSA-N 455.923 5.919 5 20 JKBD COc1cc(C(=O)N[C@H](c2ccc(F)cc2)c2cccs2)c([N+](=O)[O-])cc1OCc1cscn1 517759740 FXOMJCVOKDCDIG-JOCHJYFZSA-N 499.545 5.359 5 20 JKBD O=[N+]([O-])c1ccc(-c2ccc(CNCc3ccc(N4CCCCCC4)nc3)o2)c(Br)c1 518765556 LUSNWSIJEJJDGZ-UHFFFAOYSA-N 485.382 5.683 5 20 JKBD O=[N+]([O-])c1ccc(-c2ccc(CNCc3ccc(Oc4cccnc4)c(F)c3)o2)c(Br)c1 518780065 CILMOHYMOYLIKM-UHFFFAOYSA-N 498.308 6.234 5 20 JKBD CN(Cc1ccccc1[N+](=O)[O-])C(=O)C(=O)Nc1ccc(Oc2ccccc2C(F)(F)F)c(F)c1 518944968 IGIJAMJISRVURS-UHFFFAOYSA-N 491.397 5.142 5 20 JKBD COc1cc(C(=O)Nc2ccc3nc(-c4ccccc4Cl)[nH]c3c2)c([N+](=O)[O-])cc1OC(F)F 521202337 VDGUULTZAOKBPL-UHFFFAOYSA-N 488.834 5.654 5 20 JKBD Cc1ccc(Cc2cnc(NC(=O)c3cc(OCC(F)(F)F)ccc3[N+](=O)[O-])s2)cc1F 603738680 GIXGLBSDJVGHBT-UHFFFAOYSA-N 469.416 5.283 5 20 JKBD CCOC(=O)c1sc(-c2cccc([N+](=O)[O-])c2)cc1NC(=O)c1ccc(NC(C)=O)c(SC)c1 603776494 SWLFIDFUGVNFQN-UHFFFAOYSA-N 499.570 5.433 5 20 JKBD Cc1noc(-c2ccc(C)c(NC(=O)c3cc([N+](=O)[O-])ccc3Sc3ccc(Cl)cc3)c2)n1 603987243 IDOIXEJYRNQSAW-UHFFFAOYSA-N 480.933 6.319 5 20 JKBD CC(C)N(Cc1ccccn1)C(=O)c1ccc(Sc2nc3ccccc3s2)c([N+](=O)[O-])c1 603990023 GFXUFXDGWHSZLD-UHFFFAOYSA-N 464.572 5.802 5 20 JKBD C[C@@H](NCc1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1)c1cccc(N2CCCC2=O)c1 608836604 XRRKXWJTTAOUHW-HXUWFJFHSA-N 481.556 5.425 5 20 JKBD Cc1nc(-c2ccccc2)sc1CNC(=O)CSc1ccc(C(F)(F)F)cc1[N+](=O)[O-] 608954477 PGXAPSKDUROSQP-UHFFFAOYSA-N 467.494 5.454 5 20 JKBD COc1ccc(NC(=O)c2ccn(-c3ccc([N+](=O)[O-])cc3)n2)cc1OCc1ccc2ccccc2n1 609066124 JEUWUUACZOHJMC-UHFFFAOYSA-N 495.495 5.169 5 20 JKBD Cc1nn(Cc2ccc(C(=O)Nc3ccc4c(c3)CCN4C(=O)OC(C)(C)C)cc2)c(C)c1[N+](=O)[O-] 726510562 BUIMBFQAMKMMFT-UHFFFAOYSA-N 491.548 5.006 5 20 JKBD Cc1c(C(=O)Nc2ccc(N3C[C@H](C)O[C@H](C)C3)c(C(F)(F)F)c2)cc([N+](=O)[O-])c(C)c1[N+](=O)[O-] 728013616 ZVFYNIKGKQKSCV-TXEJJXNPSA-N 496.442 5.005 5 20 JKBD CCc1cc[n+](/C(C(=S)Nc2c(Cl)ccc(C)c2Cl)=C(/O)c2cccc([N+](=O)[O-])c2)cc1 728559080 XJBBAXYBNFNFLA-UHFFFAOYSA-O 489.404 6.383 5 20 JKBD C[C@@H](OC(=O)Cc1csc(-c2ccc(Cl)cc2Cl)n1)C(=O)Nc1ccccc1[N+](=O)[O-] 747258047 FTYXRFHXIKUKEL-LLVKDONJSA-N 480.329 5.138 5 20 JKBD CN(CCCCCc1cc(-c2ccccc2)no1)C(=O)c1cc([N+](=O)[O-])ccc1Br 751193064 AZGSSIBBNNJLMA-UHFFFAOYSA-N 472.339 5.497 5 20 JKBD Cc1cccc(-c2nnc(-c3ccc(C(=O)O[C@H](C)c4nnc(-c5ccc([N+](=O)[O-])cc5)o4)cc3)o2)c1 904168608 ICTZDLJRNHAAAH-MRXNPFEDSA-N 497.467 5.588 5 20 JKBD COc1ccc(Oc2ccc([N+](=O)[O-])cc2C(=O)O[C@@H](C)C(=O)Nc2cccc(C)c2C)cc1 915249636 MIPUPKXBEVKLCM-KRWDZBQOSA-N 464.474 5.197 5 20 JKBD CCOc1ccc(N[C@@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Br)c2ccccc2)cc1F 917941905 XMCFIWXGMOYBRY-OAQYLSRUSA-N 488.313 5.687 5 20 JKBD O=C(Cn1ccc2ccc([N+](=O)[O-])cc21)Nc1ccc(C2(NC(=O)CCC3CCC3)CCC2)cc1 1786275287 BFFJPAIPNAHWOB-UHFFFAOYSA-N 474.561 5.264 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)c3cccc([N+](=O)[O-])c3Br)CCC2)cc1)c1ccco1 1787271536 YEWXSXAODQBWCX-UHFFFAOYSA-N 484.306 5.012 5 20 JKBD Cc1c(C(=O)NC2(c3ccc(NC(=O)c4ccccn4)cc3)CCC2)cc(Cl)cc1[N+](=O)[O-] 1787297248 WFFFFEQMXRLHNX-UHFFFAOYSA-N 464.909 5.013 5 20 JKBD Cc1ccoc1C(=O)Nc1ccc(C2(NC(=O)c3ccc(Br)c([N+](=O)[O-])c3)CCC2)cc1 1788693220 VOUMGJRKAXVQHG-UHFFFAOYSA-N 498.333 5.320 5 20 JKBD Cc1c[nH]cc1C(=O)NC1(c2ccc(NC(=O)c3cccc([N+](=O)[O-])c3Br)cc2)CCC1 1790636824 UBENCRXPMMLGFZ-UHFFFAOYSA-N 497.349 5.055 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)[C@@H]3C[C@H]3C3CC3)CCC2)cc1)c1cc(Br)ccc1[N+](=O)[O-] 1790663927 MNWHALXYSRURJT-RBUKOAKNSA-N 498.377 5.151 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)c3cc4ccccc4o3)CCC2)cc1)c1cc(F)cc([N+](=O)[O-])c1 1790696411 CAQDZZCJGNOLQU-UHFFFAOYSA-N 473.460 5.542 5 20 JKBD C/C(=C\c1cccs1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CCCc1cc(C)c(F)cc1[N+](=O)[O-])C2 1792530560 UMLCGBADPNNLET-ZLSWTBEJSA-N 499.608 5.168 5 20 JKBD O=C(/C=C/c1ccc([N+](=O)[O-])o1)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)C1(c3cccc(Cl)c3)CCCC1)C2 1793277786 UMCXGPVLDBTZHN-XIGVJBFMSA-N 497.979 5.005 5 20 JKBD CC(C)(C)CC(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)CC1 1826337875 IEFKNWACCQZWHW-HXUWFJFHSA-N 471.623 5.479 5 20 JKBD C[C@@H]1CCC[C@@H]1C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)CC1 1828485972 DZGRXZSJROHZCA-WTNAPCKOSA-N 483.634 5.479 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)N1CCC([C@H]2CCCCN2C(=O)CCc2ccc(F)cc2)CC1 1831689968 BJCRPNKEFYNGDX-XMMPIXPASA-N 499.558 5.048 5 20 JKBD O=C(c1ccc([N+](=O)[O-])cc1F)N1CCC([C@H]2CCCCN2C(=O)c2ccccc2C2CC2)CC1 1832556209 UWEDBIIVSPCAAU-RUZDIDTESA-N 479.552 5.158 5 20 JKBD COc1cc(C(=O)Nc2nc(-c3ccc(F)cc3)c(C)s2)c([N+](=O)[O-])cc1OC(F)F 10963717 ZROXJSSYNAEIGS-UHFFFAOYSA-N 453.398 5.028 5 20 JKBD CC(=O)N(c1nc(COC(=O)CCNc2ccccc2[N+](=O)[O-])cs1)c1c(C)cc(C)cc1C 11315318 QWWSVWGRUYOVBI-UHFFFAOYSA-N 482.562 5.207 5 20 JKBD CC(C)N(C)S(=O)(=O)c1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2Sc2ccccc2)cc1 14425066 YDYCCXJYAGOTDP-UHFFFAOYSA-N 485.587 5.027 5 20 JKBD CC[C@@H](C)c1ccc([C@H](NC(=O)CSc2ccc(C(N)=O)cc2[N+](=O)[O-])c2cccs2)cc1 15616425 HCVSSPGIPRBEKL-CMJOXMDJSA-N 483.615 5.267 5 20 JKBD Cc1ccc(NC(=O)[C@H](C)OC(=O)c2ccccc2C(=O)c2ccc(Cl)c([N+](=O)[O-])c2)cc1F 15710283 POFUJSHTSDOFSR-AWEZNQCLSA-N 484.867 5.111 5 20 JKBD Cc1cccc(-n2ccnc2S[C@@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2C(F)(F)F)c1 23083098 IAMCMCHCXZXQRL-ZDUSSCGKSA-N 450.442 5.227 5 20 JKBD O=C(Cc1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1)Nc1ccc2oc(C3CC3)nc2c1 33214503 INVXMRZCGYIUCT-UHFFFAOYSA-N 479.496 5.647 5 20 JKBD COc1ccc(C(=O)Nc2ccccc2C(=O)Nc2cccc(C(F)(F)F)c2)cc1[N+](=O)[O-] 72039037 RFABKULPTBRFIV-UHFFFAOYSA-N 459.380 5.127 5 20 JKBD COc1cc(C(=O)Nc2ccccc2C(=O)N2CCCC2)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 115251574 IBGBXYPHGFUKHV-UHFFFAOYSA-N 495.919 5.537 5 20 JKBD C[C@H](Nc1ccc(C(=O)N[C@H]2C[C@@H]2c2ccccc2C(F)(F)F)cc1[N+](=O)[O-])c1ccccn1 116554202 DDFIQUALOYVRPR-OXTHUFEASA-N 470.451 5.468 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)N[C@H](c2ccccc2)c2ccc3c(c2)CCCO3)cc1SC 410043107 PYVNTKZZLVFWQF-XMMPIXPASA-N 464.543 5.170 5 20 JKBD COc1ccc(Oc2ccc([N+](=O)[O-])cc2C(=O)N(C)CCCc2cc(-c3ccccc3)n[nH]2)cc1 486651780 MUFBAINYXHCOKF-UHFFFAOYSA-N 486.528 5.491 5 20 JKBD C[C@H](c1cc(F)ccc1F)N(C)C(=O)Cc1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1 498564953 WUFKVLHGUMFSEL-QGZVFWFLSA-N 476.483 5.488 5 20 JKBD CC[C@H](C)Sc1ccc(NC(=O)c2cc(OC)c(OC)cc2[N+](=O)[O-])c(C(F)(F)F)c1 499581898 OYCXSKZDFDBWRZ-NSHDSACASA-N 458.458 5.774 5 20 JKBD Cc1noc2nc(-c3ccc(F)cc3)cc(C(=O)Nc3cc([N+](=O)[O-])ccc3OC(F)F)c12 515216358 WDEMQDHRGCNGJW-UHFFFAOYSA-N 458.352 5.099 5 20 JKBD O=C(NCc1nnc2c(Cl)cc(C(F)(F)F)cn12)c1cc2ccccc2c2cccnc12 516503822 WWOFHFWMKQEMMT-UHFFFAOYSA-N 455.827 5.033 5 20 JKBD Cc1ccc(-c2nc(C)c([C@@H](C)Nc3cnn(-c4ccc([N+](=O)[O-])cc4)c(=O)c3Cl)s2)cc1 520754767 CZDKACMJOLNFOK-CQSZACIVSA-N 481.965 5.708 5 20 JKBD O=C(Nc1nc2cc(C(F)(F)F)ccc2n1Cc1ccco1)c1ccc(Cl)cc1[N+](=O)[O-] 524276970 XEHUQBQJORXLRF-UHFFFAOYSA-N 464.787 5.510 5 20 JKBD CCN1CCc2nc(NC(=O)c3cc([N+](=O)[O-])ccc3Sc3ccc(Cl)cc3)sc2C1 600200850 YUZIPGBOVLMMGJ-UHFFFAOYSA-N 474.995 5.486 5 20 JKBD O=C(COc1ccccc1[N+](=O)[O-])Nc1ccccc1OCc1ncc(-c2cccc(Cl)c2)o1 608850949 PEVCUWGASGIJTP-UHFFFAOYSA-N 479.876 5.500 5 20 JKBD COCCOc1ccc(F)cc1NC(=O)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1 608946149 RFHLOXBYZRCCJG-UHFFFAOYSA-N 460.845 5.457 5 20 JKBD O=C(Cc1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1)Nc1cc(F)ccc1Cl 609065444 BPYJPLMOFWQNOH-UHFFFAOYSA-N 450.857 5.421 5 20 JKBD CC(=O)N(c1ccc(F)cc1)c1nc(CSc2nc3ccccc3c3nc4ccccc4n23)cs1 614501172 ZLDBOODEELAMLS-UHFFFAOYSA-N 499.596 6.608 5 20 JKBD C[C@H](OC(=O)c1ccc(Oc2ccc(Cl)cc2)c(N)c1)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 727529423 NWNWOXIVMUODEH-ZDUSSCGKSA-N 480.864 5.591 5 20 JKBD Cn1ccnc1[C@H](NC(=O)CCC(=O)c1ccc2ccc3cccc4ccc1c2c34)c1ccccc1 727753712 PLHPIDDIXQZTQN-SSEXGKCCSA-N 471.560 6.186 5 20 JKBD Cc1nc(-c2ccc(Cl)cc2)sc1C(=O)N(Cc1nnc(-c2cccc([N+](=O)[O-])c2)o1)C(C)C 728083944 ZZPMUHIUPJEANL-UHFFFAOYSA-N 497.964 5.781 5 20 JKBD CS(=O)(=O)c1ccc(-c2nc(CSc3nc4ccc([N+](=O)[O-])cc4s3)cs2)cc1 728176728 YVFRWTWOLMKUSR-UHFFFAOYSA-N 463.587 5.024 5 20 JKBD O=C(OCc1c(F)cccc1[N+](=O)[O-])c1cnn(-c2ncc(C(F)(F)F)cc2Cl)c1C(F)F 731102538 PISZLHAJGCKTOA-UHFFFAOYSA-N 494.735 5.281 5 20 JKBD O=C(C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)NC[C@@H]1COc2ccccc2C1 747586673 HVPPEMTTZLBKRI-UOIFGXKSSA-N 485.565 5.503 5 20 JKBD COc1cccc(CC(=O)N2CCc3ccc(NCc4ccc(Cl)cc4[N+](=O)[O-])cc32)c1 864010009 GYSRSGVQMJVILE-UHFFFAOYSA-N 451.910 5.001 5 20 JKBD CCCN(C(=O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1)c1nc(-c2ccc(Cl)cc2Cl)cs1 906477785 JANLVLLEMLLYLF-UHFFFAOYSA-N 481.317 5.990 5 20 JKBD COc1cc(/C=C\C(=O)Nc2cc([N+](=O)[O-])c(C)cc2C)ccc1OCc1c(C)noc1C 913416510 HCLQIQRLOWNFGZ-CLFYSBASSA-N 451.479 5.056 5 20 JKBD COc1ccc(/C=C2\N=C(SCc3cc(F)ccc3[N+](=O)[O-])N(c3cccc(OC)c3)C2=O)cc1 915791617 RYFFCQUGCQABOQ-UUYOSTAYSA-N 493.516 5.428 5 20 JKBD CC1=NN(c2ccc(C(=O)Oc3ccc(NC(=O)c4cc([N+](=O)[O-])ccc4Cl)cc3)cc2)CC1 915810554 ARFDUVPOTLXMBA-UHFFFAOYSA-N 478.892 5.306 5 20 JKBD CC(C)N(Cc1nnc(-c2cccc([N+](=O)[O-])c2)o1)C(=O)CCCOc1cccc2ccccc12 915823081 CXVWOBVAYQPFPL-UHFFFAOYSA-N 474.517 5.394 5 20 JKBD CN(CCCCNC(=O)c1ccccc1NC(=O)c1ccc([N+](=O)[O-])cc1Cl)c1ccccc1 919855837 ZAVASXZTUPFDTK-UHFFFAOYSA-N 480.952 5.147 5 20 JKBD O=C(Nc1ccc(OC(=O)c2csc(-c3ccccc3F)n2)cc1)c1cccc([N+](=O)[O-])c1 920735379 IUEDNFXABLHPMT-UHFFFAOYSA-N 463.446 5.329 5 20 JKBD C[C@@H](C(=O)NC1(c2ccc(NC(=O)c3ccc([N+](=O)[O-])o3)cc2)CCC1)c1ccc(Cl)cc1 1785748770 PWBMBWDQLVUCFJ-OAHLLOKOSA-N 467.909 5.393 5 20 JKBD O=C(Cc1ccc(Cl)cc1[N+](=O)[O-])Nc1ccc(C2(NC(=O)C3=CCCC3)CCC2)cc1 1786116490 NWYKYGYAIMGSME-UHFFFAOYSA-N 453.926 5.035 5 20 JKBD COc1cc(F)c(C(=O)Nc2ccc(C3(NC(=O)c4cccc(F)c4[N+](=O)[O-])CCC3)cc2)c(F)c1 1790677073 XZGZXZKBQYXIDZ-UHFFFAOYSA-N 499.445 5.082 5 20 JKBD O=C(NC1(c2ccc(NC(=O)c3cccc(F)c3[N+](=O)[O-])cc2)CCC1)c1ccnc(C(F)F)c1 1790697945 CNDPAGHADDTIMA-UHFFFAOYSA-N 484.434 5.128 5 20 JKBD COc1cc(C(=O)NC2(c3ccc(NC(=O)C[C@@H]4C[C@@H]5CC[C@H]4C5)cc3)CCC2)ccc1[N+](=O)[O-] 1791324033 NVRKHTDIVNXNQL-HBFSDRIKSA-N 477.561 5.177 5 20 JKBD Cc1c(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)[C@@H]2CCC[C@@H]4CCCC[C@@H]42)C3)cc(Cl)cc1[N+](=O)[O-] 1800712155 YAKOQGIQMMRCFH-BGOZWBLRSA-N 488.028 5.415 5 20 JKBD O=C(Nc1cc([C@H]2CCCCN2C(=O)/C=C/c2ccccc2[N+](=O)[O-])[nH]n1)c1cccc2ccoc12 1821543108 PHGSBUWHOCBXBF-VDZCTEQFSA-N 485.500 5.083 5 20 JKBD Cc1cc(CCCC(=O)N2CCC([C@@H]3CCCCN3C(=O)[C@H]3C[C@@H]3C3CC3)CC2)c([N+](=O)[O-])cc1F 1824066343 VKENPPOQRFMZDT-CUYJMHBOSA-N 499.627 5.031 5 20 JKBD CC1(C)CCC(CC(=O)N2CCCC[C@@H]2C2CCN(C(=O)/C=C/c3ccc([N+](=O)[O-])o3)CC2)CC1 1830421998 RBGDFLHRSCXGQR-AVAOGFIGSA-N 485.625 5.427 5 20 JKBD O=C(c1ccc2ccoc2c1)N1CCC([C@H]2CCCCN2C(=O)c2ccc([N+](=O)[O-])cc2F)CC1 1830499332 SNNOTTJCLUNMFR-HSZRJFAPSA-N 479.508 5.027 5 20 JKBD Cc1ccc(CC(=O)N2CCC([C@H]3CCCCN3C(=O)c3ccc(C4CC4)cc3)CC2)cc1[N+](=O)[O-] 1830749855 JWCGVTHOOZNTOM-AREMUKBSSA-N 489.616 5.257 5 20 JKBD Cc1ccc([C@@H](C)C(=O)N2CCCC[C@@H]2C2CCN(C(=O)Cc3cc([N+](=O)[O-])ccc3F)CC2)cc1 1831525653 VLFPAIOOTFFUGM-FQRUVTKNSA-N 495.595 5.008 5 20 JKBD O=C(O[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1)c1ccc2ncsc2c1 8937362 SGRPJESSDRNETJ-HXUWFJFHSA-N 467.890 5.395 5 20 JKBD Cc1csc(SCc2ccccc2C(=O)OCC(=O)Nc2cc([N+](=O)[O-])ccc2Cl)n1 9623700 NPRPPFCXCWPRFS-UHFFFAOYSA-N 477.951 5.101 5 20 JKBD CC(=O)N(c1cccc(Cl)c1)c1nc(COC(=O)/C=C/c2ccc([N+](=O)[O-])cc2)cs1 10757941 FSSPGQBZEFGTMG-JXMROGBWSA-N 457.895 5.146 5 20 JKBD Cc1ccc(NC(=O)COC(=O)c2ccccc2C(=O)c2ccc(Cl)c([N+](=O)[O-])c2)c(Cl)c1 11029352 ZSUOBYNTZOZCDM-UHFFFAOYSA-N 487.295 5.237 5 20 JKBD C[C@H](Sc1nnc(NCc2ccccc2)s1)C(=O)Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1 11408355 GIPGMYKEGHWDNX-ZDUSSCGKSA-N 498.615 5.301 5 20 JKBD O=C(Cc1csc(-c2cccs2)n1)Oc1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2Cl)cc1 15516101 OSOLKQQAALJPLC-UHFFFAOYSA-N 499.957 5.834 5 20 JKBD O=C(CSc1ccc(C(F)(F)F)cc1[N+](=O)[O-])Nc1ccc(Br)cc1F 15582913 HFTDIBGVYQUDRR-UHFFFAOYSA-N 453.211 5.246 5 20 JKBD Cc1noc(C)c1CSc1ccccc1C(=O)O[C@@H](C)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 17665081 DCCNETMXTSLIHC-HNNXBMFYSA-N 480.502 5.460 5 20 JKBD O=C(OCc1nnc(-c2ccc([N+](=O)[O-])cc2)o1)c1oc2ccccc2c1COc1ccccc1 21175332 RKZLEELEIKROAE-UHFFFAOYSA-N 471.425 5.327 5 20 JKBD O=[N+]([O-])c1cc(S(=O)(=O)N(Cc2cc(-c3ccccc3)on2)c2ccccc2)ccc1Cl 21585299 FGSLZVJBGLZYSC-UHFFFAOYSA-N 469.906 5.299 5 20 JKBD CN(C(=O)CSc1nnc(-c2ccccc2Cl)n1C1CCCC1)c1ccc([N+](=O)[O-])cc1 22060886 IFBGJYCNUYHZKY-UHFFFAOYSA-N 471.970 5.377 5 20 JKBD Cc1c(NC(=O)[C@@H](C)OC(=O)[C@H](Sc2ccccc2)c2ccccc2)cccc1[N+](=O)[O-] 23202241 MBVGCFVZCNRUDK-VGOFRKELSA-N 450.516 5.307 5 20 JKBD COc1ccc([N+](=O)[O-])cc1NC(=O)[C@@H](C)OC(=O)c1ccc(CSc2ccccc2)cc1 23876831 CCFTWJXUMLAICZ-MRXNPFEDSA-N 466.515 5.080 5 20 JKBD Cc1nn(Cc2ccc(C(=O)OCc3ncc(-c4cccc(Cl)c4)o3)cc2)c(C)c1[N+](=O)[O-] 26160565 VHWIMCUQKZDECB-UHFFFAOYSA-N 466.881 5.122 5 20 JKBD O=C1CCc2cc(N[C@H](C(=O)Nc3ccc([N+](=O)[O-])cc3Br)c3ccccc3)ccc2N1 27017330 VZWCBZWZGWAZHA-QFIPXVFZSA-N 495.333 5.034 5 20 JKBD O=C(CSc1ccccc1)O[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1 28801406 AVXTYRAEEXTLDJ-OAQYLSRUSA-N 456.907 5.264 5 20 JKBD CC(=O)Nc1cccc(CNC(=O)C/C(=C/c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)c1 32360856 YRDWSFCHCNLHIN-MOSHPQCFSA-N 486.553 5.410 5 20 JKBD COCCOc1cc([N+](=O)[O-])c(C(=O)Nc2ccccc2-c2nc3ccccc3s2)cc1OC 105339872 UTIFFYWUAXCMIM-UHFFFAOYSA-N 479.514 5.158 5 20 JKBD COc1cc(C(=O)N(C[C@@H]2CCCO2)[C@H]2CCSC2)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 106000825 SSDGGHHCFRQYFU-ROUUACIJSA-N 492.981 5.176 5 20 JKBD COc1cc(C(=O)Nc2ccc(-c3nc(C)n[nH]3)cc2)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 109598834 ISODFTRCSGSWTB-UHFFFAOYSA-N 479.880 5.395 5 20 JKBD CCOc1cc(NC(=O)c2nc(-c3cccs3)n(-c3cccc(F)c3)n2)c([N+](=O)[O-])cc1OCC 478076306 CIBWIJMWRMYMBC-UHFFFAOYSA-N 497.508 5.093 5 20 JKBD O=C(C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)Nc1cccc(-c2cnco2)c1 489000060 IACQUMNVZVXANK-XDHOZWIPSA-N 482.521 6.429 5 20 JKBD CCOc1cc(/C=C(\c2ccncc2)c2ccc([N+](=O)[O-])cc2)ccc1OCC(=O)Nc1ccccc1 502180712 HYSZZRMZZROTPV-ITYLOYPMSA-N 495.535 5.995 5 20 JKBD COc1cc(C(=O)Nc2cccc(C(=O)NC(C)(C)C)c2)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 502197352 NHHBAVPYQGFFSC-UHFFFAOYSA-N 497.935 5.830 5 20 JKBD C[C@H]1C[C@H](C)CN(c2ccc(C(=O)Nc3ccccc3OCc3cscn3)cc2[N+](=O)[O-])C1 503493705 XGHYEFBIBRBCAM-IRXDYDNUSA-N 466.563 5.365 5 20 JKBD CCOc1ccc(Oc2ccc(C(F)(F)F)cc2NC(=O)c2cc([N+](=O)[O-])cnc2C)cc1 506721911 KEOSGPHIRJITPK-UHFFFAOYSA-N 461.396 5.760 5 20 JKBD CCN(C(=O)Nc1cccc([N+](=O)[O-])c1C)[C@H]1CCSc2ccc(Br)cc21 510066573 YVAPCEHVHYNWES-KRWDZBQOSA-N 450.358 5.757 5 20 JKBD CCOc1cc([N+](=O)[O-])c(C(=O)Nc2ccc(Oc3ccc(C)cc3OC)c(F)c2)cc1OC 510254047 JGDUICCBCDWSEW-UHFFFAOYSA-N 470.453 5.503 5 20 JKBD CCOc1ccc(C(=O)Nc2ccc(Cl)cc2C(=O)N2[C@@H](C)CCC[C@@H]2C)cc1[N+](=O)[O-] 512352460 MSSNPLJXLZQZHU-GJZGRUSLSA-N 459.930 5.302 5 20 JKBD COc1cccc(Oc2ccc(CNCc3ccc(Oc4ccc(F)cc4)c([N+](=O)[O-])c3)cn2)c1 512842331 XMNHUXQBDMZXLI-UHFFFAOYSA-N 475.476 6.012 5 20 JKBD CC(=O)Nc1cc(N[C@@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2ccccc2)ccc1Cl 516835770 SGUDGEMHFHHRQZ-OAQYLSRUSA-N 473.316 5.652 5 20 JKBD CC[C@H](C)NC(=O)c1ccc(NC(=O)c2ccc(N3C[C@@H](C)C[C@H](C)C3)c([N+](=O)[O-])c2)c(C)c1 520557692 FXAZQJKLDUGFDL-LNLFQRSKSA-N 466.582 5.166 5 20 JKBD Cc1ccccc1NC(=O)[C@@H]1CCc2ccccc2N1C(=O)c1csc(-c2cccc([N+](=O)[O-])c2)n1 524228636 SFTZKQGMODKEBL-DEOSSOPVSA-N 498.564 5.627 5 20 JKBD CCCN(CC(=O)Nc1ccc(Cl)cc1Cl)[C@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl 559805020 SITXQPOUVIJUTR-GFCCVEGCSA-N 487.771 5.233 5 20 JKBD Cc1csc(Sc2ccc(C(=O)N3C[C@@H](C(F)(F)F)C[C@@H](C(F)(F)F)C3)cc2[N+](=O)[O-])n1 604257544 GWRYKJJFZKKSEG-TXEJJXNPSA-N 499.458 5.714 5 20 JKBD Cc1nc(-c2ccc(NC(=O)c3ccc(N[C@H](C)c4ccccn4)c([N+](=O)[O-])c3)cc2)oc1C 604310739 ZGDIURJLUMJXMV-MRXNPFEDSA-N 457.490 5.687 5 20 JKBD CCOc1cc([N+](=O)[O-])c(C(=O)Nc2nc(C3CC3)c(Cc3ccc(F)cc3)s2)cc1OC 608901763 CVZGRBUYHYUILI-UHFFFAOYSA-N 471.510 5.318 5 20 JKBD O=C(c1ccc(NCc2ccccc2)c([N+](=O)[O-])c1)N1CCO[C@H](c2ccc(F)c(Cl)c2)C1 608963640 VEGALLKFBHJSKK-QHCPKHFHSA-N 469.900 5.213 5 20 JKBD COc1ccc(Sc2ccc(NC(=O)c3ccc(Sc4nncn4C)c([N+](=O)[O-])c3)cc2)cc1 609103470 DAWZDNFNCDWNDJ-UHFFFAOYSA-N 493.570 5.287 5 20 JKBD COc1ccc(Cl)cc1NCC(=O)Oc1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2Cl)cc1 727100667 WMUSNZHFBFPWHW-UHFFFAOYSA-N 490.299 5.180 5 20 JKBD COc1ccc(Br)cc1[C@@H]1CCCN1C(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1 750682321 CODCXJMNEXGRTM-HNNXBMFYSA-N 454.708 5.388 5 20 JKBD CCn1c(S[C@H](C)C(=O)Nc2ccc(N3CCCC3)cc2)nc2cc3ccccc3cc2c1=O 857311140 OQCLHDONNTURPM-GOSISDBHSA-N 472.614 5.289 5 20 JKBD COc1ccc(-c2noc(C/C(=C\c3ccc([N+](=O)[O-])cc3)c3nc4ccccc4s3)n2)cn1 904529858 HPMXNLNCURNTGM-SFQUDFHCSA-N 471.498 5.441 5 20 JKBD Cc1ccc(/C=C\S(=O)(=O)Oc2ccc(NC(=O)c3cc([N+](=O)[O-])ccc3Cl)cc2)cc1 917868626 VTZOQWCNDYSSHD-SEYXRHQNSA-N 472.906 5.188 5 20 JKBD Cc1nn(-c2ccccc2)c2ncc(C(=O)Nc3nc(-c4cccc([N+](=O)[O-])c4)cs3)cc12 918541669 NHERNISCPUXXTE-UHFFFAOYSA-N 456.487 5.013 5 20 JKBD C[C@@H](OC(=O)c1cc2c(Cl)c(Cl)ccc2[nH]1)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 919203834 DZPZVGNQMXJSJN-MRVPVSSYSA-N 490.221 5.586 5 20 JKBD C[C@H](Oc1ccc(Cl)c(Cl)c1)C(=O)O[C@H](C)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 919442761 FKXNJLGBXGMARI-MNOVXSKESA-N 452.250 5.023 5 20 JKBD C[C@@H](Nc1ccc(C(=O)Oc2ccccc2C(=O)N2CCCCC2)cc1[N+](=O)[O-])c1ccccn1 920109231 ZCKMTKQLVYPMNS-GOSISDBHSA-N 474.517 5.008 5 20 JKBD Cc1c(F)cccc1C(=O)N1CCCC2(CCN(C(=O)c3cc4cc([N+](=O)[O-])ccc4s3)CC2)C1 1805117388 VMDFCGFFLAJZLR-UHFFFAOYSA-N 495.576 5.416 5 20 JKBD O=C(c1cccc(F)c1[N+](=O)[O-])N1CCC2(CCCN(C(=O)C3(c4ccccc4)CCCC3)C2)CC1 1805240222 GRGQFVLYCOWMEN-UHFFFAOYSA-N 493.579 5.091 5 20 JKBD CC(C)[C@@H](C(=O)Nc1cc([C@@H]2CCCCN2C(=O)/C=C/c2ccc([N+](=O)[O-])o2)[nH]n1)c1ccccc1 1814928140 BRZJAUZESZCRSH-UZHFMHAUSA-N 491.548 5.056 5 20 JKBD Cc1ccc(CC(=O)N2CCCC[C@@H]2c2cc(NC(=O)c3ccc(C4CC4)cc3)n[nH]2)cc1[N+](=O)[O-] 1821307041 NJHVCRCHIKXYNM-HSZRJFAPSA-N 487.560 5.052 5 20 JKBD O=C(N1CCCC[C@@H]1C1CCN(C(=O)C2(c3cccc([N+](=O)[O-])c3)CCC2)CC1)C1(F)CCCCC1 1828411731 KYKRQILTXYRSHW-XMMPIXPASA-N 499.627 5.309 5 20 JKBD Cc1ccc(CC(=O)N2CCCC[C@H]2C2CCN(C(=O)c3ccccc3C3CC3)CC2)cc1[N+](=O)[O-] 1830365018 YCIKKROLTYZSGG-SANMLTNESA-N 489.616 5.257 5 20 JKBD COc1ccc(Cc2nnc(S[C@H](C(=O)Nc3ccc(C)cc3[N+](=O)[O-])c3ccccc3)o2)cc1 11648375 RDFBLZMLHFBHDI-QHCPKHFHSA-N 490.541 5.358 5 20 JKBD C[C@H](OC(=O)CCc1ncc(-c2ccc(Cl)cc2Cl)o1)C(=O)Nc1ccc([N+](=O)[O-])cc1 12272313 ZPSGGADBXAOMMP-LBPRGKRZSA-N 478.288 5.060 5 20 JKBD Cc1ccc(-c2nc(C(=O)Oc3ccc(NC(=O)c4cc([N+](=O)[O-])ccc4Cl)cc3)cs2)cc1 17344163 BZVGOXXJHLBQAC-UHFFFAOYSA-N 493.928 6.152 5 20 JKBD CCOc1cc([N+](=O)[O-])c(C(=O)O[C@@H](C(=O)Nc2cc(C)ccc2C)c2ccccc2)cc1OC 18969098 GNDIDOGPKCELHR-XMMPIXPASA-N 478.501 5.156 5 20 JKBD O=C(O[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1)c1csc(-c2cccs2)n1 19259553 GEXXCEVHTPCXEU-IBGZPJMESA-N 499.957 5.970 5 20 JKBD CCc1ccc(N(C(=O)CCNC(=O)c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)cc1 20935855 TYXZUTITWHGDNU-UHFFFAOYSA-N 474.542 5.252 5 20 JKBD O=C(CCSc1nnc(-c2ccccc2)n1-c1ccc(F)cc1)Nc1ccccc1[N+](=O)[O-] 26361563 UPOMDQAVXHSPCT-UHFFFAOYSA-N 463.494 5.103 5 20 JKBD Cc1noc(C)c1CSc1ccccc1C(=O)NCCNc1ccc(C(F)(F)F)cc1[N+](=O)[O-] 28024077 VIAJOPHYORQKFC-UHFFFAOYSA-N 494.495 5.353 5 20 JKBD Cc1ccsc1CN[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Br)c1ccccc1 28383752 AUFSARYNPJFRDW-LJQANCHMSA-N 460.353 5.197 5 20 JKBD O=C(c1n[nH]c2ccc([N+](=O)[O-])cc12)N(Cc1ccc(Cl)c(Cl)c1)Cc1ccccn1 72040574 IOOFEDSBWFZXOP-UHFFFAOYSA-N 456.289 5.016 5 20 JKBD COc1cc(C(=O)N2CCC[C@H](c3ccccc3)CC2)c([N+](=O)[O-])cc1OCc1cscn1 72092618 FLDMBYXGYGNWKS-SFHVURJKSA-N 467.547 5.049 5 20 JKBD COCCn1c(C)c(C)c2cc(C(=O)N(Cc3ccccc3[N+](=O)[O-])CC(F)(F)F)ccc21 482933641 RZVXIAVIIVXZDK-UHFFFAOYSA-N 463.456 5.017 5 20 JKBD CCCCCC(=O)NC1CCN(C(=O)c2cc([N+](=O)[O-])ccc2Sc2ccc(Cl)cc2)CC1 498492237 VAMYWUGGRDLMDF-UHFFFAOYSA-N 490.025 5.701 5 20 JKBD O=C(Cc1cccs1)Nc1ccccc1NC(=O)c1ccc(NCc2ccccc2)c([N+](=O)[O-])c1 500879538 DLGMJINZPSIMFS-UHFFFAOYSA-N 486.553 5.702 5 20 JKBD CCOC(=O)c1sc(-c2cccc([N+](=O)[O-])c2)cc1NC(=O)c1ccc(C(F)(F)F)nc1 505152258 KGXKSOFEXSOVBR-UHFFFAOYSA-N 465.409 5.166 5 20 JKBD Cc1ccc(C(C)C)c(Oc2ccc(CNCc3ccc(NS(C)(=O)=O)cc3)cc2[N+](=O)[O-])c1 507904246 PDOCQLCMLSDTFU-UHFFFAOYSA-N 483.590 5.480 5 20 JKBD COc1cc([C@H](C)NCc2ccc(N(C)c3ccccc3)c([N+](=O)[O-])c2)cc(OC)c1OC 508102757 MJTDUCCYANDNGK-KRWDZBQOSA-N 451.523 5.239 5 20 JKBD CC(C)c1nc(-c2ccccc2NC(=O)c2ccc(N[C@@H](C)c3ccccn3)c([N+](=O)[O-])c2)n[nH]1 509137980 LWUGQSMZBHJGLJ-INIZCTEOSA-N 471.521 5.324 5 20 JKBD COc1c(Cl)cccc1NC(=O)C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1 509693758 AZTUCDQFZQCGDZ-SSZFMOIBSA-N 479.945 6.436 5 20 JKBD CN(Cc1ccccc1N1CCCC1)C(=O)Cc1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1 512500898 AHIMXICPSNTDFM-UHFFFAOYSA-N 495.583 5.249 5 20 JKBD COCCc1ccc(Oc2ccc(NC(=O)c3ccn(-c4ccc([N+](=O)[O-])cc4)n3)cc2)cc1 518648380 BSHPABJPMWJXLF-UHFFFAOYSA-N 458.474 5.014 5 20 JKBD CCOc1cc([N+](=O)[O-])c(C(=O)N[C@@H](c2ccccc2)c2ccc(Br)cc2)cc1OC 518939873 KCBIPJYJSPTEKK-QFIPXVFZSA-N 485.334 5.284 5 20 JKBD Cc1nn(Cc2ccc(C(=O)N(C)c3ccc(Oc4ccccc4)cc3)cc2)c(C)c1[N+](=O)[O-] 519901354 OWBLRGDDWBEASN-UHFFFAOYSA-N 456.502 5.525 5 20 JKBD CN1CCC2(CC1)C[C@H](NC(=O)c1ccc(Nc3ccccc3)c([N+](=O)[O-])c1)c1ccccc1O2 520496280 YCORRXUDVSPHFR-QHCPKHFHSA-N 472.545 5.056 5 20 JKBD C[C@H](Nc1ccc(C(=O)Nc2ccnn2[C@H]2CCCc3ccccc32)cc1[N+](=O)[O-])c1ccccn1 522247201 KJQXEYQHGVKYGZ-UUOWRZLLSA-N 482.544 5.537 5 20 JKBD C[C@@H](Nc1ccc(C(=O)Nc2ccc(-c3n[nH]c(C4CC4)n3)cc2)cc1[N+](=O)[O-])c1ccccn1 523569294 QPTBBKSELCLKBI-OAHLLOKOSA-N 469.505 5.078 5 20 JKBD O=C(NCc1ccncc1)Nc1cccc(CNC(=O)c2cc3ccccc3c3cccnc23)c1 588819578 VAWHJAPANHNWRU-UHFFFAOYSA-N 461.525 5.035 5 20 JKBD CSc1nc(-c2ccc(F)cc2)nc(C)c1C(=O)Nc1nc(-c2ccc(C)c([N+](=O)[O-])c2)cs1 603752221 LAAVCPVGLLVKQT-UHFFFAOYSA-N 495.561 5.905 5 20 JKBD Cc1ccc(NC(=O)c2cccc(C(F)(F)F)c2)cc1NC(=O)Cc1ccc([N+](=O)[O-])cc1 604449415 WXDBZMVJZQIXTP-UHFFFAOYSA-N 457.408 5.356 5 20 JKBD O=[N+]([O-])c1ccccc1-c1ccc(CNC2C[C@H](C(F)(F)F)C[C@@H](C(F)(F)F)C2)s1 608835871 REXAAUSXNMXIPJ-VXGBXAGGSA-N 452.420 6.322 5 20 JKBD Cc1ccc(NC(=O)c2ccc(N3CCC(C(=O)Nc4ccc(Cl)cn4)CC3)c([N+](=O)[O-])c2)cc1 608972625 BMGMTBKPEJRTFO-UHFFFAOYSA-N 493.951 5.059 5 20 JKBD CSCCc1ccc(NC(=O)C2CCN(c3ccc(C(F)(F)F)cc3[N+](=O)[O-])CC2)cc1 609015428 WIQJSWUDFLXKFZ-UHFFFAOYSA-N 467.513 5.374 5 20 JKBD C[C@H](NC(=O)N[C@@H]1c2cc(Br)ccc2SC[C@@H]1C)c1cccc([N+](=O)[O-])c1 609199868 RQFHEMNVNPCWKJ-PZROIBLQSA-N 450.358 5.201 5 20 JKBD O=C(c1ccc(Sc2nc3ccccc3s2)c([N+](=O)[O-])c1)N1CCN(c2cccc(O)c2)CC1 610913394 WDQFGYXUKFHSHQ-UHFFFAOYSA-N 492.582 5.024 5 20 JKBD CC(=O)N(c1ccc(C)cc1)c1nc(COC(=O)c2cc([N+](=O)[O-])ccc2Br)cs1 725986045 RSIARPRLEHNRIG-UHFFFAOYSA-N 490.335 5.164 5 20 JKBD COC1CCN(c2ccc(NC(=O)Nc3ccc([N+](=O)[O-])cc3Cl)cc2C(F)(F)F)CC1 728066479 RRTKYZJNLKTCOA-UHFFFAOYSA-N 472.851 5.526 5 20 JKBD C[C@@H](OC(=O)c1cn(C(C)(C)C)nc1-c1ccccc1Cl)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 731089232 WOTCHKWGIVCKKC-CQSZACIVSA-N 495.923 5.835 5 20 JKBD CC(=O)c1cccc(O[C@H](C)C(=O)O[C@@H](C(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)c2ccccc2)c1 745230087 KJJVIGUVZWVRBK-WAIKUNEKSA-N 496.903 5.141 5 20 JKBD CCOc1ccc(-c2nc(COC(=O)c3csc(-c4ccc([N+](=O)[O-])cc4)n3)cs2)cc1 747640316 NDVBGCBOQPQNQC-UHFFFAOYSA-N 467.528 5.598 5 20 JKBD COc1ccc(NC(=O)[C@@H](OC(=O)c2csc(-c3cccc([N+](=O)[O-])c3)n2)c2ccccc2)cc1 747963584 WMIVYKRCAGAWNY-QFIPXVFZSA-N 489.509 5.264 5 20 JKBD COc1cc(C(=O)O[C@H](C)c2ccccc2NC(=O)c2ccccc2)c([N+](=O)[O-])cc1OC(F)F 748017951 COFIMBOAMKSENI-CQSZACIVSA-N 486.427 5.375 5 20 JKBD COC(=O)c1ccc(COC(=O)C/C(=C\c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)o1 748579047 JHBABFRVDDFLBR-FOWTUZBSSA-N 478.482 5.258 5 20 JKBD O=C(NC1CCCCC1)c1cc(NC(=O)c2cc([N+](=O)[O-])ccc2Br)ccc1Cl 751097320 WUIONVPIDFHXDP-UHFFFAOYSA-N 480.746 5.326 5 20 JKBD CC(C)Cn1cc([C@@H]2N(Cc3ccc(-c4ccccc4[N+](=O)[O-])s3)CC23CCOCC3)cn1 849479269 PAIDNVKVRHXHOQ-DEOSSOPVSA-N 466.607 5.530 5 20 JKBD CC(C)(C)OC(=O)NCc1ccc(-c2noc(-c3ccnc(-c4ccccc4)c3[N+](=O)[O-])n2)cc1 904718859 LRQGIBUENMRZGJ-UHFFFAOYSA-N 473.489 5.399 5 20 JKBD Cc1sc(NC(=O)c2cnc3c(c2)c(C)nn3-c2ccccc2)nc1-c1cccc([N+](=O)[O-])c1 917790525 IAEQVRGAMCPXIL-UHFFFAOYSA-N 470.514 5.321 5 20 JKBD O=C(Nc1ccccc1SCc1ccccc1)[C@H]1CC(=O)N(c2ccc(F)c([N+](=O)[O-])c2)C1 918556789 MEOZVACLGXYVEU-KRWDZBQOSA-N 465.506 5.018 5 20 JKBD COC(=O)c1cc2cc(NC(=O)c3ccccc3NC(=O)c3ccc([N+](=O)[O-])cc3Cl)ccc2o1 918591460 PINOCTHMVGNXAM-UHFFFAOYSA-N 493.859 5.286 5 20 JKBD CCc1ccc(N(C(C)=O)c2nc(COC(=O)c3cc4cc([N+](=O)[O-])ccc4o3)cs2)cc1 919212469 BIVLEFZEJSZZHE-UHFFFAOYSA-N 465.487 5.402 5 20 JKBD CCOC(=O)N(C)c1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2Oc2ccc(OC)cc2)cc1 919768425 CDRGTBBPGNALFP-UHFFFAOYSA-N 465.462 5.241 5 20 JKBD C[C@@H](OC(=O)c1ccc(N[C@H](C)c2ccccn2)c([N+](=O)[O-])c1)C(=O)Nc1cccc2ccccc12 920543658 HIQIUPGTUGPULC-QZTJIDSGSA-N 484.512 5.500 5 20 JKBD C[C@H](Nc1ccc(C(=O)O[C@@H](C)c2nnc(-c3cccs3)o2)cc1[N+](=O)[O-])c1ccccn1 920545236 HOCNLLKNHWUXAK-KBPBESRZSA-N 465.491 5.192 5 20 JKBD O=C(NC1(c2ccc(NC(=O)c3ccc([N+](=O)[O-])o3)cc2)CCC1)c1csc(-c2ccccc2)n1 1785748720 DCAYJTLDPQXMTK-UHFFFAOYSA-N 488.525 5.373 5 20 JKBD Cc1ccc(F)cc1C(=O)NC1(c2ccc(NC(=O)/C=C/c3ccc([N+](=O)[O-])o3)cc2)CCC1 1786205563 GMFIJHRZWOBVQI-PKNBQFBNSA-N 463.465 5.096 5 20 JKBD Cc1c(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)[C@H](C)c2ccc(Cl)cc2)C3)cc(Cl)cc1[N+](=O)[O-] 1800709172 PHDIPZICYPYLRN-NWTFUFRBSA-N 490.387 5.266 5 20 JKBD Cc1c(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)CC(C)(C)C)n[nH]2)cc(Cl)cc1[N+](=O)[O-] 1816760966 OMXWBBSEUYSMEA-QGZVFWFLSA-N 461.950 5.022 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cc3ccoc3s2)n[nH]1 1817827394 ZATXCCOZNGUPRO-KRWDZBQOSA-N 497.508 5.193 5 20 JKBD Cc1c(C(=O)N2CCC([C@H]3CCCCN3C(=O)c3ccoc3Cl)CC2)cc(Cl)cc1[N+](=O)[O-] 1829864078 UDYAHYCGZHLVSH-LJQANCHMSA-N 494.375 5.350 5 20 JKBD CC(C)=CCCC(=O)N1CCCC[C@@H]1C1CCN(C(=O)CSc2ccccc2[N+](=O)[O-])CC1 1830256695 WDGKWDYQJZJSPN-OAQYLSRUSA-N 473.639 5.053 5 20 JKBD CC(C)CCC(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cccc(Br)c2[N+](=O)[O-])CC1 1831382035 NVKLOIVWARYPQA-HXUWFJFHSA-N 494.430 5.027 5 20 JKBD CCC[C@@H](C(=O)N1CCC([C@H]2CCCCN2C(=O)/C=C/c2ccccc2[N+](=O)[O-])CC1)n1cccc1 1832906610 CZYUIKPFKVSZQO-YHXKCMJXSA-N 492.620 5.071 5 20 JKBD C[C@@H](c1nc(-c2cccc(C(F)(F)F)c2)no1)N1CCN(c2ccc([N+](=O)[O-])c3cnccc23)CC1 10428139 YYNHEXGABMOWMR-HNNXBMFYSA-N 498.465 5.095 5 20 JKBD O=C(COC(=O)c1ccccc1C(=O)c1ccc(Cl)c([N+](=O)[O-])c1)Nc1ccc2ccccc2c1 11029361 FDCVCTZSPRMHRN-UHFFFAOYSA-N 488.883 5.428 5 20 JKBD COc1ccc([N+](=O)[O-])cc1NC(=O)[C@@H](C)OC(=O)c1sc2cc(Cl)ccc2c1Cl 11397070 SWJVRZJDWCXSOJ-SECBINFHSA-N 469.302 5.309 5 20 JKBD C[C@H](OC(=O)c1ccccc1Cc1ccccc1)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 11399150 YUJSKMJAQGCWTO-HNNXBMFYSA-N 472.419 5.388 5 20 JKBD Cc1ccc(NC(=O)[C@@H](Sc2nnc(-c3ccc(F)cc3)o2)c2ccccc2)c([N+](=O)[O-])c1 12677809 HJGLCYYEMGIUSQ-FQEVSTJZSA-N 464.478 5.564 5 20 JKBD O=C1c2ccccc2N[C@H](c2cn(-c3ccccc3)nc2-c2ccc([N+](=O)[O-])cc2)N1C[C@H]1CCCO1 15503709 PLCXEUWOIHIJDM-AMGIVPHBSA-N 495.539 5.193 5 20 JKBD CCOc1ccc([C@@H](CNC(=S)Nc2ccc([N+](=O)[O-])cc2)c2c[nH]c3ccccc23)cc1OC 18169218 LYVASQNNHJQBNS-OAQYLSRUSA-N 490.585 5.602 5 20 JKBD C[C@@H](Sc1nnc(-c2cccc(Br)c2)o1)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl 21322341 DIQVKVQBBWNLGR-SECBINFHSA-N 483.731 5.180 5 20 JKBD O=[N+]([O-])c1ccc(-c2nnc(CSc3ncnc4cc(-c5ccc(F)cc5)sc34)o2)cc1 23950383 ZZJWGVHXXRIFGV-UHFFFAOYSA-N 465.491 5.748 5 20 JKBD COc1ccccc1CN(C)[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Br)c1ccccc1 32800060 RHFVAZDPZFMFMX-JOCHJYFZSA-N 484.350 5.178 5 20 JKBD O=C(CSc1nnc(-c2ccc(Cl)cc2)n1Cc1ccco1)Nc1ccc(F)c([N+](=O)[O-])c1 36801867 STZXIVMIKZXYJV-UHFFFAOYSA-N 487.900 5.018 5 20 JKBD C[C@H](Nc1ccc(C(=O)c2ccccc2)cc1[N+](=O)[O-])c1cc(F)ccc1N1CCC(O)CC1 78656491 DOBAPXJFSVORHI-KRWDZBQOSA-N 463.509 5.099 5 20 JKBD Cc1nc(-c2cccc(NC(=O)c3ccccc3C(=O)c3ccc(N(C)C)c([N+](=O)[O-])c3)c2)oc1C 108236699 RGHQFEXRGUXSLZ-UHFFFAOYSA-N 484.512 5.416 5 20 JKBD Cc1csc(Sc2ccc(C(=O)N3C[C@@H](C)O[C@H](c4ccccc4)C3)cc2[N+](=O)[O-])n1 109044822 REYZKKYYXRLTKI-BEFAXECRSA-N 455.561 5.113 5 20 JKBD Cc1ccc(CN(Cc2ccco2)C(=O)c2ccc(N[C@H](C)c3ccccn3)c([N+](=O)[O-])c2)s1 109202761 NBQZRVBWECDATC-GOSISDBHSA-N 476.558 5.968 5 20 JKBD C[C@H](Sc1ncc(-c2ccccc2)n1CC(F)(F)F)C(=O)Nc1ccccc1[N+](=O)[O-] 109623323 LWNMQUSWZFMKGK-ZDUSSCGKSA-N 450.442 5.140 5 20 JKBD O=C(N[C@H](c1ccccc1)c1ccc2c(c1)CCCO2)C1CCN(c2ccccc2[N+](=O)[O-])CC1 410049407 OHPHSLNOBRTLKB-HHHXNRCGSA-N 471.557 5.042 5 20 JKBD C[C@H](c1ccccc1F)N(C)C(=O)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 498326272 PIOVNTHNTMCIGW-CQSZACIVSA-N 453.436 5.189 5 20 JKBD C[C@@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)NCc1ccccc1-c1ccc(Cn2ccnc2)cc1 504770811 YEYCDTKJMAORJI-LJQANCHMSA-N 472.570 5.304 5 20 JKBD COc1cc(C(=O)N(Cc2ccccn2)C2CC2)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 508066972 GMHFJNKTUCMSNW-UHFFFAOYSA-N 453.882 5.249 5 20 JKBD O=C(c1cc([N+](=O)[O-])ccc1Sc1ccccc1)N1CCC(c2c[nH]c3ncccc23)CC1 509422401 RISJENQABZSWTL-UHFFFAOYSA-N 458.543 5.642 5 20 JKBD COc1cc(C(=O)Nc2ccc(C)c(C(F)(F)F)c2)c([N+](=O)[O-])cc1OCc1cscn1 509873639 YLOFHOABDAFUME-UHFFFAOYSA-N 467.425 5.218 5 20 JKBD CCc1sc(NC(=O)c2ccc([N+](=O)[O-])cc2I)nc1-c1ccccc1 512207319 QAZKNSMSXAKGGK-UHFFFAOYSA-N 479.299 5.138 5 20 JKBD COc1cc(C(=O)N(Cc2ccccc2)Cc2ccco2)c([N+](=O)[O-])cc1OCc1cscn1 512600108 PFFJHLWECNQDAA-UHFFFAOYSA-N 479.514 5.075 5 20 JKBD COc1cc([C@H](C)NC(=O)Cn2c3ccccc3c(=O)c3ccccc32)ccc1OC1CCCC1 515161814 HVYXGPHLVLEVIX-IBGZPJMESA-N 470.569 5.362 5 20 JKBD CN(CCCCCc1cc(-c2cccc(F)c2)no1)C(=O)c1c[nH]c2cc([N+](=O)[O-])ccc12 519885717 XKFKVQRRXAGLMT-UHFFFAOYSA-N 450.470 5.355 5 20 JKBD COc1cc(C(=O)Nc2ccccc2CCC(C)C)c([N+](=O)[O-])cc1OCc1cscn1 520080272 JQSRSVHVHSXCAJ-UHFFFAOYSA-N 455.536 5.480 5 20 JKBD COCCOc1c(Cl)cccc1NC(=O)c1cc([N+](=O)[O-])ccc1Sc1ccccc1 520678069 RGVXVKVIRQFESV-UHFFFAOYSA-N 458.923 5.677 5 20 JKBD Cc1cc(C(=O)N2CCCC[C@@H]2C)ccc1NC(=O)c1ccc(N2CCC[C@H](C)C2)c([N+](=O)[O-])c1 520680757 GQZKBBMMOCJEHE-ICSRJNTNSA-N 478.593 5.406 5 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471.516 5.159 5 20 JKBD C[C@@H](OC(=O)c1csc(-c2cccc([N+](=O)[O-])c2)n1)C(=O)Nc1ccccc1Cc1ccccc1 747962797 UIQADOAJHYZCBI-QGZVFWFLSA-N 487.537 5.493 5 20 JKBD O=C(OCC1CCN(c2ncccc2[N+](=O)[O-])CC1)[C@H]1CC=CC[C@H]1c1nc2ccccc2s1 749358645 MWNBXAXNSNJYHC-MOPGFXCFSA-N 478.574 5.109 5 20 JKBD Cc1nn(-c2ccccc2)c(C)c1NC(=O)[C@@H](C)OC(=O)c1ccc(Nc2ccccc2)c([N+](=O)[O-])c1 857340954 JUNPBIFCUCCETO-LJQANCHMSA-N 499.527 5.325 5 20 JKBD CC(C)(C)Cc1noc2nc(C3CC3)cc(C(=O)OCC(=O)Nc3ccc(Cl)cc3[N+](=O)[O-])c12 915578187 NBBNCKSWUHLFHS-UHFFFAOYSA-N 486.912 5.046 5 20 JKBD Cc1ccc(S(=O)(=O)Nc2ccc(NC(=S)Nc3cccc(Cl)c3C)cc2)cc1[N+](=O)[O-] 916120187 YAUSXSKHTCTGPD-UHFFFAOYSA-N 490.994 5.475 5 20 JKBD COc1c([N+](=O)[O-])cc(NCc2ccc(Oc3ccc(F)cc3)nc2)c([N+](=O)[O-])c1Br 917082078 KWHBNUFDRHCFON-UHFFFAOYSA-N 493.245 5.213 5 20 JKBD O=c1nc(/C(Cl)=C/c2csc([N+](=O)[O-])c2)[nH]c2c(Br)cc(Br)cc12 917143053 VHNQIQOSPZKKGJ-LAFDYMOFSA-N 491.548 5.155 5 20 JKBD Cc1ccc[n+](/C(C(=S)Nc2ccc3ccccc3c2)=C(/O)c2ccc(C)c([N+](=O)[O-])c2)c1 917611079 YMDCEIQYHHYDCB-UHFFFAOYSA-O 456.547 5.976 5 20 JKBD COC(=O)Nc1cccc(NC(=O)C/C(=C\c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)c1 917706486 OPYBBVQJEVKUPM-GHRIWEEISA-N 488.525 5.952 5 20 JKBD C[C@@H](Nc1ccc(C(=O)OCc2csc(Br)c2)cc1[N+](=O)[O-])c1ccccn1 920544382 LYOOEHJIKNYPNC-GFCCVEGCSA-N 462.325 5.344 5 20 JKBD Cc1nc(-c2ccc(Cl)s2)sc1C(=O)O[C@@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl 921106466 PHGFNLPXMBATPV-VIFPVBQESA-N 486.358 5.579 5 20 JKBD C[C@@H](OC(=O)CCCOc1cccc(Cl)c1Cl)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 921225256 QNELXAOTIQQKOD-GFCCVEGCSA-N 466.277 5.415 5 20 JKBD CSCC[C@@H](NC(=O)c1ccccc1Cl)C(=O)OCc1nc2ccccc2c2ccccc12 921249844 AGJXHGMNQCIFKD-HSZRJFAPSA-N 479.001 5.636 5 20 JKBD O=C(Cc1cccc([N+](=O)[O-])c1)Nc1ccc(C2(NC(=O)c3ccc4scnc4c3)CCC2)cc1 1785792346 XHMDWQKDSXNSMZ-UHFFFAOYSA-N 486.553 5.195 5 20 JKBD O=C(/C=C/c1ccc([N+](=O)[O-])o1)Nc1ccc(C2(NC(=O)c3cc4[nH]ccc4s3)CCC2)cc1 1786207406 JASJJHDBEISFES-SOFGYWHQSA-N 476.514 5.192 5 20 JKBD Cc1ccc(CCC(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cc4cc([N+](=O)[O-])ccc4s2)C3)s1 1794313278 XIJNROJUHPOBNU-BCDXTJNWSA-N 483.615 5.064 5 20 JKBD Cc1c(C(=O)NC[C@@H]2CCN(C(=O)[C@@]3(C)CC=CCC3)[C@@H]2c2cccnc2)cc(Cl)cc1[N+](=O)[O-] 1811797864 XBWNRDRPCHNABC-CNPGNWEMSA-N 496.995 5.018 5 20 JKBD C[C@H](C(=O)N1CCCC[C@H]1c1cc(NC(=O)/C=C/c2ccc([N+](=O)[O-])o2)n[nH]1)c1ccc(Cl)cc1 1814964883 QBLWMZLVSOEGDK-YSWJYSBWSA-N 497.939 5.074 5 20 JKBD Cc1c(C(=O)N2CCCC[C@H]2c2cc(NC(=O)CCC(C)C)n[nH]2)cc(Cl)cc1[N+](=O)[O-] 1821932764 MPXCPQMXZXXMKH-SFHVURJKSA-N 461.950 5.022 5 20 JKBD O=C(CC1CCCC1)N1CCC([C@@H]2CCCCN2C(=O)C2(c3cccc([N+](=O)[O-])c3)CCC2)CC1 1830292952 MXHPFWBELHBZFA-VWLOTQADSA-N 481.637 5.217 5 20 JKBD Cc1ccc(C(=O)N2CCC([C@@H]3CCCCN3C(=O)c3cc4cc([N+](=O)[O-])ccc4s3)CC2)o1 1831060283 QKRBAKDGAOCNIX-FQEVSTJZSA-N 481.574 5.258 5 20 JKBD CCC[C@H]1CC[C@H](C(=O)N2CCCC23CN(C(=O)c2cc4cc([N+](=O)[O-])ccc4s2)C3)CC1 1846077666 FIJHZJBTLICEGA-IYARVYRRSA-N 469.607 5.233 5 20 JKBD C[C@@H](OC(=O)c1cc2sc(Nc3ccccc3)nc2s1)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 10712368 LRVMRDUQJFKCFL-GFCCVEGCSA-N 493.526 5.978 5 20 JKBD Cc1ccc(NC(=O)[C@H](OC(=O)c2ccccc2Br)c2ccccc2)c([N+](=O)[O-])c1 11026288 ZOIFWRSGIJYLEX-HXUWFJFHSA-N 469.291 5.203 5 20 JKBD O=C1c2ccccc2N[C@@H](c2ccc(-c3ccc([N+](=O)[O-])cc3Cl)o2)N1C[C@@H]1CCCO1 15503650 MAFQAWYREHJBLF-OYHNWAKOSA-N 453.882 5.254 5 20 JKBD Cc1ccc(S(C)(=O)=O)cc1NC(=O)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1 15815920 IGSYMPZIZAQQCO-UHFFFAOYSA-N 460.895 5.005 5 20 JKBD Cc1cccc(NC(=O)c2ccccc2Sc2ccc(S(=O)(=O)N3CCCC3)cc2[N+](=O)[O-])c1 16028450 VEKUNMYFEQUZAR-UHFFFAOYSA-N 497.598 5.091 5 20 JKBD CC(=O)Nc1cccc(NC(=O)[C@H](C)OC(=O)c2ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])cc2)c1 23988977 IPCQTPIXKLDINN-AWEZNQCLSA-N 497.891 5.183 5 20 JKBD CCOCc1ccccc1CN[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1 26996465 COUJAIJEFYUWLB-HSZRJFAPSA-N 453.926 5.254 5 20 JKBD COc1cc(NC(=O)c2cc([N+](=O)[O-])ccc2NCc2ccccc2)ccc1NC(=O)c1cccnc1 33180437 HWAGDKLKCHGOTJ-UHFFFAOYSA-N 497.511 5.115 5 20 JKBD Cc1nn(Cc2ccc(C(=O)Nc3ccc(OCc4ccccc4)cc3)cc2)c(C)c1[N+](=O)[O-] 46551172 MRGDRTZUEOQWPP-UHFFFAOYSA-N 456.502 5.288 5 20 JKBD CCn1c(S[C@H](C(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)c2ccccc2)nnc1-c1ccncc1 104768798 OUIRMNSGBGOAET-FQEVSTJZSA-N 494.964 5.394 5 20 JKBD COc1ccc2c(C)c(CCC(=O)Nc3nc(-c4ccc(C)c([N+](=O)[O-])c4)cs3)c(=O)oc2c1 105356377 BXSFEKHVTFYYHF-UHFFFAOYSA-N 479.514 5.021 5 20 JKBD Cc1ccc(NC(=O)CSc2ccc(C(F)(F)F)cc2[N+](=O)[O-])c(OC[C@@H]2CCCO2)c1 108889307 SRQMDRHIFFYQPA-HNNXBMFYSA-N 470.469 5.211 5 20 JKBD Cc1ccc([N+](=O)[O-])cc1NC(=O)CNc1ccc(NC(=O)c2ccccc2)cc1C(F)(F)F 109097849 WFGYZCJGIRDIGR-UHFFFAOYSA-N 472.423 5.225 5 20 JKBD CCOc1ccc([C@@H](NC(=O)C2CCN(c3ccccc3[N+](=O)[O-])CC2)c2ccccc2)cc1 478257439 XXMHCJQOEFHZJB-SANMLTNESA-N 459.546 5.116 5 20 JKBD COc1cccc(OC)c1OC1CCN(C(=O)c2ccc(SCCC(C)C)c([N+](=O)[O-])c2)CC1 501897794 FASQMDMOXZBASZ-UHFFFAOYSA-N 488.606 5.434 5 20 JKBD O=C(Cc1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1)Nc1ccc2scnc2c1 505898361 IFQHYLODMLEDKN-UHFFFAOYSA-N 455.499 5.238 5 20 JKBD C[C@H](NC(=O)NCc1ccccc1-c1ccc(Cn2ccnc2)cc1)c1cccc([N+](=O)[O-])c1 507333308 KVSJKOYYHSNSPL-IBGZPJMESA-N 455.518 5.067 5 20 JKBD COc1ccc([C@@H](C)NC(=O)N(Cc2ccc([N+](=O)[O-])cc2)C(C)C)cc1Br 509421450 YZAYAVZTJUVVEK-CQSZACIVSA-N 450.333 5.047 5 20 JKBD Cc1oncc1C(=O)Nc1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2Oc2ccccc2)cc1 512537865 ZHRLKFSWCOSRJV-UHFFFAOYSA-N 458.430 5.188 5 20 JKBD COc1ccc([C@@H](NC(=O)c2ccc(Cn3nc(C)c([N+](=O)[O-])c3C)cc2)c2ccc(C)cc2)cc1 512869304 QEJWYTISCADCRW-SANMLTNESA-N 484.556 5.293 5 20 JKBD C[C@H](CC(=O)Nc1ncc(S(=O)(=O)c2ccc([N+](=O)[O-])cc2)s1)c1ccc(C(F)(F)F)cc1 512960960 FEKFJIOFAUBZKJ-GFCCVEGCSA-N 499.492 5.035 5 20 JKBD O=C(Nc1cccc(NC(=O)c2cc3c(cc2[N+](=O)[O-])OCCO3)c1)Nc1cccc2c1CCCC2 519505124 FTPFKGSJYYLTQV-UHFFFAOYSA-N 488.500 5.141 5 20 JKBD CC(=O)Nc1cccc([C@@H](C)NCc2cn(-c3ccccc3)nc2-c2ccc([N+](=O)[O-])cc2)c1 520206800 NLKMJQXRMBSBGE-GOSISDBHSA-N 455.518 5.257 5 20 JKBD CCOc1cc(NC(=O)N(C)[C@H](C)c2cccc(C(F)(F)F)c2)c([N+](=O)[O-])cc1OCC 562183651 FAEYGEJDOIVBOL-CYBMUJFWSA-N 455.433 5.636 5 20 JKBD CC(C)CCSc1ccc(C(=O)Nc2ccc(NC(=O)C3CC3)cc2C(F)(F)F)cc1[N+](=O)[O-] 590873929 WWBBNEBGIWAADZ-UHFFFAOYSA-N 495.523 6.353 5 20 JKBD O=C(Nc1cc([N+](=O)[O-])ccc1OC(F)F)c1sc2cc(C(F)(F)F)ccc2c1Cl 603638141 CPBNXTRLGCADFT-UHFFFAOYSA-N 466.771 6.335 5 20 JKBD O=C(Nc1cc([N+](=O)[O-])ccc1OC(F)F)c1ccc(Oc2ccc(Br)cc2)nc1 603785081 URLZIKFTVWVMKS-UHFFFAOYSA-N 480.221 5.398 5 20 JKBD COc1cc([C@H](C)NC(=O)C2CCN(c3ccccc3[N+](=O)[O-])CC2)ccc1OCCC(C)C 603921231 QVGWMVLDACXGIB-IBGZPJMESA-N 469.582 5.122 5 20 JKBD O=[N+]([O-])c1ccc(-c2noc(CN[C@@H](c3ccccc3)c3ccc(Cl)c(Cl)c3)n2)cc1 604010606 FPIFYAKPLFXYPP-NRFANRHFSA-N 455.301 5.831 5 20 JKBD C[C@@H](Nc1ccc(OCc2ccccc2)nc1)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 604044371 OVSVLXZDVCUKRN-CQSZACIVSA-N 460.412 5.027 5 20 JKBD Cc1nccn1-c1ccc(CNCc2ccc(-c3ccc([N+](=O)[O-])cc3Br)o2)cc1F 608836867 VKHVOZNXHRXMGI-UHFFFAOYSA-N 485.313 5.540 5 20 JKBD O=C(C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)N1CCC[C@@H]1CN1CCCCC1 609023902 AJYACKBPSBQGKE-FLVWFLKISA-N 490.629 5.612 5 20 JKBD CC(C)[C@H](Sc1ccccc1)C(=O)O[C@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 727212928 SGVMUKSENIAQRU-ACJLOTCBSA-N 470.469 5.301 5 20 JKBD Cc1cc(NC(=O)c2cc(F)c(F)cc2[N+](=O)[O-])n(-c2cc(C(F)(F)F)ccc2Cl)n1 727707411 RTYVYEVOWMSBLM-UHFFFAOYSA-N 460.746 5.292 5 20 JKBD CC(C)N(Cc1nnc(-c2cccc([N+](=O)[O-])c2)o1)C(=O)[C@H]1C[C@H]1c1ccc(Cl)cc1Cl 730449097 AWAXRJJTTOYLEB-ROUUACIJSA-N 475.332 5.492 5 20 JKBD C[C@@H](OC(=O)CCc1nc2cc(Cl)ccc2s1)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl 730606282 ANFWCPKVOVXLDU-SNVBAGLBSA-N 468.318 5.014 5 20 JKBD O=C(Nc1ncc(Cc2ccc(C(F)(F)F)cc2)s1)c1cc([N+](=O)[O-])ccc1Br 751074578 ZSNAPSKJNGHAFC-UHFFFAOYSA-N 486.269 5.676 5 20 JKBD CCc1nc(CN(c2ccc(C)cc2C)S(=O)(=O)c2ccc(Cl)c([N+](=O)[O-])c2)cs1 915671612 SOZJIETVNHNCTF-UHFFFAOYSA-N 465.984 5.279 5 20 JKBD C[C@H](Nc1ccc(C(=O)N2CCC[C@@H]2COc2ccc(Cl)cc2)cc1[N+](=O)[O-])c1ccccn1 919711735 YOJFZDKAWRNOQX-FXAWDEMLSA-N 480.952 5.500 5 20 JKBD O=C(Cc1cccc([N+](=O)[O-])c1)NC1(c2ccc(NC(=O)C3CCC(F)(F)CC3)cc2)CCC1 1786242621 MGZMFRPZXQYKEY-UHFFFAOYSA-N 471.504 5.097 5 20 JKBD COc1ccc2oc(C(=O)Nc3ccc(C4(NC(=O)Cc5cccc([N+](=O)[O-])c5)CCC4)cc3)cc2c1 1789238158 JCGKHRDCMRUYBW-UHFFFAOYSA-N 499.523 5.340 5 20 JKBD COc1ccc(CC(=O)Nc2ccc(C3(NC(=O)[C@H]4CC=C(C)CC4)CCC3)cc2)c([N+](=O)[O-])c1 1790571459 WHIOUQYMVKDLLX-IBGZPJMESA-N 477.561 5.026 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)NC1(c2ccc(NC(=O)[C@@H](C)Cc3ccccn3)cc2)CCC1 1791767588 OENVOYXYZZYNIA-KRWDZBQOSA-N 490.535 5.064 5 20 JKBD Cc1ccc(CC(=O)N2CCC3(CCCN(C(=O)[C@@H](C)c4ccc(Cl)cc4)C3)CC2)cc1[N+](=O)[O-] 1805198252 KSOIVUIYVVGODA-FQEVSTJZSA-N 498.023 5.134 5 20 JKBD O=C(Nc1cc([C@@H]2CCCCN2C(=O)[C@@H]2CCC[C@H]3CCCC[C@H]32)[nH]n1)c1ccc([N+](=O)[O-])cc1F 1821054579 PNEBDIJECQGCCX-UYCVCSCRSA-N 497.571 5.369 5 20 JKBD C[C@@H](C(=O)N1CCC([C@H]2CCCCN2C(=O)/C=C/c2ccc([N+](=O)[O-])o2)CC1)c1ccc(Cl)cc1 1824275526 CNKHYWGQYICINF-CBXSUMEWSA-N 499.995 5.278 5 20 JKBD O=C(c1cc2cc([N+](=O)[O-])ccc2s1)N1CCC([C@@H]2CCCCN2C(=O)C2CCCC2)CC1 1826255624 HPXQLYZVBXLSFA-NRFANRHFSA-N 469.607 5.233 5 20 JKBD COc1cc(C(=O)N2CCC([C@H]3CCCCN3C(=O)c3c(C)cccc3Cl)CC2)ccc1[N+](=O)[O-] 1830599403 ZBPPQYAZSLMRKJ-OAQYLSRUSA-N 499.995 5.112 5 20 JKBD CC1(C)CCC(CC(=O)N2CCC([C@H]3CCCCN3C(=O)c3cc(F)cc([N+](=O)[O-])c3)CC2)CC1 1830618224 OMNBMWACFPJCGA-XMMPIXPASA-N 487.616 5.574 5 20 JKBD COc1cc(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3ccc(C(C)C)cc3)CC2)ccc1[N+](=O)[O-] 1832696515 ZLEFALQDTVVPNV-XMMPIXPASA-N 493.604 5.274 5 20 JKBD c1ccc(Cn2c(SCc3nc4ccccc4c4ccccc34)nnc2-c2cccnc2)cc1 26042660 ZNUIZMGSPZQCLL-UHFFFAOYSA-N 459.578 6.382 5 20 JKBD O=C(O[C@@H](C(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1)c1ccccc1)c1ccc(C(F)(F)F)nc1 26434627 DUTIRNBVOAVWGF-GOSISDBHSA-N 479.798 5.199 5 20 JKBD C[C@H](Nc1ccc(C(=O)Nc2cccc(OCC(F)(F)F)c2)cc1[N+](=O)[O-])c1ccccn1 302973158 IJIKEFRDKPMUDE-AWEZNQCLSA-N 460.412 5.356 5 20 JKBD Cc1ccc(NC(=O)C2CC2)cc1NC(=O)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1 481930907 KZGDEAJSYWZUSK-UHFFFAOYSA-N 465.893 5.950 5 20 JKBD Cc1csc(Sc2ccc(C(=O)N[C@H](c3ccccc3)c3cccnc3)cc2[N+](=O)[O-])n1 485507507 BZSTUIFGVHDWPP-OAQYLSRUSA-N 462.556 5.425 5 20 JKBD CC(=O)N1CCCc2cc(N[C@@H](C(=O)Nc3ccc([N+](=O)[O-])cc3Cl)c3ccccc3)ccc21 501978341 FQNPEYVCHVSKEO-XMMPIXPASA-N 478.936 5.339 5 20 JKBD Cn1cnnc1Sc1ccc(NC(=O)c2ccc(NCc3ccccc3)c([N+](=O)[O-])c2)cc1Cl 503705844 SVISNBSCUMDEMR-UHFFFAOYSA-N 494.964 5.392 5 20 JKBD CCC(CC)(CNC(=O)c1cc(OC)c(OC(F)F)cc1[N+](=O)[O-])c1ccc(Cl)cc1 507056389 ISMQBRAPYWWHDS-UHFFFAOYSA-N 456.873 5.346 5 20 JKBD CCCc1noc2nc(C3CC3)cc(C(=O)Nc3cc(OCC)c(OCC)cc3[N+](=O)[O-])c12 514431354 LUEZPGNWDOAXDP-UHFFFAOYSA-N 454.483 5.011 5 20 JKBD CC(C)(C)c1ccc(C(=O)N2CCC([C@@H]3C(=O)Nc4cc(Cl)ccc43)CC2)cc1[N+](=O)[O-] 514731259 XWGKNFDPYHGDSE-NRFANRHFSA-N 455.942 5.134 5 20 JKBD CN(Cc1ccccc1[N+](=O)[O-])C(=O)Nc1ccc(NC(=O)c2ccc(F)cc2)cc1C(F)(F)F 515396309 WMORLWWBVCJTKN-UHFFFAOYSA-N 490.413 5.669 5 20 JKBD CCCN(C(=O)c1ccc(N[C@@H](C)c2ccccn2)c([N+](=O)[O-])c1)[C@@H](C)c1ccccc1OC 519887095 RUAKLEQEEFYYTE-OALUTQOASA-N 462.550 5.785 5 20 JKBD COCc1cccc2sc(NC(=O)c3ccc(N[C@H](C)c4ccccn4)c([N+](=O)[O-])c3)nc12 521505595 VRNWNLBCRLVWLZ-CQSZACIVSA-N 463.519 5.171 5 20 JKBD COc1ccc(Oc2ccc([N+](=O)[O-])cc2C(=O)Nc2ccc3nc([C@H]4CCCO4)[nH]c3c2)cc1 521951970 CNJRZEFUEUDWLK-HSZRJFAPSA-N 474.473 5.376 5 20 JKBD Cn1c(CNC(=O)c2ccccc2Sc2ccc(C(F)(F)F)cc2[N+](=O)[O-])nc2ccccc21 524491948 JXCBQJQPSPFURD-UHFFFAOYSA-N 486.475 5.582 5 20 JKBD CC(=O)N(c1ccc(C)cc1)c1nc(/C=C(\c2ccncc2)c2ccc([N+](=O)[O-])cc2)cs1 603945583 JAPZPESCQOKOMV-IWIPYMOSSA-N 456.527 6.028 5 20 JKBD CC[C@H](C(=O)N1CCC(NCc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)CC1)c1ccccc1 608837012 USKLQUWPJQXPMM-DEOSSOPVSA-N 463.603 5.598 5 20 JKBD O=C(c1csc(-c2ccc([N+](=O)[O-])cc2)n1)N(CCc1ccccn1)Cc1ccc(F)cc1 608881416 VUYIVUQSWLPJCS-UHFFFAOYSA-N 462.506 5.138 5 20 JKBD O=C(Oc1ccc(-c2noc([C@H]3CCCO3)n2)cc1)c1cc([N+](=O)[O-])ccc1Oc1ccccc1 729112366 OVJRFXVWUMHHEG-JOCHJYFZSA-N 473.441 5.508 5 20 JKBD CC(=O)c1cccc(O[C@@H](C)C(=O)O[C@@H](C(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)c2ccccc2)c1 745230085 KJJVIGUVZWVRBK-QMHKHESXSA-N 496.903 5.141 5 20 JKBD O=C(c1csc(-c2cccc([N+](=O)[O-])c2)n1)N1CCC[C@@H]1Cc1ccc(Br)cc1 747715636 LCOOKUBHUROKLZ-QGZVFWFLSA-N 472.364 5.328 5 20 JKBD C[C@@H](OC(=O)c1csc(-c2cccc([N+](=O)[O-])c2)n1)C(=O)Nc1ccc(Cl)c(Cl)c1 747961069 FLGAQIUCKVETSS-SNVBAGLBSA-N 466.302 5.209 5 20 JKBD CN(Cc1ccccc1[N+](=O)[O-])C(=O)c1ccc(F)cc1NC(=O)c1cccc(Br)c1 915287938 JSDJFBPPGLNIOE-UHFFFAOYSA-N 486.297 5.021 5 20 JKBD CN(C)c1ccc([C@@H](CNC(=S)Nc2ccc([N+](=O)[O-])cc2)c2c[nH]c3ccccc23)cc1 916122091 OXIMUHCTGYAWCL-JOCHJYFZSA-N 459.575 5.261 5 20 JKBD CCc1cccc(CC)c1NC(=O)[C@H](C)OC(=O)c1cc([N+](=O)[O-])ccc1Oc1ccccc1 917257908 VYGNEBOJTSAPHR-KRWDZBQOSA-N 462.502 5.696 5 20 JKBD Cc1cc(NC(=O)c2ccc(F)cc2Cl)sc1C(=O)Nc1cc([N+](=O)[O-])ccc1F 917611982 SHEFZBPKPNGCPJ-UHFFFAOYSA-N 451.838 5.401 5 20 JKBD CCCC(=O)Nc1c(Cl)cc(Cl)cc1C(=O)OCc1nc(-c2cccc([N+](=O)[O-])c2)no1 919558966 WPMJTNLTQXHFAC-UHFFFAOYSA-N 479.276 5.047 5 20 JKBD CC(=O)N(c1nc(COC(=O)CNc2ccccc2[N+](=O)[O-])cs1)c1c(C)cc(C)cc1Cl 920604771 NKGLLJJFZATSDL-UHFFFAOYSA-N 488.953 5.161 5 20 JKBD O=C(COC(=O)c1csc(-c2ccc(Cl)s2)n1)Nc1ccc(C(F)(F)F)cc1[N+](=O)[O-] 920675448 JSIKDGIDPRQWKP-UHFFFAOYSA-N 491.856 5.248 5 20 JKBD Cc1c(C(=O)NC2(c3ccc(NC(=O)C[C@@H]4CCCCO4)cc3)CCC2)cc(Cl)cc1[N+](=O)[O-] 1786646210 DSFGSKDTVPEKQU-FQEVSTJZSA-N 485.968 5.264 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)[C@@H]3[C@@H]4CCC[C@H]3c3ccccc3N4)CCC2)cc1)c1ccc([N+](=O)[O-])[nH]1 1790185010 FQQCIDXWQDGVBR-XTJBDQBJSA-N 499.571 5.049 5 20 JKBD CCSc1cccnc1C(=O)Nc1ccc(C2(NC(=O)Cc3cccc([N+](=O)[O-])c3)CCC2)cc1 1790207037 CSNBCRYZJJFABC-UHFFFAOYSA-N 490.585 5.092 5 20 JKBD Cc1ccc(C(=O)NC2(c3ccc(NC(=O)c4cccc([N+](=O)[O-])c4Br)cc3)CCC2)o1 1790636497 IJHWHIGTZIXEPA-UHFFFAOYSA-N 498.333 5.320 5 20 JKBD Cc1c(C(=O)Nc2ccc(C3(NC(=O)CC[C@H]4CCOC4)CCC3)cc2)cc(Cl)cc1[N+](=O)[O-] 1790774916 VIGSADRLIPMBRJ-KRWDZBQOSA-N 485.968 5.121 5 20 JKBD COc1cc(C(=O)Nc2ccc(C3(NC(=O)[C@H]4CC=C(C)CC4)CCC3)cc2)cc([N+](=O)[O-])c1OC 1790815164 PLSUVHVJYDRQIZ-SFHVURJKSA-N 493.560 5.106 5 20 JKBD Cc1c(C(=O)N2CCC3(CCCN(C(=O)[C@H]4CCCCC4(F)F)C3)CC2)cc(Cl)cc1[N+](=O)[O-] 1806207256 GTWZCIRJHWJQMM-LJQANCHMSA-N 497.970 5.227 5 20 JKBD O=C(CCc1cccc([N+](=O)[O-])c1)Nc1cc([C@H]2CCCCN2C(=O)c2cccc3ccccc23)[nH]n1 1815537376 XCPFVMJRGMTDNE-RUZDIDTESA-N 497.555 5.410 5 20 JKBD Cc1c(C(=O)N2CCCC[C@H]2c2cc(NC(=O)c3ccoc3Cl)n[nH]2)cc(Cl)cc1[N+](=O)[O-] 1820395181 STEQTIHQQGOYJR-INIZCTEOSA-N 492.319 5.146 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cccc(Cl)c2)n[nH]1 1820501214 AGKSDVGDEJCTCS-LJQANCHMSA-N 485.903 5.039 5 20 JKBD CC(C)[C@H](C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cc(F)cc([N+](=O)[O-])c2)n[nH]1)c1ccccc1 1821163888 YQWRGXZBVZEQIW-UPVQGACJSA-N 493.539 5.203 5 20 JKBD O=C(/C=C/c1ccc([N+](=O)[O-])o1)N1CCC([C@@H]2CCCCN2C(=O)[C@@H]2CCC[C@H]3CCCC[C@H]32)CC1 1828456722 VTNMGEKHERNSLF-NTYGTILDSA-N 497.636 5.427 5 20 JKBD Cc1nn(Cc2ccc(C(=O)NC[C@@H](c3ccccc3)c3c[nH]c4ccccc34)cc2)c(C)c1[N+](=O)[O-] 10695608 YKQVNQIJJDYJKZ-VWLOTQADSA-N 493.567 5.500 5 20 JKBD COc1ccc(-c2nnc(SCC(=O)N(C)c3ccc([N+](=O)[O-])cc3)n2C2CCCCC2)cc1 11979869 CPTNGWPEIRVPQZ-UHFFFAOYSA-N 481.578 5.122 5 20 JKBD C[C@H](OC(=O)c1ccc(NCc2ccccc2)c([N+](=O)[O-])c1)c1nnc(-c2cccs2)o1 17656738 OMBDDCIVMGKGBI-AWEZNQCLSA-N 450.476 5.236 5 20 JKBD O=C(CSc1ccc(F)c(F)c1)Nc1c(Br)cc([N+](=O)[O-])cc1Br 17982504 MWXOBNWPJRPEJX-UHFFFAOYSA-N 482.100 5.129 5 20 JKBD CCN(CC)c1ccc(-c2nnc(SCC(=O)Nc3ccc([N+](=O)[O-])cc3Cl)n2CC)cc1 21115702 GKVIGVRZOPFVBN-UHFFFAOYSA-N 489.001 5.104 5 20 JKBD CCOc1ccccc1NC(=O)[C@@H](OC(=O)c1ccc(Br)c([N+](=O)[O-])c1)c1ccccc1 22833642 HUYAZCXHNVFWFQ-NRFANRHFSA-N 499.317 5.293 5 20 JKBD CC(C)OC(=O)C[C@@H](NC(=O)Cc1csc(-c2ccccc2Cl)n1)c1ccccc1[N+](=O)[O-] 24483606 LCCUMIVLSNVKTH-LJQANCHMSA-N 487.965 5.113 5 20 JKBD Cc1cccc(NC(=O)[C@H](C)OC(=O)Cc2cn(-c3ccccc3)nc2-c2ccc([N+](=O)[O-])cc2)c1C 27258833 KVXGBXHCRRCZKY-FQEVSTJZSA-N 498.539 5.177 5 20 JKBD CCN(Cc1cccc(N[C@@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2ccccc2)c1)C(C)=O 30494054 FYMXNAGBSVJHCF-XMMPIXPASA-N 480.952 5.409 5 20 JKBD CSc1ccc(C(=O)c2ccccc2C(=O)Nc2cccc(Oc3cnccn3)c2)cc1[N+](=O)[O-] 33137917 GKOMBUGHGVKKKQ-UHFFFAOYSA-N 486.509 5.382 5 20 JKBD CCN(Cc1ccc(OC)c(OC)c1)C(=O)c1cc([N+](=O)[O-])ccc1Oc1ccc(OC)cc1 33159789 HGZJFJFOYAFIKO-UHFFFAOYSA-N 466.490 5.075 5 20 JKBD O=C(Nc1cc(C(F)(F)F)ccc1N1CCCC1)c1ccc(Br)c([N+](=O)[O-])c1 106892885 DOCZLJRMICKHIU-UHFFFAOYSA-N 458.234 5.229 5 20 JKBD Cc1ccc(-c2csc(NC(=O)c3ccc(N[C@@H](C)c4ccccn4)c([N+](=O)[O-])c3)n2)cc1 108751696 LRTJUHDAPIZRQD-INIZCTEOSA-N 459.531 5.847 5 20 JKBD CCOc1cccc([C@H](C)NC(=O)C2CCN(c3ccc(C(F)(F)F)cc3[N+](=O)[O-])CC2)c1 109367062 CUVYZDLDCPQFBK-HNNXBMFYSA-N 465.472 5.106 5 20 JKBD O=C(CN(Cc1ccccc1F)C(=O)c1cc2cc([N+](=O)[O-])ccc2s1)Nc1ccccc1F 195586235 UPGCJVOJQOSCEJ-UHFFFAOYSA-N 481.480 5.369 5 20 JKBD Cc1ccc(NC(=O)c2ccc(N[C@@H](C)c3ccccn3)c([N+](=O)[O-])c2)cc1OCC(F)F 303205471 YSGVIEYNRSZINM-HNNXBMFYSA-N 456.449 5.368 5 20 JKBD O=C(NC[C@H]1CCCO[C@@H]1c1ccccc1)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1 409556268 WBJSVZOOTQKUKR-NTKDMRAZSA-N 466.921 5.938 5 20 JKBD C[C@H](Nc1ccc(C(=O)Nc2nc(-c3ccccc3F)cs2)cc1[N+](=O)[O-])c1ccccn1 410081531 HBDOIROLHSTNCN-AWEZNQCLSA-N 463.494 5.678 5 20 JKBD C[C@H](NC(=O)c1ccc(Cl)cc1[N+](=O)[O-])c1cccc(NC(=O)Cc2ccccc2F)c1 483264483 COMCGIMJGRVZJR-AWEZNQCLSA-N 455.873 5.060 5 20 JKBD CCOc1cccc2cc([C@@H](C)NC(=O)c3cc(OCC(F)(F)F)ccc3[N+](=O)[O-])oc12 495361261 ZHCCZGZTUNERAJ-GFCCVEGCSA-N 452.385 5.172 5 20 JKBD O=C(CSc1ccc(C(F)(F)F)cc1[N+](=O)[O-])Nc1cccc(COCc2ccco2)c1 502728146 QWJOTKCPGLFMHE-UHFFFAOYSA-N 466.437 5.654 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Cl)[C@H](c1ccccc1)N1CCC[C@H](c2nccs2)C1 505250352 CKANWUZCBZVJQF-JXFKEZNVSA-N 456.955 5.264 5 20 JKBD CCn1c(SCC(=O)N(C)[C@@H](C)c2ccc(F)c(F)c2)nc2cc3ccccc3cc2c1=O 510383923 HXBNWUSUDJEDJD-HNNXBMFYSA-N 467.541 5.160 5 20 JKBD COc1ccc(-c2nnc(SCc3cc([N+](=O)[O-])ccc3OC(C)C)n2C[C@@H]2CCCO2)cc1 511056823 CQIPWTOTZHDRBM-NRFANRHFSA-N 484.578 5.120 5 20 JKBD O=C(Nc1ccc(Cc2nc3ccccc3s2)cc1)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-] 512174224 CKEPZXGJNDENIS-UHFFFAOYSA-N 487.459 5.989 5 20 JKBD C[C@H](c1ccccc1)n1c(SCc2nc(-c3cccc([N+](=O)[O-])c3)no2)nc2ccccc2c1=O 514487734 IJOPAIWDZZXZNP-MRXNPFEDSA-N 485.525 5.256 5 20 JKBD O=C(Nc1ccc(Cc2ccncc2)cc1)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 514858683 BDNDUHJHFSAMQO-UHFFFAOYSA-N 484.478 5.455 5 20 JKBD Cc1noc(C)c1CNC(=O)c1c2c(nc3ccccc13)/C(=C\c1cccc([N+](=O)[O-])c1)CCC2 516337882 XGSNHLKWWQUZQC-UYRXBGFRSA-N 468.513 5.555 5 20 JKBD COCCN(C(=O)c1ccc(-c2ccsc2)nc1C)c1nc(-c2ccc([N+](=O)[O-])cc2)cs1 522394112 SEUNIAOXHLZCOZ-UHFFFAOYSA-N 480.571 5.443 5 20 JKBD CCCOc1cc(NC(=O)N2CCC[C@@H]2c2cccc(OC)c2)c([N+](=O)[O-])cc1OCCC 603652954 QCNGNGQQAHBRRR-HXUWFJFHSA-N 457.527 5.550 5 20 JKBD O=C(Nc1ccc(F)c(NC(=O)C2CCCCC2)c1)c1ccc(N2CCCC2)c([N+](=O)[O-])c1 603671920 JUBOGERJLYFOTK-UHFFFAOYSA-N 454.502 5.105 5 20 JKBD COc1ccc([N+](=O)[O-])cc1C(=O)Nc1ccccc1OCc1ncc(-c2cccc(Cl)c2)o1 608851137 SISVLHLXNOIVCS-UHFFFAOYSA-N 479.876 5.743 5 20 JKBD CCCO[C@H]1CCCN(C(=O)c2ccc(Sc3nc4ccccc4s3)c([N+](=O)[O-])c2)CC1 609376220 XDLCQPWASACJRV-KRWDZBQOSA-N 471.604 5.777 5 20 JKBD CCc1cccc[n+]1/C(C(=S)NC12CC3CC(CC(C3)C1)C2)=C(/O)c1ccc(C)c([N+](=O)[O-])c1 725762062 NFSVHRLXJDNPRF-UHFFFAOYSA-O 478.638 5.523 5 20 JKBD CC(C)C[C@@H](NC(=O)C(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1)c1cccc(C(F)(F)F)c1 726854312 KBJCJFKWAJVVNX-MRXNPFEDSA-N 457.836 5.109 5 20 JKBD CC(=O)N1CCC(COC(=O)c2c3c(nc4ccccc24)/C(=C/c2cccc([N+](=O)[O-])c2)CCC3)CC1 727771548 SJNTXVXBPPIOJU-CJLVFECKSA-N 499.567 5.435 5 20 JKBD O=C(Nc1nc2ccc(OCC(F)(F)F)cc2s1)c1cc([N+](=O)[O-])ccc1Br 751082100 HNDXGXZVUJBVFP-UHFFFAOYSA-N 476.230 5.160 5 20 JKBD O=C(Nc1ccc(NC(=O)c2ccccc2NC(=O)c2ccc([N+](=O)[O-])cc2Cl)cc1)NC1CC1 900751712 SFXZLKQIIWKQNQ-UHFFFAOYSA-N 493.907 5.037 5 20 JKBD CS(=O)(=O)c1ccc(Cl)c(C(=O)Nc2cc(Cl)c([N+](=O)[O-])cc2OCc2ccccc2)c1 916827421 HVHPPBPYUKEMRM-UHFFFAOYSA-N 495.340 5.136 5 20 JKBD CCOc1cc(/C=C(\C(=O)OCc2nc(-c3ccc([N+](=O)[O-])cc3)no2)c2ccccc2)ccc1O 918951353 FKVOGVNRLQZRBE-STZFKDTASA-N 487.468 5.033 5 20 JKBD C[C@H](Nc1ccc(C(=O)Oc2cccc(C(=O)NCc3ccccc3)c2)cc1[N+](=O)[O-])c1ccccn1 919680284 MSGNAQXYWLECEN-IBGZPJMESA-N 496.523 5.312 5 20 JKBD COCCOC(=O)Nc1cccc(NC(=O)c2cc([N+](=O)[O-])ccc2Sc2ccccc2)c1 920229527 MAXRSYGYUSSFEX-UHFFFAOYSA-N 467.503 5.193 5 20 JKBD Cc1cc[n+](/C(C(=S)Nc2ccc3c(c2)OC(F)(F)O3)=C(/O)c2ccc(C)c([N+](=O)[O-])c2)cc1 920396428 LGUZZPMJECUKOG-UHFFFAOYSA-O 486.476 5.144 5 20 JKBD C[C@@H](OC(=O)c1ccc(N[C@H](C)c2ccccn2)c([N+](=O)[O-])c1)C(=O)Nc1cc(Cl)ccc1F 920544005 BOVUBACSRJLWFA-ZIAGYGMSSA-N 486.887 5.139 5 20 JKBD CC(=O)Nc1cc(NC(=O)c2cc([N+](=O)[O-])ccc2Sc2ccc(Cl)cc2)c(F)cc1F 921156012 FQDVUCVBEGRUAB-UHFFFAOYSA-N 477.876 5.888 5 20 JKBD C[C@@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)O[C@H](C)c1nc(-c2cccc(C(F)(F)F)c2)no1 924160184 FFVJUOLANFIQSM-VXGBXAGGSA-N 467.425 5.449 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)c3ccc([N+](=O)[O-])[nH]3)CCC2)cc1)c1ccc(-c2cccnc2)cc1 1790590550 BYXULWOKGVQPCU-UHFFFAOYSA-N 481.512 5.046 5 20 JKBD O=C([C@@H]1CCC[C@@H]2CCCC[C@@H]21)N1CCC([C@H]2CCCCN2C(=O)c2ccc([N+](=O)[O-])o2)CC1 1823614503 LUXNLZISMZENPO-VXSCBNMQSA-N 471.598 5.028 5 20 JKBD Cc1oc(C(C)(C)C)cc1C(=O)N1CCC([C@@H]2CCCCN2C(=O)Cc2cccc([N+](=O)[O-])c2)CC1 1823679272 DNPGWIJQNBAQQW-DEOSSOPVSA-N 495.620 5.270 5 20 JKBD Cc1cccc(C(=O)N2CCC([C@@H]3CCCCN3C(=O)Cc3ccc(Cl)cc3[N+](=O)[O-])CC2)c1 1824160275 AVPFMNVPMDYVFA-QHCPKHFHSA-N 483.996 5.033 5 20 JKBD CC(C)(C)CC(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cc(Br)ccc2[N+](=O)[O-])CC1 1830563499 CRAHHZRPOXQHHO-IBGZPJMESA-N 494.430 5.027 5 20 JKBD Cc1cscc1C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)CC1 1831061182 OMFHLRYGKGJVHI-OAQYLSRUSA-N 497.642 5.727 5 20 JKBD O=C(CSc1nnc(COc2ccccc2Cl)n1C1CC1)Nc1cc(Cl)ccc1[N+](=O)[O-] 9413267 FYUWJIZQULSZKS-UHFFFAOYSA-N 494.360 5.138 5 20 JKBD O=C(COC(=O)c1ccc(Oc2ccccc2)cc1)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 10647851 HSBMLPMNGLQTJY-UHFFFAOYSA-N 460.364 5.201 5 20 JKBD O=C(NCCCn1cnc2ccccc21)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1 15137614 VYRVYJHRVGRGBT-UHFFFAOYSA-N 450.882 5.210 5 20 JKBD Cc1occc1-c1nnc(S[C@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)n1Cc1ccccc1 17662439 AFAXLLGDMNLFLG-MRXNPFEDSA-N 488.529 5.706 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Cl)[C@@H](N[C@@H]1CCSc2ccccc21)c1ccccc1 19669686 ZUWWHHIPMZXVGG-KNQAVFIVSA-N 453.951 5.755 5 20 JKBD C[C@@H](Sc1nn(-c2ccc(Cl)cc2)c(=S)s1)C(=O)Nc1cccc([N+](=O)[O-])c1 20852149 CHGQFLFZCFRHHB-SNVBAGLBSA-N 452.970 5.344 5 20 JKBD C[C@H](OC(=O)Cc1c(Cl)cccc1Cl)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 21346916 UYOMTFDMKQOXNJ-VIFPVBQESA-N 465.211 5.033 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Br)[C@H](NCc1ccc(Cl)cc1)c1ccccc1 21818306 NQCGDAJFSJNJRP-HXUWFJFHSA-N 474.742 5.480 5 20 JKBD CCn1c(S[C@H](C)C(=O)Nc2cc(Cl)ccc2OC)nc2cc3ccccc3cc2c1=O 22178140 IADHMSOFTPNAOD-CQSZACIVSA-N 467.978 5.351 5 20 JKBD O=C(c1ccc([N+](=O)[O-])cc1)N(C[C@@H]1CCCO1)c1nc(-c2cccc(C(F)(F)F)c2)cs1 26131618 TXBOGUNNJASAIG-SFHVURJKSA-N 477.464 5.563 5 20 JKBD Cc1cccc(C(=O)N2CCCN(C(=O)c3ccc(SCCC(C)C)c([N+](=O)[O-])c3)CC2)c1 31252712 WJWCYWMEKYLUMZ-UHFFFAOYSA-N 469.607 5.030 5 20 JKBD CCOc1ccc([C@@H](NC(=O)Cn2c3ccccc3c(=O)c3ccccc32)C(C)C)cc1OCC 58537706 UCANFQXMLQYJFY-NDEPHWFRSA-N 472.585 5.466 5 20 JKBD CCOc1ccc([C@H](NC(=O)Cn2c3ccccc3c(=O)c3ccccc32)c2ccccc2)cc1 71891963 STJZLJVCWIODQP-GDLZYMKVSA-N 462.549 5.459 5 20 JKBD Cc1ccc(NC(=O)[C@H](OC(=O)c2cc(C3CC3)nc3onc(C)c23)c2ccccc2)c([N+](=O)[O-])c1 115406844 GFYQENZVIUCZDV-HSZRJFAPSA-N 486.484 5.162 5 20 JKBD CCCn1c2ccccc2c2nnc(S[C@H](C)C(=O)Nc3ccc([N+](=O)[O-])cc3Cl)nc21 495456178 XRHIBBOWWOLMEU-GFCCVEGCSA-N 470.942 5.070 5 20 JKBD C[C@H](Nc1ccc(C(=O)Nc2nc(CN3CCC[C@@H](C)C3)cs2)cc1[N+](=O)[O-])c1ccccn1 507161849 SVIHHYUEJSWJDO-SJORKVTESA-N 480.594 5.104 5 20 JKBD C[C@H](Nc1ccc(C(=O)N(C)CCCOc2cccc(Cl)c2)cc1[N+](=O)[O-])c1ccccn1 509170840 QZNBETHOIWSCRA-KRWDZBQOSA-N 468.941 5.357 5 20 JKBD Cc1cc(Oc2ccc(N(C)S(=O)(=O)c3ccc(F)cc3)cc2)nc(-c2ccc([N+](=O)[O-])cc2)n1 515585399 VRVROZFDZXWXPH-UHFFFAOYSA-N 494.504 5.117 5 20 JKBD O=C(COc1ccc(-c2ccccc2)cc1[N+](=O)[O-])N1CCC[C@H]1c1ccc2c(c1)OCCCO2 517914697 UFDHMKQWDWJUGO-QFIPXVFZSA-N 474.513 5.166 5 20 JKBD O=[N+]([O-])c1cc2c(c(CSCc3coc(-c4ccc(Br)cc4)n3)c1)OCOC2 518743715 KHLYPQMGVNBTNR-UHFFFAOYSA-N 463.309 5.312 5 20 JKBD C[C@H](S[C@H](C)c1ccc(OC(F)(F)F)cc1)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 518917014 NWPCICUTWYRVKX-MNOVXSKESA-N 482.402 6.334 5 20 JKBD O=C(CCCn1c(=O)oc2cc([N+](=O)[O-])ccc21)Nc1cccc(-c2ccc3ccccc3c2)n1 524261937 GCRLRMXIXASNIF-UHFFFAOYSA-N 468.469 5.137 5 20 JKBD COc1cc(NC(=O)c2cc3cc([N+](=O)[O-])ccc3s2)c(C(=O)N2[C@H](C)CCC[C@H]2C)cc1OC 603596706 LYNPORMHDHMSFB-HUUCEWRRSA-N 497.573 5.482 5 20 JKBD Cn1c(=O)oc2ccc(NC(=O)C/C(=C/c3ccc([N+](=O)[O-])cc3)c3nc4ccccc4s3)cc21 608808325 AXAKHQAQWJXFQL-VBKFSLOCSA-N 486.509 5.219 5 20 JKBD C[C@H](OC(=O)c1csc(-c2cccc([N+](=O)[O-])c2)n1)C(=O)N[C@@H](C)c1cccc2ccccc12 747962824 UYPXMBJXCAFYHJ-HOTGVXAUSA-N 475.526 5.294 5 20 JKBD CC(C)c1ccc(-c2nc(C(=O)O[C@H](C)C(=O)Nc3ccc([N+](=O)[O-])cc3Cl)cs2)cc1 900227293 YJWZBSSJTOAYSG-CYBMUJFWSA-N 473.938 5.679 5 20 JKBD CC(C)(CCc1nc(-c2ccc(Oc3ncc(C(F)(F)F)cc3Cl)cc2)no1)[N+](=O)[O-] 904669974 GQWDJJZZQAFMEF-UHFFFAOYSA-N 456.808 5.584 5 20 JKBD O=C(Nc1ccc(N2C(=O)CCCC2=O)cc1)c1ccc(NCc2ccccc2Cl)c([N+](=O)[O-])c1 915296646 OPXVSBRXPTWYSB-UHFFFAOYSA-N 492.919 5.156 5 20 JKBD CCOc1ccc(-n2c(SCc3cc(F)ccc3[N+](=O)[O-])nnc2-c2cccnc2)cc1 915790182 JVCPANXRWBEVAS-UHFFFAOYSA-N 451.483 5.068 5 20 JKBD C[C@H](OC(=O)c1cc([N+](=O)[O-])ccc1Oc1ccccc1)C(=O)Nc1ccccc1Br 917256647 AOSKEJSOJPIIDW-AWEZNQCLSA-N 485.290 5.334 5 20 JKBD CCC(CC)c1cc[n+](/C(C(=S)N[C@@H](C)c2ccccc2)=C(/O)c2cccc([N+](=O)[O-])c2)cc1 917614678 XUXOTVJXBDOINS-IBGZPJMESA-O 476.622 6.348 5 20 JKBD O=C(Nc1ccccc1SC[C@H]1CC1(Cl)Cl)[C@H]1CC(=O)N(c2ccc(F)c([N+](=O)[O-])c2)C1 917751780 OUTZOOKFNMLZIP-QWHCGFSZSA-N 498.363 5.011 5 20 JKBD Cc1cc(C)n(-c2ccc(NC(=O)c3ccc(N[C@H](C)c4ccccn4)c([N+](=O)[O-])c3)cc2)n1 919703840 HFEUKBMXFABZFI-GOSISDBHSA-N 456.506 5.218 5 20 JKBD C[C@@H](Nc1ccc(C(=O)O[C@H](c2ccccc2)c2ccccn2)cc1[N+](=O)[O-])c1ccccn1 920771120 LPEJULXHGOVAGE-IQGLISFBSA-N 454.486 5.504 5 20 JKBD Cc1[nH]ccc1C(=O)Nc1ccc(C2(NC(=O)C3(c4cccc([N+](=O)[O-])c4)CCC3)CCC2)cc1 1788805836 CZMVYOGEJRHARE-UHFFFAOYSA-N 472.545 5.101 5 20 JKBD O=C(NC1(c2ccc(NC(=O)c3c4ccccc4n4ccsc34)cc2)CCC1)c1ccc([N+](=O)[O-])[nH]1 1790002715 RYTGSAXGDYAWFS-UHFFFAOYSA-N 499.552 5.452 5 20 JKBD Cc1cccc(C(=O)NC2(c3ccc(NC(=O)C4(c5cccc([N+](=O)[O-])c5)CCC4)cc3)CCC2)n1 1790475942 LZFYKPMYKJSJEQ-UHFFFAOYSA-N 484.556 5.168 5 20 JKBD CCOc1ccc(Cl)cc1C(=O)Nc1ccc(C2(NC(=O)c3ccc([N+](=O)[O-])o3)CCC2)cc1 1790691522 HVNSPUKJYXTAHV-UHFFFAOYSA-N 483.908 5.301 5 20 JKBD CC(C)[C@H]1CC[C@H](C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)CC1 1801207171 MRQRYINCHXXQIV-SMWGBGATSA-N 483.634 5.524 5 20 JKBD Cc1csc(C(=O)N2CCCC3(CCN(C(=O)c4cc5cc([N+](=O)[O-])ccc5s4)CC3)C2)c1 1806242375 WMOYOGTZCKXIJO-UHFFFAOYSA-N 483.615 5.338 5 20 JKBD O=C(CCc1cccc([N+](=O)[O-])c1)N1CCCC2(CCN(C(=O)[C@@H]3CCC[C@@H]4CCCC[C@H]43)CC2)C1 1806490075 GPTXRSQFEWTCEK-SKBVVQJISA-N 495.664 5.365 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2c[nH]c(C(C)(C)C)c2)n[nH]1 1816112230 WTGMBOQJZLPNEY-LJQANCHMSA-N 496.543 5.011 5 20 JKBD O=C(CCC1CCCC1)Nc1cc([C@H]2CCCCN2C(=O)CSc2ccccc2[N+](=O)[O-])[nH]n1 1816694385 CNAYSHXRSXKQKA-LJQANCHMSA-N 485.610 5.073 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cccc(Cl)c2)[nH]n1 1821286594 AAWLCBXWGXWYJN-IBGZPJMESA-N 485.903 5.039 5 20 JKBD Cc1ccc([C@@H](C)C(=O)N2CCCC[C@H]2C2CCN(C(=O)Cc3cc([N+](=O)[O-])ccc3F)CC2)cc1 1831525655 VLFPAIOOTFFUGM-IBVKSMDESA-N 495.595 5.008 5 20 JKBD Cc1ccc(-n2c(SCC(=O)Nc3cc([N+](=O)[O-])ccc3F)nnc2-c2ccccc2)cc1 9928367 SZBOJYXYKHNNHQ-UHFFFAOYSA-N 463.494 5.021 5 20 JKBD O=C(c1ccc(N2CCCC2)c([N+](=O)[O-])c1)N1CCC(c2nc3cc(Cl)ccc3s2)CC1 10235625 AQFZAICSHPMTPE-UHFFFAOYSA-N 470.982 5.478 5 20 JKBD CCOc1ccc(Oc2ccc(NC(=O)CCCn3c(=O)oc4cc([N+](=O)[O-])ccc43)cc2)cc1 11507182 AFVBSNXNELCTNT-UHFFFAOYSA-N 477.473 5.113 5 20 JKBD C[C@@H](Sc1nnc(-c2ccc(F)cc2)n1C[C@@H]1CCCO1)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 17715329 VHDQQYXXDWJFPK-KUHUBIRLSA-N 496.524 5.075 5 20 JKBD O=C(OCC(=O)N1N=C(c2cc3ccccc3o2)C[C@H]1c1ccco1)c1cc([N+](=O)[O-])ccc1Cl 24459190 LYCFUBBOEFAHFK-IBGZPJMESA-N 493.859 5.122 5 20 JKBD CCn1c(S[C@H](C(=O)Nc2ccc(C)cc2[N+](=O)[O-])c2ccccc2)nnc1-c1ccncc1 31641759 JIRWGKMJFRUYOL-NRFANRHFSA-N 474.546 5.049 5 20 JKBD C[C@H](Nc1ccc(C(=O)NCc2ccccc2CN2CCC[C@@H](C)C2)cc1[N+](=O)[O-])c1ccccn1 108829253 PFKHRIJOGHHWEE-RTWAWAEBSA-N 487.604 5.325 5 20 JKBD O=C(Nc1ccccc1)c1nnc(/C(Cl)=C\c2ccc(-c3ccc([N+](=O)[O-])cc3)o2)s1 210160848 ZRRYVQHTEVCWQZ-SFQUDFHCSA-N 452.879 5.696 5 20 JKBD O=C(CNC(=O)c1c(Cl)cccc1[N+](=O)[O-])Nc1ccc(Oc2cccc(Cl)c2)cc1 303426690 ZUXNUKJAPYPFDM-UHFFFAOYSA-N 460.273 5.062 5 20 JKBD C[C@@H](Nc1ccc(C(=O)Nc2n[nH]c(-c3cccc(C(F)(F)F)c3)n2)cc1[N+](=O)[O-])c1ccccn1 490607773 LMFUGASJDZHLIV-CYBMUJFWSA-N 497.437 5.219 5 20 JKBD O=C(Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1)c1nc(C2CC2)n(-c2ccccc2Cl)n1 499330670 RNESGJNPQYUAQV-UHFFFAOYSA-N 466.910 5.082 5 20 JKBD O=C(c1c[nH]c2cc([N+](=O)[O-])ccc12)N(Cc1ccc(Cl)c(Cl)c1)Cc1ccccn1 500055646 ABEAZCZQQLDEIN-UHFFFAOYSA-N 455.301 5.621 5 20 JKBD COCCn1ccc(NC(=O)c2c3c(nc4ccccc24)/C(=C/c2cccc([N+](=O)[O-])c2)CCC3)n1 507150365 VDIHGGLMHFEEDS-KNTRCKAVSA-N 483.528 5.115 5 20 JKBD C[C@H]1CCCN(Cc2csc(NC(=O)c3ccc(N[C@H](C)c4ccccn4)c([N+](=O)[O-])c3)n2)C1 507161843 SVIHHYUEJSWJDO-DLBZAZTESA-N 480.594 5.104 5 20 JKBD CCOc1ccc(NC(=O)c2ccc(NC(=O)N(Cc3ccc([N+](=O)[O-])cc3)C(C)C)cc2)cc1 509615103 FJDGAXHEMBFLIU-UHFFFAOYSA-N 476.533 5.688 5 20 JKBD CCOc1cc(CN[C@@H](C)c2cc(C)sc2C)ccc1OCc1cc([N+](=O)[O-])cc2c1OCOC2 509616607 HAYFWZPWKUGHBB-KRWDZBQOSA-N 498.601 5.968 5 20 JKBD CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)Cc1ccc(NC(=O)c2cc3ccccc3o2)cc1 509697299 KKGYEIGCCYJQAM-UHFFFAOYSA-N 471.513 5.573 5 20 JKBD CN(C(=O)c1ccc(Cl)cc1)c1ccc(NC(=O)CSc2ccc([N+](=O)[O-])cc2)cc1 511606833 PSYXCWJBNPKQDZ-UHFFFAOYSA-N 455.923 5.256 5 20 JKBD CN(CCCCCc1cc(-c2ccccc2)n[nH]1)C(=O)c1ccc(N2CCCC2)c([N+](=O)[O-])c1 518059813 WYUVDUADJOGREI-UHFFFAOYSA-N 461.566 5.070 5 20 JKBD O=C(Nc1cc(Cl)ccc1Cl)[C@H]1CCCCN1C(=O)c1ccc(Cl)cc1[N+](=O)[O-] 522508510 HQLDZBSFSJYRCY-MRXNPFEDSA-N 456.713 5.188 5 20 JKBD COCCOc1cc([N+](=O)[O-])c(C(=O)Nc2cccc(-c3ccc4ccccc4c3)n2)cc1OC 524703974 BHAMYUOLPNDNKC-UHFFFAOYSA-N 473.485 5.096 5 20 JKBD Cc1cccc(Oc2ccc(Cl)cc2NC(=O)c2ccc(S(C)(=O)=O)c([N+](=O)[O-])c2)c1 603464044 AYFHDEVHRSLQPY-UHFFFAOYSA-N 460.895 5.005 5 20 JKBD O=C(Nc1ccc(C(=O)N(Cc2ccccc2[N+](=O)[O-])CC(F)(F)F)cc1)c1ccccc1 603614350 JLEDGENNGBMXEC-UHFFFAOYSA-N 457.408 5.052 5 20 JKBD O=C(Cc1csc(-c2ccc(C(F)(F)F)cc2)n1)Nc1cc([N+](=O)[O-])ccc1OC(F)F 603638134 CHPFRHKUNMBNLT-UHFFFAOYSA-N 473.379 5.520 5 20 JKBD O=C(c1cccc2ccccc12)N1CCC(C(=O)N(Cc2ccccc2[N+](=O)[O-])CC(F)(F)F)CC1 603742191 NTQWUEKGFSDQLP-UHFFFAOYSA-N 499.489 5.191 5 20 JKBD Cc1ccc(C(=O)NCC(F)(F)F)cc1NC(=O)c1cc([N+](=O)[O-])ccc1NCc1ccccc1 603774282 DEYGEDLOFSCOHB-UHFFFAOYSA-N 486.450 5.060 5 20 JKBD CC(=O)N(c1ccc(C)cc1)c1nc(COc2ccc([N+](=O)[O-])cc2Cc2ccccc2)cs1 603947480 GUTYYYZCNRAXLS-UHFFFAOYSA-N 473.554 6.214 5 20 JKBD O=C(Cn1ccc([N+](=O)[O-])n1)N(Cc1cccc(C(F)(F)F)c1)Cc1cccc(C(F)(F)F)c1 603951971 ZEZLKLRFPKNPHF-UHFFFAOYSA-N 486.372 5.058 5 20 JKBD COc1ccc(COCc2cccc(NC(=O)[C@H](C)Sc3ccc([N+](=O)[O-])cc3)c2)cc1 604465148 OTYNPUMFVWJJLM-KRWDZBQOSA-N 452.532 5.440 5 20 JKBD CCCCC1CCC(C(=O)Nc2ccc(CNC(=O)C(=O)Nc3ccc(C)c([N+](=O)[O-])c3)cc2)CC1 608923729 MNXPSWCOENEPMZ-UHFFFAOYSA-N 494.592 5.093 5 20 JKBD CCn1cnnc1-c1ccccc1NC(=O)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1 609164835 XQIFKYCYVGLHGH-UHFFFAOYSA-N 463.881 5.571 5 20 JKBD O=C(Nc1cc([N+](=O)[O-])c(F)cc1F)c1cc(-c2ccc(F)cc2)nc2onc(C3CC3)c12 727707175 JNCLJKQRNOQTMF-UHFFFAOYSA-N 454.364 5.345 5 20 JKBD O=C(NCc1ccc(C(=O)N(CC2CC2)c2ccc(Cl)c([N+](=O)[O-])c2)cc1)C1CCCC1 728166911 QFXCMHYXVVNRCL-UHFFFAOYSA-N 455.942 5.111 5 20 JKBD Cc1ccc[n+](/C(C(=S)Nc2c(Cl)ccc(C)c2Cl)=C(/O)c2ccc(C)c([N+](=O)[O-])c2)c1 728559110 YUHBQSHAMSFMNH-UHFFFAOYSA-O 489.404 6.438 5 20 JKBD CCOc1ccccc1NC(=O)[C@@H](OC(=O)c1c(Cl)cccc1[N+](=O)[O-])c1ccccc1 730646521 GBYKRWJVTMSRPW-NRFANRHFSA-N 454.866 5.184 5 20 JKBD Cc1nnc(SCc2c(C(=O)OCc3cccc([N+](=O)[O-])c3C)oc3ccccc23)s1 742957104 RRRGSUZGXZIOGC-UHFFFAOYSA-N 455.517 5.459 5 20 JKBD C[C@@H](OC(=O)c1csc(-c2ccc([N+](=O)[O-])cc2)n1)C(=O)Nc1ccc(Cl)cc1C(F)(F)F 747957946 GYZGBTSXSXAXJY-SNVBAGLBSA-N 499.854 5.575 5 20 JKBD Cc1ccc(C(C)C)c(Oc2ccc(CNCc3ccc(-n4ccnc4)nc3)cc2[N+](=O)[O-])c1 915227862 JILZKZVRSZPCIX-UHFFFAOYSA-N 457.534 5.689 5 20 JKBD COc1cc(/C=C(/Cl)c2nc3ccc([N+](=O)[O-])cc3[nH]2)cc(Br)c1OC(F)F 917143898 STWRCBLYEDPNQE-VZUCSPMQSA-N 474.645 5.581 5 20 JKBD CN(Cc1cc([N+](=O)[O-])ccc1Cl)C(=O)[C@@H]1CCC(=O)N(Cc2ccccc2)[C@H]1c1ccccc1 920884978 MDZJZBMMKGKMLT-BVAGGSTKSA-N 491.975 5.387 5 20 JKBD Cc1c(C(=O)NC2(c3ccc(NC(=O)CCc4ccccn4)cc3)CCC2)cc(Cl)cc1[N+](=O)[O-] 1786960958 NRZLUFLVYDCUGA-UHFFFAOYSA-N 492.963 5.332 5 20 JKBD Cc1ccc2cc(C(=O)Nc3ccc(C4(NC(=O)c5cc(C)c([N+](=O)[O-])cn5)CCC4)cc3)ccc2n1 1789033217 OCMWBGCUQZDBLF-UHFFFAOYSA-N 495.539 5.216 5 20 JKBD O=C(C[C@H]1C[C@@H]2CC[C@H]1C2)Nc1ccc(C2(NC(=O)c3cccc(F)c3[N+](=O)[O-])CCC2)cc1 1791324858 BIYLBDOPHSGZEU-FGTMMUONSA-N 465.525 5.308 5 20 JKBD CC1(C)CCC(CC(=O)N2CC[C@H](CNC(=O)c3cc(F)cc([N+](=O)[O-])c3)[C@@H]2c2cccnc2)CC1 1811306922 XFOHIKNNDFNGAN-NLFFAJNJSA-N 496.583 5.055 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)N1CCC([C@@H]2CCCCN2C(=O)C2(c3ccccc3)CC2)CC1 1823783313 PRVODYCSSPAFCM-DEOSSOPVSA-N 493.579 5.007 5 20 JKBD Cc1c(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3ccc(F)cc3)CC2)cc(Cl)cc1[N+](=O)[O-] 1830736291 VHGIGRMZJHJAQG-JOCHJYFZSA-N 487.959 5.243 5 20 JKBD CC1(C(=O)N2CCCC[C@H]2C2CCN(C(=O)CCc3cccc([N+](=O)[O-])c3)CC2)CCCCC1 1831792419 RFGFTWFVXSHKOW-DEOSSOPVSA-N 469.626 5.118 5 20 JKBD Cc1ccccc1-c1cc(C(=O)OCc2cc([N+](=O)[O-])cc3c2OCOC3)c2cnn(C(C)C)c2n1 14362283 ZDXAEOAJAVKZAF-UHFFFAOYSA-N 488.500 5.119 5 20 JKBD C[C@H](Sc1nnc(-c2cccs2)n1-c1ccccc1)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 17652171 YRRKYYWUWHLAOD-AWEZNQCLSA-N 476.543 5.807 5 20 JKBD CSc1ccc([N+](=O)[O-])c(C(=O)Nc2nc(-c3ccc(OC(F)F)cc3)c(C)s2)c1 21597419 UFUVKDOFEMAINZ-UHFFFAOYSA-N 451.476 5.602 5 20 JKBD NC(=O)Cc1ccc(NC(=O)c2c3c(nc4ccccc24)/C(=C/c2cccc([N+](=O)[O-])c2)CCC3)cc1 24490549 GGIVOUWRQVELEH-HMMYKYKNSA-N 492.535 5.300 5 20 JKBD Cc1nc(-c2ccc([C@@H](C)NC(=O)Cn3c4ccccc4c(=O)c4ccccc43)cc2)cs1 30892969 RDTRFNLHKAWNAS-QGZVFWFLSA-N 453.567 5.464 5 20 JKBD CCCOc1ccc(C(F)(F)F)cc1NC(=O)c1ccc(N[C@H](C)c2ccccn2)c([N+](=O)[O-])c1 108757385 STCKIRUXXOQROS-OAHLLOKOSA-N 488.466 6.223 5 20 JKBD O=C(NCCCc1nc(-c2ccncc2)cs1)c1ccc(Nc2ccccc2)c([N+](=O)[O-])c1 110680505 LKCSDSAHKDCSQA-UHFFFAOYSA-N 459.531 5.220 5 20 JKBD CCn1c(SCc2cccc(C(=O)N3CCCCC3)c2)nc2cc3ccccc3cc2c1=O 117502184 OKUGNBKIWYVFHR-UHFFFAOYSA-N 457.599 5.488 5 20 JKBD Cc1noc([C@@H]2CCCN(C(=O)c3cc([N+](=O)[O-])ccc3Sc3ccc(Cl)cc3)C2)n1 410079214 WPJYBYOVPNHYTG-CQSZACIVSA-N 458.927 5.111 5 20 JKBD COc1ccc(-c2ccc(CNCc3ccccc3-c3ccc(Cn4ccnc4)cc3)o2)c([N+](=O)[O-])c1 504161920 IIFIIBLHVIRSTO-UHFFFAOYSA-N 494.551 6.065 5 20 JKBD CC(=O)N1CCN(c2ccccc2CNCc2ccc(Sc3ccc(C)cc3)c([N+](=O)[O-])c2)CC1 508054631 PJCHYVCSZCGNQS-UHFFFAOYSA-N 490.629 5.013 5 20 JKBD COc1cc(C(=O)NCC2(c3cccc(C)c3)CCCCC2)c([N+](=O)[O-])cc1OCc1cscn1 509917612 UYMLHTDHAHDLGU-UHFFFAOYSA-N 495.601 5.579 5 20 JKBD CN(Cc1ccccc1[N+](=O)[O-])C(=O)Nc1nnc(SCc2c(Cl)cccc2Cl)s1 510223985 RETNEZZSNNEABV-UHFFFAOYSA-N 484.390 5.709 5 20 JKBD O=C(Nc1nccs1)c1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2Sc2ccccc2)cc1 512322986 KTGYCLDNNSQKKF-UHFFFAOYSA-N 476.539 5.707 5 20 JKBD CCOc1ccc(NC(=O)CNc2ccccc2C(=O)Nc2ccc(F)cc2Cl)c([N+](=O)[O-])c1 515445511 UOIJBXNRIYIABI-UHFFFAOYSA-N 486.887 5.089 5 20 JKBD Cc1ccc(C(=O)Nc2cccc(CNC(=O)c3cc(OCC(F)(F)F)ccc3[N+](=O)[O-])c2)cc1 515741469 HJTJBDCQIUHZNW-UHFFFAOYSA-N 487.434 5.027 5 20 JKBD CCCN(C(=O)NCc1ccc(OC)c([N+](=O)[O-])c1)[C@H](C)c1ccccc1Br 515829827 SNXAKRPZOILKJP-CQSZACIVSA-N 450.333 5.049 5 20 JKBD Cc1ccc(C(=O)C2CCN(C(=O)c3ccc(N[C@@H](C)c4ccccn4)c([N+](=O)[O-])c3)CC2)c(C)c1 517551025 HORSKFPAJBYHIE-FQEVSTJZSA-N 486.572 5.515 5 20 JKBD Cc1ccc(C(C)C)c(Oc2ccc(CNCc3cccc(CN4CCCC4=O)c3)cc2[N+](=O)[O-])c1 517560998 FSFFISDFGPOMJB-UHFFFAOYSA-N 487.600 6.231 5 20 JKBD Cc1nc(-c2ccc(F)cc2)sc1[C@@H](C)N[C@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl 520634572 UIPWFJXACZIXJF-DGCLKSJQSA-N 462.934 5.497 5 20 JKBD O=C(Nc1ccnn1Cc1ccc(Cl)c(F)c1)c1csc(-c2cccc([N+](=O)[O-])c2)n1 521313682 YIUOHWCRSOLRDO-UHFFFAOYSA-N 457.874 5.008 5 20 JKBD Cc1cc([N+](=O)[O-])ccc1NC(=O)CCSc1nnc([C@@H](C)N2CCCCC2)n1-c1ccccc1 602216980 JWUOPNCHZGSSPX-LJQANCHMSA-N 494.621 5.152 5 20 JKBD CCCCc1ccc([C@H](NC(=O)C(=O)Nc2ccc(C)c([N+](=O)[O-])c2)c2cccs2)cc1 603706149 IDFSHMISJYLUSQ-QFIPXVFZSA-N 451.548 5.152 5 20 JKBD O=C(Nc1nc(-c2ccco2)cs1)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 603898021 KYWVNDWKTFVVEM-UHFFFAOYSA-N 466.441 5.185 5 20 JKBD O=C(Nc1ccccc1COCc1ccccc1)c1ccc(NCc2ccccc2)c([N+](=O)[O-])c1 603912303 QEECXSDGKVLMNF-UHFFFAOYSA-N 467.525 6.176 5 20 JKBD O=C(CCNc1ccc(C(F)(F)F)cc1[N+](=O)[O-])N(Cc1ccccn1)c1ccc(F)cc1 603996564 IFSMWUJKJWTXRZ-UHFFFAOYSA-N 462.403 5.183 5 20 JKBD COc1ccc(NC(=O)C/C(=C/c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)c(OC)n1 604471712 STQXYLQUMVPOQP-SSZFMOIBSA-N 476.514 5.186 5 20 JKBD O=C(C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)NCCN1Cc2ccccc2C1 604481394 NLSHXNKHWNSBHT-PXLXIMEGSA-N 484.581 5.267 5 20 JKBD COc1cc(CNC[C@@H]2CCN(c3ccc(F)c(F)c3)C2)ccc1OCc1ccc([N+](=O)[O-])cc1 608782067 QJNSLMJISJIAAQ-FQEVSTJZSA-N 483.515 5.077 5 20 JKBD Cc1cc(CSc2ncccc2C(=O)Nc2nc(-c3ccc(C)c([N+](=O)[O-])c3)cs2)no1 619729659 FTJITTHDYRUNIX-UHFFFAOYSA-N 467.532 5.263 5 20 JKBD C[C@H](OC(=O)c1cn(C(C)(C)C)nc1-c1ccccc1Cl)C(=O)Nc1ccccc1[N+](=O)[O-] 731084520 FMWDUWDNPWZXMT-AWEZNQCLSA-N 470.913 5.051 5 20 JKBD CCOc1ccc(NC(=O)COC(=O)c2csc(-c3ccc(Cl)c(Cl)c3)n2)c([N+](=O)[O-])c1 744605349 UWDLXNJEWPUCGH-UHFFFAOYSA-N 496.328 5.219 5 20 JKBD CC(C)Cc1nc(C(=O)Oc2ccc3c(-c4ccc([N+](=O)[O-])cc4)cc(=O)oc3c2)cs1 745744185 RXBUOXMTLZXHAE-UHFFFAOYSA-N 450.472 5.242 5 20 JKBD CCOC(=O)c1c(-c2ccccc2)csc1NC(=O)c1cc(OC)c(OC(F)F)cc1[N+](=O)[O-] 785935390 ZXBMJUZXUCJRBJ-UHFFFAOYSA-N 492.456 5.362 5 20 JKBD CCOc1ccc(N2C(=S)N[C@@H](c3ccc([N+](=O)[O-])o3)C(C(=O)Nc3ccc(F)cc3)=C2C)cc1 812827156 JJTCFJZFNXUSGX-QFIPXVFZSA-N 496.520 5.074 5 20 JKBD CC(C)CNC(=O)C1CCN(C(=O)c2cc([N+](=O)[O-])ccc2Sc2ccc(Cl)cc2)CC1 881438258 DKSPZBWIRIHRQW-UHFFFAOYSA-N 475.998 5.024 5 20 JKBD COc1ccc([C@H]2[C@@H](C(=O)Nc3cc([N+](=O)[O-])c(F)cc3F)CCC(=O)N2c2ccc(C)cc2)cc1 897500586 ZTHVIPNXNHCCIE-DFBJGRDBSA-N 495.482 5.313 5 20 JKBD O=C(Nc1cc(Cl)c([N+](=O)[O-])cc1OCc1ccccc1)c1coc(Br)c1 914438739 SZZKCLHBRGJVCZ-UHFFFAOYSA-N 451.660 5.435 5 20 JKBD Cc1ccc(S/C=C/C(=O)NC2(c3ccc(NC(=O)c4ccc([N+](=O)[O-])o4)cc3)CCC2)cc1 1785750323 FHDIJGAFCPRUNZ-DTQAZKPQSA-N 477.542 5.550 5 20 JKBD Cc1cc(CCCC(=O)Nc2ccc(C3(NC(=O)c4ccncc4)CCC3)cc2)c([N+](=O)[O-])cc1F 1786274587 DHSTVDOXRSTFRL-UHFFFAOYSA-N 490.535 5.208 5 20 JKBD COc1cc(CC(=O)Nc2ccc(C3(NC(=O)CCC4CCCC4)CCC3)cc2)ccc1[N+](=O)[O-] 1790478192 YGLUWBMCAKYNAD-UHFFFAOYSA-N 479.577 5.250 5 20 JKBD Cc1ccoc1C(=O)NC1(c2ccc(NC(=O)c3ccc(Br)c([N+](=O)[O-])c3)cc2)CCC1 1790642344 PWBCBQSWFNAQPB-UHFFFAOYSA-N 498.333 5.320 5 20 JKBD Cc1c(Cl)ccc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2c(F)ccc([N+](=O)[O-])c2C)C3)c1Cl 1803536840 FJRGAKTZOUZNJI-QDMKHBRRSA-N 494.350 5.223 5 20 JKBD Cc1ccc(-c2nc(C)sc2CC(=O)OCC(=O)Nc2ccc(C(F)(F)F)cc2[N+](=O)[O-])cc1 11219793 IYQHNZPIFQURGM-UHFFFAOYSA-N 493.463 5.078 5 20 JKBD Cc1nc(CSc2ccc(C(=O)O[C@H](C)C(=O)Nc3ccc([N+](=O)[O-])cc3Cl)cc2)cs1 11698586 HMFGMAFSUOUWAQ-GFCCVEGCSA-N 491.978 5.489 5 20 JKBD Cc1ccc(Nc2nnc(S[C@H](C)c3nnc(-c4ccc([N+](=O)[O-])cc4)o3)s2)cc1C 17532267 VAFCEVRWBMZDEG-CYBMUJFWSA-N 454.537 5.710 5 20 JKBD CC(=O)Nc1cccc(-n2c(Sc3ccc(C(F)(F)F)cc3[N+](=O)[O-])nnc2C2CC2)c1 26723840 HMYQHUNFYFEKAO-UHFFFAOYSA-N 463.441 5.181 5 20 JKBD C[C@@H](OC(=O)Cn1c2ccccc2c(=O)c2ccccc21)C(=O)Nc1ccccc1Cc1ccccc1 28775130 XKFBVUFDSKJKPP-OAQYLSRUSA-N 490.559 5.316 5 20 JKBD CC(=O)N(c1nc(COc2ccc([N+](=O)[O-])cc2Cc2ccccc2)cs1)c1ccccc1F 31767662 SNPAFSJGBAXVDQ-UHFFFAOYSA-N 477.517 6.045 5 20 JKBD COC(=O)c1ccc(Cl)c(NC(=O)c2cc([N+](=O)[O-])ccc2Oc2ccc(OC)cc2)c1 33157564 VMHNZNZOWHNIBP-UHFFFAOYSA-N 456.838 5.088 5 20 JKBD Cc1cc(O[C@@H](C)c2ccccc2)ccc1NC(=O)[C@@H]1CCCN1C(=O)c1ccc([N+](=O)[O-])c(C)c1 112519493 MISMZSFGPDJTGV-FNZWTVRRSA-N 487.556 5.595 5 20 JKBD O=C1CCCN1c1ccc(CNCc2ccc(Oc3ccccc3Cl)c([N+](=O)[O-])c2)cc1 216500207 OLPAUVDEXLCLCG-UHFFFAOYSA-N 451.910 5.457 5 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GXYLQPQUAHKJDP-UHFFFAOYSA-N 497.960 5.155 5 20 JKBD O=C(Nc1ccc(Cc2nc3ccccc3s2)cc1)c1ccn(-c2cccc([N+](=O)[O-])c2)n1 513835908 WUPBOXGMEHVVAC-UHFFFAOYSA-N 455.499 5.233 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Cl)[C@H](c1ccccc1)N1CCCN(c2ccccc2)CC1 515550213 GNVNXRYQIXLEHS-DEOSSOPVSA-N 464.953 5.140 5 20 JKBD COc1ccc([N+](=O)[O-])cc1NC(=O)[C@@H](C)N[C@H](C)c1ccc(Oc2ccccc2)c(F)c1 515717558 OVBRYXRIJZANJY-HZPDHXFCSA-N 453.470 5.213 5 20 JKBD COc1cc(C(=O)N[C@H](C)c2ccc(Oc3ccccc3)c(F)c2)c([N+](=O)[O-])cc1OC(F)F 515997121 SNFJKWWIWDVKNL-CYBMUJFWSA-N 476.407 5.627 5 20 JKBD CCN(C(=O)c1ccc(NC2CC2)c([N+](=O)[O-])c1)[C@@H](c1cccnc1)c1ccc(F)c(F)c1 517812083 PTTMNMJHQNWXKG-HSZRJFAPSA-N 452.461 5.094 5 20 JKBD Cc1ccc(NC(=O)c2cccc(C(F)(F)F)c2)cc1NCc1nc(-c2cccc([N+](=O)[O-])c2)no1 519946667 JSIAIWRCPSHJIW-UHFFFAOYSA-N 497.433 5.836 5 20 JKBD Cc1cc(O[C@@H](C)c2ccccc2)ccc1NC(=O)CCCn1c(=O)oc2cc([N+](=O)[O-])ccc21 524380897 CPXCLMOWIJNBBH-SFHVURJKSA-N 475.501 5.370 5 20 JKBD COc1cc(C(=O)Nc2nc(-c3ccco3)c(-c3ccco3)s2)c([N+](=O)[O-])cc1OC(F)F 585699156 QZFZZFKZYHKROF-UHFFFAOYSA-N 477.401 5.434 5 20 JKBD CC(C)c1c(C(=O)Nc2cc([N+](=O)[O-])ccc2OC(F)F)cnn1-c1ccc(Cl)cc1 603638515 QZICWPOFYYZPBA-UHFFFAOYSA-N 450.829 5.411 5 20 JKBD CCOC(=O)C[C@H](c1ccccc1)C1CCN(C(=O)Cn2c3ccccc3c(=O)c3ccccc32)CC1 603932850 XSCNSKWSQXLADC-AREMUKBSSA-N 496.607 5.130 5 20 JKBD Cc1sc(NC(=O)c2ccc(N3C(=O)c4ccccc4C3=O)cc2)nc1-c1cccc([N+](=O)[O-])c1 603996997 LQKVKTIJOFSWPV-UHFFFAOYSA-N 484.493 5.080 5 20 JKBD Cc1occc1C(=O)Nc1cc(N[C@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2C(F)(F)F)ccc1F 604044405 LXONUXUVWVVUSF-LLVKDONJSA-N 494.401 5.346 5 20 JKBD CCCC(=O)Nc1ccc(CNCc2ccc(-c3ccc([N+](=O)[O-])cc3Br)o2)cc1 608836251 VGHOJTDOGYTHBK-UHFFFAOYSA-N 472.339 5.646 5 20 JKBD O=C(Nc1ccc(OC(=O)c2c[nH]c3ccc([N+](=O)[O-])cc23)cc1)c1cc([N+](=O)[O-])ccc1Cl 726768272 VTUMCPJUBZDFIR-UHFFFAOYSA-N 480.820 5.109 5 20 JKBD O=C(Nc1cc(Cl)c([N+](=O)[O-])cc1OCc1ccccc1)c1ccc(Br)cn1 727297361 JVPBNJPUKMZNKG-UHFFFAOYSA-N 462.687 5.237 5 20 JKBD C[C@@H](SCc1ncc(-c2ccc(Cl)cc2)o1)C(=O)OCc1c(F)cccc1[N+](=O)[O-] 728994199 LEWDYVYAOWQDOK-GFCCVEGCSA-N 450.875 5.407 5 20 JKBD Cc1nc2nc(S[C@H](C(=O)Nc3ccc(Cl)c([N+](=O)[O-])c3)c3ccccc3)nn2c(C)c1C 917251543 ZPLBSRBBURHNSD-IBGZPJMESA-N 482.953 5.083 5 20 JKBD CN(Cc1cc([N+](=O)[O-])ccc1Cl)C(=O)Cc1csc(-c2cc(Br)cs2)n1 917499542 JBQKTJQJHPPERY-UHFFFAOYSA-N 486.800 5.397 5 20 JKBD CCCCOc1ccc(-c2nnc(COC(=O)Cn3c4ccccc4c(=O)c4ccccc43)o2)cc1 919056066 UCDFLZIVMSHVKA-UHFFFAOYSA-N 483.524 5.127 5 20 JKBD CC(=O)N(c1cccc(C(F)(F)F)c1)c1nc(COC(=O)c2cc([N+](=O)[O-])ccc2F)cs1 919251207 UPJHIJRCWSSHGM-UHFFFAOYSA-N 483.399 5.251 5 20 JKBD Cc1c[nH]cc1C(=O)Nc1ccc(C2(NC(=O)c3cccc([N+](=O)[O-])c3Br)CCC2)cc1 1788732770 QWVSQBGYAMNXCL-UHFFFAOYSA-N 497.349 5.055 5 20 JKBD CC1=CC[C@@H](C(=O)Nc2ccc(C3(NC(=O)Cn4ccc5ccc([N+](=O)[O-])cc54)CCC3)cc2)CC1 1789111028 XGTQEFWJCKKMOA-OAQYLSRUSA-N 486.572 5.430 5 20 JKBD O=C(NC1(c2ccc(NC(=O)c3cccc(F)c3[N+](=O)[O-])cc2)CCC1)c1ccc2cnccc2c1 1790701624 XNSLJSWNCICEEV-UHFFFAOYSA-N 484.487 5.344 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)c3cccc(-c4cnco4)c3)CCC2)cc1)c1cc(O)cc([N+](=O)[O-])c1 1790757087 YJXKWYFIYLKHGH-UHFFFAOYSA-N 498.495 5.017 5 20 JKBD CN(C)c1ccc([N+](=O)[O-])cc1C(=O)Nc1ccc(C2(NC(=O)CCCC(F)(F)F)CCC2)cc1 1790791878 MJVGWRMBJGEEDG-UHFFFAOYSA-N 492.498 5.141 5 20 JKBD Cc1ccc(CC(=O)Nc2ccc(C3(NC(=O)c4cc(Cl)cc([N+](=O)[O-])c4C)CCC3)cc2)o1 1791947736 KJZPQYQJYWOIEQ-UHFFFAOYSA-N 481.936 5.448 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)C3(c4cccc([N+](=O)[O-])c4)CCC3)CCC2)cc1)[C@H]1CCCS1 1792014005 KSGHZMLXAHCXNL-JOCHJYFZSA-N 479.602 5.046 5 20 JKBD CC1(C)CCC(CC(=O)NC[C@@H]2CCN(C(=O)c3cc(F)cc([N+](=O)[O-])c3)[C@H]2c2cccnc2)CC1 1808902374 KPUXBKMXBCCWLV-CPJSRVTESA-N 496.583 5.055 5 20 JKBD C[C@@H](C(=O)N1CCCC[C@@H]1c1cc(NC(=O)Cc2cccc([N+](=O)[O-])c2)n[nH]1)c1ccc(Cl)cc1 1814372771 CVBZVRDRWPZIMR-OPAMFIHVSA-N 495.967 5.010 5 20 JKBD Cc1c(C(=O)N2CCCC[C@H]2c2cc(NC(=O)CCC3CCC3)n[nH]2)cc(Cl)cc1[N+](=O)[O-] 1815051235 BPLNOEVUYCJRBX-IBGZPJMESA-N 473.961 5.166 5 20 JKBD CC(C)[C@@H](C(=O)N1CCCC[C@@H]1C1CCN(C(=O)/C=C/c2ccc([N+](=O)[O-])o2)CC1)c1ccccc1 1824235571 LXECHXWOUOROGB-QIPWJXNQSA-N 493.604 5.261 5 20 JKBD CC(C)(C)c1cc(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)CCc3cccc([N+](=O)[O-])c3)CC2)c[nH]1 1825437556 WOOILPATJVLWIV-XMMPIXPASA-N 494.636 5.087 5 20 JKBD Cc1cccc(C)c1C(=O)N1CCC([C@H]2CCCCN2C(=O)CSc2ccccc2[N+](=O)[O-])CC1 1831778004 ZMBPZBMYLWNHHN-JOCHJYFZSA-N 495.645 5.237 5 20 JKBD C[C@H](C(=O)N1CCCC[C@@H]1C1CCN(C(=O)Cc2ccc(Cl)cc2[N+](=O)[O-])CC1)c1ccccc1 1832889288 LCIHZCXVBGTPME-YADARESESA-N 498.023 5.214 5 20 JKBD CC(C)n1ncc2c(C(=O)O[C@H](C)C(=O)Nc3cc([N+](=O)[O-])ccc3Cl)cc(-c3ccco3)nc21 11043292 NDHWXCGKEZILQK-CYBMUJFWSA-N 497.895 5.018 5 20 JKBD O=C(COC(=O)CCc1ncc(-c2ccccc2Cl)o1)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 12252220 RMYHJDXTSXRJQY-UHFFFAOYSA-N 497.813 5.037 5 20 JKBD Cc1cccc(C)c1NC(=O)CN(C)C(=O)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1 15473358 QIMOITIEZIDDTM-UHFFFAOYSA-N 467.909 5.368 5 20 JKBD Cc1nc(-c2cccs2)c(CC(=O)O[C@@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2C(F)(F)F)s1 22104251 LSTAVLHGLXBUTC-JTQLQIEISA-N 499.492 5.220 5 20 JKBD CC(C)n1c(S[C@@H](C)C(=O)Nc2nc(-c3cccc([N+](=O)[O-])c3)cs2)nc2ccccc2c1=O 24834438 TXVVIFJLOVQEPF-AWEZNQCLSA-N 495.586 5.128 5 20 JKBD O=C(NC[C@@H]1CCCO[C@@H]1c1ccccc1)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1 409556270 WBJSVZOOTQKUKR-YADARESESA-N 466.921 5.938 5 20 JKBD COc1cc(NC(=O)c2ccc(Sc3nc4ccccc4s3)c([N+](=O)[O-])c2)ccc1NC(C)=O 484220718 NWTPHWVWPYFMBG-UHFFFAOYSA-N 494.554 5.575 5 20 JKBD COCc1ccc(CNC(=O)C/C(=C\c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)cc1 497330817 DISWYNKAKVHZQF-KGENOOAVSA-N 473.554 5.598 5 20 JKBD COc1ccc2[nH]cc(C3=CCN(C(=O)c4csc(-c5cccc([N+](=O)[O-])c5)n4)CC3)c2c1 497363402 JGJAHWFLPNXJOS-UHFFFAOYSA-N 460.515 5.138 5 20 JKBD Cc1ccc(NC(=O)c2ccc(N[C@H](C)c3ccccn3)c([N+](=O)[O-])c2)cc1Br 506136119 KRCRZPCIIYVVRQ-CQSZACIVSA-N 455.312 5.486 5 20 JKBD C[C@H](c1ccccc1)n1c(Sc2cc3c(cc2[N+](=O)[O-])CCC(=O)N3)nnc1-c1ccccc1 506842426 ZQVLBCHOZLEUBX-MRXNPFEDSA-N 471.542 5.499 5 20 JKBD COc1ccc(Oc2ccc([N+](=O)[O-])cc2C(=O)Nc2ccc(C(=O)N(C)C)c(Cl)c2)cc1 511453301 HZMVVFISKJQDIO-UHFFFAOYSA-N 469.881 5.003 5 20 JKBD Cc1nc(CSc2ccccc2C(=O)Nc2cc([N+](=O)[O-])ccc2OC(F)F)cs1 515215289 XPYQFAXIBRKGJO-UHFFFAOYSA-N 451.476 5.506 5 20 JKBD C[C@H](Nc1ccc(C(=O)Nc2ccc(Sc3nncs3)cc2)cc1[N+](=O)[O-])c1ccccn1 517648068 PHLBUFUNRCYLLM-AWEZNQCLSA-N 478.559 5.418 5 20 JKBD COc1cc(C(=O)N(Cc2ccncc2)C[C@H]2CCCO2)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 518694066 GGBXWZGZHJMHPA-HXUWFJFHSA-N 497.935 5.266 5 20 JKBD Cc1c(NC(=O)[C@@H](C)Oc2ccc(Cl)cc2[N+](=O)[O-])cccc1C(=O)N1CCc2sccc2C1 521277060 WVZQIBHIVBWXOA-OAHLLOKOSA-N 499.976 5.223 5 20 JKBD Cc1nc(-c2ccc(F)cc2)sc1[C@H](C)NC(=O)[C@H](C)Oc1ccc(Cl)cc1[N+](=O)[O-] 609186357 JIFLOZPKTBOAPU-AAEUAGOBSA-N 463.918 5.464 5 20 JKBD CCOc1cccc2cc([C@H](C)N[C@H](C)C(=O)Nc3ccc([N+](=O)[O-])cc3C(F)(F)F)oc12 610250142 DYRISNBZZVWSAK-QWHCGFSZSA-N 465.428 5.436 5 20 JKBD O=C(COC(=O)[C@H]1C[C@H]1c1ccc(Cl)c(Cl)c1)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 727929617 SIULWNSPTAAYJX-RYUDHWBXSA-N 477.222 5.206 5 20 JKBD C[C@@H]1CN(c2ccc(NC(=O)c3cc4cc([N+](=O)[O-])ccc4o3)cc2C(F)(F)F)C[C@@H](C)O1 728011099 BZCPSYKKFIYFJA-CHWSQXEVSA-N 463.412 5.226 5 20 JKBD O=C(O[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1)c1ccn(-c2ccccc2F)n1 730604567 JTTJLHVNASIHSN-QFIPXVFZSA-N 494.866 5.110 5 20 JKBD Cc1cccc(C(=O)Oc2ccc(NC(=O)c3cccc([N+](=O)[O-])c3)cc2)c1NC(=O)c1ccncc1 743749478 FZUZKXPOENMDRJ-UHFFFAOYSA-N 496.479 5.022 5 20 JKBD CC(C)Oc1ccc(C(=O)COC(=O)c2ccccc2NC(=O)c2ccc([N+](=O)[O-])cc2Cl)cc1 749277005 JCHCYJYVEDJXEP-UHFFFAOYSA-N 496.903 5.327 5 20 JKBD CCN(Cc1ccccc1)C(=O)c1cc(NC(=O)c2cc(F)ccc2[N+](=O)[O-])ccc1Cl 751092154 AKQSNEVCVZZVGV-UHFFFAOYSA-N 455.873 5.302 5 20 JKBD C[C@@H](OC(=O)/C=C\c1ccc2ccc(Cl)cc2n1)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 912874654 YNSMKVLOLXKETC-OJIASSBASA-N 493.825 5.399 5 20 JKBD C[C@H](NC(=O)c1ccc(Br)s1)C(=O)OCc1nc2ccccc2c2ccccc12 919520922 LIEXIUGERUIRKW-ZDUSSCGKSA-N 469.360 5.074 5 20 JKBD O=C(/C=C/c1ccccc1[N+](=O)[O-])NC1(c2ccc(NC(=O)[C@@H]3CCC(F)(F)C3)cc2)CCC1 1785803685 UILXITCFCZFJFJ-PMQIGOLDSA-N 469.488 5.178 5 20 JKBD COc1cc(CC(=O)NC2(c3ccc(NC(=O)c4sccc4Cl)cc3)CCC2)ccc1[N+](=O)[O-] 1789902896 IDULHCKKIWZPCS-UHFFFAOYSA-N 499.976 5.309 5 20 JKBD Cc1ccc(C(=O)Nc2ccc(C3(NC(=O)CSc4ccccc4[N+](=O)[O-])CCC3)cc2)cc1O 1790616463 KSKHWUWSAGUCPM-UHFFFAOYSA-N 491.569 5.149 5 20 JKBD CN(C)c1ccc([N+](=O)[O-])cc1C(=O)NC1(c2ccc(NC(=O)c3ccc4ccoc4c3)cc2)CCC1 1790892270 APCTYKBYVNAGDS-UHFFFAOYSA-N 498.539 5.469 5 20 JKBD Cc1oc(C(C)(C)C)cc1C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2ccc([N+](=O)[O-])cc2F)n[nH]1 1821051486 LQSVTWBEAYGMGR-FQEVSTJZSA-N 497.527 5.276 5 20 JKBD C[C@@H](CC(=O)N1CCC([C@@H]2CCCCN2C(=O)CCc2cccc([N+](=O)[O-])c2)CC1)c1ccccc1 1824843644 QXPMTNBNQBDQOD-CUNXSJBXSA-N 491.632 5.341 5 20 JKBD Cc1cccc2cc(C(=O)N3CCCC[C@@H]3C3CCN(C(=O)c4cccc(F)c4[N+](=O)[O-])CC3)[nH]c12 1828549987 ZZDKFQTWRNSBAN-HSZRJFAPSA-N 492.551 5.071 5 20 JKBD C[C@@H](OC(=O)c1cccc(Cl)c1Cl)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 11029729 QAMCWBOBLUNKSW-MRVPVSSYSA-N 451.184 5.104 5 20 JKBD CS(=O)(=O)c1ccc(C(=O)Nc2nc(-c3ccc(-c4ccccc4)cc3)cs2)cc1[N+](=O)[O-] 14343702 VDAVHHPJRLTOOW-UHFFFAOYSA-N 479.539 5.041 5 20 JKBD Cc1c(C(=O)Nc2ncc(S(=O)(=O)c3ccc([N+](=O)[O-])cc3)s2)oc2c1ccc1ccccc12 14826619 FZKVJCUYRGIHCZ-UHFFFAOYSA-N 493.522 5.344 5 20 JKBD CS(=O)(=O)c1ccc(Sc2nc(-c3ccccc3)c(-c3ccccc3)[nH]2)c([N+](=O)[O-])c1 18900966 KTYDEJJLNTVNQD-UHFFFAOYSA-N 451.529 5.207 5 20 JKBD CCOc1cc(C(=O)O[C@@H](C)C(=O)Nc2c(Cl)cc(Cl)cc2Cl)c([N+](=O)[O-])cc1OC 19473409 BOTZCWVCJMPYML-VIFPVBQESA-N 491.711 5.146 5 20 JKBD Cc1ccc(C)c(NC(=O)[C@H](OC(=O)CSc2ccccc2[N+](=O)[O-])c2ccccc2)c1 24199435 RDHAIJLYXGKCNU-HSZRJFAPSA-N 450.516 5.227 5 20 JKBD O=C(Nc1ccccc1C(=O)N[C@H]1CCSc2c(F)cccc21)c1ccc([N+](=O)[O-])cc1Cl 28043592 DTUHKUAQKMILMI-FQEVSTJZSA-N 485.924 5.607 5 20 JKBD Cc1nn(CC(C)C)c(C)c1CC(=O)O[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1 28442525 GQJCSZHOPZHSGU-DEOSSOPVSA-N 498.967 5.183 5 20 JKBD COc1ncccc1CNC(=O)c1ccccc1Sc1ccc(C(F)(F)F)cc1[N+](=O)[O-] 30304771 MKOZPTZBODMZBU-UHFFFAOYSA-N 463.437 5.098 5 20 JKBD Cc1cc(C(=O)Nc2ccc(NC(=O)c3ccccc3F)cc2C(F)(F)F)ccc1[N+](=O)[O-] 107813896 MDQPUEFSSGOJAK-UHFFFAOYSA-N 461.371 5.566 5 20 JKBD C[C@@H](Nc1ccc(C(=O)Nc2ncc(Cc3cccc(F)c3)s2)cc1[N+](=O)[O-])c1ccccn1 108833911 ZXATURUPZWAHQN-OAHLLOKOSA-N 477.521 5.602 5 20 JKBD O=C(Cc1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1)NC[C@H]1CCCO[C@H]1c1ccccc1 409559843 XVTPOKNVNISDML-BTYSJIOQSA-N 496.567 5.274 5 20 JKBD COc1cccc(-c2nnc(SCCC(=O)Nc3ccc([N+](=O)[O-])cc3C)n2-c2ccccc2)c1 476593450 HDWASMVFTHATBI-UHFFFAOYSA-N 489.557 5.280 5 20 JKBD O=C(Nc1nc2ccccc2n1CCCn1ccnc1)c1cc([N+](=O)[O-])ccc1Oc1ccccc1 485436708 JEXIJLROBAQAPI-UHFFFAOYSA-N 482.500 5.276 5 20 JKBD O=C(Nc1ccc(NCc2ccccc2)c(Cl)c1)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-] 497526633 TWJZHZHGNZSVFV-UHFFFAOYSA-N 479.842 6.054 5 20 JKBD CC(C)Cn1c(SCC(=O)NCc2ccccc2[N+](=O)[O-])nnc1-c1ccc(Cl)cc1Cl 500794688 LISYQSGJXMMQOQ-UHFFFAOYSA-N 494.404 5.225 5 20 JKBD C[C@H](Nc1ccc(C(=O)Nc2cccc(CN3CCCCC3)c2)cc1[N+](=O)[O-])c1ccccn1 506222314 YKBOIBKOIXVKEQ-IBGZPJMESA-N 459.550 5.401 5 20 JKBD Cc1ccc(NC(=O)c2ccc(NCc3ccccc3)c([N+](=O)[O-])c2)c(OC[C@H]2CCCO2)c1 508040321 KXTGVXVCCWFTJT-OAQYLSRUSA-N 461.518 5.325 5 20 JKBD COCCN(C(=O)c1cc(Cl)ccc1OC(C)C)c1nc(-c2ccc([N+](=O)[O-])cc2)cs1 512383771 FIJKKYZDYFAGJF-UHFFFAOYSA-N 475.954 5.452 5 20 JKBD CO[C@H](C)C(=O)Nc1cccc(N[C@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2ccccc2)c1 520466940 KLLPEUHUKFSONY-QRQCRPRQSA-N 482.924 5.014 5 20 JKBD CN(C)C(=O)C[C@@H](NCc1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1)c1ccccc1 551229102 HVDIBFOTCIWJRP-OAQYLSRUSA-N 453.926 5.350 5 20 JKBD COc1ccc([C@@H](CNC(=O)c2ccc(N3CCCC3)c([N+](=O)[O-])c2)c2c[nH]c3ccccc23)cc1 603467100 LEHKLFVTGHFIEK-HSZRJFAPSA-N 484.556 5.247 5 20 JKBD CC(C)(C)c1ccc(C(=O)Nc2ccccc2NC(=O)c2cc([N+](=O)[O-])cc3c2OCCO3)cc1 608939242 YSEKVTDFRHMMTO-UHFFFAOYSA-N 475.501 5.168 5 20 JKBD CCN(CC)C(=O)c1ccc(CNc2ccc(C(=O)Nc3ccc(C)cc3)cc2[N+](=O)[O-])cc1 608972735 DCBDOQWHPGXFME-UHFFFAOYSA-N 460.534 5.250 5 20 JKBD O=C(Cn1c2ccccc2c(=O)c2ccccc21)Nc1cc(-c2ccc(Br)s2)[nH]n1 617361918 VLIHIOVHJICAJR-UHFFFAOYSA-N 479.359 5.008 5 20 JKBD Cc1ccc(C(=O)Nc2nc3ccc(NC(=O)c4cc(F)c(F)cc4[N+](=O)[O-])cc3s2)s1 729178991 VPOLBYMJJMQCOK-UHFFFAOYSA-N 474.470 5.357 5 20 JKBD C[C@H](OC(=O)c1csc(-c2cccc([N+](=O)[O-])c2)n1)C(=O)N[C@@H](C)c1ccc2ccccc2c1 747963737 ZPOGVCKZOVWFGR-HOTGVXAUSA-N 475.526 5.294 5 20 JKBD O=C(c1cc([N+](=O)[O-])ccc1Cl)N(Cc1ccccn1)Cc1ccc(Br)cc1F 748638532 GTNHUQBKCGVHNP-UHFFFAOYSA-N 478.705 5.387 5 20 JKBD C[C@H](Nc1ccc(C(=O)OCc2cccc(NC(=O)c3ccccc3)c2)cc1[N+](=O)[O-])c1ccccn1 750428274 ZFUMNEAHMOEGDR-IBGZPJMESA-N 496.523 5.772 5 20 JKBD Cc1cccc(NC(=O)c2ccccc2NC(=O)Cn2c3ccccc3c(=O)c3ccccc32)c1 836069874 HSVWZGQTBBCEIG-UHFFFAOYSA-N 461.521 5.354 5 20 JKBD CCCc1nc(C)c(C(=O)O[C@@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2ccccc2)s1 915508328 OJDYTOAQADQYGK-LJQANCHMSA-N 473.938 5.502 5 20 JKBD Cc1ccccc1N1C(=O)/C(=C/c2ccc(Br)c([N+](=O)[O-])c2)c2ccccc2C1=O 915851423 YMJCZVNFKDCXCX-LDADJPATSA-N 463.287 5.393 5 20 JKBD Cc1c(NC(=O)c2ccccc2)cccc1N[C@@H](C)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl 917640546 FDYXNBGUJNMTPX-HNNXBMFYSA-N 452.898 5.248 5 20 JKBD Cc1cccc(Cc2sc(NC(=O)c3cc([N+](=O)[O-])ccc3I)nc2C)c1 917736145 XVYPSUVAUBTUGQ-UHFFFAOYSA-N 493.326 5.116 5 20 JKBD Cc1ccc(OCc2nc(COC(=O)[C@@H](C)Oc3ccc(Cl)cc3[N+](=O)[O-])cs2)cc1 920778510 KTNRPPSIUBLZQX-CQSZACIVSA-N 462.911 5.103 5 20 JKBD O=C(Cc1cccc([N+](=O)[O-])c1)Nc1ccc(C2(NC(=O)c3cc4[nH]ccc4s3)CCC2)cc1 1785792024 PRAUNUOVTHAGQK-UHFFFAOYSA-N 474.542 5.128 5 20 JKBD O=C(/C=C/c1ccc([N+](=O)[O-])o1)Nc1ccc(C2(NC(=O)Cc3ccccc3Cl)CCC2)cc1 1786206186 BLZKAMNJRZPURP-ZRDIBKRKSA-N 479.920 5.231 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)c3cccc4ccoc34)CCC2)cc1)c1cccc(F)c1[N+](=O)[O-] 1790698546 DSBHNHWBZYGBFR-UHFFFAOYSA-N 473.460 5.542 5 20 JKBD CC1=CC[C@@H](C(=O)NC2(c3ccc(NC(=O)c4cccc(F)c4[N+](=O)[O-])cc3)CCC2)CC1 1790701649 ZWPXCSTZFQKHMZ-QGZVFWFLSA-N 451.498 5.228 5 20 JKBD CC(C)[C@H](C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cc(F)cc([N+](=O)[O-])c2)[nH]n1)c1ccccc1 1814931321 HNDPQUYUVMIITJ-VWNXMTODSA-N 493.539 5.203 5 20 JKBD Cc1cc(C(=O)N2CCC([C@@H]3CCCCN3C(=O)[C@@H]3CCC[C@@H]4CCCC[C@H]43)CC2)ncc1[N+](=O)[O-] 1828459447 CTQGNOOVDRMJOB-QSHYMPABSA-N 496.652 5.138 5 20 JKBD O=C(Cc1cccc([N+](=O)[O-])c1)N1CCC([C@@H]2CCCCN2C(=O)c2cc3sccc3s2)CC1 1828547371 RCYXFANJUIZNJJ-FQEVSTJZSA-N 497.642 5.347 5 20 JKBD O=C(c1cccc2ccncc12)N1CCC([C@H]2CCCCN2C(=O)/C=C/c2ccccc2[N+](=O)[O-])CC1 1832904856 ZBEDNMVKWWDFCZ-TYBKAHOSSA-N 498.583 5.090 5 20 JKBD Cc1ccc(-c2csc3nc(SCC(=O)Nc4c(C)cccc4[N+](=O)[O-])n(C)c(=O)c23)cc1C 10792804 CRBCNAWGJSVKGB-UHFFFAOYSA-N 494.598 5.226 5 20 JKBD Cc1ccc(NC(=O)[C@@H](Sc2nnc(/C=C/c3ccc(C)o3)[nH]2)c2ccccc2)c([N+](=O)[O-])c1 12839567 QOTJJYKMIZKFFZ-SDNYCIMKSA-N 475.530 5.565 5 20 JKBD Cc1c(NC(=O)c2ccc(OCC(=O)Nc3cccc(C(F)(F)F)c3)cc2)cccc1[N+](=O)[O-] 15790810 HAAGVIJIAPGASQ-UHFFFAOYSA-N 473.407 5.192 5 20 JKBD Cc1sc2nc(SCc3cc([N+](=O)[O-])cc4c3OCOC4)n(C3CCCC3)c(=O)c2c1C 22206529 ICVBOOYUEFNQSB-UHFFFAOYSA-N 473.576 5.257 5 20 JKBD Cc1ccccc1-c1nn(-c2ccccc2)cc1C(=O)OCc1nnc(-c2ccc([N+](=O)[O-])cc2)o1 23582597 ZOTSUMKIHWLBAL-UHFFFAOYSA-N 481.468 5.163 5 20 JKBD CC(=O)Nc1ccc(NC(=O)c2ccccc2NC(=O)c2ccc([N+](=O)[O-])cc2Cl)cc1Cl 25610570 YIYRIUHUINPORP-UHFFFAOYSA-N 487.299 5.365 5 20 JKBD CCCn1c(SCCC(=O)Nc2ccc(OC)cc2[N+](=O)[O-])nnc1-c1ccc(Cl)cc1 26224670 CXKJRDBVMTUREG-UHFFFAOYSA-N 475.958 5.046 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Cl)[C@@H](Nc1cccc(Cn2cccn2)c1)c1ccccc1 27012928 JVHGQCAILOGRRK-QHCPKHFHSA-N 461.909 5.285 5 20 JKBD CC(=O)c1ccc(Sc2nnc([C@@H](C)N3CCCCC3)n2-c2ccccc2)c([N+](=O)[O-])c1 29004780 GDVQPGITMREOTD-MRXNPFEDSA-N 451.552 5.076 5 20 JKBD CN(Cc1ccccc1NC(=O)c1ccc([N+](=O)[O-])cc1I)C1CCCCC1 72068715 SNLVLYMVTVXOAJ-UHFFFAOYSA-N 493.345 5.216 5 20 JKBD Cc1cc(C)n([C@@H](C)C(=O)Nc2ccc(NC(=O)c3cc([N+](=O)[O-])ccc3Cl)cc2Cl)n1 109143671 VXWMQKHBEHDCMQ-ZDUSSCGKSA-N 476.320 5.167 5 20 JKBD C[C@@H](NC(=O)Cn1ccc2cc([N+](=O)[O-])ccc21)c1ccc(NC(=O)Nc2ccccc2)cc1 109347379 GKONHTFQCUNVJR-QGZVFWFLSA-N 457.490 5.071 5 20 JKBD Cc1ccc(OCCCC(=O)Nc2ccc(CNC(=O)c3c[nH]c4cc([N+](=O)[O-])ccc34)cc2)cc1 482218455 WZOBBDARORHBMO-UHFFFAOYSA-N 486.528 5.112 5 20 JKBD O=C(C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)NC[C@H]1Cc2ccccc2O1 482657776 LSLOFVHTOZPCFP-UBXANZILSA-N 471.538 5.255 5 20 JKBD CC(C)c1nc(-c2ccccc2NC(=O)c2ccc(N3C[C@@H](C)C[C@H](C)C3)c([N+](=O)[O-])c2)n[nH]1 492615428 WJEPNEYHAUUZGS-IRXDYDNUSA-N 462.554 5.238 5 20 JKBD COc1cc(C(=O)Nc2nc(-c3c(F)cc(F)cc3F)c(C)s2)c([N+](=O)[O-])cc1OC(F)F 504728320 BNDBTACOZGJGTN-UHFFFAOYSA-N 489.378 5.306 5 20 JKBD Cc1ncc(CNC(=O)c2ccccc2Sc2ccc(C(F)(F)F)cc2[N+](=O)[O-])s1 509867040 QBKGPYACNYKQOP-UHFFFAOYSA-N 453.467 5.460 5 20 JKBD Cc1c(NC(=O)c2cc3cc([N+](=O)[O-])ccc3o2)cccc1C(=O)N1CCc2sccc2C1 514433331 KITSMJGSXLGQND-UHFFFAOYSA-N 461.499 5.162 5 20 JKBD CN(Cc1cscn1)C(=O)c1c2c(nc3ccccc13)/C(=C/c1cccc([N+](=O)[O-])c1)CCC2 517900380 YICROYPKPJLLFN-LDADJPATSA-N 470.554 5.749 5 20 JKBD CC[C@H](C)c1ccc([C@H](NC(=O)CNC(=O)c2c(Cl)cccc2[N+](=O)[O-])c2cccs2)cc1 520816613 ZSGWUWBYCYTYPP-WNSKOXEYSA-N 485.993 5.459 5 20 JKBD O=C(Nc1nnc(SCc2ccc(F)cc2)s1)c1csc(-c2cccc([N+](=O)[O-])c2)n1 522093810 BEOWZPSGLFYSPP-UHFFFAOYSA-N 473.536 5.254 5 20 JKBD COc1ccc([N+](=O)[O-])cc1NC(=O)CSc1ncnc2scc(-c3ccc(C)cc3)c12 591887637 RUSITRKWRMDNGT-UHFFFAOYSA-N 466.544 5.314 5 20 JKBD COc1ccc([N+](=O)[O-])cc1NC(=O)c1ccccc1SCc1ccc(Br)cc1 603732721 SEFQTMGCKUBUKD-UHFFFAOYSA-N 473.348 5.911 5 20 JKBD CC(C)Oc1ccccc1[C@H](C)N[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1 603954769 HXFJVRFPSVDZPB-BXKMTCNYSA-N 467.953 6.066 5 20 JKBD CCOc1ccc(C(=O)Nc2ccc(C(=O)N(C)C3CCCCC3)c(Cl)c2)cc1[N+](=O)[O-] 603982359 IDMCPFRGOLKRSJ-UHFFFAOYSA-N 459.930 5.304 5 20 JKBD CC1CCN(c2ccc(C(=O)Nc3cccc(C(=O)N(C)c4ccccc4)c3)cc2[N+](=O)[O-])CC1 603991452 ROEDDSPJQSSLNZ-UHFFFAOYSA-N 472.545 5.360 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Cl)N1CCC[C@@H](c2nc(-c3ccc(Cl)cc3)no2)C1 608838092 BQBJMBQYGWFBGS-CYBMUJFWSA-N 462.293 5.363 5 20 JKBD C[C@H](Nc1ccc(C(=O)Nc2ccccc2SC(F)(F)F)cc1[N+](=O)[O-])c1ccccn1 726534392 AFBAEWKASUWUQK-ZDUSSCGKSA-N 462.453 6.027 5 20 JKBD CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccc(N2CCc3sccc3C2)cc1 729039695 QMMQQWUKICNTCY-UHFFFAOYSA-N 450.564 5.662 5 20 JKBD O=C(O[C@@H](C(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1)c1ccccc1)c1cnc(C2CC2)s1 729771949 BDAYJPKDMREVCL-GOSISDBHSA-N 457.895 5.119 5 20 JKBD O=[N+]([O-])c1ccc2nc(Sc3nnc(CN4CCCCC4)n3-c3ccc(F)cc3)sc2c1 731208369 DEFXUHRPOYWPEY-UHFFFAOYSA-N 470.555 5.061 5 20 JKBD Cc1ccc(F)c(NC(=S)/C(=C(/O)c2ccc([N+](=O)[O-])cc2)[n+]2ccc3c(c2)CCCC3)c1 744115879 IYAQRCYRZORIIF-UHFFFAOYSA-O 464.542 5.532 5 20 JKBD CCOC(=O)Nc1nc2ccc(NC(=O)c3csc(-c4ccc([N+](=O)[O-])cc4)n3)cc2s1 747652268 COOUIKDNUGGBCD-UHFFFAOYSA-N 469.504 5.149 5 20 JKBD CCc1cccc(CC)c1NC(=O)[C@@H](C)OC(=O)c1csc(-c2cccc([N+](=O)[O-])c2)n1 747962870 VPEXNSVTXWTPGW-CQSZACIVSA-N 453.520 5.027 5 20 JKBD C[C@H](OC(=O)c1csc(-c2cccc([N+](=O)[O-])c2)n1)c1ccccc1NC(=O)c1ccccc1 748021012 IUXPTTLQUUPDHG-INIZCTEOSA-N 473.510 5.889 5 20 JKBD CCN(C(=O)[C@H](C)OC(=O)c1ccccc1C(=O)c1ccc(SC)c([N+](=O)[O-])c1)c1ccccc1 777420936 OGSGJTNVMPZWSY-KRWDZBQOSA-N 492.553 5.146 5 20 JKBD CCOc1cc(/C=C(\C(=O)OCC(=O)Nc2cc(Cl)ccc2[N+](=O)[O-])c2ccccc2)ccc1O 786193504 WMLZPDCTOYAWIF-UNOMPAQXSA-N 496.903 5.075 5 20 JKBD CCN(C)Cc1cc(O[C@@H]2CCN(Cc3ccc(-c4ccc([N+](=O)[O-])cc4Cl)o3)C2)ccn1 856555260 YXFABJMENVAMLF-OAQYLSRUSA-N 470.957 5.008 5 20 JKBD CCOC(=O)c1sc(NC(=O)c2ccccc2NC(=O)c2ccc([N+](=O)[O-])cc2Cl)cc1C 863949434 HOPOIRBSMHZCBJ-UHFFFAOYSA-N 487.921 5.299 5 20 JKBD C[C@@H](Oc1ccc(Cl)cc1[N+](=O)[O-])c1nc(-c2ccc(-n3cnc4ccccc43)nc2)no1 904488751 RXTMVBWOQGELAW-CYBMUJFWSA-N 462.853 5.172 5 20 JKBD Cc1ccc(NC(=O)[C@@H](OC(=O)c2cc(C)n(Cc3ccccn3)c2C)c2ccccc2)c([N+](=O)[O-])c1 914613454 HCZKSSHDSKRJKR-SANMLTNESA-N 498.539 5.302 5 20 JKBD C[C@H](OC(=O)c1cccc(OCc2cccs2)c1)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl 915463875 ASRLEJLTCWUHKQ-ZDUSSCGKSA-N 460.895 5.073 5 20 JKBD CCN(Cc1cccc(NC(=O)c2cc3ccccc3c3cccnc23)c1)C(=O)C(F)(F)F 915858573 RCPSCKLWXQASGH-UHFFFAOYSA-N 451.448 5.551 5 20 JKBD Cc1c(C(=O)Nc2ccc(C(=O)N(C)C3CCCCC3)c(Cl)c2)cc([N+](=O)[O-])cc1[N+](=O)[O-] 917754643 FREUPGLBBSSNRQ-UHFFFAOYSA-N 474.901 5.122 5 20 JKBD C[C@H]1CCCCN1C(=O)c1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2N2CCCCC2)cc1Cl 917761064 FXMSCNISQPAJFO-KRWDZBQOSA-N 484.984 5.505 5 20 JKBD Cc1ccccc1-c1cc(C(=O)OCc2nc(-c3ccc([N+](=O)[O-])cc3)no2)c2cnn(C(C)C)c2n1 919045605 AKBVZVPSCPSMCD-UHFFFAOYSA-N 498.499 5.303 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)c3cccc(F)c3[N+](=O)[O-])CCC2)cc1)c1ccc(C(F)(F)F)[nH]1 1789674271 KPKOJNWHBHVHTO-UHFFFAOYSA-N 490.413 5.142 5 20 JKBD O=C(Cc1cccc([N+](=O)[O-])c1)NC1(c2ccc(NC(=O)c3cnc(Cl)c(Cl)c3)cc2)CCC1 1789738044 RARYUQWGNXSMHD-UHFFFAOYSA-N 499.354 5.287 5 20 JKBD O=C(/C=C/c1ccc([N+](=O)[O-])o1)NC1(c2ccc(NC(=O)c3cc(-c4ccccc4)[nH]n3)cc2)CCC1 1790124472 FHJVPCKLWQNCDO-ACCUITESSA-N 497.511 5.039 5 20 JKBD COc1cccc(C(=O)Nc2ccc(C3(NC(=O)/C=C/c4ccccc4[N+](=O)[O-])CCC3)cc2)c1 1790273972 QKKYXDXQHYPJIU-XNTDXEJSSA-N 471.513 5.065 5 20 JKBD Cc1ccc(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)c3cc(F)cc([N+](=O)[O-])c3)n[nH]2)cc1Cl 1821163343 LHKNOHTVLJEFQJ-HXUWFJFHSA-N 485.903 5.039 5 20 JKBD O=C(c1ccccc1C1CC1)N1CCC([C@@H]2CCCCN2C(=O)CCc2cccc([N+](=O)[O-])c2)CC1 1824841849 CBMIVWWHXWBFIX-MHZLTWQESA-N 489.616 5.338 5 20 JKBD CC(C)CCC(=O)N1CCC([C@@H]2CCCCN2C(=O)C2(c3cccc([N+](=O)[O-])c3)CCC2)CC1 1830295295 NSXRKQXEPUJIHG-DEOSSOPVSA-N 469.626 5.072 5 20 JKBD CCn1c(S[C@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2C(F)(F)F)nnc1-c1ccc(Cl)cc1 9071805 PDIOJZIPDPIRFC-LLVKDONJSA-N 499.902 5.665 5 20 JKBD CCc1ccccc1NC(=O)COC(=O)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])c(OC)c1 10912044 ZVGLZQXGMCMISG-UHFFFAOYSA-N 484.892 5.407 5 20 JKBD O=C(OCC(=O)N1N=C(c2ccc(Cl)cc2)C[C@H]1c1ccco1)c1ccc([N+](=O)[O-])cc1Cl 11029102 YJLBFBYZSCJXQB-IBGZPJMESA-N 488.283 5.029 5 20 JKBD COc1ccc([N+](=O)[O-])cc1NC(=O)[C@@H](C)OC(=O)c1ccccc1-c1ncc(-c2ccccc2)o1 19164837 LYWIDDBHIDFLNJ-MRXNPFEDSA-N 487.468 5.109 5 20 JKBD Cc1occc1-c1nnc(SCC(=O)Nc2cc([N+](=O)[O-])ccc2Cl)n1-c1ccccc1 22033467 PSTKTIZPBHCQAF-UHFFFAOYSA-N 469.910 5.128 5 20 JKBD CSc1ccc(C(=O)c2ccccc2C(=O)Nc2ccc(NC(C)=O)c(Cl)c2)cc1[N+](=O)[O-] 26711895 YUHCPFCQDMTTRA-UHFFFAOYSA-N 483.933 5.412 5 20 JKBD Cc1ccc(N2C(=O)CC[C@H](C(=O)Nc3cc([N+](=O)[O-])ccc3F)[C@H]2c2cccs2)cc1 57564589 XFLDMDULLDKLLJ-JTSKRJEESA-N 453.495 5.227 5 20 JKBD COc1cc(C(=O)N(C[C@H]2CCCO2)[C@@H]2CCSC2)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 106000823 SSDGGHHCFRQYFU-QZTJIDSGSA-N 492.981 5.176 5 20 JKBD C[C@@H](Nc1ccc(C(=O)N2CCC(Oc3ccc(F)cc3F)CC2)cc1[N+](=O)[O-])c1ccccn1 195609571 VIWGFLJWTNCFDX-MRXNPFEDSA-N 482.487 5.125 5 20 JKBD Cc1ccc(NC(=O)c2cc3ccccc3c3cccnc23)cc1NC(=O)CN1CCCCC1 303087397 YDRGLWLLIGRAAG-UHFFFAOYSA-N 452.558 5.373 5 20 JKBD COc1ccc(Oc2ccc(Cl)cc2NC(=O)c2cc(SC)c(OC)cc2[N+](=O)[O-])cc1 482344628 VYSRRRBUOKYQPG-UHFFFAOYSA-N 474.922 6.032 5 20 JKBD C[C@@H]1CCCN(c2ccc(C(=O)Nc3ccc(-n4cccn4)cc3C(F)(F)F)cc2[N+](=O)[O-])C1 482364745 OGVROKNFYKALMK-OAHLLOKOSA-N 473.455 5.288 5 20 JKBD Cc1csc(Sc2ccc(C(=O)N3CCC[C@H](CN4CCCCCC4)C3)cc2[N+](=O)[O-])n1 487836805 FGHQKLPUUKLAOF-GOSISDBHSA-N 474.652 5.239 5 20 JKBD CN(C[C@@H]1OCCc2ccccc21)C(=O)C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1 506266961 ADZFEYCNWPFKOT-CCOQBKANSA-N 499.592 5.908 5 20 JKBD C[C@H](Nc1ccc(NC(=O)c2ccc([N+](=O)[O-])cc2I)cc1)c1ccccc1 511677565 NCVAKIRGYZXHCW-AWEZNQCLSA-N 487.297 5.625 5 20 JKBD COCCN(C(=O)CCc1ccc(-c2ccccc2)[nH]1)c1nc(-c2ccc([N+](=O)[O-])cc2)cs1 512384140 KVAVPXACUCLYSB-UHFFFAOYSA-N 476.558 5.326 5 20 JKBD CC[C@H](C)NC(=O)c1ccc(NC(=O)c2ccc(Sc3nc(C)cs3)c([N+](=O)[O-])c2)cc1 512695603 VOGIEECJSNVFMH-ZDUSSCGKSA-N 470.576 5.292 5 20 JKBD CC(=O)N(c1ccc(C)cc1)c1nc(/C=C/c2nc3cc([N+](=O)[O-])ccc3n2-c2ccccc2)cs1 515598242 KIDYOTSRYOZOIC-XNTDXEJSSA-N 495.564 6.554 5 20 JKBD C[C@@H](Nc1ccc(C(=O)NCc2nc3cc(Cl)ccc3s2)cc1[N+](=O)[O-])c1ccccn1 518855569 NBJMDWJGIYFPOR-CYBMUJFWSA-N 467.938 5.356 5 20 JKBD CC[C@H](C)NC(=O)c1ccc(NC(=O)c2ccc(N[C@@H](C)c3ccccn3)c([N+](=O)[O-])c2)c(C)c1 519027628 WVGXDOPTOHVQTR-ROUUACIJSA-N 475.549 5.252 5 20 JKBD C[C@H](Nc1ccc(C(=O)N(CCc2ccccc2)Cc2cccnc2)cc1[N+](=O)[O-])c1ccccn1 524022604 UQGDNLVWKHUVMG-NRFANRHFSA-N 481.556 5.443 5 20 JKBD COc1ccc(-c2ccc(/C=C3/CN(C)Cc4c3nc3ccccc3c4C(=O)O)o2)c([N+](=O)[O-])c1 603781558 UGDPEDODAQDUMP-PTNGSMBKSA-N 471.469 5.096 5 20 JKBD COc1cc(C(=O)Nc2ccc(Sc3nc(C)cs3)cc2)c([N+](=O)[O-])cc1OC(F)F 604117581 WWXUALMWTQKKGX-UHFFFAOYSA-N 467.475 5.373 5 20 JKBD O=C(NCC1(c2ccc(Br)cc2)CCC1)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-] 604200976 UVUWGXTYRXNBHP-UHFFFAOYSA-N 487.272 5.150 5 20 JKBD Cc1noc(CCCNC(=O)c2c3c(nc4ccccc24)/C(=C\c2cccc([N+](=O)[O-])c2)CCC3)n1 608965772 LSVQOPNDSGZNAJ-CYVLTUHYSA-N 483.528 5.074 5 20 JKBD Cc1nn(CCC(=O)Nc2ccc(Oc3ccnc4cc(Cl)ccc34)c(F)c2)c(C)c1[N+](=O)[O-] 609066629 RSHJUUVJYWMCNU-UHFFFAOYSA-N 483.887 5.570 5 20 JKBD COc1cc(C(=O)OCc2csc(N(C(C)=O)c3c(C)cc(C)cc3Cl)n2)ccc1[N+](=O)[O-] 725946462 STAVAIFGDPRYNP-UHFFFAOYSA-N 489.937 5.372 5 20 JKBD Cc1ccc(NC(=O)[C@@H]2CCc3ccccc3N2C(=O)c2cc([N+](=O)[O-])c(C)c([N+](=O)[O-])c2C)cc1 727056245 NSRRYFWIOPPQAB-QFIPXVFZSA-N 488.500 5.029 5 20 JKBD C[C@@H](OC(=O)c1c(Cl)cccc1[N+](=O)[O-])C(=O)N1c2ccccc2Sc2ccccc21 730643222 OLYPUJGCZVPYLT-CYBMUJFWSA-N 454.891 5.623 5 20 JKBD COCCc1ccc(Oc2ccc(NC(=O)c3cc([N+](=O)[O-])ccc3Br)cc2)cc1 730984186 WNPIUFZFSDZSAG-UHFFFAOYSA-N 471.307 5.591 5 20 JKBD CCc1ccccc1NC(=S)/C(=C(/O)c1ccc(C)c([N+](=O)[O-])c1)[n+]1ccc(C(CC)CC)cc1 731122801 WFRXHYAVMLXNHV-UHFFFAOYSA-O 490.649 6.980 5 20 JKBD COc1ccc(NC(=O)c2cc(F)ccc2[N+](=O)[O-])cc1NC(=O)c1ccc(Cl)cc1F 751100450 POPCXCVLIGCRDK-UHFFFAOYSA-N 461.808 5.040 5 20 JKBD CCCOc1cc(NC(=O)c2ccc(C3SCCCS3)cc2)c([N+](=O)[O-])cc1OCCC 790521323 MYHHDAYPNWDWCD-UHFFFAOYSA-N 476.620 6.293 5 20 JKBD CC(C)n1c2ccccc2n2c(S[C@H](C)C(=O)Nc3ccc([N+](=O)[O-])cc3C(F)(F)F)nnc12 847219323 ISARBXLPLIIXEZ-GFCCVEGCSA-N 492.483 5.311 5 20 JKBD Cc1csc(Sc2ccc(C(=O)OCc3nnc(-c4ccccc4Cl)o3)cc2[N+](=O)[O-])n1 849119957 FGDIPLPBRQAWDW-UHFFFAOYSA-N 488.934 5.571 5 20 JKBD CC(C)(c1nc(-c2ccc(Oc3ncc(C(F)(F)F)cc3Cl)cc2)no1)n1cc([N+](=O)[O-])cn1 904669587 CGYXVHVEPACHCU-UHFFFAOYSA-N 494.817 5.484 5 20 JKBD C[C@H](OC(=O)/C=C\c1ccc2ccc(Cl)cc2n1)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 912874655 YNSMKVLOLXKETC-PWWFUAJNSA-N 493.825 5.399 5 20 JKBD CC(C)c1c(C(=O)O[C@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)cnn1-c1ccc(Cl)cc1 913378808 NBNIJDQYMAMASR-CQSZACIVSA-N 481.896 5.525 5 20 JKBD O=C(Nc1ccc(Cl)c([N+](=O)[O-])c1)[C@@H]1CCCN(C(=O)c2ccc(Cl)c(Cl)c2)C1 914838149 CZVBCBUBRGRFEW-GFCCVEGCSA-N 456.713 5.046 5 20 JKBD CCCc1cc[n+](/C(C(=S)Nc2ccccc2C(F)(F)F)=C(/O)c2cccc([N+](=O)[O-])c2)cc1 916202127 CKWATYOPIYKTCC-UHFFFAOYSA-O 488.511 6.177 5 20 JKBD Cc1ccc(/C(O)=C(/C(=S)Nc2ccccc2C(F)(F)F)[n+]2ccccc2)cc1[N+](=O)[O-] 916202388 ZYJICCCUEYAVFO-UHFFFAOYSA-O 460.457 5.533 5 20 JKBD COc1ccc(C)cc1NC(=O)c1cc2ccccc2cc1OC(=O)Cc1ccc([N+](=O)[O-])cc1 916877923 IWOZECSXSRGSHW-UHFFFAOYSA-N 470.481 5.465 5 20 JKBD C[C@@H](OC(=O)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-])C(=O)Nc1ccccc1-c1ccccc1 919195591 IHRSCUUMKJWBQW-OAHLLOKOSA-N 488.418 5.387 5 20 JKBD CC(=O)N(c1nc(COC(=O)c2cc3cc([N+](=O)[O-])ccc3[nH]2)cs1)c1c(C)cc(C)cc1C 919515850 BTCCTMPZVFUKFK-UHFFFAOYSA-N 478.530 5.499 5 20 JKBD O=C(/C=C/c1ccc([N+](=O)[O-])o1)Nc1ccc(C2(NC(=O)c3cc(F)cc(F)c3F)CCC2)cc1 1786208024 FYCKAFASSXIDDY-SOFGYWHQSA-N 485.418 5.066 5 20 JKBD Cc1c(C(=O)NC2(c3ccc(NC(=O)C4CCC(CO)CC4)cc3)CCC2)cc(Cl)cc1[N+](=O)[O-] 1786700649 DLAZUDSHAMQLLA-UHFFFAOYSA-N 499.995 5.103 5 20 JKBD Cc1c(C(=O)Nc2ccc(C3(NC(=O)c4ccnn4C(C)C)CCC3)cc2)cc(Cl)cc1[N+](=O)[O-] 1790773892 JJIAWCMRQYLOJQ-UHFFFAOYSA-N 495.967 5.396 5 20 JKBD Cc1cc(C(=O)NC2(c3ccc(NC(=O)c4cc(Cl)cc([N+](=O)[O-])c4C)cc3)CCC2)ccn1 1790774920 VKZKYRWUGFDAKY-UHFFFAOYSA-N 478.936 5.322 5 20 JKBD Cc1c(C(=O)NC2(c3ccc(NC(=O)[C@H]4[C@H]5SC=C[C@H]54)cc3)CCC2)cc(Cl)cc1[N+](=O)[O-] 1791090122 AUUDHZQMZQDOKU-WMQCIHAUSA-N 483.977 5.179 5 20 JKBD O=C(NC1(c2ccc(NC(=O)[C@H]3CC[C@H](O)CC3)cc2)CCC1)c1cc2cc([N+](=O)[O-])ccc2s1 1791704525 WWKOPNZAWRUWKU-OQIWPSSASA-N 493.585 5.108 5 20 JKBD C[C@@H](C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc2cc([N+](=O)[O-])ccc2s1)c1ccc(Cl)cc1 1801206187 TUKSSSNMTKWUKZ-PPRPKMEESA-N 498.004 5.518 5 20 JKBD CC[C@H](C)CC(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cccc(Br)c2[N+](=O)[O-])CC1 1824346644 JWRWVRPHWNGRTI-JXFKEZNVSA-N 494.430 5.027 5 20 JKBD Cc1cscc1C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)CC1 1827809246 OCKIOIOLFBRRMT-OAQYLSRUSA-N 497.642 5.727 5 20 JKBD CCCCC[C@H](C)C(=O)N1CCC([C@@H]2CCCCN2C(=O)Cc2ccc([N+](=O)[O-])cc2F)CC1 1831294844 RZASYPQCPWWKHA-CYFREDJKSA-N 475.605 5.113 5 20 JKBD COC(=O)c1cc(C(=O)Nc2nnc(SCc3c(Cl)cccc3Cl)s2)cc([N+](=O)[O-])c1 14582314 BLKJTKZZKDYSTK-UHFFFAOYSA-N 499.357 5.084 5 20 JKBD Cc1cccc(-c2nnc([C@@H](C)OC(=O)c3ccc(NCc4ccccc4)c([N+](=O)[O-])c3)o2)c1 17656717 VPPMABQFCYWVJD-QGZVFWFLSA-N 458.474 5.483 5 20 JKBD C[C@H](Sc1nnc(-c2ccc(C(C)(C)C)cc2)n1C)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl 21138247 GOQUZYUASNDWNG-ZDUSSCGKSA-N 473.986 5.461 5 20 JKBD C[C@@H](OC(=O)c1ccc(COc2ccc3ccccc3c2)o1)C(=O)Nc1ccccc1[N+](=O)[O-] 25049905 MHYLHSYLGZSQNZ-MRXNPFEDSA-N 460.442 5.104 5 20 JKBD CCc1cccc(CC)c1NC(=O)[C@@H](C)Sc1nc2cc3ccccc3cc2c(=O)n1CC 26581072 LCGHMMKUJIJDRA-QGZVFWFLSA-N 459.615 5.814 5 20 JKBD Cc1ccccc1-c1nnc(S[C@@H](C(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)c2ccccc2)n1C 36801950 GJPPYSRELFIHFK-OAQYLSRUSA-N 493.976 5.824 5 20 JKBD C[C@H](NC(=O)c1ccccc1NC(=O)c1ccc([N+](=O)[O-])cc1Cl)c1cccc(OC(F)F)c1 72009745 FUACJCMOOHGJAG-ZDUSSCGKSA-N 489.862 5.593 5 20 JKBD O=C(Cn1c2ccccc2c(=O)c2ccccc21)Nc1cccc(OCc2cn3ccccc3n2)c1 78449977 FGGWRHONCDIIAQ-UHFFFAOYSA-N 474.520 5.020 5 20 JKBD CCN(CC)Cc1ccccc1CNC(=O)c1ccccc1NC(=O)c1ccc([N+](=O)[O-])cc1Cl 105049860 PCJWSVSJCYTJSQ-UHFFFAOYSA-N 494.979 5.272 5 20 JKBD C[C@H](Nc1ccc(C(=O)N2CCC(c3c[nH]c4ncccc34)CC2)cc1[N+](=O)[O-])c1ccccn1 108830623 IFCKYQISQCPORI-KRWDZBQOSA-N 470.533 5.059 5 20 JKBD CCc1ccc(N(C(=O)c2cc([N+](=O)[O-])cc(S(C)(=O)=O)c2)c2nc3ccccc3s2)cc1 109024878 QUMAGGNWHMZDEW-UHFFFAOYSA-N 481.555 5.149 5 20 JKBD CCCOc1cc(NC(=O)c2cc(C3CC3)nc3onc(C)c23)c([N+](=O)[O-])cc1OCCC 115467831 HLJSOFPXEPJUTP-UHFFFAOYSA-N 454.483 5.147 5 20 JKBD C[C@H](Nc1ccc(C(=O)NCCc2cc(Cl)cc(Cl)c2)cc1[N+](=O)[O-])c1ccccn1 303071787 XJXWNGGZUKLQTK-AWEZNQCLSA-N 459.333 5.442 5 20 JKBD C[C@@H]1CCCN(c2ccc(C(=O)Nc3ccc(NC(=O)N4CCCCCC4)cc3)cc2[N+](=O)[O-])C1 498532183 QJSAPTOGJFJJFT-LJQANCHMSA-N 479.581 5.491 5 20 JKBD NC(=O)c1ccc(F)c(NC(=O)c2c3c(nc4ccccc24)/C(=C\c2cccc([N+](=O)[O-])c2)CCC3)c1 515297649 GFRRDSNQJFYODY-LGMDPLHJSA-N 496.498 5.510 5 20 JKBD COc1cc(C(=O)NC(c2ccc(Cl)cc2)c2ccc(Cl)cc2)c([N+](=O)[O-])cc1OC 515634934 WCOLEBPCXIGMBB-UHFFFAOYSA-N 461.301 5.438 5 20 JKBD Cc1cc(=O)c(C(=O)Nc2ccccc2Oc2ccc(Cl)cc2)nn1-c1ccccc1[N+](=O)[O-] 517905982 KJKFUTPIXOLABM-UHFFFAOYSA-N 476.876 5.147 5 20 JKBD O=C(C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)N(C[C@@H]1CCOC1)C1CC1 520406106 AEMFYABUFPUHEQ-UZNZLNSGSA-N 463.559 5.163 5 20 JKBD CCN(CC)CCn1ccc2cc(NC(=O)c3ccc(Cn4nc(C)c([N+](=O)[O-])c4C)cc3)ccc21 522903802 ROZPLLBEFJVWCR-UHFFFAOYSA-N 488.592 5.005 5 20 JKBD COc1ccc(N(C)C(=O)c2ccc(Sc3nc4ccccc4s3)c([N+](=O)[O-])c2)cn1 524246418 QIXVUOAKFZVQSR-UHFFFAOYSA-N 452.517 5.036 5 20 JKBD COc1cc(C(=O)N[C@@H](c2ccc3c(c2)CCCC3)c2cccs2)c([N+](=O)[O-])cc1OC(F)F 585708102 UHKJYKSFSHRUPQ-QFIPXVFZSA-N 488.512 5.665 5 20 JKBD CSc1ccc([N+](=O)[O-])c(C(=O)Nc2cc(-c3nnc4n3CCCCC4)ccc2Cl)c1 591773363 IZORJOIKTLWRHM-UHFFFAOYSA-N 457.943 5.207 5 20 JKBD Cc1nc(-c2ccccc2)sc1CN[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1 608981464 SCBBBLOOARWSBN-HSZRJFAPSA-N 492.988 6.150 5 20 JKBD O=C(c1ccc(Sc2nc3ccccc3s2)c([N+](=O)[O-])c1)N1CCC[C@@H](n2ccnc2)C1 609130989 FHGBAMISNDIUKO-MRXNPFEDSA-N 465.560 5.030 5 20 JKBD O=C(Cc1csc(-c2cccc(C(F)(F)F)c2)n1)OCc1nnc(-c2ccc([N+](=O)[O-])cc2)o1 725969898 RRBZSGZSVZWDMZ-UHFFFAOYSA-N 490.419 5.073 5 20 JKBD O=C(Nc1ccc(OC(=O)[C@@H](OC2CCCC2)c2ccccc2)cc1)c1cc([N+](=O)[O-])ccc1Cl 726911170 LFNKREMIAHJHAW-DEOSSOPVSA-N 494.931 6.106 5 20 JKBD CC(C)N(Cc1nnc(-c2cccc([N+](=O)[O-])c2)o1)C(=O)/C=C/c1cccc(OC2CCCC2)c1 727661398 RPWOOKNPCZQPKI-BUHFOSPRSA-N 476.533 5.417 5 20 JKBD CC(C)[C@H](CC(=O)O[C@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F)c1ccccc1 728640646 XHJJYVLWJKSPBL-PBHICJAKSA-N 452.429 5.314 5 20 JKBD CC1=C(C(=O)Nc2ccc(C)cc2C)[C@H](c2ccc([N+](=O)[O-])cc2)NC(=O)N1Cc1cccs1 732018263 KNJZGBXHBNHHKD-QHCPKHFHSA-N 476.558 5.452 5 20 JKBD O=C(Cn1c2ccccc2c(=O)c2ccccc21)N(CC1CC1)c1ccc(Cl)c([N+](=O)[O-])c1 745344494 DMAQGHMJWFDMRZ-UHFFFAOYSA-N 461.905 5.160 5 20 JKBD Cc1ccc(-c2cc(C(=O)Nc3cc([N+](=O)[O-])c(F)cc3F)c3cnn(C(C)C)c3n2)s1 897593221 DACKFFOMPSMKKP-UHFFFAOYSA-N 457.462 5.488 5 20 JKBD CC(C)(C)OC(=O)Nc1cccc(-c2noc(-c3ccc([N+](=O)[O-])cc3Br)n2)c1 904633730 NKUSGRCKGGWCQU-UHFFFAOYSA-N 461.272 5.421 5 20 JKBD O=C(Nc1ccccc1SC[C@H]1CC1(Cl)Cl)c1ccn(-c2cccc([N+](=O)[O-])c2)n1 917752182 SSEDGUFRPAFGSP-CYBMUJFWSA-N 463.346 5.319 5 20 JKBD C[C@H](Nc1ccc(C(=O)Oc2ccc(C(=O)Nc3cccnc3)cc2)cc1[N+](=O)[O-])c1ccccn1 921008938 WJHPIWNAMOLEIZ-KRWDZBQOSA-N 483.484 5.029 5 20 JKBD O=C(NC1(c2ccc(NC(=O)C34CC(C(F)(F)F)(C3)C4)cc2)CCC1)c1cc(F)cc([N+](=O)[O-])c1 1786461827 YYUKWUBUJOZYOT-UHFFFAOYSA-N 491.441 5.214 5 20 JKBD Cc1cc(C(=O)Nc2ccc(C3(NC(=O)Cc4ccc(Cl)s4)CCC3)cc2)ncc1[N+](=O)[O-] 1788764195 BBQNKELWQSMLHB-UHFFFAOYSA-N 484.965 5.004 5 20 JKBD C[C@@H](Sc1ccccn1)C(=O)NC1(c2ccc(NC(=O)c3cccc(F)c3[N+](=O)[O-])cc2)CCC1 1790702776 YGPKWAATKSELHP-MRXNPFEDSA-N 494.548 5.057 5 20 JKBD Cc1ccc2[nH]cc(CC(=O)NC3(c4ccc(NC(=O)c5cc(O)cc([N+](=O)[O-])c5)cc4)CCC3)c2c1 1790754841 GDJOZBXPZWYGRP-UHFFFAOYSA-N 498.539 5.081 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)c3ccc(Cl)s3)CCC2)cc1)c1nc2cc([N+](=O)[O-])ccc2[nH]1 1790829412 PVSSSIDHFBOEMW-UHFFFAOYSA-N 495.948 5.248 5 20 JKBD COc1ccc(CC(=O)NC2(c3ccc(NC(=O)[C@@H](C)c4cccs4)cc3)CCC2)c([N+](=O)[O-])c1 1791814994 CXYDUKXNJJHNDM-KRWDZBQOSA-N 493.585 5.145 5 20 JKBD COc1cc(C(=O)Nc2ccc(C3(NC(=O)c4cc5ccccc5o4)CCC3)cc2)ccc1[N+](=O)[O-] 1792164713 RXMAQLFBXGZCAL-UHFFFAOYSA-N 485.496 5.411 5 20 JKBD Cc1nc(CC(=O)NC2(c3ccc(NC(=O)/C=C/c4ccccc4[N+](=O)[O-])cc3)CCC2)c(C)s1 1792315429 NYXAQWSMTDJQGG-MDWZMJQESA-N 490.585 5.058 5 20 JKBD CC1(C)CCC(CC(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)Cc2ccc(Cl)cc2[N+](=O)[O-])CC1 1793080343 TVXRDZBCDMKEBJ-WKCHPHFGSA-N 476.017 5.035 5 20 JKBD O=C(COC1CCCCC1)N1CCCC2(CCN(C(=O)c3cc4cc([N+](=O)[O-])ccc4s3)CC2)C1 1805272156 VGEJYHLEJPNRBH-UHFFFAOYSA-N 499.633 5.004 5 20 JKBD CCC1(C(=O)N2CC[C@@H](CNC(=O)c3cc4cc([N+](=O)[O-])ccc4s3)[C@@H]2c2cccnc2)CCC1 1812303982 SYNQOORFPZIQBB-MBSDFSHPSA-N 492.601 5.104 5 20 JKBD CC(C)(C)CCCCCC(=O)NC[C@@H]1CCN(C(=O)c2cc(O)cc([N+](=O)[O-])c2)[C@H]1c1cccnc1 1812808792 JATGNCRLLFBOCV-CPJSRVTESA-N 496.608 5.012 5 20 JKBD O=C(CCc1cccc([N+](=O)[O-])c1)Nc1cc([C@H]2CCCCN2C(=O)/C=C/C2CCCCC2)[nH]n1 1815538199 AJMKTANGFQGKFJ-SERSOLAASA-N 479.581 5.079 5 20 JKBD Cc1c(C(=O)Nc2cc([C@H]3CCCCN3C(=O)C3CC(C)(C)C3)[nH]n2)cc(Cl)cc1[N+](=O)[O-] 1821292143 BAXIWCFQJDMVRE-GOSISDBHSA-N 473.961 5.022 5 20 JKBD Cc1cc(Cl)ccc1C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cccc(F)c2[N+](=O)[O-])CC1 1823911957 HHUFPGKGVKPXDJ-QFIPXVFZSA-N 487.959 5.243 5 20 JKBD C[C@@]1(C(=O)N2CCC([C@H]3CCCCN3C(=O)Cc3ccc(Cl)cc3[N+](=O)[O-])CC2)CC=CCC1 1824159113 SODXDRCZUGMABV-ATIYNZHBSA-N 488.028 5.157 5 20 JKBD CC(C)(C)C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)CC1 1831061451 SRLOVUNSXMVLFI-LJQANCHMSA-N 457.596 5.089 5 20 JKBD C[C@@H](CC(=O)N1CCCC[C@H]1C1CCN(C(=O)Cc2cc(F)ccc2[N+](=O)[O-])CC1)c1ccccc1 1831509651 FNNJOEZHXPKRFV-CPJSRVTESA-N 495.595 5.090 5 20 JKBD CC1(C)CCC(CC(=O)N2CCCC23CN(C(=O)c2cc4cc([N+](=O)[O-])ccc4s2)C3)CC1 1845258602 FUYUJURWBFLOEQ-UHFFFAOYSA-N 469.607 5.233 5 20 JKBD Cc1nc(SCC(=O)Nc2ccc([N+](=O)[O-])cc2Br)n(C2CCCCC2)c1C 22215929 JFDIWZWXIBNZGM-UHFFFAOYSA-N 467.389 5.407 5 20 JKBD Cc1c(NC(=O)[C@H](C)Sc2nnc([C@@H](C)N3CCCCC3)n2-c2ccccc2)cccc1[N+](=O)[O-] 25002304 ARZUFLXLJRGSKH-MOPGFXCFSA-N 494.621 5.150 5 20 JKBD CC(C)NC(=O)Nc1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2Sc2ccccc2)cc1 27096229 ZHUYTMVERYQUMJ-UHFFFAOYSA-N 450.520 5.528 5 20 JKBD O=C(O[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Br)c1ccccc1)c1cccc(F)c1 28300843 RMDWPWWEPWKZLD-LJQANCHMSA-N 473.254 5.033 5 20 JKBD C[C@@H](Sc1nnc(-c2ccc(Cl)cc2)n1Cc1ccccc1)C(=O)Nc1ccccc1[N+](=O)[O-] 45266984 KFOLVASNOOYVCT-MRXNPFEDSA-N 493.976 5.674 5 20 JKBD CC[C@H](C)Sc1ccc(NC(=O)c2cc([N+](=O)[O-])cc(S(C)(=O)=O)c2)c(C(F)(F)F)c1 68813044 MHTBSUAJIXDMKY-NSHDSACASA-N 476.498 5.160 5 20 JKBD O=C(Nc1ccc2c(c1)CCC(=O)N2Cc1ccc(Cl)cc1)c1ccc(Cl)cc1[N+](=O)[O-] 72045392 QEUQVEJBJQNALT-UHFFFAOYSA-N 470.312 5.633 5 20 JKBD C[C@@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)NCc1ccccc1-c1ccc(Cn2cccn2)cc1 110621594 TXBOXWFJJQDGHH-LJQANCHMSA-N 472.570 5.304 5 20 JKBD C[C@H]1CCCN(Cc2ccc(CNC(=O)c3ccc(N[C@H](C)c4ccccn4)c([N+](=O)[O-])c3)cc2)C1 247939554 UIYLXQASYYWGKS-LEWJYISDSA-N 487.604 5.325 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)Nc2ccc(Br)c(C(F)(F)F)c2)cc1SC 482361987 BDWXRBHZQWYTCM-UHFFFAOYSA-N 465.247 5.359 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)Nc2ccc(NC(=O)c3ccc(Cl)cc3)cc2)cc1SC 483385876 YVZSGXNRSLPAJX-UHFFFAOYSA-N 471.922 5.483 5 20 JKBD CC[C@@H](C)Sc1ccc(NC(=O)c2cc(SC)c(OC)cc2[N+](=O)[O-])c(C(F)(F)F)c1 483531629 SQMXNEDZYKSDBJ-LLVKDONJSA-N 474.526 6.487 5 20 JKBD CCOc1ccc(Oc2ccc(Cl)cc2NC(=O)c2ccc(-n3cncn3)c([N+](=O)[O-])c2)cc1 496882326 PPTOWZSJPQLHCQ-UHFFFAOYSA-N 479.880 5.272 5 20 JKBD COc1cc([C@H](C)NC(=O)Cn2c3ccccc3c(=O)c3ccccc32)ccc1OCCC(C)C 501446189 BLDTZYAROCWLLM-FQEVSTJZSA-N 472.585 5.466 5 20 JKBD COc1cc(C(=O)Nc2ccc3nc(C4CCC4)[nH]c3c2)c([N+](=O)[O-])cc1OCc1cscn1 503183005 JTSQVRVYJLRTDC-UHFFFAOYSA-N 479.518 5.035 5 20 JKBD Cc1cc(-c2cc(C(=O)Nc3nc(-c4cccc([N+](=O)[O-])c4)cs3)c3c(C)noc3n2)c(C)o1 505107604 BGYJHIAYLMIVJJ-UHFFFAOYSA-N 475.486 5.692 5 20 JKBD Cc1cccc(Cc2cnc(NC(=O)c3cn(C)nc3-c3ccc([N+](=O)[O-])cc3)s2)c1Cl 506862858 SUOQFGDPGFHFOF-UHFFFAOYSA-N 467.938 5.257 5 20 JKBD O=C(Nc1cc(C(F)(F)F)ccc1Cl)c1ccc([N+](=O)[O-])cc1I 508914530 DFYFGEKZAKDJRG-UHFFFAOYSA-N 470.572 5.124 5 20 JKBD COc1cc(C(=O)Nc2ccccc2Oc2ccccc2)c([N+](=O)[O-])cc1OCc1cscn1 512360035 QUSFPSROEGQAAV-UHFFFAOYSA-N 477.498 5.684 5 20 JKBD O=C(Nc1ccc(NC2CCOCC2)cc1)c1ccc(NCc2ccccc2Cl)c([N+](=O)[O-])c1 513066879 AMGNKFMWIHSKEO-UHFFFAOYSA-N 480.952 5.704 5 20 JKBD O=[N+]([O-])c1cc2c(O)ncnc2cc1NC[C@@H](c1ccc(Cl)cc1)N1CCc2sccc2C1 515550417 KPTLMESXBMABQY-NRFANRHFSA-N 481.965 5.170 5 20 JKBD O=C(C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)N1CCC[C@H]1c1cccnc1 515747575 RNQAFZHSPDINOE-FIWMFUAISA-N 470.554 5.894 5 20 JKBD CCN(C(=O)Cc1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1 518167567 LJCPODRVVXUUAQ-UHFFFAOYSA-N 483.553 5.653 5 20 JKBD O=C(c1ccn(-c2ccc([N+](=O)[O-])cc2)n1)C(c1nc2ccccc2s1)c1nc2ccccc2s1 520911500 FQAKTVFDUHZUQK-UHFFFAOYSA-N 497.561 6.015 5 20 JKBD O=C(c1ccc(C(F)(F)F)cc1)N1CCN(C(=O)c2cc([N+](=O)[O-])ccc2Oc2ccccc2)CC1 603737444 JJKRURSOXPNNQL-UHFFFAOYSA-N 499.445 5.004 5 20 JKBD COc1ccc(CN(C)C(=O)c2cc([N+](=O)[O-])ccc2Oc2ccccc2)cc1OC(F)F 603739715 OIGLZUAETCAMGW-UHFFFAOYSA-N 458.417 5.269 5 20 JKBD O=C(NC[C@@H]1CCN(CC(F)(F)F)C1)c1cc([N+](=O)[O-])ccc1Sc1ccc(Cl)cc1 608812655 XVRASIXHHVVCQL-ZDUSSCGKSA-N 473.904 5.013 5 20 JKBD Cc1cc(-c2cccc(Cl)c2)ccc1NC(=O)N1CCN(C(=O)c2ccc([N+](=O)[O-])s2)CC1 608863964 CKGILJMLLIXHLG-UHFFFAOYSA-N 484.965 5.275 5 20 JKBD O=C(Nc1cccc(-c2cnco2)c1)c1ccc(C(=O)Nc2cccc(-c3cnco3)c2)c([N+](=O)[O-])c1 609044928 WBDGZIGMZAMBNZ-UHFFFAOYSA-N 495.451 5.409 5 20 JKBD CCOC(=O)c1c(CC(C)C)csc1NC(=O)c1cc(SC)c(OC)cc1[N+](=O)[O-] 609125613 IGHPWLRLPDQKRU-UHFFFAOYSA-N 452.554 5.014 5 20 JKBD Cc1c([N+](=O)[O-])cc(C(=O)Nc2ccc(Oc3ccc(C(F)(F)F)cc3)nc2)cc1[N+](=O)[O-] 729536579 NCSYZWZXBCJPAY-UHFFFAOYSA-N 462.340 5.270 5 20 JKBD CC(=O)N(c1nc(COC(=O)c2cc([N+](=O)[O-])ccc2C)cs1)c1c(C)cc(C)cc1Cl 743000372 JLQPACRZBZJORT-UHFFFAOYSA-N 473.938 5.672 5 20 JKBD Cc1nc2ccccc2c(-c2ccccc2)c1CC(=O)O[C@H](C)C(=O)Nc1ccccc1[N+](=O)[O-] 800373591 BVOVUTQTZXJCJY-GOSISDBHSA-N 469.497 5.231 5 20 JKBD C[C@@H](OC(=O)[C@@H](C)Sc1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccccc1Cc1ccccc1 856620275 IBURIQIHPBXAOS-QZTJIDSGSA-N 464.543 5.237 5 20 JKBD Cc1cc(C(=O)N2CCC[C@H]2c2nc(-c3ccc(C(F)(F)F)s3)no2)ccc1[N+](=O)[O-] 904971308 SKQZYXJGQKOBER-ZDUSSCGKSA-N 452.414 5.011 5 20 JKBD O=C(Nc1ccccc1C(=O)NCc1c(F)cccc1Cl)c1ccc([N+](=O)[O-])cc1Cl 914477973 JOEXRKWTPDCCPS-UHFFFAOYSA-N 462.264 5.223 5 20 JKBD COc1ccc(Oc2ccc([N+](=O)[O-])cc2C(=O)OCC(=O)Nc2ccccc2C(F)(F)F)cc1 915443046 WVJGRVUWTRGDLC-UHFFFAOYSA-N 490.390 5.210 5 20 JKBD C[C@H](OC(=O)Cc1csc(-c2cc(Br)cs2)n1)c1cccc([N+](=O)[O-])c1 919556912 RTYVYVVDEVRZCK-JTQLQIEISA-N 453.339 5.389 5 20 JKBD C[C@H](Nc1ccc(C(=O)OCc2cccc(C(=O)N3CCCCC3)c2)cc1[N+](=O)[O-])c1ccccn1 920544247 KGDLXUUGGQEMDA-IBGZPJMESA-N 488.544 5.146 5 20 JKBD COc1ccc(COCc2cccc(NC(=O)c3ccc(Br)c([N+](=O)[O-])c3)c2)cc1 921155212 DLOAVPBDJFDNPW-UHFFFAOYSA-N 471.307 5.335 5 20 JKBD Cc1nocc1C(=O)Nc1ccc(C2(NC(=O)c3cc4cc([N+](=O)[O-])ccc4s3)CCC2)cc1 1787463255 OFHHYSDLCWGWMX-UHFFFAOYSA-N 476.514 5.167 5 20 JKBD CC(=O)C[C@@H](C)C(=O)NC1(c2ccc(NC(=O)c3cc4cc([N+](=O)[O-])ccc4s3)cc2)CCC1 1791010801 ZGVLMMVZUAYPFQ-OAHLLOKOSA-N 479.558 5.172 5 20 JKBD CC[C@@H](C)[C@H](C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1c(F)ccc([N+](=O)[O-])c1C)C2)c1ccccc1 1795575136 WIGHSKSYTGXHOQ-ZVQINVJOSA-N 481.568 5.124 5 20 JKBD COc1cc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cccc4c2oc2ccccc24)C3)ccc1[N+](=O)[O-] 1803821498 BUVUYGKSZIDFKR-REPLKXPHSA-N 499.523 5.068 5 20 JKBD O=C(Cc1cc([N+](=O)[O-])ccc1F)N1CCCC2(CCN(C(=O)[C@@H]3CCC[C@H]4CCCC[C@@H]43)CC2)C1 1806655539 GNXWCJZJOCCMQW-FGCOXFRFSA-N 499.627 5.114 5 20 JKBD CC[C@H](C)CC(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cc(Cl)cc([N+](=O)[O-])c2C)[nH]n1 1815045526 REZJLFMFCXCMCB-UGSOOPFHSA-N 461.950 5.022 5 20 JKBD CC1(C)CC(C(=O)Nc2cc([C@H]3CCCCN3C(=O)c3cc4cc([N+](=O)[O-])ccc4s3)[nH]n2)C1 1822475214 HTDSWFHOGSEMEI-GOSISDBHSA-N 481.578 5.275 5 20 JKBD Cc1ccc(CC(=O)N2CCCC[C@H]2c2cc(NC(=O)c3ccccc3C3CC3)n[nH]2)cc1[N+](=O)[O-] 1823134851 LLXTWFHTSKCLIY-QHCPKHFHSA-N 487.560 5.052 5 20 JKBD O=C(c1ccc(C2CC2)cc1)N1CCC([C@@H]2CCCCN2C(=O)CCc2cccc([N+](=O)[O-])c2)CC1 1824842545 KJMXYIPULWJJCN-MHZLTWQESA-N 489.616 5.338 5 20 JKBD CC[C@H](C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2ccc([N+](=O)[O-])cc2F)CC1)c1ccccc1 1826316480 HRQWTTJHODLRHJ-DHLKQENFSA-N 481.568 5.161 5 20 JKBD Cc1ccoc1C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)CC1 1827742654 UREFXMYDGGDHRD-FQEVSTJZSA-N 481.574 5.258 5 20 JKBD Cc1ccc(CC(=O)N2CCC([C@H]3CCCCN3C(=O)c3ccccc3Cl)CC2)cc1[N+](=O)[O-] 1829895443 XZKBGJLBGOEXDS-HSZRJFAPSA-N 483.996 5.033 5 20 JKBD CC[C@H](C)CC(=O)N1CCC([C@H]2CCCCN2C(=O)c2cccc(Br)c2[N+](=O)[O-])CC1 1830697443 BFNVLIYFSJNHCD-OXJNMPFZSA-N 494.430 5.027 5 20 JKBD O=C(c1ccc([N+](=O)[O-])cc1F)N1CCC([C@H]2CCCCN2C(=O)c2ccc(C3CC3)cc2)CC1 1830749857 KBKFCTICXUNTNT-RUZDIDTESA-N 479.552 5.158 5 20 JKBD O=C([C@@H]1C[C@H]1c1ccc(Cl)cc1)N1CC2(CCCN2C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)C1 1845739216 YADWYXBREMAXFU-VQTJNVASSA-N 495.988 5.084 5 20 JKBD CNc1ccc(C(=O)OCc2csc(N(C(C)=O)c3cccc(C(F)(F)F)c3)n2)cc1[N+](=O)[O-] 9924100 VTSKTLOJQHBJHO-UHFFFAOYSA-N 494.451 5.153 5 20 JKBD COc1ccccc1N(C(C)=O)c1nc(CSc2nc3ccc([N+](=O)[O-])cc3s2)cs1 10592389 HYBXPTVTIABFEJ-UHFFFAOYSA-N 472.573 5.647 5 20 JKBD Cc1ccc(NC(=O)[C@H](Sc2nnc(NCc3ccccc3)s2)c2ccccc2)c([N+](=O)[O-])c1 11408257 ULVVMWZHLDAJNU-OAQYLSRUSA-N 491.598 5.839 5 20 JKBD C[C@H](Oc1ccc2c(-c3ccc([N+](=O)[O-])cc3)cc(=O)oc2c1)C(=O)Nc1ccccc1C(F)(F)F 15370825 WEKYJYJHIXIUKW-AWEZNQCLSA-N 498.413 5.793 5 20 JKBD Cc1nn(-c2ccccc2)c(C)c1CN[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1 15505227 KWOVKXIBRBGWHF-RUZDIDTESA-N 489.963 5.520 5 20 JKBD Cc1cc(C)c2c(-c3ccccc3)nc(SCc3nnc(-c4ccc([N+](=O)[O-])cc4)o3)n2n1 21722493 OUDSUEXHBNRUJX-UHFFFAOYSA-N 458.503 5.264 5 20 JKBD CCCCC[C@@H](C)n1c(SCC(=O)Nc2c(C)cccc2[N+](=O)[O-])nc2ccccc2c1=O 21995344 GGISBCQRINKLTK-QGZVFWFLSA-N 468.579 5.485 5 20 JKBD O=C(CSc1ccccc1)O[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1 28801404 AVXTYRAEEXTLDJ-NRFANRHFSA-N 456.907 5.264 5 20 JKBD COc1cc([C@@H](C)N[C@@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2ccccc2)ccc1OC(C)C 30454845 NCOFBYUBEVYILZ-CRICUBBOSA-N 497.979 6.075 5 20 JKBD CN(Cc1ccc(C(=O)NC2CC2)cc1)C(=O)c1ccc(NCc2ccccc2Cl)c([N+](=O)[O-])c1 31194560 HCKIIVHIPZBEIZ-UHFFFAOYSA-N 492.963 5.025 5 20 JKBD C[C@H](Nc1ccc(C(=O)N[C@@H]2CCSc3ccc(F)cc32)cc1[N+](=O)[O-])c1ccccn1 108788884 POGPPEBUVFPIHB-IFXJQAMLSA-N 452.511 5.269 5 20 JKBD COc1ccc(C2(CN[C@@H](C)C(=O)Nc3ccc([N+](=O)[O-])cc3C(F)(F)F)CCCCC2)cc1 302949958 BWCHWKIMBVWDOJ-INIZCTEOSA-N 479.499 5.441 5 20 JKBD Cc1ccccc1-c1cc(C(=O)N2c3ccc([N+](=O)[O-])cc3C[C@@H]2C)c2cnn(C(C)C)c2n1 504324273 HUBZKHBXQNIJEB-KRWDZBQOSA-N 455.518 5.487 5 20 JKBD C[C@H](Nc1ccc(C(=O)N[C@@H](c2ccccc2)c2ccc(F)cc2)cc1[N+](=O)[O-])c1ccccn1 506178429 KHLHKAQUYWVHFZ-QYBDOPJKSA-N 470.504 5.821 5 20 JKBD Cc1ccc(C(=O)Nc2nc(-c3cccc([N+](=O)[O-])c3)cs2)cc1NC(=O)c1ccccc1 506551683 ZBDJWTYLKOAGJX-UHFFFAOYSA-N 458.499 5.531 5 20 JKBD CCc1cc(Sc2nnc(C(C)C)n2Cc2ccco2)nc(-c2ccc([N+](=O)[O-])cc2)n1 507112665 WETGLDIYRUIQDN-UHFFFAOYSA-N 450.524 5.122 5 20 JKBD COc1cc(CNC(=O)c2ccc(N[C@@H](C)c3ccccn3)c([N+](=O)[O-])c2)ccc1OC1CCCC1 507346850 CPDDHDBXHLMHBF-SFHVURJKSA-N 490.560 5.423 5 20 JKBD Cc1sc(NC(=O)c2cc(F)ccc2I)nc1-c1cccc([N+](=O)[O-])c1 508946096 GKPNUKVBLUHEHC-UHFFFAOYSA-N 483.262 5.023 5 20 JKBD CC(C)Oc1ccc([N+](=O)[O-])cc1CSc1nnc(N2CCC[C@H](C)C2)n1Cc1ccco1 511092007 QYWDUJOUKIJCJS-KRWDZBQOSA-N 471.583 5.143 5 20 JKBD CCN(C(=O)c1ccc(Sc2nncn2C)c([N+](=O)[O-])c1)C(c1ccccc1)c1ccccc1 514535449 IEEZOQXKUDKDTQ-UHFFFAOYSA-N 473.558 5.126 5 20 JKBD COc1ccc(OC)c(NC(=O)C/C(=C\c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)c1 514995899 UBULATPKIOTYGV-GHRIWEEISA-N 475.526 5.791 5 20 JKBD CCCCN(C(=O)c1cc([N+](=O)[O-])cnc1C)c1nc(-c2ccc(Cl)cc2Cl)cs1 516464247 UNSLFKWBWXRITQ-UHFFFAOYSA-N 465.362 6.175 5 20 JKBD COc1ccc([C@@H](NCc2cn(-c3ccccc3)nc2-c2ccc([N+](=O)[O-])cc2)c2nccn2C)cc1 517541087 QRPSZICDEAWJEE-HHHXNRCGSA-N 494.555 5.069 5 20 JKBD CC[C@H](NCc1ccc(-c2ccccc2[N+](=O)[O-])o1)c1ccccc1OCC(=O)N1CCCC1 518263581 ZGPRCXNYQVJEOO-QFIPXVFZSA-N 463.534 5.097 5 20 JKBD CCCN(Cc1nnc(-c2ccccc2Cl)o1)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl 518520976 YEKVBALFHDWIDG-UHFFFAOYSA-N 450.282 5.396 5 20 JKBD O=[N+]([O-])c1ccc(OC(F)F)c(CNCc2ccccc2-c2ccc(Cn3cccn3)cc2)c1 520965074 VMXDFFDQPWMZIL-UHFFFAOYSA-N 464.472 5.398 5 20 JKBD COCCN(C(=O)[C@@H]1C[C@@H]1c1ccc(C(F)(F)F)cc1)c1nc(-c2ccc([N+](=O)[O-])cc2)cs1 589197830 CPWGVNIUMJKUAD-RTBURBONSA-N 491.491 5.520 5 20 JKBD O=C(Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1)c1cnn(-c2ccc(Cl)cc2)c1C(F)(F)F 590613474 UBRSCFUGXQBEHY-UHFFFAOYSA-N 493.854 5.829 5 20 JKBD COc1ccc(CN(C)C)cc1NC(=O)c1ccc(Sc2nc3ccccc3s2)c([N+](=O)[O-])c1 603589956 RODMQCLYTYYWLT-UHFFFAOYSA-N 494.598 5.678 5 20 JKBD CN1CC(=O)N(c2cccc(NC(=O)c3cc([N+](=O)[O-])ccc3Sc3ccc(Cl)cc3)c2)C1=O 603775240 XJXPASNAOUMKOS-UHFFFAOYSA-N 496.932 5.050 5 20 JKBD C[C@@H](N[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Br)c1ccccc1)c1c(F)cccc1F 604047855 NUVREFIEAMTYAN-ASSNKEHSSA-N 490.304 5.666 5 20 JKBD CC(C)CCSc1ccc(C(=O)N2C[C@H](C(F)(F)F)C[C@@H](C(F)(F)F)C2)cc1[N+](=O)[O-] 604257973 RCZVMPYODDMGLY-ZIAGYGMSSA-N 472.451 5.936 5 20 JKBD CN(Cc1ccsc1)[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Br)c1ccccc1 604474903 ZVMAQUNJWBRNML-IBGZPJMESA-N 460.353 5.231 5 20 JKBD Cc1nn(C)c(Oc2cccnc2)c1NC(=O)c1ccc(NCc2ccccc2Cl)c([N+](=O)[O-])c1 608961925 NVYQRPFDMFPTHK-UHFFFAOYSA-N 492.923 5.342 5 20 JKBD COc1ccc(CC(=O)N(Cc2ccc(Cl)c(Cl)c2)Cc2ccccn2)cc1[N+](=O)[O-] 609012320 UYICJAORJPTMHX-UHFFFAOYSA-N 460.317 5.077 5 20 JKBD O=[N+]([O-])c1ccc(-c2nn(-c3ccccc3)cc2CNCCc2coc(-c3ccc(F)cc3)n2)cc1 609223541 FYOAOGOLGHFTJH-UHFFFAOYSA-N 483.503 5.574 5 20 JKBD CC(C)(C(=O)OCc1nc2ccccc2c2ccccc12)S(=O)(=O)c1ccc(Br)cc1 726225841 SEYROULJQUBKEF-UHFFFAOYSA-N 498.398 5.446 5 20 JKBD C[C@@H](Nc1ccc(C(=O)Oc2ccccc2OCC(F)(F)F)cc1[N+](=O)[O-])c1ccccn1 727641565 GVTBWWAQLDRAKJ-CQSZACIVSA-N 461.396 5.323 5 20 JKBD CC(=O)N(c1nc(COC(=O)c2c[nH]c3ccc([N+](=O)[O-])cc23)cs1)c1cccc(C)c1C 728340054 FZQULSULUGPIKN-UHFFFAOYSA-N 464.503 5.191 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)Oc2ccc(NC(=O)c3ccc(C)cc3)cc2)cc1SC 728521332 BENZGRHJATYKRL-UHFFFAOYSA-N 452.488 5.105 5 20 JKBD CCN(C(=O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1C)[C@H]1CCSc2ccc(Br)cc21 728846827 SMYIRRFWEWIKAS-INIZCTEOSA-N 480.340 5.273 5 20 JKBD C[C@H](OC(=O)c1csc(-c2cccc([N+](=O)[O-])c2)n1)C(=O)N[C@@H](C)c1ccc2c(c1)CCCC2 747961699 IUPDPSSLMBKRBN-HOTGVXAUSA-N 479.558 5.020 5 20 JKBD O=C(COC(=O)c1csc(-c2cccc([N+](=O)[O-])c2)n1)Nc1ccccc1-c1ccccc1 747962473 QUUPBEODWQJBMJ-UHFFFAOYSA-N 459.483 5.181 5 20 JKBD Cn1c(CSc2nc3ccccc3s2)nnc1Sc1ccc([N+](=O)[O-])c2cnccc12 799858683 ZSCUMOUTLXQSGG-UHFFFAOYSA-N 466.573 5.325 5 20 JKBD NC(=O)[C@H](OC(=O)C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)c1ccc(F)cc1 824255259 WLYHTBSBSSYGON-GNBRFLJNSA-N 491.500 5.044 5 20 JKBD C[C@@H](OC(=O)CCc1ccc(Cl)cc1Cl)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 912870448 XXQGAHQKPOBNOP-SNVBAGLBSA-N 479.238 5.423 5 20 JKBD C[C@H](OC(=O)c1cc(C2CC2)nc2onc(CC(C)(C)C)c12)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 915581263 IMCCZJQPPQZDAE-ZDUSSCGKSA-N 491.504 5.565 5 20 JKBD O=C(Nc1ccc(=O)n(Cc2ccccc2)c1)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1 916460457 AGDKANOKVWVCGJ-UHFFFAOYSA-N 475.888 5.503 5 20 JKBD CC(=O)N(c1ccc(Cl)cc1)c1nc(COC(=O)/C=C/c2ccc([N+](=O)[O-])cc2)cs1 918860836 CWNZJLDDKGOKSX-NYYWCZLTSA-N 457.895 5.146 5 20 JKBD C[C@H](Nc1ccc(C(=O)O[C@H](C)c2nc3ccccc3n2C(F)F)cc1[N+](=O)[O-])c1ccccn1 919684217 IQRFMVURNFIIRN-LSDHHAIUSA-N 481.459 5.826 5 20 JKBD O=C(Nc1ccccc1C(=O)N[C@@H]1CCc2c(Cl)cccc21)c1ccc([N+](=O)[O-])cc1Cl 919873366 OTWVKNVDXQJVGP-OAQYLSRUSA-N 470.312 5.571 5 20 JKBD CC(C)[C@@H](OC(=O)c1ccc(N[C@H](C)c2ccccn2)c([N+](=O)[O-])c1)C(=O)N(C)c1ccccc1 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JKBD CCC1(C(=O)NC[C@@H]2CCN(C(=O)c3cc4cc([N+](=O)[O-])ccc4s3)[C@@H]2c2cccnc2)CCC1 1809648489 AVQAVFHHANNMHQ-FDDCHVKYSA-N 492.601 5.104 5 20 JKBD CC(C)(C)CCCCCC(=O)NC[C@@H]1CCN(C(=O)c2ccc([N+](=O)[O-])cc2F)[C@@H]1c1cccnc1 1812808745 IDNHUZPLZYSOLT-NBGIEHNGSA-N 498.599 5.445 5 20 JKBD CC1(C)CCC(CC(=O)N2CCCC[C@@H]2c2cc(NC(=O)c3cc(F)cc([N+](=O)[O-])c3)n[nH]2)CC1 1821166997 KBFZWPKJMMHVDS-OAQYLSRUSA-N 485.560 5.369 5 20 JKBD C[C@H](CC(=O)N1CCC([C@H]2CCCCN2C(=O)CCc2cccc([N+](=O)[O-])c2)CC1)c1ccccc1 1824843642 QXPMTNBNQBDQOD-AJTFRIOCSA-N 491.632 5.341 5 20 JKBD CC[C@@H](C(=O)N1CCCC[C@@H]1C1CCN(C(=O)/C=C/c2ccc([N+](=O)[O-])o2)CC1)c1ccccc1 1826309555 BDTSFBDKVCHQAD-DGTKBQTJSA-N 479.577 5.015 5 20 JKBD CSCc1c(C(=O)N[C@@H](CC(=O)OC(C)C)c2ccccc2[N+](=O)[O-])oc2ccccc12 16144777 AZZVRAJVYZBCGD-SFHVURJKSA-N 456.520 5.017 5 20 JKBD O=C(CSc1nnc(-c2ccccc2)c(-c2ccccc2)n1)Nc1ccc([N+](=O)[O-])cc1Cl 36785223 BLHXGWKUWJNTMD-UHFFFAOYSA-N 477.933 5.498 5 20 JKBD C[C@@H](Nc1ccc(C(=O)Nc2ccc(-n3cnc4ccccc43)cc2)cc1[N+](=O)[O-])c1ccccn1 108785471 OCOOCIBFMOZLNW-GOSISDBHSA-N 478.512 5.754 5 20 JKBD Cc1ccc(-c2nc(NC(=O)c3ccc(N[C@H](C)c4ccccn4)c([N+](=O)[O-])c3)sc2C)s1 303143345 BNZGOMJIHSLVKX-CQSZACIVSA-N 479.587 6.217 5 20 JKBD Cc1csc(Sc2ccc(C(=O)N[C@H](c3ccccc3)c3nccs3)cc2[N+](=O)[O-])n1 303155186 DFONDDJCIOYYRI-GOSISDBHSA-N 468.585 5.487 5 20 JKBD O=[N+]([O-])c1ccc(-c2nnc(CSc3nnc(-c4cccs4)n3Cc3ccccc3)o2)cc1 409568640 RFXWQIIELDXGBP-UHFFFAOYSA-N 476.543 5.305 5 20 JKBD O=[N+]([O-])c1cccc(CSc2nnc(-c3ccc(Br)o3)n2Cc2ccccc2)c1 409614551 VBJOVLVQUAGTGM-UHFFFAOYSA-N 471.336 5.549 5 20 JKBD COc1cccc(/C=C(/CC(=O)N2CCc3ccc([N+](=O)[O-])cc32)c2nc3ccccc3s2)c1 477611883 CJTHZNILKREHCC-UYRXBGFRSA-N 471.538 5.733 5 20 JKBD O=C(Nc1ccc2nc(N3CCOCC3)sc2c1)c1cc([N+](=O)[O-])ccc1Sc1ccccc1 490911692 VGVCRNCKSFESKL-UHFFFAOYSA-N 492.582 5.445 5 20 JKBD C[C@@H](SCc1ncc(-c2ccc(Cl)cc2)o1)C(=O)N1c2ccc([N+](=O)[O-])cc2C[C@H]1C 504375724 AXOWVUYCMHICJQ-ZIAGYGMSSA-N 457.939 5.503 5 20 JKBD Cn1ccnc1C(=O)c1ccc(NCc2ccccc2-c2ccc(Cn3ccnc3)cc2)c([N+](=O)[O-])c1 505605313 FZKVRKBKMAKKLI-UHFFFAOYSA-N 492.539 5.083 5 20 JKBD COCCN(C(=O)c1cc(-c2ccccc2Cl)on1)c1nc(-c2ccc([N+](=O)[O-])cc2)cs1 506536418 WXIKPBXSGCXSLC-UHFFFAOYSA-N 484.921 5.320 5 20 JKBD C[C@H](Nc1ccc(C(=O)N[C@H](C)c2ccc(OC(F)F)cc2)cc1[N+](=O)[O-])c1ccccn1 506847817 SVYPCACXKTWCMQ-CABCVRRESA-N 456.449 5.255 5 20 JKBD C[C@@H](Nc1ccc(C(=O)Nc2cccc(NC(=O)c3ccccc3)c2)cc1[N+](=O)[O-])c1ccccn1 507404683 PPOHFLNYUIAVAZ-GOSISDBHSA-N 481.512 5.668 5 20 JKBD COc1cc([C@H](C)NCc2ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])cc2)cc(OC)c1OC 508104524 RDOGGJQCCFILHP-HNNXBMFYSA-N 472.925 5.917 5 20 JKBD Cc1ccc(Cc2sc(NC(=O)c3ccc([N+](=O)[O-])cc3I)nc2C)cc1 511864089 JVBKDKQDCGQFAX-UHFFFAOYSA-N 493.326 5.116 5 20 JKBD COc1cc(C(=O)N(C2CC2)[C@@H]2CCCc3ccccc32)c([N+](=O)[O-])cc1OCc1cscn1 512443883 IHPGGRABGMFTEK-OAQYLSRUSA-N 479.558 5.321 5 20 JKBD CCOc1cc([N+](=O)[O-])c(C(=O)N[C@@H](c2ccc3c(c2)CCCC3)c2cccs2)cc1OC 514317319 URPWYXAFOVPNKC-DEOSSOPVSA-N 466.559 5.462 5 20 JKBD O=[N+]([O-])c1ccc(-c2ccc(CN[C@H](c3ccccc3)c3ccccn3)o2)c(Br)c1 520955214 CAPBRBCYUGHPOH-HSZRJFAPSA-N 464.319 5.892 5 20 JKBD C[C@@H](Nc1ccc(C(=O)Nc2cccc(Cl)c2-n2cccn2)cc1[N+](=O)[O-])c1ccccn1 569754373 QVNXDIXGFNKVFK-OAHLLOKOSA-N 462.897 5.254 5 20 JKBD O=C(C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)N1CCC[C@H]1c1ccccc1 590683045 YQKRMEIEONCTRL-QZPFXSPMSA-N 469.566 6.499 5 20 JKBD C[C@@H](Sc1nnc(-c2ccccc2Br)o1)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl 594639389 DXLQBEBYXKGGNV-SECBINFHSA-N 483.731 5.180 5 20 JKBD COc1ccc(Oc2ccc([N+](=O)[O-])cc2C(=O)N2C[C@@H](C(F)(F)F)C[C@H](C(F)(F)F)C2)cc1 604257687 LLAGLIWDKORCEZ-STQMWFEESA-N 492.372 5.599 5 20 JKBD CCn1c(Sc2ccc(C(=O)Nc3ccc(C)cc3)cc2[N+](=O)[O-])nnc1-c1ccccc1OC 608972542 UODJNWFYBFNPCV-UHFFFAOYSA-N 489.557 5.594 5 20 JKBD O=C(C1CCN(c2ccc(C(F)(F)F)cn2)CC1)N(CC1CC1)c1ccc(Cl)c([N+](=O)[O-])c1 728166626 JGKMSNQQDTXQSF-UHFFFAOYSA-N 482.890 5.322 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)O[C@@H](C)C(=O)N[C@H](C)c2ccc(Cl)cc2Cl)cc1SC 728651020 OYWQRFVNSLRPIR-MNOVXSKESA-N 487.361 5.055 5 20 JKBD O=C(Oc1ccccc1C(=O)NCCCc1ccccc1)c1csc(-c2cccc([N+](=O)[O-])c2)n1 729918993 RFMRUICJDYBAED-UHFFFAOYSA-N 487.537 5.300 5 20 JKBD Cc1ccc(NC(=O)[C@H](OC(=O)c2csc(-c3ccoc3)n2)c2ccccc2)c([N+](=O)[O-])c1 731090858 HEZSMXYAOKCMNF-HXUWFJFHSA-N 463.471 5.157 5 20 JKBD Cc1c(C(=O)Nc2nc(-c3ccco3)c(-c3ccco3)s2)cc([N+](=O)[O-])c(C)c1[N+](=O)[O-] 748604126 ALGXBJINQRPDSS-UHFFFAOYSA-N 454.420 5.349 5 20 JKBD CCCOc1ccccc1Oc1ncccc1CNC(=O)c1cc([N+](=O)[O-])ccc1Br 751095930 MQISLIIMPQUWFS-UHFFFAOYSA-N 486.322 5.263 5 20 JKBD O=[N+]([O-])c1cccnc1Sc1nnc(CSc2nc3ccccc3s2)n1Cc1ccccc1 799715046 KWRCQXJLDVFQLH-UHFFFAOYSA-N 492.611 5.683 5 20 JKBD C[C@H]1CCC[C@H](C)N1C(=O)c1cc(Cl)ccc1NC(=O)c1cc(Cl)ccc1[N+](=O)[O-] 915154211 LAIIYMTXHBLTKV-STQMWFEESA-N 450.322 5.557 5 20 JKBD CC(C)(C)c1ccc(Oc2ccc(CNCc3cccnc3-n3ccnc3)cc2[N+](=O)[O-])cc1 915228157 FGJUDDVGMBHLRB-UHFFFAOYSA-N 457.534 5.555 5 20 JKBD CC(C)OCc1ccc(C(=O)O[C@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2ccccc2)cc1 916535538 PDFUDLDJVCMAHR-QHCPKHFHSA-N 482.920 5.710 5 20 JKBD CN(C(=O)c1ccc(NC(=O)c2ccc(Br)c([N+](=O)[O-])c2)cc1Cl)C1CCCCC1 917755319 UVNQHEWFIKTWQN-UHFFFAOYSA-N 494.773 5.668 5 20 JKBD Cc1c(COC(=O)c2ccccc2NC(=O)c2ccc([N+](=O)[O-])cc2Cl)cccc1[N+](=O)[O-] 918978659 JHYFEGDOKQVGJV-UHFFFAOYSA-N 469.837 5.074 5 20 JKBD COc1ccc(C(=O)O[C@@H](C(=O)Nc2ccc(C)cc2[N+](=O)[O-])c2ccccc2)cc1OC(F)F 919214246 NEKWDLAHOBYULG-OAQYLSRUSA-N 486.427 5.050 5 20 JKBD C[C@H](c1ccccc1)N1CC[C@@H](NC(=O)c2ccccc2NC(=O)c2ccc([N+](=O)[O-])cc2Cl)C1 919857430 PWONIAHFIZYGDQ-IEBWSBKVSA-N 492.963 5.066 5 20 JKBD O=C(Cn1c2ccccc2c(=O)c2ccccc21)N1CCC[C@H]1Cc1ccc(Br)cc1 920809886 QNZVWNKFBBSEAY-FQEVSTJZSA-N 475.386 5.151 5 20 JKBD COc1cc(-c2cc(C(=O)N(C)c3ccc([N+](=O)[O-])cc3)c3ccccc3n2)cc(OC)c1OC 920963989 YSEMIRDFKPYCJE-UHFFFAOYSA-N 473.485 5.112 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)c3cccc(F)c3[N+](=O)[O-])CCC2)cc1)c1cc2sccn2c1 1788412353 RWHMBTYVDNVLQB-UHFFFAOYSA-N 478.505 5.110 5 20 JKBD Cn1c(C(=O)Nc2ccc(C3(NC(=O)Cc4cccc([N+](=O)[O-])c4)CCC3)cc2)cc2ccccc21 1788884632 CFCKORPHYHTKHW-UHFFFAOYSA-N 482.540 5.077 5 20 JKBD C/C(=C\c1ccc(C)o1)C(=O)Nc1ccc(C2(NC(=O)c3ccc(O)c([N+](=O)[O-])c3)CCC2)cc1 1789585868 VEFZWAXEQARDAD-JQIJEIRASA-N 475.501 5.053 5 20 JKBD C/C(=C\c1ccc(C)o1)C(=O)NC1(c2ccc(NC(=O)c3ccc(O)c([N+](=O)[O-])c3)cc2)CCC1 1790619673 MCKPSRWOGZHEJG-JQIJEIRASA-N 475.501 5.053 5 20 JKBD O=C(CSc1ccccc1[N+](=O)[O-])Nc1ccc(C2(NC(=O)Cc3ccccc3F)CCC2)cc1 1791522357 LOBAEEMRRFVYJD-UHFFFAOYSA-N 493.560 5.203 5 20 JKBD CC[C@H](C)[C@@H](C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CSc1ccccc1[N+](=O)[O-])C2)c1ccccc1 1795572704 MBBXKSMOAFOZIP-YAZAZGCCSA-N 495.645 5.155 5 20 JKBD Cc1c(C(=O)Nc2cc([C@H]3CCCCN3C(=O)c3ccc(Cl)o3)[nH]n2)cc(Cl)cc1[N+](=O)[O-] 1821294941 XJNYIZGYWOQLOI-OAHLLOKOSA-N 492.319 5.146 5 20 JKBD O=C(CSc1ccccc1[N+](=O)[O-])Nc1cc([C@H]2CCCCN2C(=O)C23CCC(CC2)CC3)[nH]n1 1822315363 QBGPCWGLRUIJRR-WHEQYPTASA-N 497.621 5.073 5 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VFEQFPUPKPFASU-LBPRGKRZSA-N 480.468 5.024 5 20 JKBD CC(=O)c1ccc(C(=O)O[C@@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2ccccc2)s1 25267030 YEESOUMAQNUEQR-LJQANCHMSA-N 458.879 5.049 5 20 JKBD CCN(Cc1ccc(OCc2cccs2)c(OC)c1)C(=O)c1cc(SC)ccc1[N+](=O)[O-] 29435338 UVCOFCFRDAWYFU-UHFFFAOYSA-N 472.588 5.628 5 20 JKBD COc1cc([C@H](C)N[C@@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2C(F)(F)F)ccc1OC(C)C 30492583 KQFNGIHAGLQYQQ-KBPBESRZSA-N 469.460 5.087 5 20 JKBD O=[N+]([O-])c1cccc(-c2noc(CSc3nnc(-c4ccc(F)cc4)n3-c3ccccc3)n2)c1 31842457 OSIGAVHJPBPONK-UHFFFAOYSA-N 474.477 5.324 5 20 JKBD COc1cc([C@H](C)NC(=O)Cn2c3ccccc3c(=O)c3ccccc32)ccc1OCC(C)C 106085460 RIFOXNGMIDSQRT-IBGZPJMESA-N 458.558 5.076 5 20 JKBD Cc1cc(NC(=O)c2cc(C3CC3)nc3c2c(C)nn3C(C)(C)C)n(-c2ccc([N+](=O)[O-])cc2)n1 107779545 LGKCTFXTXVGJQD-UHFFFAOYSA-N 473.537 5.027 5 20 JKBD CC1CCN(c2ccc(C(=O)Nc3ccccc3NC(=O)Cc3cccs3)cc2[N+](=O)[O-])CC1 409975234 CZVMDCOUVCNGNT-UHFFFAOYSA-N 478.574 5.326 5 20 JKBD O=C(c1ccc([N+](=O)[O-])s1)N1CCN(c2nc(C3CC3)nc3scc(-c4ccccc4)c23)CC1 477622009 KPHSKMARWYDTMN-UHFFFAOYSA-N 491.598 5.168 5 20 JKBD O=C(Cn1c2ccccc2c(=O)c2ccccc21)Nc1ccc(NC(=O)N2CCCCCC2)cc1 498524410 FRJPXFDIPHHGSF-UHFFFAOYSA-N 468.557 5.201 5 20 JKBD CSc1ccc([N+](=O)[O-])c(C(=O)Nc2cccc(NC(=O)c3cccc(C(F)(F)F)c3)c2)c1 504769358 OYISVJYVBDAKJY-UHFFFAOYSA-N 475.448 5.840 5 20 JKBD COc1cc([N+](=O)[O-])ccc1OCc1csc(N(C(C)=O)c2cccc(C(F)(F)F)c2)n1 509063625 FOLYGTZISPCIQX-UHFFFAOYSA-N 467.425 5.342 5 20 JKBD C[C@@H](C(=O)Nc1cccc(NC(=O)c2cc([N+](=O)[O-])ccc2Sc2ccccc2)c1)n1cccn1 512396796 UPSAHRBXQQUZQY-KRWDZBQOSA-N 487.541 5.395 5 20 JKBD O=C(Cn1ccc2cc([N+](=O)[O-])ccc21)C(c1nc2ccccc2s1)c1nc2ccccc2s1 520123446 BOVNFEBIYCIFEZ-UHFFFAOYSA-N 484.562 6.170 5 20 JKBD CC1(C)CN(CC2CN(C(=O)c3ccc4[nH]c5ccccc5c(=O)c4c3)C2)c2cc(C3CC3)ccc21 563458468 IVTBIWPDHHCJKR-UHFFFAOYSA-N 477.608 5.429 5 20 JKBD CCCN(Cc1ccccc1Br)C(=O)c1cc(OC)c(OC(F)F)cc1[N+](=O)[O-] 603528549 IZVHPGOASDIPOB-UHFFFAOYSA-N 473.270 5.020 5 20 JKBD CCS(=O)(=O)c1ccc2oc(/C=C/c3ccc(-c4ccc([N+](=O)[O-])cc4Cl)o3)nc2c1 603784801 QVMNEKQKEQLDND-BJMVGYQFSA-N 458.879 5.613 5 20 JKBD Cc1cc([N+](=O)[O-])ccc1NC(=O)CCSc1nnc(-c2ccccc2)n1[C@@H](C)c1ccccc1 603917438 RDNUHGNXDHQTED-IBGZPJMESA-N 487.585 5.892 5 20 JKBD O=C(Cn1ccc2cc([N+](=O)[O-])ccc21)Nc1cc(OCC(F)(F)F)cc(OCC(F)(F)F)c1 604476787 DVSWTQDDMZOZIW-UHFFFAOYSA-N 491.344 5.070 5 20 JKBD COc1cc(C(=O)Nc2scnc2-c2ccccc2)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 604537409 VIOUHTLOMIKJTI-UHFFFAOYSA-N 481.917 6.425 5 20 JKBD COc1cc(C(=O)Nc2ccc(O[C@@H](C)c3ccccc3)cc2C)c([N+](=O)[O-])cc1OC(F)F 609066412 FRSDKQDFBQQWKD-HNNXBMFYSA-N 472.444 5.906 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)N[C@H](c2ccc(C(C)(C)C)cc2)C(F)(F)F)cc1SC 609126681 DIRCJUXEBPQLNL-GOSISDBHSA-N 456.486 5.656 5 20 JKBD CC(C)n1ncc2cc(NC(=O)C/C(=C\c3ccc([N+](=O)[O-])cc3)c3nc4ccccc4s3)cnc21 617164712 NIKVDXVNZYEYNG-WOJGMQOQSA-N 498.568 6.100 5 20 JKBD O=C(Cn1c2ccccc2c(=O)c2ccccc21)Nc1ncc(Cc2cc(F)cc(F)c2)s1 633676208 JSWRBAWGJVGQOK-UHFFFAOYSA-N 461.493 5.119 5 20 JKBD Cc1ccc(O)c[n+]1/C(C(=S)Nc1ccccc1-c1ccccc1)=C(/O)c1ccc([N+](=O)[O-])cc1 725762681 DOKISLXATPBVGF-UHFFFAOYSA-O 484.557 5.887 5 20 JKBD CC(C)(C)c1nc(C(=O)Oc2ccc3c(-c4ccc([N+](=O)[O-])cc4)cc(=O)oc3c2)cs1 726497940 CHRPDCGUGMOZBM-UHFFFAOYSA-N 450.472 5.341 5 20 JKBD COc1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2N(C)C)cc1OCc1ccc2ccccc2n1 728008987 JYCYYFFKJDUKFL-UHFFFAOYSA-N 472.501 5.049 5 20 JKBD C[C@@H](NC(=O)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1)c1ccc2c(c1)CC(=O)N2C 728256159 ZYLLUNVRZABREH-CQSZACIVSA-N 465.893 5.050 5 20 JKBD CC(C)(C)OC(=O)N1CCC[C@@H](N(Cc2ccccc2)C(=S)Nc2ccc([N+](=O)[O-])cc2)C1 730439103 XDXDPNRPZOKXKD-OAQYLSRUSA-N 470.595 5.193 5 20 JKBD O=C(Nc1ccccc1)c1ccc(COC(=O)c2csc(-c3ccc([N+](=O)[O-])cc3)n2)cc1 747957142 JZMNBDXGFKPOIV-UHFFFAOYSA-N 459.483 5.328 5 20 JKBD C/C(=C\C(=O)OCC(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F)c1ccc(C(F)(F)F)cc1 748385747 JPDQJTSUMOKUBA-DHZHZOJOSA-N 476.329 5.218 5 20 JKBD Cc1ccc(C(C)C)c(Oc2ccc(CNCc3ccc(C(=O)N4CCCC4)cc3)cc2[N+](=O)[O-])c1 822275946 WIRAGSQCVVLQFW-UHFFFAOYSA-N 487.600 6.345 5 20 JKBD CCc1nc(COC(=O)C/C(=C\c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)cs1 863942310 VCMJCWDQZLDXCF-LFIBNONCSA-N 465.556 5.898 5 20 JKBD CC1CCN(c2ccc([N+](=O)[O-])cc2C(=O)NC2C[C@H](C(F)(F)F)C[C@@H](C(F)(F)F)C2)CC1 914743484 AMXSINVTGWDUTE-ZIAGYGMSSA-N 481.437 5.470 5 20 JKBD CC(C)OC(=O)C[C@@H](NC(=O)Nc1ccccc1SC(F)F)c1ccccc1[N+](=O)[O-] 915317692 DBPNMHJNAVGTKW-OAHLLOKOSA-N 453.467 5.114 5 20 JKBD O=C(CCOc1ccc(F)cc1Cl)Oc1ccc(NC(=O)c2cccc([N+](=O)[O-])c2)cc1 916036749 RRZUQQNDWSFWGZ-UHFFFAOYSA-N 458.829 5.014 5 20 JKBD COc1ccc(N2C(=S)N[C@@H](c3csc([N+](=O)[O-])c3)C(C(=O)Nc3ccc(F)cc3)=C2C)cc1 917378657 LZDUGHPEDVVZFJ-NRFANRHFSA-N 498.561 5.153 5 20 JKBD O=C(Nc1ccccc1C(=O)OCc1csc([N+](=O)[O-])c1)c1ccccc1Br 918992147 UUIDZBUXCHDRSJ-UHFFFAOYSA-N 461.293 5.028 5 20 JKBD CSc1ccccc1NC(=O)[C@@H](C)OC(=O)c1cc([N+](=O)[O-])ccc1Oc1ccccc1 919192772 NLOFFAWSGIFBIL-OAHLLOKOSA-N 452.488 5.293 5 20 JKBD O=C(/C=C/c1ccc([N+](=O)[O-])o1)Nc1ccc(C2(NC(=O)c3ccc(-c4ncc[nH]4)cc3)CCC2)cc1 1786208055 ICPNMJZWGQMXIE-ZRDIBKRKSA-N 497.511 5.039 5 20 JKBD O=C(CCCC(F)(F)F)Nc1ccc(C2(NC(=O)Cc3cc([N+](=O)[O-])ccc3F)CCC2)cc1 1786619682 BPYDIWOHHFPCFB-UHFFFAOYSA-N 481.446 5.143 5 20 JKBD O=C(CSc1ccccc1)NC1(c2ccc(NC(=O)c3cc(F)cc([N+](=O)[O-])c3)cc2)CCC1 1790696714 NGWDXTPHZKNCIK-UHFFFAOYSA-N 479.533 5.274 5 20 JKBD CC(C)(C)CCCCCC(=O)N1CCC([C@@H]2CCCCN2C(=O)c2ccc([N+](=O)[O-])o2)CC1 1823618058 ORQLSCHCQFKHIR-FQEVSTJZSA-N 461.603 5.418 5 20 JKBD O=C(/C=C/c1ccccc1[N+](=O)[O-])N1CCC([C@@H]2CCCCN2C(=O)c2cc3ccoc3s2)CC1 1827412185 OQMBQNIQSALDKD-SHBDEGQCSA-N 493.585 5.349 5 20 JKBD O=C(Cc1cccc([N+](=O)[O-])c1)N1CCC([C@@H]2CCCCN2C(=O)c2cccc3ccccc23)CC1 1828006717 PSMAOADFVWMDBI-MHZLTWQESA-N 485.584 5.224 5 20 JKBD Cc1c(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)CCc3cccc([N+](=O)[O-])c3)CC2)ccc(F)c1F 1832617042 CSKBPLHQDJUVAN-XMMPIXPASA-N 499.558 5.048 5 20 JKBD COc1ccc([N+](=O)[O-])cc1NC(=O)[C@H](C)Sc1nnc(-c2ccco2)n1C1CCCCC1 10014901 IRIDXLARRSYCHF-AWEZNQCLSA-N 471.539 5.079 5 20 JKBD CC(=O)N(c1ccc(C)c(C)c1)c1nc(COC(=O)c2cc([N+](=O)[O-])ccc2Cl)cs1 10665133 WDCCHBSQGNHNPF-UHFFFAOYSA-N 459.911 5.363 5 20 JKBD C[C@@H](OC(=O)CCc1ncc(-c2ccccc2Cl)o1)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl 12252698 SGMVHGXTBVBQJD-GFCCVEGCSA-N 478.288 5.060 5 20 JKBD CC(C)CCSc1ccc(C(=O)Nc2c(C(=O)N3CCOCC3)oc3ccccc23)cc1[N+](=O)[O-] 18948390 WOYYKCKOASDYNH-UHFFFAOYSA-N 497.573 5.204 5 20 JKBD CC(C)c1ccc(NC(=O)COC(=O)c2ccccc2NC(=O)c2ccc([N+](=O)[O-])cc2Cl)cc1 21745305 DDNQTHJUZDNPHO-UHFFFAOYSA-N 495.919 5.419 5 20 JKBD COc1cccc(-c2nnc(S[C@H](C)C(=O)Nc3cccc([N+](=O)[O-])c3C)n2-c2ccccc2)c1 24003044 BLHXBRODMSADKL-QGZVFWFLSA-N 489.557 5.279 5 20 JKBD O=[N+]([O-])c1cccc(-c2noc(CSc3ncnc4scc(-c5ccc(F)cc5)c34)n2)c1 31843551 UVYACUUDFAUTKT-UHFFFAOYSA-N 465.491 5.748 5 20 JKBD CN(C)c1ccc(NC(=O)c2ccccc2NC(=O)c2ccc([N+](=O)[O-])cc2Cl)cc1Cl 108073720 PZUJQQFGRJWBER-UHFFFAOYSA-N 473.316 5.472 5 20 JKBD Cc1cc(C(=O)Cn2nc(-c3cccc([N+](=O)[O-])c3)ccc2=O)c(C)n1CCC1=CCCCC1 195741484 KXVQHZFBQBGOPZ-UHFFFAOYSA-N 460.534 5.010 5 20 JKBD COc1ccc(CN(Cc2ccc(OC)cc2)C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)cc1 303170806 BJGVRDQHUDHIND-UHFFFAOYSA-N 455.898 5.500 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)Nc2ccccc2-c2ccc(-c3ccccc3)cc2)cc1SC 410045873 JECCTLNSJQRTNP-UHFFFAOYSA-N 470.550 6.912 5 20 JKBD COc1cc(C(=O)N[C@H](c2ccccc2)c2ccc3c(c2)CCCO3)c([N+](=O)[O-])cc1OC(F)F 410048875 MILDKJXVTUSEIN-HSZRJFAPSA-N 484.455 5.049 5 20 JKBD CCOc1ccc(-c2nc(NC(=O)c3cc(SC)c(OC)cc3[N+](=O)[O-])sc2C)cc1 482136714 UUGBEEFLHVYOSP-UHFFFAOYSA-N 459.549 5.408 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)N2c3ccccc3CC[C@H]2C(=O)Nc2ccc(F)cc2)cc1SC 483672761 QMNBVWHCHKNEOH-FQEVSTJZSA-N 495.532 5.065 5 20 JKBD Cc1sc(C(=O)N(CC(=O)Nc2ccccc2F)Cc2ccc(Cl)cc2)cc1[N+](=O)[O-] 488140603 KOVSCEKMSCSELM-UHFFFAOYSA-N 461.902 5.038 5 20 JKBD O=C(Nc1ccccc1)Nc1cccc(NC(=O)c2csc(-c3ccc([N+](=O)[O-])cc3)n2)c1 496377735 LRZCOXYVZDWOCE-UHFFFAOYSA-N 459.487 5.615 5 20 JKBD COc1cc(C(=O)Nc2cccc(CO[C@@H]3CCC[C@H](C)C3)c2)c([N+](=O)[O-])cc1OC(F)F 499196134 SOPMUICPZRNBSA-WMLDXEAASA-N 464.465 5.552 5 20 JKBD COc1cc(C(=O)Nc2ccc(-c3nc4c(F)cccc4[nH]3)cc2)c([N+](=O)[O-])cc1OC(F)F 502563444 OHKCQARVHLTIIO-UHFFFAOYSA-N 472.379 5.140 5 20 JKBD CCOC(=O)c1cc(-c2ccccc2)sc1NC(=O)c1cc(OCC)c(OC)cc1[N+](=O)[O-] 502799701 OHIXHIHDXWUDKH-UHFFFAOYSA-N 470.503 5.160 5 20 JKBD CCOc1cc(C(=O)Nc2nc(-c3cccc(Br)c3)cs2)c([N+](=O)[O-])cc1OC 502833938 PMLKBLCKJRNUJV-UHFFFAOYSA-N 478.324 5.140 5 20 JKBD CC[C@H](C)C(=O)Nc1cccc(CNCc2ccc(Oc3ccc(F)cc3)c([N+](=O)[O-])c2)c1 507902646 KYGQUQALXMRZFC-KRWDZBQOSA-N 451.498 5.801 5 20 JKBD CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)CSc1nnc(-c2ccc3ccccc3c2)o1 509702237 YVVMHFMJRXSTJM-UHFFFAOYSA-N 462.531 5.327 5 20 JKBD O=C(NC[C@H]1CCN(c2ccc(F)cc2)C1)c1cc([N+](=O)[O-])ccc1Sc1ccccc1 512153647 USBVCRLHIKFPRU-QGZVFWFLSA-N 451.523 5.141 5 20 JKBD CC(C)(C)c1cc(NC(=O)c2cc(OCC(F)(F)F)ccc2[N+](=O)[O-])n(Cc2ccccc2)n1 514562133 DCHFNJPGXMDRNT-UHFFFAOYSA-N 476.455 5.331 5 20 JKBD Cc1ccc(Sc2ccc(C(=O)Nc3ccc(-n4ncc5c(O)ncnc54)cc3)cc2[N+](=O)[O-])cc1 514787305 VWOLQIOQSPLVNH-UHFFFAOYSA-N 498.524 5.141 5 20 JKBD Cc1ccc(OCCCC(=O)Nc2ccc(CNc3cc4c(cc3[N+](=O)[O-])CCC(=O)N4)cc2)cc1 515550612 SWKPDSJZRRWZTD-UHFFFAOYSA-N 488.544 5.198 5 20 JKBD Cc1csc(Sc2ccc(C(=O)Nc3ccc4nc([C@@H]5CCCO5)[nH]c4c3)cc2[N+](=O)[O-])n1 517891237 OXHCSVYQXJFCPO-SFHVURJKSA-N 481.559 5.491 5 20 JKBD COc1cccc(N2CC[C@H](CNCc3ccc(-c4ccc([N+](=O)[O-])cc4Br)o3)C2)c1 518278857 ISLFIOXFHXDQHG-MRXNPFEDSA-N 486.366 5.242 5 20 JKBD O=C(Nc1ccc(NCc2ccccc2)c(Cl)c1)C1CCN(c2ccccc2[N+](=O)[O-])CC1 519869579 OVSZTVQZEUMOIY-UHFFFAOYSA-N 464.953 5.715 5 20 JKBD CN(C)C(=O)c1cccc(NC(=O)C/C(=C/c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)c1 592950425 VNYRZBBDSQLPSE-RGEXLXHISA-N 486.553 5.476 5 20 JKBD CN(C)c1ccc(C(=O)c2ccccc2C(=O)Nc2ccc(Br)cc2F)cc1[N+](=O)[O-] 603440739 MNQWHZRVBIRPTB-UHFFFAOYSA-N 486.297 5.046 5 20 JKBD CCc1cccc(Cc2cnc(NC(=O)c3cc(OCC(F)(F)F)ccc3[N+](=O)[O-])s2)c1 603908264 IYGQBBDBXJCYOV-UHFFFAOYSA-N 465.453 5.398 5 20 JKBD C[C@H]1CCCCN1C(=O)c1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2Sc2ccccc2)cc1 603993141 OWXNKJMDKKCWGL-SFHVURJKSA-N 475.570 6.013 5 20 JKBD O=[N+]([O-])c1cccc(-c2noc(CNC(c3ccc(Cl)cc3)c3ccc(Cl)cc3)n2)c1 604008781 CMKAIOMOHNDTPR-UHFFFAOYSA-N 455.301 5.831 5 20 JKBD Cn1cnnc1Sc1ccc(Br)cc1NC(=O)c1cc2cc([N+](=O)[O-])ccc2s1 609170341 PBIAKVRVNMHPTQ-UHFFFAOYSA-N 490.364 5.104 5 20 JKBD O=C(c1ccc(Sc2nc3ccccc3s2)c([N+](=O)[O-])c1)N1CCC[C@H](N2CCCC2)C1 609346234 WAWVLEVMJLOSPW-KRWDZBQOSA-N 468.604 5.056 5 20 JKBD Cc1csc(Nc2cccc(NC(=O)c3ccc(N[C@H](C)c4ccccn4)c([N+](=O)[O-])c3)c2)n1 729336268 GNYBIDJUCXUNNM-MRXNPFEDSA-N 474.546 5.924 5 20 JKBD O=C(c1nn(-c2ccc(F)cc2)c2c1CCC2)N(CC1CC1)c1ccc(Cl)c([N+](=O)[O-])c1 745344995 SARBEIZYOIRDBI-UHFFFAOYSA-N 454.889 5.119 5 20 JKBD C[C@H](NC(=O)[C@@H](C)OC(=O)c1csc(-c2ccc([N+](=O)[O-])cc2)n1)c1ccc2ccccc2c1 747956549 HJBDMCGGVOUTKW-JKSUJKDBSA-N 475.526 5.294 5 20 JKBD O=C(CCc1ncc(-c2ccccc2)o1)Nc1cc(Cl)c([N+](=O)[O-])cc1OCc1ccccc1 822219754 PXKJZSFLYRDVEA-UHFFFAOYSA-N 477.904 6.054 5 20 JKBD O=C(CCCOC(=O)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1)c1ccccc1 825345363 FMNPEPMLEOXTQF-UHFFFAOYSA-N 464.440 5.036 5 20 JKBD C[C@H](OC(=O)c1cc([N+](=O)[O-])ccc1Oc1ccccc1)C(=O)Nc1ccccc1C(F)(F)F 917257154 KDVCBZSOAHWZOF-AWEZNQCLSA-N 474.391 5.590 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)c3cccc(C(F)(F)F)c3F)CCC2)cc1)c1ccc([N+](=O)[O-])o1 1785751260 VRPVOQSGYPZMEQ-UHFFFAOYSA-N 491.397 5.407 5 20 JKBD C[C@@H]1CCC[C@@H]1C(=O)Nc1ccc(C2(NC(=O)Cn3ccc4ccc([N+](=O)[O-])cc43)CCC2)cc1 1789205342 HXZDDYIROJLAMZ-JPYJTQIMSA-N 474.561 5.120 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)c3cc4cc(F)ccc4s3)CCC2)cc1)c1ccc([N+](=O)[O-])[nH]1 1790185805 FTBXVDHUMJLSMG-UHFFFAOYSA-N 478.505 5.338 5 20 JKBD COc1ccc(C(=O)NC2(c3ccc(NC(=O)c4cc(Cl)cc([N+](=O)[O-])c4C)cc3)CCC2)cn1 1790773827 IQXMJXJJIMOLJC-UHFFFAOYSA-N 494.935 5.022 5 20 JKBD Cc1n[nH]c(C)c1C(=O)NC1(c2ccc(NC(=O)c3cc4cc([N+](=O)[O-])ccc4s3)cc2)CCC1 1791010383 MAIKUUFRJNMPKT-UHFFFAOYSA-N 489.557 5.211 5 20 JKBD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(F)cc([N+](=O)[O-])c1)c1ccccc1Oc1ccccc1 1800524546 DNSPZINIBFHYBH-WKCHPHFGSA-N 489.503 5.092 5 20 JKBD Cc1ccc2cc(C(=O)N3CCC4(CCCN(C(=O)/C=C/c5ccc([N+](=O)[O-])o5)C4)CC3)sc2c1 1805686604 PXXZREZEMXQMPX-FNORWQNLSA-N 493.585 5.269 5 20 JKBD Cc1c(C(=O)N2CC[C@@H](CNC(=O)CCC3CCCC3)[C@H]2c2cccnc2)cc(Cl)cc1[N+](=O)[O-] 1806207069 OLZJWPOLUUBFTG-NBGIEHNGSA-N 499.011 5.242 5 20 JKBD CC(C)=CCCC(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)[nH]n1 1820805640 RIIZDUPIZTTZRZ-IBGZPJMESA-N 481.578 5.585 5 20 JKBD CC(C)(C)CCCCCC(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cc(O)cc([N+](=O)[O-])c2)[nH]n1 1822116133 OYVMIEQTJZYNEC-NRFANRHFSA-N 485.585 5.326 5 20 JKBD Cc1cccc2[nH]c(C(=O)N3CCCC[C@@H]3c3cc(NC(=O)/C=C/c4ccccc4[N+](=O)[O-])n[nH]3)cc12 1823505159 XBRBRPCWHFXQEE-JHUUHBRDSA-N 498.543 5.127 5 20 JKBD Cc1nscc1C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)CC1 1831060364 VCKIMHSNCLGYKV-FQEVSTJZSA-N 498.630 5.122 5 20 JKBD CCOc1ccccc1NC(=O)[C@@H](OC(=O)c1cc([N+](=O)[O-])ccc1Cl)c1ccccc1 3513879 SLWVCEVQSRGCOK-NRFANRHFSA-N 454.866 5.184 5 20 JKBD Cc1oc(-c2ccccc2)nc1C(=O)O[C@H](C(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1)c1ccccc1 9717700 XBXUGBDIZFFLCK-QFIPXVFZSA-N 491.887 5.748 5 20 JKBD COc1cccc([C@@H]2CCCN2C(=O)C2CCN(c3ccc(C(F)(F)F)cc3[N+](=O)[O-])CC2)c1 11486979 QPAAMWJBSZCYBW-FQEVSTJZSA-N 477.483 5.202 5 20 JKBD O=c1c2cc([N+](=O)[O-])ccc2nc2n1CC/C2=C/c1ccc(-c2ccc(Br)cc2)o1 16387014 GFYVGVVRECZUOB-KAMYIIQDSA-N 464.275 5.272 5 20 JKBD C[C@H](OC(=O)/C(=C/c1ccc(F)cc1)c1cccs1)C(=O)Nc1ccc(F)c([N+](=O)[O-])c1 21679322 ZKIJOERDBUFHHD-HNEYUBDGSA-N 458.442 5.046 5 20 JKBD O=C(Cn1c2ccccc2c(=O)c2ccccc21)NC[C@H]1CC2c3ccccc3C1c1ccccc12 26001614 OMSLYKIPUMLUQD-MDGZQJFKSA-N 470.572 5.568 5 20 JKBD O=C1CCc2cc(NC(=O)c3ccc(Sc4nc5ccccc5s4)c([N+](=O)[O-])c3)ccc2N1 33065808 JFJWZOUZKGQUEJ-UHFFFAOYSA-N 476.539 5.493 5 20 JKBD C[C@H](Sc1nc2ccccc2c(=O)n1C1CCCC1)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl 36795721 QEBIXCOUYKZAFA-ZDUSSCGKSA-N 472.954 5.193 5 20 JKBD CC1CCN([C@H](CNC(=O)c2ccc(N[C@H](C)c3ccccn3)c([N+](=O)[O-])c2)c2cccs2)CC1 108751803 YWQJZKCEUVSKAU-NTKDMRAZSA-N 493.633 5.427 5 20 JKBD CSc1ccc([N+](=O)[O-])c(C(=O)N(C)CCCCCc2cc(-c3ccc(F)cc3)n[nH]2)c1 108825478 WCSAHXHZVMLSLD-UHFFFAOYSA-N 456.543 5.331 5 20 JKBD C[C@H]1C[C@@H](C)CN(c2ccc(C(=O)Nc3ccc(Cl)cc3C(=O)N3CCCC3)cc2[N+](=O)[O-])C1 302960731 QCYQDMFDWIUOPO-CALCHBBNSA-N 484.984 5.219 5 20 JKBD O=C(Cc1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1)N[C@@H](c1ccccc1)c1nccs1 303237447 YPCJJHJZMGAFIE-SANMLTNESA-N 495.564 5.352 5 20 JKBD Cc1nc(C2(NC(=O)c3ccc(NCc4ccccc4Cl)c([N+](=O)[O-])c3)CCCCC2)no1 492484529 TUBIHFWLYUKMFG-UHFFFAOYSA-N 469.929 5.141 5 20 JKBD COc1ccc(-c2nc(NC(=O)c3csc(-c4ccc([N+](=O)[O-])cc4)n3)sc2C)cc1 496412119 PZLAVHQYTKIJSA-UHFFFAOYSA-N 452.517 5.411 5 20 JKBD O=C(N[C@H](Cc1ccc(O)cc1)c1nc2ccccc2[nH]1)c1csc(-c2ccc([N+](=O)[O-])cc2)n1 496611431 LFCBJCBGABBXKT-OAQYLSRUSA-N 485.525 5.014 5 20 JKBD CCN(CCc1cccs1)C(=O)c1ccccc1C(=O)c1ccc(SC)c([N+](=O)[O-])c1 501134619 NOIISISQLMYLFH-UHFFFAOYSA-N 454.573 5.314 5 20 JKBD O=C(Nc1cccc(COCc2ccco2)c1)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-] 502701510 VPODAXYFWWYPED-UHFFFAOYSA-N 450.369 5.098 5 20 JKBD Cc1noc2ncc(NC(=O)C/C(=C\c3ccc([N+](=O)[O-])cc3)c3nc4ccccc4s3)cc12 506525094 PWZFJZNNULUENH-MHWRWJLKSA-N 471.498 5.619 5 20 JKBD O=C(NCc1ccccc1-c1ccc(CN2CCCC2)cc1)C1CCN(c2ccccc2[N+](=O)[O-])CC1 514367769 DTBHYQSVXXVGHR-UHFFFAOYSA-N 498.627 5.390 5 20 JKBD C[C@H](NC(=O)c1cccc(NC(=O)c2cccc(Br)c2)c1)c1cccc([N+](=O)[O-])c1 515849912 INOBAPQVKAFLAL-AWEZNQCLSA-N 468.307 5.101 5 20 JKBD CC[C@@H](NC(=O)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])c(OC)c1)c1nnc2n1CCCCC2 518123526 IHHAXMSEHLGYAT-QGZVFWFLSA-N 499.955 5.248 5 20 JKBD C[C@H](NCc1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1)c1ccc(NC(=O)NC2CC2)cc1 603681130 JNLKBKBNBOIMBU-INIZCTEOSA-N 480.952 6.175 5 20 JKBD C[C@@H](Nc1ccc(C(=O)N(CCc2ccccc2)Cc2ccncc2)cc1[N+](=O)[O-])c1ccccn1 608879646 ZMKVOPMUPJTQDV-OAQYLSRUSA-N 481.556 5.443 5 20 JKBD C[C@H](OC(=O)c1csc(-c2cccc(C(F)(F)F)c2)n1)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 725995079 VXLSONXVWAWACA-NSHDSACASA-N 490.419 5.705 5 20 JKBD CN(CCOc1cccc(CNc2cc(Cl)c(C(F)(F)F)cc2[N+](=O)[O-])c1)C1CCOCC1 728052567 PTJSFCRZROJWOY-UHFFFAOYSA-N 487.906 5.369 5 20 JKBD C[C@H](Nc1ccc(C(=O)N(CC2CC2)c2ccc(Cl)c([N+](=O)[O-])c2)cc1[N+](=O)[O-])c1ccccn1 728167477 ZKHJDZKQAUTHSZ-HNNXBMFYSA-N 495.923 5.781 5 20 JKBD CC(C)(C)OC(=O)NCc1ccc2c(c1)CCCN2C(=O)Cn1c2ccccc2c(=O)c2ccccc21 731024417 WMDFHTOVNWRVDK-UHFFFAOYSA-N 497.595 5.159 5 20 JKBD O=C(O[C@H](C(=O)Nc1ccc(F)cc1)c1ccccc1)c1csc(-c2ccc([N+](=O)[O-])cc2)n1 747958653 RFUWHUOAHSWFEQ-NRFANRHFSA-N 477.473 5.394 5 20 JKBD COc1ccc(NC(=O)[C@H](C)Sc2nc3cc(C(F)(F)F)ccc3s2)c([N+](=O)[O-])c1 753855592 ZHXMFFJHIIKXJA-VIFPVBQESA-N 457.455 5.351 5 20 JKBD CCc1ccccc1N(C(C)=O)c1nc(COC(=O)c2c[nH]c3cc([N+](=O)[O-])ccc23)cs1 756766938 DGNKGBJTEDURPO-UHFFFAOYSA-N 464.503 5.137 5 20 JKBD CC1=C(C(=O)Nc2ccc(F)cc2)[C@@H](c2ccc([N+](=O)[O-])o2)NC(=S)N1c1cc(C)cc(C)c1 812776224 ADEBDQJTXBSNMW-JOCHJYFZSA-N 480.521 5.292 5 20 JKBD CCc1cccc(CC)c1NC(=O)c1ccc(OS(=O)(=O)c2cc([N+](=O)[O-])ccc2C)cc1 857706201 WXWWBGHYBAQRTL-UHFFFAOYSA-N 468.531 5.048 5 20 JKBD COc1ccc(CSCc2nc(-c3ccc(Oc4ccc(F)cc4)nc3)no2)cc1[N+](=O)[O-] 904509422 DPTKNNLNNLJDAB-UHFFFAOYSA-N 468.466 5.413 5 20 JKBD O=C(Nc1ccc(=O)n(Cc2ccccc2)c1)c1cc([N+](=O)[O-])ccc1Sc1ccccc1 916461858 YSXFHGBMNDLILO-UHFFFAOYSA-N 457.511 5.208 5 20 JKBD COc1ccccc1NC(=O)c1cc2ccccc2cc1OC(=O)CCNc1ccccc1[N+](=O)[O-] 916879005 GAFBCBSJNNQKPR-UHFFFAOYSA-N 485.496 5.417 5 20 JKBD COc1ccnc(C(=O)Nc2ccc(C3(NC(=O)c4cc(Cl)cc([N+](=O)[O-])c4C)CCC3)cc2)c1 1789759435 QUEHKIWKTNBSIW-UHFFFAOYSA-N 494.935 5.022 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)c3cccc4ccncc34)CCC2)cc1)c1cccc(F)c1[N+](=O)[O-] 1790698786 NJYLXFFFNFKWQU-UHFFFAOYSA-N 484.487 5.344 5 20 JKBD Cc1oc(C(C)(C)C)cc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C1(c2cccc([N+](=O)[O-])c2)CCC1 1800040242 UZLQXTGDNDYYGX-WKCHPHFGSA-N 493.604 5.167 5 20 JKBD COc1cc(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)[C@H]3CC[C@H](C(C)C)CC3)[nH]n2)ccc1[N+](=O)[O-] 1823286659 DEGFIPGQELRPDD-WFXMLNOXSA-N 497.596 5.095 5 20 JKBD O=C(c1ccc([N+](=O)[O-])o1)N1CCC([C@@H]2CCCCN2C(=O)c2cc3sccc3s2)CC1 1828547136 MTCJPJLFESTYPG-HNNXBMFYSA-N 473.576 5.011 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)N1CCCC[C@H]1C1CCN(C(=O)C2(C(F)(F)F)CCC2)CC1 1830730092 XSJXSCRYOUIVGJ-IBGZPJMESA-N 499.505 5.008 5 20 JKBD Cc1ccc(CC(=O)N2CCC([C@@H]3CCCCN3C(=O)c3ccc4ccoc4c3)CC2)cc1[N+](=O)[O-] 1830912094 MUXZRAYMHOWWCL-DEOSSOPVSA-N 489.572 5.125 5 20 JKBD O=C(CCc1cccc([N+](=O)[O-])c1)N1CC[C@H]2[C@@H]1CCN2C(=O)c1cc(Cl)c(Cl)c(Cl)c1 1847995831 QTKBHZZZRKSNIZ-OALUTQOASA-N 496.778 5.003 5 20 JKBD CSc1ccc(C(=O)OCc2csc(N(C(C)=O)c3cccc(C)c3C)n2)cc1[N+](=O)[O-] 9620805 IKXQZQWNZQNZEV-UHFFFAOYSA-N 471.560 5.432 5 20 JKBD Cc1cccc([N+](=O)[O-])c1NC(=O)CSc1nnc(-c2ccccc2)n1-c1ccc(F)cc1F 10317003 PCISMZWFDHEULF-UHFFFAOYSA-N 481.484 5.160 5 20 JKBD COc1cc(C(=O)OCC(=O)c2ccc(NC(C)=O)cc2)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 10911654 KCLWTUFZSRYVBY-UHFFFAOYSA-N 498.875 5.047 5 20 JKBD C[C@H](OC(=O)CCC(=O)c1ccc2ccccc2c1)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 10975451 UHWZNKYKKUICHK-AWEZNQCLSA-N 488.418 5.300 5 20 JKBD CCOc1ccc([C@H](C)N[C@@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Br)c2ccccc2)cc1 11707817 ZATCFHCSYAKQMW-QMHKHESXSA-N 498.377 5.787 5 20 JKBD O=C(Nc1ccc(OS(=O)(=O)c2ccc(Cl)cc2F)cc1)c1cc([N+](=O)[O-])ccc1Cl 14100544 HEVNGWDIVYOKER-UHFFFAOYSA-N 485.276 5.061 5 20 JKBD COc1cc(C(=O)Nc2ccccc2OC(F)F)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 15993560 KHOIVSCYCCQCNV-UHFFFAOYSA-N 464.808 5.903 5 20 JKBD O=C(CSc1nnc(Cc2cccs2)n1-c1ccccc1)Nc1ccc([N+](=O)[O-])cc1Cl 17757900 RUFQVRZVKUZXJU-UHFFFAOYSA-N 485.978 5.212 5 20 JKBD COc1ccccc1CCC(=O)O[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1 20891221 QHQAYEDFAAVEEO-HSZRJFAPSA-N 468.893 5.113 5 20 JKBD COc1cc(/C=C/c2ccc3cccc([N+](=O)[O-])c3n2)ccc1OCC(=O)Nc1ccccc1Cl 21190482 AKPAKPSOXHAGGG-FMIVXFBMSA-N 489.915 5.993 5 20 JKBD O=c1cc(-c2ccc([N+](=O)[O-])cc2)c2ccc(Oc3nc(-c4ccncc4)nc4ccccc34)cc2o1 24040869 XWUZDCAKNUOJMM-UHFFFAOYSA-N 488.459 6.166 5 20 JKBD Cc1csc(Sc2ccc(C(=O)N3CCC[C@H](c4nc5ccccc5o4)C3)cc2[N+](=O)[O-])n1 24695510 KRYWKCOKMLDKPP-INIZCTEOSA-N 480.571 5.672 5 20 JKBD Cc1ccc(-n2cnnc2S[C@H](C)C(=O)Nc2nc(-c3cccc([N+](=O)[O-])c3)cs2)c(C)c1 24845269 AYUNDHWYNBOTLG-OAHLLOKOSA-N 480.575 5.035 5 20 JKBD CC(C)c1noc(COC(=O)C/C(=C/c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)n1 29143489 ZMUGDMUCYSOVDA-WJDWOHSUSA-N 464.503 5.385 5 20 JKBD O=[N+]([O-])c1cc(S(=O)(=O)N2CCCCCC2)ccc1SCc1csc(-c2ccco2)n1 71855524 MXQRPBYLCQXSAE-UHFFFAOYSA-N 479.605 5.168 5 20 JKBD Cc1csc(Sc2ccc(C(=O)Nc3c(F)cccc3N3CCCC3)cc2[N+](=O)[O-])n1 110641559 HPYLKBMZSIJYIR-UHFFFAOYSA-N 458.540 5.503 5 20 JKBD COc1ccc([C@H](CNC(=O)CSc2ccc([N+](=O)[O-])cc2)c2c[nH]c3ccccc23)cc1 139823051 IEFKNKWGDPDHDL-QFIPXVFZSA-N 461.543 5.125 5 20 JKBD CSc1ccc(C(=O)Nc2ccc(NC(=O)c3ccc(F)cc3)cc2C(F)(F)F)cc1[N+](=O)[O-] 195612547 DESZCCZGEFLUCR-UHFFFAOYSA-N 493.438 5.979 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)N(Cc2cccnc2)c2ccc(Br)cc2)cc1SC 483409936 KBGSJUWFQFKOLF-UHFFFAOYSA-N 488.363 5.330 5 20 JKBD Cc1cc(-c2cc(C(=O)N3c4ccc([N+](=O)[O-])cc4C[C@H]3C)c3cnn(C(C)C)c3n2)c(C)o1 504319107 VFSLLTDZIHGNFO-CQSZACIVSA-N 459.506 5.389 5 20 JKBD Cc1csc(N(C(=O)c2ccc(N[C@H](C)c3ccccn3)c([N+](=O)[O-])c2)c2ccccc2)n1 506245526 LDJCGHWNGUKFHC-QGZVFWFLSA-N 459.531 5.906 5 20 JKBD CC(=O)Nc1ccc(Cl)c(NC(=O)c2cc([N+](=O)[O-])ccc2Sc2ccc(Cl)cc2)c1 511098769 ATJRBASCRWSQPT-UHFFFAOYSA-N 476.341 6.264 5 20 JKBD Cc1cccc(C)c1NS(=O)(=O)c1ccc(NC(=O)c2cc3cc([N+](=O)[O-])ccc3s2)cc1 513190771 YKSOSQPZSUAEDG-UHFFFAOYSA-N 481.555 5.479 5 20 JKBD O=C(c1ccc(Sc2nc3ccccc3s2)c([N+](=O)[O-])c1)N1CC[C@H](N2CCCCC2)C1 518087382 VSJUFOUGQLCBMY-KRWDZBQOSA-N 468.604 5.056 5 20 JKBD CC(C)Oc1ccc([C@@H](C)NC(=O)C2CCN(c3ccc(C(F)(F)F)cc3[N+](=O)[O-])CC2)cc1 518436777 KVBOFGFMLJRACI-MRXNPFEDSA-N 479.499 5.495 5 20 JKBD CC(C)Sc1ccc([N+](=O)[O-])cc1C(=O)N1C[C@H]2CC[C@H]1[C@H]1CN(Cc3ccccc3)C[C@H]21 594660289 KFJQJHJRPSMJAY-JFTIXFDTSA-N 465.619 5.078 5 20 JKBD COc1cccc(-c2cc(NC(=O)c3cc(OC)c(OC)cc3[N+](=O)[O-])n(-c3ccc(C)cc3)n2)c1 603760947 XWFWAGPHRSNHGG-UHFFFAOYSA-N 488.500 5.034 5 20 JKBD COC(=O)c1sc2[nH]c(/C=C\c3ccc(-c4ccc([N+](=O)[O-])cc4Cl)o3)nc(=O)c2c1C 603784845 TWJPVOZOKTYCBL-YVMONPNESA-N 471.878 5.072 5 20 JKBD O=C(Nc1ccc(NC(=O)c2ccco2)c(Cl)c1)c1ccc(NCc2ccccc2)c([N+](=O)[O-])c1 604198747 PCIYGYMUSWUNHR-UHFFFAOYSA-N 490.903 5.958 5 20 JKBD CCOC(=O)c1cc(NC(=O)c2ccc(N[C@@H](C)c3ccccn3)c([N+](=O)[O-])c2)ccc1Cl 604338879 HREWUDUELXRPHR-AWEZNQCLSA-N 468.897 5.245 5 20 JKBD O=C(Nc1nc(-c2ccc(OC(F)F)cc2OC(F)F)cs1)c1cc2cccc([N+](=O)[O-])c2[nH]1 604514888 VNYBHTWQCMQYSI-UHFFFAOYSA-N 496.398 5.655 5 20 JKBD CC(C)N(C(=O)c1ccc(Nc2ccccc2)c([N+](=O)[O-])c1)c1ccc(Br)cn1 609097772 KSYYVDXWTOUUKZ-UHFFFAOYSA-N 455.312 5.551 5 20 JKBD C[C@@H](c1cc2ccccc2o1)N(C)C(=O)CSc1nc2cc3ccccc3cc2c(=O)n1C 613972908 KXHBAORTHGJXIY-INIZCTEOSA-N 457.555 5.145 5 20 JKBD Cc1ncc([N+](=O)[O-])cc1C(=O)O[C@@H](C(=O)Nc1cc(Cl)cc(Cl)c1)c1ccccc1 730011582 DFGUBUDRLISRBJ-LJQANCHMSA-N 460.273 5.142 5 20 JKBD CN(Cc1cc([N+](=O)[O-])ccc1Cl)C(=O)c1ccc(CNC(=O)C23CC4CC(CC(C4)C2)C3)cc1 758852011 MTRYMKJZSPIDDQ-UHFFFAOYSA-N 496.007 5.353 5 20 JKBD COc1ccc(CSCc2nc(-c3ccc(Oc4ccccc4)nc3)no2)cc1[N+](=O)[O-] 904447805 JCNNBNJMGDGJEA-UHFFFAOYSA-N 450.476 5.274 5 20 JKBD O=C(C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)N1CCc2ccc([N+](=O)[O-])cc21 914605309 LVDSVYANEOQLRS-QGOAFFKASA-N 486.509 5.633 5 20 JKBD COC(=O)/C=C/c1ccc(N[C@@H](C)c2cccc(NC(=O)Cc3ccccc3F)c2)c([N+](=O)[O-])c1 917075307 FATNIQQDEKGZKU-HVJHFUJKSA-N 477.492 5.274 5 20 JKBD CC1CCN(c2ccc([N+](=O)[O-])cc2C(=O)Nc2ccc(C(=O)N3CCCCCC3)cc2)CC1 917779462 ZWXGSTIZJTUHGE-UHFFFAOYSA-N 464.566 5.100 5 20 JKBD COc1cc([C@H](C)NC(=O)c2cc([N+](=O)[O-])ccc2N2CCCC2)ccc1OC1CCCC1 918586955 UITXOUDLFTXKRU-KRWDZBQOSA-N 453.539 5.016 5 20 JKBD C[C@@H](Nc1ccc(C(=O)OCc2ccc(Br)s2)cc1[N+](=O)[O-])c1ccccn1 920121255 JDLZGJXRYDXEDZ-GFCCVEGCSA-N 462.325 5.344 5 20 JKBD Cn1cc(C(=O)OCc2csc(COc3ccc(Cl)cc3)n2)c(-c2ccc([N+](=O)[O-])cc2)n1 920549701 BMZIVVPZKKUTNY-UHFFFAOYSA-N 484.921 5.041 5 20 JKBD O=C(NC1(c2ccc(NC(=O)[C@@H]3C[C@@H]3c3ccc(F)c(F)c3)cc2)CCC1)c1ccc([N+](=O)[O-])o1 1786174881 NYMXZKRMEINZDG-QZTJIDSGSA-N 481.455 5.017 5 20 JKBD Cc1ncccc1CCC(=O)Nc1ccc(C2(NC(=O)/C=C/c3ccccc3[N+](=O)[O-])CCC2)cc1 1786748431 QRYVRDSZWLGBQY-MHWRWJLKSA-N 484.556 5.078 5 20 JKBD O=C(Cc1cc(F)ccc1[N+](=O)[O-])NC1(c2ccc(NC(=O)c3cc4sccc4[nH]3)cc2)CCC1 1789370171 XZLBDRZICPSMLG-UHFFFAOYSA-N 492.532 5.267 5 20 JKBD COc1cc(CC(=O)Nc2ccc(C3(NC(=O)c4cc5ccccc5o4)CCC3)cc2)ccc1[N+](=O)[O-] 1790478057 LWGWAPLMDSWCAL-UHFFFAOYSA-N 499.523 5.340 5 20 JKBD Cc1ccc(CC(=O)Nc2ccc(C3(NC(=O)C4(c5cccc([N+](=O)[O-])c5)CCC4)CCC3)cc2)o1 1791948350 YCJUPSDZHCQPIT-UHFFFAOYSA-N 487.556 5.295 5 20 JKBD Cc1ccc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cc4cc([N+](=O)[O-])ccc4s2)C3)cc1Cl 1792734698 OPPZRJNAEPDNIC-BCDXTJNWSA-N 483.977 5.337 5 20 JKBD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)/C=C/c1ccc([N+](=O)[O-])o1)c1sc2ccccc2c1Cl 1793273940 HDLVVZPHJKCQQW-DDQJEZCPSA-N 485.949 5.021 5 20 JKBD CC(C)c1ccc(CC(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)C2(c3cccc([N+](=O)[O-])c3)CCC2)cc1 1800041449 BREJMGHMCGAQDD-QEIWAGNOSA-N 489.616 5.021 5 20 JKBD O=C(CCC1CCC1)NC[C@@H]1CCN(C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)[C@@H]1c1cccnc1 1803377070 BAVKMMLZGYQOJR-UQBPGWFLSA-N 492.601 5.104 5 20 JKBD Cc1cccc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cc(Cl)cc([N+](=O)[O-])c2C)C3)c1Cl 1803622493 GAVHBVJNEIGUDH-BJWYYQGGSA-N 476.360 5.084 5 20 JKBD Cc1ccc(C(=O)N2CCCC3(CCN(C(=O)CCc4cccc([N+](=O)[O-])c4)CC3)C2)cc1Cl 1805081120 XPJAPQIORLETOZ-UHFFFAOYSA-N 483.996 5.034 5 20 JKBD Cc1c(Cl)cccc1C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cc(F)cc([N+](=O)[O-])c2)[nH]n1 1814599146 DACZOZWAOZZWRY-HXUWFJFHSA-N 485.903 5.039 5 20 JKBD O=C(/C=C/c1ccc([N+](=O)[O-])o1)Nc1cc([C@@H]2CCCCN2C(=O)Cc2ccc3ccccc3c2)[nH]n1 1814966973 YRHLMHUOUBHSEY-XDQZKXAQSA-N 499.527 5.012 5 20 JKBD CCCOc1ccc(C(=O)N2CCC([C@@H]3CCCCN3C(=O)c3ccc([N+](=O)[O-])cc3F)CC2)cc1 1830499494 YGZFRRHBZQAMHP-VWLOTQADSA-N 497.567 5.070 5 20 JKBD O=C(c1cccc2ccccc12)N1CCC([C@@H]2CCCCN2C(=O)c2cc(O)cc([N+](=O)[O-])c2)CC1 1830705135 SNJDJCGRUUTWTI-SANMLTNESA-N 487.556 5.001 5 20 JKBD C[C@@H](C(=O)N1CCC([C@H]2CCCCN2C(=O)CSc2ccccc2[N+](=O)[O-])CC1)c1ccccc1 1831777094 CWPKWNTXTZLADN-NFBKMPQASA-N 495.645 5.110 5 20 JKBD O=C(/C=C/c1ccc([N+](=O)[O-])o1)N1CCC([C@H]2CCCCN2C(=O)c2cccc3c2CCCC3)CC1 1832639853 YMIYOAOMKPIESJ-CVJKAFSHSA-N 491.588 5.013 5 20 JKBD CCCn1c(S[C@H](C)C(=O)Nc2cc([N+](=O)[O-])ccc2Cl)nnc1-c1ccc(Cl)cc1 9139102 LZKAFCKWCFUGBZ-GFCCVEGCSA-N 480.377 5.689 5 20 JKBD CSc1ccc(C(=O)c2ccccc2C(=O)OCC(=O)Nc2c(C)cc(C)cc2C)cc1[N+](=O)[O-] 10155184 FYCUFWTUIRYVIM-UHFFFAOYSA-N 492.553 5.268 5 20 JKBD COc1ccc(NC(=O)[C@@H](OC(=O)Cn2c3ccccc3c(=O)c3ccccc32)c2ccccc2)cc1 11278954 FRYVZRVYFLDOKJ-LJAQVGFWSA-N 492.531 5.087 5 20 JKBD c1ccc(Cn2c(CN3CCCCC3)nnc2SCc2nc3ccccc3c3ccccc23)cc1 14634005 YZKLPPCUEWRSJW-UHFFFAOYSA-N 479.653 6.306 5 20 JKBD Cc1ccc(-c2nc(CC(=O)O[C@H](C)C(=O)Nc3ccc([N+](=O)[O-])cc3C(F)(F)F)cs2)cc1 17205604 SJZALGMFRCZZKW-CYBMUJFWSA-N 493.463 5.158 5 20 JKBD C[C@H](Sc1nc2scc(-c3ccccc3)c2c(=O)n1C)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 17655320 IZZGPCYHFFVYJJ-ZDUSSCGKSA-N 491.554 5.474 5 20 JKBD C[C@H](OC(=O)c1cc([N+](=O)[O-])ccc1NCc1ccccc1)C(=O)Nc1ccccc1C(F)(F)F 18521251 LKFMXTZVWWYBMA-HNNXBMFYSA-N 487.434 5.410 5 20 JKBD Cc1cccc([N+](=O)[O-])c1C(=O)O[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1 22003737 YCLYLJCSEBMJFE-FQEVSTJZSA-N 469.837 5.002 5 20 JKBD CN(CC(=O)Nc1c(Cl)cccc1Cl)C(=O)c1cc([N+](=O)[O-])ccc1Sc1ccccc1 24861499 UDJMHELXDHEREM-UHFFFAOYSA-N 490.368 5.764 5 20 JKBD COc1cc(C(=O)Nc2cccc(Oc3cnccn3)c2)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 33136594 SJCCNADNOXCSHV-UHFFFAOYSA-N 492.875 5.884 5 20 JKBD O=C(CSc1nnc(-c2ccccc2Cl)n1Cc1ccccc1)Nc1ccccc1[N+](=O)[O-] 36859613 SQHRECADCHAFQN-UHFFFAOYSA-N 479.949 5.286 5 20 JKBD Cn1cnnc1Sc1ccc(C(=O)N2CCCC[C@@H]2c2ccc(C(F)(F)F)cc2)cc1[N+](=O)[O-] 116682098 UMXVTNWKBJUDOR-QGZVFWFLSA-N 491.495 5.261 5 20 JKBD CCCOc1c(Br)cc(C(=O)N(C)Cc2cc([N+](=O)[O-])ccc2Cl)cc1OC 248249811 OORUCGQEJAECEV-UHFFFAOYSA-N 471.735 5.080 5 20 JKBD COc1ccc(Oc2ccc([N+](=O)[O-])cc2C(=O)Nc2ccc(C(=O)NC(C)C)cc2C)cc1 490122398 INICFJIOEIQQMB-UHFFFAOYSA-N 463.490 5.095 5 20 JKBD O=C(NCC1CCOCC1)c1c2c(nc3ccccc13)/C(=C\c1cccc([N+](=O)[O-])c1)CCC2 501717960 PKLLSPUJJCDVAX-HKWRFOASSA-N 457.530 5.176 5 20 JKBD C[C@@H]1C[C@@H](C)CN(c2ccc(C(=O)Nc3cc(F)ccc3OC[C@@H]3CCCO3)cc2[N+](=O)[O-])C1 502365687 LKZASZPSDANEPV-HLIPFELVSA-N 471.529 5.026 5 20 JKBD CC(C)Sc1ccc([C@@H](C)NC(=O)c2ccc([N+](=O)[O-])cc2I)cc1 504743470 WSDCUTWHHIJLHT-GFCCVEGCSA-N 470.332 5.191 5 20 JKBD Cc1nc(-c2ccc([C@@H](C)NC(=O)c3ccc([N+](=O)[O-])cc3I)cc2)cs1 511391678 QBPYFWWDLLMVOK-LLVKDONJSA-N 493.326 5.122 5 20 JKBD Cc1nn(Cc2ccc(C(=O)N3CCC(c4nc5cc(Cl)ccc5o4)CC3)cc2)c(C)c1[N+](=O)[O-] 515575946 FDMSRKBZELFTTF-UHFFFAOYSA-N 493.951 5.271 5 20 JKBD CCOc1cc(C(=O)N(Cc2cccnc2)c2ccc(Br)cc2)c([N+](=O)[O-])cc1OC 515628555 SVTZKFXXRVSGSB-UHFFFAOYSA-N 486.322 5.007 5 20 JKBD COc1ccc(-c2ccc(CN[C@H](C)c3cnn(-c4ccc(F)cc4)c3C)o2)c([N+](=O)[O-])c1 518276759 NSRDRIWAFGHKSV-OAHLLOKOSA-N 450.470 5.347 5 20 JKBD COc1ccc2cc(CNCc3ccc(OCc4ccc([N+](=O)[O-])cc4)c(OC)c3)ccc2c1 521823292 UENYYJNUOUOHSG-UHFFFAOYSA-N 458.514 5.634 5 20 JKBD Cc1cnn([C@@H]2CCCc3ccccc32)c1NC(=O)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-] 524377700 NDZHCJOUOSNOHZ-LJQANCHMSA-N 474.439 5.219 5 20 JKBD Cc1ccc(NC(=O)[C@H](Sc2n[nH]c(/C=C\c3ccccc3)n2)c2ccccc2)c([N+](=O)[O-])c1 598953730 WBCLNXIZRVFJMM-ODFVOIPKSA-N 471.542 5.664 5 20 JKBD O=C(Cc1ccc([N+](=O)[O-])cc1)N(C[C@H]1CCCO1)c1nc(-c2ccc(Cl)cc2Cl)cs1 603463239 SVXRPEONJAENBF-QGZVFWFLSA-N 492.384 5.780 5 20 JKBD COc1cc(C(=O)Nc2c3ccccc3n3c(C)nc4ccccc4c23)c([N+](=O)[O-])cc1OC 603470021 FPRSYHDLANIKKV-UHFFFAOYSA-N 456.458 5.127 5 20 JKBD COc1cccc([C@@H](C)NC(=O)C/C(=C/c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)c1 603518388 NYRNNQVIADAGCO-LCJWNIEWSA-N 473.554 6.021 5 20 JKBD CCOc1cc(NC(=O)N2CCC[C@@H](c3nc4ccccc4s3)C2)c([N+](=O)[O-])cc1OCC 603651376 JYBKNRCLSVIXRF-OAHLLOKOSA-N 470.551 5.413 5 20 JKBD CCCOc1cc(NC(=O)N2CCC(C(=O)Nc3ccccc3)CC2)c([N+](=O)[O-])cc1OCCC 603653372 ZRFPUMACQOTCMD-UHFFFAOYSA-N 484.553 5.055 5 20 JKBD O=C(C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1)N1CCCSc2ccccc21 603820083 KLDZBZZYWNNCBF-UHFFFAOYSA-N 465.497 5.359 5 20 JKBD CCOc1cc([N+](=O)[O-])c(C(=O)N2CC[C@H](C)Sc3ccc(C(F)(F)F)cc32)cc1OC 603961827 KQLHQLNBTFKJGL-LBPRGKRZSA-N 470.469 5.552 5 20 JKBD CN(C(=O)c1ccc(NC(=O)c2cnn(-c3ccc([N+](=O)[O-])cc3)c2)cc1Cl)C1CCCCC1 603982686 PUYBYARLKXKBLT-UHFFFAOYSA-N 481.940 5.091 5 20 JKBD O=C(Nc1cccc(-c2n[nH]c(C3CC3)n2)c1)c1ccc(NCc2ccccc2)c([N+](=O)[O-])c1 608855356 JLWZJTOZHBOMPA-UHFFFAOYSA-N 454.490 5.122 5 20 JKBD COc1ccc(-c2nnc(Sc3ccc(C(=O)Nc4ccc(C)cc4)cc3[N+](=O)[O-])o2)cc1 608971779 QOYDFYZSUMIZDQ-UHFFFAOYSA-N 462.487 5.365 5 20 JKBD C[C@@H](NC(=O)c1ccc(N[C@H](C)c2ccccn2)c([N+](=O)[O-])c1)c1ccc(F)c(Br)c1 609374977 OENUVHCVQVEEGK-ZIAGYGMSSA-N 487.329 5.556 5 20 JKBD O=[N+]([O-])c1ccc(-c2ccc(CNC[C@@H](O)c3ccc(OC(F)(F)F)cc3)o2)c(Cl)c1 726605230 AGNYMFSPPAWNNO-GOSISDBHSA-N 456.804 5.230 5 20 JKBD COc1ccc(OC)c([C@H](O)CNC(=O)CCC(=O)c2ccc3ccc4cccc5ccc2c3c45)c1 727766718 DZPRLZGBLWRBOK-AREMUKBSSA-N 481.548 5.414 5 20 JKBD O=C(O[C@H](C(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1)c1ccccc1)c1cnc(C2CC2)s1 729771954 BDAYJPKDMREVCL-SFHVURJKSA-N 457.895 5.119 5 20 JKBD CC(C)N(Cc1nnc(-c2cccc([N+](=O)[O-])c2)o1)C(=O)[C@@H]1C[C@H]1c1ccc(Cl)cc1Cl 730449098 AWAXRJJTTOYLEB-ZWKOTPCHSA-N 475.332 5.492 5 20 JKBD Cc1cc(NC(=O)c2cc([N+](=O)[O-])ccc2Br)n(-c2cccc(C(F)(F)F)c2)n1 751073971 YZOPCWXSHUJDNY-UHFFFAOYSA-N 469.217 5.123 5 20 JKBD O=[N+]([O-])c1ccc(/C=C(\Cc2nc(Cc3cccnc3)no2)c2nc3ccccc3s2)cc1 904678554 PCZGAZIHQYMDEY-LDADJPATSA-N 455.499 5.357 5 20 JKBD Cc1ccc(Sc2ccc(C(=O)N3CCC(NC(=O)OC(C)(C)C)CC3)cc2[N+](=O)[O-])cc1 917209903 CYGLBKFQVYKDSY-UHFFFAOYSA-N 471.579 5.184 5 20 JKBD O=C(Cc1cccc([N+](=O)[O-])c1)Nc1ccc(C2(NC(=O)c3cc4sccc4[nH]3)CCC2)cc1 1785792426 YBFLCHPZLIASOS-UHFFFAOYSA-N 474.542 5.128 5 20 JKBD O=C(/C=C/c1ccc([N+](=O)[O-])o1)NC1(c2ccc(NC(=O)c3cc4cccnc4s3)cc2)CCC1 1788968196 KKJCBSGAAQEJRV-CSKARUKUSA-N 488.525 5.259 5 20 JKBD CC(C)[C@@H](C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)/C=C/c1ccccc1[N+](=O)[O-])C2)c1ccc(Cl)cc1 1801555032 JWIVMWUEIVUFHI-CSDUMEFYSA-N 496.007 5.339 5 20 JKBD O=C(Nc1cc([C@H]2CCCCN2C(=O)/C=C/c2ccccc2[N+](=O)[O-])[nH]n1)c1cc2ccccc2o1 1818634230 UYNYOAPCWKQWNO-JNCYCUAHSA-N 485.500 5.083 5 20 JKBD CC1(C)CCC(CC(=O)N2CCCC[C@H]2c2cc(NC(=O)c3cc(F)cc([N+](=O)[O-])c3)n[nH]2)CC1 1821166996 KBFZWPKJMMHVDS-NRFANRHFSA-N 485.560 5.369 5 20 JKBD Cc1cc(CCCC(=O)N2CCC([C@@H]3CCCCN3C(=O)[C@]3(C)C[C@H]3C)CC2)c([N+](=O)[O-])cc1F 1830216705 SIRHISHZNMQALL-VQEMNGCCSA-N 487.616 5.031 5 20 JKBD O=C(C1=CCCC1)N1CCC([C@@H]2CCCCN2C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)CC1 1831061411 SFMIHGKJAKVSOK-NRFANRHFSA-N 467.591 5.153 5 20 JKBD COc1ccc(-c2nnc(SCc3cccc([N+](=O)[O-])c3)n2C2CCCCC2)cc1OC 11379165 SVLPVWODTVFIGH-UHFFFAOYSA-N 454.552 5.668 5 20 JKBD Cc1c(C(=O)OCC(=O)Nc2c(Cl)c(Cl)cc(Cl)c2Cl)cccc1[N+](=O)[O-] 11397348 WERQBMWMGWTAGR-UHFFFAOYSA-N 452.077 5.312 5 20 JKBD O=C(Nc1ncc(S(=O)(=O)c2ccc([N+](=O)[O-])cc2)s1)c1ccc(Oc2ccc(F)cc2)cc1 16182605 YXPFCIOCHZLSNT-UHFFFAOYSA-N 499.501 5.068 5 20 JKBD CC(=O)Nc1cccc(NC(=O)[C@H](C)Sc2nc3ccccc3c3nc4ccccc4n23)c1 21767887 OEWDJXYOSUZUNC-HNNXBMFYSA-N 455.543 5.113 5 20 JKBD CCN(CC)C(=O)c1ccc(NC(=O)c2ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])c(OC)c2)cc1 22885262 KEYQBWQEMSNJHW-UHFFFAOYSA-N 497.935 5.783 5 20 JKBD COc1ccc(C)cc1-c1csc(NC(=O)c2ccc(N[C@H](C)c3ccccn3)c([N+](=O)[O-])c2)n1 108780513 AKNCVJGOSKFLGS-MRXNPFEDSA-N 489.557 5.856 5 20 JKBD O=C(CCNc1ccc(C(F)(F)F)cc1[N+](=O)[O-])N1CCCC[C@H]1c1nc(-c2ccccc2)no1 303146130 BXSULZJZBJDTKL-SFHVURJKSA-N 489.454 5.219 5 20 JKBD C[C@@H](Sc1nnc(-c2ccccc2Cl)n1Cc1ccccc1)C(=O)Nc1ccc([N+](=O)[O-])cc1 409932345 KYXNXUCRLHDCRP-MRXNPFEDSA-N 493.976 5.674 5 20 JKBD O=C(Nc1ccc(Cl)c(C(=O)NCc2ccccc2F)c1)c1cc2cc([N+](=O)[O-])ccc2s1 484266647 LWKKOXCVZYKZET-UHFFFAOYSA-N 483.908 5.784 5 20 JKBD C[C@H](NC(=O)c1ccccc1Sc1ccc(Br)cn1)c1cccc([N+](=O)[O-])c1 489327791 KRXZUXAORAOQHV-ZDUSSCGKSA-N 458.337 5.395 5 20 JKBD COc1ccc(Br)cc1[C@H]1CCCN1C(=O)Cn1c2ccccc2c(=O)c2ccccc21 504920009 QBEYEZYQIPPDPM-HSZRJFAPSA-N 491.385 5.290 5 20 JKBD Cc1cccc(-c2nc(C(C)C)no2)c1NC(=O)CCNc1ccc(C(F)(F)F)cc1[N+](=O)[O-] 508743523 PGHBGLXTAZAPNG-UHFFFAOYSA-N 477.443 5.536 5 20 JKBD CCCC(=O)Nc1ccc(CNCc2ccc(Oc3ccccc3Cl)c([N+](=O)[O-])c2)cc1 509562940 BDKYXSNTPGYZML-UHFFFAOYSA-N 453.926 6.069 5 20 JKBD C[C@H](Nc1ccc(C(=O)N[C@H](c2ccc(F)cc2)c2cccs2)cc1[N+](=O)[O-])c1ccccn1 516162047 APGPYYSHDSAKAC-UPCLLVRISA-N 476.533 5.883 5 20 JKBD CCCN(C(=O)c1ccc(Nc2ccccc2)c([N+](=O)[O-])c1)C1CCN(C(=O)c2ccccc2)CC1 523243842 NWSQEJNAMGUURI-UHFFFAOYSA-N 486.572 5.495 5 20 JKBD COc1cc(C(=O)N2Cc3ccccc3-c3ccccc3C2)c([N+](=O)[O-])cc1OCc1cscn1 523899296 QGFGMERXWPXFNC-UHFFFAOYSA-N 487.537 5.462 5 20 JKBD O=C(C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)Nc1ccc(N2CCNC2=O)cc1 589743177 IEVLCCUQANUGQU-SDXDJHTJSA-N 499.552 5.304 5 20 JKBD CN(Cc1ccc(F)cc1F)C(=O)C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1 603263216 GTCMARXLNFCBTC-LDADJPATSA-N 479.508 6.072 5 20 JKBD CS(=O)(=O)c1ccc(Cl)c(NC(=O)c2cc([N+](=O)[O-])ccc2Sc2ccc(Cl)cc2)c1 603450167 OXGNLOMCRRUUPY-UHFFFAOYSA-N 497.381 5.709 5 20 JKBD Cc1nn(Cc2ccc(C(=O)N3CC=C(c4c[nH]c5cc(F)ccc45)CC3)cc2)c(C)c1[N+](=O)[O-] 603674752 YNZMKYZGJZGBEU-UHFFFAOYSA-N 473.508 5.006 5 20 JKBD CCCOc1ccc(C(F)(F)F)cc1NC(=O)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-] 603727522 VGTUQKBVKLXBBH-UHFFFAOYSA-N 466.334 5.596 5 20 JKBD CN(Cc1ccccc1[N+](=O)[O-])C(=O)N[C@@H](c1ccccc1)c1ccc(Br)cc1F 604127704 HDDPXCZQVVQALT-NRFANRHFSA-N 472.314 5.427 5 20 JKBD O=C(C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)N1CCC[C@@H]1CN1CCCC1 608813894 FMKVLUREOLRFKT-QMZMWQIVSA-N 476.602 5.222 5 20 JKBD Cc1ccc(S(=O)(=O)Nc2ccc(NC(=O)c3c[nH]c4cc(Cl)ccc34)cc2)cc1[N+](=O)[O-] 608889630 LFKYZRWNDNWJKL-UHFFFAOYSA-N 484.921 5.091 5 20 JKBD O=C(c1ccc(NCc2ccccc2Cl)c([N+](=O)[O-])c1)N1CCO[C@@H](c2ccc(F)c(F)c2)C1 608964961 PGXJGFQZJPGRMO-HSZRJFAPSA-N 487.890 5.352 5 20 JKBD Cc1nn(Cc2ccc(C(=O)Nc3cc(F)ccc3Oc3ccccc3)cc2)c(C)c1[N+](=O)[O-] 609022966 WUKIIXWQIDJBAB-UHFFFAOYSA-N 460.465 5.640 5 20 JKBD O=C(c1ccc(C(=O)N2CCC[C@H]2c2ccsc2)c([N+](=O)[O-])c1)N1CCC[C@H]1c1ccsc1 609044541 KKTIWPUOYUFMEA-SFTDATJTSA-N 481.599 5.672 5 20 JKBD CC[C@@H](Nc1ccc(S(=O)(=O)N(CC)c2ccccc2)cc1[N+](=O)[O-])c1nc(C)cs1 609193502 NMPBKDRMTZEOPP-GOSISDBHSA-N 460.581 5.138 5 20 JKBD CCc1cc[n+](/C(C(=S)Nc2ccc(OC)c(F)c2)=C(/O)c2ccc(C)c([N+](=O)[O-])c2)cc1 726576259 PEGNTHXGYVOSOF-UHFFFAOYSA-O 468.530 5.224 5 20 JKBD Cc1cc(OC(C)C)ccc1NC(=O)N1CCN(c2ccc([N+](=O)[O-])cc2C(F)(F)F)CC1 727590721 OLXNASAQNNRZFC-UHFFFAOYSA-N 466.460 5.063 5 20 JKBD COC1CCN(c2ccc(NC(=O)N[C@@H](C)c3cccc([N+](=O)[O-])c3)cc2C(F)(F)F)CC1 728125096 RACNBTYZMYNVMS-AWEZNQCLSA-N 466.460 5.112 5 20 JKBD CCN(C(=O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1C)[C@@H]1CCSc2ccc(Br)cc21 728846828 SMYIRRFWEWIKAS-MRXNPFEDSA-N 480.340 5.273 5 20 JKBD Cc1c(C(=O)N2CCCC[C@@H]2C(=O)Nc2cc(Cl)ccc2Cl)cc([N+](=O)[O-])c(C)c1[N+](=O)[O-] 748838468 TWNXILDOHOWHJE-QGZVFWFLSA-N 495.319 5.060 5 20 JKBD C[C@@H](OC(=O)/C=C\c1ccccc1OC(F)(F)F)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 914944090 YWELYLRXVUGHIC-DHHDDZJSSA-N 492.328 5.096 5 20 JKBD CN(C(=O)C1CC1)c1ccccc1C(=O)Oc1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2Cl)cc1 916952027 NZLTWOZNJDACBD-UHFFFAOYSA-N 493.903 5.093 5 20 JKBD O=C(COC(=O)c1cc([N+](=O)[O-])ccc1Oc1ccccc1)Nc1ccccc1C(F)(F)F 919192360 IXWNJLRUNRNONU-UHFFFAOYSA-N 460.364 5.201 5 20 JKBD O=C(Nc1ccc(Cl)cc1)Nc1ccc(NC(=O)c2cc([N+](=O)[O-])cc([N+](=O)[O-])c2)cc1 920297221 LFGYTVPITVJCIA-UHFFFAOYSA-N 455.814 5.053 5 20 JKBD C[C@H](OC(=O)CCSc1ccc(Br)cc1)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl 920581158 JMACHRXIRPCGLX-NSHDSACASA-N 487.759 5.063 5 20 JKBD C[C@H](OC(=O)c1cccnc1Oc1ccc(Cl)cc1Cl)C(=O)Nc1ccccc1[N+](=O)[O-] 920911062 AGMUZGQGCULACL-LBPRGKRZSA-N 476.272 5.273 5 20 JKBD COc1ccc([C@@H](C)C(=O)Nc2ccc(C3(NC(=O)Cc4cccc([N+](=O)[O-])c4)CCC3)cc2)cc1 1786035587 HHSZMDYXQDIQFF-LJQANCHMSA-N 487.556 5.084 5 20 JKBD COc1cc(C(=O)NC2(c3ccc(NC(=O)c4sccc4C)cc3)CCC2)ccc1[N+](=O)[O-] 1787280022 GNSMNLRUCLFOGM-UHFFFAOYSA-N 465.531 5.035 5 20 JKBD COc1cc(CC(=O)NC2(c3ccc(NC(=O)CCC4CCCC4)cc3)CCC2)ccc1[N+](=O)[O-] 1787618798 XSXSGWUWBLJLNW-UHFFFAOYSA-N 479.577 5.250 5 20 JKBD O=C(/C=C/c1cc2ccccc2o1)Nc1ccc(C2(NC(=O)c3cc(O)cc([N+](=O)[O-])c3)CCC2)cc1 1789116108 GDAGGXBDPYVXSL-ZHACJKMWSA-N 497.507 5.508 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)NC1(c2ccc(NC(=O)c3cc4ncsc4[nH]3)cc2)CCC1 1789668074 BLJNZAPYAULIRE-UHFFFAOYSA-N 493.520 5.042 5 20 JKBD CC1(C)CCC(CC(=O)NC2(c3ccc(NC(=O)c4ccc([N+](=O)[O-])[nH]4)cc3)CCC2)CC1 1790187226 ILMLVXKQXGZVKK-UHFFFAOYSA-N 452.555 5.277 5 20 JKBD O=C(/C=C/c1ccccc1[N+](=O)[O-])N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccccc1Oc1ccccc1 1799552583 CPMWLWZYPYXMQJ-QYPWNIQKSA-N 497.551 5.352 5 20 JKBD CC(C)c1ccc(CC(=O)Nc2cc([C@@H]3CCCCN3C(=O)c3cccc(F)c3[N+](=O)[O-])[nH]n2)cc1 1822137802 CXWZJPQOSOPKJE-QFIPXVFZSA-N 493.539 5.129 5 20 JKBD O=C(/C=C/c1ccccc1[N+](=O)[O-])N1CCC([C@H]2CCCCN2C(=O)/C=C/c2ccsc2)CC1 1825304236 NWMHXXDRIWXHER-VSSKNMHGSA-N 479.602 5.003 5 20 JKBD Cc1c(C(=O)N2CCCC23CN(C(=O)c2cc4cc(F)ccc4s2)C3)cc(Cl)cc1[N+](=O)[O-] 1845499464 XDCOAQCSBVGWNN-UHFFFAOYSA-N 487.940 5.041 5 20 JKBD O=C(OCc1cc([N+](=O)[O-])cc2c1OCOC2)c1ccccc1CSc1nc2ccccc2o1 9555935 BOYPBWVQFFCVMM-UHFFFAOYSA-N 478.482 5.252 5 20 JKBD Cc1ccc(NC(=O)[C@H](OC(=O)c2csc(-c3ccccc3)n2)c2ccccc2)c([N+](=O)[O-])c1 17984165 JOLVPWZBTWYENR-JOCHJYFZSA-N 473.510 5.564 5 20 JKBD CC(C)[C@H](NC(=O)CSc1ccc(C(F)(F)F)cc1[N+](=O)[O-])c1nc2ccccc2[nH]1 104723616 UHPGDVRBXDRFHQ-SFHVURJKSA-N 452.458 5.096 5 20 JKBD O=C(C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)NCc1ccn(-c2ccccc2)n1 490565697 KRIQQAXJOINZQX-CAPFRKAQSA-N 495.564 5.637 5 20 JKBD O=C(Nc1cccc(CNC(=O)c2csc(-c3ccc([N+](=O)[O-])cc3)n2)c1)c1ccc(F)cc1 496633606 UHBQWXDZWGFTRN-UHFFFAOYSA-N 476.489 5.040 5 20 JKBD Cc1occc1C(=O)Nc1cc(NC(=O)c2csc(-c3ccc([N+](=O)[O-])cc3)n2)ccc1F 498420934 RNXJZEBASPADMW-UHFFFAOYSA-N 466.450 5.263 5 20 JKBD CC(C)[C@@H](C)NC(=O)C1CCN(C(=O)c2ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])cc2)CC1 500240800 YVXFXJWPUIXCCJ-MRXNPFEDSA-N 473.957 5.053 5 20 JKBD COc1cc([C@H](C)NC(=O)c2ccc(C(C)(C)C)c([N+](=O)[O-])c2)ccc1OCc1ccncc1 502697703 JALYPJCQFYYPAV-KRWDZBQOSA-N 463.534 5.366 5 20 JKBD CSc1ccc(-c2csc(NC(=O)c3cn(C)nc3-c3ccc([N+](=O)[O-])cc3)n2)cc1 505992780 RVMXVXPPGOUNLT-UHFFFAOYSA-N 451.533 5.093 5 20 JKBD CCOc1cc(Br)c(NC(=O)C2CCN(c3ccccc3[N+](=O)[O-])CC2)cc1OCC 508052981 NPIJBEYSOAPLSL-UHFFFAOYSA-N 492.370 5.010 5 20 JKBD O=[N+]([O-])c1ccc(-c2nn(-c3ccccc3)cc2CNCc2ccnc(OCc3ccccc3)c2)cc1 518266309 XTFPHVMSWYAKLR-UHFFFAOYSA-N 491.551 5.711 5 20 JKBD COc1cc(CS(=O)(=O)Cc2ccccc2Oc2ccccc2)c([N+](=O)[O-])cc1OC(F)F 552438813 LTIVSKMUYTWNJW-UHFFFAOYSA-N 479.457 5.112 5 20 JKBD O=C(Nc1cc(-c2nnc3n2CCCCC3)ccc1Cl)c1cc2cc([N+](=O)[O-])ccc2s1 591773253 FWUSPDRXGHNEDM-UHFFFAOYSA-N 467.938 5.700 5 20 JKBD O=C(C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)N1CCN(c2ccccc2)CC1 601566348 FGKCGHAXRPJGCM-DYTRJAOYSA-N 484.581 5.484 5 20 JKBD C[C@@H]1CCCN(c2ccc(C(=O)Nc3cccc(-c4nnc5n4CCCCC5)c3)cc2[N+](=O)[O-])C1 603467102 LPAIKBMSKRJQMD-GOSISDBHSA-N 474.565 5.068 5 20 JKBD C[C@@H]1C[C@@H](C)CN(c2ccc(C(=O)N3CCC[C@@H](c4nc5ccccc5o4)C3)cc2[N+](=O)[O-])C1 603609380 MIRGWPKAVRIWJY-QWFCFKBJSA-N 462.550 5.238 5 20 JKBD COc1ccc(-c2cc(NC(=O)c3cc(OC)c(OC)cc3[N+](=O)[O-])n(-c3cccc(C)c3)n2)cc1 603760157 HOTLIMCVGVNHJZ-UHFFFAOYSA-N 488.500 5.034 5 20 JKBD COc1cc([C@H](C)NC(=O)c2ccc(Cn3nc(C)c([N+](=O)[O-])c3C)cc2)ccc1OC1CCCC1 603764138 HHANXSHZTOWKSB-KRWDZBQOSA-N 492.576 5.277 5 20 JKBD Cc1cc(-c2csc(NC(=O)c3cc4c(cc3[N+](=O)[O-])OCO4)n2)c(C)n1CCc1ccccc1 603941587 DQBPLJSPLOYKHC-UHFFFAOYSA-N 490.541 5.360 5 20 JKBD Cc1sc(NC(=O)c2cn(Cc3ccccc3)nc2-c2cccnc2)nc1-c1cccc([N+](=O)[O-])c1 603997066 QBKXXRUWBHWETF-UHFFFAOYSA-N 496.552 5.586 5 20 JKBD Cc1cc([N+](=O)[O-])ccc1NC(=O)CNc1ccc(Cl)cc1C(=O)N1[C@@H](C)CCC[C@H]1C 604009984 JEJOJAIFPLCROV-IYBDPMFKSA-N 458.946 5.010 5 20 JKBD Cc1nn(Cc2ccc(C(=O)Nc3ccc(NC(=O)c4ccco4)c(Cl)c3)cc2)c(C)c1[N+](=O)[O-] 604119986 VGWFMBFEGCCDOL-UHFFFAOYSA-N 493.907 5.207 5 20 JKBD COc1cc(C(=O)N(c2ccc(C)cn2)C2CCCCC2)c([N+](=O)[O-])cc1OCc1cscn1 609375609 CWCBALQYSDBLTA-UHFFFAOYSA-N 482.562 5.322 5 20 JKBD CC(C)n1ncc2cc(NC(=O)C/C(=C/c3ccc([N+](=O)[O-])cc3)c3nc4ccccc4s3)cnc21 617164713 NIKVDXVNZYEYNG-WQRHYEAKSA-N 498.568 6.100 5 20 JKBD O=C(c1ccccc1)c1ccc(Sc2nnc(Cc3cccs3)n2C2CC2)c([N+](=O)[O-])c1 619568925 ZLXOCJASYVKDAH-UHFFFAOYSA-N 462.556 5.556 5 20 JKBD COc1c(Br)cc(Cl)cc1NC(=O)Cn1c2ccccc2c(=O)c2ccccc21 653959344 FYLZYQCXIRPFSQ-UHFFFAOYSA-N 471.738 5.218 5 20 JKBD Cc1cc(C(=O)O[C@@H](C)C(=O)Nc2cc([N+](=O)[O-])ccc2Cl)c2cc(Br)ccc2n1 725977089 UKCLJHYYQSNOAB-NSHDSACASA-N 492.713 5.051 5 20 JKBD C[C@H]1Cc2cc([N+](=O)[O-])ccc2N1C(=O)CCCCCCC(=O)N1c2ccc([N+](=O)[O-])cc2C[C@H]1C 728810963 YJTPDIHCXQZCQA-HDICACEKSA-N 494.548 5.099 5 20 JKBD O=C(Nc1ccc(OC(=O)[C@@H]2CCCN(Cc3ccccc3)C2)cc1)c1cc([N+](=O)[O-])ccc1Cl 746818817 IQLZHMNAPFTRBE-LJQANCHMSA-N 493.947 5.318 5 20 JKBD Cc1oc(-c2ccco2)nc1CC(=O)Oc1ccc2c(-c3ccc([N+](=O)[O-])cc3)cc(=O)oc2c1 749473443 JQJYDDSJOKYBNZ-UHFFFAOYSA-N 472.409 5.073 5 20 JKBD Cc1cccc(-c2nnc(S[C@@H](C(=O)Nc3ccc(Cl)c([N+](=O)[O-])c3)c3ccccc3)o2)c1 780126338 QNHPXJDHVXMNPK-HXUWFJFHSA-N 480.933 6.079 5 20 JKBD Cc1ccc(N2C(=O)CC[C@H](C(=O)Nc3cc([N+](=O)[O-])c(F)cc3F)[C@H]2c2cccs2)cc1 825487356 APQGVBZYJMKBGK-NYHFZMIOSA-N 471.485 5.366 5 20 JKBD O=C(COc1ccc(Oc2ccccn2)cc1)Oc1ccc(NC(=O)c2cccc([N+](=O)[O-])c2)cc1 899213274 ZEFJTZRVLUPWOL-UHFFFAOYSA-N 485.452 5.019 5 20 JKBD CCc1ccc(N(C(=O)Cn2ncc3ccc([N+](=O)[O-])cc32)c2nc3ccccc3s2)cc1 918541629 LVOYMJVPVGTHPJ-UHFFFAOYSA-N 457.515 5.482 5 20 JKBD CC1CCN(c2ccc([N+](=O)[O-])cc2C(=O)Nc2ccccc2OC[C@H]2CCCCO2)CC1 920012936 GFVKOLREJRDAMJ-HXUWFJFHSA-N 453.539 5.031 5 20 JKBD Cc1ccc(NCCC(=O)NC2(c3ccc(NC(=O)c4ccc([N+](=O)[O-])o4)cc3)CCC2)c(C)c1 1785750807 TXZNAVZJIZKRNO-UHFFFAOYSA-N 476.533 5.055 5 20 JKBD CCOc1ccsc1C(=O)Nc1ccc(C2(NC(=O)c3cccc(F)c3[N+](=O)[O-])CCC2)cc1 1785774388 SWFHGZLWKCAMMR-UHFFFAOYSA-N 483.521 5.256 5 20 JKBD COc1cc(C(=O)NC2(c3ccc(NC(=O)c4cccc5ccn(C)c45)cc3)CCC2)ccc1[N+](=O)[O-] 1789061524 JNPOPWIGOBWGSG-UHFFFAOYSA-N 498.539 5.157 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)c3ccc([N+](=O)[O-])o3)CCC2)cc1)c1ccc(Cl)c(Cl)c1 1790266345 YTARCNWWVDZJJE-UHFFFAOYSA-N 474.300 5.556 5 20 JKBD O=C(Cc1cc(F)ccc1[N+](=O)[O-])Nc1ccc(C2(NC(=O)c3ccnc(C(F)F)c3)CCC2)cc1 1792308281 ICWRAZFKLHQLRK-UHFFFAOYSA-N 498.461 5.057 5 20 JKBD Cc1ccc2cc(C(=O)N[C@@H]3C[C@@H]4CC[C@H](C3)N4C(=O)/C=C/c3ccccc3[N+](=O)[O-])sc2c1 1804345699 STPLNCJCTMFYCT-IKNLRRFCSA-N 475.570 5.083 5 20 JKBD CC(C)(C)CCCCCC(=O)N1CC[C@H](CNC(=O)c2ccc(O)c([N+](=O)[O-])c2)[C@H]1c1cccnc1 1810718869 ZNEYNSXFAROJLT-PXDATVDWSA-N 496.608 5.012 5 20 JKBD Cc1c(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)c3cccc(F)c3)[nH]n2)cc(Cl)cc1[N+](=O)[O-] 1821294873 VBBVODYWQRYXEB-IBGZPJMESA-N 485.903 5.039 5 20 JKBD Cc1cc(CCCC(=O)N2CCC([C@@H]3CCCCN3C(=O)c3occc3C)CC2)c([N+](=O)[O-])cc1F 1827736211 JOAOAJYREWDDNL-QHCPKHFHSA-N 499.583 5.200 5 20 JKBD Cc1cc(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)[C@@H]3CCC[C@@H]4CCCC[C@@H]43)CC2)ncc1[N+](=O)[O-] 1827828465 YZMUVRGFKVDLSZ-FDHFVPJWSA-N 496.652 5.138 5 20 JKBD O=C([C@@H]1CCC[C@@H]2CCCC[C@@H]21)N1CCC([C@H]2CCCCN2C(=O)c2cc(O)cc([N+](=O)[O-])c2)CC1 1830705191 UVTZVJOEWYQEKW-HEEDUKKLSA-N 497.636 5.140 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)N1CCC([C@@H]2CCCCN2C(=O)C[C@H]2C[C@@H]3CC[C@H]2C3)CC1 1831482720 UUCLOTPIQCPQJN-QUFILJBYSA-N 485.600 5.102 5 20 JKBD COc1cc(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3ccc(Cl)cc3C)CC2)ccc1[N+](=O)[O-] 1832694607 NLPKVRJAOBOHJU-JOCHJYFZSA-N 499.995 5.112 5 20 JKBD C[C@H](OC(=O)c1ccc(COc2ccccc2)cc1)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl 9480463 CVFOQYFCIPGMIA-HNNXBMFYSA-N 454.866 5.011 5 20 JKBD O=C(NC1CCN(C(=O)c2ccco2)CC1)c1cc([N+](=O)[O-])ccc1Sc1ccc(Cl)cc1 11527817 NVSNLMVWKXAGTD-UHFFFAOYSA-N 485.949 5.027 5 20 JKBD Cc1ccc(NC(=O)[C@@H](Sc2nnc(-c3ccccc3C)n2C)c2ccccc2)c([N+](=O)[O-])c1 21674579 JMGCBLZVITWZQB-QFIPXVFZSA-N 473.558 5.479 5 20 JKBD O=C(Cn1c2ccccc2c(=O)c2ccccc21)OCc1csc(-c2ccc(C(F)(F)F)cc2)n1 25639379 OSCORBIBYMMCDX-UHFFFAOYSA-N 494.494 6.040 5 20 JKBD Cc1cc(C)c(NC(=O)COC(=O)c2cc([N+](=O)[O-])ccc2Sc2nc(C)cs2)c(C)c1 28832369 UKPJZJDGRNIFJN-UHFFFAOYSA-N 471.560 5.232 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)Nc2ccc(Br)cc2Br)cc1SC 112529949 CZHNXCFOKIQKBX-UHFFFAOYSA-N 476.146 5.103 5 20 JKBD COc1cc(OC)c(Cl)c(-c2ccc3nc(Nc4c(C)cccc4[N+](=O)[O-])ncc3c2)c1Cl 216829160 AWPFTEVSSDBFLQ-UHFFFAOYSA-N 485.327 6.581 5 20 JKBD C[C@@H](Nc1ccc(NC(=O)c2ccc(N[C@H](C)c3ccccn3)c([N+](=O)[O-])c2)cc1)c1ccccc1 302974702 DRFGUQUGAVJXTF-WOJBJXKFSA-N 481.556 6.588 5 20 JKBD O=[N+]([O-])c1ccc(-c2ccc(CNC[C@H](c3ccco3)N3CCCC3)o2)c(Br)c1 409484824 KZDGMCRDNSMLBI-LJQANCHMSA-N 460.328 5.137 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)Nc2ccc(Sc3nc(C)cc(C)n3)cc2)cc1SC 482023817 FFBJJPOGWCQDMD-UHFFFAOYSA-N 456.549 5.136 5 20 JKBD O=C(NC[C@@H]1CCN(CCc2ccccc2)C1)c1cc([N+](=O)[O-])ccc1Sc1ccccc1 487016170 ZNJXGEXOXLRPFO-NRFANRHFSA-N 461.587 5.040 5 20 JKBD Cc1nc(CN(C(=O)c2ccc(Cn3nc(C)c([N+](=O)[O-])c3C)cc2)c2ccc(F)cc2)cs1 487887496 RCRJQPQOKLFMLY-UHFFFAOYSA-N 479.537 5.207 5 20 JKBD C[C@H](NC(=O)c1ccc(Sc2nncn2C)c([N+](=O)[O-])c1)c1ccc(Oc2ccccc2)c(F)c1 488997911 ACZZTHIFUNKPAI-HNNXBMFYSA-N 493.520 5.297 5 20 JKBD CCCN(CCc1ccccn1)C(=O)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])c(OC)c1 489746341 YBHCOOQXJYUVPE-UHFFFAOYSA-N 469.925 5.539 5 20 JKBD O=C(C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)NCC(=O)Nc1ccc(F)cc1 493983285 NERSZBIGKFOPBP-GHRIWEEISA-N 490.516 5.029 5 20 JKBD Cc1nc(CN(C(=O)c2csc(-c3cccc([N+](=O)[O-])c3)n2)c2ccc(F)cc2)cs1 496280526 CNJTUDUATFLSEX-UHFFFAOYSA-N 454.508 5.469 5 20 JKBD Cc1ccccc1-c1cc(C(=O)N2c3ccc([N+](=O)[O-])cc3C[C@H]2C)c2cnn(C(C)C)c2n1 504324274 HUBZKHBXQNIJEB-QGZVFWFLSA-N 455.518 5.487 5 20 JKBD C[C@@H](NC(=O)N(C)[C@H]1CCSc2ccc(Br)cc21)c1cccc([N+](=O)[O-])c1 509479329 KSMNOUOTXGWTRW-PXAZEXFGSA-N 450.358 5.297 5 20 JKBD Cc1cc(CN(C)C(=O)c2c3c(nc4ccccc24)/C(=C\c2ccc([N+](=O)[O-])cc2)CCC3)no1 512803137 RQDNHTUTQPYQHM-CYVLTUHYSA-N 468.513 5.589 5 20 JKBD COc1cc(CNCc2ccc([N+](=O)[O-])cc2)cc(Br)c1OCc1ccccc1 513643108 MWSZTWWSYRJQNM-UHFFFAOYSA-N 457.324 5.235 5 20 JKBD CC(=O)Nc1ccc(Cl)c(NC(=O)c2ccc(Sc3nc4ccccc4s3)c([N+](=O)[O-])c2)c1 515733497 WEKHIBSVPKAPSC-UHFFFAOYSA-N 498.973 6.220 5 20 JKBD Cc1csc(Sc2ccc(C(=O)Nc3ccc(-n4ccnc4)c(F)c3)cc2[N+](=O)[O-])n1 517474845 QIAVZEMUXITNBV-UHFFFAOYSA-N 455.496 5.088 5 20 JKBD CC[C@H](NC(=O)C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)c1nc(C)cs1 519122773 XAQUOWHNDKMQFA-GTVARFKMSA-N 478.599 6.168 5 20 JKBD C[C@@H](Nc1ccc(C(=O)N2CCCC[C@@H]2c2cc3ccccc3[nH]2)cc1[N+](=O)[O-])c1ccccn1 520832859 VPJNJMIJOHZKOL-IQGLISFBSA-N 469.545 6.012 5 20 JKBD Cc1cc(NC(=O)[C@H](C)SCc2ncc(-c3ccc(Cl)cc3)o2)n(-c2ccc([N+](=O)[O-])cc2)n1 521198075 DMXYGFZSLGKKKT-HNNXBMFYSA-N 497.964 5.658 5 20 JKBD COc1ccc(COc2cccc(F)c2)cc1NC(=O)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-] 521534589 BXWBTBJHLZSMTH-UHFFFAOYSA-N 494.397 5.515 5 20 JKBD COCCN(C(=O)Nc1cc([N+](=O)[O-])ccc1OC(F)F)[C@H](C)c1cccc(C(F)(F)F)c1 521840581 BPXODJLXBLGALM-GFCCVEGCSA-N 477.386 5.457 5 20 JKBD Cc1ncsc1CN(C)C(=O)c1c2c(nc3ccccc13)/C(=C\c1cccc([N+](=O)[O-])c1)CCC2 524569251 QSOGIBRLWHACCC-UYRXBGFRSA-N 484.581 6.057 5 20 JKBD COCCN(C(=O)CCc1ncc(-c2ccccc2F)o1)c1nc(-c2ccc([N+](=O)[O-])cc2)cs1 590614149 WNQSQXUAARHNRC-UHFFFAOYSA-N 496.520 5.125 5 20 JKBD Cc1nc(-c2ccc(CCNC(=O)c3cc(OCC(F)(F)F)ccc3[N+](=O)[O-])s2)cs1 603685977 XQTSDADFYYRDJB-UHFFFAOYSA-N 471.482 5.002 5 20 JKBD O=C(NCc1ccc(-c2nc3ccccc3s2)o1)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-] 603734896 PAAYJSYRMVYLJG-UHFFFAOYSA-N 477.420 5.336 5 20 JKBD CN(c1ccc(Oc2cccnc2[N+](=O)[O-])cc1)S(=O)(=O)c1ccc(Cl)c(C(F)(F)F)c1 603837778 CBTOYGQOJONHLY-UHFFFAOYSA-N 487.843 5.279 5 20 JKBD C[C@H]1CCCN(c2ccc(C(=O)Nc3cccc(NC(=O)c4ccccc4)c3)cc2[N+](=O)[O-])C1 603913560 IPUQDKJHPPQBFI-SFHVURJKSA-N 458.518 5.336 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Cl)[C@@H](N[C@H]1CCc2c(Cl)cccc21)c1ccccc1 604403756 QBJZDAZTNBMOFJ-UNMCSNQZSA-N 456.329 5.859 5 20 JKBD Cc1csc(Sc2ccc(NC(=O)CCn3nc(C)c([N+](=O)[O-])c3C)cc2Cl)n1 608874839 VOKUMZJZGWJWCL-UHFFFAOYSA-N 451.961 5.006 5 20 JKBD O=C(COC(=O)c1csc(-c2cccc(C(F)(F)F)c2)n1)Nc1ccc([N+](=O)[O-])cc1Cl 725997381 OQLOYZJBYJELFL-UHFFFAOYSA-N 485.827 5.186 5 20 JKBD Cc1onc(-c2c(F)cccc2Cl)c1C(=O)O[C@@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl 766522893 PUBMEIYVJHZUFE-JTQLQIEISA-N 482.251 5.188 5 20 JKBD CCOc1cc(/C=C(\C(=O)OCc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)c2ccccc2)ccc1O 786189277 FVQYMZLUOVHGCW-STZFKDTASA-N 487.468 5.033 5 20 JKBD COc1ccc2c(ccn2CC(=O)O[C@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2ccccc2)c1 915592208 DQRPHPZDTCPJKN-DEOSSOPVSA-N 493.903 5.135 5 20 JKBD CCC(=O)Nc1ccc(NC(=O)c2ccccc2NC(=O)c2ccc([N+](=O)[O-])cc2Cl)cc1 918592247 AHVOOOKIGDNQOB-UHFFFAOYSA-N 466.881 5.101 5 20 JKBD Cc1n[nH]c(C)c1C(=O)Nc1ccc(C2(NC(=O)c3cc4cc([N+](=O)[O-])ccc4s3)CCC2)cc1 1789695891 UQFOFGBATPNTNY-UHFFFAOYSA-N 489.557 5.211 5 20 JKBD O=C(CSc1ccccc1[N+](=O)[O-])Nc1ccc(C2(NC(=O)c3cc(Cl)ccn3)CCC2)cc1 1791522478 XQRJVMKADAHDJI-UHFFFAOYSA-N 496.976 5.183 5 20 JKBD O=C(/C=C/c1ccccc1[N+](=O)[O-])Nc1ccc(C2(NC(=O)c3cc(-c4ccco4)no3)CCC2)cc1 1792317995 YDXKYBYMCTYUBC-MDWZMJQESA-N 498.495 5.304 5 20 JKBD O=C(c1cc(Cl)sc1Cl)N1CCC([C@H]2CCCCN2C(=O)c2ccc([N+](=O)[O-])o2)CC1 1823613981 OVUMKCJDIXOWGG-CQSZACIVSA-N 486.377 5.103 5 20 JKBD CC(C)C1(C(=O)N2CCC([C@H]3CCCCN3C(=O)Cc3ccc(Cl)cc3[N+](=O)[O-])CC2)CCC1 1824158513 LTHGQCZCXVQTCY-JOCHJYFZSA-N 490.044 5.237 5 20 JKBD C[C@@H](CC(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cccc(F)c2[N+](=O)[O-])CC1)c1ccccc1 1830623444 VEPZITLCLZYRKH-CYFREDJKSA-N 481.568 5.161 5 20 JKBD Cc1cc(CCCC(=O)N2CCCC23CN(C(=O)c2cc(C(C)(C)C)oc2C)C3)c([N+](=O)[O-])cc1F 1841506417 NCZNPHBCTUTIPB-UHFFFAOYSA-N 499.583 5.081 5 20 JKBD O=C(COC(=O)c1c2c(nc3ccccc13)/C(=C/c1ccco1)CC2)Nc1ccc(F)c([N+](=O)[O-])c1 8620837 RVAYEOSQIIIAEF-NTCAYCPXSA-N 487.443 5.157 5 20 JKBD CC(=O)N(c1nc(COC(=O)c2ccc(Cl)cc2[N+](=O)[O-])cs1)c1c(C)cc(C)cc1Cl 10748685 GAVAUXIRBROYSC-UHFFFAOYSA-N 494.356 6.017 5 20 JKBD COc1cc(CSc2nnc(-c3ccco3)n2Cc2ccccc2)c([N+](=O)[O-])cc1OC(F)F 11271481 QUSLYUYAMROWBS-UHFFFAOYSA-N 488.472 5.397 5 20 JKBD COc1ccc(N2C(=O)CC[C@H](C(=O)Nc3cc([N+](=O)[O-])ccc3C)[C@H]2c2ccccc2OC)cc1 19161036 JYQXVMGYHBIKCM-BKMJKUGQSA-N 489.528 5.043 5 20 JKBD CC(=O)Nc1cccc(CNC(=O)c2cc([N+](=O)[O-])ccc2Sc2ccc(Cl)cc2)c1 32358628 AFEVOOPGQKLAFB-UHFFFAOYSA-N 455.923 5.288 5 20 JKBD O=C(C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1)N1CCC[C@@H]1Cc1ccccc1Cl 72021664 BUQVLQBSIGAFKI-LJQANCHMSA-N 495.929 5.717 5 20 JKBD COc1cc(C(=O)N(C)Cc2csc3ccccc23)c([N+](=O)[O-])cc1OCc1cscn1 302936110 AEAOQQVHHJNNFN-UHFFFAOYSA-N 469.544 5.126 5 20 JKBD Cc1ccc(-c2csc(N(C(=O)CCn3nc(C)c([N+](=O)[O-])c3C)c3cc(C)ccc3C)n2)cc1 303199767 XCSCYDPCGPMANQ-UHFFFAOYSA-N 489.601 6.212 5 20 JKBD COc1ccccc1C(C)(C)NC(=O)Cc1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1 303211617 ROWOFQKANSUYFZ-UHFFFAOYSA-N 470.529 5.050 5 20 JKBD C[C@@H]1CCCN(c2ccc(C(=O)Nc3nc(-c4ccc5c(c4)CCC(=O)N5)cs3)cc2[N+](=O)[O-])C1 490939853 XEDGQAXJFWXTDO-OAHLLOKOSA-N 491.573 5.092 5 20 JKBD Cc1nn(Cc2ccc(C(=O)Nc3cccc(C(=O)Nc4ccccc4)c3C)cc2)c(C)c1[N+](=O)[O-] 498435506 OLGYUXPVVNRZLL-UHFFFAOYSA-N 483.528 5.269 5 20 JKBD O=C(Cn1cc([N+](=O)[O-])ccc1=O)N(c1ccc(Oc2ccccc2)cc1)c1nc2ccccc2s1 499316724 PGGRVQWLYPVJEI-UHFFFAOYSA-N 498.520 5.523 5 20 JKBD Cc1cc(C(=O)N(CC(=O)Nc2ccc(Cl)cc2C(F)(F)F)C(C)C)ccc1[N+](=O)[O-] 504789968 LWLZZZUEJLYDKP-UHFFFAOYSA-N 457.836 5.065 5 20 JKBD O=C(Nc1ccccc1CN1CCc2ccccc21)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-] 515635451 APPXAKVDZRGXLX-UHFFFAOYSA-N 471.435 5.351 5 20 JKBD C[C@@H](Nc1ccc(C(=O)Nc2ccc(Sc3nncs3)cc2)cc1[N+](=O)[O-])c1ccccn1 517648072 PHLBUFUNRCYLLM-CQSZACIVSA-N 478.559 5.418 5 20 JKBD O=C(CC1CCCC1)NC1CCN([C@@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2ccccc2)CC1 520195174 WRUAIXNOXZBOAK-RUZDIDTESA-N 499.011 5.089 5 20 JKBD O=C(C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)Nc1ccc(C(=O)NC2CC2)cc1 589735503 WEDVOJNFOBVYOT-CYVLTUHYSA-N 498.564 5.666 5 20 JKBD O=C(c1ccc(N2CCCC2)c([N+](=O)[O-])c1)N(CCc1ccccc1)c1nc2ccccc2s1 602760970 ZDXXAHYPMUXDKN-UHFFFAOYSA-N 472.570 5.694 5 20 JKBD COc1ccc(CN[C@@H](c2ccc(Cl)cc2)c2nccn2C)cc1OCc1ccc([N+](=O)[O-])cc1 604417924 PQWGDXVYYCHPTK-VWLOTQADSA-N 492.963 5.449 5 20 JKBD Cc1ccccc1NC(=O)[C@@H]1CCc2ccccc2N1C(=O)c1ccc(N2CCCC2)c([N+](=O)[O-])c1 608799973 WOJZQEPAZZCLNO-VWLOTQADSA-N 484.556 5.104 5 20 JKBD CO[C@H](C)c1cccc(NC(=O)N2CCN(Cc3ccc(-c4ccccc4[N+](=O)[O-])s3)CC2)c1 608893617 VPCSPBJWKGRVRP-GOSISDBHSA-N 480.590 5.380 5 20 JKBD Cc1ccc(NC(=O)c2ccc(NCc3cccc(C(=O)NCc4ccco4)c3)c([N+](=O)[O-])c2)cc1 608972955 WKLAXVZYONMVEI-UHFFFAOYSA-N 484.512 5.291 5 20 JKBD Cc1c(Cl)cc(S(=O)(=O)Nc2ccc(Sc3nncs3)c(Cl)c2)cc1[N+](=O)[O-] 609108041 IOQCDYWSWFGPDT-UHFFFAOYSA-N 477.376 5.014 5 20 JKBD O=C(c1ccc(NCc2ccccc2Cl)c([N+](=O)[O-])c1)N1CCCO[C@@H](c2ccccc2)C1 609230296 CDQDDDNNMIGUJI-XMMPIXPASA-N 465.937 5.464 5 20 JKBD CCCOc1cc(NC(=O)N2CCCO[C@@H](c3ccccc3)C2)c([N+](=O)[O-])cc1OCCC 609252269 NTQCBZCUZLCGOB-HSZRJFAPSA-N 457.527 5.168 5 20 JKBD Cc1ccc(NC(=O)c2ccc(Nc3ccc(OCc4noc(C)n4)cc3)c([N+](=O)[O-])c2)cc1 609384286 DZJHIJUHIXQBPJ-UHFFFAOYSA-N 459.462 5.170 5 20 JKBD CCOc1cc(NC(=O)c2oc3ccc(Br)cc3c2C)c([N+](=O)[O-])cc1OCC 619212815 XSLNGYGGIJTBRU-UHFFFAOYSA-N 463.284 5.462 5 20 JKBD C[C@H]1CCCN(c2ccc(C(=O)Nc3ccc(SCc4cccnc4)cc3)cc2[N+](=O)[O-])C1 619687444 SOGUPEVILYJDQJ-SFHVURJKSA-N 462.575 5.771 5 20 JKBD CC(C)(C)OC(=O)N1CCc2cc(NC(=O)c3cc([N+](=O)[O-])ccc3N3CCCCC3)ccc21 726511186 OTHUVHAJQYZPAG-UHFFFAOYSA-N 466.538 5.135 5 20 JKBD Cc1nc(C(C)(C)NCn2c(=S)n(-c3cccc(C(F)(F)F)c3)c3ccc([N+](=O)[O-])cc32)no1 729852059 YIRPOFFXMYPMLS-UHFFFAOYSA-N 492.483 5.262 5 20 JKBD O=C(Cn1ccc2cc([N+](=O)[O-])ccc21)Nc1ccccc1SC[C@H]1CC1(Cl)Cl 743633101 VGFMRHZTDZFRDH-CQSZACIVSA-N 450.347 5.474 5 20 JKBD COc1ccccc1/C=C(\C(=O)O[C@H](C)C(=O)Nc1cccc([N+](=O)[O-])c1C)c1ccccc1 827602766 VBCKPJFTYVDTMS-TVJQZGFISA-N 460.486 5.023 5 20 JKBD CC(=O)N(c1ccc(C)cc1)c1nc(COC(=O)c2ccc(N3CCCC3)c([N+](=O)[O-])c2)cs1 918864734 GOOKGKUZJZHYCA-UHFFFAOYSA-N 480.546 5.002 5 20 JKBD O=C(Nc1ccccc1)Nc1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2N2CCCCC2)cc1 920442537 JQMKTWABPORVLA-UHFFFAOYSA-N 459.506 5.481 5 20 JKBD Cc1cccc([N+](=O)[O-])c1NC(=O)COC(=O)[C@@H](C)SCc1ncc(-c2ccc(Cl)cc2)o1 920671730 AEAKJTNAKIRKRE-CQSZACIVSA-N 489.937 5.015 5 20 JKBD O=C(NC1(c2ccc(NC(=O)C3CCC(F)(F)CC3)cc2)CCC1)c1cccc(F)c1[N+](=O)[O-] 1786244711 JWGFPDAAASNULJ-UHFFFAOYSA-N 475.467 5.307 5 20 JKBD O=C(/C=C/c1ccc([N+](=O)[O-])o1)NC1(c2ccc(NC(=O)CCCC(F)(F)F)cc2)CCC1 1786620326 LRFFUSQNZZGREC-CSKARUKUSA-N 465.428 5.068 5 20 JKBD CC1=C(C(=O)Nc2ccc(C3(NC(=O)CCCc4cc(C)c(F)cc4[N+](=O)[O-])CCC3)cc2)CCO1 1788324550 JSIOCZKTOPXIHV-UHFFFAOYSA-N 495.551 5.193 5 20 JKBD CCc1nc(C(=O)NC2(c3ccc(NC(=O)C4(c5cccc([N+](=O)[O-])c5)CCC4)cc3)CCC2)co1 1790475944 MBKZCCHNMCUINT-UHFFFAOYSA-N 488.544 5.015 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)c3cccc(F)c3[N+](=O)[O-])CCC2)cc1)c1cc2ccsc2[nH]1 1790876746 DRTDHYGISPXPTD-UHFFFAOYSA-N 478.505 5.338 5 20 JKBD CC1(C)CCC(CC(=O)Nc2cc([C@@H]3CCCCN3C(=O)/C=C/c3ccc([N+](=O)[O-])o3)[nH]n2)CC1 1820974629 BMBDSFGYZXSZFX-IEJURRBGSA-N 483.569 5.223 5 20 JKBD O=C(c1cc2c(s1)CCCC2)N1CCC([C@@H]2CCCCN2C(=O)/C=C/c2ccc([N+](=O)[O-])o2)CC1 1824276419 INQUCYKFGWHGBI-DJGBTNNQSA-N 497.617 5.075 5 20 JKBD O=C(Cc1ccc(Cl)cc1[N+](=O)[O-])N1CCC([C@H]2CCCCN2C(=O)CCc2ccccc2)CC1 1826366006 INWXGXJYMQVISU-XMMPIXPASA-N 498.023 5.043 5 20 JKBD C[C@@H](CC(=O)N1CCC([C@H]2CCCCN2C(=O)c2cc(F)cc([N+](=O)[O-])c2)CC1)c1ccccc1 1830615471 GVZJGTPKWHTIKI-UQBPGWFLSA-N 481.568 5.161 5 20 JKBD C/C(=C\c1cccs1)C(=O)N1CCC([C@H]2CCCCN2C(=O)Cc2ccc([N+](=O)[O-])cc2F)CC1 1831290525 ICYAIEAKBJOTJG-MMYRTMNYSA-N 499.608 5.061 5 20 JKBD CC[C@@H](C(=O)N1CCC([C@@H]2CCCCN2C(=O)Cc2cc(F)ccc2[N+](=O)[O-])CC1)c1ccccc1 1832887811 YMGPAMHVIJHQSG-RPBOFIJWSA-N 495.595 5.090 5 20 JKBD Cc1c(C(=O)N2CCCC23CN(C(=O)c2ccc4occ(Cl)c4c2)C3)cc(Cl)cc1[N+](=O)[O-] 1845499495 AJDZVGWTKGXWBB-UHFFFAOYSA-N 488.327 5.087 5 20 JKBD C[C@H](NCC(c1ccccc1)c1ccccc1)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 11046248 YJRKLKWAXXQXMO-INIZCTEOSA-N 457.452 5.362 5 20 JKBD Cc1cccc([N+](=O)[O-])c1NC(=O)CSc1nnc(-c2ccccc2)n1-c1ccc(Cl)cc1 11196762 LCZCMAJKMJYUHT-UHFFFAOYSA-N 479.949 5.535 5 20 JKBD O=C(c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1)N1CCC[C@H](c2nnc3n2CCCCC3)C1 11547173 PWLIGSQVUSDEOI-SFHVURJKSA-N 495.967 5.378 5 20 JKBD COc1ccc(-c2ccc(/C=C(\Cl)c3nc4ccc(Cl)cc4c(=O)[nH]3)o2)c([N+](=O)[O-])c1 18913739 DRHVOFMPJHPFBB-SXGWCWSVSA-N 458.257 5.490 5 20 JKBD C[C@@H](OC(=O)C[C@H](NC(=O)c1ccccc1Cl)c1ccccc1)c1cccc([N+](=O)[O-])c1 21673034 VNHFYVGDABZFNR-ZHRRBRCNSA-N 452.894 5.414 5 20 JKBD CCn1c(S[C@@H](C)C(=O)Nc2ccc(OC(F)F)cc2)nc2cc3ccccc3cc2c1=O 22178348 IHPLHVABILEQPG-AWEZNQCLSA-N 469.513 5.290 5 20 JKBD CSc1ccc(NC(=O)[C@@H](C)OC(=O)c2ccccc2C(=O)c2ccc(Cl)c([N+](=O)[O-])c2)cc1 22669925 MRTKXJGCHISALE-CQSZACIVSA-N 498.944 5.385 5 20 JKBD COc1ccc(NC(=O)c2ccc(NCc3ccccc3Cl)c([N+](=O)[O-])c2)cc1NC(C)=O 27997700 FANAOOSFYYTTPI-UHFFFAOYSA-N 468.897 5.080 5 20 JKBD O=C(Cc1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1)N(Cc1ccccc1)C1CC1 31069745 PKIGJRSPVVLZQN-UHFFFAOYSA-N 452.514 5.181 5 20 JKBD C[C@@H](Sc1nnc(-c2cccs2)n1Cc1ccccc1)C(=O)Nc1ccc(F)c([N+](=O)[O-])c1 36802156 LJKCRWLRBJXAQW-CQSZACIVSA-N 483.550 5.222 5 20 JKBD CCOc1cc([N+](=O)[O-])c(C(=O)NC[C@@H](c2ccccc2)c2c[nH]c3ccccc23)cc1OC 45863797 YYCBVEGMHTWYRG-FQEVSTJZSA-N 459.502 5.045 5 20 JKBD COc1ccccc1-c1nnc(SCc2csc([N+](=O)[O-])c2)n1CCc1ccccc1 71937511 YYKPIBDHEPMZBO-UHFFFAOYSA-N 452.561 5.458 5 20 JKBD CCC[C@@H](NC(=O)Cn1c2ccccc2c(=O)c2ccccc21)c1cccc(C(F)(F)F)c1 72084878 LNWNBWUVZKVPLW-OAQYLSRUSA-N 452.476 5.831 5 20 JKBD C[C@H]1CN(CC2CCN(C(=O)c3ccc(Oc4ccc(Cl)cc4[N+](=O)[O-])cc3)CC2)C[C@@H](C)O1 110460087 XZLQLXILWIYAJQ-HDICACEKSA-N 487.984 5.002 5 20 JKBD O=C(Nc1cc(Cl)ccc1OC[C@@H]1CCCO1)c1csc(-c2ccc([N+](=O)[O-])cc2)n1 215730872 YBYIAOYOVBOBSJ-INIZCTEOSA-N 459.911 5.182 5 20 JKBD Cc1ccc(-c2nc(C)c([C@@H](C)NC(=O)c3ccc(Sc4nncn4C)c([N+](=O)[O-])c3)s2)cc1 303245781 ARTOABHIJJEZSW-CQSZACIVSA-N 494.602 5.106 5 20 JKBD O=C(NCc1ccc(OC(F)(F)F)cc1)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 478062204 MOBAHYHAEXARHV-UHFFFAOYSA-N 491.388 5.045 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)Nc2cc(C(F)(F)F)ccc2-n2nc(C)cc2C)cc1SC 482907880 NGWQNJJZODGQAM-UHFFFAOYSA-N 480.468 5.399 5 20 JKBD C[C@H](Nc1ccc(C(=O)NCc2ccc(Oc3ccccc3)nc2)cc1[N+](=O)[O-])c1ccccn1 503450911 YPVNBQFYUCXGRX-SFHVURJKSA-N 469.501 5.280 5 20 JKBD CCN(Cc1ccccc1NC(=O)c1ccc(Sc2ccc(C)cc2)c([N+](=O)[O-])c1)C(C)=O 509513974 QCVVFZUQAMYQTR-UHFFFAOYSA-N 463.559 5.675 5 20 JKBD O=C(N[C@H](c1ccccc1)c1ccc2nc(C(F)(F)F)[nH]c2c1)c1ccc([N+](=O)[O-])cc1Cl 514343823 ITEBVYSHLOJBLB-LJQANCHMSA-N 474.826 5.663 5 20 JKBD CC[C@H](C)NC(=O)c1cccc(CN[C@@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2ccccc2)c1 515759728 WNJVQIOPNLDLPH-BXKMTCNYSA-N 494.979 5.246 5 20 JKBD C[C@@H](NCc1ccc(-c2ccc([N+](=O)[O-])cc2Br)o1)c1ccccc1OC(F)F 517538666 IDICZNNRLKMHIC-GFCCVEGCSA-N 467.266 6.070 5 20 JKBD Cc1csc(Sc2ccc(C(=O)Nc3ccc(F)cc3C(F)(F)F)cc2[N+](=O)[O-])n1 524386825 YFXFSJWTNOHYBT-UHFFFAOYSA-N 457.430 5.921 5 20 JKBD O=C1CCCN1Cc1cccc(CNCc2ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])cc2)c1 603633218 QJSONYBIPPQVJF-UHFFFAOYSA-N 465.937 5.453 5 20 JKBD COc1cc([C@@H](C)NC(=O)C2CCN(c3ccccc3[N+](=O)[O-])CC2)ccc1OCc1ccccc1 603986686 NONGYVXXVXLCKK-HXUWFJFHSA-N 489.572 5.276 5 20 JKBD CCOc1cc(C(=O)N[C@@H](C)c2ccc(Oc3ccccc3)c(F)c2)c([N+](=O)[O-])cc1OC 603991576 MWQJFEGCSSTLPR-HNNXBMFYSA-N 454.454 5.425 5 20 JKBD O=C(C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)Nc1cccnc1N1CCCC1 604236595 ZJJOFNFPCJZZKB-MNDPQUGUSA-N 485.569 5.769 5 20 JKBD Cc1csc(Sc2ccc(C(=O)N(C)C[C@@H]3CCCO[C@@H]3c3ccccc3)cc2[N+](=O)[O-])n1 604519102 JUTAXGDPNILWQR-SIKLNZKXSA-N 483.615 5.751 5 20 JKBD Cc1cc(C)c(NC(=O)Cc2cn(-c3ccccc3)nc2-c2ccc([N+](=O)[O-])cc2)c(Cl)c1 604561990 RHOMTJIWUHTKIP-UHFFFAOYSA-N 460.921 5.899 5 20 JKBD O=c1c(Cl)c(N[C@H]2CCOc3c(-c4ccccc4)cccc32)cnn1-c1ccc([N+](=O)[O-])cc1 608831171 IYFXAWDDNZCSAL-NRFANRHFSA-N 474.904 5.397 5 20 JKBD CCc1cc[n+](/C(C(=S)NCc2cccc(C(F)(F)F)c2)=C(/O)c2cccc([N+](=O)[O-])c2)cc1 726571235 UUHZPOBPTXDCDA-UHFFFAOYSA-O 488.511 5.465 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Cl)[C@@H](OC(=O)[C@@H]1CCOc2ccccc21)c1ccccc1 728355773 DXSWNEXOTQUKAC-GCJKJVERSA-N 466.877 5.038 5 20 JKBD O=C(OCC[C@H]1CCCCN1C(=O)C[C@H](c1ccccc1)C(F)(F)F)c1cccc([N+](=O)[O-])c1 728516712 ZACBZVDRMVWQEV-TZIWHRDSSA-N 478.467 5.259 5 20 JKBD C[C@H](OC(=O)CCc1nc2cc(Cl)ccc2s1)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl 730606281 ANFWCPKVOVXLDU-JTQLQIEISA-N 468.318 5.014 5 20 JKBD Cc1nn(-c2ccc(F)cc2)c(C)c1CC(=O)N(CC1CC1)c1ccc(Cl)c([N+](=O)[O-])c1 745345011 UBDQYDUVJMFGOP-UHFFFAOYSA-N 456.905 5.176 5 20 JKBD COc1ccc(NC(=O)[C@H](OC(=O)c2csc(-c3ccc([N+](=O)[O-])cc3)n2)c2ccccc2)cc1 747955491 ASIQJXPIFFOODL-JOCHJYFZSA-N 489.509 5.264 5 20 JKBD CC(C)[C@@H](OC(=O)c1csc(-c2ccc([N+](=O)[O-])cc2)n1)C(=O)Nc1cccc2ncccc12 747957737 SITOLCIMFQDUEG-OAQYLSRUSA-N 476.514 5.087 5 20 JKBD COc1ccc(C(=O)c2ccccc2)c(OC(=O)c2csc(-c3cccc([N+](=O)[O-])c3)n2)c1 748003736 ITGBJFLEXURTHU-UHFFFAOYSA-N 460.467 5.177 5 20 JKBD O=C(Nc1ccn(Cc2ccccn2)n1)c1cc([N+](=O)[O-])ccc1Sc1ccc(Cl)cc1 748687005 MKMVODCEZVKEPA-UHFFFAOYSA-N 465.922 5.292 5 20 JKBD Cn1cc(-c2nc(-c3ccc(OCc4ccccc4)cc3)no2)c(-c2ccc([N+](=O)[O-])cc2)n1 904424554 ZWDRKMMPQJJJJC-UHFFFAOYSA-N 453.458 5.291 5 20 JKBD COc1cc(-c2ccccc2)sc1C(=O)O[C@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 919459917 YJWLWUARKHZDKA-GFCCVEGCSA-N 494.447 5.535 5 20 JKBD CCc1ccc(-c2noc(COC(=O)c3ccc(N[C@@H](C)c4ccccn4)c([N+](=O)[O-])c3)n2)cc1 920548119 PTXRQNONXJGUJO-INIZCTEOSA-N 473.489 5.132 5 20 JKBD O=C(/C=C/c1ccc([N+](=O)[O-])o1)NC1(c2ccc(NC(=O)c3cc(-c4ccccc4)on3)cc2)CCC1 1785786300 KHTLTPYGBIRPQW-ACCUITESSA-N 498.495 5.304 5 20 JKBD O=C(CCCC(F)(F)F)Nc1ccc(C2(NC(=O)c3ccc([N+](=O)[O-])cc3F)CCC2)cc1 1786621336 GUUGUCVNTFXTQV-UHFFFAOYSA-N 467.419 5.214 5 20 JKBD CCCC(=O)Nc1ccc(C2(NC(=O)c3cc(F)cc([N+](=O)[O-])c3Br)CCC2)cc1 1787698600 QAIUDECNAZOLHO-UHFFFAOYSA-N 478.318 5.044 5 20 JKBD COc1cc(C(=O)NC2(c3ccc(NC(=O)/C(C)=C/c4ccc(C)o4)cc3)CCC2)ccc1[N+](=O)[O-] 1789585535 RDXPUYIKBWLQEF-BMRADRMJSA-N 489.528 5.356 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)c3ccc([N+](=O)[O-])o3)CCC2)cc1)c1ccc(OCC2CC2)c(F)c1 1792186231 WCGWOPSWRFMNQE-UHFFFAOYSA-N 493.491 5.177 5 20 JKBD O=C(/C=C/c1ccccc1[N+](=O)[O-])Nc1cc([C@H]2CCCCN2C(=O)c2cc3ccccc3o2)[nH]n1 1823505086 UYXPIQLWHOKGGO-JNCYCUAHSA-N 485.500 5.083 5 20 JKBD C[C@H](CC(=O)N1CCC([C@@H]2CCCCN2C(=O)/C=C/c2ccc([N+](=O)[O-])o2)CC1)c1ccccc1 1824278471 JDMOMVCNXZVSIX-KAYDMBQGSA-N 479.577 5.015 5 20 JKBD C[C@@H](OC(=O)c1ccc([N+](=O)[O-])cc1Cl)C(=O)N(Cc1ccccc1)Cc1ccccc1 11028927 QLBIPXDOVOYOHK-QGZVFWFLSA-N 452.894 5.023 5 20 JKBD COc1ccc(C)cc1NC(=O)[C@@H](C)Oc1ccc2c(-c3ccc([N+](=O)[O-])cc3)cc(=O)oc2c1 15370843 DIOZNCBVILVWAU-MRXNPFEDSA-N 474.469 5.091 5 20 JKBD O=C(CCC(=O)c1ccc2ccccc2c1)Oc1ccc(NC(=O)c2cccc([N+](=O)[O-])c2)cc1 15603952 QCMSBALQIFNUJR-UHFFFAOYSA-N 468.465 5.569 5 20 JKBD COc1cc2c(cc1OC)[C@@H](c1ccccc1)N(C(=O)c1ccc(SC)c([N+](=O)[O-])c1)CC2 16002151 QQDUEAAWDPKBIC-XMMPIXPASA-N 464.543 5.122 5 20 JKBD C[C@@H](c1nnc(S[C@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)n1-c1ccc(Cl)cc1)N(C)C 17718188 JWNHPENHHMQIIO-UONOGXRCSA-N 499.984 5.355 5 20 JKBD Cc1c(NC(=O)[C@@H](C)OC(=O)c2nc(Cl)c(Cl)c(Cl)c2Cl)cccc1[N+](=O)[O-] 21371415 GHSQRWHWAJEZGK-SSDOTTSWSA-N 467.092 5.096 5 20 JKBD CCCCn1c(S[C@@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2C)nnc1-c1ccc(OC)cc1 21747041 YHMSOTAJQHTIQE-INIZCTEOSA-N 469.567 5.090 5 20 JKBD COc1ccc(Oc2ccc([N+](=O)[O-])cc2C(=O)Nc2cccc(-c3ccnc(C)n3)c2)cc1 25168815 AEKRXSOZBJMNGU-UHFFFAOYSA-N 456.458 5.413 5 20 JKBD O=C(OCc1nnc(-c2ccc([N+](=O)[O-])cc2)o1)c1cc(-c2ccc(F)cc2)nc2ccccc12 28614468 HHGBNXJAVJXHRL-UHFFFAOYSA-N 470.416 5.356 5 20 JKBD O=[N+]([O-])c1cccc(-c2noc(CSc3nnc(-c4ccccc4F)n3Cc3ccccc3)n2)c1 31838396 RNSGSDYWXLXRFZ-UHFFFAOYSA-N 488.504 5.383 5 20 JKBD Cc1ccc(CN(C(=O)c2nn(-c3ccccc3[N+](=O)[O-])c(C)cc2=O)[C@H]2CCc3ccccc32)cc1 68710755 VOWHQLMWACDLCN-DEOSSOPVSA-N 494.551 5.087 5 20 JKBD Cc1ccc2nc(-c3ccc(NC(=O)Cn4cnc(-c5cccc([N+](=O)[O-])c5)n4)cc3)sc2c1 72086060 QQMOMXZYIDQIJO-UHFFFAOYSA-N 470.514 5.077 5 20 JKBD C[C@H](Nc1ccc(C(=O)NCc2ccc(F)cc2C(F)(F)F)cc1[N+](=O)[O-])c1ccccn1 108777177 KDOQQSALDQJANU-ZDUSSCGKSA-N 462.403 5.251 5 20 JKBD Cc1ccc([C@@H](CNC(=O)c2ccc(N[C@@H](C)c3ccccn3)c([N+](=O)[O-])c2)N2CCCC2)cc1 109504840 YLCPWRCHUJWTAN-RXFWQSSRSA-N 473.577 5.038 5 20 JKBD O=C(Nc1ccc(NCc2nc(-c3ccc([N+](=O)[O-])cc3)no2)c(C(F)(F)F)c1)c1ccccc1 195673382 DIZVLNGLXXMHLU-UHFFFAOYSA-N 483.406 5.528 5 20 JKBD O=C(NCc1ccnc(OCC(F)(F)F)c1)c1cc([N+](=O)[O-])ccc1Sc1ccccc1 480156734 YTTOAWSKNRIIHT-UHFFFAOYSA-N 463.437 5.012 5 20 JKBD CC(C)N(Cc1nnc(-c2ccccc2Cl)o1)C(=O)c1csc(-c2cccc([N+](=O)[O-])c2)n1 496361729 MZUAIJLPQIVYJZ-UHFFFAOYSA-N 483.937 5.473 5 20 JKBD O=C(c1csc(-c2ccc([N+](=O)[O-])cc2)n1)N(Cc1ccccn1)c1ccc(Br)cc1 496612968 RYWVLRBWJZXBSS-UHFFFAOYSA-N 495.358 5.723 5 20 JKBD COc1cc(C(=O)Nc2ccc(OCC3CCCCC3)cc2)c([N+](=O)[O-])cc1OC(F)F 498388006 UXTNBKKBHADPDZ-UHFFFAOYSA-N 450.438 5.416 5 20 JKBD C[C@@H](Nc1ccc(C(=O)N[C@@H](c2ccc(Cl)cc2)c2nccn2C)cc1[N+](=O)[O-])c1ccccn1 506084499 ANEOINISEMKLPH-MWTRTKDXSA-N 490.951 5.069 5 20 JKBD O=C(NCc1cccnc1-n1cccn1)c1ccccc1Sc1ccc(C(F)(F)F)cc1[N+](=O)[O-] 509456043 VPRIUBODHNTQMO-UHFFFAOYSA-N 499.474 5.276 5 20 JKBD O=C(c1c2c(nc3ccccc13)/C(=C\c1cccc([N+](=O)[O-])c1)CCC2)N1CCC(c2ncc[nH]2)CC1 509951277 GAKBHEWVSMGCOG-FXBPSFAMSA-N 493.567 5.763 5 20 JKBD Cn1cc(C(=O)Nc2nc(-c3cc(Cl)sc3Cl)cs2)c(-c2ccc([N+](=O)[O-])cc2)n1 512559684 MSVVWXDFATWYGC-UHFFFAOYSA-N 480.358 5.739 5 20 JKBD COc1ccccc1NC(=O)Nc1cc(NC(=O)c2ccc(NC3CC3)c([N+](=O)[O-])c2)ccc1OC 512572941 NWDXZCZHJQJYPB-UHFFFAOYSA-N 491.504 5.083 5 20 JKBD COc1cc(C(=O)Nc2ccccc2OCC(F)(F)F)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 514912705 ZKDABCWZULAMMX-UHFFFAOYSA-N 496.825 6.243 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Br)[C@H](NCc1csc2ccccc12)c1ccccc1 515526569 HAUAGMHEODPMMZ-JOCHJYFZSA-N 496.386 6.042 5 20 JKBD O=C(NCCc1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccc(Oc2ccc(Cl)cc2Cl)c(F)c1 516712044 HWZRYCDWEOCUFC-UHFFFAOYSA-N 492.290 5.130 5 20 JKBD O=[N+]([O-])c1ccc(-c2ccc(CN[C@H](c3ccc(F)cc3)[C@H]3CCCO3)o2)c(Br)c1 517553189 UOHXVDAKZDVCFZ-FGZHOGPDSA-N 475.314 5.766 5 20 JKBD CCN(CC)CC1CCN(C(=O)C/C(=C/c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)CC1 521184853 XXSOFIPTERNYNE-XLNRJJMWSA-N 492.645 5.716 5 20 JKBD Cc1cc(C(=O)N2CCCC[C@H]2C)ccc1NC(=O)CSc1ccc(C(F)(F)F)cc1[N+](=O)[O-] 521378069 FMOLAJBBIYNJED-OAHLLOKOSA-N 495.523 5.667 5 20 JKBD CSc1ccc(C(=O)Nc2cc(-c3nnc4n3CCCCC4)ccc2Cl)cc1[N+](=O)[O-] 591557809 UFCQWBSBWASSEI-UHFFFAOYSA-N 457.943 5.207 5 20 JKBD CCCN(C(=O)NCCc1cc(OC)c(OC)cc1[N+](=O)[O-])[C@@H](C)c1ccccc1Br 603802080 NVPHECPFPFZEPM-HNNXBMFYSA-N 494.386 5.100 5 20 JKBD COc1ccc(Br)cc1[C@@H]1CCCN1C(=O)c1cc(SC)ccc1[N+](=O)[O-] 604569437 PLMBOSXDLIAYOP-INIZCTEOSA-N 451.342 5.065 5 20 JKBD O=C(NCc1cc(F)cc2c1OCOC2)c1cc([N+](=O)[O-])ccc1Sc1ccc(Cl)cc1 608810624 WARVDZGMZWFXHV-UHFFFAOYSA-N 474.897 5.335 5 20 JKBD COCCN(Cc1cccnc1)C(=O)C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1 609025897 UFDWFMFAGAKRCB-RCCKNPSSSA-N 488.569 5.205 5 20 JKBD COc1cc(C(=O)Nc2ccc(-c3nc(C(C)C)no3)cc2)c([N+](=O)[O-])cc1OCc1cscn1 609061871 ZGJYTKBSBSULPU-UHFFFAOYSA-N 495.517 5.065 5 20 JKBD O=C(Nc1ccnn1Cc1ccc(Cl)c(F)c1)c1csc(-c2ccc([N+](=O)[O-])cc2)n1 609428679 CUEFWHIRENMFJD-UHFFFAOYSA-N 457.874 5.008 5 20 JKBD C[C@H](Nc1ccc(C(=O)Nc2ccc(NC(=O)OC(C)(C)C)nc2)cc1[N+](=O)[O-])c1ccccn1 727339856 VVNDFLALJKVXGD-HNNXBMFYSA-N 478.509 5.157 5 20 JKBD C[C@H]1CCCN(C(=O)C2CCN(C(=O)CCC(=O)c3ccc4ccc5cccc6ccc3c4c56)CC2)C1 727755642 GJODOMUUODOXAN-NRFANRHFSA-N 494.635 6.044 5 20 JKBD CCOC(=O)Nc1nc2ccc(NC(=O)c3cc([N+](=O)[O-])ccc3N3CCCCC3)cc2s1 746789480 AESNPGGEGSFZGD-UHFFFAOYSA-N 469.523 5.016 5 20 JKBD Cc1c(C(=O)Nc2nc(-c3cc(Cl)sc3Cl)cs2)cc([N+](=O)[O-])cc1[N+](=O)[O-] 747628350 ZZAUSVUTDMURDV-UHFFFAOYSA-N 459.292 5.556 5 20 JKBD Cc1nc(COc2ccc(F)cc2)sc1C(=O)O[C@@H](C)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 818168922 UNEFOGUIZYJQTI-ZDUSSCGKSA-N 484.465 5.046 5 20 JKBD COc1ccccc1NC(=O)c1ccc(NCc2c(Br)cccc2[N+](=O)[O-])cc1 863988424 PASGCOBIPPGUPN-UHFFFAOYSA-N 456.296 5.230 5 20 JKBD O=[N+]([O-])c1cc(C(F)(F)F)ccc1N1CCC(c2nc(COc3cccc(F)c3)no2)CC1 904723540 XXWSLJJHOYXAGG-UHFFFAOYSA-N 466.391 5.099 5 20 JKBD O=C(O[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Br)c1ccccc1)c1ccc2cc[nH]c2c1 915491205 AXOQTBUIJNWRQS-OAQYLSRUSA-N 494.301 5.375 5 20 JKBD C[C@H](OC(=O)c1ccc(N[C@H](C)c2ccccn2)c([N+](=O)[O-])c1)C(=O)Nc1cc(Cl)ccc1F 920544003 BOVUBACSRJLWFA-KGLIPLIRSA-N 486.887 5.139 5 20 JKBD CC(C)c1ccccc1NC(=O)[C@H](C)OC(=O)c1ccc(N[C@@H](C)c2ccccn2)c([N+](=O)[O-])c1 920548787 SQEFVXMHZIKGAI-ROUUACIJSA-N 476.533 5.470 5 20 JKBD Cc1ccc2oc(C(=O)NC3(c4ccc(NC(=O)Cc5cccc([N+](=O)[O-])c5)cc4)CCC3)cc2n1 1785791757 CVSPXQAKPYCFJO-UHFFFAOYSA-N 484.512 5.035 5 20 JKBD Cc1nc(C)c(C(=O)NC2(c3ccc(NC(=O)c4cc(Cl)cc([N+](=O)[O-])c4C)cc3)CCC2)s1 1790774628 UEFRGFWNKJUMEC-UHFFFAOYSA-N 498.992 5.691 5 20 JKBD Cn1cccc1C(=O)NC1(c2ccc(NC(=O)c3cc4cc([N+](=O)[O-])ccc4s3)cc2)CCC1 1791009970 DFUZHEBTBYKVGD-UHFFFAOYSA-N 474.542 5.210 5 20 JKBD Cc1oc(C(C)(C)C)cc1C(=O)N1CCC([C@H]2CCCCN2C(=O)c2ccc(O)c([N+](=O)[O-])c2)CC1 1830491508 XTXGWQWRNZBIPU-OAQYLSRUSA-N 497.592 5.046 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)N1CC2(CCCN2C(=O)c2ccc(-c3ccc(Cl)cc3)o2)C1 1843459599 GDWGJSWYYYCXJO-UHFFFAOYSA-N 497.910 5.087 5 20 JKBD C[C@@H](Sc1nnc(-c2ccco2)n1C1CCCCC1)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl 10015049 JBSQGNFOUCALAF-CYBMUJFWSA-N 475.958 5.724 5 20 JKBD Cc1ccc(NC(=O)c2ccccc2Sc2ccc(S(=O)(=O)N3CCCC3)cc2[N+](=O)[O-])cc1 14426790 RVUQQBCRMYYHMH-UHFFFAOYSA-N 497.598 5.091 5 20 JKBD C[C@H](OC(=O)c1csc(-c2cccc(Cl)c2)n1)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 17981019 HRJRWMXGPVRVSJ-JTQLQIEISA-N 499.854 5.575 5 20 JKBD C[C@@H]1CCCN(Cc2ccccc2CNC(=O)c2ccc(N[C@H](C)c3ccccn3)c([N+](=O)[O-])c2)C1 227403438 PFKHRIJOGHHWEE-NHCUHLMSSA-N 487.604 5.325 5 20 JKBD Cc1nc(-c2ccccc2)sc1[C@@H](C)NC(=O)Cn1c2ccccc2c(=O)c2ccccc21 303028210 SRYTYBBGUVISGU-QGZVFWFLSA-N 453.567 5.464 5 20 JKBD Cc1csc(-c2ccc(NC(=O)c3ccc(N[C@H](C)c4ccccn4)c([N+](=O)[O-])c3)cc2)n1 303120858 MJMUDXNNEMKJIL-MRXNPFEDSA-N 459.531 5.847 5 20 JKBD O=C(Nc1ccccc1C(=O)N1CCC(Nc2ccc(F)cc2)CC1)c1ccc([N+](=O)[O-])cc1Cl 486528088 BFNCWJDDTUCGME-UHFFFAOYSA-N 496.926 5.356 5 20 JKBD CC(C)c1nc(-c2ccccc2NC(=O)c2ccc(N3C[C@@H](C)C[C@@H](C)C3)c([N+](=O)[O-])c2)n[nH]1 492615422 WJEPNEYHAUUZGS-CALCHBBNSA-N 462.554 5.238 5 20 JKBD COc1ccc(I)c(NC(=O)c2cc3ccccc3c3cccnc23)c1 497346598 FWSNOUYJLHJDFW-UHFFFAOYSA-N 454.267 5.254 5 20 JKBD CCc1cccc2c1OCC[C@H]2NC(=O)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 506972905 NZDAGEOBUYTRRT-LJQANCHMSA-N 477.483 5.032 5 20 JKBD Cc1c(NC(=O)c2cc(OCC(F)(F)F)ccc2[N+](=O)[O-])cccc1-c1nnc2n1CCCCC2 515705683 PVKVXSNKANNHMT-UHFFFAOYSA-N 489.454 5.082 5 20 JKBD CC[C@H](C)NC(=O)c1cccc(CN[C@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2ccccc2)c1 515759731 WNJVQIOPNLDLPH-XDHUDOTRSA-N 494.979 5.246 5 20 JKBD O=C(CCN1CCCCC1)Nc1cccc(NC(=O)c2cc3ccccc3c3cccnc23)c1 518230952 UJFNOPLARNUXBL-UHFFFAOYSA-N 452.558 5.455 5 20 JKBD CN(CCCCCc1cc(-c2cccc(F)c2)no1)S(=O)(=O)c1c(Cl)cccc1[N+](=O)[O-] 520153983 GRXGQWBGWMZYNG-UHFFFAOYSA-N 481.933 5.076 5 20 JKBD Cc1c(NC(=O)C(=O)N(Cc2ccc(-c3ccccc3C(F)(F)F)o2)C2CC2)cccc1[N+](=O)[O-] 520428750 UFOXCFZNAYBKST-UHFFFAOYSA-N 487.434 5.312 5 20 JKBD Cc1ccc(OCCC(=O)N(Cc2ccccc2[N+](=O)[O-])CC(F)(F)F)c(Br)c1 521378993 UCJMFXJPYKQABP-UHFFFAOYSA-N 475.261 5.026 5 20 JKBD COc1cc([C@H](C)Nc2cnn(-c3ccc([N+](=O)[O-])cc3)c(=O)c2Cl)ccc1OCC(C)C 522625811 BXGCSFPKQXGGAW-HNNXBMFYSA-N 472.929 5.011 5 20 JKBD O=C(c1ccc(Sc2nc3ccccc3s2)c([N+](=O)[O-])c1)N1CCC[C@H](c2ncc[nH]2)C1 524340830 ZHZPYMCFFGBMMG-HNNXBMFYSA-N 465.560 5.099 5 20 JKBD COc1cc([N+](=O)[O-])ccc1NC(=O)CSc1nnc(-c2ccco2)n1[C@H](C)[C@H]1C[C@H]2CC[C@H]1C2 594534379 FPQFLUATHWVWIE-MUQADHOPSA-N 497.577 5.183 5 20 JKBD Cc1nc(-c2ccc(NC(=O)c3ccc(N[C@@H](C)c4ccccn4)c([N+](=O)[O-])c3)cc2)oc1C 604310738 ZGDIURJLUMJXMV-INIZCTEOSA-N 457.490 5.687 5 20 JKBD CC(C)CCSc1ccc(C(=O)N2CCC(N3CCc4ccccc4C3)CC2)cc1[N+](=O)[O-] 604482584 QXPOPFZJWPLEBV-UHFFFAOYSA-N 467.635 5.396 5 20 JKBD O=[N+]([O-])c1cc(CNCc2cccc(OCc3ccccn3)c2)ccc1Oc1ccc(F)cc1 608781987 XAGOERKORQQARY-UHFFFAOYSA-N 459.477 5.790 5 20 JKBD CC(C)c1nc(CCNC(=O)C/C(=C\c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)cs1 608819901 DIYSBSXOXIPGSZ-QGOAFFKASA-N 492.626 6.074 5 20 JKBD Cc1ccc(-n2c(Sc3ccc([N+](=O)[O-])c4cnccc34)nnc2-c2ccncc2)cc1C 619685540 HUGXLVFFAYYGTP-UHFFFAOYSA-N 454.515 5.554 5 20 JKBD CC(C)(C)c1cc[n+](/C(C(=S)Nc2ccc(Cl)nc2)=C(/O)c2ccc([N+](=O)[O-])cc2)cc1 727161188 CDHSYCBAKHHCBQ-UHFFFAOYSA-O 469.974 5.552 5 20 JKBD Cc1c(C(=O)Nc2cc(C(F)(F)F)ccc2NC(=O)OC(C)(C)C)cc([N+](=O)[O-])cc1[N+](=O)[O-] 727790424 IDSWMTJVJRTWBN-UHFFFAOYSA-N 484.387 5.430 5 20 JKBD Cc1nn(Cc2ccccc2Cl)c(Cl)c1C(=O)Nc1cc(-c2cccc([N+](=O)[O-])c2)[nH]n1 729528842 GDXMAOMAKYAOIV-UHFFFAOYSA-N 471.304 5.097 5 20 JKBD CCOc1ccc(-c2nc(COC(=O)c3csc(-c4cccc([N+](=O)[O-])c4)n3)cs2)cc1 747640330 NYCWANMRXSYLHH-UHFFFAOYSA-N 467.528 5.598 5 20 JKBD O=C(C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)OCc1cn2ccccc2n1 748579017 GCMLVPUZUGNIMW-QGOAFFKASA-N 470.510 5.526 5 20 JKBD C[C@@H](OC(=O)C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)C(=O)NC1CCCC1 748579193 JVNAGQRAWCGNDC-WDMNMGCXSA-N 479.558 5.126 5 20 JKBD COc1cc(C(=O)Nc2ccccc2C(=O)Nc2ccc(Cl)cc2)c([N+](=O)[O-])cc1OC(F)F 786986449 RVARNOKMKXJHBX-UHFFFAOYSA-N 491.834 5.363 5 20 JKBD O=C(COc1cccc(NC(=O)c2ccco2)c1)OCc1nc2ccccc2c2ccccc12 914982478 GPEUQYLINAEJRT-UHFFFAOYSA-N 452.466 5.356 5 20 JKBD COc1cc(/C=C2/C(=O)Nc3cc(Cl)c([N+](=O)[O-])cc32)cc(Br)c1OC(F)F 917145166 LDYJKSRTLMNUBT-XNWCZRBMSA-N 475.629 5.113 5 20 JKBD CC1CCN(c2ccc([N+](=O)[O-])cc2C(=O)Nc2ccc(C(=O)N3CCCC[C@H]3C)cc2)CC1 917777883 CSZRLVBHBWUCCJ-LJQANCHMSA-N 464.566 5.098 5 20 JKBD O=C(OCC(=O)N1CCC[C@H]1c1ccc(Cl)c(Cl)c1)c1ccc([N+](=O)[O-])cc1Cl 918855398 OGDQPBDLPQGCIG-KRWDZBQOSA-N 457.697 5.076 5 20 JKBD O=C(CSc1ccccc1[N+](=O)[O-])NC1(c2ccc(NC(=O)[C@H]3CCC(F)(F)C3)cc2)CCC1 1785803598 USRWKJZELTVYDB-INIZCTEOSA-N 489.544 5.256 5 20 JKBD CC(C)=CCCC(=O)NC1(c2ccc(NC(=O)Cc3cc([N+](=O)[O-])ccc3F)cc2)CCC1 1786672657 IYNATUBPSSGFMX-UHFFFAOYSA-N 453.514 5.157 5 20 JKBD O=C(C[C@@H]1C[C@@H]2CC[C@H]1C2)Nc1ccc(C2(NC(=O)Cc3cc([N+](=O)[O-])ccc3F)CCC2)cc1 1791321234 UAEKZGITPKWADA-QYZOEREBSA-N 479.552 5.237 5 20 JKBD Cc1occc1C(=O)NC1(c2ccc(NC(=O)CSc3ccccc3[N+](=O)[O-])cc2)CCC1 1791521237 BPNFAAXYJTYCRL-UHFFFAOYSA-N 465.531 5.036 5 20 JKBD CC1(C)CCC(CC(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cc4cc([N+](=O)[O-])ccc4s2)C3)CC1 1800234118 BAAFOYUYDOJTAL-ACDBMABISA-N 483.634 5.668 5 20 JKBD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2ccc([N+](=O)[O-])o2)[nH]n1)c1cc2c(Cl)cccc2s1 1818773407 QOTKJKRAKWJTDM-HNNXBMFYSA-N 499.936 5.399 5 20 JKBD C[C@@H]1CCC[C@H]1C(=O)N1CCCC[C@@H]1C1CCN(C(=O)C2(c3cccc([N+](=O)[O-])c3)CCC2)CC1 1828487419 TXIAARFFYHFVLS-NIJXNBFTSA-N 481.637 5.072 5 20 JKBD C[C@H](Sc1ccccc1)C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cccc(F)c2[N+](=O)[O-])CC1 1830617571 VUPPHUBXQJQFJJ-MBSDFSHPSA-N 499.608 5.148 5 20 JKBD O=C(c1ccc([N+](=O)[O-])cc1F)N1CCC([C@H]2CCCCN2C(=O)c2ccc3ccoc3c2)CC1 1830913685 YIOWNVADVSDLEP-HSZRJFAPSA-N 479.508 5.027 5 20 JKBD Cc1ccc(C(=O)N2CCC([C@H]3CCCCN3C(=O)c3cc4cc([N+](=O)[O-])ccc4s3)CC2)o1 1831060285 QKRBAKDGAOCNIX-HXUWFJFHSA-N 481.574 5.258 5 20 JKBD Cc1ccc(NC(=O)[C@@H](Sc2nc3cc(Cl)cnc3[nH]2)c2ccccc2)c([N+](=O)[O-])c1 9552854 HSKYLVRAIBFKQW-SFHVURJKSA-N 453.911 5.300 5 20 JKBD O=C(Nc1ccccc1-c1nc2ccccc2s1)C1CCN(c2ccccc2[N+](=O)[O-])CC1 14604056 AXUYWISOQDNRTN-UHFFFAOYSA-N 458.543 5.727 5 20 JKBD O=C(Nc1ccc(OC(=O)[C@@H]2COc3ccc(Cl)cc3C2)cc1)c1cc([N+](=O)[O-])ccc1Cl 15571570 FDEROUUMCLTIDP-AWEZNQCLSA-N 487.295 5.311 5 20 JKBD Cc1nn(Cc2ccc(C(=O)Nc3ccc(-c4nc5ccccc5[nH]4)cc3)cc2)c(C)c1[N+](=O)[O-] 19678210 UHFYHPAIQZSTGT-UHFFFAOYSA-N 466.501 5.252 5 20 JKBD C[C@H](OC(=O)CCc1ncc(-c2ccc(Cl)cc2Cl)o1)C(=O)Nc1ccc(F)c([N+](=O)[O-])c1 21802239 SKPGGEXBTVRWNI-NSHDSACASA-N 496.278 5.199 5 20 JKBD CSc1cccc(N[C@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Br)c2ccccc2)c1 21818883 OGNSJVLSSJKHLU-FQEVSTJZSA-N 472.364 5.871 5 20 JKBD C[C@@H](c1ccc(F)c(F)c1)N(C)C(=O)Cc1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1 23765018 XALPSCGEXAQLJE-KRWDZBQOSA-N 476.483 5.488 5 20 JKBD O=C(Cn1c2ccccc2c(=O)c2ccccc21)NC1C[C@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1 33196875 OFMXQDVGWIZMJO-ZIAGYGMSSA-N 470.413 5.180 5 20 JKBD Cc1nn(Cc2ccc(C(=O)Nc3cccc(C(=O)Nc4cccc(F)c4)c3)cc2)c(C)c1[N+](=O)[O-] 68734375 MXMGAFSHZPTDGL-UHFFFAOYSA-N 487.491 5.100 5 20 JKBD COc1ccc(NC(=O)c2ccc(N3CCC[C@H](C)C3)c([N+](=O)[O-])c2)cc1OCc1ccncc1 116945885 BNPYHRIJGBRRRL-SFHVURJKSA-N 476.533 5.066 5 20 JKBD Cc1ccccc1-c1nnc(SCc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)n1Cc1ccco1 301904298 CUUXOXLSJVDAOM-UHFFFAOYSA-N 474.502 5.145 5 20 JKBD C[C@@H](Nc1ccc(C(=O)Nc2cc(F)ccc2Oc2ccccc2)cc1[N+](=O)[O-])c1ccccn1 303174485 JSESTHFHLXVAQP-QGZVFWFLSA-N 472.476 6.347 5 20 JKBD C[C@@H]1C[C@@H](C)CN(c2ccc(C(=O)Nc3ccccc3NC(=O)Cc3cccs3)cc2[N+](=O)[O-])C1 409992247 JRYFLFCXJLKIBL-QZTJIDSGSA-N 492.601 5.572 5 20 JKBD CCN(c1ccccc1)S(=O)(=O)c1ccc(N[C@H](c2ccccc2)c2cccnc2)c([N+](=O)[O-])c1 488014424 MCSDZDOVELEZFF-AREMUKBSSA-N 488.569 5.407 5 20 JKBD C[C@H](NC(=O)c1cc([N+](=O)[O-])ccc1Sc1ccc(Cl)cc1)c1ccc2c(c1)CCC(=O)N2 500099021 RHLSUQJSQYQGBA-AWEZNQCLSA-N 481.961 5.775 5 20 JKBD Cc1nn(Cc2ccc(C(=O)N(C3CC3)[C@@H](C)c3cccc(C(F)(F)F)c3)cc2)c(C)c1[N+](=O)[O-] 502849015 VLWDVMDFUZZCGB-INIZCTEOSA-N 486.494 5.841 5 20 JKBD C[C@H](NC(=O)Nc1ccc(NC(=O)c2ccco2)cc1C(F)(F)F)c1cccc([N+](=O)[O-])c1 509732380 RUMCTOPWJRBSFC-LBPRGKRZSA-N 462.384 5.342 5 20 JKBD O=C(Nc1nc(-c2ccc3ccccc3c2)cs1)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-] 512159496 RJRVJGHMUBXRLJ-UHFFFAOYSA-N 473.432 6.065 5 20 JKBD CCn1c(SCc2nnc(-c3ccc(Cl)cc3Cl)o2)nc2cc3ccccc3cc2c1=O 513276280 OFDXCLPTZJYWAH-UHFFFAOYSA-N 483.380 6.219 5 20 JKBD CCOc1cc([N+](=O)[O-])c(C(=O)Nc2cc(-c3ccc(C)cc3)nn2-c2ccccc2)cc1OC 514740453 YGLSFXLAASEYOX-UHFFFAOYSA-N 472.501 5.416 5 20 JKBD COc1ccc(C)cc1NC(=O)C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1 514993611 ROKURWMLSLBLJF-NBVRZTHBSA-N 459.527 6.091 5 20 JKBD Cc1c(NC(=O)[C@@H](C)Sc2nnc(-c3ccccc3)n2[C@H](C)c2ccccc2)cccc1[N+](=O)[O-] 515574037 CQTXNBRBKJMRKZ-RTBURBONSA-N 487.585 5.890 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Cl)[C@H](NCc1cccc(OCC(F)(F)F)c1)c1ccccc1 515756713 AVWRLWXCWHDDKG-OAQYLSRUSA-N 493.869 5.659 5 20 JKBD C[C@@H](Nc1ccc(C(=O)N(Cc2cscn2)c2ccccc2)cc1[N+](=O)[O-])c1ccccn1 518188650 KZBPREBDEICNNI-QGZVFWFLSA-N 459.531 5.466 5 20 JKBD Cc1cc(C(=O)NC2CCCC2)ccc1NC(=O)c1ccc(NCc2ccccc2)c([N+](=O)[O-])c1 518931998 DUZLVNDBXSNJPM-UHFFFAOYSA-N 472.545 5.440 5 20 JKBD O=[N+]([O-])c1ccc(-c2ccc(CNCc3cc(Br)cs3)o2)c(Br)c1 520956136 AMAYBHCLPOQJFS-UHFFFAOYSA-N 472.158 5.731 5 20 JKBD Cc1nn(C)cc1[C@H](C)NC(=O)C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1 524341113 LNTPCIKRPISXSH-BRYHAGSVSA-N 461.547 5.055 5 20 JKBD CC(C)N(Cc1nnc(-c2ccccc2Cl)o1)C(=O)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-] 603730539 MHBCWTQUPYIFBM-UHFFFAOYSA-N 498.845 5.290 5 20 JKBD O=[N+]([O-])c1ccc(-c2noc(CSc3nnc(-c4ccc(F)cc4)n3-c3ccccc3)n2)cc1 603748353 MFBOZPLWWATVLW-UHFFFAOYSA-N 474.477 5.324 5 20 JKBD Cc1ccc(Cc2sc(NC(=O)c3cc(OCC(F)(F)F)ccc3[N+](=O)[O-])nc2C)cc1 603974080 HBGNGAMOKIVIJZ-UHFFFAOYSA-N 465.453 5.452 5 20 JKBD CCOc1cc([N+](=O)[O-])c(C(=O)N[C@H](c2ccc(Br)cc2)C2CCC2)cc1OC 604016837 GVJGAYXXBNNJJJ-FQEVSTJZSA-N 463.328 5.036 5 20 JKBD O=[N+]([O-])c1ccc(S(=O)(=O)Nc2ncc(Cc3ccc(C(F)(F)F)cc3)s2)c(Cl)c1 604024202 QUZFYYJOKZOAIP-UHFFFAOYSA-N 477.873 5.115 5 20 JKBD COc1cc2c(cc1OC)[C@@H](c1ccccc1)N(C(=O)N[C@@H](C)c1cccc([N+](=O)[O-])c1)CC2 604126756 VFHXVANGMNQOGZ-SSOJOUAXSA-N 461.518 5.030 5 20 JKBD C[C@@H](Nc1ccc(C(=O)NCCc2ccc(C(F)(F)F)cc2)cc1[N+](=O)[O-])c1ccccn1 604295514 MHCFBZWXBASQLR-OAHLLOKOSA-N 458.440 5.154 5 20 JKBD COc1cc(CNCc2c(C)nn(-c3ccccc3)c2C)ccc1OCc1ccc([N+](=O)[O-])cc1 604478805 SASVRXBEPDTFET-UHFFFAOYSA-N 472.545 5.275 5 20 JKBD Cc1cccc(-n2ncc(C(=O)Nc3nc(-c4cccc([N+](=O)[O-])c4)cs3)c2C(F)(F)F)c1 619672581 IJFRULDPMJTRHN-UHFFFAOYSA-N 473.436 5.484 5 20 JKBD O=C(CCc1nnc(-c2cc3ccccc3o2)o1)Oc1ccc(NC(=O)c2cccc([N+](=O)[O-])c2)cc1 726133550 IKHLUCLNVLGFMR-UHFFFAOYSA-N 498.451 5.182 5 20 JKBD C[C@H](OC(=O)c1ccccc1NCc1ccccc1)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 726830979 MTJTXMVGQAXYQM-HNNXBMFYSA-N 487.434 5.410 5 20 JKBD CCc1cccc[n+]1/C(C(=S)Nc1ccc(OC)c(Cl)c1)=C(/O)c1cccc([N+](=O)[O-])c1 726960654 BLLUPLVYJSYTKF-UHFFFAOYSA-O 470.958 5.430 5 20 JKBD O=C1Nc2cc(Cl)ccc2[C@H]1C1CCN(c2c([N+](=O)[O-])cc(C(F)(F)F)cc2[N+](=O)[O-])CC1 727432298 DDVAIZSIGARZPO-QGZVFWFLSA-N 484.818 5.128 5 20 JKBD O=C(C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)OCc1nnsc1Cl 729235273 RVMVNHYCFLFEOH-UKTHLTGXSA-N 472.935 5.384 5 20 JKBD C/C(=C\C(=O)N(Cc1nnc(-c2cccc([N+](=O)[O-])c2)o1)C(C)C)c1ccc(C(F)(F)F)cc1 748167102 GADWRSHAYIMOID-RVDMUPIBSA-N 474.439 5.504 5 20 JKBD Cc1cc(C)nc(Sc2ccc(NC(=O)c3cc([N+](=O)[O-])ccc3Br)cc2)n1 750604119 WRVDVVVOZZTXSY-UHFFFAOYSA-N 459.325 5.168 5 20 JKBD CC(C)N(CC(=O)Nc1ccc(Cl)cc1C(F)(F)F)C(=O)c1cc(Cl)ccc1[N+](=O)[O-] 820131092 GVYNUUAIOIDSEM-UHFFFAOYSA-N 478.254 5.410 5 20 JKBD O=C(Nc1cc([N+](=O)[O-])c(F)cc1F)c1ccc2c(c1)C(=O)N(c1ccc(Cl)c(Cl)c1)C2=O 897473169 QXFXPJNYRREOPR-UHFFFAOYSA-N 492.221 5.233 5 20 JKBD CC1=C(C(=O)Nc2ccccc2)[C@H](c2cc([N+](=O)[O-])c(F)cc2F)NC(=O)N1Cc1ccccc1 916723220 IYOAZDZTMLQLDN-QHCPKHFHSA-N 478.455 5.052 5 20 JKBD CCn1c(SCC(=O)OCc2cc(F)ccc2[N+](=O)[O-])nnc1-c1ccc(Cl)cc1Cl 918798607 CFULVJWKGMLVQV-UHFFFAOYSA-N 485.324 5.155 5 20 JKBD C[C@@H](Nc1ccc(C(=O)NCCc2ccc(N3CCCCC3)cc2)cc1[N+](=O)[O-])c1ccccn1 919748347 YBYXZUABKXAGJK-HXUWFJFHSA-N 473.577 5.126 5 20 JKBD O=C(/C=C\c1c[nH]c2ccccc12)NC1(c2ccc(NC(=O)c3ccc([N+](=O)[O-])o3)cc2)CCC1 1785747840 FKAQOESYIOTEGG-SDQBBNPISA-N 470.485 5.130 5 20 JKBD O=C(NC1(c2ccc(NC(=O)c3cccnc3-c3ccccc3)cc2)CCC1)c1ccc([N+](=O)[O-])o1 1788735234 PSIJHHCMEDHIKJ-UHFFFAOYSA-N 482.496 5.311 5 20 JKBD Cc1cc(C(=O)Nc2ccc(C3(NC(=O)c4cccc5ccoc45)CCC3)cc2)ncc1[N+](=O)[O-] 1788766598 ILRNGMOSZDNVOU-UHFFFAOYSA-N 470.485 5.106 5 20 JKBD O=C(/C=C/c1cc2ccccc2o1)Nc1ccc(C2(NC(=O)c3ccc([N+](=O)[O-])o3)CCC2)cc1 1789114435 KMVTUTQUURWVHU-ZRDIBKRKSA-N 471.469 5.395 5 20 JKBD O=C(/C=C/c1ccc([N+](=O)[O-])o1)NC1(c2ccc(NC(=O)c3sccc3Cl)cc2)CCC1 1789897363 ALXLOYWDVTZMBK-SOFGYWHQSA-N 471.922 5.364 5 20 JKBD CC(=O)C[C@H](C)C(=O)NC1(c2ccc(NC(=O)c3cc4cc([N+](=O)[O-])ccc4s3)cc2)CCC1 1791010800 ZGVLMMVZUAYPFQ-HNNXBMFYSA-N 479.558 5.172 5 20 JKBD CCOc1ccccc1C(=O)NC1(c2ccc(NC(=O)Cc3cc(F)ccc3[N+](=O)[O-])cc2)CCC1 1792308714 CONRRJBSAUEPGQ-UHFFFAOYSA-N 491.519 5.123 5 20 JKBD COc1ccc(C(=O)N2CCCC3(CCN(C(=O)c4cc5cc([N+](=O)[O-])ccc5s4)CC3)C2)s1 1807506986 BDBVAUSLJBNAFH-UHFFFAOYSA-N 499.614 5.038 5 20 JKBD C[C@H](C(=O)N1CCC([C@@H]2CCCCN2C(=O)/C=C/c2ccc([N+](=O)[O-])o2)CC1)c1ccc(Cl)cc1 1824275527 CNKHYWGQYICINF-GYKAZKIPSA-N 499.995 5.278 5 20 JKBD CC[C@H](C)CC(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cccc(Br)c2[N+](=O)[O-])CC1 1824346646 JWRWVRPHWNGRTI-OXJNMPFZSA-N 494.430 5.027 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)N1CCCC[C@H]1C1CCN(C(=O)[C@@H]2CCc3ccccc32)CC1 1830729764 XDSRABAHQQJBGQ-RDGATRHJSA-N 493.579 5.006 5 20 JKBD O=C(c1ccc([N+](=O)[O-])o1)N1CCC([C@@H]2CCCCN2C(=O)c2cc(Cl)c(F)c(Cl)c2)CC1 1830730469 HNFPWDAYPAYMOU-KRWDZBQOSA-N 498.338 5.181 5 20 JKBD Nc1cc(C(=O)O[C@@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2ccccc2)ccc1Cl 10874546 JVGFWSFIOBWHJD-LJQANCHMSA-N 460.273 5.021 5 20 JKBD CCOc1cc(C(=O)O[C@@H](C(=O)Nc2cc(C)ccc2C)c2ccccc2)c([N+](=O)[O-])cc1OC 19473002 QNKKVLMBOREGRL-XMMPIXPASA-N 478.501 5.156 5 20 JKBD CC(C)n1c(S[C@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2C(F)(F)F)nc2ccccc2c1=O 25021070 VFEQFPUPKPFASU-GFCCVEGCSA-N 480.468 5.024 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Cl)[C@@H](Nc1ccc(N2CCCC2=O)cc1)c1ccccc1 32815131 MHXGUEKSQZLMOJ-QHCPKHFHSA-N 464.909 5.167 5 20 JKBD Cc1cc(NC(=O)COC(=O)c2c3c(nc4ccccc24)/C(=C\c2ccc([N+](=O)[O-])cc2)CCC3)no1 206744019 GAXMNPFGXUECQT-JXAWBTAJSA-N 498.495 5.112 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)Nc2nc3ccc(OC(F)(F)F)cc3s2)cc1SC 481917006 GXIAYLSDQZPERU-UHFFFAOYSA-N 459.427 5.086 5 20 JKBD O=C(c1csc(-c2ccc([N+](=O)[O-])cc2)n1)N(Cc1ccc(Cl)c(Cl)c1)Cc1ccccn1 499610254 KMEMUFZCTQIMEE-UHFFFAOYSA-N 499.379 6.263 5 20 JKBD CC(=O)CCc1ccc(OCc2cccc(C(=O)N3c4ccc([N+](=O)[O-])cc4C[C@H]3C)c2)cc1 504382540 VGYKALVOGNEGJS-GOSISDBHSA-N 458.514 5.287 5 20 JKBD CCOc1cc([N+](=O)[O-])c(C(=O)Nc2ccc(Cl)cc2C(=O)N2[C@@H](C)CCC[C@H]2C)cc1OC 508288229 MJSLYXBKJSZSAF-GASCZTMLSA-N 489.956 5.311 5 20 JKBD CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)c1cccc(S(=O)(=O)Nc2ccccc2Cl)c1 509718627 LCEFGEHPYUGANB-UHFFFAOYSA-N 487.965 5.100 5 20 JKBD COc1cc([C@H](C)NC(=O)N(Cc2ccc([N+](=O)[O-])cc2)C(C)C)ccc1OCc1ccccc1 509765322 XIUNMAVVRUGQGJ-FQEVSTJZSA-N 477.561 5.864 5 20 JKBD C[C@H](c1ccccc1)n1c(SCC(=O)Nc2ccccc2[N+](=O)[O-])nnc1-c1ccccc1 510247679 ZFDCOWWDVWYBTA-QGZVFWFLSA-N 459.531 5.193 5 20 JKBD COCCN(C(=O)C[C@@H]1CCCc2cc(OC)ccc21)c1nc(-c2ccc([N+](=O)[O-])cc2)cs1 512383959 IJZIYIBHXCTIKE-IBGZPJMESA-N 481.574 5.217 5 20 JKBD COc1ccc(OCCNC(=O)C/C(=C\c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)cc1 512389431 LSPJOORTKOYTSF-KNTRCKAVSA-N 489.553 5.339 5 20 JKBD CS(=O)(=O)c1cc(C(=O)Nc2cc(Cl)ccc2Sc2ccccc2)cc([N+](=O)[O-])c1 516336068 IIJSPMUCGPELKI-UHFFFAOYSA-N 462.936 5.055 5 20 JKBD C[C@H](NCc1ccc(Oc2ccc(C(C)(C)C)cc2)c([N+](=O)[O-])c1)c1nnc2n1CCCCC2 517538845 MODDNKSHRNCYSG-SFHVURJKSA-N 463.582 5.853 5 20 JKBD Cc1nccc(CNC(=O)c2c3c(nc4ccccc24)/C(=C\c2cccc([N+](=O)[O-])c2)CCC3)n1 518326924 MVXGZQAFVWUGQC-RGEXLXHISA-N 465.513 5.048 5 20 JKBD COC(=O)Cc1ccc(NC(=O)C/C(=C/c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)cc1 521251279 ABYMEWHHFNMVJN-RGEXLXHISA-N 487.537 5.489 5 20 JKBD Cc1ccc(NC(=O)NC[C@H]2CCCN(C(=O)c3cc([N+](=O)[O-])ccc3Oc3ccccc3)C2)cc1 524273523 WXBKVKYLWIZORA-HXUWFJFHSA-N 488.544 5.369 5 20 JKBD CC(=O)Nc1cccc([C@H](C)N(Cc2ccccc2)C(=O)c2ccc(NC3CC3)c([N+](=O)[O-])c2)c1 591353897 SMQUQIMELSZBEM-SFHVURJKSA-N 472.545 5.531 5 20 JKBD C[C@H]([C@@H]1C[C@H]2CC[C@H]1C2)n1c(SCC(=O)Nc2ccccc2[N+](=O)[O-])nnc1-c1ccco1 594533793 CQSOGTKEJIRIIC-QZWWFDLISA-N 467.551 5.174 5 20 JKBD Cc1ccc(C(=O)Nc2ccc([N+](=O)[O-])cc2)cc1NC(=O)c1ccc(Br)cc1 603637459 KXEUOYYWGPZPLC-UHFFFAOYSA-N 454.280 5.170 5 20 JKBD CC(C)Oc1cccc([C@@H](C)N[C@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2ccccc2)c1 604044818 COGGTZRTXSFUDM-OSPHWJPCSA-N 467.953 6.066 5 20 JKBD Cc1ccc(C(=O)N2C[C@@H](C)C[C@@H](C)C2)cc1NC(=O)[C@H](C)Oc1ccc(Cl)cc1[N+](=O)[O-] 604443682 KJUSQDGPFWLESI-UXLLHSPISA-N 473.957 5.081 5 20 JKBD C[C@H](NC(=O)c1ccc(C(=O)N[C@@H](C)c2cc3ccccc3o2)c([N+](=O)[O-])c1)c1cc2ccccc2o1 609043652 GYLXBDONHZULPH-IRXDYDNUSA-N 497.507 6.069 5 20 JKBD O=C(c1ccc(C(=O)N2CCC[C@@H]2c2ccsc2)c([N+](=O)[O-])c1)N1CCC[C@H]1c1ccsc1 609044529 KKTIWPUOYUFMEA-LEWJYISDSA-N 481.599 5.672 5 20 JKBD CSc1ccc([N+](=O)[O-])c(C(=O)Nc2nc3ccccc3n2Cc2cccc(C(F)(F)F)c2)c1 609063070 VDBZINDOUKEOGB-UHFFFAOYSA-N 486.475 5.986 5 20 JKBD O=C(Cc1ccc(NC(=O)c2csc(-c3cccc([N+](=O)[O-])c3)n2)cc1)Nc1ccccc1F 609064362 QQPIGOUXSIQWOZ-UHFFFAOYSA-N 476.489 5.291 5 20 JKBD COc1ccc(NC(=O)c2ccc(NC3CC3)c([N+](=O)[O-])c2)cc1OCc1ccc2ccccc2n1 609066029 AONLGKMNMJVXFC-UHFFFAOYSA-N 484.512 5.557 5 20 JKBD Cc1ccccc1C1(C(=O)Oc2ccc(NC(=O)c3cc([N+](=O)[O-])ccc3Cl)cc2)CC1 726912392 XSSWTVOQZBWUCS-UHFFFAOYSA-N 450.878 5.446 5 20 JKBD COc1ccc(C[C@H](NC(=O)c2cc([N+](=O)[O-])ccc2Br)c2ccccc2)cc1OC 727331952 FUGAJEURVAIJCT-FQEVSTJZSA-N 485.334 5.088 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)O[C@@H](C)C(=O)Nc2ccccc2-c2ccccc2)cc1SC 728658351 UQMSIXBKBFKDSM-HNNXBMFYSA-N 466.515 5.176 5 20 JKBD O=C(Nc1ccc(OC(=O)[C@H]2CCCN(Cc3ccccc3)C2)cc1)c1cc([N+](=O)[O-])ccc1Cl 746818816 IQLZHMNAPFTRBE-IBGZPJMESA-N 493.947 5.318 5 20 JKBD Cc1ccc(C)c(NC(=O)[C@H](OC(=O)c2csc(-c3ccc([N+](=O)[O-])cc3)n2)c2ccccc2)c1 747954670 CTXFURSRLIKENG-HSZRJFAPSA-N 487.537 5.872 5 20 JKBD O=C(COC(=O)c1csc(-c2ccc([N+](=O)[O-])cc2)n1)Nc1ccccc1Oc1ccccc1 747956601 XCGQULWDQFAMIB-UHFFFAOYSA-N 475.482 5.306 5 20 JKBD Cc1cccc(NC(=O)c2ccccc2NC(=O)c2cc([N+](=O)[O-])ccc2Br)c1 751054996 OXWDSCHIDBEFPY-UHFFFAOYSA-N 454.280 5.170 5 20 JKBD O=C(Oc1ccc2c(-c3ccc([N+](=O)[O-])cc3)cc(=O)oc2c1)c1ccc(CN2CCCCC2=O)cc1 915132862 MVZJEUAIFMYOBY-UHFFFAOYSA-N 498.491 5.100 5 20 JKBD Cc1noc(C)c1CN(C)C(=O)c1c2c(nc3ccccc13)/C(=C\c1ccc([N+](=O)[O-])cc1)CCC2 915195185 LSJOQNHMGKWTSP-HKWRFOASSA-N 482.540 5.897 5 20 JKBD COCCN(C(=O)c1nc(-c2cccs2)oc1C)c1nc(-c2ccc([N+](=O)[O-])cc2)cs1 915812559 FCSPRBWHBZBNQM-UHFFFAOYSA-N 470.532 5.036 5 20 JKBD O=c1c2cc([N+](=O)[O-])ccc2nc2n1CC/C2=C\c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1 916127377 QVINHLYENOKZHR-RVDMUPIBSA-N 490.859 5.603 5 20 JKBD Cc1ccc(C)c(NC(=O)Cc2nc(COC(=O)[C@H](C)Sc3ccc([N+](=O)[O-])cc3)cs2)c1 916523149 JSJQTZVASXOXTL-INIZCTEOSA-N 485.587 5.073 5 20 JKBD O=C(COC(=O)c1c(Cl)cc(C(F)(F)F)cc1Cl)Nc1ccc([N+](=O)[O-])cc1Cl 919295620 CVPQWQLVYHQCKO-UHFFFAOYSA-N 471.602 5.369 5 20 JKBD COc1cc(C(=O)OCc2nc(-c3cccs3)oc2C)c([N+](=O)[O-])cc1OCc1cscn1 920652143 IYFGXFADKIAULP-UHFFFAOYSA-N 487.515 5.021 5 20 JKBD Cc1nc(C)c(C(=O)Nc2ccc(C3(NC(=O)CSc4ccccc4[N+](=O)[O-])CCC3)cc2)s1 1787336314 VDGOCFDWGKCERR-UHFFFAOYSA-N 496.614 5.208 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)c3cccnc3-c3ccc(F)cc3)CCC2)cc1)c1ccc([N+](=O)[O-])[nH]1 1790187227 IQKBUDHEXBZDIP-UHFFFAOYSA-N 499.502 5.186 5 20 JKBD Cc1c(C(=O)NC2(c3ccc(NC(=O)[C@@H]4[C@@H]5C=CS[C@@H]45)cc3)CCC2)cc(Cl)cc1[N+](=O)[O-] 1791090118 AUUDHZQMZQDOKU-IOMROCGXSA-N 483.977 5.179 5 20 JKBD CC1(C(=O)Nc2cc([C@H]3CCCCN3C(=O)c3cc4cc([N+](=O)[O-])ccc4s3)[nH]n2)CCC1 1814404143 IDKTVRUAPJFCOI-QGZVFWFLSA-N 467.551 5.029 5 20 JKBD O=C(c1ccc([N+](=O)[O-])o1)N1CCC([C@@H]2CCCCN2C(=O)[C@@H]2CCC[C@H]3CCCC[C@@H]32)CC1 1828455458 BAZQHRQUWXENNU-ZDFPQIBNSA-N 471.598 5.028 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)N1CCC([C@H]2CCCCN2C(=O)C[C@@H]2C[C@@H]3CC[C@H]2C3)CC1 1831482710 UUCLOTPIQCPQJN-KDNSLJGTSA-N 485.600 5.102 5 20 JKBD C[C@@]1(C(=O)N2CCCC[C@H]2C2CCN(C(=O)CSc3ccccc3[N+](=O)[O-])CC2)CC=CCC1 1832410664 JVMBLUOMNJBARE-HFZDXXHNSA-N 485.650 5.053 5 20 JKBD O=C(c1ccc2occc2c1)N1CCC([C@H]2CCCCN2C(=O)/C=C/c2ccccc2[N+](=O)[O-])CC1 1832906994 LGCDRSOAZJHIIY-KMEWNKIWSA-N 487.556 5.288 5 20 JKBD Cc1ccc([N+](=O)[O-])cc1NC(=O)CSc1nnc(-c2ccncc2)n1-c1cccc(Cl)c1C 10318050 RBLJFOFHZPLXID-UHFFFAOYSA-N 494.964 5.239 5 20 JKBD O=C(O[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1)c1ccc2ccccc2n1 10663600 PDZIJSUKENWALO-JOCHJYFZSA-N 461.861 5.333 5 20 JKBD C[C@H](OC(=O)c1cccc(Cl)c1Cl)C(=O)Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1 11029618 IICPNKLLWFKONL-JTQLQIEISA-N 466.302 5.209 5 20 JKBD C[C@H](Sc1nnc(-c2ccccc2)c(-c2ccccc2)n1)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 16048683 DYEJSTCMWFDEGP-INIZCTEOSA-N 482.525 6.017 5 20 JKBD O=C(Nc1nnc(C2CC2)s1)c1ccccc1Sc1ccc(C(F)(F)F)cc1[N+](=O)[O-] 24021931 LSRNFMQHEHJBEI-UHFFFAOYSA-N 466.466 5.746 5 20 JKBD COc1ccc(Oc2ccc([N+](=O)[O-])cc2C(=O)N2CCC(c3c[nH]c4ncccc34)CC2)cc1 409798288 TZAUUZJNRDVLJF-UHFFFAOYSA-N 472.501 5.292 5 20 JKBD C[C@H](Nc1ccc(C(=O)N2CCC[C@H]2c2cccc(Br)c2)cc1[N+](=O)[O-])c1ccccn1 410088391 PDJVBJZTMVGLFX-AOMKIAJQSA-N 495.377 5.903 5 20 JKBD O=C1NCc2ccc(NC(=O)c3ccccc3Sc3ccc(C(F)(F)F)cc3[N+](=O)[O-])cc21 478428451 VHIPCYQUVXUBMA-UHFFFAOYSA-N 473.432 5.261 5 20 JKBD O=C(N[C@H](c1ccc(Cl)cc1)c1cccs1)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-] 488509673 AEJHNJXUYSMOSM-GOSISDBHSA-N 470.856 5.770 5 20 JKBD Cc1csc(Sc2ccc(C(=O)Nc3cc(F)ccc3OC[C@@H]3CCCO3)cc2[N+](=O)[O-])n1 502394844 VSOQKIQJXNDBLW-INIZCTEOSA-N 489.550 5.460 5 20 JKBD Cc1ccc(NC(=O)c2ccc([N+](=O)[O-])cc2I)c(OCc2ccccc2)c1 508965565 WGWCRMFEKSVAKW-UHFFFAOYSA-N 488.281 5.339 5 20 JKBD O=C(C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)NC1CCN(c2ccccc2)CC1 509373864 RFKLTKQQCVLDQU-DYTRJAOYSA-N 498.608 5.920 5 20 JKBD COc1cc(CNC[C@@H]2CCCO[C@@H]2c2ccccc2)c([N+](=O)[O-])cc1OCc1ccccc1 509614479 BOINQAQLZXAINR-WXVAWEFUSA-N 462.546 5.440 5 20 JKBD COc1cc(C(=O)N(C)[C@H](C)c2ccccc2Cl)c([N+](=O)[O-])cc1OCc1cscn1 512432418 GAKIAQWEOXXFTG-CYBMUJFWSA-N 461.927 5.126 5 20 JKBD Cc1cc(O[C@@H](C)c2ccccc2)ccc1NC(=O)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-] 524381573 JJUNIIQJVIDWDT-INIZCTEOSA-N 474.435 6.237 5 20 JKBD CS(=O)(=O)c1ccc(C(=O)Nc2cc(Cl)ccc2Oc2ccc(Cl)cc2)cc1[N+](=O)[O-] 603463578 FVZDUFIZQRRASU-UHFFFAOYSA-N 481.313 5.350 5 20 JKBD Cc1cccn2c(NC(=O)c3cc(OCC(F)(F)F)ccc3[N+](=O)[O-])c(-c3ccccc3)nc12 603732199 BSXSJXNGKZSDDZ-UHFFFAOYSA-N 470.407 5.411 5 20 JKBD COc1ccc(NC(=O)c2ccc(N3C[C@H](C)C[C@@H](C)C3)c([N+](=O)[O-])c2)cc1OCc1ccncc1 603876747 PMWNTAYOZYRMKE-RTBURBONSA-N 490.560 5.312 5 20 JKBD CC(=O)N(c1ccc(Cl)cc1)c1nc(/C=C2\CCn3c2nc2ccc([N+](=O)[O-])cc2c3=O)cs1 603945798 PMMQZZUZCKLHLY-GXDHUFHOSA-N 493.932 5.044 5 20 JKBD O=C(Nc1cc([N+](=O)[O-])ccc1OC(F)F)[C@H]1CCC(=O)N(Cc2ccccc2)[C@H]1c1ccccc1 603961485 XDGGCVXAFHVDSC-RDPSFJRHSA-N 495.482 5.315 5 20 JKBD O=C(C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)Nc1ccc(-c2ncon2)cc1 608874382 DYFPMADJWUOPFD-QGOAFFKASA-N 483.509 5.824 5 20 JKBD COc1ccc(NC(=O)c2cc3cc([N+](=O)[O-])ccc3o2)cc1OCc1ccc2ccccc2n1 609066052 CEXLASLMVYXXMK-UHFFFAOYSA-N 469.453 5.729 5 20 JKBD CC(C)(C)OC(=O)N1CCC[C@@H]1[C@H]1CCCCN1C(=O)Nc1ccc([N+](=O)[O-])cc1Cl 725855059 SFRYIPGDGRXGEG-QZTJIDSGSA-N 452.939 5.034 5 20 JKBD O=C(O[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1)c1cnc(-c2ccco2)s1 729023965 KHQNPEWGYBUTTL-IBGZPJMESA-N 483.889 5.502 5 20 JKBD O=C(Nc1cc(-c2cccc([N+](=O)[O-])c2)[nH]n1)c1ccccc1-c1ncc(-c2ccccc2)o1 729528903 IZTXFDAJWVAOKU-UHFFFAOYSA-N 451.442 5.559 5 20 JKBD O=C(NCc1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2Cl)cc1)c1ccc(C(F)(F)F)cc1 730761126 HIVMGSLLTKVHER-UHFFFAOYSA-N 477.826 5.449 5 20 JKBD O=C(CCC(=O)c1ccc(-c2ccccc2)cc1)OCC1CCN(c2ccc([N+](=O)[O-])cn2)CC1 750426526 DVVZBUMIUUNTBI-UHFFFAOYSA-N 473.529 5.080 5 20 JKBD O=C(NC[C@H](c1ccccc1Cl)c1c[nH]c2ccccc12)c1cc(F)c(F)cc1[N+](=O)[O-] 750562665 RNTLJOOSLWDBBJ-MRXNPFEDSA-N 455.848 5.570 5 20 JKBD COc1ccc(CCC(=O)Oc2ccc(NC(=O)c3cc([N+](=O)[O-])ccc3Cl)cc2)cc1Cl 818025973 YYDSGODBPAQNEB-UHFFFAOYSA-N 489.311 5.701 5 20 JKBD Cc1ccc(C(C)C)c(Oc2ccc(CNc3ccc([C@H]4CC(=O)NC(=O)N4)cc3)cc2[N+](=O)[O-])c1 864044840 MMQOUASPPUDQOW-JOCHJYFZSA-N 488.544 5.702 5 20 JKBD CC(C)(C)c1ncc(C(=O)O[C@@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2ccccc2)s1 920692207 OSPBODYBRWTWPO-GOSISDBHSA-N 473.938 5.539 5 20 JKBD Cc1cc(C(=O)N2CCC[C@H](C)C2)ccc1NC(=O)c1cc([N+](=O)[O-])ccc1N1CCC(C)CC1 921008426 FHTWGBHTAUKMSW-IBGZPJMESA-N 478.593 5.264 5 20 JKBD O=C(Cc1ccc(Cl)cc1[N+](=O)[O-])NC1(c2ccc(NC(=O)c3cc(C4CC4)on3)cc2)CCC1 1785965450 VUINPLNTYPQDIV-UHFFFAOYSA-N 494.935 5.104 5 20 JKBD Cc1cc(C(=O)Nc2ccc(C3(NC(=O)CSc4ccccc4[N+](=O)[O-])CCC3)cc2)c(C)o1 1787344842 OQQHYJXSSSRPMP-UHFFFAOYSA-N 479.558 5.345 5 20 JKBD COc1cc(CC(=O)NC2(c3ccc(NC(=O)[C@@]4(C)CC=CCC4)cc3)CCC2)ccc1[N+](=O)[O-] 1791992985 YPHNAKNXVZMMJW-SANMLTNESA-N 477.561 5.026 5 20 JKBD CC(C)c1ccc(C(=O)N2CCC3(CCCN(C(=O)CCc4cccc([N+](=O)[O-])c4)C3)CC2)cc1 1806493264 UKSKRQHXJRTJSS-UHFFFAOYSA-N 477.605 5.196 5 20 JKBD Cc1c(C(=O)NC[C@@H]2CCN(C(=O)C3(C(C)C)CCC3)[C@H]2c2cccnc2)cc(Cl)cc1[N+](=O)[O-] 1811796231 FPXQKALOCOJXEA-CVDCTZTESA-N 499.011 5.098 5 20 JKBD O=C(NC[C@H]1CCN(C(=O)CC2CCCC2)[C@H]1c1cccnc1)c1cc2cc([N+](=O)[O-])ccc2s1 1812304456 IXYAXMXPJNMOQS-CLOONOSVSA-N 492.601 5.104 5 20 JKBD Cc1ccsc1C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cc3cc([N+](=O)[O-])ccc3s2)n[nH]1 1821610827 ILYHWULWLXPSKE-KRWDZBQOSA-N 495.586 5.522 5 20 JKBD Cc1ncsc1C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)CC1 1825997328 HSPFRCIKKDKUMV-IBGZPJMESA-N 498.630 5.122 5 20 JKBD CC(C)(C)CC(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cccc([N+](=O)[O-])c2Br)CC1 1826337944 KTPPQEGOOOJVAY-GOSISDBHSA-N 494.430 5.027 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2c[nH]c(C(C)(C)C)c2)CC1 1830728862 PRZQUGNYFSFPKL-JOCHJYFZSA-N 498.599 5.215 5 20 JKBD C[C@@H]1CCC[C@H]1C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)CC1 1831061590 WUPYXDWCMGNBSG-ZPMCFJSWSA-N 483.634 5.479 5 20 JKBD O=C(c1cc2cc([N+](=O)[O-])ccc2s1)N1CC2(CCCN2C(=O)[C@@H]2CCC[C@@H]3CCCC[C@@H]32)C1 1843941394 WSSZTDHEWUKJFJ-DZFGPLHGSA-N 481.618 5.233 5 20 JKBD O=c1c2ccccc2nc(SCc2cc([N+](=O)[O-])cc3c2OCOC3)n1Cc1ccccc1Cl 9456243 FXQSNTXXRWWJJW-UHFFFAOYSA-N 495.944 5.165 5 20 JKBD COc1cccc(-c2nc(COC(=O)Cn3c4ccccc4c(=O)c4ccccc43)cs2)c1OC 11278111 CAZALQBAFGRGPD-UHFFFAOYSA-N 486.549 5.039 5 20 JKBD O=C(COC(=O)CCc1ncc(-c2ccc(Cl)cc2Cl)o1)Nc1ccc(Cl)cc1[N+](=O)[O-] 12271832 VYLXCMKYXWCQTD-UHFFFAOYSA-N 498.706 5.325 5 20 JKBD Cc1csc(Sc2ccc(C(=O)Nc3ccc(NC(=O)C(C)C)cc3)cc2[N+](=O)[O-])n1 15560758 WXYDGHXSQULYSL-UHFFFAOYSA-N 456.549 5.358 5 20 JKBD CCN(CC)c1ccc(NC(=O)c2ccccc2NC(=O)c2ccc([N+](=O)[O-])cc2Cl)cc1 23193110 XVMGXWDDYUZJIK-UHFFFAOYSA-N 466.925 5.599 5 20 JKBD CCn1c(SCCC(=O)Nc2ccccc2[N+](=O)[O-])nnc1-c1ccc(C(C)(C)C)cc1 26371486 MMQRWZCTPMBKSI-UHFFFAOYSA-N 453.568 5.292 5 20 JKBD CN(Cc1cc([N+](=O)[O-])ccc1Cl)Cn1nc(-c2ccc(F)cc2)n(C[C@@H]2CCCO2)c1=S 27533250 SZBNYWCBDRDREU-IBGZPJMESA-N 491.976 5.050 5 20 JKBD COc1cc([C@@H](C)N[C@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2C(F)(F)F)ccc1OC(C)C 30492584 KQFNGIHAGLQYQQ-ZIAGYGMSSA-N 469.460 5.087 5 20 JKBD Cc1ccc(C(=O)N2C[C@@H](C)C[C@@H](C)C2)cc1NC(=O)[C@H](C)Sc1ccc([N+](=O)[O-])cc1 59775723 DUZQEWMMHNEZKK-JZXOWHBKSA-N 455.580 5.141 5 20 JKBD C[C@H](Nc1ccc(C(=O)N2CCC(c3nc4ccccc4s3)CC2)cc1[N+](=O)[O-])c1ccccn1 108753105 HRHJWDNZFSQGOB-KRWDZBQOSA-N 487.585 5.792 5 20 JKBD Cc1cc(C(=O)N2CCC[C@@H](C)C2)ccc1NC(=O)c1csc(-c2cccc([N+](=O)[O-])c2)n1 215734409 WGEUIMZWRMULMU-OAHLLOKOSA-N 464.547 5.151 5 20 JKBD Cc1ccc(C(=O)C2CCN(C(=O)c3ccc(N4C[C@@H](C)C[C@H](C)C4)c([N+](=O)[O-])c3)CC2)cc1 490742910 AHJTYENZSSOXQE-PMACEKPBSA-N 463.578 5.121 5 20 JKBD Cn1cc(C(=O)Nc2ncc(Cc3cccc(Br)c3)s2)c(-c2ccc([N+](=O)[O-])cc2)n1 505411386 ORLFKNWAWTWMGW-UHFFFAOYSA-N 498.362 5.057 5 20 JKBD C[C@@H](Nc1ccc(C(=O)N[C@@H]2CCSc3ccc(Cl)cc32)cc1[N+](=O)[O-])c1ccccn1 506069116 BBAGMVZIQBLQHV-AUUYWEPGSA-N 468.966 5.783 5 20 JKBD COc1ccc(CN[C@H]2CCSc3ccc(F)cc32)cc1OCc1ccc([N+](=O)[O-])cc1 507955133 ZAETWOCSKBXXTJ-NRFANRHFSA-N 454.523 5.648 5 20 JKBD Cc1ccc(N(C(=O)CCNC(=O)c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)c(C)c1 508567841 IYBPASXFWQOXAW-UHFFFAOYSA-N 474.542 5.306 5 20 JKBD CCc1ccc(-c2csc(NC(=O)c3cc(OCC(F)(F)F)ccc3[N+](=O)[O-])n2)cc1 512105542 LNVGPOBLAMUQJQ-UHFFFAOYSA-N 451.426 5.474 5 20 JKBD COc1ccc(CNCc2ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])cc2)c(OC)c1OC 513071816 VRMJXQHPMCRYCC-UHFFFAOYSA-N 458.898 5.356 5 20 JKBD COCCN(C(=O)CCc1cc(Br)cs1)c1nc(-c2ccc([N+](=O)[O-])cc2)cs1 518603898 QVTWKBFMUDADAV-UHFFFAOYSA-N 496.408 5.155 5 20 JKBD Cc1ccc(Sc2ccc(C(=O)Nc3cc(C4CC4)nn3-c3ncccn3)cc2[N+](=O)[O-])cc1 518702183 DBVCRPUUZWGYDT-UHFFFAOYSA-N 472.530 5.160 5 20 JKBD CC1CCN(c2ccc(CNCc3ccc(-c4ccc([N+](=O)[O-])cc4Br)o3)cn2)CC1 520205986 MZDKSJDAKFECMV-UHFFFAOYSA-N 485.382 5.538 5 20 JKBD O=C(NCc1ccncc1)Nc1cccc(NC(=O)c2cc([N+](=O)[O-])ccc2Oc2ccccc2)c1 520537778 KOLJHSCLNFZYPU-UHFFFAOYSA-N 483.484 5.356 5 20 JKBD CCN(CC)C(=O)c1ccc(CNCc2ccc(Oc3ccc(F)cc3)c([N+](=O)[O-])c2)cc1 520954403 XGDOWUGRCKECDN-UHFFFAOYSA-N 451.498 5.298 5 20 JKBD COc1ccc(CC[C@@H]2CCCCN2C(=O)c2cc(OCC(F)(F)F)ccc2[N+](=O)[O-])cc1OC 523565613 JMVKAOYFASGECX-KRWDZBQOSA-N 496.482 5.181 5 20 JKBD COc1ccc(CSCC(=O)Nc2c(-c3ccccc3)nc3c(C)cccn23)cc1[N+](=O)[O-] 603564896 MXLUMHJFCURGEZ-UHFFFAOYSA-N 462.531 5.098 5 20 JKBD NC(=O)c1cc(NC(=O)C/C(=C\c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)ccc1F 603571705 XWQFYQGBXHDALM-RVDMUPIBSA-N 476.489 5.012 5 20 JKBD O=C(Nc1cccc(COc2cccc(F)c2)c1)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-] 603875504 KVSPDCBPZSCSSL-UHFFFAOYSA-N 464.371 5.506 5 20 JKBD CC(C)Oc1ccccc1CN[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1 604048069 ZWDOUASNICZBEF-HSZRJFAPSA-N 453.926 5.505 5 20 JKBD COCCN(Cc1ccc(C)cc1C)C(=O)c1ccc(N[C@@H](C)c2ccccn2)c([N+](=O)[O-])c1 604301495 VVWJERHNXAETGF-FQEVSTJZSA-N 462.550 5.069 5 20 JKBD COc1ccc(Sc2ccc(NC(=O)c3cn(C)nc3-c3ccc([N+](=O)[O-])cc3)cc2)cc1 609103582 KZPNWMSOJVOJJE-UHFFFAOYSA-N 460.515 5.407 5 20 JKBD COc1cc(-c2noc(CNc3cc([N+](=O)[O-])ccc3Nc3ccccc3)n2)ccc1OC(F)F 619625359 IZBUYBOFPCSWNR-UHFFFAOYSA-N 483.431 5.611 5 20 JKBD Fc1ccc(-c2nnc(SCc3nc4ccccc4c4ccccc34)n2C[C@H]2CCCO2)cc1 620677403 QINPRIKAMYZJKL-HXUWFJFHSA-N 470.573 6.257 5 20 JKBD Cc1ccc(NC(=O)[C@@H](OC(=O)c2cc(F)c(Cl)nc2Cl)c2ccccc2)c([N+](=O)[O-])c1 727520421 FNCZTZHRRHYJIU-KRWDZBQOSA-N 478.263 5.281 5 20 JKBD C[C@@H](C(=O)O[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1)c1ccccc1F 731395871 XJZWMLCURDVOGM-SZNDQCEHSA-N 456.857 5.414 5 20 JKBD C[C@H](OC(=O)c1ccc(COc2ccc3ccccc3c2)o1)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 746134904 JDOKYRXUQITYRY-INIZCTEOSA-N 485.452 5.888 5 20 JKBD C[C@H](OC(=O)CCNc1ccc(C(F)(F)F)cc1[N+](=O)[O-])c1nnc(-c2cccc(Cl)c2)o1 750503700 NLMJMSPFCDASGD-NSHDSACASA-N 484.818 5.423 5 20 JKBD Cc1ccc(Sc2ncccc2C(=O)OCc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)c(C)c1 776926098 NECOTCQCZSIAAM-UHFFFAOYSA-N 462.487 5.165 5 20 JKBD Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)Oc1ccc(C(=O)Nc2c(C)cccc2C(C)C)cc1 854569308 UWEQUHNECZEXQR-UHFFFAOYSA-N 468.531 5.355 5 20 JKBD C[C@@H](Cc1ccco1)NC(=O)c1ccccc1Sc1ccc(C(F)(F)F)cc1[N+](=O)[O-] 914744220 GYESAUJLFHZEPL-ZDUSSCGKSA-N 450.438 5.719 5 20 JKBD O=C1/C(=C\c2ccc(-c3ccc([N+](=O)[O-])cc3Cl)o2)c2ccccc2C(=O)N1Cc1ccccn1 915852993 XKJGWCCPWQCQOS-HMAPJEAMSA-N 485.883 5.626 5 20 JKBD O=C(Nc1ccccc1SC[C@H]1CC1(Cl)Cl)N1CCN(c2ccccc2[N+](=O)[O-])CC1 916693709 DCSYQKXGCBPMTN-OAHLLOKOSA-N 481.405 5.235 5 20 JKBD Cc1nn(-c2ccccc2)c2nc(C(=O)Oc3ccc(NC(=O)c4cccc([N+](=O)[O-])c4)cc3)ccc12 918400124 ZEYOFDDATUTWRM-UHFFFAOYSA-N 493.479 5.109 5 20 JKBD O=C(Cn1ncc2ccc([N+](=O)[O-])cc21)N(c1ccc(Cl)c(Cl)c1)c1nc2ccccc2s1 918549439 SILXJSFRFTXZAR-UHFFFAOYSA-N 498.351 6.226 5 20 JKBD COc1ccc([C@H]2C[C@@H]2C(=O)NC2(c3ccc(NC(=O)Cc4cccc([N+](=O)[O-])c4)cc3)CCC2)cc1 1785791487 DQLJJQYNEQCHBO-FTJBHMTQSA-N 499.567 5.084 5 20 JKBD Cc1nc(C(=O)Nc2ccc(C3(NC(=O)c4cc5cc([N+](=O)[O-])ccc5s4)CCC3)cc2)cs1 1787527862 FERHVDSXMOGTKQ-UHFFFAOYSA-N 492.582 5.636 5 20 JKBD CCc1ncsc1C(=O)NC1(c2ccc(NC(=O)c3c(F)ccc([N+](=O)[O-])c3C)cc2)CCC1 1790772289 KOZWDVRNRZGOKA-UHFFFAOYSA-N 482.537 5.123 5 20 JKBD O=C(Cc1ccc([N+](=O)[O-])cc1F)Nc1ccc(C2(NC(=O)CSC3CCCC3)CCC2)cc1 1791182622 QINKZARMVGUQMN-UHFFFAOYSA-N 485.581 5.086 5 20 JKBD O=C(c1cc2cc([N+](=O)[O-])ccc2s1)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)C1(c3ccccc3)CCC1)C2 1801208792 OMJOVHFBRJHYNX-WKCHPHFGSA-N 489.597 5.183 5 20 JKBD CC1(C)CCC(CC(=O)N2CC[C@@H](CNC(=O)c3cc(F)cc([N+](=O)[O-])c3)[C@@H]2c2cccnc2)CC1 1811306919 XFOHIKNNDFNGAN-CPJSRVTESA-N 496.583 5.055 5 20 JKBD O=C(CCc1cccc([N+](=O)[O-])c1)Nc1cc([C@@H]2CCCCN2C(=O)c2cc(Cl)ccc2F)[nH]n1 1815536027 LFRINOLUBDMZDO-NRFANRHFSA-N 499.930 5.049 5 20 JKBD Cc1c(C(=O)N2CCCC[C@H]2c2cc(NC(=O)c3ccc(F)s3)n[nH]2)cc(Cl)cc1[N+](=O)[O-] 1816029412 NIXIOUQFMIPDHF-HNNXBMFYSA-N 491.932 5.100 5 20 JKBD Cc1c(C(=O)N2CCC([C@H]3CCCCN3C(=O)CCC3CCC3)CC2)cc(Cl)cc1[N+](=O)[O-] 1824352514 GGHGPWAUBKTDKO-JOCHJYFZSA-N 476.017 5.370 5 20 JKBD C/C(=C\c1ccc(C)o1)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)/C=C/c2ccccc2[N+](=O)[O-])CC1 1829011484 OWYIPKNXXWGJOB-PGTXPIOFSA-N 491.588 5.233 5 20 JKBD Cc1occc1C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cc(Cl)cc([N+](=O)[O-])c2C)CC1 1830734430 KCLWFGVNAJETCU-OAQYLSRUSA-N 473.957 5.005 5 20 JKBD O=C(c1cccc(F)c1[N+](=O)[O-])N1CCC([C@H]2CCCCN2C(=O)c2cccc3ccoc23)CC1 1830990803 KOYQFMVIVGIUKR-JOCHJYFZSA-N 479.508 5.027 5 20 JKBD COc1cc(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)CC3CCC(C)(C)CC3)CC2)ccc1[N+](=O)[O-] 1832695771 MAVMMPUACCZIPW-HSZRJFAPSA-N 499.652 5.443 5 20 JKBD O=C(CSc1ccc([N+](=O)[O-])cc1)OCC(=O)N1c2ccccc2Sc2ccccc21 9352719 MPLBEFCUTCVYNF-UHFFFAOYSA-N 452.513 5.060 5 20 JKBD CC(=O)N(c1nc(COC(=O)c2ccc([N+](=O)[O-])cc2Cl)cs1)c1c(C)cc(C)cc1C 11028709 RQWPDMJMHDORNN-UHFFFAOYSA-N 473.938 5.672 5 20 JKBD O=C(CSc1ccccc1Cl)Nc1c(Br)cc([N+](=O)[O-])cc1Br 11481361 MLSBDMPSLJKAAN-UHFFFAOYSA-N 480.565 5.504 5 20 JKBD O=C(C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1)N1CCC[C@H]1c1cccs1 15788061 KTFKRGMEBBKVEP-KRWDZBQOSA-N 453.486 5.255 5 20 JKBD COc1ccc(CN(C)[C@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2ccccc2)c(OC)c1 16591015 OKGSDWQOWZGCQD-QHCPKHFHSA-N 469.925 5.077 5 20 JKBD CCOc1ccc(Oc2ccc(NC(=O)c3cc(SC)c(OC)cc3[N+](=O)[O-])cc2)cc1 482270336 TWTBRLHYIJSVKK-UHFFFAOYSA-N 454.504 5.769 5 20 JKBD CCOc1c(OC)cc(CNC(=O)c2cc([N+](=O)[O-])ccc2Sc2ccccc2)cc1OC 493075565 CNNJBMGVAQNJMV-UHFFFAOYSA-N 468.531 5.092 5 20 JKBD COC1CCN(C2(CNC(=O)c3ccc(Oc4ccc(Cl)cc4[N+](=O)[O-])cc3)CCCC2)CC1 502529428 NFZGOHAHVMIHSL-UHFFFAOYSA-N 487.984 5.194 5 20 JKBD O=C(CSc1ccc(C(F)(F)F)cc1[N+](=O)[O-])NCc1ccc(Oc2ccccc2)nc1 503479761 SVRCQMRAGKSQBF-UHFFFAOYSA-N 463.437 5.209 5 20 JKBD COc1cc(C(=O)N[C@H](c2ccccc2)c2ccc3nc(C(F)(F)F)[nH]c3c2)ccc1[N+](=O)[O-] 508801124 HDQBRKOHHAWIGQ-HXUWFJFHSA-N 470.407 5.018 5 20 JKBD Cc1cc([N+](=O)[O-])ccc1C(=O)N[C@@H](c1ccccc1)c1ccc2nc(C(F)(F)F)[nH]c2c1 508804432 TWZZMYFKORUXQK-FQEVSTJZSA-N 454.408 5.318 5 20 JKBD Cc1noc([C@H](C)NC(=O)c2c3c(nc4ccccc24)/C(=C\c2ccc([N+](=O)[O-])cc2)CCC3)n1 509115921 UKXUADUMPNUEPV-LSVCFVEQSA-N 469.501 5.202 5 20 JKBD CC(C)[C@H](C)NC(=O)C1CCN(C(=O)c2cc([N+](=O)[O-])ccc2Sc2ccc(Cl)cc2)CC1 512297524 CLEBSMUBCQIQPQ-INIZCTEOSA-N 490.025 5.412 5 20 JKBD O=C(c1ccc(NCc2ccccc2)c([N+](=O)[O-])c1)N1CCC(Oc2ccc(F)cc2F)CC1 515593701 MUDCRJILDZBUEV-UHFFFAOYSA-N 467.472 5.169 5 20 JKBD CC(C)(C)c1ccc(Oc2ccc(CNCc3cccc(NS(C)(=O)=O)c3)cc2[N+](=O)[O-])cc1 518771879 MJAHOZZPAWAMDX-UHFFFAOYSA-N 483.590 5.346 5 20 JKBD C[C@H](Nc1ccc(C(=O)Nc2cccc(COC3CCCCC3)c2)cc1[N+](=O)[O-])c1ccccn1 520003905 CPPUSHYASHYGDX-IBGZPJMESA-N 474.561 6.265 5 20 JKBD O=C(CC1CCCC1)NC1CCN([C@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2ccccc2)CC1 520195175 WRUAIXNOXZBOAK-VWLOTQADSA-N 499.011 5.089 5 20 JKBD O=C(Nc1nc(-c2ccc(OCc3ccccc3)cc2)cs1)c1cc2c(cc1[N+](=O)[O-])OCO2 522922625 ANUVMGASIKPIRJ-UHFFFAOYSA-N 475.482 5.278 5 20 JKBD CC(C)Oc1ccccc1[C@@H](C)N[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1 603954774 HXFJVRFPSVDZPB-MZNJEOGPSA-N 467.953 6.066 5 20 JKBD COc1ccc(CN[C@@H](C(=O)Nc2cccc(C(F)(F)F)c2)c2ccccc2)cc1[N+](=O)[O-] 604047375 PSGAPTQPORAWGA-OAQYLSRUSA-N 459.424 5.092 5 20 JKBD O=C(c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1)N1C[C@@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1 604258181 UZJFGIRNWQWTHX-BETUJISGSA-N 496.791 6.243 5 20 JKBD COC(=O)C[C@H]1CCCCN1C(=O)C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1 604479142 QLWQFPKCDMGVOX-BKHFDQEPSA-N 479.558 5.079 5 20 JKBD COC[C@H](C)n1c(SCC(=O)OCc2nc3ccccc3c3ccccc23)nnc1-c1ccccc1 726023275 YPPWZWDSJAQYRC-IBGZPJMESA-N 498.608 5.689 5 20 JKBD C[C@@H](OC(=O)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1)c1cnc2ccccc2c1 726335366 JPZXPVGHMRLGHR-OAHLLOKOSA-N 473.451 5.683 5 20 JKBD Cc1[nH]c2ccccc2c1CCNC(=O)c1ccccc1NC(=O)c1ccc([N+](=O)[O-])cc1Cl 726951075 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O=C(CSc1nnc(-c2ccc(F)cc2)c2ccccc12)Nc1cc([N+](=O)[O-])ccc1Cl 779461150 WFNLRIFAYVPZGS-UHFFFAOYSA-N 468.897 5.728 5 20 JKBD COc1c([N+](=O)[O-])cc(N[C@H](C)c2nc3ccccc3n2C(F)F)c([N+](=O)[O-])c1Br 836459963 WNRZKWLOUVLPIE-MRVPVSSYSA-N 486.229 5.192 5 20 JKBD O=C(c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1)N1CCC([C@H](O)c2ccccc2)CC1 914538583 WVQYEBSKSOFJCY-XMMPIXPASA-N 466.921 5.626 5 20 JKBD O=C(Nc1ccc(OC[C@@H](O)c2ccc(OC(F)(F)F)cc2)cc1)c1cc([N+](=O)[O-])ccc1Cl 917002186 AYTKOQBNEFWKNZ-HXUWFJFHSA-N 496.825 5.512 5 20 JKBD COc1cc(CNc2c([N+](=O)[O-])cc(C(F)(F)F)cc2[N+](=O)[O-])ccc1OCC(F)(F)F 917080033 KGCPOSKWRZOOFH-UHFFFAOYSA-N 469.294 5.084 5 20 JKBD Cc1ccc(S(=O)(=O)Nc2ccc(NC(=S)Nc3ccc4c(c3)CCC4)cc2)cc1[N+](=O)[O-] 919714877 RLKXALNKEUJMQV-UHFFFAOYSA-N 482.587 5.002 5 20 JKBD COc1cc(C(=O)Nc2ccc(Nc3ccccc3)cc2)c([N+](=O)[O-])cc1OCc1cscn1 919881122 MIDWFGFTOAYJAP-UHFFFAOYSA-N 476.514 5.635 5 20 JKBD O=C(Nc1ccccc1C(=O)NC[C@@H]1CCCO[C@H]1c1ccccc1)c1ccc([N+](=O)[O-])cc1Cl 920297754 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487.560 5.217 5 20 JKBD Cc1ccc(C(=O)Nc2cc([C@H]3CCCCN3C(=O)c3cc(F)cc([N+](=O)[O-])c3)[nH]n2)c(Cl)c1 1823185859 DHZKXPDLCVTEDF-HXUWFJFHSA-N 485.903 5.039 5 20 JKBD O=C(c1cc(F)cc([N+](=O)[O-])c1)N1CCC([C@H]2CCCCN2C(=O)c2ccc3ccoc3c2)CC1 1830911519 CXPJKOFAFMYQEY-HSZRJFAPSA-N 479.508 5.027 5 20 JKBD C[C@@H](Sc1nnc(-c2ccc(Br)cc2)o1)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl 8758827 DCWZDYFJOUHIMF-SECBINFHSA-N 483.731 5.180 5 20 JKBD Cc1ccc(NC(=O)[C@H](Sc2nnc(Cc3csc(C)n3)o2)c2ccccc2)c([N+](=O)[O-])c1 11103976 GJSIPWDOAMBIJU-HXUWFJFHSA-N 481.559 5.114 5 20 JKBD Cc1ccc([N+](=O)[O-])cc1NC(=O)CSc1nnc(Cc2cccs2)n1CCc1ccccc1 12743872 JJMUHJBQXYLMNY-UHFFFAOYSA-N 493.614 5.121 5 20 JKBD COc1ccc(NC(=O)[C@H](C)Sc2nnc(-c3ccc(C(C)(C)C)cc3)o2)c([N+](=O)[O-])c1 18588787 TWWTULFCQOJEQB-ZDUSSCGKSA-N 456.524 5.070 5 20 JKBD CCN(CC)c1ccc(-c2nnc(S[C@H](C)C(=O)Nc3ccc([N+](=O)[O-])cc3Cl)o2)cc1 22003070 RBOGYIMKFWQZDT-CYBMUJFWSA-N 475.958 5.264 5 20 JKBD COc1ccc(CCC(=O)O[C@@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2ccccc2)cc1 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Cc1ccc(NC(=O)C2CCN(c3ccc(C(F)(F)F)cc3[N+](=O)[O-])CC2)c2cccnc12 515182529 UWASBODUOGYTQQ-UHFFFAOYSA-N 458.440 5.325 5 20 JKBD CCOC(=O)c1csc(NC(=O)c2ccc(Sc3nc4ccccc4s3)c([N+](=O)[O-])c2)n1 515317974 KPFHREVYFFCOND-UHFFFAOYSA-N 486.556 5.241 5 20 JKBD COCCN(C(=O)[C@H]1C[C@@H]1c1ccc2ccccc2c1)c1nc(-c2ccc([N+](=O)[O-])cc2)cs1 518701607 UTWQJDAXUIQESM-PKTZIBPZSA-N 473.554 5.655 5 20 JKBD COc1ccc(NC(=O)c2cc(SC)ccc2[N+](=O)[O-])cc1OCc1ccc2ccccc2n1 524386158 NVBGDNAMCZURFU-UHFFFAOYSA-N 475.526 5.705 5 20 JKBD Cc1cc(C)n(CCCNC(=O)C/C(=C/c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)n1 603468595 PNVGGXLIWGWJDV-HKWRFOASSA-N 475.574 5.155 5 20 JKBD CN(C)C(=O)c1cc(NC(=O)c2cc([N+](=O)[O-])ccc2Sc2ccccc2)ccc1Cl 603623741 GEQJMTUARXYSJW-UHFFFAOYSA-N 455.923 5.354 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Br)[C@@H](NCc1ccc(Cl)o1)c1ccccc1 603926151 MBHIOHPHZUTQDC-SFHVURJKSA-N 464.703 5.073 5 20 JKBD CC(C)(C)c1ccc(Oc2ccc(CNCc3ccc(CN4CCCC4=O)cc3)cc2[N+](=O)[O-])cc1 603934328 RKQWDMFFQPSUBM-UHFFFAOYSA-N 487.600 6.097 5 20 JKBD CNS(=O)(=O)Cc1ccc(CNCc2ccc(Oc3cc(C)ccc3C(C)C)c([N+](=O)[O-])c2)cc1 604417880 GUVSLRHUQYFCMY-UHFFFAOYSA-N 497.617 5.158 5 20 JKBD COc1ccc([C@@H](Cc2ccc(F)cc2)N[C@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)cc1 604459756 IZEUCPFMMWLAIE-WAIKUNEKSA-N 462.481 5.427 5 20 JKBD Cc1oc(-c2ccsc2)nc1CN(c1cccc([N+](=O)[O-])c1)S(=O)(=O)c1ccc(F)c(F)c1 608856161 XUBKBHKLRYPEAQ-UHFFFAOYSA-N 491.497 5.293 5 20 JKBD Cc1cc([N+](=O)[O-])ccc1C(=O)OCC(=O)N1c2ccccc2Sc2ccc(Cl)cc21 725987730 OASWYOHHAWCOJK-UHFFFAOYSA-N 454.891 5.543 5 20 JKBD C[C@H]1CN(c2ccc(CNC(=O)CCC(=O)c3ccc4ccc5cccc6ccc3c4c56)cn2)CCO1 727766524 BHYWFMXPUUGDGE-FQEVSTJZSA-N 491.591 5.483 5 20 JKBD O=C(Oc1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2Cl)cc1)c1csc(-c2ccoc2)n1 730957232 YTZOFRPZRYXVRA-UHFFFAOYSA-N 469.862 5.436 5 20 JKBD O=C(Cn1c(C(F)(F)F)nc2ccccc21)N(CC1CC1)c1ccc(Cl)c([N+](=O)[O-])c1 745354035 OIEIIKXVXHLMOV-UHFFFAOYSA-N 452.820 5.060 5 20 JKBD C[C@@H](c1cccc(C(F)(F)F)c1)N(Cn1nc(-c2cccc([N+](=O)[O-])c2)ccc1=O)C1CC1 747074253 NPBXJVSRAUIYPK-HNNXBMFYSA-N 458.440 5.020 5 20 JKBD O=C(COC(=O)c1c2c(nc3ccccc13)/C(=C\c1ccc(O)cc1)CC2)Nc1ccccc1[N+](=O)[O-] 755864693 XTCZVAZYTITQEG-SDXDJHTJSA-N 495.491 5.131 5 20 JKBD CCN(C(C)=O)c1nc(COC(=O)c2cc([N+](=O)[O-])ccc2NCc2ccccc2Cl)cs1 849186875 MMAFYUTVFNUIPT-UHFFFAOYSA-N 488.953 5.047 5 20 JKBD COc1ccccc1[C@H](NCc1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1)c1nccn1C 915226091 AWFGMMUQKYFZNJ-DEOSSOPVSA-N 478.936 5.662 5 20 JKBD O=C(NCc1nc(C2CC2)no1)c1c2c(nc3ccccc13)/C(=C/c1cccc([N+](=O)[O-])c1)CCC2 917765365 ILCMBKMTDSISSQ-QGOAFFKASA-N 481.512 5.210 5 20 JKBD C[C@@H](Nc1ccc(C(=O)O[C@@H](Cn2cncn2)c2ccc(Cl)cc2)cc1[N+](=O)[O-])c1ccccn1 920772880 CFDWVHGNLVIQGA-MWTRTKDXSA-N 492.923 5.006 5 20 JKBD CN(Cc1cc([N+](=O)[O-])ccc1Cl)C(=O)[C@H]1CCC(=O)N(Cc2ccccc2)[C@H]1c1ccccc1 920884981 MDZJZBMMKGKMLT-OZXSUGGESA-N 491.975 5.387 5 20 JKBD CC(F)(F)C(C)(C)C(=O)Nc1ccc(C2(NC(=O)Cc3cc(F)ccc3[N+](=O)[O-])CCC2)cc1 1786455971 HTVWGFCQGQZEPK-UHFFFAOYSA-N 477.483 5.092 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)c3ccc([N+](=O)[O-])o3)CCC2)cc1)c1c[nH]c(-c2ccc(F)cc2)c1 1787135148 SEGTVWZAZTZUTE-UHFFFAOYSA-N 488.475 5.384 5 20 JKBD O=C(Cc1cccc(F)c1)Nc1ccc(C2(NC(=O)CSc3ccccc3[N+](=O)[O-])CCC2)cc1 1787753664 RESYPIFLTWWZEE-UHFFFAOYSA-N 493.560 5.203 5 20 JKBD Cc1ccc(CC(=O)Nc2ccc(C3(NC(=O)c4ccc5c(c4)C(=O)CC5)CCC3)cc2)cc1[N+](=O)[O-] 1790525134 CHPBUOMHCNSIHP-UHFFFAOYSA-N 497.551 5.023 5 20 JKBD COc1c(C(=O)Nc2ccc(C3(NC(=O)c4cc(F)cc([N+](=O)[O-])c4)CCC3)cc2)ccc(F)c1F 1790727935 GICJAHIHCSHMDH-UHFFFAOYSA-N 499.445 5.082 5 20 JKBD Cc1c(C(=O)NC2(c3ccc(NC(=O)[C@@H]4[C@H]5C=CS[C@H]54)cc3)CCC2)cc(Cl)cc1[N+](=O)[O-] 1791090117 AUUDHZQMZQDOKU-DUXKGJEZSA-N 483.977 5.179 5 20 JKBD C[C@@]1(C(=O)Nc2ccc(C3(NC(=O)c4cc5cc([N+](=O)[O-])ccc5s4)CCC3)cc2)CC1(F)F 1792248533 PROQXLCNWOKQEI-QFIPXVFZSA-N 485.512 5.603 5 20 JKBD O=C(CCN1CCCC1)Nc1ccc(C2(NC(=O)c3cc4cc([N+](=O)[O-])ccc4s3)CCC2)cc1 1792368909 YTLXFGMCYOLRDA-UHFFFAOYSA-N 492.601 5.043 5 20 JKBD CC(C)(C)c1ccc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)Cc2ccc(Cl)cc2[N+](=O)[O-])s1 1793079292 PMVOCABZTACDRW-BCDXTJNWSA-N 490.025 5.102 5 20 JKBD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(F)cc([N+](=O)[O-])c1)c1ccc(Oc2ccccc2)cc1 1800524030 RTEXRYVITBXOGS-KOUNCHBCSA-N 489.503 5.092 5 20 JKBD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc(F)c1[N+](=O)[O-])c1ccccc1Oc1ccccc1 1800532528 QEYGVTIBBVPCTM-REPLKXPHSA-N 489.503 5.092 5 20 JKBD Cc1c(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cc4sccc4s2)C3)cc(Cl)cc1[N+](=O)[O-] 1800711374 LVOBMQGHEOWRPV-QDMKHBRRSA-N 490.006 5.398 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)N1CCCC[C@H]1C1CCN(C(=O)[C@H]2CCCCC2(F)F)CC1 1830728353 KMVSRIGROVSCRT-NQIIRXRSSA-N 495.542 5.101 5 20 JKBD CC(C)CCC(=O)N1CCCC[C@H]1C1CCN(C(=O)c2ccc(Br)c([N+](=O)[O-])c2)CC1 1831382541 OQISGUNJELHGFN-FQEVSTJZSA-N 494.430 5.027 5 20 JKBD O=C(c1cc2cc([N+](=O)[O-])ccc2s1)N1CC2(CCCN2C(=O)/C=C/c2cc3ccccc3o2)C1 1843836128 JJXMWNPYJGDBKP-VQHVLOKHSA-N 487.537 5.086 5 20 JKBD Cc1ccc(NC(=O)[C@H](Sc2nc(-c3ccccc3F)n[nH]2)c2ccccc2)c([N+](=O)[O-])c1 9801174 JOUBYHLIFZLPTH-HXUWFJFHSA-N 463.494 5.300 5 20 JKBD Cc1ccccc1-c1nnc(S[C@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2C(F)(F)F)o1 10015732 JZXHAKAZLVCCSP-LLVKDONJSA-N 452.414 5.091 5 20 JKBD COc1cc(C(=O)Nc2nc(-c3ccc4c(c3)CCCC4)cs2)c([N+](=O)[O-])cc1OC(F)F 10959984 ZNFJOAQMFSMQBM-UHFFFAOYSA-N 475.473 5.459 5 20 JKBD CCOc1cc(C(=O)NCc2ccccc2-c2ccc(CN3CCCC3)cc2)c([N+](=O)[O-])cc1OC 26404211 NAXCKYJIRPQQLN-UHFFFAOYSA-N 489.572 5.195 5 20 JKBD O=C(Nc1ccc(N[C@@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2ccccc2)cc1)[C@@H]1CCCO1 27000697 YGZGJRCQDLPBFZ-XZOQPEGZSA-N 494.935 5.158 5 20 JKBD NC(=O)c1cc(NC(=O)C/C(=C/c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)ccc1F 33065375 XWQFYQGBXHDALM-PTNGSMBKSA-N 476.489 5.012 5 20 JKBD CC(=O)c1ccc(Sc2nnc(-c3ccc(Cl)cc3Cl)n2C(C)C)c([N+](=O)[O-])c1 37132453 UYQIARDYYHVCSG-UHFFFAOYSA-N 451.335 6.095 5 20 JKBD Cc1ccc(-c2nc(C)c([C@@H](C)NC(=O)[C@@H]3CCCN3C(=O)c3ccc([N+](=O)[O-])c(C)c3)s2)cc1 78661104 SCAIPHARFMOHGG-VGSWGCGISA-N 492.601 5.126 5 20 JKBD O=C(Nc1ccc(NC(=O)c2ccccc2F)cc1C(F)(F)F)c1ccc(Cl)c([N+](=O)[O-])c1 107813569 QKGSWHAYSLULAD-UHFFFAOYSA-N 481.789 5.911 5 20 JKBD COc1cc(C(=O)Nc2nc(-c3cccc(F)c3)cs2)c([N+](=O)[O-])cc1OCc1cscn1 108939796 PQBZBKCMMXTLQC-UHFFFAOYSA-N 486.506 5.154 5 20 JKBD CC[C@@H](c1ccc(F)cc1)N(Cc1cccc(F)c1)C(=O)c1cc([N+](=O)[O-])cc(S(C)(=O)=O)c1 109032899 GISGYZAGHVLRLE-QHCPKHFHSA-N 488.512 5.070 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)Nc2ccc(Cl)cc2C(=O)N2[C@@H](C)CCC[C@H]2C)cc1SC 482823399 ZMOQOHCZSWLMQE-OKILXGFUSA-N 491.997 5.634 5 20 JKBD O=C(CSc1ccc([N+](=O)[O-])cc1)Nc1cccc(NC(=O)c2cccc(C(F)(F)F)c2)c1 504798980 ZWWHURIDJKTJMB-UHFFFAOYSA-N 475.448 5.597 5 20 JKBD CC(C)N(CC(=O)Nc1ccccc1C(F)(F)F)C(=O)c1ccc(C(C)(C)C)c([N+](=O)[O-])c1 505264986 GWVSLIJSFZQSOT-UHFFFAOYSA-N 465.472 5.400 5 20 JKBD O=[N+]([O-])c1cccc(OC[C@@H](O)CSc2nnc(SCc3cccc4ccccc34)s2)c1 508373040 WZLGYLDNVAWCNM-GOSISDBHSA-N 485.612 5.424 5 20 JKBD O=C(c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1)N(CC(F)(F)F)c1ccccn1 508590754 WSQGCEJQGTXCCF-UHFFFAOYSA-N 451.788 5.645 5 20 JKBD CCCNC(=O)c1cccc(CNCc2ccc(Oc3ccccc3Cl)c([N+](=O)[O-])c2)c1 509564300 QHKYHPNGBIRZDF-UHFFFAOYSA-N 453.926 5.470 5 20 JKBD C[C@@H](Nc1ccc(C(=O)Nc2ccc(-n3nccc3C(F)(F)F)cc2)cc1[N+](=O)[O-])c1ccccn1 509753584 ZITCJBYUIMEEOR-OAHLLOKOSA-N 496.449 5.620 5 20 JKBD Cc1cc(Sc2ccccc2)ccc1NC(=O)N1CCN(C(=O)c2ccc([N+](=O)[O-])s2)CC1 510886183 ARKMYBSYNJBLBJ-UHFFFAOYSA-N 482.587 5.106 5 20 JKBD Cc1cc(NC(=O)c2ccc(N[C@@H](C)c3ccccn3)c([N+](=O)[O-])c2)ccc1Oc1cccnc1 512133689 WEKVXMGDXVJEDO-SFHVURJKSA-N 469.501 5.911 5 20 JKBD COC(=O)c1ccccc1C(=O)c1ccc(NC[C@H]2CCCO[C@H]2c2ccccc2)c([N+](=O)[O-])c1 513201108 YBNZRCHHHBFCHP-IBVKSMDESA-N 474.513 5.192 5 20 JKBD O=C(Cn1c2ccccc2c(=O)c2ccccc21)N(Cc1ccccc1F)c1ccccc1F 519231682 JJPJUBORIGQFSW-UHFFFAOYSA-N 454.476 5.666 5 20 JKBD C[C@H](NCc1ccc(-c2ccc([N+](=O)[O-])cc2)o1)c1cccc(NC(=O)Cc2ccccc2F)c1 520951199 VTUAZICWKKPZGF-SFHVURJKSA-N 473.504 6.026 5 20 JKBD COc1cc(CN[C@@H]2CCSc3c(F)cccc32)ccc1OCc1ccc([N+](=O)[O-])cc1 521818900 CGOKQZSGHZDHJR-OAQYLSRUSA-N 454.523 5.648 5 20 JKBD CSc1cccc(N(C)C(=O)c2ccccc2NS(=O)(=O)c2cc(C)cc([N+](=O)[O-])c2C)c1 523167459 FULAYXVNJRUZIT-UHFFFAOYSA-N 485.587 5.011 5 20 JKBD CC(C)CCSc1ccc(C(=O)N2CCC(C(=O)Nc3ccc(F)cc3)CC2)cc1[N+](=O)[O-] 523564601 LDTTTZOLZBEXRK-UHFFFAOYSA-N 473.570 5.363 5 20 JKBD O=C(NC[C@H]1CCCN(C(=O)c2cc3ccccc3c3cccnc23)C1)Nc1cccc(F)c1 524482708 KPOZOLXBDOHHMM-GOSISDBHSA-N 456.521 5.201 5 20 JKBD Cc1ccc(NC(=O)[C@@H](Sc2nccn2Cc2ccccc2)c2ccccc2)c([N+](=O)[O-])c1 588998346 ABBNEGSAPWJHGO-QHCPKHFHSA-N 458.543 5.620 5 20 JKBD CCOc1c(Br)cc(Cl)cc1NCc1nc(-c2cccc([N+](=O)[O-])c2)no1 604006862 NYEXOGYWKQVJHQ-UHFFFAOYSA-N 453.680 5.072 5 20 JKBD COc1cccc(CN(CC(C)C)C(=O)c2ccc(N[C@H](C)c3ccccn3)c([N+](=O)[O-])c2)c1 604490825 GEMPBCUEDLQRPL-LJQANCHMSA-N 462.550 5.470 5 20 JKBD Cc1nn(-c2ccccc2)cc1C(=O)O[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1 726678761 FRKHEWJTBNRYBL-HSZRJFAPSA-N 490.903 5.279 5 20 JKBD COc1ccc(NC(=S)/C(=C(/O)c2ccc([N+](=O)[O-])cc2)[n+]2ccc(Cc3ccccc3)cc2)cn1 726963722 YHDDZGSVBMGCHP-UHFFFAOYSA-O 499.572 5.200 5 20 JKBD O=C1Nc2cc(Cl)ccc2[C@@H]1C1CCN(c2c([N+](=O)[O-])cc(C(F)(F)F)cc2[N+](=O)[O-])CC1 727432297 DDVAIZSIGARZPO-KRWDZBQOSA-N 484.818 5.128 5 20 JKBD C[C@@H](NC(=O)CCC(=O)c1ccc2ccc3cccc4ccc1c2c34)c1cccc(S(N)(=O)=O)c1 727764920 UWHBJDHBXRODPM-QGZVFWFLSA-N 484.577 5.072 5 20 JKBD Cc1ccc(-c2ccc(CN(Cn3nc(-c4cccc([N+](=O)[O-])c4)ccc3=O)C(C)C)s2)cc1 747073553 FAFQLQIKRQEZFZ-UHFFFAOYSA-N 474.586 5.724 5 20 JKBD Cc1ccc(/C(O)=C(/C(=S)Nc2cc(Cl)cc(Cl)c2)[n+]2ccccc2)cc1[N+](=O)[O-] 747880221 WSPXBNUQQHVZIV-UHFFFAOYSA-O 461.350 5.821 5 20 JKBD Cc1ccc(NC(=O)Cc2nc(COC(=O)c3csc(-c4ccc([N+](=O)[O-])cc4)n3)cs2)cc1 747956600 ICBSMXFODYEZMZ-UHFFFAOYSA-N 494.554 5.021 5 20 JKBD O=C(Nc1ccc(CC(=O)N2CCCc3ccccc32)cc1)c1cc([N+](=O)[O-])ccc1Br 751126104 GWRUWUWVFFNILY-UHFFFAOYSA-N 494.345 5.132 5 20 JKBD C[C@@H](OC(=O)c1occc1CSc1ccccc1)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 792738870 YNQOCWZGDPTVID-CQSZACIVSA-N 451.460 5.448 5 20 JKBD O=C(Nc1nc(-c2ccc(Cl)cc2Cl)cs1)c1cc([N+](=O)[O-])ccc1N1CCOCC1 878430937 ABGJMNTYIARHOG-UHFFFAOYSA-N 479.345 5.114 5 20 JKBD COc1ccc([N+](=O)[O-])cc1NC(=O)c1ccccc1SCC(=O)NC1CCCCCCC1 912763707 TVVORQRDUCAWTI-UHFFFAOYSA-N 471.579 5.177 5 20 JKBD CC(C)[C@@H](OC(=O)c1ccc(NC2CC2)c([N+](=O)[O-])c1)C(=O)Nc1ccccc1C(F)(F)F 915366838 IMGLGWDHASLHHT-LJQANCHMSA-N 465.428 5.008 5 20 JKBD Cc1cc(C)c(/C=C/C(=O)O[C@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2C(F)(F)F)cc1C 915494201 ZVQZAYNGQZYNCM-SBJJXXPASA-N 450.413 5.122 5 20 JKBD Cc1ccc(N2CCCN(C(=O)c3ccccc3NC(=O)c3ccc([N+](=O)[O-])cc3Cl)CC2)cc1 918664162 NQKKBWWEQPZUOH-UHFFFAOYSA-N 492.963 5.161 5 20 JKBD C[C@H](Sc1ccc(Br)cc1)C(=O)O[C@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl 919468530 WMZJQPIBSFCILL-MNOVXSKESA-N 487.759 5.062 5 20 JKBD O=C(OCc1nc2ccccc2c2ccccc12)C1CCN(C(=O)c2ccc(Cl)s2)CC1 919633327 AQCZRXMCHSOOCX-UHFFFAOYSA-N 464.974 5.699 5 20 JKBD CCO/C=C/C(=O)NC1(c2ccc(NC(=O)CCCc3cc(C)c(F)cc3[N+](=O)[O-])cc2)CCC1 1786274931 RBTKWWHWDFZQQO-NTCAYCPXSA-N 483.540 5.049 5 20 JKBD O=C(CCc1cccc([N+](=O)[O-])c1)Nc1ccc(C2(NC(=O)c3cc4ccoc4cn3)CCC2)cc1 1786602741 PNYSVWWFWDOLDG-UHFFFAOYSA-N 484.512 5.117 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)NC1(c2ccc(NC(=O)c3cc(C)n(C)c3C)cc2)CCC1 1789975917 KOSGJLQTYPMXRY-UHFFFAOYSA-N 478.524 5.059 5 20 JKBD O=C(CSc1ccccc1[N+](=O)[O-])Nc1cc([C@H]2CCCCN2C(=O)c2cccc(Cl)c2)[nH]n1 1822312749 FSDHNCWCLMOZEF-GOSISDBHSA-N 499.980 5.070 5 20 JKBD CC(C)(C)c1ccc(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3ccc(O)c([N+](=O)[O-])c3)CC2)s1 1827903834 JHPGKTUBVBZTFS-LJQANCHMSA-N 499.633 5.207 5 20 JKBD Cc1ccc(C(=O)N2CCC([C@@H]3CCCCN3C(=O)CSc3ccccc3[N+](=O)[O-])CC2)cc1C 1831777937 YOWOKZIULQBCAC-QHCPKHFHSA-N 495.645 5.237 5 20 JKBD O=C(c1cc2cc([N+](=O)[O-])ccc2s1)N1CC2(CCCN2C(=O)[C@@H]2CCC[C@H]3CCCC[C@H]32)C1 1843941393 WSSZTDHEWUKJFJ-DUXKGJEZSA-N 481.618 5.233 5 20 JKBD C[C@H](Sc1nnc(-c2ccccc2F)n1C1CC1)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 9637896 TUAUCGDIHOWIFG-NSHDSACASA-N 495.458 5.465 5 20 JKBD C[C@@H](OC(=O)c1ccc(Cl)cc1Cl)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 10729777 MXYGTLVQKPUUBJ-MRVPVSSYSA-N 451.184 5.104 5 20 JKBD CC(=O)N(c1nc(COC(=O)c2ccc(Cl)cc2[N+](=O)[O-])cs1)c1cccc(C)c1C 10748646 TUGOZQAMFITOFR-UHFFFAOYSA-N 459.911 5.363 5 20 JKBD CCCCn1c(S[C@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)nc2sc(C)c(C)c2c1=O 17653520 WWPLAIYWQHDSTQ-CQSZACIVSA-N 485.591 5.686 5 20 JKBD COc1cc(/C=C(\Cl)c2nc3ccc(Cl)cc3c(=O)[nH]2)ccc1OCc1ccc([N+](=O)[O-])cc1 18913883 FSQGHMNBBOAAJD-GRSHGNNSSA-N 498.322 5.809 5 20 JKBD Cc1cccc([N+](=O)[O-])c1NC(=O)COC(=O)c1cc(-c2ccc(F)cc2)nc2ccccc12 20888263 JZRUVLZMSDDCSJ-UHFFFAOYSA-N 459.433 5.053 5 20 JKBD C[C@H](Sc1nnc(/C=C/c2ccccc2)[nH]1)C(=O)Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1 253491832 NXLAKSOWCPXVGM-VNDWYCCKSA-N 478.559 5.126 5 20 JKBD O=C(C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)NCCCOC1CCCC1 489599991 SKWISCMUCXBTNO-KNTRCKAVSA-N 465.575 5.601 5 20 JKBD COc1cc(C(=O)NCC2(c3ccc(Cl)cc3)CCCC2)c([N+](=O)[O-])cc1OC(F)F 500935333 RPPVZWNNIQXDGK-UHFFFAOYSA-N 454.857 5.100 5 20 JKBD CCN(C(=O)c1ccc(-n2ccnc2)c([N+](=O)[O-])c1)[C@@H]1CCSc2ccc(Br)cc21 504552554 KPDLMJRDCBOISF-QGZVFWFLSA-N 487.379 5.242 5 20 JKBD CC(=O)Nc1ccc(NC(=O)c2ccc(N[C@@H](C)c3ccccn3)c([N+](=O)[O-])c2)cc1Cl 506074307 ZRSNKJVFQQGASU-ZDUSSCGKSA-N 453.886 5.027 5 20 JKBD C[C@H](Nc1ccc(C(=O)Nc2ccc(-c3nnc4n3CCCCC4)cc2)cc1[N+](=O)[O-])c1ccccn1 506116475 YKZCJPQDRLPBFJ-SFHVURJKSA-N 497.559 5.400 5 20 JKBD COc1cc([C@H](C)NC(=O)c2ccc(N[C@H](C)c3ccccn3)c([N+](=O)[O-])c2)ccc1OC(C)C 506249149 RJOYMHOVZMDDND-ZWKOTPCHSA-N 478.549 5.450 5 20 JKBD Cc1ccc(NC(=O)[C@H](Sc2nnc(C[C@H](C)c3ccccc3)o2)c2ccccc2)c([N+](=O)[O-])c1 515309930 ZPBMXKAMDFTTID-MHECFPHRSA-N 488.569 6.105 5 20 JKBD C[C@H](Cc1ccsc1)NC(=O)C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1 516538416 PHSSWCYUZZPLQX-YZYPPFLQSA-N 463.584 5.944 5 20 JKBD CN(C)C(=O)c1cccc(CNCc2ccc(Oc3ccc(C(C)(C)C)cc3)c([N+](=O)[O-])c2)c1 518766181 HYCNPYISWOBQJL-UHFFFAOYSA-N 461.562 5.676 5 20 JKBD CO[C@H](C)C(=O)Nc1cccc(NC(=O)c2ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])cc2)c1 520450652 WWQQWCMPSNRJEV-CQSZACIVSA-N 469.881 5.266 5 20 JKBD O=C(CCc1ncc(-c2ccc(F)cc2F)o1)Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1 590612903 CDCCGIXVLSLDIJ-UHFFFAOYSA-N 456.430 5.223 5 20 JKBD CCN(Cc1ccncc1)C(=O)c1ccccc1Sc1ccc(C(F)(F)F)cc1[N+](=O)[O-] 591593724 UCCHXSUNLBGGMD-UHFFFAOYSA-N 461.465 5.822 5 20 JKBD CC(C)C(=O)Nc1ccc(CNCc2ccc(-c3ccc([N+](=O)[O-])cc3Br)o2)cc1 608835898 WNBZPCHMVXDYMF-UHFFFAOYSA-N 472.339 5.502 5 20 JKBD O=C(Nc1cccc(SC(F)F)c1)N1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 727598053 RTVBOPMGMXEPDF-UHFFFAOYSA-N 476.427 5.282 5 20 JKBD C[C@H](OC(=O)CCc1cccc(OC2CCCC2)c1)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 727891391 UWTZIMKDPPFJIF-INIZCTEOSA-N 451.479 5.203 5 20 JKBD O=C(c1cnn(-c2ccc(Br)cc2)c1)N(CC1CC1)c1ccc(Cl)c([N+](=O)[O-])c1 728165378 IGYQSEVNNGXCKB-UHFFFAOYSA-N 475.730 5.253 5 20 JKBD O=C(Cc1csc(-c2cccnc2)n1)Oc1ccc2c(-c3ccc([N+](=O)[O-])cc3)cc(=O)oc2c1 743918954 MFDCWQIFYIPPRP-UHFFFAOYSA-N 485.477 5.035 5 20 JKBD C[C@@H](OC(=O)COc1ccc2ccccc2c1Br)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 746065695 HYAOCMOTOBNNDG-CYBMUJFWSA-N 498.289 5.244 5 20 JKBD Cc1nc(C(C)(C)C)sc1C(=O)Oc1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2Cl)cc1 747112153 ZMSZFWSVYRZGCX-UHFFFAOYSA-N 473.938 5.782 5 20 JKBD CCOc1cc([N+](=O)[O-])c(C(=O)O[C@H](C)c2ccc(NC(=O)c3ccccc3)cc2)cc1OC 748014445 NYGWZPAEFMOBHR-MRXNPFEDSA-N 464.474 5.172 5 20 JKBD C[C@H]1CCCCN1C(=O)c1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2Br)cc1Cl 751094504 WBRQEKRVIPBDPW-LBPRGKRZSA-N 480.746 5.278 5 20 JKBD Cc1c(-c2ccccc2)oc2c(C(=O)OCc3nnc(-c4ccc([N+](=O)[O-])cc4)o3)cccc2c1=O 778720448 CBZQIGRGJXNAAF-UHFFFAOYSA-N 483.436 5.084 5 20 JKBD C[C@@H](Sc1nnc(-c2ccc(F)cc2)c2ccccc12)C(=O)Nc1ccc(F)c([N+](=O)[O-])c1 779458912 LRDZPRZSDVTBMK-CYBMUJFWSA-N 466.469 5.603 5 20 JKBD COc1ccc(-c2[nH]c3ccccc3c2CCC(=O)Nc2cc([N+](=O)[O-])c(F)cc2F)cc1 825488287 WACVONZHZDFSFA-UHFFFAOYSA-N 451.429 5.601 5 20 JKBD COc1ccc(-c2nc(Cc3noc(-c4ccc(N5CCC(C)CC5)c([N+](=O)[O-])c4)n3)co2)cc1 904331395 FWPOVMHNUZRGCQ-UHFFFAOYSA-N 475.505 5.136 5 20 JKBD Cc1ccc(-c2nnc(CN(c3ccccc3)S(=O)(=O)c3ccc(Cl)c([N+](=O)[O-])c3)o2)cc1 914684027 YDUQAPSAOBDBLK-UHFFFAOYSA-N 484.921 5.002 5 20 JKBD COc1ccccc1Nc1nc2sc(C(=O)OCC(=O)Nc3c(C)cccc3[N+](=O)[O-])cc2s1 915524776 SKCVLXCDKWVHBE-UHFFFAOYSA-N 498.542 5.122 5 20 JKBD Cc1cc(Br)cc(C)c1NC(=O)N[C@H](CC(=O)OC(C)C)c1ccccc1[N+](=O)[O-] 915707754 GGRWHOBLJVTADX-QGZVFWFLSA-N 478.343 5.179 5 20 JKBD O=C(Nc1ccc(OC(=O)c2c(Cl)nc3ccccn23)cc1)c1cc([N+](=O)[O-])ccc1Cl 916952130 QHJMDOBTXMLESV-UHFFFAOYSA-N 471.256 5.021 5 20 JKBD CCCc1cc[n+](/C(C(=S)N[C@@H](C)c2ccccc2)=C(/O)c2ccc(C)c([N+](=O)[O-])c2)cc1 917611879 HAAMLVIXCVIBDP-IBGZPJMESA-O 462.595 5.705 5 20 JKBD Cc1c(COC(=O)[C@H]2CCC(=O)N(Cc3ccccc3)[C@@H]2c2ccccc2)cccc1[N+](=O)[O-] 919531770 DZDAPPJLTSCWMR-JYFHCDHNSA-N 458.514 5.127 5 20 JKBD O=C(/C=C/c1ccc([N+](=O)[O-])o1)Nc1ccc(C2(NC(=O)CCCC(F)(F)F)CCC2)cc1 1786205952 YALHJJVRFWOAOR-CSKARUKUSA-N 465.428 5.068 5 20 JKBD CC(C)(C)Oc1ccc(C(=O)Nc2ccc(C3(NC(=O)c4ccc([N+](=O)[O-])o4)CCC3)cc2)cc1 1790684088 CCVLTRIVFKTOLS-UHFFFAOYSA-N 477.517 5.427 5 20 JKBD O=C(NC1(c2ccc(NC(=O)c3cc4cc([N+](=O)[O-])ccc4s3)cc2)CCC1)c1ccc(F)cn1 1791011249 TYIRUSPBXIHPQI-UHFFFAOYSA-N 490.516 5.405 5 20 JKBD O=C(NC1(c2ccc(NC(=O)c3cc4cc([N+](=O)[O-])ccc4s3)cc2)CCC1)c1cscn1 1791011366 ZHJXNJVPJQTLOG-UHFFFAOYSA-N 478.555 5.328 5 20 JKBD COc1ccc(C(=O)Nc2ccc(C3(NC(=O)c4cc(C)c([N+](=O)[O-])cn4)CCC3)cc2)cc1Cl 1792140756 JWSHIZYLKIVKMS-UHFFFAOYSA-N 494.935 5.022 5 20 JKBD CC1(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)c3cc4cc([N+](=O)[O-])ccc4s3)[nH]n2)CCC1 1814404142 IDKTVRUAPJFCOI-KRWDZBQOSA-N 467.551 5.029 5 20 JKBD O=C(Nc1cc([C@H]2CCCCN2C(=O)c2ccc(Cl)o2)[nH]n1)c1cc2cc([N+](=O)[O-])ccc2s1 1821609262 AUYIAGQWVRXHLZ-OAHLLOKOSA-N 499.936 5.399 5 20 JKBD O=C(/C=C/c1ccc([N+](=O)[O-])o1)N1CCC([C@H]2CCCCN2C(=O)CCc2ccccc2Cl)CC1 1826571822 NWPPZDWSLUMYBE-JYLQPTBZSA-N 499.995 5.107 5 20 JKBD Cc1c(C(=O)N2CCCC[C@H]2C2CCN(C(=O)c3cccs3)CC2)cc(Cl)cc1[N+](=O)[O-] 1830735107 YZJLXVIZOHVRIL-IBGZPJMESA-N 475.998 5.165 5 20 JKBD Cc1cc(Cl)cc(C(=O)N2CCCC[C@H]2C2CCN(C(=O)/C=C/c3ccc([N+](=O)[O-])o3)CC2)c1 1832608424 SZWWEFBPFSMZIJ-HVPBSWBLSA-N 485.968 5.096 5 20 JKBD O=C([C@@H]1C[C@H]1c1ccccc1)N1CCC([C@H]2CCCCN2C(=O)/C=C/c2ccccc2[N+](=O)[O-])CC1 1832904235 PUUVUANDPFPEBB-PDLWVZGPSA-N 487.600 5.031 5 20 JKBD CCCCn1c(SCC(=O)Nc2cc([N+](=O)[O-])ccc2Cl)nc2sc(C)c(C)c2c1=O 8646417 SSIGZTRPKICDHJ-UHFFFAOYSA-N 480.999 5.167 5 20 JKBD Cc1cccc(OCc2nnc(S[C@H](C)C(=O)Nc3ccc([N+](=O)[O-])cc3C(F)(F)F)o2)c1 12674333 GSTHKRPCLVTTEL-GFCCVEGCSA-N 482.440 5.003 5 20 JKBD C[C@H](N[C@H]1CCSc2ccc(Cl)cc21)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 25216120 STNMSVVMBAYKHZ-BONVTDFDSA-N 459.877 5.421 5 20 JKBD O=C(Nc1ccccc1C(=O)N1CCC(Cc2ccccc2)CC1)c1ccc([N+](=O)[O-])cc1Cl 29514688 OIWPFPPCRZWOPT-UHFFFAOYSA-N 477.948 5.595 5 20 JKBD O=C(Nc1cc(Cl)ccc1NS(=O)(=O)c1ccccc1F)c1ccc([N+](=O)[O-])cc1Cl 31651537 CVSRXFFLTRYIHU-UHFFFAOYSA-N 484.292 5.094 5 20 JKBD Cc1ccc(Sc2ccc(C(=O)N3CCC(NC(=O)c4ccccc4C)CC3)cc2[N+](=O)[O-])cc1 32305118 XCXQNRNJYYIYON-UHFFFAOYSA-N 489.597 5.397 5 20 JKBD Cc1ccccc1C(=O)NC1CCN(C(=O)c2ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])cc2)CC1 32305242 BAOMGQKGUBMFSY-UHFFFAOYSA-N 493.947 5.384 5 20 JKBD CC(C)Oc1ccc(CNC(=O)c2ccccc2NC(=O)c2ccc([N+](=O)[O-])cc2Cl)cc1 105887770 WEERRHFURIGPRP-UHFFFAOYSA-N 467.909 5.218 5 20 JKBD Cc1nc(COc2cccc(C(=O)Nc3nc(-c4ccc(C)c([N+](=O)[O-])c4)cs3)c2)cs1 302920562 IZACYDGABJLIKO-UHFFFAOYSA-N 466.544 5.623 5 20 JKBD O=[N+]([O-])c1ccc(-c2nnc(CSc3nnc(-c4ccccc4Cl)n3C3CCCC3)o2)cc1 409939219 UIGKDMUFDOFTCE-UHFFFAOYSA-N 482.953 5.964 5 20 JKBD Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)c1ccc(NC(=O)c2ccc(Br)cc2)cc1 410151000 DZTLFWGATCPQBL-UHFFFAOYSA-N 468.307 5.479 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)Nc2ccc(OC(F)F)c(Cc3ccccc3)c2)cc1SC 481933080 SSTQYRCIYIIDRM-UHFFFAOYSA-N 474.485 5.770 5 20 JKBD CN(C(=O)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1)[C@@H](c1ccccc1)C(F)(F)F 485389475 YFQUKZONAGGABS-IBGZPJMESA-N 489.416 5.592 5 20 JKBD O=C(Nc1ccccc1C(=O)N1CCC[C@@H](CN2CCCCCC2)C1)c1ccc([N+](=O)[O-])cc1Cl 487808546 NWPPYYGEVWPHLA-IBGZPJMESA-N 499.011 5.229 5 20 JKBD COc1ccccc1N1CCC(N[C@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2ccccc2)CC1 493859065 BYZIDJPJQSYHAP-VWLOTQADSA-N 494.979 5.195 5 20 JKBD O=C(Nc1ccc2scnc2c1)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 505854846 LFYBBPZHINEITG-UHFFFAOYSA-N 450.442 5.078 5 20 JKBD C[C@H](NC(=O)c1ccc(N[C@@H](C)c2ccccn2)c([N+](=O)[O-])c1)c1cccc(C(F)(F)F)c1 505996370 NZPGIZNVORYBCS-GJZGRUSLSA-N 458.440 5.673 5 20 JKBD CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)N[C@@H](C)c1ccc(NC(=O)c2ccc(F)cc2)cc1 509781278 HREVMLITTWZISS-SFHVURJKSA-N 478.524 5.667 5 20 JKBD C[C@H](Sc1nnc(C[C@@H](C)c2ccccc2)o1)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 514298459 PJSKZWLZOKCRJH-OLZOCXBDSA-N 480.468 5.462 5 20 JKBD Cc1ccc2c(C3=CCN(C(=O)c4ccc(Cn5nc(C)c([N+](=O)[O-])c5C)cc4)CC3)c[nH]c2c1 515133411 FLGMKBPGKBOMBS-UHFFFAOYSA-N 469.545 5.176 5 20 JKBD COc1ccc(-n2ccc(CNCc3ccc(-c4ccc([N+](=O)[O-])cc4Br)o3)n2)cc1 518273885 DBRPVJYLMCYKAD-UHFFFAOYSA-N 483.322 5.101 5 20 JKBD COc1cc(C(=O)Nc2nc(-c3ccccc3)c(C(=O)c3ccccc3)s2)c([N+](=O)[O-])cc1OC 599809837 XGEHPNMUBSGXIZ-UHFFFAOYSA-N 489.509 5.219 5 20 JKBD Cc1ccc(NC(=O)c2ccccc2)cc1NC(=O)CCNc1ccc(C(F)(F)F)cc1[N+](=O)[O-] 603774273 BPCNXBQIUIAUBB-UHFFFAOYSA-N 486.450 5.615 5 20 JKBD CCOc1cc([N+](=O)[O-])c(C(=O)N(c2cccc(C(F)(F)F)c2)[C@@H](C)C2CC2)cc1OC 603964310 CAWNEIOTSSWDNO-ZDUSSCGKSA-N 452.429 5.466 5 20 JKBD C[C@@H](NC(=O)NCc1cn(Cc2ccccc2)nc1-c1ccccc1)c1cccc([N+](=O)[O-])c1 604126022 DCJGOIHCMUDGOG-LJQANCHMSA-N 455.518 5.067 5 20 JKBD Cc1ccc(C(C)C)c(Oc2ccc(CN[C@@H](C)c3nnc4n3CCCCC4)cc2[N+](=O)[O-])c1 604417894 JTYPUWLIYWVCPM-IBGZPJMESA-N 463.582 5.988 5 20 JKBD CCOc1ccc(NC(=O)c2ccc(Cn3nc(C)c([N+](=O)[O-])c3C)cc2)c(C(F)(F)F)c1 604447521 XQNZSHIESBRCKH-UHFFFAOYSA-N 462.428 5.126 5 20 JKBD CC(C)CC(=O)Nc1cccc(CNCc2ccc(-c3ccc([N+](=O)[O-])cc3Br)o2)c1 608836661 CFKOZRHODCZFPQ-UHFFFAOYSA-N 486.366 5.892 5 20 JKBD O=C(Nc1ccccc1)[C@@H]1CCc2ccccc2N1C(=O)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-] 608871259 AMNGYYUHSUOULU-QFIPXVFZSA-N 499.445 5.136 5 20 JKBD CSc1ccc(C(=O)N2c3ccccc3CC[C@@H]2C(=O)Nc2ccc(F)cc2)cc1[N+](=O)[O-] 608873127 VWGHVWWZHFFABB-HXUWFJFHSA-N 465.506 5.056 5 20 JKBD O=C(NCc1ccc(NC(=O)c2c[nH]c3cc([N+](=O)[O-])ccc23)cc1)c1ccc(Br)cc1 609347131 VVGWVVUQSYXBMX-UHFFFAOYSA-N 493.317 5.021 5 20 JKBD COCCOc1cc([N+](=O)[O-])c(C(=O)Nc2ccc(-c3cccc(Cl)c3)cc2C)cc1OC 726763584 VNNRAQXJXPXOTE-UHFFFAOYSA-N 470.909 5.510 5 20 JKBD COc1ccc(NC(=S)/C(=C(/O)c2ccc(C)c([N+](=O)[O-])c2)[n+]2ccccc2)cc1Cl 726963131 ZILNYUNESYBRDP-UHFFFAOYSA-O 456.931 5.176 5 20 JKBD O=[N+]([O-])c1cccc(-c2csc(NS(=O)(=O)C3=Cc4ccc(OC(F)F)cc4CC3)n2)c1 727242167 UOJJWTBSQGBSRZ-UHFFFAOYSA-N 479.486 5.049 5 20 JKBD Cc1c(C(=O)Nc2nc(-c3cc(Cl)sc3Cl)cs2)cc([N+](=O)[O-])c(C)c1[N+](=O)[O-] 748612690 BCFWVOFHFAIDFB-UHFFFAOYSA-N 473.319 5.864 5 20 JKBD COc1cc([C@@H](C)NC(=O)c2cc([N+](=O)[O-])ccc2Br)ccc1OCc1ccccc1 751092589 GQSAEALJKOZGEO-OAHLLOKOSA-N 485.334 5.436 5 20 JKBD CN(C)c1cc(C(F)(F)F)nc(Oc2ccc3c(-c4ccc([N+](=O)[O-])cc4)cc(=O)oc3c2)n1 844161522 SOSXANRYHOGOOF-UHFFFAOYSA-N 472.379 5.035 5 20 JKBD Cc1cccc(-c2nnc(-c3ccc(C(=O)O[C@@H](C)c4nnc(-c5ccc([N+](=O)[O-])cc5)o4)cc3)o2)c1 904168607 ICTZDLJRNHAAAH-INIZCTEOSA-N 497.467 5.588 5 20 JKBD Cc1c(C(=O)O[C@@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2ccccc2)cnn1C(C)(C)C 919190141 VKGSEACYFYREQT-HXUWFJFHSA-N 470.913 5.045 5 20 JKBD Cc1ccc(C(C)C)cc1O[C@H](C)C(=O)O[C@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 919408921 WPYFQIDJTBUYSQ-HUUCEWRRSA-N 482.455 5.383 5 20 JKBD C[C@H](OC(=O)c1cc2cccc([N+](=O)[O-])c2[nH]1)C(=O)Nc1c(Cl)cc(Cl)cc1Cl 919523357 RKJBUGAEMCHFGL-QMMMGPOBSA-N 456.669 5.220 5 20 JKBD C[C@@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)OCc1nnc(-c2ccc(Cl)cc2Cl)o1 920498829 DOGKTEFXAAEYJQ-SNVBAGLBSA-N 454.291 5.176 5 20 JKBD CN(Cc1cc([N+](=O)[O-])ccc1Cl)C(=O)[C@@H]1CCC(=O)N(Cc2ccccc2)[C@@H]1c1ccccc1 920884983 MDZJZBMMKGKMLT-ZEQKJWHPSA-N 491.975 5.387 5 20 JKBD O=C(NC1(c2ccc(NC(=O)c3cnc(-c4ccccc4)s3)cc2)CCC1)c1ccc([N+](=O)[O-])[nH]1 1789879803 LNCBJBXBQOXFPR-UHFFFAOYSA-N 487.541 5.108 5 20 JKBD O=C(/C=C/c1ccccc1[N+](=O)[O-])Nc1ccc(C2(NC(=O)c3n[nH]c4ccc(F)cc34)CCC2)cc1 1792317789 NARMVSJWYMKSGY-AWNIVKPZSA-N 499.502 5.071 5 20 JKBD Cc1ccc(CCC(=O)N2CCC([C@H]3CCCCN3C(=O)c3cccc(F)c3[N+](=O)[O-])CC2)cc1F 1830616429 ILRUGIFCSKBJOR-XMMPIXPASA-N 499.558 5.048 5 20 JKBD C[C@]1(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)CSc3ccccc3[N+](=O)[O-])CC2)CC=CCC1 1832410830 JVMBLUOMNJBARE-RLWLMLJZSA-N 485.650 5.053 5 20 JKBD COc1ccc(-c2nc(CC(=O)Nc3nc(-c4cccc([N+](=O)[O-])c4)cs3)cs2)cc1OC 14376572 OILXFGRACBPTDB-UHFFFAOYSA-N 482.543 5.040 5 20 JKBD COc1cc(C(=O)NCCn2c(C)nc3ccccc32)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 15136010 MNHMWMZHCFMVQI-UHFFFAOYSA-N 480.908 5.137 5 20 JKBD C[C@H]1CCCN(c2ccc(C(=O)O[C@@H](C)C(=O)Nc3ccccc3C(F)(F)F)cc2[N+](=O)[O-])C1 15816664 POSWJEFPUISALV-GJZGRUSLSA-N 479.455 5.034 5 20 JKBD CCOc1cc(C(=O)O[C@H](C)C(=O)Nc2c(Cl)cc(Cl)cc2Cl)c([N+](=O)[O-])cc1OC 19473411 BOTZCWVCJMPYML-SECBINFHSA-N 491.711 5.146 5 20 JKBD COc1ccc(CSCC(=O)Nc2ccccc2CN2CCc3ccccc32)cc1[N+](=O)[O-] 59338167 PBYFNGPRJUPTIB-UHFFFAOYSA-N 463.559 5.038 5 20 JKBD Cc1ccc(NC(=O)[C@H](Sc2nnc(/C=C/c3ccccc3)[nH]2)c2ccccc2)c([N+](=O)[O-])c1 69525547 WBCLNXIZRVFJMM-SERSOLAASA-N 471.542 5.664 5 20 JKBD CC(C)(C)OC(=O)Nc1ccc(C(F)(F)F)cc1NC(=O)c1cnn(-c2ccc([N+](=O)[O-])cc2)c1 108641567 NFNBXYCMUYLOMI-UHFFFAOYSA-N 491.426 5.399 5 20 JKBD C[C@@H]1C[C@@H](C)CN(c2ccc(C(=O)N3CCC(Oc4ccc(F)cc4F)CC3)cc2[N+](=O)[O-])C1 195640723 PYNKBVIVBDUORU-IAGOWNOFSA-N 473.520 5.039 5 20 JKBD O=C(Nc1ccccc1C(=O)N1CCC[C@H](c2ccccc2)CC1)c1ccc([N+](=O)[O-])cc1Cl 303206436 QBSQXZMZFYBXGK-IBGZPJMESA-N 477.948 5.910 5 20 JKBD C[C@@H](Nc1ccc(C(=O)Nc2ccccc2NC(=O)C[C@@H]2C=CCC2)cc1[N+](=O)[O-])c1ccccn1 409988500 WHUKTGWJSPWSQT-RTBURBONSA-N 485.544 5.710 5 20 JKBD CC(=O)Nc1cccc2c1CCCN2C(=O)c1ccc(Sc2nc(C)cs2)c([N+](=O)[O-])c1 491188593 ZBZVTPGNTUJAJT-UHFFFAOYSA-N 468.560 5.062 5 20 JKBD O=C(Nc1cccc(/C=C(/c2ccncc2)c2ccc([N+](=O)[O-])cc2)c1)c1ccccc1Cl 502183538 UHLIJGVQYWMUBL-JJIBRWJFSA-N 455.901 6.484 5 20 JKBD COc1cc(CCNC(=O)c2ccccc2-c2ncc(-c3ccc(C)cc3)o2)c([N+](=O)[O-])cc1OC 514990472 FJIIXKDSGJDPQX-UHFFFAOYSA-N 487.512 5.215 5 20 JKBD O=C(C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)N1CCC[C@@H]1c1cccc(F)c1 516142310 RSSUMHKYQKISKJ-UJWNWPGJSA-N 487.556 6.638 5 20 JKBD Cc1cc(NC(=O)c2ccc(Nc3ccccc3)c([N+](=O)[O-])c2)ccc1NC(=O)c1ccco1 516544005 QGQUSGZRGHFVIM-UHFFFAOYSA-N 456.458 5.744 5 20 JKBD CCOC(=O)c1cccc(N(CC)C(=O)c2ccc(N[C@@H](C)c3ccccn3)c([N+](=O)[O-])c2)c1 516629392 JAMKBNHDYDLSKY-KRWDZBQOSA-N 462.506 5.006 5 20 JKBD CCCC(=O)Nc1ccc(CNC(=O)c2ccccc2C(=O)c2ccc(SC)c([N+](=O)[O-])c2)cc1 518274915 PHOCTYJWDZAWER-UHFFFAOYSA-N 491.569 5.216 5 20 JKBD Cn1cc(/C=C(/CC(=O)O)c2nc3cc(C(F)(F)F)ccc3s2)c(-c2ccc([N+](=O)[O-])cc2)n1 518602726 JGSPKGQJHKBHNP-JYRVWZFOSA-N 488.447 5.639 5 20 JKBD CCCSc1ccc([N+](=O)[O-])cc1C(=O)N1C[C@H]2CC[C@H]1[C@H]1CN(Cc3ccccc3)C[C@H]21 594660122 JBNXLEWWQOTYJU-JFTIXFDTSA-N 465.619 5.080 5 20 JKBD CCOCc1ccccc1CNc1ccc(S(=O)(=O)Nc2ccc(C)cc2C)cc1[N+](=O)[O-] 603849100 AVDYPQGWMOJFLW-UHFFFAOYSA-N 469.563 5.161 5 20 JKBD COc1ccc(-n2c(SCc3csc([N+](=O)[O-])c3)nnc2-c2ccccc2OC)cc1 603938390 OMAIBJOLZFHTPI-UHFFFAOYSA-N 454.533 5.214 5 20 JKBD O=C(Cn1ccc([N+](=O)[O-])n1)N(Cc1ccccc1)c1nc(-c2ccc(Cl)cc2Cl)cs1 603947308 DZXNNCSLIKMEOO-UHFFFAOYSA-N 488.356 5.455 5 20 JKBD Cc1ccc([C@H](C)N[C@@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Br)c2ccccc2)cc1 604047598 KLNDJLPDYRTALK-KSFYIVLOSA-N 468.351 5.696 5 20 JKBD Cc1ccc(C(C)C)c(Oc2ccc(CN[C@@H]3CCCc4c3cnn4CCO)cc2[N+](=O)[O-])c1 608782041 KHEZWONVABNJFI-JOCHJYFZSA-N 464.566 5.175 5 20 JKBD COc1cc(C(=O)Nc2ccc(-c3nc4c(Cl)cccc4[nH]3)cc2)c([N+](=O)[O-])cc1OC(F)F 608947931 IRYOVYUAMMEPAT-UHFFFAOYSA-N 488.834 5.654 5 20 JKBD O=C(Cn1c2ccccc2c(=O)c2ccccc21)N[C@H](c1ccccc1)c1ccc(Br)cc1 620389299 DFSBNLUMCZSIQH-HHHXNRCGSA-N 497.392 5.823 5 20 JKBD COCC(=O)Nc1ccc(NC(=O)CCC(=O)c2ccc3ccc4cccc5ccc2c3c45)cc1 727753954 CZAJUOHWYFXLQG-UHFFFAOYSA-N 464.521 5.771 5 20 JKBD CN(C)C(=O)Sc1ccc(NC(=O)c2ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])cc2)cc1 729249499 CQRBUZARHIOOMC-UHFFFAOYSA-N 471.922 6.067 5 20 JKBD O=[N+]([O-])c1ccc2nc(Sc3ccc(CN[C@@H]4CCc5c(O)cccc54)cc3[N+](=O)[O-])sc2c1 729686106 ZMESVXQJEBUEOZ-QGZVFWFLSA-N 494.554 5.747 5 20 JKBD COc1ccc(CC[C@@H](C)NC(=O)c2ccccc2NC(=O)c2ccc([N+](=O)[O-])cc2Cl)cc1 742411157 OKFBDCUABQGEQR-MRXNPFEDSA-N 481.936 5.260 5 20 JKBD C[C@H](Nc1ccc(OCc2ccccn2)c(Cl)c1)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 744262218 XAHJOKXZKNPIKC-ZDUSSCGKSA-N 494.857 5.680 5 20 JKBD COc1ccc(-c2ccc(/C=C(\Cl)c3nnc(C(=O)NCc4ccccc4)s3)o2)c([N+](=O)[O-])c1 797269755 QJGKGDUERQHROH-WQRHYEAKSA-N 496.932 5.382 5 20 JKBD COc1ccc(Oc2ccc([N+](=O)[O-])cc2C(=O)O[C@@H](C)C(=O)Nc2c(C)cc(C)cc2C)cc1 915443066 XQSGSVPHMOAXPE-SFHVURJKSA-N 478.501 5.505 5 20 JKBD Cc1c([N+](=O)[O-])cc(C(=O)Nc2nc(-c3sccc3Br)cs2)cc1[N+](=O)[O-] 916420272 HMBWDBRGACCNNU-UHFFFAOYSA-N 469.298 5.011 5 20 JKBD O=C(O[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1)c1c(Cl)nc2ccccn12 919234700 JLDNNGQTUJUYHW-LJQANCHMSA-N 485.283 5.086 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)NC1(c2ccc(NC(=O)CCc3ccco3)cc2)CCC1 1786902826 BGISXLGXXKFOKU-UHFFFAOYSA-N 465.481 5.016 5 20 JKBD Cc1cncc(C(=O)Nc2ccc(C3(NC(=O)C4(c5cccc([N+](=O)[O-])c5)CCC4)CCC3)cc2)c1 1787433046 WLFLPOZRDLHUSE-UHFFFAOYSA-N 484.556 5.168 5 20 JKBD O=C(NC1(c2ccc(NC(=O)C3(c4cccc([N+](=O)[O-])c4)CCC3)cc2)CCC1)[C@@H]1[C@@H]2C=CS[C@@H]12 1790476644 PVRRBTMOVFBVMK-YTFSRNRJSA-N 489.597 5.026 5 20 JKBD O=C(NC1(c2ccc(NC(=O)c3ccc([N+](=O)[O-])cc3F)cc2)CCC1)c1cc2sccc2[nH]1 1790621665 CBDZYVBHQFIUJX-UHFFFAOYSA-N 478.505 5.338 5 20 JKBD Cc1cc2cc(C(=O)Nc3ccc(C4(NC(=O)Cc5cccc([N+](=O)[O-])c5)CCC4)cc3)ccc2[nH]1 1790987767 XOXFSVMXFRKRPV-UHFFFAOYSA-N 482.540 5.375 5 20 JKBD Cc1cccc(C(=O)Nc2cc([C@H]3CCCCN3C(=O)c3ccc([N+](=O)[O-])cc3F)[nH]n2)c1Cl 1823183519 BBNYUPSGCVPTQS-LJQANCHMSA-N 485.903 5.039 5 20 JKBD Cc1cc(C(=O)N[C@@H]2CCc3nc(NC(=O)c4cc5cc([N+](=O)[O-])ccc5s4)sc3C2)c(C)o1 1824426662 NKUYCJWLHQXRSH-CQSZACIVSA-N 496.570 5.015 5 20 JKBD O=C(c1cc2cc([N+](=O)[O-])ccc2s1)N1CCC([C@@H]2CCCCN2C(=O)Cc2ccccc2)CC1 1826466164 ZEBZEVUEAPBFBX-QHCPKHFHSA-N 491.613 5.286 5 20 JKBD Cc1c(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3ccsc3)CC2)cc(Cl)cc1[N+](=O)[O-] 1830734232 FVZAHSMJRCQRBU-HXUWFJFHSA-N 475.998 5.165 5 20 JKBD O=C(c1ccc2cc[nH]c2c1)N1CCC([C@@H]2CCCCN2C(=O)/C=C/c2ccccc2[N+](=O)[O-])CC1 1832907283 RLEREQSHDBUGOD-VSFTXHECSA-N 486.572 5.023 5 20 JKBD C[C@@H](OC(=O)c1c2c(nc3ccccc13)/C(=C/c1ccco1)CC2)C(=O)Nc1ccccc1[N+](=O)[O-] 8620795 ZECQIWRZRAXOHQ-IBOXJLQUSA-N 483.480 5.407 5 20 JKBD O=C(COC(=O)c1ccc(Cl)cc1[N+](=O)[O-])Nc1c(Cl)c(Cl)cc(Cl)c1Cl 10748467 VVJONXPSXALXQI-UHFFFAOYSA-N 472.495 5.657 5 20 JKBD COc1cc(CSc2nnc(-c3c[nH]c4ccccc34)n2C2CC2)c([N+](=O)[O-])cc1OC(F)F 11129600 RNWBHJMDMDOKPU-UHFFFAOYSA-N 487.488 5.572 5 20 JKBD O=C(CSc1nnc(-c2c[nH]c3ccccc23)n1C1CC1)Nc1cc([N+](=O)[O-])ccc1Cl 17881780 FMQBMSPUGGJOFH-UHFFFAOYSA-N 468.926 5.054 5 20 JKBD CC(C)C(=O)Nc1ccc(C(=O)[C@H](C)Sc2nc3cc4ccccc4cc3c(=O)n2C)cc1 22254695 VGJNHSIMCONQHC-INIZCTEOSA-N 459.571 5.045 5 20 JKBD CCOc1ccccc1Nc1nnc(SCC(=O)Nc2ccc([N+](=O)[O-])cc2C(F)(F)F)s1 23557888 SLKGTEWISVMDNE-UHFFFAOYSA-N 499.496 5.338 5 20 JKBD Cc1cccc(N2CCN(Cc3ccc(NC(=O)c4ccc(Cl)cc4[N+](=O)[O-])cc3)CC2)c1 29417759 OSRJODPFOLXGBM-UHFFFAOYSA-N 464.953 5.131 5 20 JKBD C[C@H](Sc1nnc2c(Cl)cc(C(F)(F)F)cn12)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl 36796059 ZWQCIKDDQHUSMQ-ZETCQYMHSA-N 480.255 5.082 5 20 JKBD O=C(Nc1ccc(C(=O)N2CCCC2)cc1)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1 45870013 QFBFIXCQYBMZOT-UHFFFAOYSA-N 465.893 5.529 5 20 JKBD C[C@@H](OC(=O)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1)c1nc(-c2cccnc2)no1 105448585 QUAYKNXFNHUDDA-CYBMUJFWSA-N 466.837 5.404 5 20 JKBD COc1ccc(NC(=O)CSc2ccc(C(F)(F)F)cc2[N+](=O)[O-])cc1OCc1cccnc1 106103248 GRBVSPVNWLUWRC-UHFFFAOYSA-N 493.463 5.327 5 20 JKBD COc1ccc([C@@H](CNC(=O)c2c[nH]c3ccc([N+](=O)[O-])cc23)c2c[nH]c3ccccc23)cc1 109869804 MPWCPBMECBBBAY-OAQYLSRUSA-N 454.486 5.128 5 20 JKBD Cc1nn(Cc2ccc(C(=O)Nc3ccccc3NC(=O)C[C@H]3C=CCC3)cc2)c(C)c1[N+](=O)[O-] 409980704 PTCUOJNRVJOFDI-IBGZPJMESA-N 473.533 5.004 5 20 JKBD C[C@H]1C[C@@H](C)CN(c2ccc(C(=O)Nc3ccc(-n4cccn4)cc3C(F)(F)F)cc2[N+](=O)[O-])C1 484316657 HGVLNFMAWFULIF-IYBDPMFKSA-N 487.482 5.534 5 20 JKBD O=C(C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)NCC[C@@H]1C(=O)Nc2ccccc21 491196369 QVYPFGFBUUHDIY-RHYRFBSLSA-N 498.564 5.377 5 20 JKBD O=C(c1nn(-c2cc(C(F)(F)F)ccc2Cl)c2c1CCC2)N1CCc2ccc([N+](=O)[O-])cc21 498322066 HNZCAQQSUBESSA-UHFFFAOYSA-N 476.842 5.144 5 20 JKBD Cc1c(NC(=O)c2ccc(N3CCC[C@@H](C)C3)c([N+](=O)[O-])c2)cccc1C(=O)Nc1ccccc1 498461765 GYNXHMSYJOOIOP-GOSISDBHSA-N 472.545 5.644 5 20 JKBD CCOc1ccc(C(=O)N2CCC(NCc3ccc(N(C)c4ccccc4)c([N+](=O)[O-])c3)CC2)cc1 507913616 LNPIMBPWGBZTIS-UHFFFAOYSA-N 488.588 5.156 5 20 JKBD C[C@H](NC(=O)Nc1cc([N+](=O)[O-])ccc1OC(F)F)c1cccc(NC(=O)c2ccccc2)c1 510867110 HCLNZAZFURZNQD-AWEZNQCLSA-N 470.432 5.331 5 20 JKBD O=C(Nc1nc(-c2cccc(Cl)c2)cs1)c1ccc([N+](=O)[O-])cc1I 511283276 FSLMNBBXMKOKLS-UHFFFAOYSA-N 485.690 5.229 5 20 JKBD O=C(NCCC(c1ccccc1)c1ccccc1)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-] 511713080 NJSQXVYHANFFFR-UHFFFAOYSA-N 458.436 5.488 5 20 JKBD COc1cc(C(=O)N[C@H](Cc2ccccc2)c2ccccc2)c([N+](=O)[O-])cc1OCc1cscn1 512594914 GMUWWRSUANUACA-JOCHJYFZSA-N 489.553 5.353 5 20 JKBD CCCN(C(=O)NCc1ccc(OC)c([N+](=O)[O-])c1)[C@@H](C)c1ccccc1Br 515829826 SNXAKRPZOILKJP-AWEZNQCLSA-N 450.333 5.049 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Br)[C@H](NCc1ccc(F)c(F)c1)c1ccccc1 516378213 SZWIAYRXIPVHLQ-HXUWFJFHSA-N 476.277 5.105 5 20 JKBD O=[N+]([O-])c1ccc(-c2ccc(CNCc3ccccc3OC(F)F)o2)c(Br)c1 517542248 WGJQFDCAUUHJSS-UHFFFAOYSA-N 453.239 5.509 5 20 JKBD O=C(Cc1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1)Nc1ccc(-c2cnc[nH]2)cc1 520614415 KSTISTPIFJWETN-UHFFFAOYSA-N 464.485 5.019 5 20 JKBD O=C(Nc1cc(Cl)ccc1Cl)[C@@H]1CCCCN1C(=O)c1cc2cc([N+](=O)[O-])ccc2s1 522269046 GYEXNBAPNGINJQ-KRWDZBQOSA-N 478.357 5.750 5 20 JKBD O=[N+]([O-])c1ccc(-c2ncn(C[C@H](O)COC(c3ccc(Cl)cc3)c3ccc(Cl)cc3)n2)cc1 549192352 SWRKIGBNAASVOA-QFIPXVFZSA-N 499.354 5.327 5 20 JKBD O=C(C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)N1CCC[C@@H]1c1ccccc1 590683043 YQKRMEIEONCTRL-FGNRIPBJSA-N 469.566 6.499 5 20 JKBD COc1cc(C(=O)Nc2ccc(C(=O)N3CCCC[C@@H]3C)c(Cl)c2)c([N+](=O)[O-])cc1OC(F)F 603987612 RUWGQIWWHUVJEW-LBPRGKRZSA-N 497.882 5.125 5 20 JKBD CCOc1cc(Br)c(NC(=O)[C@@H](C)Oc2ccc(Cl)cc2[N+](=O)[O-])cc1OCC 604443816 PXDWUSFEFWEYOD-LLVKDONJSA-N 487.734 5.214 5 20 JKBD O=C(C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)Nc1cnn(Cc2ccccn2)c1 604549071 ZQXGKKVARYTUBT-UYRXBGFRSA-N 496.552 5.414 5 20 JKBD O=C(Nc1cnn(-c2ccncc2)c1)c1ccc(Sc2nc3ccccc3s2)c([N+](=O)[O-])c1 608900667 OJHIATNUQDDEIC-UHFFFAOYSA-N 474.527 5.189 5 20 JKBD O=C(Nc1cc(-c2ccccc2F)no1)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 729272207 GURSTCYMKGZLQA-UHFFFAOYSA-N 478.402 5.263 5 20 JKBD CC1CCN(c2ccc([N+](=O)[O-])cc2C(=O)N(C)C[C@@H]2CCCO[C@H]2c2ccccc2)CC1 747785060 RIPCYDOELPXPDI-OFVILXPXSA-N 451.567 5.071 5 20 JKBD O=C(O[C@H](C(=O)Nc1ccc(F)cc1)c1ccccc1)c1csc(-c2cccc([N+](=O)[O-])c2)n1 747962394 ONEHZCNJNHQYQS-NRFANRHFSA-N 477.473 5.394 5 20 JKBD O=C(OCC1CCN(c2ccc([N+](=O)[O-])cn2)CC1)[C@@H]1CC=CC[C@@H]1c1nc2ccccc2s1 750428622 UBAINPPUFYJYOZ-VQTJNVASSA-N 478.574 5.109 5 20 JKBD CC(C)(C)OC(=O)Nc1ccc(F)c(NC(=O)CSc2ccc(C(F)(F)F)cc2[N+](=O)[O-])c1 914769655 HNUOTNMDYIQPNV-UHFFFAOYSA-N 489.447 5.831 5 20 JKBD CC(C)[C@@H](OC(=O)C1CCN(c2ccccc2[N+](=O)[O-])CC1)C(=O)Nc1ccccc1C(F)(F)F 915368547 KZHHNJHQPANBTA-OAQYLSRUSA-N 493.482 5.037 5 20 JKBD COc1cc(C(=O)OCc2nnc(-c3cc(C)oc3C)o2)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 916437931 QXDQUDGRQZXSCA-UHFFFAOYSA-N 499.863 5.666 5 20 JKBD Cc1cc(NC(=O)c2ccccc2Cl)sc1C(=O)Nc1cc([N+](=O)[O-])c(F)cc1F 917630922 KRKWRLHTUKIUAD-UHFFFAOYSA-N 451.838 5.401 5 20 JKBD O=C(OCC[C@@H]1CCCCN1C(=O)c1csc(-c2cccs2)n1)c1cccc([N+](=O)[O-])c1 918635922 VILNIUAJRZHYKR-INIZCTEOSA-N 471.560 5.022 5 20 JKBD C[C@@H](OC(=O)[C@H]1CCCN(C(=O)c2ccc(Cl)c(Cl)c2)C1)c1ccccc1[N+](=O)[O-] 920267501 KALYMGKHXCEIMD-HIFRSBDPSA-N 451.306 5.058 5 20 JKBD Cc1ncoc1C(=O)Nc1ccc(C2(NC(=O)c3cc4cc([N+](=O)[O-])ccc4s3)CCC2)cc1 1787477961 OEASUXBYGIGDGE-UHFFFAOYSA-N 476.514 5.167 5 20 JKBD Cc1cnc(Cl)c(C(=O)Nc2ccc(C3(NC(=O)c4ccc([N+](=O)[O-])cc4F)CCC3)cc2)c1 1787568468 ZCSOFFRQNRPYOY-UHFFFAOYSA-N 482.899 5.152 5 20 JKBD COc1c(C(=O)Nc2ccc(C3(NC(=O)c4cccc(F)c4[N+](=O)[O-])CCC3)cc2)ccc(F)c1F 1790728625 VFCSQOSRRAYNCX-UHFFFAOYSA-N 499.445 5.082 5 20 JKBD Cc1ccc(C(=O)NC2(c3ccc(NC(=O)c4cc(Cl)cc([N+](=O)[O-])c4C)cc3)CCC2)cn1 1790774483 OTAXAGAZYNBBAJ-UHFFFAOYSA-N 478.936 5.322 5 20 JKBD C[C@@H](C(=O)Nc1cc([C@@H]2CCCCN2C(=O)Cc2cccc([N+](=O)[O-])c2)[nH]n1)c1ccc(Cl)cc1 1814656225 RNYWVFFMDPGQOP-ZHRRBRCNSA-N 495.967 5.010 5 20 JKBD CC(C)[C@@H](C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cc(F)cc([N+](=O)[O-])c2)n[nH]1)c1ccccc1 1821163886 YQWRGXZBVZEQIW-ISKFKSNPSA-N 493.539 5.203 5 20 JKBD Cc1ccc(CSCCC(=O)N2CCC([C@H]3CCCCN3C(=O)c3ccc([N+](=O)[O-])o3)CC2)cc1 1823618004 LPNHLIRPGAPLPE-JOCHJYFZSA-N 499.633 5.053 5 20 JKBD CC1=CC[C@@H](C(=O)N2CCCC[C@H]2C2CCN(C(=O)c3c(F)ccc([N+](=O)[O-])c3C)CC2)CC1 1828351362 FEAKCXDESRQRHW-OFNKIYASSA-N 471.573 5.022 5 20 JKBD Cc1cc(CCCC(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)[C@H](c2ccccc2)C(C)C)c([N+](=O)[O-])cc1F 1847614255 RAZABYDPEXUMTA-DPZBCOQUSA-N 495.595 5.007 5 20 JKBD CC(C)n1ncc2c(C(=O)OCc3nnc(-c4ccc([N+](=O)[O-])cc4)o3)cc(-c3cccs3)nc21 11050303 JGPFDPZFNPCHLN-UHFFFAOYSA-N 490.501 5.056 5 20 JKBD CC(=O)N(c1nc(COC(=O)c2ccc(NC3CC3)c([N+](=O)[O-])c2)cs1)c1c(C)cc(C)cc1C 11227079 GXERQTDVPWBZEE-UHFFFAOYSA-N 494.573 5.592 5 20 JKBD Cc1cc(C)c2nc(N(Cc3ccccc3)C(=O)c3ccc(S(C)(=O)=O)c([N+](=O)[O-])c3)sc2c1 14595878 JHFWXMADFBJVIU-UHFFFAOYSA-N 495.582 5.072 5 20 JKBD CCOc1ccc(NC(=O)c2ccc(NC(=O)c3ccc(SC)c([N+](=O)[O-])c3)cc2)cc1 15737120 OLKWOAYMXCIMMV-UHFFFAOYSA-N 451.504 5.220 5 20 JKBD C[C@@H](Sc1nccn1-c1ccc(Br)cc1)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 16678938 SQOWAAAGDYIKQI-GFCCVEGCSA-N 472.324 5.446 5 20 JKBD Cc1cc(C)c(NC(=O)COC(=O)c2ccccc2NC(=O)c2ccc([N+](=O)[O-])cc2Cl)c(C)c1 21745319 NCZKARZEOULVLV-UHFFFAOYSA-N 495.919 5.221 5 20 JKBD CSc1ccc(NC(=O)[C@H](C)OC(=O)c2ccccc2C(=O)c2ccc(Cl)c([N+](=O)[O-])c2)cc1 22669929 MRTKXJGCHISALE-AWEZNQCLSA-N 498.944 5.385 5 20 JKBD Cc1ccc(C)c(NC(=O)[C@@H](OC(=O)CSc2ccccc2[N+](=O)[O-])c2ccccc2)c1 24199431 RDHAIJLYXGKCNU-QHCPKHFHSA-N 450.516 5.227 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Cl)[C@H](Nc1cc(F)cc(N2CCOCC2)c1)c1ccccc1 498573666 FLRPNWNBMSBSCO-HSZRJFAPSA-N 484.915 5.016 5 20 JKBD O=C(Nc1nnc(-c2ccccn2)s1)c1ccc(Sc2nc3ccccc3s2)c([N+](=O)[O-])c1 502875238 CCOXAHUEERWDPU-UHFFFAOYSA-N 492.567 5.522 5 20 JKBD CN(C[C@H]1OCCc2ccccc21)[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1 507258581 CQXNCBLLEPPJPL-DNQXCXABSA-N 465.937 5.174 5 20 JKBD O=C(c1ccc(Nc2ccccc2)c([N+](=O)[O-])c1)N1CCC[C@H](c2nc(-c3ccc(F)cc3)no2)C1 507988741 HTOCHNUQHWPDKC-IBGZPJMESA-N 487.491 5.547 5 20 JKBD O=C(Nc1ccc(-n2cncn2)c(F)c1)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1 509473131 VHDAKQFCIITUGO-UHFFFAOYSA-N 453.817 5.013 5 20 JKBD CCCOc1cc(NC(=O)c2cnc3ccccc3c2C(F)(F)F)c([N+](=O)[O-])cc1OCCC 514983555 SNSPYGSAKRIOAX-UHFFFAOYSA-N 477.439 5.992 5 20 JKBD COC(=O)c1ccsc1NC(=O)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])c(OC)c1 515681729 FVXMZNZUMWDIJK-UHFFFAOYSA-N 462.867 5.150 5 20 JKBD Cc1noc(-c2ccc(C)c(NC(=O)c3ccc(N[C@H](C)c4ccccn4)c([N+](=O)[O-])c3)c2)n1 516623373 JOMRUFRRBSKXJQ-OAHLLOKOSA-N 458.478 5.082 5 20 JKBD O=C(c1ccc(Sc2nc3ccccc3s2)c([N+](=O)[O-])c1)N1CCC[C@@H](c2ncc[nH]2)C1 524340831 ZHZPYMCFFGBMMG-OAHLLOKOSA-N 465.560 5.099 5 20 JKBD COC(=O)CC1CCN(C(=O)c2c3c(nc4ccccc24)/C(=C\c2ccc([N+](=O)[O-])cc2)CCC3)CC1 568375193 XSHULLYJLWFQBT-FXBPSFAMSA-N 499.567 5.435 5 20 JKBD Cc1ccccc1NC(=O)c1cc2ccccc2cc1OCC(=O)N1CCc2ccc([N+](=O)[O-])cc21 595555401 KZCPYBBGLPCQEX-UHFFFAOYSA-N 481.508 5.277 5 20 JKBD COc1cc([C@H](C)NC(=O)c2cc(SC)ccc2[N+](=O)[O-])ccc1OCc1ccccc1 603986694 OTPBIMMLNBLQGP-INIZCTEOSA-N 452.532 5.395 5 20 JKBD Cc1cc(C(=O)Nc2cc(OCC(F)(F)F)cc(OCC(F)(F)F)c2)cc([N+](=O)[O-])c1 604448965 JYSVDZWHNGXERS-UHFFFAOYSA-N 452.307 5.038 5 20 JKBD C[C@H](Nc1ccc(C(=O)Nc2ccc3nc([C@@H]4CCCO4)[nH]c3c2)cc1[N+](=O)[O-])c1ccccn1 604480922 BASTYZLGJHFIQQ-WNSKOXEYSA-N 472.505 5.143 5 20 JKBD CC(C)OCc1ccccc1CNCc1ccc(-c2ccc([N+](=O)[O-])cc2Br)o1 608836477 KUHUHKVQDZVNQP-UHFFFAOYSA-N 459.340 5.832 5 20 JKBD COc1ccccc1[C@@H]1CCCN1C(=O)C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1 609036414 FLKYLLUBBJYDOJ-ARHOYUFESA-N 499.592 6.508 5 20 JKBD COc1ccc(NC(=O)c2ccc([N+](=O)[O-])cc2Cl)cc1OCc1ccc2ccccc2n1 609067016 XIABVIUHBTWWMB-UHFFFAOYSA-N 463.877 5.636 5 20 JKBD Cc1cc(C(=O)N2CCC[C@H]2C(=O)Nc2nc3ccc(SC(F)F)cc3s2)ccc1[N+](=O)[O-] 726496466 ZDDBBRKJIQXHPN-INIZCTEOSA-N 492.529 5.071 5 20 JKBD Cc1nc(C(=O)N(CC2CC2)c2ccc(Cl)c([N+](=O)[O-])c2)nn1-c1ccccc1C(C)C 728165375 IGCYZJQZXFNMOU-UHFFFAOYSA-N 453.930 5.318 5 20 JKBD C[C@H](OC(=O)CCc1nc2cc(Cl)ccc2s1)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 730608892 NSNPTKMUQNJTHN-NSHDSACASA-N 458.883 5.145 5 20 JKBD C[C@@H](OC(=O)c1c(Cl)cccc1[N+](=O)[O-])C(=O)Nc1c(Cl)cc(Cl)cc1Cl 730643453 CFORXAXIPZBRIZ-SSDOTTSWSA-N 452.077 5.392 5 20 JKBD O=C(c1csc(-c2ccc([N+](=O)[O-])cc2)n1)N1CCC[C@H]1Cc1ccc(Br)cc1 747716166 XTRBJUZFVHDAQU-SFHVURJKSA-N 472.364 5.328 5 20 JKBD CCc1nc(C)c(C(=O)O[C@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2ccccc2)s1 747950531 KPMMDRFKDAWBJP-SFHVURJKSA-N 459.911 5.112 5 20 JKBD C[C@H](OC(=O)C1(c2ccccc2F)CCCC1)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 755675637 FQGXAAUBVNENAI-ZDUSSCGKSA-N 468.403 5.135 5 20 JKBD Cc1ccc(-c2csc(NC(=O)c3c(C)nn(-c4ccccc4)c3Cl)n2)cc1[N+](=O)[O-] 800581617 GKLLYUPYQZTIEM-UHFFFAOYSA-N 453.911 5.427 5 20 JKBD Cc1cc(NC(=O)c2ccccc2Cl)sc1C(=O)O[C@H](C)C(=O)Nc1ccccc1[N+](=O)[O-] 915580525 ONBIPCFWRONLBA-CYBMUJFWSA-N 487.921 5.054 5 20 JKBD COc1c([N+](=O)[O-])cc(N[C@H](C)c2ccccc2OC(C)C)c([N+](=O)[O-])c1Br 917077346 JSXLAZUZDSRAMI-LLVKDONJSA-N 454.277 5.234 5 20 JKBD Cc1c(-c2ccccc2)sc(NC(=O)c2cc(Cl)ccc2[N+](=O)[O-])c1C(=O)N1CCCCC1 917513349 DUJYONGPQAECCI-UHFFFAOYSA-N 483.977 6.164 5 20 JKBD CC1=C(C(=O)Nc2ccc(F)cc2)[C@H](c2csc([N+](=O)[O-])c2)NC(=O)N1Cc1cccs1 917963409 WNALRALXBNYPPZ-IBGZPJMESA-N 472.523 5.036 5 20 JKBD CC(C)(C)CCCCCC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)/C=C/c2ccccc2[N+](=O)[O-])C1 1783256951 MSKVLDZRJDBRRI-XHYPSFNUSA-N 499.652 5.119 5 20 JKBD CNc1ccc(C(=O)Nc2ccc(C3(NC(=O)CCc4cccc([N+](=O)[O-])c4)CCC3)cc2)cc1 1788000477 XUMDKJGXCWDQND-UHFFFAOYSA-N 472.545 5.017 5 20 JKBD O=C(NC1(c2ccc(NC(=O)[C@H]3CC3(F)F)cc2)CCC1)c1cc2cc([N+](=O)[O-])ccc2s1 1789135991 QRKZIDSSYVXZLK-QGZVFWFLSA-N 471.485 5.212 5 20 JKBD COc1ccc(CC(=O)Nc2ccc(C3(NC(=O)[C@]4(F)CCCC=C4F)CCC3)cc2)c([N+](=O)[O-])c1 1790573554 IEAZYSLZPOKYRY-SANMLTNESA-N 499.514 5.026 5 20 JKBD O=C(Nc1cc([C@@H]2CCCCN2C(=O)/C=C/c2ccccc2[N+](=O)[O-])[nH]n1)c1c(F)cccc1Cl 1820432641 MOIPPLKHQLFJAJ-SGWGQVFISA-N 497.914 5.130 5 20 JKBD CC(C)(C)CC(=O)N1CCCC[C@H]1C1CCN(C(=O)c2ccc(Br)c([N+](=O)[O-])c2)CC1 1826338110 NWICBVQFKLMJFG-IBGZPJMESA-N 494.430 5.027 5 20 JKBD Cc1ccc([C@H](C)C(=O)N2CCCC[C@@H]2C2CCN(C(=O)Cc3cc([N+](=O)[O-])ccc3F)CC2)cc1 1831525657 VLFPAIOOTFFUGM-RXFWQSSRSA-N 495.595 5.008 5 20 JKBD C[C@@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)N1CCC(c2nc3cc(Cl)ccc3s2)CC1 10235751 DVRAJDMAKWJVRN-CYBMUJFWSA-N 461.996 5.745 5 20 JKBD COc1ccccc1NC(=O)c1ccc(NC(=O)c2ccc(N3CCC[C@H](C)C3)c([N+](=O)[O-])c2)cc1 15313629 ZFPBXZMQCUZZDY-SFHVURJKSA-N 488.544 5.344 5 20 JKBD Cc1cccc(C)c1NC(=O)[C@@H](C)OC(=O)Cc1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1 18589359 VRLNKFJPGJUKOJ-HXUWFJFHSA-N 498.539 5.177 5 20 JKBD COc1ccc([N+](=O)[O-])cc1NC(=O)[C@@H](C)Sc1nn(-c2ccc(Cl)cc2)c(=S)s1 23589464 UQGZIRNHIUQRRQ-SNVBAGLBSA-N 482.996 5.353 5 20 JKBD C[C@@H](Nc1ccc(OCc2ccccn2)c(Cl)c1)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl 109355298 KAXCIIGYNHYIQG-CYBMUJFWSA-N 461.305 5.315 5 20 JKBD Cc1noc(C)c1CCNC(=O)c1c2c(nc3ccccc13)/C(=C\c1ccc([N+](=O)[O-])cc1)CCC2 410300542 GZXCVPHFFBBOBF-SILNSSARSA-N 482.540 5.597 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)Nc2ccccc2Oc2ncc(Cl)cc2Cl)cc1SC 482777510 DSSQFHMJCNPXBD-UHFFFAOYSA-N 480.329 6.072 5 20 JKBD CC[C@@H](C)Sc1ccc(NC(=O)c2ccc(S(C)(=O)=O)c([N+](=O)[O-])c2)c(C(F)(F)F)c1 499579413 BELGVPNZQPJOQN-LLVKDONJSA-N 476.498 5.160 5 20 JKBD Cc1cccc([N+](=O)[O-])c1NC(=O)CSc1nc2ccccc2c(=O)n1Cc1ccccc1Cl 499637004 OWENXMOIWOKKNV-UHFFFAOYSA-N 494.960 5.046 5 20 JKBD C[C@@H](Nc1ccc(C(=O)Nc2cccc(-c3nnc4n3CCCCC4)c2)cc1[N+](=O)[O-])c1ccccn1 505981493 KQTRVHUZJJVWKP-GOSISDBHSA-N 497.559 5.400 5 20 JKBD O=C(C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)N1CCC(c2ncc[nH]2)CC1 509966638 HJNREMVCUVOTMJ-CYVLTUHYSA-N 473.558 5.265 5 20 JKBD COc1cc(C(=O)N(C2CC2)[C@@H](C)c2ccc(Cl)cc2)c([N+](=O)[O-])cc1OCc1cscn1 512326796 BJYPGMSJUKOAGS-AWEZNQCLSA-N 487.965 5.658 5 20 JKBD COc1ccc(-c2[nH]c3ccccc3c2CCC(=O)N(C)Cc2ccccc2[N+](=O)[O-])c(OC)c1 512788802 RQFXBKMXNRSHHN-UHFFFAOYSA-N 473.529 5.352 5 20 JKBD C[C@H](Sc1nc2cc3ccccc3cc2c(=O)n1C)C(=O)N(c1nccs1)C1CCCCC1 514908762 DRWGSVIESJZLHV-INIZCTEOSA-N 478.643 5.390 5 20 JKBD CCCC(=O)Nc1cccc(NC(=O)c2ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])c(OC)c2)c1C 516339038 MLBZTDJESXTYBV-UHFFFAOYSA-N 497.935 6.348 5 20 JKBD O=C(Nc1cc(Cl)ccc1Cl)[C@H]1CCCCN1C(=O)c1ccc(NC2CC2)c([N+](=O)[O-])c1 523063183 ZHQMUKBMESJWEI-LJQANCHMSA-N 477.348 5.109 5 20 JKBD CCOc1cc(NC(=O)c2cc(-c3ccc(C)cc3)nc3onc(C)c23)c([N+](=O)[O-])cc1OCC 590851838 BQAQCGVCVNSSTL-UHFFFAOYSA-N 476.489 5.465 5 20 JKBD O=C(NCCc1ccc2ccccc2c1)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 603879616 HSIZVEPTPUXZIA-UHFFFAOYSA-N 471.479 5.342 5 20 JKBD Cc1ccc(NC(=O)C(C)C)cc1NC(=O)c1ccc(N2C[C@@H](C)C[C@@H](C)C2)c([N+](=O)[O-])c1 603895814 ZFMKIISKTADPCT-CALCHBBNSA-N 452.555 5.232 5 20 JKBD CN(CCCc1cc(-c2ccc(F)cc2)no1)C(=O)CSc1ccc(C(F)(F)F)cc1[N+](=O)[O-] 604570464 XVRFSWNWBCICCM-UHFFFAOYSA-N 497.470 5.591 5 20 JKBD O=[N+]([O-])c1ccc(-c2ccc(CNCC3(c4ccccc4)CCOCC3)o2)c(Br)c1 608836354 OWOZQRDTIUVLFC-UHFFFAOYSA-N 471.351 5.455 5 20 JKBD Cc1sc(NC(=O)c2cnc(Cc3ccc(F)cc3)s2)nc1-c1cccc([N+](=O)[O-])c1 608896234 QTTXDMLSXAWGOF-UHFFFAOYSA-N 454.508 5.465 5 20 JKBD Cc1nc(-c2ccc(F)cc2)sc1[C@@H](C)N[C@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 609221879 HGPVZWDQPDAKLX-DGCLKSJQSA-N 496.486 5.862 5 20 JKBD Cc1cc(C(=O)N(Cc2nnc(-c3cccc([N+](=O)[O-])c3)o2)C(C)C)sc1-c1cccc(Cl)c1 726500187 SHNXMUSBZBICRG-UHFFFAOYSA-N 496.976 6.386 5 20 JKBD Cc1ccc(NC(=O)c2ccc(Nc3ccc(NC(=O)[C@H]4CCCO4)cc3)c([N+](=O)[O-])c2)cc1 727431426 PXQCSMJPIAYNPL-HSZRJFAPSA-N 460.490 5.017 5 20 JKBD CCOC(=O)/C(=C/c1ccc(-c2cccc([N+](=O)[O-])c2)s1)c1nc(O)c2c(C)c(C)sc2n1 728699939 JLEFDWQAXZRTCH-GZTJUZNOSA-N 481.555 5.754 5 20 JKBD O=C(COC(=O)c1sccc1-c1ccc(F)cc1)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 744608742 VQFBRLSMCFVSFQ-UHFFFAOYSA-N 468.384 5.277 5 20 JKBD CCCOc1ccc(-c2nc(C(=O)O[C@@H](C)c3nnc(-c4ccc([N+](=O)[O-])cc4)o3)cs2)cc1 750276100 NTQQMTDCLYJFMM-AWEZNQCLSA-N 480.502 5.475 5 20 JKBD O=[N+]([O-])c1ccccc1C1=NO[C@@H](c2nc(-c3cc(Br)cc(Br)c3)no2)C1 904914258 LLYIIVUHDPFVPU-OAHLLOKOSA-N 494.099 5.036 5 20 JKBD C[C@H](Nc1ccc(-c2nc(-c3ccccc3Br)no2)cc1[N+](=O)[O-])c1ccccn1 904967048 VRGLVGFOXKDMKT-ZDUSSCGKSA-N 466.295 5.642 5 20 JKBD CCOC(=O)/C(=C/c1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1)c1nc(O)c2c(C)c(C)sc2n1 916127018 VMJLIOBKABKXOJ-MHWRWJLKSA-N 499.932 5.939 5 20 JKBD Cc1ccc(NC(=O)[C@H](OC(=O)[C@H]2CCC[C@@H](C(F)(F)F)C2)c2ccccc2)c([N+](=O)[O-])c1 919372402 YGJWHACOHYKUCH-SQGPQFPESA-N 464.440 5.495 5 20 JKBD Cc1c(C(=O)NC2(c3ccc(NC(=O)c4ccns4)cc3)CCC2)cc(Cl)cc1[N+](=O)[O-] 1787205051 QSGQUFIDKHELJC-UHFFFAOYSA-N 470.938 5.075 5 20 JKBD O=C(CCc1cccc([N+](=O)[O-])c1)NC1(c2ccc(NC(=O)c3ccc4cnccc4c3)cc2)CCC1 1789010650 RBAPHIVIKMXCNM-UHFFFAOYSA-N 494.551 5.524 5 20 JKBD C/C(=C\c1ccc(C)o1)C(=O)Nc1ccc(C2(NC(=O)Cc3cc(F)ccc3[N+](=O)[O-])CCC2)cc1 1789586012 JFGBJSCNYCZXRF-SAPNQHFASA-N 491.519 5.415 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)c3ccc([N+](=O)[O-])[nH]3)CCC2)cc1)c1ccc(F)c(C(F)(F)F)c1 1792173255 DDGQHSMAKPCTPL-UHFFFAOYSA-N 490.413 5.142 5 20 JKBD O=C(/C=C/c1ccccc1[N+](=O)[O-])N1CCC2(CCCN(C(=O)Cc3ccc4ccccc4c3)C2)CC1 1809128606 ZULQDUZLBCETJN-OUKQBFOZSA-N 497.595 5.235 5 20 JKBD CCc1ccc(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)CSc3ccccc3[N+](=O)[O-])CC2)cc1 1830072696 HQEAISHEZCQHHK-HSZRJFAPSA-N 495.645 5.183 5 20 JKBD O=C(c1ccc2ccoc2c1)N1CCC([C@H]2CCCCN2C(=O)c2cc(F)cc([N+](=O)[O-])c2)CC1 1830617472 CABXLCQVOMLSQR-HSZRJFAPSA-N 479.508 5.027 5 20 JKBD C[C@H](OC(=O)c1ccc(SC(F)F)cc1)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 10766009 CYRLUAIFJHQLLE-VIFPVBQESA-N 464.368 5.112 5 20 JKBD COc1cc([C@H]2Nc3ccccc3C(=O)N2Cc2ccco2)ccc1OCc1ccc([N+](=O)[O-])cc1 15248857 YNCWXYYDMIFIQH-SANMLTNESA-N 485.496 5.542 5 20 JKBD CCOc1cc([N+](=O)[O-])c(C(=O)Nc2nc(-c3ccc(Cl)cc3Cl)cs2)cc1OC 19358130 DQDCQZNNJUPSBH-UHFFFAOYSA-N 468.318 5.685 5 20 JKBD C[C@@H](Sc1nnc(-c2cccc(Cl)c2)o1)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 21548168 LEZLVTYCHAIMFM-SECBINFHSA-N 472.832 5.436 5 20 JKBD COC(=O)c1ccc2c(O)nc(/C(Cl)=C/c3ccc(-c4ccccc4[N+](=O)[O-])s3)nc2c1 25889362 OOKIXYZSUGJGDT-WJDWOHSUSA-N 467.890 5.496 5 20 JKBD CC(=O)c1ccc(Sc2nnc([C@H](C)N3CCCCC3)n2-c2ccccc2)c([N+](=O)[O-])c1 29004785 GDVQPGITMREOTD-INIZCTEOSA-N 451.552 5.076 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1)c1ccc(-n2nc(SCc3ccccc3)sc2=S)cc1 36774302 GUOLVGUYVNSOLX-UHFFFAOYSA-N 480.596 6.116 5 20 JKBD Cc1sc(NC(=O)c2cccc(CS(=O)(=O)c3ccccc3)c2)nc1-c1cccc([N+](=O)[O-])c1 195704372 SVTOOYOOFWNRNN-UHFFFAOYSA-N 493.566 5.253 5 20 JKBD COc1ccccc1[C@@H](NC(=O)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1)c1nccn1C 248124678 HBRSQUQPZMCXNM-HSZRJFAPSA-N 492.919 5.302 5 20 JKBD C[C@H]1CN(c2ccccc2NC(=O)c2ccc(N[C@H](C)c3ccccn3)c([N+](=O)[O-])c2)C[C@@H](C)O1 410054356 JSBSFADXTMVWJA-CEXWTWQISA-N 475.549 5.029 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)Nc2nc3ccc(Oc4ccccc4)cc3s2)cc1SC 482190271 BXEHEXFGKSZVKM-UHFFFAOYSA-N 467.528 5.980 5 20 JKBD CC(=O)N[C@H](C)CCc1ccc(C(=O)CSc2nc3ccccc3c3nc4ccccc4n23)cc1 495373681 HGXUIAUIKDXRQT-GOSISDBHSA-N 482.609 5.468 5 20 JKBD Cc1cc(C(=O)N2CCCC[C@@H]2C)ccc1NC(=O)c1csc(-c2cccc([N+](=O)[O-])c2)n1 495495653 VLSYYSNZISSVRY-INIZCTEOSA-N 464.547 5.294 5 20 JKBD O=C(Nc1ccccc1)Nc1ccc(C(=O)N(Cc2ccccc2[N+](=O)[O-])CC(F)(F)F)cc1 504323167 ALXFEWWHMPBUQB-UHFFFAOYSA-N 472.423 5.444 5 20 JKBD CSc1ccc(C(=O)N(C)[C@H]2CCSc3ccc(Br)cc32)cc1[N+](=O)[O-] 504591229 GDXHFZJBIBLBIS-AWEZNQCLSA-N 453.383 5.388 5 20 JKBD CCN(C(=O)c1cc(OC)ccc1[N+](=O)[O-])[C@H]1CCSc2ccc(Br)cc21 504606345 MVSOMUUEJBHZNO-INIZCTEOSA-N 451.342 5.065 5 20 JKBD Cc1nnc(Sc2ccc(NC(=O)[C@H](C)Oc3ccc(Cl)cc3[N+](=O)[O-])c(C)c2)s1 505894302 RUTIPWGWGLFVOL-NSHDSACASA-N 464.956 5.274 5 20 JKBD C[C@H](Nc1ccc(C(=O)NC(c2ccccc2)c2ccccc2)cc1[N+](=O)[O-])c1ccccn1 506054784 BQRWWCBSPWXQKP-IBGZPJMESA-N 452.514 5.682 5 20 JKBD CSc1ccc(C(=O)NCC2(c3ccc(Cl)cc3Cl)CCOCC2)cc1[N+](=O)[O-] 508759453 SHOHJEFFACCSKL-UHFFFAOYSA-N 455.363 5.102 5 20 JKBD O=[N+]([O-])c1cc(CNCc2ccc(-n3ccnc3)c(F)c2)ccc1Oc1ccccc1Cl 509621052 SIGCOUBVTMAJCQ-UHFFFAOYSA-N 452.873 5.655 5 20 JKBD COc1ccc2cc(CN(C)C(=O)c3cc(OC)c(OCc4cscn4)cc3[N+](=O)[O-])ccc2c1 509912653 NUNFCIJSGWKFKN-UHFFFAOYSA-N 493.541 5.073 5 20 JKBD CCOc1ccccc1CN[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Br)c1ccccc1 513184072 QADQJUSTUCCAPK-JOCHJYFZSA-N 484.350 5.226 5 20 JKBD COc1cc(C(=O)Nc2ccc3[nH]c(-c4ccc(F)cc4)nc3c2)c([N+](=O)[O-])cc1OC(F)F 518243803 ASLDPWCDNFLKFN-UHFFFAOYSA-N 472.379 5.140 5 20 JKBD COc1cc(C(=O)Nc2ccc(N[C@H](C)c3ccccc3)cc2)c([N+](=O)[O-])cc1OC(F)F 518863968 KKDQJQRBFCARRE-CQSZACIVSA-N 457.433 5.630 5 20 JKBD O=C(c1ccccc1Sc1ccc(C(F)(F)F)cc1[N+](=O)[O-])N1CCC(N2CCCCC2)CC1 520166199 HLDIGRYLMKYDTM-UHFFFAOYSA-N 493.551 5.855 5 20 JKBD Cc1ncsc1CN(C)C(=O)c1c2c(nc3ccccc13)/C(=C\c1ccc([N+](=O)[O-])cc1)CCC2 520892606 KLZHMPZJAMQJCU-RGEXLXHISA-N 484.581 6.057 5 20 JKBD CC(=O)Nc1cccc([C@@H](C)N(Cc2ccccc2)C(=O)c2ccc(N3CCCC3)c([N+](=O)[O-])c2)c1 591353013 CFTCVZZJUPEPLZ-HXUWFJFHSA-N 486.572 5.557 5 20 JKBD COc1cc(C)c(NC(=O)c2ccccc2C(=O)c2ccc(SC)c([N+](=O)[O-])c2)cc1OC 603457689 CAQHVKYCWWTGQN-UHFFFAOYSA-N 466.515 5.126 5 20 JKBD COc1cc(C(=O)Nc2nc(-c3ccccc3)c(C)s2)c([N+](=O)[O-])cc1OCc1cscn1 604380393 SSEWZLSVYOJUDJ-UHFFFAOYSA-N 482.543 5.323 5 20 JKBD CCN(C[C@H]1CCOC1)C(=O)C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1 604440389 TWRHSCAWARESCH-UIMCMNAESA-N 451.548 5.020 5 20 JKBD O=C(CSc1ccc(C(F)(F)F)cc1[N+](=O)[O-])N(Cc1ccsc1)c1cccnc1 608799125 LHIWWOUSMHHNNU-UHFFFAOYSA-N 453.467 5.396 5 20 JKBD O=C(Cc1ccc([N+](=O)[O-])cc1)Nc1ccccc1OCc1ncc(-c2cccc(Cl)c2)o1 608851066 QOXKOTHUBADPME-UHFFFAOYSA-N 463.877 5.663 5 20 JKBD CN(C(=O)c1ccc(C(=O)N(C)[C@@H]2CCc3ccccc32)cc1[N+](=O)[O-])[C@H]1CCc2ccccc21 609043777 RIBFGLVRKIRKSW-RPBOFIJWSA-N 469.541 5.114 5 20 JKBD Cc1nc(-c2ccc(F)cc2)sc1[C@H](C)N[C@@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 609221878 HGPVZWDQPDAKLX-AAEUAGOBSA-N 496.486 5.862 5 20 JKBD COCCOc1cc([N+](=O)[O-])c(C(=O)Nc2nc3ccc(Oc4ccccc4)cc3s2)cc1OC 619564041 IFLGJFNKYLBSPP-UHFFFAOYSA-N 495.513 5.283 5 20 JKBD O=C(Cn1c2ccccc2c(=O)c2ccccc21)Nc1ccc2nc(N3CCCC3)sc2c1 653765281 JKBOIHVZMICCTL-UHFFFAOYSA-N 454.555 5.003 5 20 JKBD CC(C)(C)OC(=O)Nc1ccc(CC(=O)N(CC2CC2)c2ccc(Cl)c([N+](=O)[O-])c2)cc1 728166226 WRXFSCUDPZEBBL-UHFFFAOYSA-N 459.930 5.581 5 20 JKBD Cc1nn(Cc2ccc(C(=O)Nc3ccc(Oc4ccc(F)cc4)cn3)cc2)c(C)c1[N+](=O)[O-] 729379516 NDFWWTHTCULBHF-UHFFFAOYSA-N 461.453 5.035 5 20 JKBD C[C@@H](OC(=O)CCc1nc2cc(C(F)(F)F)ccc2s1)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 730606357 DQMPMUUVGSFFDW-LLVKDONJSA-N 492.435 5.510 5 20 JKBD CC(=O)N(c1ccc(C)c(C)c1)c1nc(COC(=O)Cn2ccc3cc([N+](=O)[O-])ccc32)cs1 744615948 HCQFRMDHCCKROF-UHFFFAOYSA-N 478.530 5.051 5 20 JKBD C[C@@H](OC(=O)c1csc(-c2ccc([N+](=O)[O-])cc2)n1)C(=O)N[C@H](C)c1ccc(Cl)cc1Cl 747955582 AUXRBLCQZVTFTH-VXGBXAGGSA-N 494.356 5.448 5 20 JKBD COc1cc(CN2CCC(c3nc(C(C)(C)C)cs3)CC2)c([N+](=O)[O-])cc1OC(F)F 750061239 INDSFVAHVWQIET-UHFFFAOYSA-N 455.527 5.338 5 20 JKBD COc1cc(C(=O)Nc2ccc(/C=C\C(=O)O)cc2)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 914730686 IBAGDXHCTIQQAJ-WCIBSUBMSA-N 468.849 5.399 5 20 JKBD CC(=O)N(c1nc(/C=C2\C(=O)Nc3cc(Cl)c([N+](=O)[O-])cc32)cs1)c1ccc(F)cc1F 915115105 WZJVBTLPQCXRKN-ACAGNQJTSA-N 476.848 5.160 5 20 JKBD Cc1cc(C(=O)Oc2ccc(NC(=O)c3cc([N+](=O)[O-])ccc3Cl)cc2)nn1-c1ccccc1 915811595 YEIQIUVRPWFIGY-UHFFFAOYSA-N 476.876 5.214 5 20 JKBD C[C@@H](OC(=O)c1nc(-c2ccccc2)cs1)C(=O)Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1 919122739 KVFINACNZPLBGC-CYBMUJFWSA-N 480.527 5.026 5 20 JKBD C[C@@H](Nc1ccc(C(=O)O[C@H](Cn2cncn2)c2ccc(Cl)cc2)cc1[N+](=O)[O-])c1ccccn1 920772882 CFDWVHGNLVIQGA-WAIKUNEKSA-N 492.923 5.006 5 20 JKBD Cc1cc(C)nc(C(=O)NC2(c3ccc(NC(=O)Cn4ccc5ccc([N+](=O)[O-])cc54)cc3)CCC2)c1 1786277053 FHLYLJKUBRFJNL-UHFFFAOYSA-N 497.555 5.009 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)c3cccc4cc[nH]c34)CCC2)cc1)c1nc2cc([N+](=O)[O-])ccc2[nH]1 1790827705 MZQLAALUTJENOL-UHFFFAOYSA-N 494.511 5.014 5 20 JKBD Cc1cc(C)nc(C(=O)NC2(c3ccc(NC(=O)/C=C/c4ccccc4[N+](=O)[O-])cc3)CCC2)c1 1792317792 NMKNCIKYIVNKKV-MDWZMJQESA-N 470.529 5.068 5 20 JKBD Cc1c(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)[C@@H](C)Cc3ccco3)[nH]n2)cc(Cl)cc1[N+](=O)[O-] 1821294953 YACUTYJXGRCZOY-XOBRGWDASA-N 499.955 5.057 5 20 JKBD Cc1csc(CCC(=O)N2CCCC[C@@H]2C2CCN(C(=O)CCc3cccc([N+](=O)[O-])c3)CC2)c1 1825204710 RYPXGABLIFXSQC-RUZDIDTESA-N 497.661 5.150 5 20 JKBD CCCOc1ccc(C(=O)N2CCCC[C@H]2C2CCN(C(=O)c3cc(F)cc([N+](=O)[O-])c3)CC2)cc1 1830102835 MNQXIZBZTHHPCW-VWLOTQADSA-N 497.567 5.070 5 20 JKBD O=C(C1CCC(F)(F)CC1)N1CCC([C@H]2CCCCN2C(=O)/C=C/c2ccccc2[N+](=O)[O-])CC1 1832899640 DOUHTRSVIAOXPG-HYGBKTPJSA-N 489.563 5.053 5 20 JKBD CCOc1ccc(CN(C)C(=O)Cc2cn(-c3ccccc3)nc2-c2ccc([N+](=O)[O-])cc2)cc1 18074240 JCGROPUGIXBCFP-UHFFFAOYSA-N 470.529 5.047 5 20 JKBD CCc1ccccc1NC(=O)[C@@H](C)OC(=O)c1ccccc1C(=O)c1ccc(Cl)c([N+](=O)[O-])c1 22669874 XAJPWAZLRJXRGU-OAHLLOKOSA-N 480.904 5.226 5 20 JKBD CC(C)(C)SCC(=O)O[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Br)c1ccccc1 22721230 BTKXLKPIYJCOOF-SFHVURJKSA-N 481.368 5.112 5 20 JKBD COc1cccc(-c2nnc(S[C@@H](C)C(=O)Nc3cccc([N+](=O)[O-])c3C)n2-c2ccccc2)c1 24003042 BLHXBRODMSADKL-KRWDZBQOSA-N 489.557 5.279 5 20 JKBD O=C(C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)Nc1ccc(Cn2cncn2)cc1 24634314 KJMWUGRATZHUED-MOSHPQCFSA-N 496.552 5.414 5 20 JKBD O=C1CSc2ccc(N[C@H](C(=O)Nc3ccc([N+](=O)[O-])cc3Cl)c3ccccc3)cc2N1 25702115 XAXQQRXDTQOTMK-NRFANRHFSA-N 468.922 5.084 5 20 JKBD COc1cc(C)c(CN(C)C(=O)c2ccc(Sc3nc(C)cs3)c([N+](=O)[O-])c2)cc1OC 25763439 WWFUVWDWNJVYER-UHFFFAOYSA-N 473.576 5.109 5 20 JKBD COc1ccc(Cn2c(S[C@@H](C)c3cccc([N+](=O)[O-])c3)nc3ccccc3c2=O)cc1OC 26591657 CEJHCOZUFDIFIH-INIZCTEOSA-N 477.542 5.224 5 20 JKBD Cc1cc(C(=O)NC2CCCC2)ccc1NC(=O)c1ccc(N2CCC(C)CC2)c([N+](=O)[O-])c1 302998947 HTTWFROCVFJFJJ-UHFFFAOYSA-N 464.566 5.064 5 20 JKBD C[C@H]1CCCCN1C(=O)c1ccc(NC(=O)c2ccc(N[C@H](C)c3ccccn3)c([N+](=O)[O-])c2)cc1 303007861 OCZSABKQBQGLBL-RBUKOAKNSA-N 487.560 5.430 5 20 JKBD Cc1oc2nc(SCc3cc([N+](=O)[O-])cc4c3OCOC4)nc(NC(=O)c3ccccc3)c2c1C 485051361 XGJYUIJPCSCWRW-UHFFFAOYSA-N 492.513 5.159 5 20 JKBD CC(C)n1ncc2c(C(=O)N(Cc3ccccc3[N+](=O)[O-])CC(F)(F)F)cc(-c3ccco3)nc21 486065356 AZTQLGNHZYXRBW-UHFFFAOYSA-N 487.438 5.385 5 20 JKBD Cc1nc([N+](=O)[O-])cn1CCC(=O)N(Cc1ccc(F)cc1)c1nc(-c2ccccc2Cl)cs1 488820985 ACDWTUIAWLLEJO-UHFFFAOYSA-N 499.955 5.639 5 20 JKBD O=C(Nc1cc(C(F)(F)F)cnc1O)c1cc([N+](=O)[O-])ccc1Sc1ccc(Cl)cc1 499552145 JHUIZTCUBWQPNI-UHFFFAOYSA-N 469.828 5.771 5 20 JKBD Cc1c(NC(=O)c2cc([N+](=O)[O-])ccc2Sc2ccccc2)cccc1C(=O)N1CCCC1 499554823 DKKBSDLOHOKIBU-UHFFFAOYSA-N 461.543 5.543 5 20 JKBD CSc1ccc(C(=O)c2ccccc2C(=O)Nc2cc(C)nc(C(C)C)n2)cc1[N+](=O)[O-] 502756611 QDUKDMJSFPDXSJ-UHFFFAOYSA-N 450.520 5.022 5 20 JKBD O=C(CSc1ccc(C(F)(F)F)cc1[N+](=O)[O-])N[C@@H](c1ccccc1)c1nccs1 505048055 LALLOICTLPNKCS-KRWDZBQOSA-N 453.467 5.068 5 20 JKBD Cc1cc(C)n(-c2cccc(NC(=O)c3ccc(N[C@H](C)c4ccccn4)c([N+](=O)[O-])c3)c2)n1 507053724 PHFDCMBJDUZALL-GOSISDBHSA-N 456.506 5.218 5 20 JKBD Cc1nn(-c2cccc(C(F)(F)F)c2)c(C)c1C(=O)C(=O)N(Cc1ccc([N+](=O)[O-])cc1)C(C)C 511504874 BSRCRTWPRHLOEP-UHFFFAOYSA-N 488.466 5.036 5 20 JKBD CS(=O)(=O)c1cccc(NC(=O)C/C(=C\c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)c1 512445393 ZQMVAQZHBQFJJD-GHRIWEEISA-N 493.566 5.177 5 20 JKBD CC(=O)Nc1ccc(C(F)(F)F)cc1NC(=O)c1ccc(N2C[C@@H](C)C[C@H](C)C2)c([N+](=O)[O-])c1 521239565 WRSOBBUEAHUQSF-KBPBESRZSA-N 478.471 5.307 5 20 JKBD CC(C)N(C)CC1CCN(C(=O)c2cc([N+](=O)[O-])ccc2Sc2ccc(Cl)cc2)CC1 521254262 QCTUDNFXDZXRHT-UHFFFAOYSA-N 462.015 5.592 5 20 JKBD COc1ccccc1CN(C)C(=O)C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1 603468550 KLSNGLPDAYIXPP-HMMYKYKNSA-N 473.554 5.802 5 20 JKBD COCCN(C(=O)c1ccc(OC2CCCC2)cc1)c1nc(-c2ccc([N+](=O)[O-])cc2)cs1 603563552 SGZMDKKBLMITLJ-UHFFFAOYSA-N 467.547 5.333 5 20 JKBD Cc1sc2ncnc(Sc3ccccc3C(=O)N[C@H](C)c3cccc([N+](=O)[O-])c3)c2c1C 603965980 UAZMSHIUIGCCOG-CQSZACIVSA-N 464.572 5.859 5 20 JKBD CCOc1cc(C)ccc1NC(=O)Cc1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1 603978363 AUEQAMNJDOFNQU-UHFFFAOYSA-N 456.502 5.336 5 20 JKBD Cc1nn(Cc2ccc(C(=O)Nc3ccccc3COc3ccccc3)cc2)c(C)c1[N+](=O)[O-] 604023207 VDNPYPRJZCNFDR-UHFFFAOYSA-N 456.502 5.288 5 20 JKBD C[C@@H](Nc1ccc(C(=O)NCCc2c[nH]c3cc(Cl)ccc23)cc1[N+](=O)[O-])c1ccccn1 604487026 KUTRAKUBPGHPQL-OAHLLOKOSA-N 463.925 5.270 5 20 JKBD CCOc1cc(C(=O)N[C@@H](C)c2ccc(OCc3cccc(C)c3)cc2)c([N+](=O)[O-])cc1OC 609033094 LKRNWQVFNKNNNK-SFHVURJKSA-N 464.518 5.381 5 20 JKBD COc1cc2c(cc1NC(=O)COC(=O)c1cc([N+](=O)[O-])ccc1Br)oc1ccccc12 725984284 GOMHSXSFLNFBRZ-UHFFFAOYSA-N 499.273 5.061 5 20 JKBD Cc1csc(Sc2ccc(NC(=O)c3cc([N+](=O)[O-])c(C)c([N+](=O)[O-])c3C)c(C)c2)n1 726756923 RHHIXYRVVHWSOX-UHFFFAOYSA-N 458.521 5.597 5 20 JKBD Cc1c(C(=O)Nc2ccc(Oc3ccc(F)cc3)c3ccncc23)cc([N+](=O)[O-])cc1[N+](=O)[O-] 727801199 ZHHQMGGAHQPYJV-UHFFFAOYSA-N 462.393 5.543 5 20 JKBD CN(C(=O)OC(C)(C)C)C1CCN(C(=O)c2cc([N+](=O)[O-])ccc2Sc2ccccc2)CC1 730559718 PNHXRXQEBDLRPW-UHFFFAOYSA-N 471.579 5.218 5 20 JKBD C[C@H](OC(=O)c1sccc1SC(F)F)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 730661122 RRDSRCFENYWLOL-ZETCQYMHSA-N 470.397 5.174 5 20 JKBD O=C(CSc1nc2cc(C(F)(F)F)ccc2s1)Nc1cc2c(cc1[N+](=O)[O-])OCCCO2 774357518 CATICPMZEJATTN-UHFFFAOYSA-N 485.465 5.115 5 20 JKBD O=[N+]([O-])c1cccc(-c2noc(CSc3nnc(Nc4ccc(SC(F)F)cc4)s3)n2)c1 914689671 WRLWPTLLVWXCOH-UHFFFAOYSA-N 494.530 5.847 5 20 JKBD CC1=C(C(=O)Nc2ccccc2)[C@@H](c2cc([N+](=O)[O-])c(F)cc2F)NC(=S)N1c1cccc(C)c1 916723650 NZYNYIRUZAWPFL-HSZRJFAPSA-N 494.523 5.530 5 20 JKBD COc1ccc(C)cc1NC(=O)[C@H](OC(=O)c1cc2cc([N+](=O)[O-])ccc2o1)c1ccccc1 917262974 HXKFCJCNIYFTCM-HSZRJFAPSA-N 460.442 5.195 5 20 JKBD O=C(NCc1cccnc1-n1ccnc1)c1ccccc1Sc1ccc(C(F)(F)F)cc1[N+](=O)[O-] 918043367 SQVMBMLLYQWPCQ-UHFFFAOYSA-N 499.474 5.276 5 20 JKBD C[C@@H](OC(=O)c1cc([N+](=O)[O-])ccc1Oc1ccccc1)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 919193631 ZCXPHJJIEIMESJ-CQSZACIVSA-N 476.401 5.263 5 20 JKBD COc1cccc([C@H](C)C(=O)O[C@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2ccccc2)c1 919733068 PHDIUFIAPXDZCI-NYHFZMIOSA-N 468.893 5.284 5 20 JKBD O=C(/C=C/c1ccc([N+](=O)[O-])o1)Nc1ccc(C2(NC(=O)[C@H](F)c3ccccc3)CCC2)cc1 1786205774 QCHDDEMSYWEVDE-ABSORMQESA-N 463.465 5.046 5 20 JKBD O=C(NC1(c2ccc(NC(=O)[C@@H]3CCCCC3(F)F)cc2)CCC1)c1ccc([N+](=O)[O-])cc1F 1786464736 GQPJXDTVASZWFD-IBGZPJMESA-N 475.467 5.307 5 20 JKBD Cc1ccc(CC(=O)NC2(c3ccc(NC(=O)c4cccc5cnccc45)cc3)CCC2)cc1[N+](=O)[O-] 1789328098 LYNIJIXTXCKDBP-UHFFFAOYSA-N 494.551 5.442 5 20 JKBD C/C(=C\c1ccc(C)o1)C(=O)Nc1ccc(C2(NC(=O)c3cc(F)cc([N+](=O)[O-])c3)CCC2)cc1 1789585487 GQHWJWHYNUFNEL-FOWTUZBSSA-N 477.492 5.487 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)[C@@H]3CCCCC3(F)F)CCC2)cc1)c1cc(F)cc([N+](=O)[O-])c1 1790695948 XHAZOBSZMKPOCO-FQEVSTJZSA-N 475.467 5.307 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)c3ncccc3F)CCC2)cc1)c1cc2cc([N+](=O)[O-])ccc2s1 1791010741 UJXMAHYDPMJXSI-UHFFFAOYSA-N 490.516 5.405 5 20 JKBD O=C(NC1(c2ccc(NC(=O)C34CCC(CC3)CC4)cc2)CCC1)c1ccc(O)c([N+](=O)[O-])c1 1791981061 WBZXVMHUGTUJRC-UHFFFAOYSA-N 463.534 5.019 5 20 JKBD O=C(c1cc2cc([N+](=O)[O-])ccc2s1)N1CCC2(CCCN(C(=O)[C@@H]3CCC(F)(F)C3)C2)CC1 1804776120 VWDBVNIDRWDQAQ-MRXNPFEDSA-N 491.560 5.090 5 20 JKBD CC(C)Cc1ccc(C(=O)N2CCC3(CCCN(C(=O)Cc4cc([N+](=O)[O-])ccc4F)C3)CC2)cc1 1806657449 ZFVXTYYRYGUCHT-UHFFFAOYSA-N 495.595 5.020 5 20 JKBD O=C(CCc1cccc([N+](=O)[O-])c1)Nc1cc([C@@H]2CCCCN2C(=O)c2cccc3ccccc23)[nH]n1 1815537378 XCPFVMJRGMTDNE-VWLOTQADSA-N 497.555 5.410 5 20 JKBD O=C(CSc1ccccc1[N+](=O)[O-])N1CCC([C@@H]2CCCCN2C(=O)/C=C/c2cccs2)CC1 1827080547 IRMKFPVLTUHQHF-ZJVMWOEPSA-N 499.658 5.082 5 20 JKBD O=C(c1cccc2ccccc12)N1CCC([C@H]2CCCCN2C(=O)c2cc(F)cc([N+](=O)[O-])c2)CC1 1830616992 JHLCEBNBNKWHNY-AREMUKBSSA-N 489.547 5.434 5 20 JKBD O=C(c1cccc(F)c1)N1CCC([C@H]2CCCCN2C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)CC1 1831060687 FJIYPLNXIBMSBO-JOCHJYFZSA-N 495.576 5.496 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)N1CCC([C@@H]2CCCCN2C(=O)C[C@@H]2C[C@@H]3CC[C@H]2C3)CC1 1831482705 UUCLOTPIQCPQJN-HBDUWURDSA-N 485.600 5.102 5 20 JKBD CC1=CC[C@@H](C(=O)N2CCC([C@@H]3CCCCN3C(=O)CSc3ccccc3[N+](=O)[O-])CC2)CC1 1831776117 JDNKQHSFONKPNU-YADHBBJMSA-N 485.650 5.053 5 20 JKBD CCCCn1c(SCC(=O)Nc2ccc([N+](=O)[O-])cc2Cl)nc2sc(C)c(C)c2c1=O 8646020 VQQJVTXLONGLKG-UHFFFAOYSA-N 480.999 5.167 5 20 JKBD CCc1ccc(N(C(C)=O)c2nc(COC(=O)CSc3ccc([N+](=O)[O-])cc3)cs2)cc1 9352148 JSPMGXUZMBUQOI-UHFFFAOYSA-N 471.560 5.134 5 20 JKBD Cc1csc(SCc2ccccc2C(=O)O[C@@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)n1 9622393 UQWJTZHEJMZKNM-ZDUSSCGKSA-N 491.978 5.489 5 20 JKBD COc1cc(CSc2nnc(-c3cccs3)n2C2CC2)c([N+](=O)[O-])cc1OC(F)F 11075297 NWQKZWWRNJEZOL-UHFFFAOYSA-N 454.480 5.152 5 20 JKBD CCn1c(SCC(=O)Nc2cc([N+](=O)[O-])ccc2Cl)nnc1-c1ccc(C(C)(C)C)cc1 14101563 DKSWDRWOFSXYIK-UHFFFAOYSA-N 473.986 5.555 5 20 JKBD C[C@H](Sc1nnc(Cc2cccs2)n1-c1ccccc1)C(=O)Nc1ccc(F)c([N+](=O)[O-])c1 17758436 JIBGBNMPDWAJDS-AWEZNQCLSA-N 483.550 5.086 5 20 JKBD O=C(OCc1cc([N+](=O)[O-])cc2c1OCOC2)c1ccccc1-c1ncc(-c2ccccc2)o1 19165027 OJMAOTFKCAXUET-UHFFFAOYSA-N 458.426 5.140 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Br)[C@@H](N[C@@H]1CCSc2ccccc21)c1ccccc1 19669654 KRFYFFDLYRXCNM-KNQAVFIVSA-N 498.402 5.864 5 20 JKBD O=C(Nc1cccc(-c2nnco2)c1)c1ccccc1Sc1ccc(C(F)(F)F)cc1[N+](=O)[O-] 24739377 UGHICNJXUDXCFD-UHFFFAOYSA-N 486.431 6.067 5 20 JKBD Cc1nn(CC(C)C)c(C)c1CC(=O)Oc1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2Cl)cc1 29478317 JJRVUXRWGCJNHF-UHFFFAOYSA-N 484.940 5.118 5 20 JKBD Cc1nn(Cc2ccc(C(=O)Nc3ccc(N(C)Cc4ccccc4)cc3)cc2)c(C)c1[N+](=O)[O-] 71983103 KWPNMSRFLIHOOW-UHFFFAOYSA-N 469.545 5.345 5 20 JKBD CCC(=O)Nc1ccc(NC(=O)c2ccc(NCc3ccccc3Cl)c([N+](=O)[O-])c2)cc1 107915574 FARKVDZGSYFDFE-UHFFFAOYSA-N 452.898 5.461 5 20 JKBD Cc1csc(CCCCNC(=O)c2ccccc2NC(=O)c2ccc([N+](=O)[O-])cc2Cl)n1 110514877 YUWUXHPKJASYBA-UHFFFAOYSA-N 472.954 5.018 5 20 JKBD C[C@H](Nc1ccc(C(=O)Nc2ccc(CCN3CCSCC3)cc2)cc1[N+](=O)[O-])c1ccccn1 489461150 XWZKDMUDHJIXND-IBGZPJMESA-N 491.617 5.007 5 20 JKBD CC(C)CCSc1ccc(C(=O)Nc2ccc(N3CCOCC3)cc2C(F)(F)F)cc1[N+](=O)[O-] 499821112 VVQBUUVYYZBKPI-UHFFFAOYSA-N 497.539 5.841 5 20 JKBD O=C(NCC1(c2cccc(C(F)(F)F)c2)CCOCC1)c1csc(-c2ccc([N+](=O)[O-])cc2)n1 501931922 KJHRCOOYQORCSI-UHFFFAOYSA-N 491.491 5.215 5 20 JKBD C[C@@H](NC(=O)c1ccc(Sc2nncn2C)c([N+](=O)[O-])c1)c1ccc(Oc2ccccc2)cc1 506340310 OUEAQLMQEDJCJJ-MRXNPFEDSA-N 475.530 5.158 5 20 JKBD C[C@@H](Nc1ccc(C(=O)N(C)Cc2cccc(C(F)(F)F)c2)cc1[N+](=O)[O-])c1ccccn1 507402586 LMHOVLBOQZDRQH-OAHLLOKOSA-N 458.440 5.454 5 20 JKBD O=C(Nc1cc(Cl)ccc1OC[C@H]1CCCO1)c1ccc(NCc2ccccc2)c([N+](=O)[O-])c1 509807729 PPKPGTBYEJJHDU-HXUWFJFHSA-N 481.936 5.670 5 20 JKBD O=C(N[C@@H](c1ccccc1)c1ccc2nc(C(F)(F)F)[nH]c2c1)c1ccc([N+](=O)[O-])cc1Cl 514343822 ITEBVYSHLOJBLB-IBGZPJMESA-N 474.826 5.663 5 20 JKBD Cn1ccnc1[C@H](NCc1ccc(Oc2ccc(F)cc2)c([N+](=O)[O-])c1)c1cccc(F)c1 520209905 PFHQVIJSZWTWME-HSZRJFAPSA-N 450.445 5.278 5 20 JKBD COc1ccc(-c2ccc(CN[C@H](C)c3ccc(OCC(F)(F)F)cc3)o2)c([N+](=O)[O-])c1 520961984 LNDTVCBYTPCKCW-CQSZACIVSA-N 450.413 5.655 5 20 JKBD Cc1nn(CCC(=O)NCc2ccc(Oc3ccc(Oc4ccccc4)cc3)nc2)c(C)c1[N+](=O)[O-] 522569165 FLKSPRLXHLXVNG-UHFFFAOYSA-N 487.516 5.094 5 20 JKBD Cc1csc(Sc2ccc(C(=O)Nc3ccc(Sc4ncccn4)cc3C)cc2[N+](=O)[O-])n1 523706694 DPVACSDEBOLEQT-UHFFFAOYSA-N 495.611 6.013 5 20 JKBD O=C(C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)N1CCC[C@@H]1c1cccs1 603451595 INCROFYZWZOPDA-BKBDBRRMSA-N 475.595 6.560 5 20 JKBD Cc1ccc(NC(=O)Nc2ccccc2)cc1NC(=O)C1CCN(c2ccccc2[N+](=O)[O-])CC1 603660046 WIEJDISIGLLXEP-UHFFFAOYSA-N 473.533 5.402 5 20 JKBD CC(C)OC(=O)C[C@H](NC(=O)Nc1cccc(NC(=O)c2ccccc2)c1)c1ccccc1[N+](=O)[O-] 603696418 JSDVPHDARXZDNB-QFIPXVFZSA-N 490.516 5.052 5 20 JKBD O=C(Nc1ccnn1Cc1ccc(Cl)cc1Cl)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-] 603732757 AQGSDWDCZMRQOB-UHFFFAOYSA-N 489.237 5.340 5 20 JKBD O=C(Nc1ccc(Sc2nncs2)c(Cl)c1)c1csc(-c2cccc([N+](=O)[O-])c2)n1 609107694 QXXMMQNOEQNRTP-UHFFFAOYSA-N 475.964 5.627 5 20 JKBD CSc1ccsc1C(=O)O[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1 730639427 WERVMSPCAVXYQF-KRWDZBQOSA-N 462.936 5.568 5 20 JKBD COc1ccc(N2C(=S)N[C@H](c3ccc([N+](=O)[O-])o3)C(C(=O)Nc3cccc(Cl)c3)=C2C)cc1 812721655 ADIXHELCTMFWPJ-OAQYLSRUSA-N 498.948 5.198 5 20 JKBD Cc1cccc(N2CCN(Cc3ccc(NC(=O)c4cc(Cl)ccc4[N+](=O)[O-])cc3)CC2)c1 915182148 UMYCTHZXXXNYJT-UHFFFAOYSA-N 464.953 5.131 5 20 JKBD CCCc1noc2nc(-c3ccco3)cc(C(=O)O[C@@H](C)C(=O)Nc3ccc([N+](=O)[O-])cc3Cl)c12 920679314 FOBLTHAABNFSKD-LBPRGKRZSA-N 498.879 5.181 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)NC1(c2ccc(NC(=O)CCCc3ccncc3)cc2)CCC1 1786907865 DJNZZFBITNMLDT-UHFFFAOYSA-N 490.535 5.208 5 20 JKBD O=C(CCc1ccsc1)Nc1ccc(C2(NC(=O)c3cc(F)cc([N+](=O)[O-])c3)CCC2)cc1 1788187113 LASAADUJXHTBBI-UHFFFAOYSA-N 467.522 5.176 5 20 JKBD C[C@@H](Sc1cccs1)C(=O)Nc1ccc(C2(NC(=O)c3ccc([N+](=O)[O-])o3)CCC2)cc1 1789413150 AWLYDZIVAUYFTP-CQSZACIVSA-N 471.560 5.178 5 20 JKBD COc1cc(C(=O)Nc2ccc(C3(NC(=O)C45CCC(CC4)CC5)CCC3)cc2)c([N+](=O)[O-])cc1O 1790085260 RAHIITBBBCGZLE-UHFFFAOYSA-N 493.560 5.027 5 20 JKBD O=C(NC1(c2ccc(NC(=O)c3cccc(F)c3[N+](=O)[O-])cc2)CCC1)c1cc2[nH]ccc2s1 1790701333 MBNLEXNBKPGKFK-UHFFFAOYSA-N 478.505 5.338 5 20 JKBD O=C(NC1(c2ccc(NC(=O)c3cccc(F)c3[N+](=O)[O-])cc2)CCC1)c1ccoc1Cl 1790701640 ZJZPIYXQZGWIIF-UHFFFAOYSA-N 457.845 5.042 5 20 JKBD CC(C)=CCCC(=O)NC1(c2ccc(NC(=O)c3cc([N+](=O)[O-])ccc3N(C)C)cc2)CCC1 1790793280 RMNLLMKDVDNIRR-UHFFFAOYSA-N 464.566 5.155 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)[C@@H]3C[C@H]4CC[C@@H]3O4)CCC2)cc1)c1cc2cc([N+](=O)[O-])ccc2s1 1791010757 WCEDYDBEWGKWPP-NJYVYQBISA-N 491.569 5.125 5 20 JKBD CC(C)[C@@H](C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2ccc([N+](=O)[O-])[nH]2)n[nH]1)c1ccc(Cl)cc1 1820366102 AAZZCDZGTWODEC-SIKLNZKXSA-N 498.971 5.045 5 20 JKBD O=C(Nc1cc([C@@H]2CCCCN2C(=O)CCc2cccc([N+](=O)[O-])c2)[nH]n1)c1cccc(F)c1Cl 1821117537 NARNWLFLMNVBHB-FQEVSTJZSA-N 499.930 5.049 5 20 JKBD Cc1c(Cl)ccc(C(=O)N2CCC([C@@H]3CCCCN3C(=O)c3ccc([N+](=O)[O-])[nH]3)CC2)c1Cl 1829836240 VBTUTZHGBLJZFV-IBGZPJMESA-N 493.391 5.085 5 20 JKBD Cc1ccc([C@@H](C)C(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3cccc(F)c3[N+](=O)[O-])CC2)cc1 1831530674 VIAOTJJONSZORB-NTKDMRAZSA-N 481.568 5.079 5 20 JKBD O=C(CSc1nnc(-c2ccc(F)cc2)n1-c1ccccc1)Nc1cc([N+](=O)[O-])ccc1Cl 9998866 BPKOFDUYKUJSII-UHFFFAOYSA-N 483.912 5.366 5 20 JKBD Cc1ccc(-c2nnc(S[C@@H](C(=O)Nc3ccc(C)cc3[N+](=O)[O-])c3ccccc3)n2C)cc1 10263760 KHGPWXCYVPOBSG-JOCHJYFZSA-N 473.558 5.479 5 20 JKBD NC(=O)[C@H](OC(=O)C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)c1ccc(F)cc1 11002810 WLYHTBSBSSYGON-LQFJEPQRSA-N 491.500 5.044 5 20 JKBD Cc1nc(CSc2ccc(C(=O)OCC(=O)Nc3ccc([N+](=O)[O-])cc3Cl)cc2)cs1 11698427 KOJQBFISWVDUTM-UHFFFAOYSA-N 477.951 5.101 5 20 JKBD COc1ccccc1NC(=O)c1ccc(NC(=O)c2ccc(N3CCC(C)CC3)c([N+](=O)[O-])c2)cc1 15313627 DVCLRESDNOHQDP-UHFFFAOYSA-N 488.544 5.344 5 20 JKBD O=C(CNC(=O)c1cc([N+](=O)[O-])ccc1Sc1ccccc1)Nc1cc(Cl)ccc1Cl 15991095 IBNOKVVSECBCMC-UHFFFAOYSA-N 476.341 5.421 5 20 JKBD COc1cc2c(cc1OC)[C@H](c1ccccc1)N(C(=O)c1ccc(Cl)c([N+](=O)[O-])c1)CC2 16002230 SPVKLUFEZQXENH-QHCPKHFHSA-N 452.894 5.053 5 20 JKBD O=C(CSc1nnc(-c2ccccc2Cl)n1C1CCCC1)N1CCc2cc([N+](=O)[O-])ccc21 16555530 LJHZXCISBXEDGG-UHFFFAOYSA-N 483.981 5.303 5 20 JKBD C[C@H](OC(=O)c1cc2sc3ccccc3c2s1)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 18655934 PCCYGVAPTKOAIG-NSHDSACASA-N 451.485 5.992 5 20 JKBD C[C@H](Oc1ccccc1)C(=O)O[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Br)c1ccccc1 28302497 FTMVMMUGZPPFBO-YCRPNKLZSA-N 499.317 5.048 5 20 JKBD COc1cc([C@H](C)N[C@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2C(F)(F)F)ccc1OC(C)C 30492585 KQFNGIHAGLQYQQ-UONOGXRCSA-N 469.460 5.087 5 20 JKBD COc1ccc(Oc2ccc([N+](=O)[O-])cc2C(=O)N2CCC(C(=O)c3ccc(OC)cc3)CC2)cc1 30892819 LPFWXPZHFBORRF-UHFFFAOYSA-N 490.512 5.139 5 20 JKBD COc1ccc(-n2c(SCC(=O)Nc3ccccc3[N+](=O)[O-])nnc2-c2ccccc2Cl)cc1 36185843 XAVJUPXVBAGKRQ-UHFFFAOYSA-N 495.948 5.235 5 20 JKBD O=C(COc1ccc([N+](=O)[O-])cc1C(F)(F)F)N[C@H](c1ccc(F)cc1)c1cccs1 109002225 GXIOYYITTBZDBU-LJQANCHMSA-N 454.401 5.099 5 20 JKBD O=C(Cn1ccc2cc([N+](=O)[O-])ccc21)N1CCC(c2nc3cc(Cl)ccc3s2)CC1 109317494 QJVFMJFUAXMLPV-UHFFFAOYSA-N 454.939 5.219 5 20 JKBD O=C(Nc1ccc(Cl)cc1Cl)[C@H]1CCCCN1C(=O)c1ccc(Cl)cc1[N+](=O)[O-] 302923710 APVDDKUYUQSBNY-MRXNPFEDSA-N 456.713 5.188 5 20 JKBD C[C@H]1CCCN(c2ccc(C(=O)N(C)CCCc3cc(-c4ccccc4)no3)cc2[N+](=O)[O-])C1 505343330 GQPMHVAVAVESSH-IBGZPJMESA-N 462.550 5.191 5 20 JKBD CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccc(NC(=O)c2ccco2)c(Cl)c1 509193628 FPTOCAXGEIBKIZ-UHFFFAOYSA-N 456.886 5.536 5 20 JKBD COc1ccccc1NC(=O)Nc1cc(NC(=O)c2ccc([N+](=O)[O-])cc2Cl)ccc1OC 509408417 QWRBGONZARBQAU-UHFFFAOYSA-N 470.869 5.162 5 20 JKBD Cc1nn(Cc2ccc(C(=O)N(Cc3c(F)cccc3F)C3CCCC3)cc2)c(C)c1[N+](=O)[O-] 520532226 IWUJPBQPUUWZHF-UHFFFAOYSA-N 468.504 5.320 5 20 JKBD CC[C@H](C)NC(=O)c1ccc(NC(=O)CSc2ccc(C(F)(F)F)cc2[N+](=O)[O-])c(C)c1 520592439 PHOFBIPUQFHZCT-ZDUSSCGKSA-N 469.485 5.181 5 20 JKBD Cc1nn(CCC(=O)Nc2sc(-c3ccccc3)c(C)c2C(=O)N2CCCCC2)c(C)c1[N+](=O)[O-] 522482288 BFXCDVNFXSWPMS-UHFFFAOYSA-N 495.605 5.100 5 20 JKBD CCOc1cc(C(=O)Nc2ncc(Cc3ccc(C(F)(F)F)cc3)s2)c([N+](=O)[O-])cc1OC 602228227 SWDASFKBNXPVLT-UHFFFAOYSA-N 481.452 5.321 5 20 JKBD CCOC(=O)c1cc(C(=O)N(c2cccc(C(F)(F)F)c2)[C@H](C)C2CC2)cc([N+](=O)[O-])c1 603964376 HFDAECTYGQSZRF-CYBMUJFWSA-N 450.413 5.236 5 20 JKBD CC(=O)Nc1ccc(-c2csc(NC(=O)c3csc(-c4ccc([N+](=O)[O-])cc4)n3)n2)cc1 604516450 QCOCEEWUCXCDTD-UHFFFAOYSA-N 465.516 5.053 5 20 JKBD CC(C)NC(=O)c1ccc(Cl)c(NC(=O)c2ccc(Nc3ccccc3)c([N+](=O)[O-])c2)c1 609099178 PPONVOAOKRQESY-UHFFFAOYSA-N 452.898 5.382 5 20 JKBD Cn1cnnc1Sc1ccc(C(=O)Nc2cccc(-c3ccc4ccccc4c3)n2)cc1[N+](=O)[O-] 609151531 YHTYPDJVIQFVRV-UHFFFAOYSA-N 482.525 5.342 5 20 JKBD CCn1c(SCc2nc(O)c3ccc(C(F)(F)F)cc3n2)nc2cc3ccccc3cc2c1=O 615481670 HUUKDZXXCKUFPM-UHFFFAOYSA-N 482.487 5.530 5 20 JKBD O=C(Nc1nc2cc(C(F)(F)F)ccc2n1Cc1ccco1)c1ccc(N2CCCC2)c([N+](=O)[O-])c1 619219249 BOHVBBQTOFGTSV-UHFFFAOYSA-N 499.449 5.457 5 20 JKBD O=C(Cn1c2ccccc2c(=O)c2ccccc21)N1CC=C(c2c[nH]c3cc(F)ccc23)CC1 642606188 MBXNGRDHTNXSDH-UHFFFAOYSA-N 451.501 5.091 5 20 JKBD CCc1cc[n+](/C(C(=S)Nc2ccccc2-c2ccccc2)=C(/O)c2cccc([N+](=O)[O-])c2)cc1 725764514 XZVSZKPBYNRWMK-UHFFFAOYSA-O 482.585 6.435 5 20 JKBD CCc1cccc[n+]1/C(C(=S)Nc1ccc(OC)c(Cl)c1)=C(/O)c1ccc(C)c([N+](=O)[O-])c1 726961307 GXWQQQBWGBYODG-UHFFFAOYSA-O 484.985 5.738 5 20 JKBD Cc1ccc(NC(=O)c2ccc(N[C@H](C)c3ccc(N4CCOC4=O)cc3)c([N+](=O)[O-])c2)cc1 727431487 QNCFKALZQZOCJF-QGZVFWFLSA-N 460.490 5.285 5 20 JKBD CCOC(=O)c1cc(C(=O)Nc2ccc(NC(=O)OC(C)(C)C)cc2C(F)(F)F)cc([N+](=O)[O-])c1 729654950 AZEVQFFJYWNYPC-UHFFFAOYSA-N 497.426 5.390 5 20 JKBD O=C(OCc1csc(COc2ccc(Cl)cc2)n1)c1csc(-c2ccc([N+](=O)[O-])cc2)n1 747954728 KWKPTLHNEASTQX-UHFFFAOYSA-N 487.946 5.764 5 20 JKBD Cc1oc(-c2ccco2)nc1CC(=O)O[C@@H](C(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1)c1ccccc1 750191575 SSTUBKSNSGYDIK-JOCHJYFZSA-N 495.875 5.270 5 20 JKBD C[C@@H](OC(=O)/C=C\c1ccc(Cl)s1)C(=O)Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1 829068032 YSFHBEXAUPNARK-BPOWMSRESA-N 463.924 5.017 5 20 JKBD COc1ccc([N+](=O)[O-])cc1COC(=O)CCc1ncc(-c2ccc(Cl)cc2Cl)o1 829678012 WADRLIKGGNTHHY-UHFFFAOYSA-N 451.262 5.241 5 20 JKBD Cc1ccc(-c2csc3ncnc(SCC(=O)Nc4cc([N+](=O)[O-])c(F)cc4F)c23)cc1 897502861 QDPURCMSGFWYDI-UHFFFAOYSA-N 472.498 5.584 5 20 JKBD CC(=O)N(c1nc(COC(=O)COc2cccc([N+](=O)[O-])c2)cs1)c1c(C)cc(C)cc1Cl 914909553 ULTSMHJYQORUDG-UHFFFAOYSA-N 489.937 5.128 5 20 JKBD CSc1ccc(C(=O)c2ccccc2C(=O)Nc2cc(C(=O)NC3CC3)ccc2C)cc1[N+](=O)[O-] 916081297 VQGBAJVWNZBDJW-UHFFFAOYSA-N 489.553 5.001 5 20 JKBD COc1cccc([C@@H](CNC(=S)Nc2ccc([N+](=O)[O-])cc2)c2c[nH]c3ccccc23)c1OC 916123759 CWLWCQIHYVZLEC-OAQYLSRUSA-N 476.558 5.212 5 20 JKBD Cc1nc2ccccc2nc1COC(=O)c1ccccc1NC(=O)c1ccc([N+](=O)[O-])cc1Cl 916613930 JPRHFJGUSNSJKR-UHFFFAOYSA-N 476.876 5.109 5 20 JKBD CC(C)N(Cc1nnc(-c2cccc([N+](=O)[O-])c2)o1)C(=O)c1ccc(SCc2ccccc2)cc1 917590802 HIQBGOMVUVSDSG-UHFFFAOYSA-N 488.569 5.988 5 20 JKBD Cc1ccc([N+](=O)[O-])cc1NC(=O)COC(=O)c1c(Cl)cc(C(F)(F)F)cc1Cl 919295199 VZDPQYIOLHZDQF-UHFFFAOYSA-N 451.184 5.024 5 20 JKBD CC(C)(C)n1nc(C(=O)O[C@@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2ccccc2)cc1C1CC1 919375357 QVWOHDBMHDMNCE-JOCHJYFZSA-N 496.951 5.614 5 20 JKBD Cc1cc(Br)c(NC(=O)COc2ccc([N+](=O)[O-])c(Cl)c2)c(Br)c1 921142374 JWBMRMFFDHDHHS-UHFFFAOYSA-N 478.524 5.099 5 20 JKBD C/C(=C\c1cccs1)C(=O)NC1(c2ccc(NC(=O)c3ccc([N+](=O)[O-])o3)cc2)CCC1 1785747504 QBDBJLPQYGXRCF-CCEZHUSRSA-N 451.504 5.101 5 20 JKBD Cc1c(C(=O)NC2(c3ccc(NC(=O)c4ccc([N+](=O)[O-])o4)cc3)CCC2)oc2ccccc12 1785748636 ABMMTTROWVEENI-UHFFFAOYSA-N 459.458 5.304 5 20 JKBD C[C@H](CC(=O)NC1(c2ccc(NC(=O)/C=C/c3ccc([N+](=O)[O-])o3)cc2)CCC1)Oc1ccccc1 1786208062 IIJXGHYDEQCTSM-XYDKVEKUSA-N 489.528 5.193 5 20 JKBD O=C(/C=C\c1c[nH]c2ccccc12)Nc1ccc(C2(NC(=O)c3cc(O)cc([N+](=O)[O-])c3)CCC2)cc1 1786781096 QLRAKRVSHWJUHL-WDZFZDKYSA-N 496.523 5.243 5 20 JKBD O=C(Cc1cccc([N+](=O)[O-])c1)NC1(c2ccc(NC(=O)c3cccc4ncsc34)cc2)CCC1 1789342500 UMCHBTYUSXWYGB-UHFFFAOYSA-N 486.553 5.195 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)c3ccncc3-c3ccccc3)CCC2)cc1)c1ccc([N+](=O)[O-])[nH]1 1790186810 SEAKOXJVYOIYOS-UHFFFAOYSA-N 481.512 5.046 5 20 JKBD Cc1cc(F)ccc1C(=O)Nc1ccc(C2(NC(=O)/C=C/c3ccc([N+](=O)[O-])o3)CCC2)cc1 1792181394 WWMTYWTYNLNKNN-DHZHZOJOSA-N 463.465 5.096 5 20 JKBD CC(C)[C@H](C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2ccc([N+](=O)[O-])[nH]2)n[nH]1)c1ccc(Cl)cc1 1820362071 AAZZCDZGTWODEC-UGKGYDQZSA-N 498.971 5.045 5 20 JKBD C/C(=C\c1cccs1)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)Cc2ccc(C)c([N+](=O)[O-])c2)n[nH]1 1820916196 MRHPNTRFXJSIFA-GUOCTKQSSA-N 493.589 5.026 5 20 JKBD Cc1cc(C(=O)N2CCC([C@@H]3CCCCN3C(=O)c3ccc(C(C)(C)C)s3)CC2)ncc1[N+](=O)[O-] 1827904324 WNHAFHPMVIGXOQ-FQEVSTJZSA-N 498.649 5.204 5 20 JKBD O=C(c1ccccc1C1CC1)N1CCC([C@H]2CCCCN2C(=O)/C=C/c2ccccc2[N+](=O)[O-])CC1 1832904834 XVKIVQFLKKMPJJ-ZUSJUXBOSA-N 487.600 5.419 5 20 JKBD O=[N+]([O-])c1ccc(CSc2nnc(Cn3cnc4ccccc43)n2-c2ccccc2Cl)cc1 8760928 BXJWIOSESGAOOJ-UHFFFAOYSA-N 476.949 5.519 5 20 JKBD Cc1ccc(-c2nc(C)sc2CC(=O)O[C@@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)cc1 11214221 JDRMPEKZQPOCET-ZDUSSCGKSA-N 473.938 5.101 5 20 JKBD CC(C)c1noc2ncc(C(=O)O[C@H](C(=O)Nc3ccc([N+](=O)[O-])cc3Cl)c3ccccc3)cc12 11682604 AMXHPNHVMFSJCF-NRFANRHFSA-N 494.891 5.445 5 20 JKBD Cc1nc(CSc2ccc(C(=O)O[C@H](C)c3nnc(-c4ccc([N+](=O)[O-])cc4)o3)cc2)cs1 11701930 SZTFMGYBIRWVQO-CYBMUJFWSA-N 482.543 5.620 5 20 JKBD C[C@H](Sc1nccn1Cc1ccccc1)C(=O)Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1 16685318 DKAMWSPPHKMAQV-HNNXBMFYSA-N 465.560 5.082 5 20 JKBD Cc1ccc(-n2c(S[C@H](C)C(=O)Nc3cccc([N+](=O)[O-])c3C)nnc2-c2ccncc2)cc1C 22174853 FOKYEEDJOOSUET-GOSISDBHSA-N 488.573 5.282 5 20 JKBD CC(=O)Nc1cccc(NC(=O)[C@H](C)OC(=O)c2ccc(Sc3ccc(C)cc3)c([N+](=O)[O-])c2)c1 23501724 SKPTXBSUDJCKBI-INIZCTEOSA-N 493.541 5.197 5 20 JKBD Cc1c(NC(=O)[C@@H](C)Sc2nnc([C@H](C)N3CCCCC3)n2-c2ccccc2)cccc1[N+](=O)[O-] 25002308 ARZUFLXLJRGSKH-RBUKOAKNSA-N 494.621 5.150 5 20 JKBD COc1cccc(CNC(=O)C/C(=C/c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)c1 29686279 CCRQIGSNLWCRPZ-UYRXBGFRSA-N 459.527 5.460 5 20 JKBD COc1ccc(Oc2ccc([N+](=O)[O-])cc2C(=O)Nc2ccc(NC(=O)NC(C)C)cc2)cc1 32952618 OBRQBTGNVJQABK-UHFFFAOYSA-N 464.478 5.178 5 20 JKBD CCCNC(=O)c1cccc(NC(=O)c2ccc(NCc3ccccc3Cl)c([N+](=O)[O-])c2)c1 46817205 FFDHWLPMYPCFBT-UHFFFAOYSA-N 466.925 5.252 5 20 JKBD Cc1cc(NC(=O)c2oc3ccc(Br)cc3c2C)n(-c2ccc([N+](=O)[O-])cc2)n1 105526441 WJANGEWDQRWCTQ-UHFFFAOYSA-N 455.268 5.158 5 20 JKBD Cc1nc(-c2cccc(NC(=O)CSc3ccc(C(F)(F)F)cc3[N+](=O)[O-])c2)oc1C 108201600 JRBWTEOIESGURW-UHFFFAOYSA-N 451.426 5.616 5 20 JKBD O=C(C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1)N1CCC[C@@H]1CCc1ccccc1 108283827 PWXALIAELSVCPP-OAQYLSRUSA-N 475.511 5.454 5 20 JKBD O=C(Nc1ccccc1C(=O)N1CCCC1)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1 115251396 IGIDPECRVINXBP-UHFFFAOYSA-N 465.893 5.529 5 20 JKBD Cc1cc(C)n(-c2ccc(NC(=O)c3ccc(N[C@@H](C)c4ccccn4)c([N+](=O)[O-])c3)cc2F)n1 410055366 QIUBFXYDGKQPEZ-KRWDZBQOSA-N 474.496 5.357 5 20 JKBD CC(C)CCSc1ccc(C(=O)N2CC=C(c3c[nH]c4ncccc34)CC2)cc1[N+](=O)[O-] 485362783 WQPPVFFWWJDQAY-UHFFFAOYSA-N 450.564 5.539 5 20 JKBD Cc1sc2ncnc(Sc3ccccc3C(=O)NCc3ccccc3[N+](=O)[O-])c2c1C 500788427 SDWBKEBWUQSEMD-UHFFFAOYSA-N 450.545 5.298 5 20 JKBD O=C(Cc1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1)NCc1cc(Br)cs1 501139825 JLSWZGUAFFTLOG-UHFFFAOYSA-N 497.374 5.130 5 20 JKBD Cc1ccc(NC(=O)c2cnn(-c3ncc(C(F)(F)F)cc3Cl)c2C(F)(F)F)cc1[N+](=O)[O-] 502843912 NMQKGYSKFUOBPM-UHFFFAOYSA-N 493.751 5.427 5 20 JKBD O=C(Nc1ccc(CC(=O)N2CCCc3ccccc32)cc1)c1cc2cc([N+](=O)[O-])ccc2o1 503477202 QAYPJFZVHRNMNL-UHFFFAOYSA-N 455.470 5.115 5 20 JKBD COc1ccc(CN[C@@H](c2ccc(F)cc2)[C@@H]2CCCO2)cc1OCc1ccc([N+](=O)[O-])cc1 507915897 WGTUNYINSMFSCJ-AHWVRZQESA-N 466.509 5.331 5 20 JKBD COc1ccc(OC(F)F)c(NC(=O)c2ccc(N[C@H](C)c3ccccn3)c([N+](=O)[O-])c2)c1 508879851 RCCQRGGEWPCGBO-CYBMUJFWSA-N 458.421 5.025 5 20 JKBD CCOC(=O)c1sc(-c2cccc([N+](=O)[O-])c2)cc1NC(=O)CCc1nc(-c2ccsc2)no1 512178835 JQKBSTAHVGVXCU-UHFFFAOYSA-N 498.542 5.183 5 20 JKBD CC(C)CC(=O)Nc1cccc(CNCc2ccc(Oc3ccc(F)cc3)c([N+](=O)[O-])c2)c1 517549986 INVPULRDIOUHLB-UHFFFAOYSA-N 451.498 5.801 5 20 JKBD Cc1ccc(Sc2ccc(C(=O)N3CCC(C(=O)Nc4ccc(F)cc4)CC3)cc2[N+](=O)[O-])cc1 522375556 BILDRMPGRAIUEE-UHFFFAOYSA-N 493.560 5.684 5 20 JKBD CS(=O)(=O)c1cc(NCc2ccc(Oc3ccccc3Cl)c([N+](=O)[O-])c2)ccc1F 600852167 OOWCCAYXOVIMIY-UHFFFAOYSA-N 450.875 5.195 5 20 JKBD C[C@H]1CCC[C@@H](C)N1C(=O)c1cc(Cl)ccc1NC(=O)c1cnn(-c2ccc([N+](=O)[O-])cc2)c1 603738207 GLKJILVWPMAKEZ-IYBDPMFKSA-N 481.940 5.089 5 20 JKBD CC[C@@H](NC(=O)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1)c1ccccc1OCC(=O)NC 603973041 WFMLJZRVVAHSTK-HXUWFJFHSA-N 497.935 5.046 5 20 JKBD Cc1cc(C)n([C@@H](C)C(=O)Nc2ccc(NC(=O)c3ccc([N+](=O)[O-])cc3Cl)cc2Cl)n1 604441843 LEWZTEJYGVBSFU-ZDUSSCGKSA-N 476.320 5.167 5 20 JKBD C[C@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)N1CCC[C@H]1c1cccc(Br)c1 604446950 LGNQZUISGVJMHU-LRDDRELGSA-N 453.720 5.142 5 20 JKBD CC[C@H](NC(=O)C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)c1nc2ccccc2[nH]1 608950326 QMVNYEPZOODVML-POLXVDLBSA-N 497.580 6.279 5 20 JKBD CN(Cc1ccc(Cl)s1)C(=O)c1ccc(C(=O)N(C)Cc2ccc(Cl)s2)c([N+](=O)[O-])c1 609043734 OZKOGOWWIUGMAB-UHFFFAOYSA-N 498.413 5.569 5 20 JKBD CCCN(CC(=O)Nc1ccc(F)c(F)c1F)C(=O)c1cc2ccccc2c2cccnc12 643140098 XTFGTAXJINBWOI-UHFFFAOYSA-N 451.448 5.296 5 20 JKBD CC(=O)N(c1ccc(Cl)c(Cl)c1)c1nc(COC(=O)c2cc(F)ccc2[N+](=O)[O-])cs1 743197057 BBKPRUVETOZFTC-UHFFFAOYSA-N 484.292 5.539 5 20 JKBD CC(=O)Nc1nc(COC(=O)C/C(=C\c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)cs1 748579761 VRRAPAMIBKLXAD-MHWRWJLKSA-N 494.554 5.294 5 20 JKBD O=C(Nc1ccccc1)Nc1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2Br)cc1 750602253 AGLGBEKKRHJUIH-UHFFFAOYSA-N 455.268 5.254 5 20 JKBD COc1cc(-c2noc(-c3cc(Br)c(C)c([N+](=O)[O-])c3)n2)cc(Cl)c1OC 904404855 PMZSRPVGNOUAPX-UHFFFAOYSA-N 454.664 5.053 5 20 JKBD C[C@@H](OC(=O)c1cc(Cl)ccc1Br)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 913344755 KBKXWWQNJKJEPC-MRVPVSSYSA-N 495.635 5.214 5 20 JKBD Cc1ccccc1C[C@@H](C)NC(=O)c1ccccc1NC(=O)c1ccc([N+](=O)[O-])cc1Cl 918635243 NTMOVMKNNNUJCR-MRXNPFEDSA-N 451.910 5.170 5 20 JKBD COc1cc(C(=O)OCc2cccc(C(F)(F)F)c2)c([N+](=O)[O-])cc1OCc1cscn1 920116478 FYSKGKDTGMBCNQ-UHFFFAOYSA-N 468.409 5.015 5 20 JKBD C[C@H](OC(=O)c1ccc(N[C@@H](C)c2ccccn2)c([N+](=O)[O-])c1)C(=O)c1ccc(Br)cc1 920549278 XAAAJZDCUYFQGK-GJZGRUSLSA-N 498.333 5.354 5 20 JKBD O=C(CSc1ccccc1[N+](=O)[O-])NC1(c2ccc(NC(=O)[C@@H]3CC=CCC3)cc2)CCC1 1786076865 WHYBAGDLAHLZLU-GOSISDBHSA-N 465.575 5.177 5 20 JKBD O=C(/C=C/c1ccccc1)Nc1ccc(C2(NC(=O)/C=C/c3ccc([N+](=O)[O-])o3)CCC2)cc1 1787778929 JCBYDZRVBFNVJV-MCLPEHIOSA-N 457.486 5.049 5 20 JKBD Cc1ccc(CC(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)[C@H](c2ccc(Cl)cc2)C(C)C)cc1[N+](=O)[O-] 1793223654 BHWRIIVCZKUICX-LNEBKTTKSA-N 498.023 5.177 5 20 JKBD O=C(Cc1ccc2ccccc2c1)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)C1(c3cccc([N+](=O)[O-])c3)CCC1)C2 1795541485 GYUCZDDNRVBGJC-OOSCYNTBSA-N 497.595 5.051 5 20 JKBD Cc1c(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)CCc2ccccc2Cl)cc(Cl)cc1[N+](=O)[O-] 1795739565 LUGCOIHPFZDNNX-REPLKXPHSA-N 490.387 5.095 5 20 JKBD O=C(CC1CCCC1)Nc1cc([C@@H]2CCCCN2C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)[nH]n1 1816688276 ORMGMWQTVJARAM-IBGZPJMESA-N 481.578 5.419 5 20 JKBD CC(C)[C@H]1CC[C@H](C(=O)Nc2cc([C@H]3CCCCN3C(=O)Cc3cccc([N+](=O)[O-])c3)[nH]n2)CC1 1822100696 QUJFMNXXOOMPPH-TXTKFYIRSA-N 481.597 5.015 5 20 JKBD C/C(=C\c1ccc(C)o1)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)/C=C/c2ccccc2[N+](=O)[O-])n[nH]1 1823504394 KWCUAYIZARICSE-GDUUISJWSA-N 489.532 5.028 5 20 JKBD CC(F)(F)C(C)(C)C(=O)N1CCC([C@@H]2CCCCN2C(=O)Cc2ccc(Cl)cc2[N+](=O)[O-])CC1 1824161958 SPJATBIBGUFJCH-IBGZPJMESA-N 499.986 5.092 5 20 JKBD C/C(=C\c1ccc(C)o1)C(=O)N1CCC([C@H]2CCCCN2C(=O)CCc2cccc([N+](=O)[O-])c2)CC1 1824841085 ADWHNEFZUSZSFB-OPIUMXSJSA-N 493.604 5.152 5 20 JKBD Cc1c(C(=O)N2CCC([C@@H]3CCCCN3C(=O)/C=C/C(C)C)CC2)cc(Cl)cc1[N+](=O)[O-] 1832512497 GMRCCIFQIKDJCG-CQQBXOTJSA-N 461.990 5.002 5 20 JKBD CCOc1ccc([C@@H]2CCCN2C(=O)CSc2ccc(C(F)(F)F)cc2[N+](=O)[O-])cc1 16141619 ISBKZKQIYRYPII-KRWDZBQOSA-N 454.470 5.468 5 20 JKBD Cc1csc(CNC(=O)C/C(=C/c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)n1 29885695 YYNSCMJIRNVTHD-YBEGLDIGSA-N 450.545 5.217 5 20 JKBD CCN(Cc1ccccc1Cl)C(=O)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 58699899 IAYYAXBUIMYTLW-UHFFFAOYSA-N 469.891 5.532 5 20 JKBD C[C@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccccc1Oc1ncc(Cl)cc1Cl 58987553 SVLASGOOJPWVSQ-LBPRGKRZSA-N 464.330 6.208 5 20 JKBD C[C@@H](Nc1ccc(C(=O)Nc2nnc(SCc3ccccc3)s2)cc1[N+](=O)[O-])c1ccccn1 108754295 ZWXXKWMZGJMZIR-OAHLLOKOSA-N 492.586 5.559 5 20 JKBD O=C(Nc1ccc(F)cc1)N1CCN(C(=O)c2ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])cc2)CC1 502901016 BKEPUGFROPVJFS-UHFFFAOYSA-N 498.898 5.170 5 20 JKBD COc1ccc2ccccc2c1CNC(=O)c1ccc(N[C@H](C)c2ccccn2)c([N+](=O)[O-])c1 506164473 QUWWEBDLDXHBRS-QGZVFWFLSA-N 456.502 5.255 5 20 JKBD COCCN(C(=O)Cn1ccc2ccc(Cl)cc21)c1nc(-c2ccc([N+](=O)[O-])cc2)cs1 506221159 RYJKMPCYWSRAGW-UHFFFAOYSA-N 470.938 5.006 5 20 JKBD Cc1nnc(NC(=O)c2c3c(nc4ccccc24)/C(=C\c2ccc([N+](=O)[O-])cc2)CCC3)s1 509143947 XEXYXQWQTHGVOI-SSZFMOIBSA-N 457.515 5.432 5 20 JKBD COc1ccc(CNC(=O)c2ccccc2SCc2ccc(Br)cc2)cc1[N+](=O)[O-] 515730365 OGUTWNDSNSUVAF-UHFFFAOYSA-N 487.375 5.588 5 20 JKBD O=C1CCCN1C[C@@H](NCc1ccc(-c2cccc([N+](=O)[O-])c2)o1)c1cccc(C(F)(F)F)c1 517536573 RTOWVENBUBYYTB-OAQYLSRUSA-N 473.451 5.327 5 20 JKBD CN(C)[C@H](CNC(=O)C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)c1ccco1 518748635 KFEFCCFIMVVKBH-JOIYNNFJSA-N 476.558 5.147 5 20 JKBD Cc1ccc(S(=O)(=O)Nc2ccc(NC(=O)[C@H]3CCCC[C@H]3C(F)(F)F)cc2)cc1[N+](=O)[O-] 603780513 OJXICWMXXMVLRE-ZWKOTPCHSA-N 485.484 5.011 5 20 JKBD C[C@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)N[C@H](C)c1cccc(NC(=O)Cc2ccccc2F)c1 604442236 BWHUFRSXIMGAES-CVEARBPZSA-N 499.926 5.213 5 20 JKBD Cc1ccc(NC(=O)c2ccc(Nc3ccc(CS(=O)(=O)C(C)(C)C)cc3)c([N+](=O)[O-])c2)cc1 608973611 PMIFFSCNQJLODI-UHFFFAOYSA-N 481.574 5.612 5 20 JKBD O=C(CSC[C@H]1CCCCO1)Nc1cc(Cl)c([N+](=O)[O-])cc1OCc1ccccc1 727296032 AHRRBJXOJPMSNQ-MRXNPFEDSA-N 450.944 5.068 5 20 JKBD O=C(CCC(=O)c1ccc2ccc3cccc4ccc1c2c34)NCc1nncn1-c1ccccc1 727766911 JVTPAIOPORSQAT-UHFFFAOYSA-N 458.521 5.444 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)OCC(=O)N2CCC[C@H]2c2ccc(Cl)c(Cl)c2)cc1SC 728649588 NBXBZUBOPSYZFP-INIZCTEOSA-N 499.372 5.153 5 20 JKBD Cc1nc(COc2ccc(N[C@@H](C(=O)Nc3ccc([N+](=O)[O-])cc3Cl)c3ccccc3)cc2)no1 731041454 ZSZYUFRBIKTCSJ-HSZRJFAPSA-N 493.907 5.311 5 20 JKBD Cc1nnc(SCc2c(C(=O)OCCOc3ccc([N+](=O)[O-])cc3)oc3ccccc23)s1 742956634 PMUWAROQDGZDKY-UHFFFAOYSA-N 471.516 5.029 5 20 JKBD Cc1cc(COc2ccc(C(=O)O[C@H](C)c3cccc([N+](=O)[O-])c3)cc2Br)no1 742960655 NBXSOFPKWJXKDU-CYBMUJFWSA-N 461.268 5.151 5 20 JKBD COc1ccc([C@@H](CC(=O)Nc2cc(Cl)c([N+](=O)[O-])cc2OCc2ccccc2)NC(C)=O)cc1 822219981 YWWSJHBXBCQFCB-OAQYLSRUSA-N 497.935 5.042 5 20 JKBD O=C1/C(=C/c2ccccc2)N=C(SCc2cc(F)ccc2[N+](=O)[O-])N1c1ccc(F)cc1 915792196 WQBFHSCYLNIBSJ-NDENLUEZSA-N 451.454 5.550 5 20 JKBD CCOc1ccccc1NC(=O)[C@H](OC(=O)c1cc2cccc([N+](=O)[O-])c2[nH]1)c1ccccc1 917331159 LYEXXHXLPJKXDC-HSZRJFAPSA-N 459.458 5.012 5 20 JKBD O=C(CN1CCCCC1)Nc1ccc(C2(NC(=O)c3cc4cc([N+](=O)[O-])ccc4s3)CCC2)cc1 1787897377 ABLMUYAGPLJPAZ-UHFFFAOYSA-N 492.601 5.043 5 20 JKBD Cc1cc(CCCC(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2ccc(C3CC3)cc2)c([N+](=O)[O-])cc1F 1800727986 XIQPSLJOKYTKFV-BKFWDETESA-N 493.579 5.194 5 20 JKBD O=C(Nc1cc([C@@H]2CCCCN2C(=O)/C=C/c2ccccc2[N+](=O)[O-])[nH]n1)c1ccc(Cl)cc1F 1814583179 KNZJFRUROUZYDP-MAIVGLDJSA-N 497.914 5.130 5 20 JKBD COc1cc(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)c3cccc4ccccc34)n[nH]2)ccc1[N+](=O)[O-] 1818454515 AXZDFBLEKYPPLJ-JOCHJYFZSA-N 499.527 5.099 5 20 JKBD CC(C)[C@H]1CC[C@H](C(=O)N2CCCC[C@H]2c2cc(NC(=O)Cc3ccc([N+](=O)[O-])cc3F)n[nH]2)CC1 1821844278 QPGLWZQEGOSHJD-BSRJHKFKSA-N 499.587 5.154 5 20 JKBD O=C(C[C@@H]1C[C@@H]2CC[C@H]1C2)N1CCC([C@H]2CCCCN2C(=O)CSc2ccccc2[N+](=O)[O-])CC1 1831777289 NVISAYVQKJJKDY-YPIGPJMWSA-N 499.677 5.133 5 20 JKBD O=C(/C=C/C1CCCC1)N1CCC([C@H]2CCCCN2C(=O)CSc2ccccc2[N+](=O)[O-])CC1 1831777621 UJMIEFMLCUBKEY-CHHLAKQQSA-N 485.650 5.053 5 20 JKBD Cc1ccc(CC(=O)N2CCC([C@@H]3CCCCN3C(=O)c3ccccc3C3CC3)CC2)cc1[N+](=O)[O-] 1832556062 NAVKNDQQHHQILK-SANMLTNESA-N 489.616 5.257 5 20 JKBD COc1ccc([N+](=O)[O-])cc1NC(=O)[C@H](C)OC(=O)[C@@H](Sc1ccccc1)c1ccccc1 10588837 QJCHWHBTKMBHJA-AOMKIAJQSA-N 466.515 5.007 5 20 JKBD CC(=O)N(c1nc(COC(=O)c2ccc(NC3CC3)c([N+](=O)[O-])c2)cs1)c1ccc(C)cc1C 11226993 XLACTYOAGMVTQR-UHFFFAOYSA-N 480.546 5.284 5 20 JKBD COc1ccc(NC(=O)CSc2nc(-c3cccs3)nc3ccccc23)c([N+](=O)[O-])c1 12424682 PCHBOCMJAKSCGH-UHFFFAOYSA-N 452.517 5.006 5 20 JKBD Cn1ccnc1[C@@H](NC(=O)c1ccc(NCc2ccccc2Cl)c([N+](=O)[O-])c1)c1ccc(F)cc1 14400383 QFZVSXDCZRIRJG-QHCPKHFHSA-N 493.926 5.252 5 20 JKBD COc1ccccc1NC(=O)c1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2Sc2ccccc2)cc1 15313293 WFLJDIUTFOHEQZ-UHFFFAOYSA-N 499.548 6.259 5 20 JKBD COc1cc(C(=O)Nc2cc(S(C)(=O)=O)ccc2C)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 15816010 KJIJCAGEDCEUPL-UHFFFAOYSA-N 490.921 5.013 5 20 JKBD COc1ccc(NC(=O)[C@H](C)Sc2nn(-c3ccc(Cl)cc3)c(=S)s2)c([N+](=O)[O-])c1 16766532 KTGVFYZPWNLJGS-JTQLQIEISA-N 482.996 5.353 5 20 JKBD CCn1c(S[C@@H](C)C(=O)Nc2ccccc2OC(F)F)nc2cc3ccccc3cc2c1=O 18467549 NLQCFKLFSXTMEZ-AWEZNQCLSA-N 469.513 5.290 5 20 JKBD O=C(O[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1)c1csc(-c2cccs2)n1 19259566 GEXXCEVHTPCXEU-LJQANCHMSA-N 499.957 5.970 5 20 JKBD C[C@H](Sc1nnc(-c2cccc(Cl)c2)o1)C(=O)Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1 21547919 XSPVWYIULLOOAE-NSHDSACASA-N 487.950 5.541 5 20 JKBD CC[C@H](NC(=O)CSc1nc2cc3ccccc3cc2c(=O)n1C)c1ccc(Cl)cc1 26580841 ZWIVXOXKISSAQW-FQEVSTJZSA-N 451.979 5.100 5 20 JKBD CN(Cc1cc([N+](=O)[O-])ccc1Cl)Cn1nc(-c2ccco2)n(Cc2ccccc2)c1=S 27533007 YGPBYDXTYSAFCB-UHFFFAOYSA-N 469.954 5.373 5 20 JKBD COc1ccc([C@@H](C)N[C@@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2C(F)(F)F)cc1Br 30510217 NEKVYEOFJHIOFB-MNOVXSKESA-N 490.276 5.063 5 20 JKBD CN(CCOc1ccc(Cl)cc1)C(=O)c1ccccc1NC(=O)c1ccc([N+](=O)[O-])cc1Cl 36716960 UYCDVNXCHFIFDH-UHFFFAOYSA-N 488.327 5.305 5 20 JKBD C[C@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)N1CCC(N(C)Cc2cccc(C(F)(F)F)c2)CC1 302974789 DSIQUUUNYVPGAG-INIZCTEOSA-N 481.540 5.217 5 20 JKBD C[C@@H]1CCCN(c2ccc(C(=O)Nc3ccc(OC(F)F)cc3OC(F)F)cc2[N+](=O)[O-])C1 486830046 WBGJNKCHAHCWHH-GFCCVEGCSA-N 471.407 5.286 5 20 JKBD O=C(CCNC(=O)c1ccccc1Sc1ccc(C(F)(F)F)cc1[N+](=O)[O-])NC1CCCCC1 491198139 YKYADNCCXQDVAU-UHFFFAOYSA-N 495.523 5.334 5 20 JKBD Cc1ccc([C@@H](C)N(C)C(=O)C2CCN(c3ccc(C(F)(F)F)cc3[N+](=O)[O-])CC2)c(C)c1 498572859 BWKSIUFAOUUOJQ-QGZVFWFLSA-N 463.500 5.666 5 20 JKBD Cc1ccc(Sc2ccc(CNC3CCN(C(=O)c4ccccc4)CC3)cc2[N+](=O)[O-])cc1 507934619 VKYLKMUBXXIPBZ-UHFFFAOYSA-N 461.587 5.449 5 20 JKBD CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)Nc1cccc(C(=O)Nc2cccc(F)c2)c1 509194884 IJUQACBAJXZWPA-UHFFFAOYSA-N 450.470 5.429 5 20 JKBD Cc1ccc(-c2csc(NC(=O)c3nn(Cc4ccccc4)c(=O)c4ccccc34)n2)cc1[N+](=O)[O-] 514652943 QBLZUVGMDFCHIM-UHFFFAOYSA-N 497.536 5.037 5 20 JKBD CCCN(Cc1ccc(OC)cc1)C(=O)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 603527532 ZCERYHJYRARUNM-UHFFFAOYSA-N 479.499 5.277 5 20 JKBD Cc1csc(CCNC(=O)C/C(=C\c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)n1 603558563 NHCBNGZTMZHYNA-SFQUDFHCSA-N 464.572 5.259 5 20 JKBD O=C(Nc1ccc(Cn2cnc3ccccc32)cc1)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-] 604497993 LFTBHYNHZPUZTI-UHFFFAOYSA-N 470.407 5.186 5 20 JKBD CN(C[C@@H]1CCCO[C@H]1c1ccccc1)C(=O)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1 604519244 WKNMMEZXXMCVGM-CPJSRVTESA-N 480.948 6.280 5 20 JKBD CO[C@H](C)c1cccc(NC(=O)C/C(=C/c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)c1 608874507 DIZAQNMBGIQAPR-LCJWNIEWSA-N 473.554 6.481 5 20 JKBD COc1cc(C(=O)N[C@H](c2cccc(C(F)(F)F)c2)C(C)(C)C)c([N+](=O)[O-])cc1OC(F)F 608898980 OCJBEMNBZDLRKQ-QGZVFWFLSA-N 476.398 5.741 5 20 JKBD O=C(Nc1cc(-c2ccncc2)[nH]n1)c1cc([N+](=O)[O-])ccc1Sc1ccc(Cl)cc1 609077078 XOBFLCZUNULSLC-UHFFFAOYSA-N 451.895 5.437 5 20 JKBD O=C(NC1CCN(C(=O)c2cc([N+](=O)[O-])ccc2Sc2ccccc2)CC1)Oc1ccccc1 727336117 GDVPXKCEIXVRID-UHFFFAOYSA-N 477.542 5.139 5 20 JKBD CC(C)Oc1ccc([N+](=O)[O-])cc1COC(=O)c1ccccc1N(C)C(=O)c1cccs1 729113078 JMYPBDIJMLGKCG-UHFFFAOYSA-N 454.504 5.077 5 20 JKBD CN(C)C(=O)Sc1ccc(NC(=O)C2CCN(c3ccc(C(F)(F)F)cc3[N+](=O)[O-])CC2)cc1 729242271 MXSOEGWHSQYJEB-UHFFFAOYSA-N 496.511 5.242 5 20 JKBD O=C1OC(c2c(Cl)cccc2[N+](=O)[O-])=N/C1=C/c1cccc(NC(=O)c2ccccc2Cl)c1 730957404 CAEXSFRZZGCTEM-LDADJPATSA-N 482.279 5.498 5 20 JKBD C[C@@H](OC(=O)c1cccc(OC2CCCC2)c1)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 731262032 MNDHXHXQWQRYHI-CYBMUJFWSA-N 466.412 5.119 5 20 JKBD CC(C)N(Cc1nnc(-c2cccc([N+](=O)[O-])c2)o1)C(=O)CCc1ccc(Cl)c(Cl)c1 751057425 PTNITCQKAUJYHE-UHFFFAOYSA-N 463.321 5.321 5 20 JKBD CCn1c(CNC(=O)C/C(=C/c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)nc2ccccc21 818930027 JPUQUBVZFLBIEU-CYVLTUHYSA-N 497.580 5.821 5 20 JKBD CCC(CC)c1cc[n+](/C(C(=S)NCc2cccs2)=C(/O)c2cccc([N+](=O)[O-])c2)cc1 839412978 MVSVZNSDLUGHNJ-UHFFFAOYSA-O 468.624 5.848 5 20 JKBD C[C@H](Nc1ccc(-c2nc(-c3cccc(Br)c3)no2)cc1[N+](=O)[O-])c1ccccn1 904296523 FYHWXXZUKVCCGY-ZDUSSCGKSA-N 466.295 5.642 5 20 JKBD O=C(Nc1sc2c(c1-c1nc3ccccc3[nH]1)CCCC2)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1 908182691 OUJBDRYNEHHDEF-UHFFFAOYSA-N 463.475 5.239 5 20 JKBD O=C(Nc1ccc(OC(=O)c2cccnc2OCC(F)(F)F)cc1)c1cc([N+](=O)[O-])ccc1Cl 914461152 OIGYRHYYWNLWFQ-UHFFFAOYSA-N 495.797 5.056 5 20 JKBD Cc1c(NC(=O)C(=O)N[C@@H](c2ccc(CC(C)C)cc2)c2cccs2)cccc1[N+](=O)[O-] 915740859 NZWSNLRSHDHDBC-QFIPXVFZSA-N 451.548 5.008 5 20 JKBD Cc1ccc(S(=O)(=O)Nc2ccc(NC(=S)Nc3ccc(F)c(Cl)c3)cc2)cc1[N+](=O)[O-] 916120188 YDDLQAVPFXCUCU-UHFFFAOYSA-N 494.957 5.305 5 20 JKBD CN1CCC(N(C)c2ccc(NC(=O)c3cc([N+](=O)[O-])ccc3Sc3ccccc3)cc2)CC1 917792613 CCLVDKPOPUSCNN-UHFFFAOYSA-N 476.602 5.529 5 20 JKBD CCOc1ccc(NC(=O)COC(=O)c2c(Cl)cc(C(F)(F)F)cc2Cl)c([N+](=O)[O-])c1 919295641 DZMDHCTUJILGGH-UHFFFAOYSA-N 481.210 5.115 5 20 JKBD Cc1cc(-c2nnc(COC(=O)c3ccc(NCc4ccccc4Cl)c([N+](=O)[O-])c3)o2)c(C)o1 922678376 ZYNMWGWACAOJHB-UHFFFAOYSA-N 482.880 5.477 5 20 JKBD O=C(CCc1cccc([N+](=O)[O-])c1)NC1(c2ccc(NC(=O)c3cc4sccn4c3)cc2)CCC1 1788411027 OWJJPGNQTYRNST-UHFFFAOYSA-N 488.569 5.290 5 20 JKBD O=C(/C=C/c1ccc([N+](=O)[O-])o1)NC1(c2ccc(NC(=O)c3cccc4ncsc34)cc2)CCC1 1789342419 MFSNIQTXMTVPON-PKNBQFBNSA-N 488.525 5.259 5 20 JKBD O=C(CCc1cccc([N+](=O)[O-])c1)NC1(c2ccc(NC(=O)C(Cl)(Cl)Cl)cc2)CCC1 1791329174 NOIOFGAUYLLHNP-UHFFFAOYSA-N 484.767 5.032 5 20 JKBD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc2cc([N+](=O)[O-])ccc2s1)c1ccc(Cl)s1 1801207630 ZNNYUDASYXHFPV-BTTYYORXSA-N 475.979 5.090 5 20 JKBD Cc1c(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)[C@H]3CCC(F)(F)C3)n[nH]2)cc(Cl)cc1[N+](=O)[O-] 1814389910 YFPKQWRVJKEBBR-SUMWQHHRSA-N 495.914 5.021 5 20 JKBD Cc1c(C(=O)Nc2cc([C@H]3CCCCN3C(=O)[C@@H]3CCC(F)(F)C3)[nH]n2)cc(Cl)cc1[N+](=O)[O-] 1821290287 TZFLRNFIHVJGRV-CXAGYDPISA-N 495.914 5.021 5 20 JKBD Cc1cccc(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)c3cccc(F)c3[N+](=O)[O-])[nH]n2)c1Cl 1823184030 VDLFWUQNNSSKAO-SFHVURJKSA-N 485.903 5.039 5 20 JKBD Cc1c(C(=O)N2CCC([C@H]3CCCCN3C(=O)c3ccc([N+](=O)[O-])o3)CC2)[nH]c2c(Cl)cccc12 1823612249 PJJKLXCTAUSSLC-LJQANCHMSA-N 498.967 5.178 5 20 JKBD Cc1cc(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)[C@@H]3CCC[C@H]4CCCC[C@H]43)CC2)ncc1[N+](=O)[O-] 1827828473 YZMUVRGFKVDLSZ-HBAHCVPVSA-N 496.652 5.138 5 20 JKBD O=C(c1ccccc1C1CC1)N1CCC([C@@H]2CCCCN2C(=O)c2ccc([N+](=O)[O-])cc2F)CC1 1830497423 FOATUWVEIZHCHM-VWLOTQADSA-N 479.552 5.158 5 20 JKBD Cc1ccc(NC(=O)[C@@H](Sc2nnc(-c3ccc(Cl)cc3)n2N)c2ccccc2)c([N+](=O)[O-])c1 8659205 BTECGAGDQPSINT-FQEVSTJZSA-N 494.964 5.001 5 20 JKBD CCn1c(SCC(=O)Nc2ccc([N+](=O)[O-])cc2Br)nnc1-c1ccc(Cl)cc1 9072125 QKNOXLZXWUMFCT-UHFFFAOYSA-N 496.774 5.020 5 20 JKBD C[C@H](OC(=O)c1cc2sc(Nc3ccccc3)nc2s1)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 10712367 LRVMRDUQJFKCFL-LBPRGKRZSA-N 493.526 5.978 5 20 JKBD CCCCCN(C(=O)c1ccc(Br)c([N+](=O)[O-])c1)c1nc(C)c(C(=O)OCC)s1 11232955 ZDFMJLIOTMAJPT-UHFFFAOYSA-N 484.372 5.136 5 20 JKBD C[C@H](Sc1nc2scc(-c3cccs3)c2c(=O)n1C)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 17667873 UAIBGDNVFRNYGQ-NSHDSACASA-N 497.583 5.535 5 20 JKBD CNC(=O)Nc1cccc(NC(=O)c2ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])c(OC)c2)c1 29618215 DBVSBYVEUUCPHA-UHFFFAOYSA-N 470.869 5.053 5 20 JKBD CCn1c(S[C@@H](C)C(=O)Nc2nc(-c3cccc([N+](=O)[O-])c3)cs2)nnc1-c1cccs1 36654477 USTDFVKSEKPBBM-LBPRGKRZSA-N 486.604 5.178 5 20 JKBD C[C@H](Sc1nnc(-c2ccccc2Cl)n1Cc1ccccc1)C(=O)Nc1ccc([N+](=O)[O-])cc1 409932344 KYXNXUCRLHDCRP-INIZCTEOSA-N 493.976 5.674 5 20 JKBD CCOc1cc(NC(=O)c2occc2CN2c3ccccc3C[C@H]2C)c([N+](=O)[O-])cc1OCC 481932107 PFWJJLLQGDDXPF-MRXNPFEDSA-N 465.506 5.189 5 20 JKBD CCN(C(=O)c1ccc(N[C@H](C)c2ccccn2)c([N+](=O)[O-])c1)[C@H]1CCN([C@H](C)c2ccccc2)C1 500001990 HKFQELRVHPSCBI-LGVFNWMJSA-N 487.604 5.461 5 20 JKBD CC[C@H](C)n1c(SCC(=O)Nc2nc(-c3cccc([N+](=O)[O-])c3)cs2)nnc1-c1ccccc1 504287208 ATIZEKHOALREHP-HNNXBMFYSA-N 494.602 5.679 5 20 JKBD CCc1ccc(NC(=O)c2nnc(CSc3nc4cc5ccccc5cc4c(=O)n3C)s2)cc1 510900479 HPMTZNWZWWAGJA-UHFFFAOYSA-N 487.610 5.045 5 20 JKBD O=[N+]([O-])c1cc(CSc2nnc(CN3CCCCC3)n2-c2ccccc2C(F)(F)F)cs1 515593151 VNTJNVVTLBOHKN-UHFFFAOYSA-N 483.541 5.534 5 20 JKBD Cc1nc(NC(=O)Cn2c3ccccc3c(=O)c3ccccc32)sc1Cc1ccc(F)cc1 515635890 LTXABDRNFMVMNI-UHFFFAOYSA-N 457.530 5.288 5 20 JKBD Cn1cc(C(=O)NC[C@H](c2ccccc2)c2c[nH]c3ccccc23)c(-c2ccc([N+](=O)[O-])cc2)n1 516168050 WQURTPZTADZUEG-JOCHJYFZSA-N 465.513 5.039 5 20 JKBD C[C@@H](NC(=O)C(=O)Nc1ccc(Oc2ccccc2C(F)(F)F)cc1)c1cccc([N+](=O)[O-])c1 520652383 WSXGISXYFPHMGO-CQSZACIVSA-N 473.407 5.222 5 20 JKBD Cc1ccc(Cl)cc1N1CC[C@@H](CNC(=O)c2ccc(N[C@H](C)c3ccccn3)c([N+](=O)[O-])c2)C1 523267219 NKXJPXGQBJRNTH-MOPGFXCFSA-N 493.995 5.381 5 20 JKBD O=C(Nc1cccc(CNC(=O)c2cc([N+](=O)[O-])ccc2Sc2ccccc2)c1)c1cccnc1 603738369 LIODUEZWKRKDHN-UHFFFAOYSA-N 484.537 5.323 5 20 JKBD Cc1ccc(C(=O)C2CCN(C(=O)c3ccc(N4CCC(C)CC4)c([N+](=O)[O-])c3)CC2)c(C)c1 603875628 XFSGLIXGAFJLOJ-UHFFFAOYSA-N 463.578 5.183 5 20 JKBD C[C@H](Nc1ccc(OCc2ccccc2)nc1)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 604044370 OVSVLXZDVCUKRN-AWEZNQCLSA-N 460.412 5.027 5 20 JKBD O=C(Nc1ccccc1C(=O)N1CCCO[C@H](c2ccccc2)C1)c1ccc([N+](=O)[O-])cc1Cl 609233104 PXFMFFJNIAFNKU-QHCPKHFHSA-N 479.920 5.104 5 20 JKBD O=C(Oc1ccc2c(-c3ccc([N+](=O)[O-])cc3)cc(=O)oc2c1)C1CCN(Cc2ccccc2)CC1 727298486 PDBQKFXZGDBNAZ-UHFFFAOYSA-N 484.508 5.186 5 20 JKBD Cc1ccc(NC(=O)[C@H](OC(=O)c2c(Cl)cccc2[N+](=O)[O-])c2ccccc2)c([N+](=O)[O-])c1 730645543 XTMFJDPEEGQJJA-HXUWFJFHSA-N 469.837 5.002 5 20 JKBD O=C(COC(=O)c1csc(-c2cccc([N+](=O)[O-])c2)n1)Nc1ccccc1Sc1ccccc1 747964430 YNBLBLZMWAZMOR-UHFFFAOYSA-N 491.550 5.665 5 20 JKBD Cc1c(C(=O)Nc2nc3c(s2)C[C@H](c2ccccc2)CC3)cc([N+](=O)[O-])c(C)c1[N+](=O)[O-] 748634210 VNNQXARJYIHMAA-OAHLLOKOSA-N 452.492 5.101 5 20 JKBD CCOc1cc(NC(=O)c2cc([N+](=O)[O-])ccc2Sc2ccccc2)c([N+](=O)[O-])cc1OCC 790626437 JLLPKZGQUSUPQU-UHFFFAOYSA-N 483.502 5.704 5 20 JKBD O=C(Nc1ccc(Cl)c([N+](=O)[O-])c1)[C@@H](Sc1nnc(-c2ccccc2F)o1)c1ccccc1 844130798 GTXAQOGAKVZQET-IBGZPJMESA-N 484.896 5.909 5 20 JKBD O=C(C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)Nc1ccnn1C1CCCC1 881384386 BJZPJUJMJRUWJD-OBGWFSINSA-N 473.558 6.086 5 20 JKBD O=[N+]([O-])c1cc(C(F)(F)F)ccc1NCCc1nc(-c2cccnc2Oc2ccccc2)no1 904452662 LTOULONHBQKPOD-UHFFFAOYSA-N 471.395 5.506 5 20 JKBD CN(Cc1nc(-c2cccnc2Oc2ccccc2)no1)c1cc(Br)ccc1[N+](=O)[O-] 904454132 YNPYVFGMDHUANX-UHFFFAOYSA-N 482.294 5.231 5 20 JKBD C[C@@H](OC(=O)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1)c1nc(-c2cccs2)no1 914623118 WPNVZWYASWRTJT-GFCCVEGCSA-N 496.467 5.246 5 20 JKBD COc1ccc(Oc2ccc([N+](=O)[O-])cc2C(=O)O[C@@H](C)C(=O)Nc2ccccc2Cl)cc1 915442649 OGLUKNBQGAXLGI-AWEZNQCLSA-N 470.865 5.233 5 20 JKBD CCc1ccccc1NC(=O)C1=C(C)N(c2ccccc2)C(=S)N[C@@H]1c1ccc([N+](=O)[O-])cc1 917372747 BCFLWDXWTABMPU-XMMPIXPASA-N 472.570 5.506 5 20 JKBD COc1ccc(-c2cc(COC(=O)c3ccc(N[C@H](C)c4ccccn4)c([N+](=O)[O-])c3)on2)cc1 920545681 HSMSBNRXCWPHTQ-MRXNPFEDSA-N 474.473 5.184 5 20 JKBD Cc1c(Cl)cccc1NC(=O)[C@H](C)OC(=O)c1ccc(N[C@@H](C)c2ccccn2)c([N+](=O)[O-])c1 920549421 XUQULNZBAZFIBS-HOTGVXAUSA-N 482.924 5.309 5 20 JKBD C/C(=C\c1ccc(C)o1)C(=O)NC1(c2ccc(NC(=O)c3cc(C)c([N+](=O)[O-])cn3)cc2)CCC1 1788767068 WNQVIJULWKIXDL-GHRIWEEISA-N 474.517 5.051 5 20 JKBD COc1cc(CC(=O)Nc2ccc(C3(NC(=O)c4ccc5ccoc5c4)CCC3)cc2)ccc1[N+](=O)[O-] 1790479187 BFLBIWXCFBTVDJ-UHFFFAOYSA-N 499.523 5.340 5 20 JKBD C[C@H](C(=O)Nc1ccc(C2(NC(=O)/C=C/c3ccc([N+](=O)[O-])o3)CCC2)cc1)c1cccs1 1791815719 UPEOJDYUTWXARZ-SOGBHIHOSA-N 465.531 5.200 5 20 JKBD Cc1ccc(-c2ccccc2C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)Cc2cccc([N+](=O)[O-])c2)cc1 1792477372 ZVWVQBZPKMJYNP-BKFWDETESA-N 483.568 5.065 5 20 JKBD O=C(Nc1cc([C@H]2CCCCN2C(=O)/C=C/c2ccccc2[N+](=O)[O-])[nH]n1)c1c(F)cccc1Cl 1820432651 MOIPPLKHQLFJAJ-YVNCXZRQSA-N 497.914 5.130 5 20 JKBD CC(C)CCC(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)[nH]n1 1821933434 YCRPQFNMCSBYPK-SFHVURJKSA-N 469.567 5.275 5 20 JKBD Cc1cc(CCCC(=O)N2CCC([C@H]3CCCCN3C(=O)C3=CCCC3)CC2)c([N+](=O)[O-])cc1F 1826270128 CGSGCNKEXRZNQF-XMMPIXPASA-N 485.600 5.095 5 20 JKBD O=C(c1ccc([N+](=O)[O-])cc1F)N1CCC([C@@H]2CCCCN2C(=O)c2ccccc2C2CC2)CC1 1832556211 UWEDBIIVSPCAAU-VWLOTQADSA-N 479.552 5.158 5 20 JKBD O=C(Nc1ccc(NC(=O)C2CC2)cc1)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1 10926767 KKOZLQDZBGNLPJ-UHFFFAOYSA-N 451.866 5.641 5 20 JKBD CC(C)C(=O)Nc1ccc(NC(=O)C2CCN(c3ccc(C(F)(F)F)cc3[N+](=O)[O-])CC2)cc1 11714574 HYDIMWXQUYVNLX-UHFFFAOYSA-N 478.471 5.063 5 20 JKBD C[C@@H](OC(=O)c1sc2cc(Cl)ccc2c1Cl)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 17529453 JQCTZIOBQPCFGE-SECBINFHSA-N 464.286 6.084 5 20 JKBD COc1ccc(/C=C(\Cl)c2nc3ccc(Cl)cc3c(=O)[nH]2)cc1OCc1ccc([N+](=O)[O-])cc1 18913890 VCRHRNMZZRCSHW-GRSHGNNSSA-N 498.322 5.809 5 20 JKBD CC(=O)N(c1cccc(C(F)(F)F)c1)c1nc(COC(=O)c2cc(Cl)ccc2[N+](=O)[O-])cs1 23515066 FGIRXKGBBGKOCS-UHFFFAOYSA-N 499.854 5.765 5 20 JKBD COc1ccc(Oc2ccc(Cl)cc2NC(=O)CCCn2c(=O)oc3cc([N+](=O)[O-])ccc32)cc1 26769923 FOONDOQTODLDJB-UHFFFAOYSA-N 497.891 5.376 5 20 JKBD COc1cc(C(=O)Nc2nc(-c3ccccc3)c(C(C)C)s2)c([N+](=O)[O-])cc1OC(F)F 31777455 OICJXFMGQOAVES-UHFFFAOYSA-N 463.462 5.704 5 20 JKBD O=C(Nc1cccc(NC(=O)c2cc([N+](=O)[O-])ccc2NCc2ccccc2)c1)c1ccncc1 31966098 XJURUUIDBZWWNQ-UHFFFAOYSA-N 467.485 5.107 5 20 JKBD O=C(NCCc1ccc([N+](=O)[O-])cc1)Nc1ccc(NC(=O)c2ccccc2)cc1C(F)(F)F 195612894 MBXBCZXIGQXSHJ-UHFFFAOYSA-N 472.423 5.230 5 20 JKBD Cc1csc(Sc2ccc(C(=O)NC[C@@H]3CCCO[C@@H]3c3ccccc3)cc2[N+](=O)[O-])n1 409556754 YFYXSOVKWXSHLZ-GHTZIAJQSA-N 469.588 5.409 5 20 JKBD Cc1ccc2c(c1C)OC[C@H]2N[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Br)c1ccccc1 477036351 UHGOJOOXHVAVMD-FGZHOGPDSA-N 496.361 5.377 5 20 JKBD COc1cc(C(=O)N[C@H](c2ccccc2)c2ccc(Br)cc2F)c([N+](=O)[O-])cc1OC 489487181 UBLQZBNNBQDRPR-OAQYLSRUSA-N 489.297 5.033 5 20 JKBD Cc1ccccc1CN(Cc1cccnc1)C(=O)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-] 490229458 HAPHFZHMDZBVJU-UHFFFAOYSA-N 459.424 5.082 5 20 JKBD O=C(c1csc(-c2ccc([N+](=O)[O-])cc2)n1)N1CCC(c2nc3ccccc3s2)CC1 496451616 VOEQMEKJHAPVMU-UHFFFAOYSA-N 450.545 5.348 5 20 JKBD O=C(Nc1ccc(CN2CCCC2=O)cc1)c1cc([N+](=O)[O-])ccc1Sc1ccc(Cl)cc1 500988833 DDQJLDOBFGWONR-UHFFFAOYSA-N 481.961 5.774 5 20 JKBD O=C(CC1CCCCC1)NC1CCC(C(=O)N(Cc2ccccc2[N+](=O)[O-])CC(F)(F)F)CC1 508923226 NZHKEHLMFNNIQP-UHFFFAOYSA-N 483.531 5.131 5 20 JKBD CC1CCN(C(=O)c2ccc(NC(=O)c3ccc(N[C@@H](C)c4ccccn4)c([N+](=O)[O-])c3)cc2)CC1 509135528 GVSOZGABQLRHCF-IBGZPJMESA-N 487.560 5.287 5 20 JKBD O=C(CCc1cccc(OC2CCCC2)c1)N(Cc1ccccc1[N+](=O)[O-])CC(F)(F)F 511544414 ZDQJNXISFFIJAU-UHFFFAOYSA-N 450.457 5.440 5 20 JKBD C[C@H](NCc1ccc(-c2ccc([N+](=O)[O-])cc2Br)o1)c1cccc(OC(F)F)c1 520949697 MGBPBVRDGAXPIU-LBPRGKRZSA-N 467.266 6.070 5 20 JKBD Cc1nc(COc2ccc(Cl)cc2)sc1C(=O)Nc1cc(-c2cccc([N+](=O)[O-])c2)[nH]n1 523162413 AAJMKYYSKVQJFI-UHFFFAOYSA-N 469.910 5.235 5 20 JKBD O=C(Nc1ccccc1-c1nc2ccccc2s1)c1csc(-c2ccc([N+](=O)[O-])cc2)n1 523301560 IWBOTRYLZGOQJP-UHFFFAOYSA-N 458.524 6.247 5 20 JKBD O=C(Nc1ccc(Br)cn1)c1cccc(NC(=O)c2cc3cc([N+](=O)[O-])ccc3s2)c1 523683699 UEJPZYBOIHNMRZ-UHFFFAOYSA-N 497.330 5.472 5 20 JKBD CC(C)NC(=O)c1ccc(N2CCC(c3nc4cc(Cl)ccc4s3)CC2)c([N+](=O)[O-])c1 589807102 RCSVTGCNDIQGHU-UHFFFAOYSA-N 458.971 5.380 5 20 JKBD COCCN(C(=O)Cc1coc2cc3c(cc12)CCC3)c1nc(-c2ccc([N+](=O)[O-])cc2)cs1 603461426 QPBCDLHCKDSIBO-UHFFFAOYSA-N 477.542 5.175 5 20 JKBD COc1ccc(CSCC(=O)N(Cc2ccccc2)[C@@H](C)c2cccs2)cc1[N+](=O)[O-] 603569275 FJZDTWVJSUWSIJ-KRWDZBQOSA-N 456.589 5.688 5 20 JKBD COc1ccc(Cl)cc1CN[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1 604044738 AEIDSIAEFJGGFQ-OAQYLSRUSA-N 460.317 5.380 5 20 JKBD O=C(Nc1cnn(C[C@H]2CCCO2)c1)c1cc([N+](=O)[O-])ccc1Sc1ccc(Cl)cc1 604097340 ICGCRGQIDYWCJG-QGZVFWFLSA-N 458.927 5.027 5 20 JKBD COc1cccc(Oc2ccc(CNCc3ccc(-c4ccc(OC)cc4[N+](=O)[O-])o3)cn2)c1 608836281 ZNJPCCXGUGQJME-UHFFFAOYSA-N 461.474 5.349 5 20 JKBD COc1cc(C(=O)Nc2ccc3c(c2)CCC(=O)N3C)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 609185675 GDWLEUWUSWRRJI-UHFFFAOYSA-N 481.892 5.210 5 20 JKBD CCOc1ccccc1NC(=O)[C@@H](OC(=O)c1cc([N+](=O)[O-])ccc1Br)c1ccccc1 725985570 NIXHKRSKTLFCIW-NRFANRHFSA-N 499.317 5.293 5 20 JKBD C[C@H](Nc1ccc(C(=O)O[C@@H](c2ccccc2)c2cccnc2)cc1[N+](=O)[O-])c1ccccn1 728419534 UUUQCVVNEZOIHR-BVZFJXPGSA-N 454.486 5.504 5 20 JKBD Cc1cc(-c2noc([C@@H](C)OC(=O)c3csc(-c4ccc([N+](=O)[O-])cc4)n3)n2)ccc1F 747953823 GJWVHJKPMUMVBI-GFCCVEGCSA-N 454.439 5.134 5 20 JKBD Cc1nn(Cc2ccc(C(=O)Nc3ccc(N4CCc5sccc5C4)cc3)cc2)c(C)c1[N+](=O)[O-] 748649925 LVPBTUFHGCEZMW-UHFFFAOYSA-N 487.585 5.333 5 20 JKBD COc1cc(C(=O)Nc2ccccc2SCc2ccccc2)c([N+](=O)[O-])cc1OC(F)F 786753176 NOKVTIMHJXORIO-UHFFFAOYSA-N 460.458 5.749 5 20 JKBD COc1ccc([N+](=O)[O-])cc1OC(=O)[C@H](C)SCc1nc(O)c2c(-c3ccccc3)csc2n1 818033423 MHBQNODHGNPNCR-ZDUSSCGKSA-N 497.554 5.208 5 20 JKBD CC1=C(C(=O)Nc2ccccc2C(F)(F)F)[C@@H](c2ccc(Cl)c([N+](=O)[O-])c2)N(C)C(=O)N1C 916164771 DVYIKWWMYHKSOW-GOSISDBHSA-N 482.846 5.218 5 20 JKBD C[C@H](NC(=S)/C(=C(/O)c1ccc([N+](=O)[O-])cc1)[n+]1ccc2c(c1)CCCC2)c1ccccc1 917611845 FUIXIHSQQGBZAI-SFHVURJKSA-O 460.579 5.323 5 20 JKBD O=C(OCC(=O)N1CCC[C@H]1c1ccc(Cl)c(Cl)c1)c1cc2cc([N+](=O)[O-])ccc2o1 919213490 LKABGWHPZFVHRR-KRWDZBQOSA-N 463.273 5.168 5 20 JKBD O=C(O[C@@H](C(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1)c1ccccc1)c1ccc(-c2cnco2)cc1 919498801 CICWIBZKMJTDQI-JOCHJYFZSA-N 477.860 5.440 5 20 JKBD CC(C)c1nc(C(=O)NC2(c3ccc(NC(=O)Cc4ccc(Cl)cc4[N+](=O)[O-])cc3)CCC2)co1 1786115134 WVOGMUNPWMJAEG-UHFFFAOYSA-N 496.951 5.350 5 20 JKBD O=C(NC1(c2ccc(NC(=O)c3cccc4ccoc34)cc2)CCC1)c1nc2cc([N+](=O)[O-])ccc2[nH]1 1790956976 VNNFLDRDSUIKAG-UHFFFAOYSA-N 495.495 5.279 5 20 JKBD Cc1c(Cl)cccc1C(=O)N1CCC2(CCCN(C(=O)CCc3cccc([N+](=O)[O-])c3)C2)CC1 1806486709 VQTVXVYOHGIEKU-UHFFFAOYSA-N 483.996 5.034 5 20 JKBD Cc1ccc(F)cc1C(=O)N1CCC([C@H]2CCCCN2C(=O)CSc2ccccc2[N+](=O)[O-])CC1 1831775233 IQODLNZWZVQNOL-JOCHJYFZSA-N 499.608 5.068 5 20 JKBD O=C(CSc1nnc(-c2ccccc2Cl)n1C1CCCC1)Nc1cc([N+](=O)[O-])ccc1F 8989069 NHGVITFKBDXQQX-UHFFFAOYSA-N 475.933 5.492 5 20 JKBD Cn1c(S[C@@H](C(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)c2ccccc2)nnc1-c1ccco1 10014183 AQTVAIOGVSGDCA-GOSISDBHSA-N 469.910 5.109 5 20 JKBD O=C(OCc1cn2cc(Cl)ccc2n1)c1ccccc1C(=O)c1ccc(Cl)c([N+](=O)[O-])c1 11029171 RLLNTBHUBYXPMB-UHFFFAOYSA-N 470.268 5.137 5 20 JKBD O=C1/C(=C\c2ccc(-c3ccccc3[N+](=O)[O-])s2)c2ccccc2C(=O)N1Cc1ccccn1 11291927 BXNKGMNBJUYHEO-JCMHNJIXSA-N 467.506 5.442 5 20 JKBD CCOc1ccc([C@H](CNC(=O)c2ccc(OC)c([N+](=O)[O-])c2)c2c[nH]c3ccccc23)cc1OC 16176440 UHXXGWLUPSFPGY-FQEVSTJZSA-N 489.528 5.054 5 20 JKBD COc1ccc(CSc2nnc(S[C@H](C)c3nnc(-c4ccc([N+](=O)[O-])cc4)o3)s2)cc1 17705275 FFNWPBKLRVHSDT-GFCCVEGCSA-N 487.588 5.651 5 20 JKBD O=C(Nc1ccc(Cl)c([N+](=O)[O-])c1)[C@@H](Sc1nnc2[nH]c3ccccc3n12)c1ccccc1 23472246 GFBLUHXGWTZFQO-IBGZPJMESA-N 478.921 5.244 5 20 JKBD CC(C)OCc1ccccc1CN[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1 28340828 OHGFOMUSYKNNRH-XMMPIXPASA-N 467.953 5.643 5 20 JKBD Cc1ccc(NC(=O)[C@@H](Sc2nnc(C)n2-c2ccccc2)c2ccccc2)c([N+](=O)[O-])c1 28606708 VSHURAPQDCVJJM-QFIPXVFZSA-N 459.531 5.264 5 20 JKBD Cc1ccc(NC(=O)c2ccccc2)cc1NC(=O)c1ccc(N[C@H](C)c2ccccn2)c([N+](=O)[O-])c1 108832392 GMAYCXUCNAQHNA-LJQANCHMSA-N 495.539 5.976 5 20 JKBD C[C@H](Sc1ncccc1[N+](=O)[O-])C(=O)N1N=C(c2ccc(Cl)cc2)C[C@H]1c1ccco1 195660996 ULFJQJIDNKKRCA-UGSOOPFHSA-N 456.911 5.095 5 20 JKBD CC(C)Cn1ccc2cc(NC(=O)c3ccc([N+](=O)[O-])cc3I)ccc21 303141918 RHOXVRCLGOXTPQ-UHFFFAOYSA-N 463.275 5.062 5 20 JKBD Cn1c([C@H](NC(=O)c2csc(-c3ccc([N+](=O)[O-])cc3)n2)c2ccccc2)nc2ccccc21 503147635 QMLLZCCNBBMOCO-JOCHJYFZSA-N 469.526 5.124 5 20 JKBD COc1cc(CNC[C@@H]2CCCO[C@H]2c2ccccc2)c([N+](=O)[O-])cc1OCc1ccccc1 509614476 BOINQAQLZXAINR-CUNXSJBXSA-N 462.546 5.440 5 20 JKBD COc1cc(C(=O)N[C@@H](C)c2ccc(C(F)(F)F)cc2)c([N+](=O)[O-])cc1OCc1cscn1 509917116 SVCLDJWPKXRGPC-LBPRGKRZSA-N 481.452 5.149 5 20 JKBD C[C@@H](Sc1nc2ccccc2c(=O)n1Cc1ccccc1)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl 513842899 PWSWIOCLPVCTME-OAHLLOKOSA-N 494.960 5.126 5 20 JKBD C[C@H](Nc1ccc(C(=O)Nc2ccc(CN3CCCC[C@H]3C)cc2)cc1[N+](=O)[O-])c1ccccn1 518439355 NKBSKVKSUGVTAN-UXHICEINSA-N 473.577 5.790 5 20 JKBD Cc1cc(C(=O)N(C[C@H]2CCCO2)c2nc(-c3cccc(C(F)(F)F)c3)cs2)cc([N+](=O)[O-])c1 518907569 STWOCLGPASPWLM-LJQANCHMSA-N 491.491 5.871 5 20 JKBD COc1cc2c(cc1OC)[C@H](c1ccccc1)N(C(=O)[C@H](C)Oc1ccc(Cl)cc1[N+](=O)[O-])CC2 520436407 UZFSTNWWSKNNDS-LMKMVOKYSA-N 496.947 5.207 5 20 JKBD COc1cc([N+](=O)[O-])ccc1NC(=O)CN[C@@H](c1ccc(C)cc1)c1ccc(F)cc1Cl 520831397 HSRXARAZSMKNLY-QHCPKHFHSA-N 457.889 5.022 5 20 JKBD Cn1cnnc1Sc1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2Sc2ccc(Cl)cc2)cc1 522862374 TUOQDDUJVCRHOZ-UHFFFAOYSA-N 497.989 5.931 5 20 JKBD Cc1ccc(-c2c(C(=O)Nc3cccc([N+](=O)[O-])c3)c(C)nc3sc4c(c23)CCOC4)cc1 544407505 JIJFXRUCUCEHOV-UHFFFAOYSA-N 459.527 5.813 5 20 JKBD COCCN(C(=O)[C@@H]1C[C@H]1c1ccccc1C(F)(F)F)c1nc(-c2ccc([N+](=O)[O-])cc2)cs1 589197816 BOHWEWVPLQYZLK-ZWKOTPCHSA-N 491.491 5.520 5 20 JKBD O=[N+]([O-])c1ccc(-c2nn(-c3ccccc3)cc2CN[C@@H](c2ccc(F)cc2)[C@H]2CCCO2)cc1 608837185 XLLUDWKYDKQACL-VPUSJEBWSA-N 472.520 5.597 5 20 JKBD O=C(Nc1ccc(OC(=O)c2csc(-c3cccc([N+](=O)[O-])c3)n2)cc1)c1ccc(F)cc1 728247164 NDEWOQHPTMSKHB-UHFFFAOYSA-N 463.446 5.329 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)Nc2ccc(N3C(=O)c4ccccc4C3=O)c(Cl)c2)cc1SC 728465171 VLXBJICSVFGHGJ-UHFFFAOYSA-N 497.916 5.032 5 20 JKBD CC[C@H](C)c1ccccc1NC(=O)[C@@H](C)OC(=O)c1csc(-c2ccc([N+](=O)[O-])cc2)n1 747958815 VRDAZTCZTOXLQP-LSDHHAIUSA-N 453.520 5.416 5 20 JKBD Cc1ccc(/C(O)=C(/C(=S)NCc2cccs2)[n+]2ccc3c(c2)CCCC3)cc1[N+](=O)[O-] 839413364 LNMPMUMXRWTJMB-UHFFFAOYSA-O 466.608 5.132 5 20 JKBD CCOc1ccc(-c2nc(COC(=O)C3CCN(c4ccccc4[N+](=O)[O-])CC3)cs2)cc1 844240498 GVFIBWUWBWTJSL-UHFFFAOYSA-N 467.547 5.077 5 20 JKBD COc1ccc(-c2nc(Cc3noc(-c4ccc(N[C@@H](C)c5ccccn5)c([N+](=O)[O-])c4)n3)co2)cc1 904331908 JZMCQSMHWUKSEH-INIZCTEOSA-N 498.499 5.467 5 20 JKBD COc1ccc(CSCc2nc(-c3ccc(OCc4cccnc4)cc3)no2)cc1[N+](=O)[O-] 904463884 BYNFEBLMBQHUTC-UHFFFAOYSA-N 464.503 5.061 5 20 JKBD C[C@@H](NC(=O)c1cc([N+](=O)[O-])ccc1Cl)c1cccc(NC(=O)Cc2ccccc2F)c1 916074767 ZBXQOBAKIJHLMH-CQSZACIVSA-N 455.873 5.060 5 20 JKBD C[C@@H](CC(=O)Oc1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2Cl)cc1)c1ccc(F)cc1 918144371 CDZUGDHIFIRBJW-AWEZNQCLSA-N 456.857 5.739 5 20 JKBD Cc1ccc(C)c(-c2nn(CN(Cc3ccc([N+](=O)[O-])cc3)C(C)C)c(=O)c3ccccc23)c1 919950033 CVNVKDTXWJLHRD-UHFFFAOYSA-N 456.546 5.457 5 20 JKBD O=C(C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)N(CC(F)(F)F)C1CC1 920013981 LAXCOMQXTUDJDY-RVDMUPIBSA-N 461.465 5.689 5 20 JKBD O=C(Cc1cc([N+](=O)[O-])ccc1F)Nc1ccc(C2(NC(=O)c3ccc4cnccc4c3)CCC2)cc1 1786671175 PFXNVSIRKOICGA-UHFFFAOYSA-N 498.514 5.273 5 20 JKBD COc1cc(CC(=O)NC2(c3ccc(NC(=O)/C=C/c4cccs4)cc3)CCC2)ccc1[N+](=O)[O-] 1788163556 ITXYBQIBWQVIHN-ZRDIBKRKSA-N 491.569 5.055 5 20 JKBD Cc1cccc(CC(=O)NC2(c3ccc(NC(=O)C4(c5cccc([N+](=O)[O-])c5)CCC4)cc3)CCC2)n1 1790476779 AUADJSHOWSAAMI-UHFFFAOYSA-N 498.583 5.097 5 20 JKBD C[C@@H](C(=O)Nc1ccc(C2(NC(=O)c3cc4cc([N+](=O)[O-])ccc4s3)CCC2)cc1)n1cccn1 1791883647 YWMJFNFEYFWBTB-INIZCTEOSA-N 489.557 5.015 5 20 JKBD Cc1ccc(C(=O)Nc2ccc(C3(NC(=O)CSc4ccccc4[N+](=O)[O-])CCC3)cc2)c(O)c1 1792095068 XXUHNXQRFMGNER-UHFFFAOYSA-N 491.569 5.149 5 20 JKBD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc([N+](=O)[O-])cc1F)c1ccccc1Oc1ccccc1 1800350476 XVIHGKIUJLTFQF-REPLKXPHSA-N 489.503 5.092 5 20 JKBD Cc1ccc(SCC(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3cccc(F)c3[N+](=O)[O-])CC2)cc1 1828344942 RQRSVVGAEZELOI-HSZRJFAPSA-N 499.608 5.068 5 20 JKBD C[C@H](CC(=O)N1CCC([C@H]2CCCCN2C(=O)c2cc(F)cc([N+](=O)[O-])c2)CC1)c1ccccc1 1830615470 GVZJGTPKWHTIKI-KBMIEXCESA-N 481.568 5.161 5 20 JKBD C[C@@H](Sc1ccccc1)C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cccc(F)c2[N+](=O)[O-])CC1 1830617573 VUPPHUBXQJQFJJ-WZONZLPQSA-N 499.608 5.148 5 20 JKBD O=C(CCc1cccc([N+](=O)[O-])c1)N1CCC([C@H]2CCCCN2C(=O)c2ccc(C3CC3)cc2)CC1 1830746619 KDYIYTXDMRSTHW-HHHXNRCGSA-N 489.616 5.338 5 20 JKBD CC(C)n1ncc2c(C(=O)Nc3cc4c(cc3[N+](=O)[O-])OCCCO4)cc(-c3cccs3)nc21 11053636 CWOWGDSNQDQSHM-UHFFFAOYSA-N 479.518 5.063 5 20 JKBD Cc1ccc(Sc2ccc(C(=O)Nc3nc4ccc(S(C)(=O)=O)cc4s3)cc2[N+](=O)[O-])cc1 14462063 JRYBAIRPIHVKEO-UHFFFAOYSA-N 499.595 5.320 5 20 JKBD COCCCn1c(=O)c2ccccc2n2c(SCc3nc4ccccc4c4ccccc34)nnc12 17143768 WQYLFRSKQCDXPI-UHFFFAOYSA-N 481.581 5.074 5 20 JKBD C[C@H](OC(=O)Cc1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1)c1nnc(-c2ccccc2)o1 18961828 QEQUONUXBPRLOG-SFHVURJKSA-N 495.495 5.344 5 20 JKBD CSc1ccccc1NC(=O)[C@@H](C)OC(=O)c1ccc(Sc2nc(C)cs2)c([N+](=O)[O-])c1 22089221 YKUMUGCZUSBFCV-CYBMUJFWSA-N 489.600 5.417 5 20 JKBD O=C(Cn1c2ccccc2c(=O)c2ccccc21)N1CCC(c2nc3cc(Cl)ccc3s2)CC1 25845899 WSZUNUQCBNDEOC-UHFFFAOYSA-N 488.012 5.824 5 20 JKBD c1ccc2c(c1)nc(CSc1nnc(-c3c[nH]c4ccccc34)n1C[C@@H]1CCCO1)c1ccccc12 26042314 QQJKMAUJIYZMRA-IBGZPJMESA-N 491.620 6.599 5 20 JKBD COc1cc(C(=O)Nc2nc3cc(C(F)(F)F)ccc3s2)c([N+](=O)[O-])cc1OC(F)F 26299672 TVMHPSLTDVIDTI-UHFFFAOYSA-N 463.340 5.086 5 20 JKBD O=C(CSc1nc2scc(-c3ccc(F)cc3)c2c(=O)[nH]1)Nc1ccc([N+](=O)[O-])cc1Cl 26701727 GDLVDCREEQANCE-UHFFFAOYSA-N 490.925 5.083 5 20 JKBD COc1ccc(NC(=O)c2cccc([N+](=O)[O-])c2C)cc1NC(=O)c1ccc(Cl)cc1F 59784273 IZMAUBMHJHUUOR-UHFFFAOYSA-N 457.845 5.209 5 20 JKBD Cc1ccc(C(=O)N2CCN(C(=O)c3ccc(Oc4ccc(Cl)cc4[N+](=O)[O-])cc3)CC2)s1 491026248 FQCDNFPAHVDHBE-UHFFFAOYSA-N 485.949 5.009 5 20 JKBD O=C(Nc1cnn(Cc2ccncc2)c1)c1cc([N+](=O)[O-])ccc1Sc1ccc(Cl)cc1 503932519 VBBOZAXCYZYKCQ-UHFFFAOYSA-N 465.922 5.292 5 20 JKBD Cc1ccccc1[C@H]1CCN(C(=O)c2ccccc2NC(=O)c2ccc([N+](=O)[O-])cc2Cl)C1 504953048 FRTSYIIPHQZWDZ-KRWDZBQOSA-N 463.921 5.439 5 20 JKBD C[C@H](Nc1ccc(C(=O)N[C@H](C)c2ccc(C(F)(F)F)cc2)cc1[N+](=O)[O-])c1ccccn1 506889044 DRGSRSRAVBDCPY-CABCVRRESA-N 458.440 5.673 5 20 JKBD COc1cc(C(=O)Nc2nc(-c3ccc(F)c(Cl)c3)cs2)c([N+](=O)[O-])cc1OC(F)F 511621495 FBLKROCJVKXTFH-UHFFFAOYSA-N 473.816 5.373 5 20 JKBD CC(=O)Nc1cccc([C@@H](C)N(Cc2ccccc2)C(=O)c2cc3cc([N+](=O)[O-])ccc3o2)c1 514208434 LYLYICLBJDYBKW-QGZVFWFLSA-N 457.486 5.703 5 20 JKBD CCCOc1cc(NC(=O)N2CC=C(c3c[nH]c4ncccc34)CC2)c([N+](=O)[O-])cc1OCCC 515219334 FXTIEEGGRSTVRX-UHFFFAOYSA-N 479.537 5.370 5 20 JKBD O=C(Nc1cc(-c2nnc3n2CCCCC3)ccc1Cl)c1cc2ccccc2c2cccnc12 515286951 NYRKZHSMRNSOMR-UHFFFAOYSA-N 467.960 6.279 5 20 JKBD COc1cc(CCNC(=O)N2CCC[C@@H]2c2ccc(Cl)c(Cl)c2)c([N+](=O)[O-])cc1OC 515459655 NVWRGNNGAGIZFA-QGZVFWFLSA-N 468.337 5.008 5 20 JKBD CN(C)CCC(=O)Nc1ccc(NC(=O)c2ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])cc2)cc1 521549148 FXTLRUYZBXCUFK-UHFFFAOYSA-N 482.924 5.183 5 20 JKBD Cc1ccc(C(C)C)c(Oc2ccc(CNCc3ccnc(N4CCOCC4)c3)cc2[N+](=O)[O-])c1 551228915 GLYRHNNIJNGAOZ-UHFFFAOYSA-N 476.577 5.340 5 20 JKBD O=C(c1ccc(NCc2ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])cc2)cc1F)N1CCOCC1 600848297 DGCVRWFYIIMDGB-UHFFFAOYSA-N 485.899 5.264 5 20 JKBD O=C(c1c2c(nc3ccccc13)/C(=C\c1cccs1)CC2)N1CCN(c2ccc([N+](=O)[O-])nc2)CC1 603571468 POGOVBOEPOSHON-VLGSPTGOSA-N 497.580 5.049 5 20 JKBD O=C1CCCN1C[C@H](NCc1ccc(-c2ccc([N+](=O)[O-])cc2Br)o1)c1ccccc1 608836061 JBYBUEFOLPSBNA-NRFANRHFSA-N 484.350 5.071 5 20 JKBD Cc1cc([C@@H](C)NC(=O)c2ccc(C(=O)N[C@H](C)c3cc(C)sc3C)c([N+](=O)[O-])c2)c(C)s1 609043952 JUMMIELIPHVERG-HUUCEWRRSA-N 485.631 5.933 5 20 JKBD O=C(C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)Nc1cc(F)c(F)cc1F 609182673 OTAZWMDQSKJFMS-ZROIWOOFSA-N 469.444 6.191 5 20 JKBD C[C@H](Nc1ccc2oc(CC(C)(C)C)nc2c1)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 609419378 PIDFUVDECAMXIL-LBPRGKRZSA-N 464.444 5.783 5 20 JKBD O=[N+]([O-])c1ccc(Sc2nnc(CN3CCCC3)n2-c2ccc(Cl)cc2)c2ccncc12 619709100 SEWPFHZGRXUCIS-UHFFFAOYSA-N 466.954 5.124 5 20 JKBD Cc1c(NC(=O)[C@H](C)OC(=O)c2csc(-c3cccc(C(F)(F)F)c3)n2)cccc1[N+](=O)[O-] 725994309 GLYVRCNNDDNVOU-LBPRGKRZSA-N 479.436 5.230 5 20 JKBD Cc1csc(Sc2ccc(C(=O)N3c4ccc([N+](=O)[O-])cc4C[C@H]3C)cc2[N+](=O)[O-])n1 728808228 CRJFIALFRCTCKH-GFCCVEGCSA-N 456.505 5.011 5 20 JKBD CCOC(=O)c1c(COC(=O)c2csc(-c3cccc([N+](=O)[O-])c3)n2)nc2ccccc2c1C 747962260 OPFLCUARNJEDSD-UHFFFAOYSA-N 477.498 5.109 5 20 JKBD COc1ccc(CCC(=O)Oc2ccc3c(-c4ccc([N+](=O)[O-])cc4)cc(=O)oc3c2)cc1F 790065797 VTFPBQLQHFQDSP-UHFFFAOYSA-N 463.417 5.054 5 20 JKBD CSc1ccccc1NC(=O)[C@H](C)Oc1ccc2c(-c3ccc([N+](=O)[O-])cc3)cc(=O)oc2c1 844161150 YCUFAWHIJJMFRO-HNNXBMFYSA-N 476.510 5.496 5 20 JKBD O=C(Nc1ccc(SC(F)F)cc1)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 864762666 CRGDGOKDCXCZCX-UHFFFAOYSA-N 475.439 5.783 5 20 JKBD COCCN(C(=O)c1ccc(Br)c([N+](=O)[O-])c1)[C@H](C)c1cccc(C(F)(F)F)c1 914515674 GLFWAOMCTCQEKS-GFCCVEGCSA-N 475.261 5.226 5 20 JKBD O=C(Cn1ncc2ccc([N+](=O)[O-])cc21)Nc1nnc(SCc2c(Cl)cccc2Cl)s1 915277827 CFOYSDUSXRJXAH-UHFFFAOYSA-N 495.373 5.034 5 20 JKBD COc1ccc(N2C(=S)N[C@H](c3ccsc3)C(C(=O)Nc3cccc([N+](=O)[O-])c3)=C2C)cc1 916168333 LRNWMNQZGHOGIO-OAQYLSRUSA-N 480.571 5.013 5 20 JKBD CCC(CC)c1cc[n+](/C(C(=S)Nc2ccc(Cl)cc2)=C(/O)c2ccc(C)c([N+](=O)[O-])c2)cc1 916204497 WMJLOSLGUGWMOG-UHFFFAOYSA-O 497.040 7.071 5 20 JKBD O=C(Nc1cccc2c1CCCN2C(=S)Nc1ccc([N+](=O)[O-])cc1)c1ccc(F)cc1 918164383 UJLDYUFEZMROPN-UHFFFAOYSA-N 450.495 5.136 5 20 JKBD C[C@H](NC(=O)c1cc([N+](=O)[O-])ccc1Sc1ccc(Cl)cc1)c1ccc(N2CCOC2=O)cc1 920952766 QJRVCWQASSSREF-HNNXBMFYSA-N 497.960 5.847 5 20 JKBD O=C(Cc1cccc([N+](=O)[O-])c1)Nc1ccc(C2(NC(=O)C3(C(F)(F)F)CCC3)CCC2)cc1 1785792831 YKAUSGXZGYJTNI-UHFFFAOYSA-N 475.467 5.004 5 20 JKBD O=C(Cc1ccc(Cl)cc1[N+](=O)[O-])Nc1ccc(C2(NC(=O)c3cc(Cl)ccn3)CCC2)cc1 1786115761 IKXKZFXHFLQCIO-UHFFFAOYSA-N 499.354 5.287 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)NC1(c2ccc(NC(=O)CCC(F)(F)F)cc2)CCC1 1787871534 MEDPGLJPTVUMPK-UHFFFAOYSA-N 467.419 5.133 5 20 JKBD O=C(NC1(c2ccc(NC(=O)[C@@H]3[C@@H]4CCC[C@H]3c3ccccc3N4)cc2)CCC1)c1ccc([N+](=O)[O-])[nH]1 1787949883 PWXUWPRELYLSAO-XTJBDQBJSA-N 499.571 5.049 5 20 JKBD O=C(C[C@H]1C[C@@H]2CC[C@H]1C2)NC1(c2ccc(NC(=O)c3cc([N+](=O)[O-])cc4c3OCC4)cc2)CCC1 1790045130 HSPDAQIBTZEBHU-WSTZPKSXSA-N 489.572 5.104 5 20 JKBD Cc1ncccc1C(=O)NC1(c2ccc(NC(=O)c3cc(Cl)cc([N+](=O)[O-])c3C)cc2)CCC1 1790773954 KRKLNCJWHLOLCS-UHFFFAOYSA-N 478.936 5.322 5 20 JKBD O=C(Cc1cccc([N+](=O)[O-])c1)NC1(c2ccc(NC(=O)[C@H]3C[C@H]3c3ccccc3)cc2)CCC1 1791528289 YFXOAXAEVZPXNG-DQEYMECFSA-N 469.541 5.075 5 20 JKBD Cc1ccc(CC(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2ccc(Oc3ccccc3)cc2)cc1[N+](=O)[O-] 1800348246 BCNVPDYLJDEHJJ-BKFWDETESA-N 499.567 5.190 5 20 JKBD COc1ccc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cc4cc([N+](=O)[O-])ccc4s2)C3)cc1Cl 1803738232 PEMYMBPPXPZAJY-BJWYYQGGSA-N 499.976 5.037 5 20 JKBD CCC[C@H]1CC[C@H](C(=O)N2CCCC[C@@H]2c2cc(NC(=O)Cc3cccc([N+](=O)[O-])c3)n[nH]2)CC1 1814376952 MXBRUIQXYVAAQY-KKLQWCBXSA-N 481.597 5.159 5 20 JKBD Cc1c(C(=O)N2CCC([C@@H]3CCCCN3C(=O)[C@@H]3CC=CCC3)CC2)cc(Cl)cc1[N+](=O)[O-] 1824106294 WQNVNSQYRIZJDU-KNQAVFIVSA-N 474.001 5.146 5 20 JKBD Cc1ccc(C)c(C(=O)N2CCC([C@H]3CCCCN3C(=O)CSc3ccccc3[N+](=O)[O-])CC2)c1 1831777072 BOVUDPSUKORWQS-HSZRJFAPSA-N 495.645 5.237 5 20 JKBD CCCn1c(S[C@@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)nc2cc(Cl)ccc2c1=O 9398681 ATZPOYHLQWLUME-NSHDSACASA-N 481.361 5.141 5 20 JKBD C[C@@H](Sc1nnc(-c2c[nH]c3ccccc23)o1)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 11347707 KMAGQAMMZPPWLR-SNVBAGLBSA-N 477.424 5.264 5 20 JKBD CC(C)N(Cc1nnc(-c2cccc([N+](=O)[O-])c2)o1)C(=S)Nc1cccc(C(F)(F)F)c1 18143010 LSUBLUDWGOPCNS-UHFFFAOYSA-N 465.457 5.271 5 20 JKBD CCOc1ccccc1NC(=O)[C@H](OC(=O)c1ccc(Br)c([N+](=O)[O-])c1)c1ccccc1 22833644 HUYAZCXHNVFWFQ-OAQYLSRUSA-N 499.317 5.293 5 20 JKBD CCCn1c(C)c(C(=O)OCC(=O)Nc2ccc([N+](=O)[O-])cc2C(F)(F)F)c2cc(OC)ccc21 26977073 RZYHYGZEQXNBKI-UHFFFAOYSA-N 493.438 5.091 5 20 JKBD Cc1cccc(Nc2nn(CN(Cc3ccccc3[N+](=O)[O-])CC(F)(F)F)c(=S)s2)c1 71966573 JGKCXLKWFKVVHI-UHFFFAOYSA-N 469.514 5.656 5 20 JKBD CCCOc1ccc(C(F)(F)F)cc1NC(=O)c1ccc(N[C@@H](C)c2ccccn2)c([N+](=O)[O-])c1 108757383 STCKIRUXXOQROS-HNNXBMFYSA-N 488.466 6.223 5 20 JKBD Cc1cc(-c2csc(NC(=O)c3ccc(N[C@H](C)c4ccccn4)c([N+](=O)[O-])c3)n2)c(C)o1 410080238 CFZZHTUADFOJSJ-CQSZACIVSA-N 463.519 5.749 5 20 JKBD CC(C)CCSc1ccc(C(=O)Nc2cccc(CN3CCCCC3=O)c2)cc1[N+](=O)[O-] 497318561 CXYDMEXFPQODBD-UHFFFAOYSA-N 455.580 5.498 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Cl)[C@H](NCc1cccc(OC(F)F)c1)c1ccccc1 497508400 MQPVGSOKWFQLPQ-HXUWFJFHSA-N 461.852 5.319 5 20 JKBD O=C(Nc1ccc(CN2CCCC2=O)cc1)c1ccc(NCc2ccccc2Cl)c([N+](=O)[O-])c1 500958971 CAVVGLCBIFAIOS-UHFFFAOYSA-N 478.936 5.235 5 20 JKBD CC[C@@H](C)n1c(SCC(=O)Nc2cc([N+](=O)[O-])ccc2OC(F)F)nnc1-c1ccccc1 505043261 ACQXALHXZUAGND-CYBMUJFWSA-N 477.493 5.157 5 20 JKBD CCOc1cc2c(cc1NC(=O)c1ccc(N[C@@H](C)c3ccccn3)c([N+](=O)[O-])c1)O[C@@H](C)C2 506099985 XWTZVRZNLZHBMT-HOTGVXAUSA-N 462.506 5.137 5 20 JKBD O=C(N[C@H]1CCc2c(Cl)cccc21)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 509106551 DCLLTRSVOHJIHP-SFHVURJKSA-N 467.875 5.287 5 20 JKBD C[C@H](NC(=O)c1ccc(N[C@@H](C)c2ccccn2)c([N+](=O)[O-])c1)c1cccc(OCc2ccccn2)c1 509518258 FKENHMHFBHFJLB-PMACEKPBSA-N 497.555 5.628 5 20 JKBD CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)NCc1cccc(NC(=O)c2ccc(F)cc2)c1 509750719 KEUOQKYMWQXKCT-UHFFFAOYSA-N 464.497 5.106 5 20 JKBD COc1ccc([N+](=O)[O-])c(C(=O)Nc2ccc(NC(=O)c3ccccc3F)cc2C(F)(F)F)c1 516754606 OZEWUKYPRVABAK-UHFFFAOYSA-N 477.370 5.266 5 20 JKBD CC(=O)NC[C@H]1CCCN(C(=O)c2c3c(nc4ccccc24)/C(=C/c2ccc([N+](=O)[O-])cc2)CCC3)C1 519206625 LLPSMTOPMSYXMQ-BCIXFCFJSA-N 498.583 5.008 5 20 JKBD Cc1cc(C)n([C@H](C)C(=O)Nc2ccc(NC(=O)N[C@@H](C)c3cccc([N+](=O)[O-])c3)cc2Cl)n1 519501103 HNXILQBFYKVZEC-JKSUJKDBSA-N 484.944 5.144 5 20 JKBD O=C(c1ccoc1)N1CCC(NCc2ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])cc2)CC1 521820222 AQHZXKNLSPJODF-UHFFFAOYSA-N 455.898 5.028 5 20 JKBD O=C(CSc1ccc(C(F)(F)F)cc1[N+](=O)[O-])N(Cc1ccccc1)Cc1ccco1 602090873 UTIGDTGEAURJTP-UHFFFAOYSA-N 450.438 5.528 5 20 JKBD Cc1ccc(-c2csc(NC(=O)c3cc(Cl)ccc3Br)n2)cc1[N+](=O)[O-] 603496391 YLSCLGVDHOVFCM-UHFFFAOYSA-N 452.717 5.695 5 20 JKBD Cc1ccc(-c2nc(NC(=O)c3cc(OCC(F)(F)F)ccc3[N+](=O)[O-])sc2C)cc1 603729774 PZJODWOFMFQZTC-UHFFFAOYSA-N 451.426 5.529 5 20 JKBD C[C@H](Nc1ccc(C(=O)Nc2cccnc2OCc2ccccc2)cc1[N+](=O)[O-])c1ccccn1 604337286 ILVLRKJGBZOSAG-SFHVURJKSA-N 469.501 5.389 5 20 JKBD C[C@@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)N1CCC(c2nc3cc(Cl)ccc3o2)CC1 604445543 INEZKWAUIKCRON-GFCCVEGCSA-N 464.305 5.216 5 20 JKBD O=[N+]([O-])c1ccc(-c2nn(-c3ccccc3)cc2CN[C@H](c2ccccc2)c2nccs2)cc1 608837046 WYAFCRBWRZADGK-RUZDIDTESA-N 467.554 5.783 5 20 JKBD COc1cc(C(=O)Nc2cccc(OCC(F)(F)F)c2C)c([N+](=O)[O-])cc1OCc1cscn1 609022727 UEILCMUVAMUBEW-UHFFFAOYSA-N 497.451 5.141 5 20 JKBD CC(=O)c1csc(NC(=O)c2ccccc2Sc2ccc(C(F)(F)F)cc2[N+](=O)[O-])n1 610428901 OZECKNSELRMRDA-UHFFFAOYSA-N 467.450 5.676 5 20 JKBD CC(=O)Nc1cccc([C@H](C)NC(=O)CCC(=O)c2ccc3ccc4cccc5ccc2c3c45)c1 727754372 QONDKVNKMAVOIR-SFHVURJKSA-N 462.549 6.383 5 20 JKBD O=C(C[C@@H](c1ccccc1)C(F)(F)F)Oc1ccc(NC(=O)c2cccc([N+](=O)[O-])c2)cc1 728457269 WRCUYEZTBRTHRZ-FQEVSTJZSA-N 458.392 5.489 5 20 JKBD CC(=O)N(c1cccc(C(F)(F)F)c1)c1nc(COc2cc(C=O)ccc2[N+](=O)[O-])cs1 748153866 CZPPFDCEQOVGLT-UHFFFAOYSA-N 465.409 5.146 5 20 JKBD C[C@H](Nc1ccc(C(=O)O[C@H](c2cccc(F)c2)c2ccccn2)cc1[N+](=O)[O-])c1ccccn1 750629877 AVZHRDGMVMFDMW-SSOJOUAXSA-N 472.476 5.643 5 20 JKBD O=C(COC(=O)/C(=C\c1ccc(F)cc1)c1cccs1)Nc1ccc([N+](=O)[O-])cc1Cl 772012598 AJTBMLWVYFDHQY-YBEGLDIGSA-N 460.870 5.171 5 20 JKBD Cc1nc(Oc2ccc3c(-c4ccc([N+](=O)[O-])cc4)cc(=O)oc3c2)c2cnn(-c3ccccc3)c2n1 916981779 YWJINHAQJCJEKY-UHFFFAOYSA-N 491.463 5.598 5 20 JKBD O=C(OCC(=O)N1N=C(c2cc3ccccc3o2)C[C@@H]1c1ccco1)c1cc2cc([N+](=O)[O-])ccc2o1 917263424 OHOHRSONIUHSHF-LJQANCHMSA-N 499.435 5.215 5 20 JKBD COc1cccc(N2C(=O)/C(=C/c3ccc(Oc4ccccc4Cl)c([N+](=O)[O-])c3)NC2=S)c1 917610859 FEAQEPXEKQKFIU-WQRHYEAKSA-N 481.917 5.311 5 20 JKBD O=C(CCCn1cnc2ccccc21)Oc1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2Cl)cc1 917952648 CGMODFSWCIGBDX-UHFFFAOYSA-N 478.892 5.236 5 20 JKBD CC(C)(C)c1nc(COC(=O)C/C(=C\c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)no1 919012766 MMDHRARXBAPSOW-FOWTUZBSSA-N 478.530 5.559 5 20 JKBD C[C@@H](Cc1ccccc1F)NC(=O)c1ccccc1NC(=O)c1ccc([N+](=O)[O-])cc1Cl 919853438 OELVIGQKDNVGCL-AWEZNQCLSA-N 455.873 5.001 5 20 JKBD COc1cc(C(=O)O[C@@H](C)c2ccc(F)c(Cl)c2)c([N+](=O)[O-])cc1OCc1cscn1 920161945 MJGOQBSMFFSJBJ-NSHDSACASA-N 466.874 5.349 5 20 JKBD CSc1cccc(NC(=O)[C@@H](C)OC(=O)c2ccc(N[C@H](C)c3ccccn3)c([N+](=O)[O-])c2)c1 920547508 OHSHFEJQANSVSF-HZPDHXFCSA-N 480.546 5.069 5 20 JKBD C[C@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)O[C@@H](C)C(=O)N1c2ccccc2Sc2ccccc21 920777558 KVGGQFSKCQSMLR-GJZGRUSLSA-N 498.944 5.777 5 20 JKBD Cc1nc(F)ccc1C(=O)NC1(c2ccc(NC(=O)Cc3ccc(Cl)cc3[N+](=O)[O-])cc2)CCC1 1786115665 COEDKLCWQWMWLW-UHFFFAOYSA-N 496.926 5.081 5 20 JKBD O=C(CSC1CCCC1)Nc1ccc(C2(NC(=O)CSc3ccccc3[N+](=O)[O-])CCC2)cc1 1786350170 MRFPYHCUAOGUJL-UHFFFAOYSA-N 499.658 5.497 5 20 JKBD O=C(/C=C\c1c[nH]c2ccccc12)Nc1ccc(C2(NC(=O)c3ccc(O)c([N+](=O)[O-])c3)CCC2)cc1 1786780703 HFQDYZNNPLUCSZ-QPEQYQDCSA-N 496.523 5.243 5 20 JKBD O=C(NC1(c2ccc(NC(=O)c3ccnc4ccccc34)cc2)CCC1)c1ccc([N+](=O)[O-])cc1F 1788890948 FACZDVPHFHQECF-UHFFFAOYSA-N 484.487 5.344 5 20 JKBD O=C(Cc1cccc([N+](=O)[O-])c1)NC1(c2ccc(NC(=O)c3ccc4scnc4c3)cc2)CCC1 1789337887 HWNIZHDKMNSYKL-UHFFFAOYSA-N 486.553 5.195 5 20 JKBD O=C(Cc1cc(F)ccc1[N+](=O)[O-])Nc1ccc(C2(NC(=O)CSC3CCCC3)CCC2)cc1 1792307745 VBEOWFKUORQJIB-UHFFFAOYSA-N 485.581 5.086 5 20 JKBD O=C(/C=C/c1ccccc1[N+](=O)[O-])Nc1ccc(C2(NC(=O)CCCc3ccncc3)CCC2)cc1 1792315362 GZXXIBQCRKOOSV-NTEUORMPSA-N 484.556 5.160 5 20 JKBD O=C(c1ccc([N+](=O)[O-])o1)N1CCCC2(CCN(C(=O)c3ccccc3Oc3ccccc3)CC2)C1 1804651474 UAUVAQOBPNUPIE-UHFFFAOYSA-N 489.528 5.139 5 20 JKBD O=C(CCc1ccco1)Nc1cc([C@H]2CCCCN2C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)[nH]n1 1815935801 VEDCLVZLKAUVGT-LJQANCHMSA-N 493.545 5.064 5 20 JKBD CC(C)c1ccc(C(=O)Nc2cc([C@H]3CCCCN3C(=O)Cc3ccc([N+](=O)[O-])cc3F)[nH]n2)cc1 1820592587 UWLKGXPGUBSFLB-HSZRJFAPSA-N 493.539 5.129 5 20 JKBD O=C(Nc1cc([C@H]2CCCCN2C(=O)C2CC3(CCC3)C2)[nH]n1)c1cc2cc([N+](=O)[O-])ccc2s1 1821611134 NDBZSEARWRVPSG-LJQANCHMSA-N 493.589 5.419 5 20 JKBD Cc1csc(C(=O)N2CCC([C@@H]3CCCCN3C(=O)Cc3ccc(Cl)cc3[N+](=O)[O-])CC2)c1 1824161365 LPPKSQUCTMCLPP-FQEVSTJZSA-N 490.025 5.094 5 20 JKBD CCCCC[C@@H](C)C(=O)N1CCC([C@@H]2CCCCN2C(=O)Cc2ccc([N+](=O)[O-])cc2F)CC1 1831294846 RZASYPQCPWWKHA-DVECYGJZSA-N 475.605 5.113 5 20 JKBD C[C@H](CC(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cc(F)cc([N+](=O)[O-])c2)CC1)c1ccccc1 1831509002 GIHJHBLLLVXLET-CLOONOSVSA-N 481.568 5.161 5 20 JKBD CC[C@H](C(=O)N1CCC([C@H]2CCCCN2C(=O)c2ccc([N+](=O)[O-])c(OC)c2)CC1)c1ccccc1 1832696819 XNJVQPSGPXSNAW-BJKOFHAPSA-N 493.604 5.031 5 20 JKBD Cc1c(C(=O)N2CCCC[C@H]2C2CCN(C(=O)c3ccc([N+](=O)[O-])o3)CC2)cccc1C(F)(F)F 1832700099 MHLSNHFVLGJWGM-IBGZPJMESA-N 493.482 5.062 5 20 JKBD CC(=O)Nc1ccc(NC(=O)c2ccc(N3CCC(C)CC3)c([N+](=O)[O-])c2)c(C(F)(F)F)c1 10641180 YTYRVVSYJZCALG-UHFFFAOYSA-N 464.444 5.061 5 20 JKBD Cc1cc(C)c(-c2csc(NC(=O)Cn3c4ccccc4c(=O)c4ccccc43)n2)c(C)c1 11249242 VZZFGTYKSULLPZ-UHFFFAOYSA-N 453.567 5.842 5 20 JKBD O=C(CSc1nnc(-c2c[nH]c3ccccc23)n1C1CC1)Nc1cc(Cl)ccc1[N+](=O)[O-] 17882114 RBXLQGNTNXGJFJ-UHFFFAOYSA-N 468.926 5.054 5 20 JKBD CCCC(=O)Nc1ccc(C(=O)[C@@H](C)Sc2nc3cc4ccccc4cc3c(=O)n2C)cc1 22254295 KDXLMEIYKSINLJ-MRXNPFEDSA-N 459.571 5.189 5 20 JKBD CCCCSc1nnc(S[C@H](C(=O)Nc2ccc(C)cc2[N+](=O)[O-])c2ccccc2)s1 22489801 LJZDQCPLEARDNL-SFHVURJKSA-N 474.633 6.119 5 20 JKBD Cc1ccc([N+](=O)[O-])cc1NC(=O)c1ccccc1SCC(=O)NC12CC3CC(CC(C3)C1)C2 32517115 RYGBEXQAZSUIHL-UHFFFAOYSA-N 479.602 5.333 5 20 JKBD COc1ccc2[nH]cc(C3CCN(C(=O)c4cc(OCC(F)(F)F)ccc4[N+](=O)[O-])CC3)c2c1 108870653 FFUXDUGHHAFABC-UHFFFAOYSA-N 477.439 5.046 5 20 JKBD C[C@H](Nc1ccc(C(=O)Nc2ccc(-c3cn4c(n3)CCCC4)cc2)cc1[N+](=O)[O-])c1ccccn1 410076019 WFEKHSMQYVSBKP-SFHVURJKSA-N 482.544 5.615 5 20 JKBD COc1cc([C@@H]2Nc3ccccc3C(=O)N2Cc2cccnc2)c([N+](=O)[O-])cc1OCc1ccccc1 489306431 SUJCRMXXNLRHFB-HHHXNRCGSA-N 496.523 5.344 5 20 JKBD COc1cc(C(=O)N[C@H]2CCOc3c(-c4ccccc4)cccc32)c([N+](=O)[O-])cc1OC(F)F 505104059 KDVZSQCISCSMPR-SFHVURJKSA-N 470.428 5.125 5 20 JKBD O=C(Nc1cccc(F)c1)C1CCN(C(=O)c2ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])cc2)CC1 505241613 ZIJCVYYOZLDKDJ-UHFFFAOYSA-N 497.910 5.671 5 20 JKBD COc1ccc([C@@H]2CCCN2C(=O)c2ccc(N[C@@H](C)c3ccccn3)c([N+](=O)[O-])c2)cc1OC 506087093 SBULKRUWICCICV-JTSKRJEESA-N 476.533 5.157 5 20 JKBD Cc1cc(C(=O)Nc2cc([N+](=O)[O-])ccc2OC(F)F)c2cc(Br)ccc2n1 508941115 HSKUDIOKGYIRAH-UHFFFAOYSA-N 452.211 5.068 5 20 JKBD CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccc(Cl)c(C(=O)NC2CCCCC2)c1 509259612 HGWPDJWRTZIIRR-UHFFFAOYSA-N 472.973 5.753 5 20 JKBD O=C(Nc1ncc(Cc2cccc(Cl)c2)s1)c1ccc([N+](=O)[O-])cc1I 510911920 CSBFPIFBAHKFJD-UHFFFAOYSA-N 499.717 5.152 5 20 JKBD O=C(c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1)N(Cc1ccco1)C[C@H]1CCCO1 511607187 SPPWBBIWCPBICB-HXUWFJFHSA-N 456.882 5.455 5 20 JKBD Cc1ccc(-c2csc(NC(=O)c3sc4nc5n(c(=O)c4c3C)CCCCC5)n2)cc1[N+](=O)[O-] 514653007 YCFZFCQXGBVDLT-UHFFFAOYSA-N 495.586 5.085 5 20 JKBD C[C@@H](c1ccccc1)n1c(SCCC(=O)Nc2ccc([N+](=O)[O-])cc2)nnc1-c1ccccc1 515574411 RGKFAJAKBYXYBV-SFHVURJKSA-N 473.558 5.584 5 20 JKBD C[C@H]1C[C@@H](C)CN(Cc2ccccc2CN[C@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2C(F)(F)F)C1 515759502 MPYYVOFZFVIHPU-FGTMMUONSA-N 492.542 5.208 5 20 JKBD Cc1nc(NC(=O)CCNc2ccccc2[N+](=O)[O-])sc1-c1nc2ccccc2n1C(F)F 600858672 CXPKXKUMYCADEN-UHFFFAOYSA-N 472.477 5.212 5 20 JKBD CCNc1ccc(C(=O)Nc2sc(C(=O)Nc3ccccc3)c(C)c2C(=O)OCC)cc1[N+](=O)[O-] 603453876 FGKKTWHQPPBXPH-UHFFFAOYSA-N 496.545 5.078 5 20 JKBD O=C(Cc1csc(-c2ccc(Cl)cc2)n1)N(Cc1ccccc1[N+](=O)[O-])CC(F)(F)F 603741887 BZQJVQRWCCRNMA-UHFFFAOYSA-N 469.872 5.505 5 20 JKBD CN(Cc1ccccc1[N+](=O)[O-])C(=O)c1nc(-c2ccccc2)n(-c2cccc(C(F)(F)F)c2)n1 603873281 WUPPWFITCIPHMN-UHFFFAOYSA-N 481.434 5.134 5 20 JKBD Cc1ccc(-n2c(S[C@H](C)C(=O)Nc3cccc([N+](=O)[O-])c3C)nnc2-c2ccccn2)c(C)c1 603917925 NOQGYRYDQHAMBN-GOSISDBHSA-N 488.573 5.282 5 20 JKBD O=C(CCNc1ccc(C(F)(F)F)cc1[N+](=O)[O-])N1CCC(c2nc3cc(Cl)ccc3o2)CC1 603922054 YTJRJHRXQCFVHS-UHFFFAOYSA-N 496.873 5.616 5 20 JKBD C[C@H]1C[C@H](C)CN(c2ccc(C(=O)Nc3ccc(NC(=O)c4ccco4)c(Cl)c3)cc2[N+](=O)[O-])C1 604119247 HPVOTMDHHYHRQM-HOTGVXAUSA-N 496.951 5.828 5 20 JKBD CCN1CCC(n2nccc2NC(=O)c2ccc(Sc3ccc(C)cc3)c([N+](=O)[O-])c2)CC1 609351011 YUPLKHRYOMNWJE-UHFFFAOYSA-N 465.579 5.160 5 20 JKBD COc1ccccc1[C@@H](NC(=O)c1ccc(N[C@@H](C)c2ccccn2)c([N+](=O)[O-])c1)c1ccccc1 609373905 AGZQFZTYFWXCDP-PPHZAIPVSA-N 482.540 5.691 5 20 JKBD CCc1cc[n+](/C(C(=S)N[C@@H](C)c2cccs2)=C(/O)c2ccc(C)c([N+](=O)[O-])c2)cc1 726578913 GVOAWEIAMRWDKI-INIZCTEOSA-O 454.597 5.377 5 20 JKBD O=C(OCC[C@@H]1CCCCN1C(=O)c1csc(Cc2ccc(F)cc2)n1)c1cccc([N+](=O)[O-])c1 726936879 PXSVOELLRAQHKW-FQEVSTJZSA-N 497.548 5.023 5 20 JKBD CN(C(=O)c1cccc(C(=O)Oc2ccc(NC(=O)c3cccc([N+](=O)[O-])c3)cc2)c1)c1ccccc1 729304839 KKFOIJSINXEBFV-UHFFFAOYSA-N 495.491 5.343 5 20 JKBD O=C(OCC(=O)N1CCC[C@H]1c1ccc(Cl)c(Cl)c1)c1c(Cl)cccc1[N+](=O)[O-] 730646802 MQWWANPYXPHKNK-HNNXBMFYSA-N 457.697 5.076 5 20 JKBD CCc1ccccc1NC(=S)/C(=C(/O)c1ccc([N+](=O)[O-])cc1)[n+]1ccc(C(CC)CC)cc1 731122400 JBJMDGJIUNXNBT-UHFFFAOYSA-O 476.622 6.672 5 20 JKBD COc1ccc(-c2nc(COC(=O)c3csc(-c4ccc([N+](=O)[O-])cc4)n3)cs2)cc1OC 747955875 YUDJWUISCYVKCY-UHFFFAOYSA-N 483.527 5.216 5 20 JKBD O=C(Nc1cccc(C(=O)N2CCc3ccccc32)c1)c1cc([N+](=O)[O-])ccc1N1CCCCC1 748197734 AKNDIXLFDRZVBX-UHFFFAOYSA-N 470.529 5.040 5 20 JKBD O=C1/C(=C\c2ccc(-c3ccc([N+](=O)[O-])cc3)s2)c2ccccc2C(=O)N1Cc1ccccn1 817919107 PVIVHAGOKUTCSG-HAHDFKILSA-N 467.506 5.442 5 20 JKBD COc1ccc([C@H](CC(=O)Nc2cc(Cl)c([N+](=O)[O-])cc2OCc2ccccc2)NC(C)=O)cc1 822219980 YWWSJHBXBCQFCB-NRFANRHFSA-N 497.935 5.042 5 20 JKBD CC(=O)N(c1ccc(Cl)cc1)c1nc(COC(=O)c2cc([N+](=O)[O-])c(C)s2)cs1 919070557 QYZHWOZISAHWEE-UHFFFAOYSA-N 451.913 5.116 5 20 JKBD CC(=O)N(c1cccc(Cl)c1)c1nc(COC(=O)c2cc3cc([N+](=O)[O-])ccc3o2)cs1 919212028 QLROEUDLHCTGKM-UHFFFAOYSA-N 471.878 5.493 5 20 JKBD O=C(OCC(=O)N1c2ccccc2Sc2ccc(Cl)cc21)c1cc2cc([N+](=O)[O-])ccc2[nH]1 919516599 SAOJYPUFFPURQS-UHFFFAOYSA-N 479.901 5.716 5 20 JKBD C[C@@H](c1ccccc1)N1CC[C@@H](NC(=O)c2ccccc2NC(=O)c2ccc([N+](=O)[O-])cc2Cl)C1 919857551 PWONIAHFIZYGDQ-PKOBYXMFSA-N 492.963 5.066 5 20 JKBD COc1cc(C(=O)NCc2cccnc2N2CCCCC2)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 921034168 LROPLYMCMIZWDR-UHFFFAOYSA-N 496.951 5.364 5 20 JKBD Cc1cc(Cl)cc(C(=O)NC2(c3ccc(NC(=O)c4ccc([N+](=O)[O-])o4)cc3)CCC2)c1 1785751395 BAUOXHXSZGAUPT-UHFFFAOYSA-N 453.882 5.211 5 20 JKBD O=C(NC1(c2ccc(NC(=O)c3cccc(Br)c3[N+](=O)[O-])cc2)CCC1)c1ccco1 1790751411 CFRYFXOHDOAYKW-UHFFFAOYSA-N 484.306 5.012 5 20 JKBD Cc1c(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)/C=C/c2cc3ccccc3o2)cc(Cl)cc1[N+](=O)[O-] 1797702112 PLXOOBPUSIVDQL-PMPZAWEISA-N 493.947 5.268 5 20 JKBD Cc1ccc(CC(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cccc3c2oc2ccccc23)cc1[N+](=O)[O-] 1801201958 WSHZZBGEHBJGBV-WKCHPHFGSA-N 497.551 5.297 5 20 JKBD Cc1cccc(Cl)c1C(=O)N1CCC2(CCCN(C(=O)CCc3cccc([N+](=O)[O-])c3)C2)CC1 1806492748 FFDPUAUNLRBVTL-UHFFFAOYSA-N 483.996 5.034 5 20 JKBD O=C(Nc1cc([C@H]2CCCCN2C(=O)c2cccs2)[nH]n1)c1cc2cc([N+](=O)[O-])ccc2s1 1821611948 ODAAOBJPSKZCCP-MRXNPFEDSA-N 481.559 5.214 5 20 JKBD O=C(CCc1cccc([N+](=O)[O-])c1)N1CCC([C@@H]2CCCCN2C(=O)CCC2CCCC2)CC1 1826264101 BBHOMCYRDOPVSK-VWLOTQADSA-N 469.626 5.118 5 20 JKBD Cc1ccnc(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3cc4cc([N+](=O)[O-])ccc4s3)CC2)c1 1827759718 UYCVDRFSDUIPNA-JOCHJYFZSA-N 492.601 5.060 5 20 JKBD CC(=O)Nc1cccc([C@@H](C)N(Cc2ccccc2)C(=O)c2ccc(Cl)c([N+](=O)[O-])c2)c1 11088906 CAMOIDQMJNNFOF-MRXNPFEDSA-N 451.910 5.610 5 20 JKBD COc1ccc(NC(=O)C/C(=C/c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)cc1OC 15012274 JQWWBCBXBJPMIX-LGMDPLHJSA-N 475.526 5.791 5 20 JKBD C[C@@H](Sc1nc2cc3ccccc3cc2c(=O)n1C)C(=O)N[C@H](C)c1ccc(Cl)cc1 26580943 CHAVXYNLUVCFBA-HUUCEWRRSA-N 451.979 5.098 5 20 JKBD O=C(Nc1cccc(OC[C@H]2CCCO2)c1)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 45328440 ORDZIFLASYZEMZ-HXUWFJFHSA-N 493.482 5.027 5 20 JKBD Cc1cc(C(=O)Nc2nc(-c3ccc(C)c([N+](=O)[O-])c3)cs2)c2cnn(Cc3cccs3)c2n1 69550974 WMLXLTUSDRSVPW-UHFFFAOYSA-N 490.570 5.442 5 20 JKBD Cc1sc(NC(=O)c2ccc(N[C@H](C)c3ccccn3)c([N+](=O)[O-])c2)nc1-c1ccc(F)cc1 72016628 ZCLNRYGQOIZKSK-CQSZACIVSA-N 477.521 5.986 5 20 JKBD CC1CCN(c2ccc(C(=O)N(C)CCCc3cc(-c4ccccc4)no3)cc2[N+](=O)[O-])CC1 110118741 XAMBKMGLQVRTSH-UHFFFAOYSA-N 462.550 5.191 5 20 JKBD C[C@@H](Nc1ccc(C(=O)Nc2nc(-c3c(F)cccc3F)cs2)cc1[N+](=O)[O-])c1ccccn1 303036149 VCIAJWATKCYKAG-CYBMUJFWSA-N 481.484 5.817 5 20 JKBD COc1ccc(C[C@H](NC(=O)c2cc(SC)c(OC)cc2[N+](=O)[O-])c2ccc(OC)cc2)cc1 481925662 ZCQNYNMIVLJZMX-NRFANRHFSA-N 482.558 5.056 5 20 JKBD CCC(=O)Nc1ccc(NC(=O)C/C(=C\c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)cc1 484114873 QYCWBGJIWXIIFC-OBGWFSINSA-N 486.553 6.122 5 20 JKBD C[C@H](Cc1cccs1)N(Cc1ccc(Cl)cc1)C(=O)c1ccc(-n2cncn2)c([N+](=O)[O-])c1 497036202 QNFVHYRMQFVAFF-MRXNPFEDSA-N 481.965 5.164 5 20 JKBD Cn1c([C@H](NC(=O)c2csc(-c3cccc([N+](=O)[O-])c3)n2)c2ccccc2)nc2ccccc21 503148315 UTSDVLMBJDOJKT-JOCHJYFZSA-N 469.526 5.124 5 20 JKBD CCNc1ccc(C(=O)N(CC(=O)Nc2ccc(Cl)cc2C(F)(F)F)C(C)C)cc1[N+](=O)[O-] 504761154 ZVVSWGHVNPXGMG-UHFFFAOYSA-N 486.878 5.188 5 20 JKBD COc1ccc(NC(=O)NCCc2ccc([N+](=O)[O-])cc2)cc1OCc1ccc2ccccc2n1 524437631 USFPYVCSNGIOHQ-UHFFFAOYSA-N 472.501 5.095 5 20 JKBD Cc1ccc2nc([C@@H]3CCCN(C(=O)c4ccc(N5CCC[C@H](C)C5)c([N+](=O)[O-])c4)C3)[nH]c2c1 551051764 ZPLJFFNLNWYZOZ-AZUAARDMSA-N 461.566 5.036 5 20 JKBD COc1ccc(NC(=O)[C@H](C)SCc2nc(O)c3c(-c4ccccc4)csc3n2)c([N+](=O)[O-])c1 591590080 QHQZLMHABRVVTQ-ZDUSSCGKSA-N 496.570 5.241 5 20 JKBD COc1cc(C(=O)Nc2nc(-c3cc(Cl)ccc3Cl)cs2)c([N+](=O)[O-])cc1OC 600825290 QXKUYGUNWXZYID-UHFFFAOYSA-N 454.291 5.295 5 20 JKBD O=C(Nc1ccc(NCc2ccc(Br)cc2[N+](=O)[O-])c(C(F)(F)F)c1)C1CC1 600847320 BSZZXXZWKMLBIZ-UHFFFAOYSA-N 458.234 5.337 5 20 JKBD O=C(C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1)N1CCC[C@@H]1c1ccsc1 603671927 KVJYKGNVRHWSRA-QGZVFWFLSA-N 453.486 5.255 5 20 JKBD C[C@@H](NC(=O)C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)c1nnc2ccccn12 610428542 ZTHFKZOWOJRSIG-VVZNPABPSA-N 484.541 5.055 5 20 JKBD O=C(Cn1c2ccccc2c(=O)c2ccccc21)Nc1c(C(=O)c2ccco2)oc2ccccc12 651971304 YKHTVFNUNTUNCM-UHFFFAOYSA-N 462.461 5.364 5 20 JKBD CCOc1ccccc1NC(=O)[C@H](OC(=O)c1cc([N+](=O)[O-])ccc1Br)c1ccccc1 725985571 NIXHKRSKTLFCIW-OAQYLSRUSA-N 499.317 5.293 5 20 JKBD CC(=O)N(c1nc(Cn2c(C)nc([N+](=O)[O-])c2Br)cs1)c1c(C)cc(C)cc1Cl 726431961 PHJDCKKPMOQJLM-UHFFFAOYSA-N 498.790 5.322 5 20 JKBD C[C@@H](OC(=O)c1csc(-c2cccc([N+](=O)[O-])c2)n1)C(=O)Nc1cc(Cl)ccc1Cl 747963758 QWBMJOSAJGWTEH-SNVBAGLBSA-N 466.302 5.209 5 20 JKBD O=C(Nc1cc(C2CCCC2)nn1-c1ccccc1)c1cc([N+](=O)[O-])ccc1Br 751073408 HACCYQNTEHBPAA-UHFFFAOYSA-N 455.312 5.453 5 20 JKBD COc1ccccc1/C=C(\C(=O)O[C@@H](C)C(=O)Nc1cccc([N+](=O)[O-])c1C)c1ccccc1 827602765 VBCKPJFTYVDTMS-RWZYYMRUSA-N 460.486 5.023 5 20 JKBD O=C(O[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1)[C@H]1Cc2ccccc2S1 841978870 UBZVIOMHHAIRCG-NHCUHLMSSA-N 468.918 5.188 5 20 JKBD CN(C(=O)Cc1ccc(NCc2c(Br)cccc2[N+](=O)[O-])cc1)c1ccccc1 864020428 ZDODGYXTWBANGT-UHFFFAOYSA-N 454.324 5.175 5 20 JKBD O=C(c1cc(-c2nc3ccccc3s2)nc2ccccc12)N1CCc2ccc([N+](=O)[O-])cc21 889394927 SBRJQXIIKYCVJZ-UHFFFAOYSA-N 452.495 5.623 5 20 JKBD O=C(Nc1cc([N+](=O)[O-])ccc1F)c1ccc(-n2nc(SCc3ccccc3)sc2=S)cc1 913181216 IHKJQNLTLKLIGL-UHFFFAOYSA-N 498.586 6.255 5 20 JKBD O=C(Nc1cc(Cl)c([N+](=O)[O-])cc1OCc1ccccc1)c1cc(-c2cccnc2)on1 915829587 WITWRHULPKUEDX-UHFFFAOYSA-N 450.838 5.130 5 20 JKBD COc1ccc(C)cc1NC(=O)c1cc2ccccc2cc1OC(=O)COc1cccc([N+](=O)[O-])c1 916878850 XOPCGNQBOZFCRA-UHFFFAOYSA-N 486.480 5.302 5 20 JKBD CS(=O)(=O)c1ccc(C(=O)Nc2cccc(-c3ccc(Cl)c(Cl)c3)c2)cc1[N+](=O)[O-] 917816730 MGKZXGKMADWTQU-UHFFFAOYSA-N 465.314 5.224 5 20 JKBD Cc1c(-c2ccccc2)oc2c(C(=O)N(Cc3ccccc3[N+](=O)[O-])CC(F)(F)F)cccc2c1=O 918612112 KXJVLGLGWHRUPD-UHFFFAOYSA-N 496.441 5.881 5 20 JKBD Cc1c([N+](=O)[O-])cc(C(=O)O[C@H](C)C(=O)Nc2ccccc2Sc2ccccc2)cc1[N+](=O)[O-] 919225190 VJJVEBBFPAKHGP-OAHLLOKOSA-N 481.486 5.147 5 20 JKBD CC(C)N(Cc1ccc([N+](=O)[O-])cc1)Cn1nc(-c2cccnc2)n(Cc2ccccc2)c1=S 919950756 SPAHSLWYWJXKOG-UHFFFAOYSA-N 474.590 5.301 5 20 JKBD Cc1ccc(OC(=O)c2ccc(N[C@H](C)c3ccccn3)c([N+](=O)[O-])c2)c(C(=O)NCC(C)C)c1 920285764 PDIJJNRJFJQVMF-GOSISDBHSA-N 476.533 5.076 5 20 JKBD Cc1ccc(NC(=O)c2cccc(C(F)(F)F)c2)cc1NC(=O)c1cc([N+](=O)[O-])ccc1Cl 920844536 FINMMNUSWNSUIQ-UHFFFAOYSA-N 477.826 6.080 5 20 JKBD O=C(/C=C/c1ccccc1[N+](=O)[O-])Nc1ccc(C2(NC(=O)/C=C/c3ccoc3)CCC2)cc1 1792315491 SLBAADDVZQSYNX-PWHKKFIBSA-N 457.486 5.049 5 20 JKBD Cc1cc(CCCC(=O)N2CCCC3(CCN(C(=O)C4CCCCC4)CC3)C2)c([N+](=O)[O-])cc1F 1805820995 BFZJNZUJISOQBH-UHFFFAOYSA-N 487.616 5.177 5 20 JKBD Cc1cc(C(=O)NC[C@@H]2CCN(C(=O)CCCCCC(C)(C)C)[C@@H]2c2cccnc2)ncc1[N+](=O)[O-] 1808669186 YFCLQMYZSYGUEG-SQJMNOBHSA-N 495.624 5.009 5 20 JKBD Cc1cc(C(=O)N2CC[C@H](CNC(=O)CCCCCC(C)(C)C)[C@@H]2c2cccnc2)ncc1[N+](=O)[O-] 1812807178 MWDSCWLLLGUMTF-BWKNWUBXSA-N 495.624 5.009 5 20 JKBD O=C(Nc1cc([C@H]2CCCCN2C(=O)c2ccc([N+](=O)[O-])o2)[nH]n1)c1cccc2c1oc1ccccc12 1821609220 AYPGWWWDKRTCDV-LJQANCHMSA-N 499.483 5.430 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cc3[nH]ccc3s2)CC1 1828335460 XQCRDIUJQHNBPN-FQEVSTJZSA-N 498.580 5.132 5 20 JKBD Cc1cc(C(=O)N2CCC([C@H]3CCCCN3C(=O)c3cc4cc([N+](=O)[O-])ccc4s3)CC2)cn1C 1831060623 BECQMHQWJWWOQC-JOCHJYFZSA-N 494.617 5.004 5 20 JKBD CC(C)CCC(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)CC1 1831382082 OTMHZSGNOWCQID-OAQYLSRUSA-N 471.623 5.479 5 20 JKBD Cc1ccc2c(CC(=O)O[C@@H](C)C(=O)Nc3ccc([N+](=O)[O-])cc3C(F)(F)F)coc2c1C 9784324 ZSWLPTVLBJPIIY-ZDUSSCGKSA-N 464.396 5.090 5 20 JKBD O=C(O[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1)c1ccc(Cl)c([N+](=O)[O-])c1 11025176 GWNFIHMNLXAITR-IBGZPJMESA-N 490.255 5.347 5 20 JKBD Cc1ccc(-c2cc(C(=O)O[C@@H](C)C(=O)Nc3ccccc3[N+](=O)[O-])c3cnn(C(C)C)c3n2)s1 11261264 INLLFHFDTOQKJC-HNNXBMFYSA-N 493.545 5.141 5 20 JKBD Cc1ccc(-c2cc(C(=O)O[C@@H](C)C(=O)Nc3ccc([N+](=O)[O-])cc3Cl)c3c(C)noc3n2)cc1 12177197 NXCOLAAVCUBFST-AWEZNQCLSA-N 494.891 5.252 5 20 JKBD Cc1ccc(Oc2ccc(NC(=O)c3ccc(Sc4nncn4C)c([N+](=O)[O-])c3)cc2)cc1 14792062 ROQRTUDTUJNOEG-UHFFFAOYSA-N 461.503 5.228 5 20 JKBD COc1cccc(NCc2nnc(S[C@@H](C)c3cccc([N+](=O)[O-])c3)n2C2CCCCC2)c1 21605360 OQNUTFHFUMGBKY-KRWDZBQOSA-N 467.595 6.166 5 20 JKBD O=C(NCc1ccccc1)c1nnc(/C(Cl)=C/c2ccc(-c3ccccc3[N+](=O)[O-])o2)s1 22016654 ASMXDJWNFUNNNJ-ATVHPVEESA-N 466.906 5.373 5 20 JKBD CCn1c(SCc2nnc(-c3ccccc3Br)o2)nc2cc3ccccc3cc2c1=O 24891136 HGGYADUKILRFQA-UHFFFAOYSA-N 493.386 5.674 5 20 JKBD CN(C)C(=O)c1cccc(NC(=O)c2cc([N+](=O)[O-])ccc2Sc2ccc(Cl)cc2)c1 25542431 VMQVBUGYYBYBRR-UHFFFAOYSA-N 455.923 5.354 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Cl)[C@H](NCc1ccccc1OC(F)(F)F)c1ccccc1 28623315 XOQGVOSKHJDTGI-HXUWFJFHSA-N 479.842 5.616 5 20 JKBD C[C@@H](Sc1nc2cc3ccccc3cc2c(=O)n1C)c1nc(=O)c2c(-c3ccco3)csc2[nH]1 29590332 GXFRDQBGHTVNEE-CYBMUJFWSA-N 486.578 5.498 5 20 JKBD COc1ccc(Oc2ccc([N+](=O)[O-])cc2C(=O)Nc2ccc(NC(C)=O)c(Cl)c2)cc1 32923986 UKQWZESFHQQWQG-UHFFFAOYSA-N 455.854 5.260 5 20 JKBD CN(Cc1c(F)cccc1Cl)C(=O)c1ccccc1NC(=O)c1ccc([N+](=O)[O-])cc1Cl 36716928 OBNJOUSTNKPDDJ-UHFFFAOYSA-N 476.291 5.565 5 20 JKBD Cc1nc(NC(=O)c2cc(OCC(F)(F)F)ccc2[N+](=O)[O-])sc1Cc1ccccc1F 108360914 KQAFTFWLNLOIIO-UHFFFAOYSA-N 469.416 5.283 5 20 JKBD C[C@@H](Nc1ccc(C(=O)Nc2ccc(OCC(F)(F)F)cc2)cc1[N+](=O)[O-])c1ccccn1 108785677 BCXDINDDEDHKGL-CQSZACIVSA-N 460.412 5.356 5 20 JKBD Cn1ccnc1C(=O)c1ccc(N2CCC(c3nc4cc(Cl)ccc4s3)CC2)c([N+](=O)[O-])c1 109306187 HUTHMUGZWLJYDA-UHFFFAOYSA-N 481.965 5.206 5 20 JKBD CSc1ccc([C@H](CNC(=O)c2ccc([N+](=O)[O-])cc2F)N2CCc3sccc3C2)cc1 302927430 BHAHNHVNBICYFZ-NRFANRHFSA-N 471.579 5.047 5 20 JKBD COc1cc(C(=O)N2CCCC[C@H]2c2ncc[nH]2)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 303143653 QIYHFGGLWUWQDX-INIZCTEOSA-N 456.886 5.140 5 20 JKBD C[C@H](Nc1ccc(C(=O)Nc2ccc3[nH]c(-c4ccco4)nc3c2)cc1[N+](=O)[O-])c1ccccn1 410085859 INWIUPSNCOBXJJ-HNNXBMFYSA-N 468.473 5.552 5 20 JKBD COc1cc(C(=O)N(C)Cc2ncc(C)c(OC)c2C)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 476134837 FGIDNQITUVTLBY-UHFFFAOYSA-N 485.924 5.342 5 20 JKBD COCCN(C(=O)Cc1cc(Cl)ccc1Cl)c1nc(-c2ccc([N+](=O)[O-])cc2)cs1 498272018 LHMMUGLSRVYFOD-UHFFFAOYSA-N 466.346 5.247 5 20 JKBD CCOc1ncccc1CNC(=O)C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1 498531320 DUGRIRLVGSFTOH-XMHGGMMESA-N 474.542 5.245 5 20 JKBD Cc1noc(C)c1NC(=O)c1c2c(nc3ccccc13)/C(=C/c1cccc([N+](=O)[O-])c1)CCC2 499450757 FCIPFLQEQNGJCM-QGOAFFKASA-N 454.486 5.877 5 20 JKBD Cc1cccc(-c2nc(C(C)C)no2)c1NC(=O)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-] 504416623 RQNOQBBZPPALRC-UHFFFAOYSA-N 464.400 5.270 5 20 JKBD Cc1sc(NC(=O)c2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)nc1-c1c(F)cc(F)cc1F 504711060 GGGRLLROAYAJCE-UHFFFAOYSA-N 473.436 5.097 5 20 JKBD Cc1ccc(C(C)C)c(Oc2ccc(CNC3CCN(C4CCN(C)CC4)CC3)cc2[N+](=O)[O-])c1 507901603 GKTNCAASZXKQTP-UHFFFAOYSA-N 480.653 5.467 5 20 JKBD O=C(Nc1cccc(OCc2ccc(F)cc2)c1)c1ccc([N+](=O)[O-])cc1I 509015927 JMPUUUZXGKWRFH-UHFFFAOYSA-N 492.244 5.170 5 20 JKBD O=C(c1ccco1)N1CCC(NCc2ccc(Oc3ccccc3Cl)c([N+](=O)[O-])c2)CC1 509615779 GIJJIQTUPOJWIF-UHFFFAOYSA-N 455.898 5.028 5 20 JKBD Cc1cc(NC(=O)c2ccc(F)cc2Cl)sc1C(=O)N(Cc1ccc([N+](=O)[O-])cc1)C(C)C 509728903 NGZDIXOYGZGMPS-UHFFFAOYSA-N 489.956 6.060 5 20 JKBD COc1ccc([C@@H]2CCCCCN2C(=O)c2cc(OC)c(OCc3cscn3)cc2[N+](=O)[O-])cc1 512293507 MAOMHNALPJUXFU-NRFANRHFSA-N 497.573 5.405 5 20 JKBD CC(C)NC(=O)Nc1ccc(CNCc2ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])cc2)cc1 513627736 YBUJOALWFMRRJH-UHFFFAOYSA-N 468.941 5.860 5 20 JKBD O=[N+]([O-])c1ccc(-c2noc(CSc3nnc(-c4ccccc4)n3-c3ccc(F)cc3)n2)cc1 515133918 NSTKWNPUBLGCAY-UHFFFAOYSA-N 474.477 5.324 5 20 JKBD COc1ccc(NC(=O)Nc2cccc([N+](=O)[O-])c2)cc1NC(=O)c1ccc(Cl)cc1F 515784974 XQZZQEGKMLWBOK-UHFFFAOYSA-N 458.833 5.292 5 20 JKBD Cn1ccnc1[C@H](NCc1ccc(-c2ccc([N+](=O)[O-])cc2Br)o1)c1ccccc1F 518272215 ZBWWPXFCJBYFQQ-OAQYLSRUSA-N 485.313 5.369 5 20 JKBD CC(C)n1c(SCc2nc(-c3cccc([N+](=O)[O-])c3)no2)nnc1-c1ccc(Cl)cc1Cl 603562475 OHKKXDPRTFHTIG-UHFFFAOYSA-N 491.360 6.083 5 20 JKBD Cc1nn(Cc2ccc(C(=O)N3CCC(Oc4ccc(C(C)C)cc4)CC3)cc2)c(C)c1[N+](=O)[O-] 603814403 GFHNVCFFBXVHMS-UHFFFAOYSA-N 476.577 5.263 5 20 JKBD C[C@H](c1ccccc1)n1c(SCC(=O)N2CCc3cc([N+](=O)[O-])ccc32)nnc1-c1ccccc1 603917234 HUCIBOVDQXUHFI-GOSISDBHSA-N 485.569 5.144 5 20 JKBD COCCNC(=O)c1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2Sc2ccccc2)cc1Cl 603967131 NJXVOBNLYCFBIQ-UHFFFAOYSA-N 485.949 5.028 5 20 JKBD CC1CCN(c2ccc(C(=O)Nc3ccc(C(=O)Nc4ccccc4)cc3)cc2[N+](=O)[O-])CC1 604497664 AYCDORADMXHXBW-UHFFFAOYSA-N 458.518 5.336 5 20 JKBD Cc1csc(-c2cccc(NC(=O)N[C@@H](CC(=O)OC(C)C)c3ccccc3[N+](=O)[O-])c2)n1 608841609 WCVARQUGORHKOW-IBGZPJMESA-N 468.535 5.231 5 20 JKBD CC(C)CCN1Cc2cccc(NC(=O)c3cc(OCC(F)(F)F)ccc3[N+](=O)[O-])c2C1 609063335 AAHLLABXHWEXHW-UHFFFAOYSA-N 451.445 5.150 5 20 JKBD CC(C)(C)OC(=O)N1CCCc2cc(NC(=O)c3cc([N+](=O)[O-])ccc3N3CCCC3)ccc21 729410204 LVKCZUQYWVWSCX-UHFFFAOYSA-N 466.538 5.135 5 20 JKBD C[C@H](OC(=O)Cc1coc(-c2ccc(Cl)cc2)n1)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 729782018 YUCIILJCQXXUMC-NSHDSACASA-N 497.813 5.035 5 20 JKBD CC[C@@H](C)Oc1ccccc1/C=C/C(=O)N(Cc1nnc(-c2cccc([N+](=O)[O-])c2)o1)C(C)C 729825519 JEZRXNZUCPOFCZ-KAUXGEHWSA-N 464.522 5.273 5 20 JKBD CN(CCCCCc1cc(-c2ccccc2)no1)C(=O)c1ccc(Br)c([N+](=O)[O-])c1 751195076 VOECYIZLDHHPPR-UHFFFAOYSA-N 472.339 5.497 5 20 JKBD O=c1c2ccccc2[nH]c2ccc(-c3nc(-c4cccc(Cn5cnc6ccccc65)c4)no3)cc12 904492729 PJXNUBLVFKJVSS-UHFFFAOYSA-N 469.504 5.796 5 20 JKBD C[C@@H](OC(=O)c1cc([N+](=O)[O-])ccc1Oc1ccccc1)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl 919192778 ODZJFOMGWNXDSZ-CYBMUJFWSA-N 485.836 5.133 5 20 JKBD Cc1cc(-c2noc([C@H](C)OC(=O)c3ccc(N[C@@H](C)c4ccccn4)c([N+](=O)[O-])c3)n2)ccc1F 920546311 YAGSUTPEUPZDSZ-HOTGVXAUSA-N 491.479 5.578 5 20 JKBD Cc1cc(C(=O)Oc2ccc(NC(=O)c3cccc([N+](=O)[O-])c3)cc2)c2c(C(C)C)noc2n1 920838183 AFOAATIHTJBPBO-UHFFFAOYSA-N 460.446 5.034 5 20 JKBD O=C(/C=C/c1ccc([N+](=O)[O-])o1)Nc1ccc(C2(NC(=O)/C=C/c3ccsc3)CCC2)cc1 1786206354 KMDPLQJBRJDAMQ-QZYCOVMASA-N 463.515 5.110 5 20 JKBD O=C(/C=C/c1ccsc1)Nc1ccc(C2(NC(=O)Cc3cccc([N+](=O)[O-])c3)CCC2)cc1 1786941046 AAYPWTIKNAEZQI-BJMVGYQFSA-N 461.543 5.046 5 20 JKBD COc1ccsc1C(=O)Nc1ccc(C2(NC(=O)Cc3ccc(Cl)cc3[N+](=O)[O-])CCC2)cc1 1789929232 NMQHOMHWPWXSAH-UHFFFAOYSA-N 499.976 5.309 5 20 JKBD C[C@H](C(=O)NC1(c2ccc(NC(=O)c3cc([N+](=O)[O-])cc4c3OCC4)cc2)CCC1)c1cccs1 1790045028 BBVQJAQHAKAQSZ-INIZCTEOSA-N 491.569 5.143 5 20 JKBD O=C(Cc1cc(F)ccc1[N+](=O)[O-])NC1(c2ccc(NC(=O)c3ccc4ccoc4c3)cc2)CCC1 1790894098 FRQJRJUWSRYXBT-UHFFFAOYSA-N 487.487 5.471 5 20 JKBD Cc1cc(C(=O)NC2(c3ccc(NC(=O)c4cc5cc([N+](=O)[O-])ccc5s4)cc3)CCC2)on1 1791011228 RGTUBWZRTWZUNL-UHFFFAOYSA-N 476.514 5.167 5 20 JKBD O=C(Nc1cc([C@H]2CCCCN2C(=O)c2cc3sccc3s2)[nH]n1)c1ccc([N+](=O)[O-])cc1F 1821054883 XGKSGZTWJWPJBI-MRXNPFEDSA-N 499.549 5.353 5 20 JKBD O=C(c1cc(Cl)c(Cl)cc1F)N1CCC([C@H]2CCCCN2C(=O)c2ccc([N+](=O)[O-])o2)CC1 1823617016 XIOFQKANRGOIRM-GOSISDBHSA-N 498.338 5.181 5 20 JKBD Cc1cc2cc(C(=O)N3CCC([C@H]4CCCCN4C(=O)c4cc(F)cc([N+](=O)[O-])c4)CC3)ccc2[nH]1 1830616390 ZBWCJNYLAWRGGT-RUZDIDTESA-N 492.551 5.071 5 20 JKBD O=C(c1cc2cc([N+](=O)[O-])ccc2s1)N1CC2(CCCN2C(=O)[C@@H]2C[C@@H]2c2ccc(Cl)cc2)C1 1843876923 SYJZOMJKPBKDPO-WOJBJXKFSA-N 495.988 5.084 5 20 JKBD CC(=O)N(c1nc(CSc2nc3ccc([N+](=O)[O-])cc3s2)cs1)c1c(C)cc(C)cc1C 10592385 XHZLKCWQBWUPLA-UHFFFAOYSA-N 484.628 6.563 5 20 JKBD CCOc1ccccc1NC(=O)[C@H](C)Oc1ccc2c(-c3ccc([N+](=O)[O-])cc3)cc(=O)oc2c1 15370873 CPZCXJSSIYAIKX-INIZCTEOSA-N 474.469 5.173 5 20 JKBD C[C@@H](Oc1ccc2c(-c3ccc([N+](=O)[O-])cc3)cc(=O)oc2c1)C(=O)Nc1ccccc1OC(F)F 15370891 SLKJUXHTAVWALO-CQSZACIVSA-N 496.422 5.376 5 20 JKBD COc1ccc(NC(=O)[C@@H](C)Sc2nnc(-c3ccc(C(C)(C)C)cc3)o2)c([N+](=O)[O-])c1 18588785 TWWTULFCQOJEQB-CYBMUJFWSA-N 456.524 5.070 5 20 JKBD Cc1ccc(F)cc1NC(=O)[C@H](C)OC(=O)c1ccccc1C(=O)c1ccc(Cl)c([N+](=O)[O-])c1 22669862 TYXQGWWWZBJWTP-AWEZNQCLSA-N 484.867 5.111 5 20 JKBD COc1ccc(NC(=O)CSc2ncnc3scc(-c4ccc(C)cc4)c23)c([N+](=O)[O-])c1 24203472 KBWSCDBGMQEXPY-UHFFFAOYSA-N 466.544 5.314 5 20 JKBD Cc1cccc([N+](=O)[O-])c1NC(=O)COC(=O)c1ccc(COc2ccc3ccccc3c2)o1 25024503 ZXLYBNORRLIDBQ-UHFFFAOYSA-N 460.442 5.024 5 20 JKBD C[C@@H](OC(=O)c1cc2c(F)cccc2s1)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 25035709 XTHHLTAYLRTKGI-SECBINFHSA-N 456.373 5.151 5 20 JKBD Cc1csc(Sc2ccc(C(=O)Nc3cccc(-c4ccnc(C)n4)c3)cc2[N+](=O)[O-])n1 31802938 UHXOOTWFVVBFIC-UHFFFAOYSA-N 463.544 5.529 5 20 JKBD Cc1cc(NC(=O)c2cccc(F)c2)sc1C(=O)Nc1nc(-c2cccc([N+](=O)[O-])c2)c(C)s1 195704380 QYBFUPHRLIKGHO-UHFFFAOYSA-N 496.545 6.040 5 20 JKBD Cc1c(C(C)(C)C)nn(-c2ccccc2)c1NC(=O)c1ccc(N[C@@H](C)c2ccccn2)c([N+](=O)[O-])c1 410024639 FOOULPKWRIOYAK-IBGZPJMESA-N 498.587 6.207 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)Nc2ccc3nc(-c4cccc(F)c4)[nH]c3c2)cc1SC 483037352 CNWMLUGGAWQEOR-UHFFFAOYSA-N 452.467 5.260 5 20 JKBD O=C(Nc1ccc(F)cc1-c1ccc(Cl)cc1)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-] 485760717 HKPPWPHLPVJGOE-UHFFFAOYSA-N 468.790 6.248 5 20 JKBD CCN1C/C(=C/c2ccc(-c3cccc([N+](=O)[O-])c3)s2)c2nc3ccccc3c(C(=O)O)c2C1 489676985 HHFOZHAVEQYMKK-LGMDPLHJSA-N 471.538 5.946 5 20 JKBD O=C(C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)NCC(=O)Nc1cccc(F)c1 497000879 KTJWDEJCRXAQIE-ATVHPVEESA-N 490.516 5.029 5 20 JKBD C[C@@H]1Cc2cc([N+](=O)[O-])ccc2N1C(=O)c1csc(-c2cc(Br)cs2)n1 504386834 DIRUZWPMOWLTSP-SECBINFHSA-N 450.339 5.134 5 20 JKBD Cc1ccc(C(C)C)c(Oc2ccc(CNCc3cccc(CS(C)(=O)=O)c3)cc2[N+](=O)[O-])c1 507915156 RGSPFMNTKANTRU-UHFFFAOYSA-N 482.602 5.653 5 20 JKBD COc1cc(CNCc2ccc(Br)s2)c([N+](=O)[O-])cc1OCc1ccccc1 507928901 FOZYOQRMIOJDEP-UHFFFAOYSA-N 463.353 5.296 5 20 JKBD CN(C)C(=O)c1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2Sc2ccccc2)cc1Cl 510143740 LSIXAQFQHDIKBT-UHFFFAOYSA-N 455.923 5.354 5 20 JKBD COc1cc(C(=O)N(Cc2cccc(F)c2)C2CCCC2)c([N+](=O)[O-])cc1OCc1cscn1 512443605 DZNRSKTVJUOAAA-UHFFFAOYSA-N 485.537 5.363 5 20 JKBD Cc1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2Oc2ccccc2)cc1NC(=O)c1ccncc1 519173443 KFYJUYYHIBBGIH-UHFFFAOYSA-N 468.469 5.595 5 20 JKBD Cc1ccc(C(N)=O)cc1NC(=O)c1c2c(nc3ccccc13)/C(=C/c1ccc([N+](=O)[O-])cc1)CCC2 520078811 IQTUZIASFVYZFV-XDJHFCHBSA-N 492.535 5.680 5 20 JKBD O=c1c(Cl)c(NCc2ccc(COCc3ccccc3)cc2)cnn1-c1ccc([N+](=O)[O-])cc1 523297461 UGOGBPQZJHQRNJ-UHFFFAOYSA-N 476.920 5.123 5 20 JKBD C[C@H](NC(=O)c1ccccc1Sc1ccc(C(F)(F)F)cc1[N+](=O)[O-])c1nc2ccccc2[nH]1 551579741 ZLWLRHZRHAAJCG-ZDUSSCGKSA-N 486.475 6.132 5 20 JKBD O=C(NCc1nccn1C(F)F)c1c2c(nc3ccccc13)/C(=C\c1ccc([N+](=O)[O-])cc1)CCC2 561501658 CUHGIRJGYACPTQ-VKAVYKQESA-N 489.482 5.542 5 20 JKBD O=[N+]([O-])c1ccc(Nc2ccccc2)c(NCc2nc(O)c3ccc(C(F)(F)F)cc3n2)c1 603897314 GSZPHNSUYGMRDG-UHFFFAOYSA-N 455.396 5.618 5 20 JKBD COc1cccc(/C=C(/CC(=O)N[C@H](C)c2cccc([N+](=O)[O-])c2)c2nc3ccccc3s2)c1 603966492 AMJSHDNUJMWXIM-VJOZSWGJSA-N 473.554 6.021 5 20 JKBD CCOC1CCN(C(=O)c2c3c(nc4ccccc24)/C(=C/c2cccc([N+](=O)[O-])c2)CCC3)CC1 604255777 VDJNLNRHXLFUAK-LVZFUZTISA-N 471.557 5.661 5 20 JKBD Cc1nc(NC(=O)c2ccc(N[C@H](C)c3ccccn3)c([N+](=O)[O-])c2)sc1Cc1ccccc1 604309674 UXMRQBXGHRYGOS-MRXNPFEDSA-N 473.558 5.771 5 20 JKBD C[C@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)Nc1cc(Cl)ccc1OCC(F)(F)F 604446712 PCSXYYKMAKPFEY-VIFPVBQESA-N 453.200 5.249 5 20 JKBD O=C(Cc1ccc(NC(=O)c2csc(-c3ccc([N+](=O)[O-])cc3)n2)cc1)Nc1ccccc1F 609063814 CBAMHEBXKHOFMN-UHFFFAOYSA-N 476.489 5.291 5 20 JKBD C[C@H](Nc1ccc(C(=O)Nc2cccnc2Oc2ccccc2)cc1[N+](=O)[O-])c1ccccn1 609163648 SWBSJRULMWELFH-KRWDZBQOSA-N 455.474 5.603 5 20 JKBD Cc1nc(COc2ccc(Cl)cc2)sc1C(=O)Nc1cc2c(cc1[N+](=O)[O-])OCCCO2 619215478 AKVLAGOZWNUYJZ-UHFFFAOYSA-N 475.910 5.006 5 20 JKBD CNC(=O)c1ccccc1NC(=O)C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1 750885383 PEUYWRFSMMHDSG-SAPNQHFASA-N 472.526 5.134 5 20 JKBD CN(Cc1ccccc1NCc1c(Br)cccc1[N+](=O)[O-])C(=O)c1cc2ccccc2o1 864029213 DZZUIDKIEIGEGP-UHFFFAOYSA-N 494.345 5.988 5 20 JKBD CC(C)(NC(=O)c1cccc(Cl)c1)c1noc(-c2csc(-c3cccc([N+](=O)[O-])c3)n2)n1 904598468 WHIPJEGBQSQLGQ-UHFFFAOYSA-N 469.910 5.087 5 20 JKBD O=C(NCc1ccc(F)cc1)c1nnc(/C(Cl)=C\c2ccc(-c3cccc([N+](=O)[O-])c3)o2)s1 912963376 JCEADWBBZKVTLX-WOJGMQOQSA-N 484.896 5.512 5 20 JKBD Cc1sc2ncn(Cc3c(Br)cccc3[N+](=O)[O-])c(=O)c2c1-c1ccccc1 915668487 BCHHACPZANPNCH-UHFFFAOYSA-N 456.321 5.152 5 20 JKBD CC1=C(C(=O)Nc2ccc(F)cc2)[C@@H](c2cc([N+](=O)[O-])c(F)cc2F)NC(=S)N1c1ccccc1 916723082 GCWHLVWBSMJNHA-JOCHJYFZSA-N 498.486 5.361 5 20 JKBD C[C@H]1C[C@H]1c1ccc(CNC(=O)c2ccccc2NC(=O)c2ccc([N+](=O)[O-])cc2Cl)o1 918632466 HGMRJZNPKOHEDJ-SCLBCKFNSA-N 453.882 5.147 5 20 JKBD C[C@@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)Nc1cc(NC(=O)OC(C)(C)C)ccc1F 920819494 PZUFKSVBTUFMGC-LLVKDONJSA-N 453.854 5.140 5 20 JKBD O=C(/C=C/c1cccs1)Nc1ccc(C2(NC(=O)/C=C/c3ccc([N+](=O)[O-])o3)CCC2)cc1 1788160437 BBZNCVDEINXFLB-TXSAMIJNSA-N 463.515 5.110 5 20 JKBD Cc1ccc(CC(=O)Nc2ccc(C3(NC(=O)c4ccc5ncoc5c4)CCC3)cc2)cc1[N+](=O)[O-] 1790524122 GWJCZRVCGBHSHZ-UHFFFAOYSA-N 484.512 5.035 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)NC1(c2ccc(NC(=O)CCCn3cccc3)cc2)CCC1 1791902058 DJHSXIWQDOUJKT-UHFFFAOYSA-N 478.524 5.072 5 20 JKBD COc1c(Cl)cccc1C(=O)Nc1ccc(C2(NC(=O)/C=C/c3ccc([N+](=O)[O-])o3)CCC2)cc1 1792145141 HLDUDEVUXNAGNV-ZRDIBKRKSA-N 495.919 5.311 5 20 JKBD O=C(Cc1cc(F)ccc1[N+](=O)[O-])Nc1ccc(C2(NC(=O)CSc3ccccc3)CCC2)cc1 1792311036 PCXACEUBJAOOFW-UHFFFAOYSA-N 493.560 5.203 5 20 JKBD O=C(CCCC(F)(F)F)N1CCCC2(CCN(C(=O)c3cc4cc([N+](=O)[O-])ccc4s3)CC2)C1 1806542185 VZZXSQTXOBBFNL-UHFFFAOYSA-N 497.539 5.387 5 20 JKBD CC[C@@H](C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cc(F)cc([N+](=O)[O-])c2)CC1)c1ccccc1 1826316577 KEQKIXWRBPLPQS-JWQCQUIFSA-N 481.568 5.161 5 20 JKBD C[C@@H]1C[C@@]1(C)C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)CC1 1831061114 MRORSNZFLMHOKH-KQUPGTECSA-N 469.607 5.089 5 20 JKBD O=C(c1cc2ccsc2[nH]1)N1CCC([C@@H]2CCCCN2C(=O)/C=C/c2ccccc2[N+](=O)[O-])CC1 1832904795 WZGHQTKHOFMXMS-UVIRAJKCSA-N 492.601 5.084 5 20 JKBD O=C(c1cc2cc[nH]c2cc1Cl)N1CC2(CCCN2C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)C1 1845739044 GDKSQSANQYDPRA-UHFFFAOYSA-N 494.960 5.075 5 20 JKBD O=C(Nc1ccccc1)c1nnc(/C(Cl)=C/c2ccc(-c3ccc([N+](=O)[O-])cc3)o2)s1 22608372 ZRRYVQHTEVCWQZ-ATVHPVEESA-N 452.879 5.696 5 20 JKBD CSc1ccc([N+](=O)[O-])c(C(=O)N(Cc2ccccc2)[C@@H](C)c2cccc(NC(C)=O)c2)c1 23193743 SKIDVIGCCKCBIU-KRWDZBQOSA-N 463.559 5.679 5 20 JKBD O=C(Nc1ccccc1C(=O)NCCCCc1ccccc1)c1ccc([N+](=O)[O-])cc1Cl 24758194 PWPYHTZZQXLHBK-UHFFFAOYSA-N 451.910 5.253 5 20 JKBD COc1cc(C(=O)Nc2nc(-c3ccc(Cl)cc3Cl)cs2)c([N+](=O)[O-])cc1OC(F)F 29583252 TYNCJZVHKHRSPD-UHFFFAOYSA-N 490.271 5.887 5 20 JKBD O=C(Nc1ccc(C(=O)N2CCc3ccccc32)cc1)c1csc(-c2ccc([N+](=O)[O-])cc2)n1 216266294 UNJCLENORBJATQ-UHFFFAOYSA-N 470.510 5.174 5 20 JKBD CCOc1ccc(Br)cc1NC(=O)c1ccc(N[C@H](C)c2ccccn2)c([N+](=O)[O-])c1 303203985 OXYRWCWLFZYHGK-CQSZACIVSA-N 485.338 5.576 5 20 JKBD C[C@@H](Nc1ccc(C(=O)N2CCC[C@H]2c2cccc(Br)c2)cc1[N+](=O)[O-])c1ccccn1 410088394 PDJVBJZTMVGLFX-ZHRRBRCNSA-N 495.377 5.903 5 20 JKBD CC(=O)Nc1cccc(NC(=O)c2ccc(Sc3nc4ccccc4s3)c([N+](=O)[O-])c2)c1C 484262322 JQMUFMKLSAHODH-UHFFFAOYSA-N 478.555 5.875 5 20 JKBD O=C(Nc1nc(-c2ccc(-c3ccccc3)cc2)cs1)c1cc2c(cc1[N+](=O)[O-])OCCO2 484477046 WVHQIWJFZZSNHA-UHFFFAOYSA-N 459.483 5.409 5 20 JKBD CC(C)Oc1ccc(-c2nc(C(=O)N(Cc3ccccc3[N+](=O)[O-])CC(F)(F)F)cs2)cc1 501941243 VGDSUJBCTVZFPM-UHFFFAOYSA-N 479.480 5.710 5 20 JKBD CCc1cc(Sc2nnc(COc3ccccc3Cl)n2C)nc(-c2ccc([N+](=O)[O-])cc2)n1 507104168 QACRJQLFGLAOBK-UHFFFAOYSA-N 482.953 5.126 5 20 JKBD C[C@H](NC[C@H](c1ccccc1)c1c[nH]c2ccccc12)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 510297338 KCZBSECZZXDHJF-HTAPYJJXSA-N 453.502 5.609 5 20 JKBD Cc1c([C@H](C)NC(=O)C/C(=C\c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)cnn1C 512792478 KWVGDVVXRBQABU-BRFSQIRFSA-N 461.547 5.055 5 20 JKBD CCCOc1cc(NC(=O)c2cn(C)nc2-c2ccccc2Cl)c([N+](=O)[O-])cc1OCCC 517488466 YLKLEYHCVFFXGS-UHFFFAOYSA-N 472.929 5.479 5 20 JKBD O=[N+]([O-])c1ccc(-c2ccc(CNC[C@H]3CCN(c4ccccc4)C3)o2)c(Br)c1 517538848 MRPLEEMLFFFGAU-MRXNPFEDSA-N 456.340 5.233 5 20 JKBD Cc1ccc(Sc2ccc(CN[C@H](c3ccccc3F)c3nccn3C)cc2[N+](=O)[O-])cc1 518770810 CACTUFZUSAIJJG-XMMPIXPASA-N 462.550 5.806 5 20 JKBD C[C@H]1CCC[C@H](C)N1C(=O)c1cc(Cl)ccc1NC(=O)c1ccn(-c2ccc([N+](=O)[O-])cc2)n1 520020611 YEARBJYWFHKSDD-HOTGVXAUSA-N 481.940 5.089 5 20 JKBD C[C@@H](NCc1ccc(-c2ccc([N+](=O)[O-])cc2)s1)c1cccc(NC(=O)c2ccccc2)c1 520949066 UHBPFQFXRNMRLN-GOSISDBHSA-N 457.555 6.426 5 20 JKBD CC(=O)Nc1cccc(OCCNCc2ccc(Oc3ccccc3Cl)c([N+](=O)[O-])c2)c1 521829835 XQAWNOOAFMCGOZ-UHFFFAOYSA-N 455.898 5.168 5 20 JKBD Cc1cc(=O)nc(-c2ccc(NC(=O)c3cc([N+](=O)[O-])ccc3Sc3ccc(Cl)cc3)cc2)[nH]1 522260182 OLDWWSDKPCLPHR-UHFFFAOYSA-N 492.944 5.710 5 20 JKBD O=C(Nc1ccc(-n2ccnn2)cc1)c1cc([N+](=O)[O-])ccc1Sc1ccc(Cl)cc1 524274675 RQWGKDWHNAJYIX-UHFFFAOYSA-N 451.895 5.232 5 20 JKBD O=[N+]([O-])c1ccc(-c2ccc(CN[C@@H](c3ccccc3)[C@@H]3CCCO3)o2)c(Br)c1 555190347 AXEQLTWBEFGIRA-VXKWHMMOSA-N 457.324 5.627 5 20 JKBD C[C@H](NC(=O)C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)c1nc2ccccc2[nH]1 560276590 OARXDBUYVBLNAZ-KXGFGANYSA-N 483.553 5.889 5 20 JKBD CS(=O)(=O)c1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2Sc2ccc(Cl)cc2)cc1 603459951 FPRPLCLUOICFIH-UHFFFAOYSA-N 462.936 5.055 5 20 JKBD Cc1c(C(=O)Nc2ccc(N[C@H](C)c3ccccc3)c(Cl)c2)nnn1-c1cccc([N+](=O)[O-])c1 609072448 QEYXEWIZLSOXEK-OAHLLOKOSA-N 476.924 5.563 5 20 JKBD Cc1c(Cl)cccc1-n1c(Sc2nc3sccn3c2[N+](=O)[O-])nnc1-c1ccncc1 619669528 OPGZHVFIWNQAOP-UHFFFAOYSA-N 469.939 5.060 5 20 JKBD C[C@@H](Cc1ccc(Cl)cc1Cl)C(=O)O[C@H](C)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 730636384 VKCBJTDEAGZULZ-NWDGAFQWSA-N 450.278 5.435 5 20 JKBD O=C(OC[C@@H]1CCCN1C(=O)c1ccccc1[N+](=O)[O-])[C@H]1CC=CC[C@@H]1c1nc2ccccc2s1 730704915 WHPYOLYMIOBJHS-FHWLQOOXSA-N 491.569 5.102 5 20 JKBD Cc1nn(Cc2ccc(C(=O)O[C@H](C)c3ccccc3NC(=O)c3ccccc3)cc2)c(C)c1[N+](=O)[O-] 748019607 ARYSCGCQYHKZJT-HXUWFJFHSA-N 498.539 5.627 5 20 JKBD Cc1c(C(=O)N(Cc2ccc(Cl)c(Cl)c2)Cc2ccccn2)cc([N+](=O)[O-])c(C)c1[N+](=O)[O-] 748641075 PSXVSWXCEGWJCX-UHFFFAOYSA-N 489.315 5.664 5 20 JKBD C[C@H](CC(=O)OCC(=O)Nc1c(Br)cc([N+](=O)[O-])cc1Br)CC(C)(C)C 866536797 VOHFVQLPRQYUEY-SNVBAGLBSA-N 494.180 5.064 5 20 JKBD C[C@@H](Nc1ccc(-c2nc(-c3ccc(Oc4ccccc4)nc3)no2)cc1[N+](=O)[O-])c1ccccn1 904447904 MYUJGNRTBKCZBG-QGZVFWFLSA-N 480.484 6.067 5 20 JKBD O=C(Nc1cccc(/C=C\c2ccnc(-c3cccc([N+](=O)[O-])c3)[n+]2[O-])c1)c1ccc(Cl)cc1 915987653 HXSZASBBFNOSOC-GHXNOFRVSA-N 472.888 5.366 5 20 JKBD Cc1nc(CN(C(=O)c2ccc(Br)c([N+](=O)[O-])c2)c2ccc(F)cc2)cs1 916086353 PNRQOHHDOPWNIT-UHFFFAOYSA-N 450.289 5.108 5 20 JKBD CCN(C(=O)Cc1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2N2CCCC2)cc1)c1ccccc1 918645533 BQNOANGQHNTMFS-UHFFFAOYSA-N 472.545 5.043 5 20 JKBD CC(C)Oc1cc(Br)ccc1C(=O)O[C@@H](C)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 920668599 XYEFWYGYUIERSI-LBPRGKRZSA-N 476.283 5.113 5 20 JKBD O=C(/C=C/c1ccccc1[N+](=O)[O-])Nc1ccc(C2(NC(=O)c3ccnc(Cl)c3)CCC2)cc1 1792315547 ADRPGZNFBBTHDK-IZZDOVSWSA-N 476.920 5.104 5 20 JKBD Cc1ccc(CCC(=O)N2CCC3(CCCN(C(=O)c4ccc([N+](=O)[O-])o4)C3)CC2)c2ccccc12 1804654340 ZNYYUQBRYXRQPO-UHFFFAOYSA-N 489.572 5.127 5 20 JKBD Cc1cc(CCCC(=O)Nc2cc([C@@H]3CCCCN3C(=O)[C@@H]3CC=CCC3)[nH]n2)c([N+](=O)[O-])cc1F 1815071494 UUFXMJDCQRLGSQ-GCJKJVERSA-N 497.571 5.137 5 20 JKBD Cc1cscc1C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cc(Cl)cc([N+](=O)[O-])c2C)n[nH]1 1821294974 ZPQAUEPSIQSAOW-GOSISDBHSA-N 487.969 5.269 5 20 JKBD CC1=CC[C@H](C(=O)N2CCCC[C@@H]2c2cc(NC(=O)c3cc4cc([N+](=O)[O-])ccc4s3)n[nH]2)CC1 1821609771 MNESBUMZGZMUTJ-OXJNMPFZSA-N 493.589 5.585 5 20 JKBD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2cccs2)[nH]n1)c1cc2cc([N+](=O)[O-])ccc2s1 1821611945 ODAAOBJPSKZCCP-INIZCTEOSA-N 481.559 5.214 5 20 JKBD O=C(Cc1ccc(Cl)cc1[N+](=O)[O-])N1CCC([C@H]2CCCCN2C(=O)/C=C/C2CCCC2)CC1 1830347144 VYXNHIBPUNKVAV-OXHGWOFKSA-N 488.028 5.157 5 20 JKBD Cc1ccc([C@@H](C)C(=O)N2CCC([C@@H]3CCCCN3C(=O)c3ccc([N+](=O)[O-])cc3F)CC2)cc1 1830498489 XIQIHKOBUKCTEI-CLOONOSVSA-N 481.568 5.079 5 20 JKBD O=C(c1ccc([N+](=O)[O-])cc1F)N1CCC([C@@H]2CCCCN2C(=O)c2ccc(C3CC3)cc2)CC1 1830749858 KBKFCTICXUNTNT-VWLOTQADSA-N 479.552 5.158 5 20 JKBD COc1ccccc1NC(=O)c1ccc(NC(=O)Cn2c3ccccc3c(=O)c3ccccc32)cc1 11247728 FARVDPCOJXGYAE-UHFFFAOYSA-N 477.520 5.054 5 20 JKBD C[C@@H](Sc1nnc(-c2ccc(F)cc2)o1)C(=O)Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1 12678006 WOAQRSNQFAUBHD-LLVKDONJSA-N 471.495 5.027 5 20 JKBD CC(C)c1ccc(-n2ccnc2SCC(=O)O[C@@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)cc1 17831739 GBYPJDZGJNPVLN-INIZCTEOSA-N 493.545 5.350 5 20 JKBD CCOc1cc([N+](=O)[O-])c(C(=O)Nc2nc(-c3ccc(Br)cc3)c(C)s2)cc1OC 19358306 NUJDXFQXVGTGCO-UHFFFAOYSA-N 492.351 5.449 5 20 JKBD CCn1c(-c2ccc3c(c2)OCCO3)cnc1S[C@H](C)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl 23291220 FLYAJHSHECTLAK-CYBMUJFWSA-N 488.953 5.022 5 20 JKBD O=C(Nc1ccc(Cl)c(-c2nnc3n2CCCCC3)c1)c1ccc(N2CCCC2)c([N+](=O)[O-])c1 69558773 WQGALVNMOIGNJQ-UHFFFAOYSA-N 480.956 5.086 5 20 JKBD C[C@@H](Sc1ncc(-c2ccccc2)n1CC(F)(F)F)C(=O)Nc1cccc([N+](=O)[O-])c1 109622070 XHLLNSWCWXOPLZ-CYBMUJFWSA-N 450.442 5.140 5 20 JKBD O=C(c1csc(-c2cccc([N+](=O)[O-])c2)n1)N1CCC[C@H]1c1cccc(Br)c1 215800745 RFMISTPDVSSOBQ-SFHVURJKSA-N 458.337 5.458 5 20 JKBD COc1cc(CCNC(=O)N(Cc2ccccc2)[C@@H](C)c2cccs2)c([N+](=O)[O-])cc1OC 480571576 KYQNCDWVSRJCNS-KRWDZBQOSA-N 469.563 5.189 5 20 JKBD COc1cc(C(=O)Nc2ccc(N3CCOCC3)cc2C)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 497334101 NEVDYZMIGIIXDD-UHFFFAOYSA-N 497.935 5.446 5 20 JKBD CCN(C(=O)NCc1ccccc1[N+](=O)[O-])[C@@H]1CCSc2ccc(Br)cc21 508108773 GHHDRIOEGYRCKH-QGZVFWFLSA-N 450.358 5.126 5 20 JKBD COc1ccc([N+](=O)[O-])cc1NC(=O)[C@@H]1C[C@@H]2CCCC[C@@H]2N1C(=O)c1ccc2ccccc2c1 508778689 NOMNBYJYFKOQKD-IGKWTDBASA-N 473.529 5.169 5 20 JKBD CC(C)Oc1ccc(NC(=O)C2CCN(c3ccccc3[N+](=O)[O-])CC2)c(C(F)(F)F)c1 517923893 SRBJSQBVEZJGHS-UHFFFAOYSA-N 451.445 5.256 5 20 JKBD COc1cc(C(=O)Nc2n[nH]c(C)c2-c2ccccc2)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 522168676 IHCPLHUZVAIAFG-UHFFFAOYSA-N 478.892 6.000 5 20 JKBD O=C(Cc1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1)N[C@H](c1cccs1)C1CC1 589328684 ISGDJPGMSJLHMQ-VWLOTQADSA-N 458.543 5.319 5 20 JKBD O=C(C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)NCCc1ccc(F)cc1 598898371 SGCRPFHGGONTCL-XDJHFCHBSA-N 461.518 5.633 5 20 JKBD CC[C@@H](C)c1ccc([C@H](NC(=O)C(=O)Nc2cc([N+](=O)[O-])ccc2C)c2cccs2)cc1 603706154 IKZZOWJRVZMMKB-QRQCRPRQSA-N 451.548 5.323 5 20 JKBD CSc1ccc(C(=O)N(Cc2cccnc2)c2ccc(Br)cc2)cc1[N+](=O)[O-] 603990275 LCEZULVJDDVKOQ-UHFFFAOYSA-N 458.337 5.321 5 20 JKBD CCOc1cc(NC(=O)NCc2cccc(NC(=O)c3ccc(F)cc3)c2)c([N+](=O)[O-])cc1OCC 604083133 KITXAIUATPWENQ-UHFFFAOYSA-N 496.495 5.105 5 20 JKBD CCN(Cc1ccc(OCc2cccs2)c(OC)c1)C(=O)N[C@H](C)c1cccc([N+](=O)[O-])c1 604126328 OECIPKBLNKKOAJ-QGZVFWFLSA-N 469.563 5.537 5 20 JKBD C[C@@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)Nc1ccc(Cl)c(-c2nnc3n2CCCCC3)c1 604446820 WCNLHJYURHZNHD-CYBMUJFWSA-N 490.347 5.293 5 20 JKBD COc1ccc(-c2ccc(CNCc3cccc(NC(=O)c4cccc(F)c4)c3)o2)c([N+](=O)[O-])c1 608836102 LPPNAOVEDWWRDY-UHFFFAOYSA-N 475.476 5.545 5 20 JKBD CN(C(=O)c1ccc(NC(=O)c2c[nH]c3ccc([N+](=O)[O-])cc23)cc1Cl)C1CCCCC1 608853082 YIWZQRGCPPQAPY-UHFFFAOYSA-N 454.914 5.387 5 20 JKBD Cc1ccccc1[C@H]1CCN(C(=O)c2ccc(C(=O)N3CC[C@H](c4ccccc4C)C3)c([N+](=O)[O-])c2)C1 609044652 JWXNEVDVXYRJMY-ZEQRLZLVSA-N 497.595 5.471 5 20 JKBD O=C(CNC(=O)c1c(Cl)cccc1[N+](=O)[O-])Nc1ccc(Sc2ccccc2Cl)cc1 609392017 JMSALTRRLXKJNP-UHFFFAOYSA-N 476.341 5.421 5 20 JKBD COCCOc1cc([N+](=O)[O-])c(C(=O)Nc2ccc(-c3nc4ccc(C)cc4s3)cc2)cc1OC 619563289 UVLKEWBISXJUBI-UHFFFAOYSA-N 493.541 5.466 5 20 JKBD O=C(Nc1cc(Cl)c([N+](=O)[O-])cc1OCc1ccccc1)c1cc(Br)cnc1Cl 726498042 GJUCMDLKQXCFRV-UHFFFAOYSA-N 497.132 5.890 5 20 JKBD O=C(Nc1ccc(Oc2cccc(Br)c2)nc1)c1cc(F)c(F)cc1[N+](=O)[O-] 727709449 TUTHZDKUVNZJJM-UHFFFAOYSA-N 450.195 5.075 5 20 JKBD Cc1csc(Sc2ccc(C(=O)Nc3ccccc3C(=O)NCC(F)(F)F)cc2[N+](=O)[O-])n1 730790901 OGACQYJTVDTVPC-UHFFFAOYSA-N 496.492 5.055 5 20 JKBD CC(=O)c1cccc(O[C@H](C)C(=O)O[C@H](C(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)c2ccccc2)c1 745230083 KJJVIGUVZWVRBK-MWTRTKDXSA-N 496.903 5.141 5 20 JKBD CCN(CCC(F)(F)F)C(=O)c1cc([N+](=O)[O-])ccc1N1CCC(Cc2ccccc2)CC1 748184527 QFUGYZIZZJIEGD-UHFFFAOYSA-N 463.500 5.468 5 20 JKBD O=C(/C=C\c1nc2ccccc2s1)O[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1 849189636 CDGACOZRNBUYEW-WHIOSMTNSA-N 493.928 5.794 5 20 JKBD CCCN1C(=S)N[C@@H](c2cccc([N+](=O)[O-])c2)C(C(=O)Nc2ccccc2C(F)(F)F)=C1C 916168826 QTGRHZROZUTDFO-IBGZPJMESA-N 478.496 5.168 5 20 JKBD C[C@@H](Nc1ccc(C(=O)O[C@H](C)c2nnc(-c3cccs3)o2)cc1[N+](=O)[O-])c1ccccn1 920545241 HOCNLLKNHWUXAK-ZIAGYGMSSA-N 465.491 5.192 5 20 JKBD C[C@@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)OCc1nnc(-c2ccc(Cl)cc2Cl)o1 920778591 NHVUIZZYONIYQK-SECBINFHSA-N 472.668 5.116 5 20 JKBD C[C@H](OC(=O)c1csc(-c2ccc(Cl)cc2Cl)n1)C(=O)Nc1ccc([N+](=O)[O-])cc1 921222690 GLFQMFREPFNWIO-JTQLQIEISA-N 466.302 5.209 5 20 JKBD CC(C)c1csc(C(=O)NC2(c3ccc(NC(=O)/C=C/c4ccc([N+](=O)[O-])o4)cc3)CCC2)n1 1786206229 CJTNIUWXGWCYIJ-CSKARUKUSA-N 480.546 5.229 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)[C@H]3CCC(F)(F)C3)CCC2)cc1)c1cc2cc([N+](=O)[O-])ccc2s1 1791008617 OWOLULVJQKDESV-HNNXBMFYSA-N 499.539 5.993 5 20 JKBD O=C(/C=C/c1ccccc1[N+](=O)[O-])N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(-c2ccccc2)c(F)c1 1799340652 MEHQHEYRZQIBRM-HVFRCHRUSA-N 499.542 5.366 5 20 JKBD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc([N+](=O)[O-])cc1F)c1ccc(-c2ccccc2)c(F)c1 1800350511 YZJRLFFFFPBKDB-ACDBMABISA-N 491.494 5.106 5 20 JKBD CC1(C)CCC(CC(=O)N2CC[C@@H](CNC(=O)c3ccc([N+](=O)[O-])cc3F)[C@H]2c2cccnc2)CC1 1810749589 KOQMMFNHPBBVFE-NBGIEHNGSA-N 496.583 5.055 5 20 JKBD CC(C)[C@H]1CC[C@H](C(=O)Nc2cc([C@H]3CCCCN3C(=O)Cc3cc([N+](=O)[O-])ccc3F)[nH]n2)CC1 1822101846 ASENIQZUXJNKCT-PMAPCBKXSA-N 499.587 5.154 5 20 JKBD C[C@H](C(=O)N1CCCC[C@@H]1C1CCN(C(=O)/C=C/c2ccc([N+](=O)[O-])o2)CC1)c1ccc(Cl)cc1 1823972484 ZYXULBQOUGLVEE-ZZHXAETESA-N 499.995 5.278 5 20 JKBD CCC[C@H]1CC[C@H](C(=O)N2CCCC[C@H]2C2CCN(C(=O)c3ccc([N+](=O)[O-])o3)CC2)CC1 1831559601 IPPXBROSWRTMHM-JBACZVJFSA-N 459.587 5.028 5 20 JKBD O=C(O[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1)[C@@H]1Cc2cc(Cl)ccc2O1 12643519 SBNOAMUWYBTQCG-LEWJYISDSA-N 487.295 5.128 5 20 JKBD COc1ccccc1-n1c(S[C@@H](C)C(=O)Nc2ccc(F)c([N+](=O)[O-])c2)nnc1-c1cccs1 21681228 XCQZQDGSFAPXDI-ZDUSSCGKSA-N 499.549 5.171 5 20 JKBD COc1cc(C(=O)NC2(c3noc(C)n3)CCCCC2)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 29058629 SAWCYXRHYPSWBW-UHFFFAOYSA-N 486.912 5.330 5 20 JKBD O=C(Nc1ccc(F)cc1Cl)c1ccccc1NCc1nc(-c2cccc([N+](=O)[O-])c2)no1 68735089 LOQICRSXHDPCOT-UHFFFAOYSA-N 467.844 5.302 5 20 JKBD Cc1ccc(-c2csc(NC(=O)Cn3c4ccccc4c(=O)c4ccccc43)n2)cc1[N+](=O)[O-] 69523742 WUYRWIPAKLQFSO-UHFFFAOYSA-N 470.510 5.134 5 20 JKBD C[C@H](Nc1ccc(C(=O)N[C@H](c2ccccc2)c2ccncc2)cc1[N+](=O)[O-])c1ccccn1 72016896 KCDVDGZQKVRXRY-AVRWGWEMSA-N 453.502 5.077 5 20 JKBD COc1cc(C(=O)Nc2ccc(C(=O)NC3CC3)cc2)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 105449383 DVCWICIYKLFHOZ-UHFFFAOYSA-N 481.892 5.194 5 20 JKBD Cc1nn(Cc2ccc(C(=O)N[C@H](c3ccccc3)c3ccc(F)cc3)cc2)c(C)c1[N+](=O)[O-] 105873849 PWXTXBKIRVAMOI-XMMPIXPASA-N 458.493 5.115 5 20 JKBD C[C@H](N[C@H](Cc1ccccc1)c1ccccc1)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 248235147 DGGDGEGTEDPXMH-KSFYIVLOSA-N 457.452 5.514 5 20 JKBD Cc1cc(O[C@@H](C)c2ccccc2)ccc1NC(=O)c1nnn(-c2cccc([N+](=O)[O-])c2)c1C 303220951 UVINPEBJDFIIEM-SFHVURJKSA-N 457.490 5.185 5 20 JKBD Cc1c(NC(=O)c2ccccc2)cccc1NC(=O)c1ccc(N[C@H](C)c2ccccn2)c([N+](=O)[O-])c1 409913948 ZLZOZTOAFCHOHF-LJQANCHMSA-N 495.539 5.976 5 20 JKBD Cc1ccc(NS(=O)(=O)c2ccc(NCc3cc4ccccc4[nH]3)c([N+](=O)[O-])c2)c(C)c1 477622849 PNWQTGYBQMYPSA-UHFFFAOYSA-N 450.520 5.106 5 20 JKBD COc1cc(C(=O)N(Cc2ccco2)c2ccccn2)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 486097315 PXTBLEISXGLSMA-UHFFFAOYSA-N 479.876 5.884 5 20 JKBD COc1ccc(CSCC(=O)N2CCC[C@H]2c2ccc(Cl)c(Cl)c2)cc1[N+](=O)[O-] 487920861 VOKAKDHGAMKBHZ-KRWDZBQOSA-N 455.363 5.507 5 20 JKBD C[C@H]1CCCN(Cc2ccc(NC(=O)c3cc(OCC(F)(F)F)ccc3[N+](=O)[O-])cc2)C1 500785165 FHUHEZXASDTLLA-HNNXBMFYSA-N 451.445 5.020 5 20 JKBD COCc1c(Br)cccc1NC(=O)c1ccc(Sc2nc(C)cs2)c([N+](=O)[O-])c1 505364396 PIRMNKVJKSNUCN-UHFFFAOYSA-N 494.392 5.672 5 20 JKBD CCOc1cc(NC(=O)c2cnn(-c3ccc(Cl)cc3Cl)c2)c([N+](=O)[O-])cc1OCC 512277023 KVTYCPQOHCMRJF-UHFFFAOYSA-N 465.293 5.137 5 20 JKBD COc1ccc(Oc2ccc([N+](=O)[O-])cc2C(=O)Nc2ccc(C(=O)Nc3nccs3)cc2)cc1 512318827 SJWBPJPRVMQMFI-UHFFFAOYSA-N 490.497 5.357 5 20 JKBD Cc1cccc(C(=O)N2CCCC2)c1NC(=O)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1 512348009 SHTHFZKQOBPQTL-UHFFFAOYSA-N 479.920 5.837 5 20 JKBD C[C@@H](Nc1ccc(C(=O)N[C@@H](c2ccc(F)cc2)c2cccs2)cc1[N+](=O)[O-])c1ccccn1 516162046 APGPYYSHDSAKAC-GYCJOSAFSA-N 476.533 5.883 5 20 JKBD C[C@@H](Nc1ccc(C(=O)Nc2c(-c3cccs3)nc3ccccn23)cc1[N+](=O)[O-])c1ccccn1 579273975 AVPAIIMIRZDQBS-MRXNPFEDSA-N 484.541 5.791 5 20 JKBD CC(=O)Nc1cc(NC(=O)C/C(=C\c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)ccc1F 602246703 PLXLUXLOKVXWJM-SFQUDFHCSA-N 490.516 5.871 5 20 JKBD CCCn1c(SCc2nc(-c3cccc([N+](=O)[O-])c3)no2)nnc1-c1ccc(Cl)cc1 603562412 DQUXUGPRPMKGLC-UHFFFAOYSA-N 456.915 5.259 5 20 JKBD C[C@@H](NCc1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1)c1ccc(NC(=O)NC2CC2)cc1 603681131 JNLKBKBNBOIMBU-MRXNPFEDSA-N 480.952 6.175 5 20 JKBD C[C@@H](Nc1ccc(C(=O)Nc2ccc3nc([C@H]4CCCO4)[nH]c3c2)cc1[N+](=O)[O-])c1ccccn1 604480920 BASTYZLGJHFIQQ-IQMFZBJNSA-N 472.505 5.143 5 20 JKBD O=C(Cc1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1)Nc1nc(-c2ccncc2)cs1 604561790 AVMGKHBWDKHQOH-UHFFFAOYSA-N 482.525 5.147 5 20 JKBD O=C(c1ccc(C(=O)N2CCC[C@H]2C2CCCC2)c([N+](=O)[O-])c1)N1CCC[C@H]1C1CCCC1 609044628 NQKUNXYECOBPEL-GOTSBHOMSA-N 453.583 5.184 5 20 JKBD C[C@H](NC(=O)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1)C(C)(C)c1ccccc1 609063934 TWCMIRFPDZFBSJ-INIZCTEOSA-N 463.500 5.313 5 20 JKBD C[C@H](NCc1ccc(Oc2ccccc2Cl)c([N+](=O)[O-])c1)c1ccc(N2CCOC2=O)cc1 725847611 HKTWUGMYKKUITP-INIZCTEOSA-N 467.909 5.848 5 20 JKBD C[C@H](NCc1ccc(Oc2ccc(F)cc2)c([N+](=O)[O-])c1)C(=O)Nc1cccc(N2CCCC2)c1 725850955 HLHKDRCCUIVMML-SFHVURJKSA-N 478.524 5.243 5 20 JKBD C[C@@H](CCC(=O)Nc1ccc([N+](=O)[O-])c(Cl)c1)CC(=O)Nc1ccc([N+](=O)[O-])c(Cl)c1 727710217 JKKLNBVIUZOHQL-NSHDSACASA-N 469.281 5.193 5 20 JKBD O=C(Oc1ccc2c(-c3ccc([N+](=O)[O-])cc3)cc(=O)oc2c1)c1cnc(-c2ccco2)s1 728802538 YPRMFQVHCBJMBX-UHFFFAOYSA-N 460.423 5.304 5 20 JKBD Cc1ccc(-c2nnc([C@@H](C)OC(=O)c3ccc(N4CCC[C@@H](C)C4)c([N+](=O)[O-])c3)o2)cc1 745930544 OWUVQECCHKOCQG-IAGOWNOFSA-N 450.495 5.108 5 20 JKBD Cc1c(C(=O)N[C@H](C)c2ccc(NC(=O)c3ccc(F)cc3)cc2)cc([N+](=O)[O-])c(C)c1[N+](=O)[O-] 748625418 FMLHCNCGWMDAPF-OAHLLOKOSA-N 480.452 5.002 5 20 JKBD O=C(O[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1)c1csc(-c2ccccn2)n1 749411962 OUFJOECNXLUPHF-FQEVSTJZSA-N 494.916 5.304 5 20 JKBD CC(=O)N(c1nc(CN(C)Cc2cc([N+](=O)[O-])ccc2Cl)cs1)c1ccc(F)cc1F 788463288 ICVYEQQIQBRUBR-UHFFFAOYSA-N 466.897 5.300 5 20 JKBD COc1c([N+](=O)[O-])cc(N[C@@H](C)c2ccc(OC(F)F)cc2)c([N+](=O)[O-])c1Br 913046412 CODNCIOBEKXHCO-QMMMGPOBSA-N 462.203 5.049 5 20 JKBD COc1ccc(Oc2ccc([N+](=O)[O-])cc2C(=O)OCc2nnc(-c3ccc(Cl)cc3)o2)cc1 915441999 HTVWMIDMULCDHO-UHFFFAOYSA-N 481.848 5.456 5 20 JKBD CC(=O)N(c1ccc(F)cc1)c1nc(/C=C(\Cl)c2nc3cc([N+](=O)[O-])ccc3[nH]2)cs1 917560153 SAHAAUZBOGTSMB-PXNMLYILSA-N 457.874 5.488 5 20 JKBD CCC(C)(C)NC(=O)c1ccc(NC(=O)c2ccc(Br)c([N+](=O)[O-])c2)cc1Cl 917760441 AGFTVOCARNITEI-UHFFFAOYSA-N 468.735 5.181 5 20 JKBD CC[C@H](C)CC(=O)Nc1ccc(C2(NC(=O)CSc3ccccc3[N+](=O)[O-])CCC2)cc1 1786259687 ZKKHCBXUKZLJBW-KRWDZBQOSA-N 455.580 5.257 5 20 JKBD CC(C)CC(=O)Nc1ccc(C2(NC(=O)c3cccc([N+](=O)[O-])c3Br)CCC2)cc1 1787664074 WIDFWBXUBXEQDM-UHFFFAOYSA-N 474.355 5.151 5 20 JKBD O=C(Cc1cc(F)ccc1[N+](=O)[O-])NC1(c2ccc(NC(=O)c3cc4[nH]ccc4s3)cc2)CCC1 1789104374 QOAIJOAUTWYEDU-UHFFFAOYSA-N 492.532 5.267 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)c3ccc([N+](=O)[O-])[nH]3)CCC2)cc1)c1ccc(C(F)(F)F)c(F)c1 1790650250 RVJBOHHPXXSAKW-UHFFFAOYSA-N 490.413 5.142 5 20 JKBD O=C(Cc1cc(F)ccc1[N+](=O)[O-])Nc1ccc(C2(NC(=O)c3ccnc4ccccc34)CCC2)cc1 1792308892 YOWCEVPGGVAGLK-UHFFFAOYSA-N 498.514 5.273 5 20 JKBD Cc1cc(Cl)c(Cl)cc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)Cc1ccc(C)c([N+](=O)[O-])c1 1800139148 BGNISLHCBINFHO-BCDXTJNWSA-N 490.387 5.013 5 20 JKBD CC1(C)CCC(CC(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3ccc([N+](=O)[O-])cc3F)CC2)CC1 1830423877 ZRLACXKLLCRTHY-XMMPIXPASA-N 487.616 5.574 5 20 JKBD C[C@H](Sc1ccccc1)C(=O)N1CCC([C@H]2CCCCN2C(=O)c2ccc([N+](=O)[O-])cc2F)CC1 1830492299 BKLSNKNPBPXBMC-MHECFPHRSA-N 499.608 5.148 5 20 JKBD Cc1ccc(C(=O)N2CCCC[C@H]2C2CCN(C(=O)c3cccc(F)c3[N+](=O)[O-])CC2)c(Cl)c1 1832607354 IDTIRSKACHKWHC-QFIPXVFZSA-N 487.959 5.243 5 20 JKBD COc1cc(CSc2nnc(-c3ccc(C(C)(C)C)cc3)o2)c([N+](=O)[O-])cc1OC(F)F 11015186 TULDVKRIGSILOQ-UHFFFAOYSA-N 465.478 5.845 5 20 JKBD COc1cc(CSc2nnc(-c3ccco3)n2C2CCCCC2)c([N+](=O)[O-])cc1OC(F)F 12471562 LAIIWHFMSHXTMH-UHFFFAOYSA-N 480.493 5.854 5 20 JKBD CC(=O)c1c(C)[nH]c(C(=O)[C@@H](C)OC(=O)c2ccccc2C(=O)c2ccc(Cl)c([N+](=O)[O-])c2)c1C 14754866 HBOWRPREEHFZPJ-OAHLLOKOSA-N 496.903 5.055 5 20 JKBD Cc1ccccc1-n1c(S[C@@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)nnc1-c1ccncc1 17660945 PMTAFAGAZBOZSC-INIZCTEOSA-N 485.529 5.449 5 20 JKBD O=C(/C=C/c1ccc2ccccc2n1)O[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1 20974709 MJOAWYMIZUHBKZ-FHWWYNCCSA-N 487.899 5.733 5 20 JKBD CCOc1cc(/C=C2\CCn3c2nc2ccc([N+](=O)[O-])cc2c3=O)ccc1OCc1ccccc1 21315977 OABACQZZKAJNHP-XSFVSMFZSA-N 469.497 5.227 5 20 JKBD COc1ccccc1Nc1nnc(S[C@@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2C(F)(F)F)s1 21353517 CANDUEMAUMDSEY-JTQLQIEISA-N 499.496 5.337 5 20 JKBD COc1cc2c(cc1OC)[C@H](c1ccccc1)N(C(=O)c1cc(SC)ccc1[N+](=O)[O-])CC2 24475927 HISDRUWAZZEUOJ-DEOSSOPVSA-N 464.543 5.122 5 20 JKBD Cc1c(NC(=O)[C@@H](C)Sc2nnc([C@@H](C)N3CCCCC3)n2-c2ccccc2)cccc1[N+](=O)[O-] 25002300 ARZUFLXLJRGSKH-RTBURBONSA-N 494.621 5.150 5 20 JKBD CC(=O)Nc1ccc(CNC(=O)c2cc([N+](=O)[O-])ccc2Sc2ccc(Cl)cc2)cc1 25327600 HVVZJHUNNQYGEC-UHFFFAOYSA-N 455.923 5.288 5 20 JKBD O=[N+]([O-])c1cccc(-c2noc(CSc3nnc(-c4c[nH]c5ccccc45)n3C3CC3)n2)c1 31846864 OGCRRRKIUGXVOE-UHFFFAOYSA-N 459.491 5.012 5 20 JKBD O=C(NCC1(c2cccc(C(F)(F)F)c2)CCOCC1)Nc1cc([N+](=O)[O-])ccc1OC(F)F 510624725 LFHWJBJGDUYYKD-UHFFFAOYSA-N 489.397 5.085 5 20 JKBD O=C(NCc1ccc(COCc2ccccc2)cc1)Nc1cc([N+](=O)[O-])ccc1OC(F)F 510870357 UGRMWCFHDNHRBJ-UHFFFAOYSA-N 457.433 5.235 5 20 JKBD CCCN(CC)C(=O)c1ccc(C(=O)Nc2nc(-c3cccc([N+](=O)[O-])c3)c(C)s2)cc1 511844954 UWSPFTYFOMFJCW-UHFFFAOYSA-N 452.536 5.151 5 20 JKBD O=C(Nc1ccccc1)Nc1cccc(NC(=O)c2cc(OCC(F)(F)F)ccc2[N+](=O)[O-])c1 514562467 MGKXIBMRWCARHL-UHFFFAOYSA-N 474.395 5.432 5 20 JKBD C[C@@H](c1ccccc1)n1c(Sc2ccc(S(C)(=O)=O)cc2[N+](=O)[O-])nnc1-c1ccccc1 515555138 UCGCTPSIIIIYEQ-INIZCTEOSA-N 480.571 5.017 5 20 JKBD NC(=O)c1ccc(F)c(NC(=O)c2c3c(nc4ccccc24)/C(=C\c2ccc([N+](=O)[O-])cc2)CCC3)c1 603762288 CLFNQOCSVWVLKS-VKAVYKQESA-N 496.498 5.510 5 20 JKBD COc1ccc(NC(=O)CSc2nnc(-c3ccccc3)n2[C@@H](C)c2ccccc2)c([N+](=O)[O-])c1 603917196 ADICCLGWUDDEPT-KRWDZBQOSA-N 489.557 5.202 5 20 JKBD Cc1ccc(C(=O)N[C@@H](C)c2cccc([N+](=O)[O-])c2)cc1NC(=O)c1ccc(Br)cc1 603966651 FKNJDHKSGFKREJ-HNNXBMFYSA-N 482.334 5.409 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Cl)[C@H](c1ccccc1)N1CCO[C@H](c2ccccc2F)C1 608976083 KOEQJHYYMPAHSS-GOTSBHOMSA-N 469.900 5.141 5 20 JKBD O=C(C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)Nc1nc2c(s1)COCC2 609022678 XVSWSLLFQVAJPL-PTNGSMBKSA-N 478.555 5.303 5 20 JKBD C[C@@H](SCc1ccc(Br)cc1)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 619608580 OHZXXNHOBQOAFZ-SNVBAGLBSA-N 463.275 5.637 5 20 JKBD C/C(=C\C(=O)O[C@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F)c1ccccc1Cl 727574280 HPCGVZSSNGPZOM-LMMOQWNQSA-N 456.804 5.241 5 20 JKBD COc1cc([N+](=O)[O-])ccc1NC(=O)CNc1ccc(NC(=O)OC(C)(C)C)cc1C(F)(F)F 729675085 DWRRUCLOOIBKMM-UHFFFAOYSA-N 484.431 5.020 5 20 JKBD Cc1ccc(NC(=O)[C@H](OC(=O)c2sccc2OC(F)F)c2ccccc2)c([N+](=O)[O-])c1 729774583 IGBMTKJGRNZDLO-QGZVFWFLSA-N 462.430 5.103 5 20 JKBD C[C@@H](Cc1ccc(Cl)cc1Cl)C(=O)O[C@@H](C)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 730636386 VKCBJTDEAGZULZ-RYUDHWBXSA-N 450.278 5.435 5 20 JKBD O=C(OCC(=O)N1N=C(c2cc3ccccc3o2)C[C@@H]1c1ccco1)c1c(Cl)cccc1[N+](=O)[O-] 730642967 JDNAOIGNMDFMGK-GOSISDBHSA-N 493.859 5.122 5 20 JKBD O=C(Nc1ccc(NC(=O)N2CCCCCC2)cc1)c1cc([N+](=O)[O-])ccc1N1CCCCC1 748288375 VRIAZXZAOBJZHG-UHFFFAOYSA-N 465.554 5.245 5 20 JKBD O=C(Cc1coc2cc(O)ccc12)O[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1 779873838 ZSILDIBDMKQXIU-HSZRJFAPSA-N 480.860 5.166 5 20 JKBD C[C@@H](SC1=N/C(=C/c2ccccc2)C(=O)N1c1ccc(F)cc1)C(=O)Nc1ccccc1[N+](=O)[O-] 849191731 RQQDVHCUBLCNMF-GXPOEHQZSA-N 490.516 5.238 5 20 JKBD COc1ccc(Oc2ccc([N+](=O)[O-])cc2C(=O)O[C@H](C)C(=O)Nc2cc(C)ccc2C)cc1 915250290 RLPSCVGAYACELZ-QGZVFWFLSA-N 464.474 5.197 5 20 JKBD CSCC[C@H](NC(=O)c1cccc([N+](=O)[O-])c1)C(=O)O[C@H](C)c1ccc(Cl)cc1Cl 920164960 UITKLJSYLFLKAB-XIKOKIGWSA-N 471.362 5.058 5 20 JKBD O=C(c1ccccc1Nc1ccc(SC(F)F)cc1)N1CCN(c2ccc([N+](=O)[O-])nc2)CC1 920453848 GGYCZCSLYMMAQL-UHFFFAOYSA-N 485.516 5.011 5 20 JKBD O=C(OCc1nnc(C2CC2)o1)c1c2c(nc3ccccc13)/C(=C/c1ccc([N+](=O)[O-])cc1)CCC2 920490651 LVKSTXXGVZTASE-NBVRZTHBSA-N 482.496 5.637 5 20 JKBD O=C(Cc1cccc(C(F)(F)F)c1)NC1(c2ccc(NC(=O)c3ccc([N+](=O)[O-])o3)cc2)CCC1 1785751087 OLJVPPFNSKEIRV-UHFFFAOYSA-N 487.434 5.197 5 20 JKBD CC(C)c1ccc(CC(=O)NC2(c3ccc(NC(=O)c4ccc([N+](=O)[O-])[nH]4)cc3)CCC2)cc1 1790187082 WJAVVZVGOCSYBL-UHFFFAOYSA-N 460.534 5.037 5 20 JKBD CC(C)(Cc1ccccc1)C(=O)N1CCC([C@H]2CCCCN2C(=O)/C=C/c2ccc([N+](=O)[O-])o2)CC1 1824277445 YUBSDWMJZXAKJJ-CYNGKWMKSA-N 493.604 5.090 5 20 JKBD O=C(CSc1ccccc1[N+](=O)[O-])N1CCC([C@H]2CCCCN2C(=O)[C@H](F)c2ccccc2)CC1 1824862394 YQDLHYOARLKAEC-PXDATVDWSA-N 499.608 5.017 5 20 JKBD c1ccc([C@H]2COC(c3cccc4cc5cccc(C6=N[C@@H](c7ccccc7)CO6)c5nc34)=N2)cc1 1988187964 CPMLUNQRNAZSRL-KAYWLYCHSA-N 469.544 6.424 5 20 JKBD c1ccc(C[C@@H]2COC(c3cccc4cc5cccc(C6=N[C@H](Cc7ccccc7)CO6)c5nc34)=N2)cc1 1988188017 JIAJCADSWUFNGV-KAYWLYCHSA-N 497.598 6.164 5 20 JKBD CCN(CC)c1ccc(-c2nnc(S[C@H](C)c3nnc(-c4ccc([N+](=O)[O-])cc4)o3)o2)cc1 17663740 ZBOKKAAZJBNTEY-CQSZACIVSA-N 466.523 5.394 5 20 JKBD C[C@H](Sc1nc2ccccc2c(=O)n1C1CCCC1)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 17664386 NGBMHBZTYDIDET-AWEZNQCLSA-N 463.519 5.323 5 20 JKBD COc1cc(C(=O)NC[C@@H](c2ccccc2OC)N(C)C)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 18011409 MHRKXYNTZVIJGG-FQEVSTJZSA-N 499.951 5.090 5 20 JKBD CCCCn1c(S[C@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2C)nnc1-c1ccc(OC)cc1 21747043 YHMSOTAJQHTIQE-MRXNPFEDSA-N 469.567 5.090 5 20 JKBD Cc1ccc([N+](=O)[O-])cc1NC(=O)CSc1nc2sc(C)c(C)c2c(=O)n1C1CCCC1 21996709 FLCZGDVICBCKES-UHFFFAOYSA-N 472.592 5.137 5 20 JKBD COc1ccc(CSc2nnc(S[C@@H](C)C(=O)Nc3cc([N+](=O)[O-])ccc3Cl)s2)cc1 23555537 QNNVWVITZZWESD-NSHDSACASA-N 497.023 5.520 5 20 JKBD CC(C)CCSc1ccc(C(=O)Nc2cccc(NC(=O)[C@H](C)n3cccn3)c2)cc1[N+](=O)[O-] 31613258 CTOHNTFSSFUTNG-KRWDZBQOSA-N 481.578 5.382 5 20 JKBD CCCCN(CC(F)(F)F)C(=O)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 71894683 SYCMHFOZAAQDME-UHFFFAOYSA-N 455.399 5.021 5 20 JKBD CCN(CC)C(=O)c1ccc(NC(=O)c2ccc(N3CCC[C@@H](C)C3)c([N+](=O)[O-])c2)cc1Cl 117000959 MGWLOFDBTLPKOI-MRXNPFEDSA-N 472.973 5.219 5 20 JKBD COc1cc(/C=C(/c2ccncc2)c2ccc([N+](=O)[O-])cc2)cc(Br)c1OC(F)F 195673915 VTGOVCMLFMVPKE-LICLKQGHSA-N 477.261 5.951 5 20 JKBD COc1ccc(Oc2ccc([N+](=O)[O-])cc2C(=O)NC[C@@H]2CCCO[C@@H]2c2ccccc2)cc1 409581263 KBUNMIWVKZGDAQ-UQBPGWFLSA-N 462.502 5.293 5 20 JKBD O=C(NC[C@H]1CCN(c2ccccc2)C1)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1 478189875 IYIMVDCMAHXWFL-QGZVFWFLSA-N 451.910 5.297 5 20 JKBD COc1ccc2c(C)cc3nnc(S[C@@H](C)c4nnc(-c5ccc([N+](=O)[O-])cc5)o4)n3c2c1 501226507 IJDAHYLDVUQCFM-ZDUSSCGKSA-N 462.491 5.011 5 20 JKBD CNC(=O)c1ccc(Sc2nnc(-c3ccccc3Cl)n2Cc2ccccc2)c([N+](=O)[O-])c1 507131962 NYIQAJAWKLLJLS-UHFFFAOYSA-N 479.949 5.066 5 20 JKBD COc1cc(C(=O)Nc2ccccc2Oc2cccc(F)c2)c([N+](=O)[O-])cc1OCc1cscn1 511410141 IFWSZFRWCUASST-UHFFFAOYSA-N 495.488 5.823 5 20 JKBD CCOc1cc(Br)c(NC(=O)c2cc3ccccc3c3cccnc23)cc1OCC 511607184 SMQICCIHSLWFKU-UHFFFAOYSA-N 465.347 6.200 5 20 JKBD O=C(Nc1ccc2ncnc(O)c2c1)c1ccc(Sc2nc3ccccc3s2)c([N+](=O)[O-])c1 522175330 MVYFMVQXWCMRQS-UHFFFAOYSA-N 475.511 5.257 5 20 JKBD CC(C)CCOC1CCN(C(=O)Cc2cn(-c3ccccc3)nc2-c2ccc([N+](=O)[O-])cc2)CC1 603916666 QDTXJXNDFOXMDP-UHFFFAOYSA-N 476.577 5.044 5 20 JKBD C[C@H](N[C@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccc(NC(=O)c2ccc(F)cc2)cc1 604047834 WVOOXLBYAVXPHS-LSDHHAIUSA-N 484.915 5.317 5 20 JKBD CCCN(C(=O)c1ccc(N[C@@H](C)c2ccccn2)c([N+](=O)[O-])c1)[C@H]1CCN(C(=O)OC(C)(C)C)C1 729428145 XLROQGNVEUONTD-ICSRJNTNSA-N 497.596 5.025 5 20 JKBD O=C(Nc1cccc(Cl)c1Oc1cccnc1)c1ccc(I)c([N+](=O)[O-])c1 730485237 XEJIXMCHKVGRNL-UHFFFAOYSA-N 495.660 5.292 5 20 JKBD Cc1cc(NC(=O)c2ccccc2NC(=O)c2ccc([N+](=O)[O-])cc2Cl)ccc1C(=O)NC(C)C 731202585 RNHGZNYZKJMSQQ-UHFFFAOYSA-N 494.935 5.199 5 20 JKBD CC(=O)N(c1ccc(C(F)(F)F)cc1)c1nc(COC(=O)c2cc(F)ccc2[N+](=O)[O-])cs1 743199437 JATDCGAIYBLGAG-UHFFFAOYSA-N 483.399 5.251 5 20 JKBD CSc1ccc(-c2csc(NC(=O)c3cc([N+](=O)[O-])ccc3Br)n2)cc1 751062851 HKBUDKHFDCVAKD-UHFFFAOYSA-N 450.339 5.455 5 20 JKBD CC(C)N(Cc1nnc(-c2cccc([N+](=O)[O-])c2)o1)C(=O)[C@@H](C)Sc1ccc(Cl)cc1 790124178 OQPOVWFHSMQHDO-CQSZACIVSA-N 460.943 5.216 5 20 JKBD Cc1ccc([N+](=O)[O-])cc1NC(=O)COC(=O)c1sc(-c2ccco2)nc1-c1ccccc1 900275548 DAZYZQMCWZDIAG-UHFFFAOYSA-N 463.471 5.082 5 20 JKBD Cc1cc(C)n(Cc2cccc(-c3noc(-c4ccc(Cn5nc(C)c([N+](=O)[O-])c5C)cc4)n3)c2)n1 904530746 VDOMANMOKYPARC-UHFFFAOYSA-N 483.532 5.035 5 20 JKBD C[C@H](OC(=O)c1[nH]c2ccc(Cl)cc2c1Cl)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl 915417896 STZFQWVSJNMSOQ-QMMMGPOBSA-N 456.669 5.220 5 20 JKBD C[C@@H](OC(=O)c1cc2ccccc2c(Cl)n1)C(=O)Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1 915445826 KDGITAVTXLWEPR-GFCCVEGCSA-N 482.905 5.104 5 20 JKBD C[C@H](OC(=O)CSc1ccc(C(F)(F)F)cc1[N+](=O)[O-])c1nc2ccccc2n1C(F)F 917366608 GFFNMQAXMLHDCG-JTQLQIEISA-N 475.395 5.755 5 20 JKBD CC(C)Oc1cccc(CN[C@@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Br)c2ccccc2)c1 917938930 PBFBBAIIMGNTFD-HSZRJFAPSA-N 498.377 5.614 5 20 JKBD O=C(OCC(=O)N1CCC[C@@H]1c1ccc(Cl)c(Cl)c1)c1cc([N+](=O)[O-])ccc1Cl 918854897 OYGRVYNJCRSAKQ-QGZVFWFLSA-N 457.697 5.076 5 20 JKBD C[C@H](Nc1ccc(C(=O)OCc2cc(-c3cccs3)on2)cc1[N+](=O)[O-])c1ccccn1 920549696 YHRNYFXFLGSRSV-AWEZNQCLSA-N 450.476 5.236 5 20 JKBD Cc1cc2nc(C)c(CCC(=O)Nc3cc(Cl)c([N+](=O)[O-])cc3OCc3ccccc3)c(C)n2n1 921234829 YPIITXDJAGVIJV-UHFFFAOYSA-N 493.951 5.366 5 20 JKBD O=C(Cc1ccc2ncccc2c1)NC1(c2ccc(NC(=O)c3cc(F)cc([N+](=O)[O-])c3)cc2)CCC1 1790695888 UONDSSUXACEFSC-UHFFFAOYSA-N 498.514 5.273 5 20 JKBD CCCc1onc(C)c1C(=O)NC1(c2ccc(NC(=O)c3cccc(F)c3[N+](=O)[O-])cc2)CCC1 1790698572 BMSPYHWSBFVFQG-UHFFFAOYSA-N 480.496 5.044 5 20 JKBD CC[C@@H](C(=O)N1CCC([C@H]2CCCCN2C(=O)/C=C/c2ccc([N+](=O)[O-])o2)CC1)c1ccccc1 1824274295 DVYBNZUIJLBQHO-DGTKBQTJSA-N 479.577 5.015 5 20 JKBD Cc1cccc2cc(C(=O)N3CCC([C@H]4CCCCN4C(=O)c4cccc(F)c4[N+](=O)[O-])CC3)[nH]c12 1830620566 CUPKRAMYRFBJDT-HSZRJFAPSA-N 492.551 5.071 5 20 JKBD Cc1c(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3ccoc3Cl)CC2)cc(Cl)cc1[N+](=O)[O-] 1830734284 BGCDQRLZLZXRQV-LJQANCHMSA-N 494.375 5.350 5 20 JKBD Cc1ccc2c(CC(=O)O[C@H](C)C(=O)Nc3ccc([N+](=O)[O-])cc3C(F)(F)F)coc2c1C 9784325 ZSWLPTVLBJPIIY-CYBMUJFWSA-N 464.396 5.090 5 20 JKBD O=C(Cn1c2ccccc2c(=O)c2ccccc21)Nc1ncc(Cc2cccc(C(F)(F)F)c2)s1 11251106 VYUHPANSYYCRDU-UHFFFAOYSA-N 493.510 5.860 5 20 JKBD CC(C)c1cc(C(=O)O[C@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)c2cnn(C(C)C)c2n1 17727925 JFYJHKPUUVDIEC-CQSZACIVSA-N 464.482 5.012 5 20 JKBD CC(=O)Nc1cccc([C@H](C)NC(=O)c2ccc(NCc3ccccc3Cl)c([N+](=O)[O-])c2)c1 30273757 FWJOKSVFWHTWQC-HNNXBMFYSA-N 466.925 5.310 5 20 JKBD Cc1nc(-c2ccccc2)sc1[C@@H](C)N[C@@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 303025414 PTMIIEMVOYINMH-OCCSQVGLSA-N 478.496 5.723 5 20 JKBD COc1ccc([C@H](C)NC(=O)C/C(=C/c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)cc1 498854583 JZWHOQWIRYXHHA-SWEXZPIWSA-N 473.554 6.021 5 20 JKBD COCCN(C(=O)c1csc(-c2ccc(F)cc2)n1)c1nc(-c2ccc([N+](=O)[O-])cc2)cs1 502904975 KNLIEPDBZCFCOD-UHFFFAOYSA-N 484.534 5.274 5 20 JKBD O=C(Nc1ncc(Cc2cccc(Br)c2)s1)c1ccc([N+](=O)[O-])cc1Cl 505431349 RZLJTEANOQYXMJ-UHFFFAOYSA-N 452.717 5.310 5 20 JKBD CCc1oc2ccccc2c1CN(C)C(=O)c1ccc(N[C@@H](C)c2ccccn2)c([N+](=O)[O-])c1 506071088 OPEPNHNKIWYRAX-KRWDZBQOSA-N 458.518 5.744 5 20 JKBD O=C(Nc1ccccc1C(=O)N1CCCC1)c1ccc(NCc2ccccc2Cl)c([N+](=O)[O-])c1 512228457 ODACMZHARVTRJV-UHFFFAOYSA-N 478.936 5.349 5 20 JKBD CSc1ccc(C(=O)c2ccccc2C(=O)Nc2ccc(-c3cc[nH]n3)cc2)cc1[N+](=O)[O-] 518680520 LWWWILLFAUCWMT-UHFFFAOYSA-N 458.499 5.190 5 20 JKBD FC(F)(F)Cn1c(SCc2nc3ccccc3c3ccccc23)nnc1-c1ccncc1 520939869 RUPSSCUQHWWFHC-UHFFFAOYSA-N 451.477 5.896 5 20 JKBD O=C(Nc1ccc(OCc2ccccn2)c(Cl)c1)C1CCN(c2ccccc2[N+](=O)[O-])CC1 521555651 WDBHKAFKMXLQNC-UHFFFAOYSA-N 466.925 5.077 5 20 JKBD CSc1ccc(C(=O)N2c3ccccc3CC[C@H]2C(=O)Nc2ccccc2C)cc1[N+](=O)[O-] 524228655 TXQKQIOITJBLMJ-NRFANRHFSA-N 461.543 5.225 5 20 JKBD COc1ccc(Oc2ccc([N+](=O)[O-])cc2C(=O)N2C[C@H](C(F)(F)F)C[C@@H](C(F)(F)F)C2)cc1 604257686 LLAGLIWDKORCEZ-CHWSQXEVSA-N 492.372 5.599 5 20 JKBD CCN(C[C@@H]1CCOC1)C(=O)C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1 604440390 TWRHSCAWARESCH-UZNZLNSGSA-N 451.548 5.020 5 20 JKBD O=C(C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)N1CCC(n2ccnc2)CC1 608787601 ZBSNOXVGHZPKIK-CYVLTUHYSA-N 473.558 5.195 5 20 JKBD CC(C)C[C@@H](NC(=O)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1cccc(C(F)(F)F)c1 608864903 FLZATVBPQOEZCN-QGZVFWFLSA-N 457.836 5.109 5 20 JKBD Cn1cnnc1Sc1ccc(C(=O)N2CCCC[C@@H]2c2ccccc2C(F)(F)F)cc1[N+](=O)[O-] 608945658 VINOLZXWKDDXHO-QGZVFWFLSA-N 491.495 5.261 5 20 JKBD Cc1ccc[n+](/C(C(=S)NCc2cccc(C(F)(F)F)c2)=C(/O)c2ccc(C)c([N+](=O)[O-])c2)c1 726570154 UMHBOWDOUGPLGY-UHFFFAOYSA-O 488.511 5.519 5 20 JKBD O=C(Nc1ccccc1C(=O)Nc1nc2cc(F)c(F)cc2s1)c1ccc([N+](=O)[O-])cc1Cl 728203568 XMIQKMIWCXHHNW-UHFFFAOYSA-N 488.859 5.641 5 20 JKBD Cc1ccc(C(=O)N[C@@H](CC(=O)N(C)Cc2cc([N+](=O)[O-])ccc2Cl)c2ccccc2)cc1 729830087 VVFHSIQXDIGLPG-QHCPKHFHSA-N 465.937 5.076 5 20 JKBD Cc1sc(NC(=O)c2cc([N+](=O)[O-])ccc2Br)nc1-c1ccc(Br)cc1 751054719 LYEMXMZHLFRHTC-UHFFFAOYSA-N 497.168 5.804 5 20 JKBD Cc1cc(SC(C)(C)C)ccc1NC(=O)c1ccc(N[C@@H](C)c2ccccn2)c([N+](=O)[O-])c1 751252101 MGYLNIJTXRDNIW-KRWDZBQOSA-N 464.591 6.614 5 20 JKBD O=C(Nc1ccc(OS(=O)(=O)C2=Cc3ccccc3CC2)cc1)c1cc([N+](=O)[O-])ccc1Cl 832469592 SUMWNNSGVACWIW-UHFFFAOYSA-N 484.917 5.196 5 20 JKBD O=[N+]([O-])c1ccc(/C(O)=C(/C(=S)N[C@@H]2C[C@H]3CC[C@H]2C3)[n+]2ccc(Cc3ccccc3)cc2)cc1 912842795 FKKYUPWYRWKYLQ-UMXIMWEHSA-O 486.617 5.463 5 20 JKBD Cc1ccc(NC(=O)C(=O)N[C@@H](c2ccc(CC(C)C)cc2)c2cccs2)cc1[N+](=O)[O-] 915740689 IEGNNNQYIJOHMO-QFIPXVFZSA-N 451.548 5.008 5 20 JKBD O=C(CCCOc1ccccc1F)Oc1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2Cl)cc1 918482645 AKUCRAQNPTVORY-UHFFFAOYSA-N 472.856 5.404 5 20 JKBD Cc1csc(N(C)C(=O)c2cc([N+](=O)[O-])ccc2N2CCC(Cc3ccccc3)CC2)n1 918634765 SZSFIUDTGMHBIP-UHFFFAOYSA-N 450.564 5.095 5 20 JKBD CCOC(=O)c1c(NC(=O)c2cc3c(cc2[N+](=O)[O-])OCO3)sc(C)c1-c1ccc(C)cc1 920095087 NBVGNALURCRMGZ-UHFFFAOYSA-N 468.487 5.098 5 20 JKBD C/C(=C\c1cccs1)C(=O)Nc1ccc(C2(NC(=O)c3ccc([N+](=O)[O-])o3)CCC2)cc1 1785818493 HKDICOBVIURYKI-CCEZHUSRSA-N 451.504 5.101 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)c3ccc([N+](=O)[O-])cc3F)CCC2)cc1)c1ccc2occc2c1 1789049286 KSZIQLDDPVUQEB-UHFFFAOYSA-N 473.460 5.542 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)[C@H]3C[C@H]3C3CC3)CCC2)cc1)c1ccc(Br)c([N+](=O)[O-])c1 1790641664 CCFLZAKRYDVIQN-OALUTQOASA-N 498.377 5.151 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)c3cnccc3F)CCC2)cc1)c1cc2cc([N+](=O)[O-])ccc2s1 1791011190 OAGGLDWUJYQLCG-UHFFFAOYSA-N 490.516 5.405 5 20 JKBD O=C(CSc1ccccc1[N+](=O)[O-])Nc1ccc(C2(NC(=O)[C@@H]3CC=CCC3)CCC2)cc1 1791521939 TZJKSNWWPXYVQI-GOSISDBHSA-N 465.575 5.177 5 20 JKBD CC[C@H](C)[C@H](C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)/C=C/c1ccccc1[N+](=O)[O-])c1ccccc1 1804338096 CFQAEBKAFCMULJ-DLJNGFGQSA-N 475.589 5.076 5 20 JKBD Cc1c(C(=O)NC[C@@H]2CCN(C(=O)/C=C/C3CCCC3)[C@@H]2c2cccnc2)cc(Cl)cc1[N+](=O)[O-] 1811797625 VIJCLTYMBKDPLG-DMGXODIQSA-N 496.995 5.018 5 20 JKBD CC(C)[C@H]1CC[C@H](C(=O)N2CCCC[C@@H]2c2cc(NC(=O)Cc3cc(F)ccc3[N+](=O)[O-])n[nH]2)CC1 1823488260 SHLUSWJYWUXXNG-PMAPCBKXSA-N 499.587 5.154 5 20 JKBD O=C(c1ccc2occc2c1)N1CCC([C@@H]2CCCCN2C(=O)CCc2cccc([N+](=O)[O-])c2)CC1 1824839483 HWYBTIPXMHWDHU-VWLOTQADSA-N 489.572 5.207 5 20 JKBD CCn1c(SCC(=O)Nc2ccccc2SC(F)F)nc2cc3ccccc3cc2c1=O 10671510 MXAIJRTYVUAIDH-UHFFFAOYSA-N 471.554 5.615 5 20 JKBD CC(C)OCc1c(C(=O)O[C@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2C(F)(F)F)oc2ccccc12 11242400 SLOAKABHDTYZEX-CYBMUJFWSA-N 494.422 5.469 5 20 JKBD Cc1cccc(-c2nnc(COC(=O)c3ccc(Sc4nc(C)cs4)c([N+](=O)[O-])c3)o2)c1 19010940 QOHRYSRMZCBHOM-UHFFFAOYSA-N 468.516 5.226 5 20 JKBD O=C(Nc1ccccc1)[C@H]1CCCN(C(=O)c2cc([N+](=O)[O-])ccc2Sc2ccccc2)C1 26639130 YIPFBXAMQBJPQL-SFHVURJKSA-N 461.543 5.237 5 20 JKBD Cc1c(NC(=O)[C@H](C)OC(=O)Cc2csc(-c3ccc(C(F)(F)F)cc3)n2)cccc1[N+](=O)[O-] 28961501 ZEKROFMQZLFVFH-ZDUSSCGKSA-N 493.463 5.158 5 20 JKBD O=C(Nc1nc(-c2cccnc2)cs1)c1ccc(NCc2ccccc2Cl)c([N+](=O)[O-])c1 29252156 LTVHJXDKUHEQEV-UHFFFAOYSA-N 465.922 5.631 5 20 JKBD COc1ccccc1C1(CNC(=O)c2ccc(N[C@@H](C)c3ccccn3)c([N+](=O)[O-])c2)CCCC1 108821597 MNXLIHJAKRVZIW-IBGZPJMESA-N 474.561 5.413 5 20 JKBD Cc1cc(C)n([C@H](C)C(=O)Nc2ccc(NC(=O)CCCNc3ccc([N+](=O)[O-])cc3)cc2Cl)n1 109344913 YKCGPMBHDJRMGF-QGZVFWFLSA-N 498.971 5.092 5 20 JKBD C[C@H](Nc1ccc(C(=O)Nc2ccc3oc(C(F)(F)F)nc3c2)cc1[N+](=O)[O-])c1ccccn1 195748506 OMAFLYDFPSRHDH-LBPRGKRZSA-N 471.395 5.575 5 20 JKBD C[C@H]1CCCN(c2ccc(C(=O)Nc3nnc(SCc4ccccc4)s3)cc2[N+](=O)[O-])C1 409595279 KSCGSYAKGDVRCC-HNNXBMFYSA-N 469.592 5.227 5 20 JKBD COc1ccc(NC(=O)c2ccc(N3CCC[C@@H](C)C3)c([N+](=O)[O-])c2)cc1OCc1cccnc1 409736761 OAGJQANHAWTNDP-GOSISDBHSA-N 476.533 5.066 5 20 JKBD COc1cccc(Cc2nnc(NC(=O)c3ccc(Sc4nc(C)cs4)c([N+](=O)[O-])c3)s2)c1 410303107 LOMCOXVFCVBLER-UHFFFAOYSA-N 499.599 5.214 5 20 JKBD O=C(C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)NCCc1cccc2cccnc12 477065189 XDTCFWQCRLDZAW-OQKWZONESA-N 494.576 6.042 5 20 JKBD O=C(C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)Nc1ccc(-n2cccn2)nc1 477205008 LWYHLNIMSYFYFT-JXAWBTAJSA-N 482.525 5.355 5 20 JKBD C[C@@H](NC(=O)CSc1ccc(C(F)(F)F)cc1[N+](=O)[O-])c1ccc(OC(F)F)cc1 490609267 BEZDWVWSKHTFJW-SNVBAGLBSA-N 450.385 5.185 5 20 JKBD Cc1cccc(OCc2nnc(S[C@H](C)C(=O)Nc3nc(-c4cccc([N+](=O)[O-])c4)cs3)o2)c1 500354541 ZQIYEPXQCDSPJQ-CQSZACIVSA-N 497.558 5.108 5 20 JKBD O=C(c1ccc(Cl)cc1)C1CCN(C(=O)c2csc(-c3cccc([N+](=O)[O-])c3)n2)CC1 502243945 DPAJAMWDEVNHHZ-UHFFFAOYSA-N 455.923 5.107 5 20 JKBD COCCSc1ccc([C@@H](C)NCc2ccc(-c3ccc([N+](=O)[O-])cc3Br)o2)cc1 504033114 TWPOPZZPTJUTMK-OAHLLOKOSA-N 491.407 6.207 5 20 JKBD COc1ccc([C@H]2CCN(C(=O)c3ccc(Sc4nc(C)cs4)c([N+](=O)[O-])c3)C2)cc1 504946865 BXNYKDNKYBPXEM-KRWDZBQOSA-N 455.561 5.149 5 20 JKBD Cn1ccnc1[C@@H](NCc1ccc(Oc2ccccc2Cl)c([N+](=O)[O-])c1)c1ccc(F)cc1 509597508 BATFPMBTTSOPNT-QHCPKHFHSA-N 466.900 5.792 5 20 JKBD CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)Nc1cccc(C(=O)N2CCc3ccccc32)c1 509988630 ZGFXXOVOWIAHRC-UHFFFAOYSA-N 458.518 5.240 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Cl)[C@@H](Nc1cccc(OCc2cccnc2)c1)c1ccccc1 511021675 FYSJHTGGNTYICS-VWLOTQADSA-N 488.931 6.014 5 20 JKBD COc1ccc([C@H](NC(=O)Cn2c3ccccc3c(=O)c3ccccc32)c2ccc(F)cc2)cc1 512122719 MEJSAGSXYUOSNT-MUUNZHRXSA-N 466.512 5.208 5 20 JKBD CN(Cc1c(F)cccc1Cl)C(=O)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 515316650 XNIDLKFEOIRWQQ-UHFFFAOYSA-N 473.854 5.281 5 20 JKBD O=C(C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)N1CCC[C@H]1c1cccnc1 515747579 RNQAFZHSPDINOE-WNPPMXKSSA-N 470.554 5.894 5 20 JKBD O=C(Nc1nnc(C(F)(F)F)s1)c1ccc(Sc2nc3ccccc3s2)c([N+](=O)[O-])c1 515863518 IUWSTZXBKOVHOB-UHFFFAOYSA-N 483.478 5.478 5 20 JKBD CSc1ccc(Cl)cc1NC(=O)N[C@@H](CC(=O)OC(C)C)c1ccccc1[N+](=O)[O-] 520437509 UQMDFGHPYNBPNA-HNNXBMFYSA-N 451.932 5.175 5 20 JKBD O=C(Nc1cccc(COCC2CC2)c1)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 520448110 HASCYHNUDJLWGJ-UHFFFAOYSA-N 477.483 5.395 5 20 JKBD CC(C)(C)c1ccc(Oc2ccc(CNCc3ccnc(N4CCOCC4)c3)cc2[N+](=O)[O-])cc1 551229491 PCVBIHTXZAXKKD-UHFFFAOYSA-N 476.577 5.206 5 20 JKBD CC[C@H](C)C(=O)Nc1cccc(CNC(=O)c2ccc(NCc3ccccc3)c([N+](=O)[O-])c2)c1 603910934 DBPUCUHRLCCZAQ-SFHVURJKSA-N 460.534 5.122 5 20 JKBD C[C@@H](NC(=O)c1cc([N+](=O)[O-])ccc1Sc1ccc(Cl)cc1)c1ccc2nc(O)[nH]c2c1 604243971 NWLORTMYWRSUFN-GFCCVEGCSA-N 468.922 5.472 5 20 JKBD Cc1cc(C(=O)NC2CCCC2)ccc1NC(=O)c1cc([N+](=O)[O-])ccc1Sc1ccccc1 604452351 SEOAJTMSYHEQFF-UHFFFAOYSA-N 475.570 5.979 5 20 JKBD O=[N+]([O-])c1ccc(-c2nn(-c3ccccc3)cc2CN[C@H](c2ccc3c(c2)OCCO3)C2CC2)cc1 608836469 JBIVIOYUUOHRBJ-MHZLTWQESA-N 482.540 5.460 5 20 JKBD O=C1Nc2cc(Cl)ccc2[C@@H]1C1CCN(C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)CC1 608972105 TYDRVKMCCJRLNF-FQEVSTJZSA-N 455.923 5.051 5 20 JKBD C[C@@H](OC(=O)c1cc([N+](=O)[O-])ccc1Br)C(=O)Nc1ccc(Cl)cc1C(F)(F)F 725984986 GMBQMBCGCPOOSB-MRVPVSSYSA-N 495.635 5.214 5 20 JKBD Cc1cc(C(=O)Cn2c(C)nc([N+](=O)[O-])c2Br)c(C)n1CCc1ccc(Cl)cc1 726431810 LWVULSQIRXDKRT-UHFFFAOYSA-N 479.762 5.060 5 20 JKBD CCc1cc[n+](/C(C(=S)NCc2cccc(C(F)(F)F)c2)=C(/O)c2ccc([N+](=O)[O-])cc2)cc1 726570029 HWVHMEGIEIPAST-UHFFFAOYSA-O 488.511 5.465 5 20 JKBD O=C(Nc1ccc(Oc2ccnc3cc(Cl)ccc23)c(F)c1)c1cc(F)c(F)cc1[N+](=O)[O-] 728009121 PQIFXESFBZZPFR-UHFFFAOYSA-N 473.794 6.258 5 20 JKBD Cc1csc(Sc2ccc(C(=O)Nc3cccc(SC(=O)N(C)C)c3)cc2[N+](=O)[O-])n1 729241455 JOYUUHKWLBAPQP-UHFFFAOYSA-N 474.589 5.537 5 20 JKBD O=C(Cc1csc(-c2ccc(Cl)cc2Cl)n1)OCc1cc([N+](=O)[O-])cc2c1OCOC2 747259919 YFXKBZWAGMYKMK-UHFFFAOYSA-N 481.313 5.178 5 20 JKBD CCOc1cc(NC(=O)c2cc(F)c(F)cc2[N+](=O)[O-])c(OCC)cc1NC(=O)c1ccccc1 750562489 OQFSNVLWRZJTQD-UHFFFAOYSA-N 485.443 5.175 5 20 JKBD O=C(Nc1nc2cc(C(F)(F)F)ccc2s1)c1cc([N+](=O)[O-])ccc1I 915278774 MCBHVBVYNFLMPQ-UHFFFAOYSA-N 493.204 5.080 5 20 JKBD CC(C)c1noc2nc(C3CC3)cc(C(=O)O[C@H](C)c3nnc(-c4ccc([N+](=O)[O-])cc4)o3)c12 915577713 LIONSTWFCONQDM-GFCCVEGCSA-N 463.450 5.100 5 20 JKBD CC1=C(C(=O)Nc2ccccc2C(F)(F)F)[C@H](c2ccc(Cl)c([N+](=O)[O-])c2)NC(=S)N1C 916169357 XGIQGVBQUSOAOT-KRWDZBQOSA-N 484.887 5.041 5 20 JKBD CC1=C(C(=O)Nc2ccc(F)cc2)[C@@H](c2csc([N+](=O)[O-])c2)NC(=S)N1c1ccccc1 917373830 GNXYBYNZFYQRNO-HXUWFJFHSA-N 468.535 5.144 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Cl)[C@@H](Nc1ccc(N2CCCC2)c(F)c1)c1ccccc1 917937784 JCTGXDWXWCCWDJ-QHCPKHFHSA-N 468.916 5.779 5 20 JKBD Cc1ccc(-c2cnc(CCC(=O)N3CCCC[C@H]3CCOC(=O)c3cccc([N+](=O)[O-])c3)o2)cc1 918634182 QYCKGRIABQJHMQ-QFIPXVFZSA-N 491.544 5.119 5 20 JKBD CC(=O)Nc1cccc([C@@H](C)OC(=O)C2CCN(c3ccc(C(F)(F)F)cc3[N+](=O)[O-])CC2)c1 918752573 ZSZXBCJVGQEGQS-CQSZACIVSA-N 479.455 5.093 5 20 JKBD COc1ccc(-n2c(COC(=O)Cn3c4ccccc4c(=O)c4ccccc43)nc3ccccc32)cc1 919055798 QIQBJTNKNOCMFG-UHFFFAOYSA-N 489.531 5.246 5 20 JKBD CC(C)[C@@H](OC(=O)c1cc2cc([N+](=O)[O-])ccc2o1)C(=O)Nc1ccccc1C(F)(F)F 919212620 VISRLOMLBSELQY-GOSISDBHSA-N 450.369 5.180 5 20 JKBD CCCC(=O)Nc1c(Cl)cc(Cl)cc1C(=O)OCC(=O)Nc1ccc([N+](=O)[O-])cc1Cl 919558386 ONHDXEDZJFQBDU-UHFFFAOYSA-N 488.711 5.089 5 20 JKBD CC(C)[C@H](OC(=O)c1ccc(N[C@@H](C)c2ccccn2)c([N+](=O)[O-])c1)C(=O)N(C)c1ccccc1 920543398 DQMZQWXUTMMHRR-UUOWRZLLSA-N 476.533 5.007 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)NC1(c2ccc(NC(=O)[C@H]3CCC(F)(F)C3)cc2)CCC1 1785804004 DNDHVUQLOTZLJV-HNNXBMFYSA-N 475.467 5.225 5 20 JKBD O=C(NC1(c2ccc(NC(=O)[C@@H]3C[C@H]3c3ccc(Cl)cc3)cc2)CCC1)c1ccc([N+](=O)[O-])[nH]1 1789154102 LAXBGDUKXHRYOV-VQTJNVASSA-N 478.936 5.128 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)c3cccc(F)c3[N+](=O)[O-])CCC2)cc1)c1cc2sccc2[nH]1 1789370164 KOMBJGUKDZPWGM-UHFFFAOYSA-N 478.505 5.338 5 20 JKBD Cc1ccc2[nH]cc(CC(=O)NC3(c4ccc(NC(=O)c5ccc(O)c([N+](=O)[O-])c5)cc4)CCC3)c2c1 1790618653 JQZWSPOQQRGFMA-UHFFFAOYSA-N 498.539 5.081 5 20 JKBD O=C(NC1(c2ccc(NC(=O)[C@@H]3C[C@H]4CC[C@@H]3O4)cc2)CCC1)c1cc2cc([N+](=O)[O-])ccc2s1 1791458450 XTNHGYYITBDHED-NJYVYQBISA-N 491.569 5.125 5 20 JKBD Cc1c(Cl)ccc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)CCc2cccc([N+](=O)[O-])c2)C3)c1Cl 1803530804 KUIDMMVXXSGHAB-BCDXTJNWSA-N 490.387 5.095 5 20 JKBD Cc1cc(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)c3cc4cc([N+](=O)[O-])ccc4s3)n[nH]2)c(C)o1 1821609602 IGVFZFCVFREVQA-LJQANCHMSA-N 493.545 5.362 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)N1CCC([C@H]2CCCCN2C(=O)CCCC(F)(F)F)CC1 1824874051 NUHGITJPBXOTIB-LJQANCHMSA-N 487.494 5.008 5 20 JKBD Cc1cccc(C(=O)N2CCCC[C@H]2C2CCN(C(=O)Cc3ccc(Cl)cc3[N+](=O)[O-])CC2)c1 1829997704 RCEHZDWHMNBQOV-QHCPKHFHSA-N 483.996 5.033 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)N1CCCC[C@H]1C1CCN(C(=O)CCCC(F)(F)F)CC1 1830728139 AZDAOJDGSSVNNA-IBGZPJMESA-N 487.494 5.008 5 20 JKBD Cc1ccc([C@@H](C)C(=O)N2CCCC[C@H]2C2CCN(C(=O)c3cc(F)cc([N+](=O)[O-])c3)CC2)cc1 1831529854 NOGLIGLQSJITGW-CLOONOSVSA-N 481.568 5.079 5 20 JKBD CC(C)(C)CCCCCC(=O)N1CC2(CCCN2C(=O)c2cccc([N+](=O)[O-])c2Br)C1 1845331396 YZUBLIHSVFTACZ-UHFFFAOYSA-N 494.430 5.171 5 20 JKBD O=C(COC(=O)c1ccc(NC2CC2)c([N+](=O)[O-])c1)Nc1c(Cl)c(Cl)cc(Cl)c1Cl 9866709 MBORULCCMFAJDQ-UHFFFAOYSA-N 493.130 5.578 5 20 JKBD CNC(=O)c1ccc(C)c(NC(=O)C/C(=C/c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)c1 24923203 PQMWALLRXYBESY-UYRXBGFRSA-N 486.553 5.442 5 20 JKBD Cc1ccc2[nH]c3c(c2c1)CN(C(=O)c1ccccc1NC(=O)c1ccc([N+](=O)[O-])cc1Cl)CC3 25921619 NOFHRYGUMPNFQS-UHFFFAOYSA-N 488.931 5.489 5 20 JKBD CN(C)C(=O)c1cccc(NC(=O)c2ccccc2Sc2ccc(C(F)(F)F)cc2[N+](=O)[O-])c1 26131016 ZDKRHFIXXYJXKN-UHFFFAOYSA-N 489.475 5.719 5 20 JKBD O=C(CCSc1nnc(-c2cccs2)n1-c1ccccc1)Nc1ccccc1[N+](=O)[O-] 26363013 UWBKJSODTNSWAU-UHFFFAOYSA-N 451.533 5.025 5 20 JKBD CCOc1cc([N+](=O)[O-])c(C(=O)Nc2ncc(Cc3cccc(Cl)c3Cl)s2)cc1OC 26496704 YQIRSEINYXOUGI-UHFFFAOYSA-N 482.345 5.609 5 20 JKBD CN(C)c1ccc(NC(=O)CSc2ccc(C(F)(F)F)cc2[N+](=O)[O-])c(C(F)(F)F)c1 106101082 ZWSQLIGNJBHKMR-UHFFFAOYSA-N 467.391 5.429 5 20 JKBD O=C(Nc1ccccc1C(=O)N[C@@H]1CCSc2ccc(F)cc21)c1ccc([N+](=O)[O-])cc1Cl 247304816 GHTCTULHFMQBKD-HXUWFJFHSA-N 485.924 5.607 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)Nc2ncc(Cc3ccc(Cl)cc3C)s2)cc1SC 483048211 ZKODFGLCYXIRKA-UHFFFAOYSA-N 463.968 5.587 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)N2c3ccccc3CC[C@@H]2C(=O)Nc2ccccc2C)cc1SC 483669269 GMHQCJLKBUUYNL-OAQYLSRUSA-N 491.569 5.234 5 20 JKBD O=C(C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)NC1CCN(CC2CC2)CC1 488378887 WQGCPNFKFBPYOT-HKWRFOASSA-N 476.602 5.126 5 20 JKBD Cc1cnn(Cc2cc(F)ccc2F)c1NC(=O)c1ccc(N[C@H](C)c2ccccn2)c([N+](=O)[O-])c1 502692832 RFXPEVYKRAJETA-MRXNPFEDSA-N 492.486 5.247 5 20 JKBD COc1ccc([C@@H](C)N[C@@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2ccccc2)cc1F 511072377 KAGGKAUJEUSJQK-JLCFBVMHSA-N 457.889 5.427 5 20 JKBD COc1cc(CN[C@@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Br)c2ccccc2)ccc1C 513188803 SBEVGIUFTCPUGB-JOCHJYFZSA-N 484.350 5.144 5 20 JKBD COCCOc1cc([N+](=O)[O-])c(C(=O)Nc2ccc(Sc3ccc(C)c(C)c3)cc2)cc1OC 515361050 SWLCEAAEMDXXPA-UHFFFAOYSA-N 482.558 5.649 5 20 JKBD C[C@H]1CCCN(c2ccc(C(=O)Nc3cccc(C(=O)N(C)c4ccccc4)c3)cc2[N+](=O)[O-])C1 515705957 VBJOLXBQSMYXAZ-IBGZPJMESA-N 472.545 5.360 5 20 JKBD O=C(c1cccn1Cc1cccs1)N1CCN(Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)CC1 516400336 UYLBVWFXCCEZEF-UHFFFAOYSA-N 492.626 5.193 5 20 JKBD Cc1cc(NC(=O)c2cccc(NC(=O)CCCc3cccs3)c2)n(-c2ccc([N+](=O)[O-])cc2)n1 516493662 PYDJBHQYJHQTMD-UHFFFAOYSA-N 489.557 5.364 5 20 JKBD CCCCN(C(=O)Cn1cc([N+](=O)[O-])cn1)c1nc(-c2ccc(Cl)cc2Cl)cs1 517306867 SDZORHNIRPAYLV-UHFFFAOYSA-N 454.339 5.055 5 20 JKBD CC(C)[C@H](NC(=O)c1ccc(NCc2ccccc2Cl)c([N+](=O)[O-])c1)c1nnc2ccccn12 523845221 LSWYKQYZRMHATR-QFIPXVFZSA-N 478.940 5.030 5 20 JKBD C[C@H]1CCCN(c2ccc(C(=O)Nc3ccc(CC(=O)Nc4ccccc4F)cc3)cc2[N+](=O)[O-])C1 524386814 XKFUFTGXNXGRTJ-SFHVURJKSA-N 490.535 5.404 5 20 JKBD COCCN(C(=O)[C@@H]1C[C@@H]1c1ccccc1Cl)c1nc(-c2ccc([N+](=O)[O-])cc2)cs1 552999544 LLUONMRXEFMGRQ-QZTJIDSGSA-N 457.939 5.155 5 20 JKBD C[C@H](Nc1ccc(C(=O)Nc2cccc(Cl)c2-n2cccn2)cc1[N+](=O)[O-])c1ccccn1 569754372 QVNXDIXGFNKVFK-HNNXBMFYSA-N 462.897 5.254 5 20 JKBD CCOC(=O)C1CCN(C(=O)c2c3c(nc4ccccc24)/C(=C\c2cccc([N+](=O)[O-])c2)CCC3)CC1 590781088 XIGHCFNAFSXAFH-FXBPSFAMSA-N 499.567 5.435 5 20 JKBD CCc1ccc(N(C(=O)c2ccc(S(C)(=O)=O)c([N+](=O)[O-])c2)c2nc3ccccc3s2)cc1 601704490 FIXKWMYIVHHZFS-UHFFFAOYSA-N 481.555 5.149 5 20 JKBD COc1ccc(OC2CCN(C(=O)c3cc([N+](=O)[O-])ccc3Sc3ccccc3)CC2)cc1 603816475 ILHQKXNHXSPZOE-UHFFFAOYSA-N 464.543 5.438 5 20 JKBD C[C@@H]1C[C@@H]1c1ccc(CN(C(=O)C2CCN(c3ccc(C(F)(F)F)cc3[N+](=O)[O-])CC2)C2CC2)o1 603877454 JJVKKVAHMFALLN-QRWLVFNGSA-N 491.510 5.738 5 20 JKBD O=C(C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)Nc1cnn(C[C@H]2CCCO2)c1 604243792 HVBUIBKNILOQQV-MUPHDSPYSA-N 489.557 5.149 5 20 JKBD Cc1cccc(NC(=O)Nc2cccc(CNC(=O)[C@H](C)Oc3ccc(Cl)cc3[N+](=O)[O-])c2)c1 604443674 IUUFPJSLARBVNG-INIZCTEOSA-N 482.924 5.284 5 20 JKBD Cc1ccc(OCCCNC(=O)c2ccccc2NC(=O)c2ccc([N+](=O)[O-])cc2Cl)cc1 725724338 SPTVDEKNRUEENP-UHFFFAOYSA-N 467.909 5.008 5 20 JKBD C[C@H](OC(=O)CC[C@@H](O)c1ccc(C(C)(C)C)cc1)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 726873100 OVWVYFJBAIKNSV-MGPUTAFESA-N 453.495 5.060 5 20 JKBD Cc1ccccc1-c1nc(C(=O)N(Cc2nnc(-c3cccc([N+](=O)[O-])c3)o2)C(C)C)cs1 727296913 WEOITHGNNLULMV-UHFFFAOYSA-N 463.519 5.128 5 20 JKBD O=C(c1nc(C2CC2)n(-c2ccccc2Cl)n1)N(CC1CC1)c1ccc(Cl)c([N+](=O)[O-])c1 728165436 KDDRFLKRXJVHCV-UHFFFAOYSA-N 472.332 5.417 5 20 JKBD CCN(c1ccccc1)S(=O)(=O)c1ccc(Cl)c(C(=O)N2c3ccc([N+](=O)[O-])cc3C[C@@H]2C)c1 728812002 UIIPHFQOYRCSKA-INIZCTEOSA-N 499.976 5.055 5 20 JKBD CCOc1ccc(C(=O)Nc2ccc(NC(=O)OC(C)(C)C)cc2C(F)(F)F)cc1[N+](=O)[O-] 729655743 SAFIWVFHMWRJLT-UHFFFAOYSA-N 469.416 5.612 5 20 JKBD Cc1ccc([N+](=O)[O-])cc1NC(=O)COC(=O)c1nc(-c2ccccc2)oc1-c1ccccc1 731377220 POSCTXNTDKQUFL-UHFFFAOYSA-N 457.442 5.021 5 20 JKBD Cc1cc(C)n(-c2ccc(CNC(=O)c3cc([N+](=O)[O-])ccc3Br)c(C(F)(F)F)c2)n1 751107656 LTSNYQUSNYAWLZ-UHFFFAOYSA-N 497.271 5.109 5 20 JKBD Cc1ccc(CNC(=O)c2ccccc2NC(=O)c2cc(OCC(F)(F)F)ccc2[N+](=O)[O-])cc1 915834354 YMOFFUDASLTSHJ-UHFFFAOYSA-N 487.434 5.027 5 20 JKBD CSc1ccc(C(=O)Nc2ccc(N3C(=O)c4ccccc4C3=O)c(Cl)c2)cc1[N+](=O)[O-] 916060411 BUIRRGJPCFHTSV-UHFFFAOYSA-N 467.890 5.023 5 20 JKBD CN(C)c1ccc([C@H](CNC(=S)Nc2ccc([N+](=O)[O-])cc2)c2c[nH]c3ccccc23)cc1 916122092 OXIMUHCTGYAWCL-QFIPXVFZSA-N 459.575 5.261 5 20 JKBD COC(=O)Nc1cccc(NC(=O)c2ccc(NCc3ccccc3Cl)c([N+](=O)[O-])c2)c1 917707326 WWRFCXOGPJUDSR-UHFFFAOYSA-N 454.870 5.291 5 20 JKBD C[C@@H](OC(=O)c1cc([N+](=O)[O-])ccc1Oc1ccccc1)C(=O)Nc1ncc(Cl)cc1Cl 919191794 DIDXSASOIFSJRW-GFCCVEGCSA-N 476.272 5.273 5 20 JKBD CCCc1noc2nc(-c3ccco3)cc(C(=O)O[C@@H](C)c3nnc(-c4ccc([N+](=O)[O-])cc4)o3)c12 920682828 SQKWMSOXMFALFN-ZDUSSCGKSA-N 489.444 5.312 5 20 JKBD C[C@H](Nc1ccc(C(=O)O[C@H](c2ccccc2)c2ccccn2)cc1[N+](=O)[O-])c1ccccn1 920771115 LPEJULXHGOVAGE-AVRWGWEMSA-N 454.486 5.504 5 20 JKBD O=C(CSc1ccccc1[N+](=O)[O-])NC1(c2ccc(NC(=O)c3sccc3F)cc2)CCC1 1786523274 KQKVKXGCTOKSPO-UHFFFAOYSA-N 485.562 5.335 5 20 JKBD COc1ccc(C(=O)NC2(c3ccc(NC(=O)c4cc(C)c([N+](=O)[O-])cn4)cc3)CCC2)c(Cl)c1 1788767421 NSTPJDJJTRFWNG-UHFFFAOYSA-N 494.935 5.022 5 20 JKBD O=C(NC1(c2ccc(NC(=O)[C@H]3C[C@]3(F)Cl)cc2)CCC1)c1cc2cc([N+](=O)[O-])ccc2s1 1791675833 AXYLZYRJPAOCFG-UZUQRXQVSA-N 487.940 5.482 5 20 JKBD O=C(/C=C/c1ccccc1[N+](=O)[O-])Nc1ccc(C2(NC(=O)c3ccoc3Cl)CCC2)cc1 1792317255 HFWUYGUKYYOADC-IZZDOVSWSA-N 465.893 5.302 5 20 JKBD O=C(/C=C/c1ccco1)Nc1cc([C@@H]2CCCCN2C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)[nH]n1 1815950002 BAHDZKWHEDRSEE-XSBJJCPUSA-N 491.529 5.145 5 20 JKBD CC1(C)CCC(CC(=O)Nc2cc([C@@H]3CCCCN3C(=O)Cc3ccc([N+](=O)[O-])cc3F)[nH]n2)CC1 1820978627 RQZJMMKGPVGIAF-QFIPXVFZSA-N 499.587 5.298 5 20 JKBD Cc1c(C(=O)N2CCC([C@@H]3CCCCN3C(=O)/C=C/c3ccco3)CC2)cc(Cl)cc1[N+](=O)[O-] 1825266824 NKQKHUWBLXAJHH-DORXLWPQSA-N 485.968 5.096 5 20 JKBD O=C(c1cc2cc([N+](=O)[O-])ccc2s1)N1CCC([C@H]2CCCCN2C(=O)C2CCCC2)CC1 1826255627 HPXQLYZVBXLSFA-OAQYLSRUSA-N 469.607 5.233 5 20 JKBD Cc1cc(Cl)cc(C(=O)N2CCCC[C@H]2C2CCN(C(=O)c3cc(F)cc([N+](=O)[O-])c3)CC2)c1 1832609787 FXCHEMFEGVCFHS-QHCPKHFHSA-N 487.959 5.243 5 20 JKBD Cc1ccc(Cn2c(SCC(=O)Nc3cc([N+](=O)[O-])ccc3Cl)nc3ccccc3c2=O)cc1 8954410 GTNNOSAAFOBZND-UHFFFAOYSA-N 494.960 5.046 5 20 JKBD CC(C)c1nnc(S[C@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2C(F)(F)F)n1Cc1ccco1 10932633 LBVSSJFAASLJON-GFCCVEGCSA-N 483.472 5.089 5 20 JKBD COc1cc(C(=O)N(C)Cc2cnn(-c3ccccc3)c2)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 16781074 FNVPLQNFULYERC-UHFFFAOYSA-N 492.919 5.507 5 20 JKBD C[C@H](OC(=O)c1ccc(NC2CC2)c([N+](=O)[O-])c1)C(=O)Nc1ccc(Cl)cc1C(F)(F)F 16926042 IFCJJRJQYWOTEG-JTQLQIEISA-N 471.819 5.025 5 20 JKBD Cc1ccc(NC(=O)[C@@H](Sc2nnc(-c3cccs3)n2C2CC2)c2ccccc2)c([N+](=O)[O-])c1 17270047 PJVFDSORTLMQKA-NRFANRHFSA-N 491.598 6.030 5 20 JKBD COc1ccc([N+](=O)[O-])cc1CSc1nnc(-c2ccc(Cl)cc2)n1Cc1ccco1 21368293 XGMIYJLGMIEDHI-UHFFFAOYSA-N 456.911 5.449 5 20 JKBD CCCn1c(S[C@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2C(F)(F)F)nnc1-c1cccc(C)c1 21453374 GYCFVGOWEWIPLF-CQSZACIVSA-N 493.511 5.710 5 20 JKBD CSc1ccc(C(=O)O[C@H](C)C(=O)Nc2ccccc2Cc2ccccc2)cc1[N+](=O)[O-] 22161792 MMTQOBDFWRHAGL-MRXNPFEDSA-N 450.516 5.092 5 20 JKBD CCN(Cc1cccs1)C(=O)C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1 25761279 WVHSJMIMKGIDQJ-JXAWBTAJSA-N 463.584 6.245 5 20 JKBD CC(=O)N(c1cccc(C(F)(F)F)c1)c1nc(COc2ccc(Cl)cc2[N+](=O)[O-])cs1 31708129 XRNOMEQELPIPIT-UHFFFAOYSA-N 471.844 5.987 5 20 JKBD COc1cc(OC)c(NC(=O)c2ccccc2C(=O)c2ccc(SC)c([N+](=O)[O-])c2)cc1Cl 57325532 RTXKQTUIVWIACH-UHFFFAOYSA-N 486.933 5.471 5 20 JKBD CC(C)c1cc(C(=O)N(Cc2ccccc2[N+](=O)[O-])CC(F)(F)F)c2cnn(C(C)C)c2n1 106187143 SHKQNHGJDMVVEL-UHFFFAOYSA-N 463.460 5.249 5 20 JKBD C[C@H](NC(=O)c1ccc(N[C@@H](C)c2ccccn2)c([N+](=O)[O-])c1)c1ccc(NC(=O)C2CC2)cc1 108783601 FKWFLVHJJLUTRN-IRXDYDNUSA-N 473.533 5.002 5 20 JKBD CC[C@H](NC(=O)c1ccc(N[C@@H](C)c2ccccn2)c([N+](=O)[O-])c1)c1nc(-c2ccccc2)c[nH]1 109422207 YBCOOWPYFNDTBJ-PXNSSMCTSA-N 470.533 5.434 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)N(Cc2cccs2)c2ccc3c(c2)OCCO3)cc1SC 481915373 BFYHGELLBIRQTB-UHFFFAOYSA-N 472.544 5.005 5 20 JKBD CCOc1cc(NC(=O)Cc2csc(-c3ccc(Cl)cc3Cl)n2)c([N+](=O)[O-])cc1OCC 488865679 KIIFRMPVZSBSFK-UHFFFAOYSA-N 496.372 6.004 5 20 JKBD CCS(=O)(=O)Nc1ccc(NC(=O)c2ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])cc2)cc1C 490544992 MTEUXBCPODXHQJ-UHFFFAOYSA-N 489.937 5.363 5 20 JKBD CC(C)N(Cc1cccc(F)c1)C(=O)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 510122400 WLQMBRIJCKVWFH-UHFFFAOYSA-N 467.463 5.406 5 20 JKBD CC(=O)Nc1cc(NC(=O)Cc2cn(-c3ccccc3)nc2-c2ccc([N+](=O)[O-])cc2)ccc1Cl 517977619 ZNQCUEPGADRHLS-UHFFFAOYSA-N 489.919 5.241 5 20 JKBD O=C(NCc1ccc(NC(=O)c2ccc(Cl)cc2[N+](=O)[O-])cc1)c1ccc(Br)cc1 520769589 DMOCJCGXWGSSQP-UHFFFAOYSA-N 488.725 5.193 5 20 JKBD C[C@@H](NCc1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1)c1cccc(OC(F)F)c1 520949912 ZKQSLBRLGUEFOY-QGZVFWFLSA-N 464.472 5.900 5 20 JKBD CC(=O)N1CCC(CNC(=O)c2c3c(nc4ccccc24)/C(=C/c2cccc([N+](=O)[O-])c2)CCC3)CC1 521484037 BGIFZFGOOQTIOT-CJLVFECKSA-N 498.583 5.008 5 20 JKBD O=C(NCCc1cccs1)C1CCN(C(=O)c2cc([N+](=O)[O-])ccc2Sc2ccccc2)CC1 521721853 NHZROQFDQSEWAE-UHFFFAOYSA-N 495.626 5.019 5 20 JKBD C[C@H](Nc1ccc(C(=O)Nc2ccc(-n3cccn3)c(Cl)c2)cc1[N+](=O)[O-])c1ccccn1 524052615 PHTKYPMQWQVNDI-HNNXBMFYSA-N 462.897 5.254 5 20 JKBD CCN1CCc2nc(NC(=O)c3ccc(Oc4ccc(Cl)cc4[N+](=O)[O-])c(OC)c3)sc2C1 600201975 SXWRFGSUBVLOND-UHFFFAOYSA-N 488.953 5.136 5 20 JKBD COc1cc(NC(=O)C/C(=C\c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)cc(OC)c1 603471772 PPLADQNOHCSUSX-GZTJUZNOSA-N 475.526 5.791 5 20 JKBD COc1ccc([N+](=O)[O-])cc1NC(=O)c1ccc(C)c(NC(=O)c2ccc(Br)cc2)c1 603637497 QUZSJXYEYAKSRK-UHFFFAOYSA-N 484.306 5.179 5 20 JKBD CCCC(=O)Nc1cccc(NC(=O)c2ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])c(OC)c2)c1 603969977 LPBJHBYLGPBUGW-UHFFFAOYSA-N 483.908 6.040 5 20 JKBD COc1cc(CNCc2ccc(Oc3ccccc3Cl)c([N+](=O)[O-])c2)cc(OC)c1OC 604478717 ILPSDCWVJYKLGA-UHFFFAOYSA-N 458.898 5.356 5 20 JKBD O=C(C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)NCCN1Cc2ccccc2C1 604481393 NLSHXNKHWNSBHT-JCMHNJIXSA-N 484.581 5.267 5 20 JKBD O=C(c1c2c(nc3ccccc13)/C(=C/c1ccc([N+](=O)[O-])cc1)CCC2)N1CCC[C@H](c2cc[nH]n2)C1 608813490 YEJUBKLOWPQTCY-NUTRWHQKSA-N 493.567 5.763 5 20 JKBD CCOc1ccc(C(=O)Nc2ccccc2OCc2ncc(-c3cccc(Cl)c3)o2)cc1[N+](=O)[O-] 608850680 KFIYBDHUUALIMA-UHFFFAOYSA-N 493.903 6.133 5 20 JKBD COc1cc(CSCc2coc(-c3ccc(F)c(F)c3)n2)c([N+](=O)[O-])cc1OC(F)F 609238293 RHJBIIPYMWRHQV-UHFFFAOYSA-N 458.389 5.571 5 20 JKBD Cc1cc(CN(C)C(=O)Cn2c3ccccc3c(=O)c3ccccc32)cc(C)c1OCC(F)(F)F 615132606 PBESBGRYRMTJDZ-UHFFFAOYSA-N 482.502 5.371 5 20 JKBD COCCN(Cc1cccs1)C(=O)C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1 619211464 JNGLVMKCSWVUHD-CYVLTUHYSA-N 493.610 5.872 5 20 JKBD CC(=O)N(c1nc(COC(=O)c2cc3cc([N+](=O)[O-])ccc3[nH]2)cs1)c1cccc(C)c1C 728330601 NWWZRYLVUUGZMX-UHFFFAOYSA-N 464.503 5.191 5 20 JKBD CCOc1ccc(NC(=O)COC(=O)c2nc(-c3ccccc3)oc2-c2ccccc2)c([N+](=O)[O-])c1 731377653 VDEPTHDYKJRUBO-UHFFFAOYSA-N 487.468 5.111 5 20 JKBD Cc1nnc(SCc2c(C(=O)OCCOc3cccc([N+](=O)[O-])c3)oc3ccccc23)s1 742956068 IVXFFHROQRZYAD-UHFFFAOYSA-N 471.516 5.029 5 20 JKBD Cc1c([N+](=O)[O-])cc(C(=O)Nc2cc(C(F)(F)F)ccc2N2CCCCC2)cc1[N+](=O)[O-] 857717297 RZTWYJLJMXRFGO-UHFFFAOYSA-N 452.389 5.073 5 20 JKBD COc1cc(C(=O)OCc2nc3ccccc3c3ccccc23)ccc1OCc1cscn1 913384191 ZBRUAASUPNNIIZ-UHFFFAOYSA-N 456.523 5.789 5 20 JKBD C[C@@H](NC(=O)c1cc(Cl)ccc1[N+](=O)[O-])c1cccc(NC(=O)Cc2ccccc2F)c1 916074898 RBZFRJVXNKNUOO-CQSZACIVSA-N 455.873 5.060 5 20 JKBD Cc1ccc(S(=O)(=O)Nc2ccc(NC(=S)Nc3ccccc3Cl)cc2)cc1[N+](=O)[O-] 916120031 PJWJBMRERZSTSC-UHFFFAOYSA-N 476.967 5.166 5 20 JKBD O=C(N[C@@H](c1ccc(Cl)cc1)c1cccs1)c1cc([N+](=O)[O-])ccc1I 916425467 YGPGWZFQLFASBP-KRWDZBQOSA-N 498.729 5.434 5 20 JKBD O=C(Nc1nnc(C(F)(F)F)s1)c1cc([N+](=O)[O-])ccc1N1CCC(Cc2ccccc2)CC1 918151459 VKKHPEDHBRVYCI-UHFFFAOYSA-N 491.495 5.177 5 20 JKBD COc1cc(C(=O)Nc2ccc(N3CCOC3=O)cc2)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 918386622 IGRSZSNYGYQFRL-UHFFFAOYSA-N 483.864 5.258 5 20 JKBD C[C@H](OC(=O)c1cc2cc([N+](=O)[O-])ccc2o1)C(=O)Nc1c(Cl)cc(Cl)cc1Cl 919212583 DJNWEWQNUPOGON-QMMMGPOBSA-N 457.653 5.485 5 20 JKBD CC(C)(C)c1ncc(C(=O)Oc2ccc(NC(=O)c3cc([N+](=O)[O-])ccc3Cl)cc2)s1 920217326 UATPVOJZSVMRPX-UHFFFAOYSA-N 459.911 5.474 5 20 JKBD CC(=O)N(c1ccc(C(F)(F)F)cc1)c1nc(COC(=O)c2cccc([N+](=O)[O-])c2C)cs1 920498842 FHJSMIURPAIKAE-UHFFFAOYSA-N 479.436 5.420 5 20 JKBD Cc1cc(C(=O)N(Cc2nnc(-c3cccc([N+](=O)[O-])c3)o2)C(C)C)c(C)n1Cc1ccccc1 921194801 BHBJZDNTPGKZJW-UHFFFAOYSA-N 473.533 5.162 5 20 JKBD O=C(NC1(c2ccc(NC(=O)[C@@H]3C[C@H]3C3CC3)cc2)CCC1)c1cccc(Br)c1[N+](=O)[O-] 1786054460 CLKHLYOGCZQGBK-RBUKOAKNSA-N 498.377 5.151 5 20 JKBD C[C@H](Sc1ccccc1)C(=O)Nc1ccc(C2(NC(=O)c3ccc([N+](=O)[O-])o3)CCC2)cc1 1786288579 XEVPVEROILNERH-INIZCTEOSA-N 465.531 5.116 5 20 JKBD CC1=CC[C@H](C(=O)NC2(c3ccc(NC(=O)c4cc([N+](=O)[O-])cc5c4OCC5)cc3)CCC2)CC1 1790046740 SCHBVHHMOMDOTI-SFHVURJKSA-N 475.545 5.024 5 20 JKBD O=C(Cc1ccc([N+](=O)[O-])cc1F)Nc1ccc(C2(NC(=O)c3ccc4ccoc4c3)CCC2)cc1 1791183858 LLYFVTKXJRJRMO-UHFFFAOYSA-N 487.487 5.471 5 20 JKBD O=C(/C=C/c1ccc([N+](=O)[O-])o1)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C1(c2cccc(Cl)c2)CCCC1 1802186756 XCSSBVMVCYWKDW-XIGVJBFMSA-N 497.979 5.005 5 20 JKBD O=C(/C=C/C1CCCCC1)Nc1cc([C@@H]2CCCCN2C(=O)CSc2ccccc2[N+](=O)[O-])[nH]n1 1820907751 IZZPUBHZSKHAHO-AIGDTVQASA-N 497.621 5.239 5 20 JKBD O=C(CSc1ccccc1[N+](=O)[O-])N1CCCC[C@H]1c1cc(NC(=O)C23CCC(CC2)CC3)n[nH]1 1822963369 NXOMFPKTTQNRBX-HTHJYTGDSA-N 497.621 5.073 5 20 JKBD C/C(=C\c1cccs1)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cc(F)cc([N+](=O)[O-])c2)CC1 1823718822 SAAICPNPNCIKIC-GNBRFLJNSA-N 485.581 5.132 5 20 JKBD CCC[C@H]1CC[C@H](C(=O)N2CCC([C@@H]3CCCCN3C(=O)c3cc(C)c([N+](=O)[O-])cn3)CC2)CC1 1827832428 JSFOODUCIBBOBE-SSPYTLHUSA-N 484.641 5.138 5 20 JKBD O=C(CSc1ccccc1[N+](=O)[O-])N1CCC([C@@H]2CCCCN2C(=O)C[C@@H]2C[C@@H]3CC[C@H]2C3)CC1 1831484134 VQMSSSBBQMDXRB-SWUCNREESA-N 499.677 5.133 5 20 JKBD Cc1ccc(-c2cc(C(=O)OCC(=O)Nc3cc([N+](=O)[O-])ccc3C)c3cnn(C(C)C)c3n2)s1 11260355 NUMZLTUBQIMDEG-UHFFFAOYSA-N 493.545 5.061 5 20 JKBD C[C@H](OC(=O)c1c(-n2cccc2)sc2c1CCSC2)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl 16412732 PLNYNBDJRZVOPH-LBPRGKRZSA-N 491.978 5.074 5 20 JKBD Cc1cc(Br)ccc1SCC(=O)O[C@H](C)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 17529809 NAZWPPXGBDQGDW-GFCCVEGCSA-N 478.324 5.112 5 20 JKBD CCCC[C@@H](Sc1nc2cc3ccccc3cc2c(=O)n1CC)C(=O)Nc1cc(C)on1 21487706 SKQRMOSIOXJCII-HXUWFJFHSA-N 450.564 5.156 5 20 JKBD Cc1noc(COC(=O)c2c3c(nc4ccccc24)/C(=C/c2ccc([N+](=O)[O-])cc2)CCC3)n1 23372247 OZNOPVKHTMCADD-GHRIWEEISA-N 456.458 5.068 5 20 JKBD COc1ccc(Oc2ccc([N+](=O)[O-])cc2C(=O)Nc2cccc(Oc3cnccn3)c2)cc1 25264849 APIONMQAEAAVBV-UHFFFAOYSA-N 458.430 5.230 5 20 JKBD COc1ccc(Nc2nn(CN(C)Cc3cc([N+](=O)[O-])ccc3Cl)c(=S)s2)cc1 27532897 MIOKMLOOIZRHRN-UHFFFAOYSA-N 451.961 5.077 5 20 JKBD O=C(Nc1ncc(Cc2ccc(Br)cc2)s1)c1cc([N+](=O)[O-])ccc1Cl 28685506 NHYULJRVFRDDFL-UHFFFAOYSA-N 452.717 5.310 5 20 JKBD CCS(=O)(=O)c1ccccc1NC(=O)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])c(OC)c1 105999218 UDXFUKUXUKQVNV-UHFFFAOYSA-N 490.921 5.095 5 20 JKBD O=C(Nc1ccc(Cl)c(S(=O)(=O)N2CCCC2)c1)c1cc2ccccc2c2cccnc12 107763035 RZCNAHJFZIYTLF-UHFFFAOYSA-N 465.962 5.078 5 20 JKBD C[C@H](Nc1ccc(C(=O)Nc2nc(-c3cccc(F)c3)cs2)cc1[N+](=O)[O-])c1ccccn1 108829979 DRHALRSHXBGRQE-AWEZNQCLSA-N 463.494 5.678 5 20 JKBD COCCOc1ccc(F)cc1NC(=O)c1ccc(NCc2ccccc2Cl)c([N+](=O)[O-])c1 303172362 RRQBLLIZGLAVJM-UHFFFAOYSA-N 473.888 5.277 5 20 JKBD O=C(Cn1c2ccccc2c(=O)c2ccccc21)N[C@@H](c1ccccc1)c1ccc2c(c1)CCCO2 303314044 PSZTYRAYAMBIEE-PMERELPUSA-N 474.560 5.386 5 20 JKBD O=C(Nc1nc(-c2cc(Cl)sc2Cl)cs1)c1ccc(-n2ccnc2)c([N+](=O)[O-])c1 477032724 KESABEITTJHXKA-UHFFFAOYSA-N 466.331 5.525 5 20 JKBD CCOc1cc([N+](=O)[O-])c(C(=O)N[C@H](C)c2ccc(OCc3ccc(F)cc3)cc2)cc1OC 485466546 HRTXIQIMKSXXJR-MRXNPFEDSA-N 468.481 5.211 5 20 JKBD CC(C)c1nnc(NC(=O)C/C(=C\c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)s1 491392896 DFCRXQWTHHXURW-RVDMUPIBSA-N 465.560 5.749 5 20 JKBD Cc1cc(C(=O)CSc2nc3cc4ccccc4cc3c(=O)n2C)c(C)n1CC(F)(F)F 495375402 KOJIFSDXIVLFEL-UHFFFAOYSA-N 459.493 5.042 5 20 JKBD O=C(c1csc(-c2cccc([N+](=O)[O-])c2)n1)N1CCC(c2nc3cc(Cl)ccc3s2)CC1 496381916 UMOLCWFYLFQSGT-UHFFFAOYSA-N 484.990 6.001 5 20 JKBD CN(C(=O)Cn1ccc2cc([N+](=O)[O-])ccc21)[C@@H]1CCSc2ccc(Br)cc21 504604540 GCPUNKSWSLIENQ-GOSISDBHSA-N 460.353 5.008 5 20 JKBD C[C@@H](Nc1ccc(C(=O)N2CC=C(c3c[nH]c4cc(F)ccc34)CC2)cc1[N+](=O)[O-])c1ccccn1 507374755 ZHBSYPRVUWCXCL-QGZVFWFLSA-N 485.519 5.713 5 20 JKBD O=C(NCCc1ccccc1C(F)(F)F)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 507852058 UJQSNMKTDPHTFT-UHFFFAOYSA-N 489.416 5.208 5 20 JKBD CN(CCCCCc1cc(-c2ccc(F)cc2)n[nH]1)C(=O)c1cc2cc([N+](=O)[O-])ccc2o1 508355940 TYYUCFRLKHUAQZ-UHFFFAOYSA-N 450.470 5.355 5 20 JKBD COc1cc(C(=O)Nc2nc(-c3cccc(Cl)c3)cs2)c([N+](=O)[O-])cc1OC(F)F 509446304 FRIMBNPFXHRUIA-UHFFFAOYSA-N 455.826 5.234 5 20 JKBD CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)c1ccc(CNC(=O)C23CC4CC(CC(C4)C2)C3)cc1 509720148 QORLIEFAEJLSLB-UHFFFAOYSA-N 489.616 5.478 5 20 JKBD COc1cc(C)ccc1Oc1ccc(NC(=O)CCCn2c(=O)oc3cc([N+](=O)[O-])ccc32)cc1F 510238909 IQLHUBFQGYFUBT-UHFFFAOYSA-N 495.463 5.170 5 20 JKBD CC(=O)Nc1cc(N[C@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Br)c2ccccc2)ccc1C 515763046 WAFQQKGAPIRBLS-QFIPXVFZSA-N 497.349 5.416 5 20 JKBD CCC(=O)N1CCCN(C(=O)c2c3c(nc4ccccc24)/C(=C\c2cccc([N+](=O)[O-])c2)CCC3)CC1 517433484 ZSJVMQOYFMXXOV-UZYVYHOESA-N 498.583 5.104 5 20 JKBD O=C(C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)N1CC[C@H](N2CCCCC2)C1 518086817 DYIRKJTWNUGMMP-PTMWEUFISA-N 476.602 5.222 5 20 JKBD C[C@@H](Nc1ccc(C(=O)Nc2ccc(NC(=O)c3cccs3)cc2)cc1[N+](=O)[O-])c1ccccn1 522826411 DCBQSRPRARTFRE-MRXNPFEDSA-N 487.541 5.729 5 20 JKBD Cc1occc1C(=O)Nc1cc(NC(=O)c2ccc(Nc3ccccc3)c([N+](=O)[O-])c2)ccc1F 603671620 GOKHNPMMGWEKBL-UHFFFAOYSA-N 474.448 5.884 5 20 JKBD O=C(CSc1ccc(C(F)(F)F)cc1[N+](=O)[O-])Nc1c(-c2ccccc2)ncn1C1CC1 604537364 KIFMCYKEEBZZHB-UHFFFAOYSA-N 462.453 5.543 5 20 JKBD CC(=O)Nc1ccc(NC(=O)c2ccc(N[C@H](C)c3ccccn3)c([N+](=O)[O-])c2)c(Cl)c1 609018687 LGRNMYFSZACYHT-CYBMUJFWSA-N 453.886 5.027 5 20 JKBD COc1cccc([C@@H](CNC(=O)c2cc(SC)ccc2[N+](=O)[O-])c2c[nH]c3ccccc23)c1OC 612566070 WRQBSWATZDEFOJ-OAQYLSRUSA-N 491.569 5.377 5 20 JKBD O=C(CCc1nnc(-c2cc3ccccc3o2)o1)N(CC1CC1)c1ccc(Cl)c([N+](=O)[O-])c1 728165315 GWGGHTNPXDEOJS-UHFFFAOYSA-N 466.881 5.420 5 20 JKBD O=C(OCc1csc(Cc2ccc(Cl)cc2)n1)c1csc(-c2ccc([N+](=O)[O-])cc2)n1 747954814 LSGARGTWTAXOFX-UHFFFAOYSA-N 471.947 5.776 5 20 JKBD Cc1nc(NC(=O)c2cc(F)ccc2[N+](=O)[O-])sc1Cc1cccc(Br)c1 751093114 LODOCZJTSKKOLQ-UHFFFAOYSA-N 450.289 5.104 5 20 JKBD Cc1cccc(C(C)C)c1NC(=O)[C@H](C)OC(=O)c1ccc(N2CCC(C)CC2)c([N+](=O)[O-])c1 783302036 RVPGTMXNJIJKBR-IBGZPJMESA-N 467.566 5.447 5 20 JKBD CC(C)n1c2ccccc2n2c(S[C@@H](C)C(=O)Nc3ccc([N+](=O)[O-])cc3C(F)(F)F)nnc12 847219324 ISARBXLPLIIXEZ-LBPRGKRZSA-N 492.483 5.311 5 20 JKBD CC(C)NC(=O)Nc1ccc(NC(=O)c2ccccc2NC(=O)c2ccc([N+](=O)[O-])cc2Cl)cc1 900872616 UBJKJRXWYBSDIN-UHFFFAOYSA-N 495.923 5.283 5 20 JKBD O=[N+]([O-])c1ccc(-c2nn(-c3ccccc3)cc2Cc2nc(COc3ccc(F)cc3)no2)cc1 904667875 TZGCQTFZRFKJHA-UHFFFAOYSA-N 471.448 5.139 5 20 JKBD CC(C)(C)OC(=O)NCc1ccc(-c2noc(C3(c4ccc([N+](=O)[O-])cc4)CCC3)n2)cc1 904721588 WTMKZQATSRMXJJ-UHFFFAOYSA-N 450.495 5.140 5 20 JKBD Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)c1ccc(Cl)c(S(=O)(=O)Nc2ccc(F)cc2)c1 913419157 UPCWWODFLPGSLX-UHFFFAOYSA-N 477.901 5.057 5 20 JKBD CCCN1C(=S)N[C@H](c2ccccc2[N+](=O)[O-])C(C(=O)Nc2ccccc2C(F)(F)F)=C1C 916169200 RNLNIGKETHOUOT-LJQANCHMSA-N 478.496 5.168 5 20 JKBD O=C(Oc1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2Cl)cc1)c1ccc(Oc2cccnc2)cc1 920339378 GYEJAYOJFNIMFC-UHFFFAOYSA-N 489.871 5.907 5 20 JKBD C[C@@H](OC(=O)[C@@H](C)Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)Nc1ccccc1Cc1ccccc1 920779301 RVIFOBNEYXXJKK-IAGOWNOFSA-N 482.920 5.177 5 20 JKBD Cc1ccc(NC(=O)c2cccc(C(F)(F)F)c2)cc1NC(=O)c1cc([N+](=O)[O-])ccc1F 920844964 KRJSRNPKHKTJNR-UHFFFAOYSA-N 461.371 5.566 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)C3(c4cccc([N+](=O)[O-])c4)CCC3)CCC2)cc1)c1coc(Cl)n1 1787109073 ODBCTSYRCPJMBL-UHFFFAOYSA-N 494.935 5.106 5 20 JKBD COc1cccc(C(=O)NC2(c3ccc(NC(=O)CSc4ccccc4[N+](=O)[O-])cc3)CCC2)c1 1791523452 RNPCXCRVEXZLKT-UHFFFAOYSA-N 491.569 5.143 5 20 JKBD Cc1c(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)/C=C\c2c[nH]c3ccccc23)cc(Cl)cc1[N+](=O)[O-] 1794231216 WAEZMSWKKXHZHL-NGSSCAIFSA-N 492.963 5.003 5 20 JKBD CC(C)[C@@H](C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc(F)c1[N+](=O)[O-])c1ccc(Cl)cc1 1800530305 JAYUEZOCHJDLOW-VQQMMKBISA-N 487.959 5.079 5 20 JKBD O=C(Nc1cc([C@H]2CCCCN2C(=O)/C=C/c2ccccc2[N+](=O)[O-])[nH]n1)c1cc(F)ccc1Cl 1821126394 QJCDLBYSWJYAHY-OGECGYFKSA-N 497.914 5.130 5 20 JKBD O=C(c1ccc(Cl)cc1)N1CCC([C@H]2CCCCN2C(=O)CCc2cccc([N+](=O)[O-])c2)CC1 1824842389 WOMHJWJFJPLNGL-XMMPIXPASA-N 483.996 5.114 5 20 JKBD CC(C)n1c(SCc2cc([N+](=O)[O-])cc3c2OCOC3)nnc1-c1ccc(Cl)cc1Cl 12347870 BPEGDDVLXYNNGK-UHFFFAOYSA-N 481.361 5.900 5 20 JKBD COc1ccc(CN(C)C(=O)c2ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])c(OC)c2)cc1OC 15440067 IYOXKZOBAVEANP-UHFFFAOYSA-N 486.908 5.339 5 20 JKBD C[C@H](OC(=O)c1cc(C(F)(F)F)cc(C(F)(F)F)c1)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 17717498 LBGHVLNUGALXJN-VIFPVBQESA-N 475.301 5.600 5 20 JKBD C[C@@H](OC(=O)c1csc(-c2ccc(F)cc2)n1)C(=O)Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1 19616678 ONRNFLCHAVPAMQ-GFCCVEGCSA-N 498.517 5.165 5 20 JKBD Cc1ccccc1-n1ccnc1S[C@@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 21594693 JMGQSSJGQCSROY-ZDUSSCGKSA-N 450.442 5.227 5 20 JKBD O=C(CSc1ccc(C(F)(F)F)cc1[N+](=O)[O-])Nc1cc2c(cc1Cl)OCCCO2 26981259 CVQFCHFUOPWRPB-UHFFFAOYSA-N 462.833 5.159 5 20 JKBD COc1ccc(CSCC(=O)N(c2nc3ccccc3s2)c2ccccc2C)cc1[N+](=O)[O-] 105969539 UZEMISOLWZKGJE-UHFFFAOYSA-N 479.583 6.120 5 20 JKBD CC(C)(C)c1cc(NC(=O)Cn2c3ccccc3c(=O)c3ccccc32)n(-c2ccc(F)cc2)n1 106102146 DZNDYIJONHQMPU-UHFFFAOYSA-N 468.532 5.416 5 20 JKBD COc1cc2c(cc1OC)[C@@H](c1ccccc1)N(C(=O)c1ccc(Cl)cc1[N+](=O)[O-])CC2 255943205 HUVVILBVYCMDDW-HSZRJFAPSA-N 452.894 5.053 5 20 JKBD O=C(Nc1c(F)cccc1Oc1ccccc1)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-] 410032172 AIUDHHCEJFAQEI-UHFFFAOYSA-N 450.344 5.720 5 20 JKBD O=C(C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1)N1CCCc2cc(F)c(F)cc21 484319167 NXWGMOOHMXBHLB-UHFFFAOYSA-N 469.410 5.088 5 20 JKBD COc1cccc([C@@H](CNC(=O)Nc2ccc([N+](=O)[O-])cc2)c2c[nH]c3ccccc23)c1OC 503696476 MZGFANQVBFDYSU-OAQYLSRUSA-N 460.490 5.047 5 20 JKBD C[C@@H]1Cc2cc([N+](=O)[O-])ccc2N1C(=O)c1cc(-c2ccc(F)cc2)nc2onc(C3CC3)c12 504376592 NSOZNGSWGZGUBU-CYBMUJFWSA-N 458.449 5.406 5 20 JKBD COc1ccc(OC(F)F)c(NC(=O)c2ccc(N[C@@H](C)c3ccccn3)c([N+](=O)[O-])c2)c1 508879852 RCCQRGGEWPCGBO-ZDUSSCGKSA-N 458.421 5.025 5 20 JKBD CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccccc1C(=O)N1C[C@H](C)C[C@@H](C)C1 509249006 VNWSSQMLXGREHI-RTBURBONSA-N 452.555 5.155 5 20 JKBD CCOc1cc(Br)c(NC(=O)c2cc3cc([N+](=O)[O-])ccc3s2)cc1OCC 511594024 NIFDPGZRRYITMZ-UHFFFAOYSA-N 465.325 5.622 5 20 JKBD CCC1CCC(N(C(=O)c2cc(OC)c(OCc3cscn3)cc2[N+](=O)[O-])C2CC2)CC1 512344365 WZCYHBZSPRAJAL-UHFFFAOYSA-N 459.568 5.212 5 20 JKBD CCC(CC)C(=O)N1CCC(NCc2ccc(Sc3ccc(C)cc3)c([N+](=O)[O-])c2)CC1 513638600 UAIXQQSHAWVAKG-UHFFFAOYSA-N 455.624 5.571 5 20 JKBD CC(C)NC(=O)c1ccc(N[C@H](C)c2cccc(NC(=O)Cc3ccccc3F)c2)c([N+](=O)[O-])c1 515550858 QXTCIVLSLQTQLC-QGZVFWFLSA-N 478.524 5.226 5 20 JKBD C[C@@H](NC(=O)C(=O)Nc1ccc(Oc2ccc(Cl)cc2Cl)c(F)c1)c1cccc([N+](=O)[O-])c1 516737184 FNKAHZUHIIDWDW-GFCCVEGCSA-N 492.290 5.649 5 20 JKBD O=C(N[C@H](c1ccc(F)cc1)[C@H]1CCCO1)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 521388185 SILTYUXAFUVNAC-FGZHOGPDSA-N 495.473 5.006 5 20 JKBD Cn1c([C@@H](NCc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)c2ccccc2)nc2ccccc21 549549768 BHYFQQYAPDIYSK-VWLOTQADSA-N 454.555 6.089 5 20 JKBD CN(C)[C@H](CNC(=O)C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)c1ccccc1 603454110 WNNXURFUAADYAJ-MWKGPOOMSA-N 486.597 5.554 5 20 JKBD O=C(Nc1nc2c(s1)CCN(Cc1ccccc1)C2)c1cc2cc([N+](=O)[O-])ccc2s1 603672463 MEUCPDHYJRTNIE-UHFFFAOYSA-N 450.545 5.077 5 20 JKBD Cc1nn(Cc2ccc(C(=O)N(C)c3ccccc3Oc3ccccc3)cc2)c(C)c1[N+](=O)[O-] 604567751 FFVDPTXUVDXCFK-UHFFFAOYSA-N 456.502 5.525 5 20 JKBD COc1ccc(Cl)c2c1N(C(=O)c1ccc(N[C@H](C)c3ccccn3)c([N+](=O)[O-])c1)CCC2 609065185 DOMBVMVXQNGIAY-OAHLLOKOSA-N 466.925 5.418 5 20 JKBD CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)NC1C[C@@H](C(F)(F)F)C[C@H](C(F)(F)F)C1 609148117 CCUDJVATDNPDDN-KBPBESRZSA-N 455.399 5.424 5 20 JKBD Cc1ccc(C(=O)N[C@H](CC(=O)Nc2cc([N+](=O)[O-])ccc2OC(F)F)c2ccccc2)cc1 609228477 VTTJQUMIQVTXMF-LJQANCHMSA-N 469.444 5.005 5 20 JKBD Cc1nc2ccccc2c2c(NC(=O)Cc3csc(NC(=O)C(C)C)n3)c3ccccc3n12 611762975 FFBMZAPBHBCSLL-UHFFFAOYSA-N 457.559 5.181 5 20 JKBD COc1cc(OC)c(C2CCN(C(=O)c3cc4ccccc4c4cccnc34)CC2)c(OC)c1 612175226 JNMGTYMDXLKNNV-UHFFFAOYSA-N 456.542 5.434 5 20 JKBD CN(C)S(=O)(=O)c1ccc(CNC(=O)CCC(=O)c2ccc3ccc4cccc5ccc2c3c45)cc1 727768504 FQVNCYGGMRWPAQ-UHFFFAOYSA-N 498.604 5.114 5 20 JKBD COC1CCN(c2ccc(NC(=O)N(Cc3ccc([N+](=O)[O-])cc3)C(C)C)cc2C(F)(F)F)CC1 729039393 NZQAJEIEQUHLAP-UHFFFAOYSA-N 494.514 5.671 5 20 JKBD Cc1cccc([N+](=O)[O-])c1NC(=O)COC(=O)Cc1csc(-c2ccc(Cl)cc2Cl)n1 747255126 QFYAXUBTSSBVCL-UHFFFAOYSA-N 480.329 5.058 5 20 JKBD C[C@@H](OC(=O)CSc1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccccc1Oc1ccccc1 852584562 OMOCLTFZIJXQBI-MRXNPFEDSA-N 452.488 5.050 5 20 JKBD Cc1nn(-c2ccc(Cl)c(Cl)c2)c(C)c1CC(=O)Nc1cc([N+](=O)[O-])c(F)cc1F 915283733 FUCPUPCEXQJWNJ-UHFFFAOYSA-N 455.248 5.164 5 20 JKBD Cc1nn(-c2ccc(Cl)cc2Cl)c(C)c1CC(=O)Nc1cc([N+](=O)[O-])c(F)cc1F 915837641 FMXXWIRTQKPTMH-UHFFFAOYSA-N 455.248 5.164 5 20 JKBD O=C(Nc1cc([N+](=O)[O-])ccc1F)c1ccc2c(c1)C(=O)N(c1cc(Cl)ccc1Cl)C2=O 917609320 UGBZOVPONVNHOW-UHFFFAOYSA-N 474.231 5.094 5 20 JKBD Cc1ccc(/C(O)=C(/C(=S)N[C@@H](C)c2ccccc2)[n+]2ccc3c(c2)CCCC3)cc1[N+](=O)[O-] 917612664 NYQMJJLVMHHQEZ-IBGZPJMESA-O 474.606 5.632 5 20 JKBD CC(F)(F)CCC(=O)O[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Br)c1ccccc1 919293715 PPJKBFKRQRRXLT-KRWDZBQOSA-N 471.254 5.016 5 20 JKBD C[C@@H](Sc1ccc(Br)cc1)C(=O)O[C@H](C)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 919469421 ZIQBWQDDZLYXKZ-VXGBXAGGSA-N 478.324 5.192 5 20 JKBD COc1cc(C(=O)NC2(c3ccc(NC(=O)C(C)(C)C(C)(F)F)cc3)CCC2)ccc1[N+](=O)[O-] 1786456028 JLKDZYYKICAQOA-UHFFFAOYSA-N 475.492 5.033 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)c3ccc([N+](=O)[O-])o3)CCC2)cc1)c1cc(F)c(F)c(Cl)c1 1792159725 OLNBIMMKBIWSMK-UHFFFAOYSA-N 475.835 5.181 5 20 JKBD CC(C)c1cc(C(=O)NC2(c3ccc(NC(=O)/C=C/c4ccccc4[N+](=O)[O-])cc3)CCC2)no1 1792315677 PGKPOXWPENNMLY-MDWZMJQESA-N 474.517 5.167 5 20 JKBD Cc1nc2cc(C(=O)N3[C@H]4CC[C@@H]3C[C@H](NC(=O)c3cc(Cl)cc([N+](=O)[O-])c3C)C4)ccc2s1 1797561874 AFPOWXFCUSUMEB-BCDXTJNWSA-N 498.992 5.040 5 20 JKBD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2ccc([N+](=O)[O-])cc2F)[nH]n1)[C@@H]1CCC[C@H]2CCCC[C@@H]21 1818931161 JGKZDUUPDXAYKY-WEGMGINNSA-N 497.571 5.369 5 20 JKBD Cc1cc(C)cc(C(=O)Nc2cc([C@H]3CCCCN3C(=O)CSc3ccccc3[N+](=O)[O-])[nH]n2)c1 1820545130 SUAPKZNKNTZLQO-HXUWFJFHSA-N 493.589 5.033 5 20 JKBD CC(C)c1ccc(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)c3cc(F)cc([N+](=O)[O-])c3)[nH]n2)cc1 1820592423 SDLZGNSDRLGEID-QFIPXVFZSA-N 479.512 5.200 5 20 JKBD CC(C)(C)c1cc(C(=O)N2CCCC[C@H]2C2CCN(C(=O)/C=C/c3ccccc3[N+](=O)[O-])CC2)c[nH]1 1825441821 PSUSLMJMLDBEHT-RGPPVUSESA-N 492.620 5.167 5 20 JKBD Cc1cc2cccc(C(=O)N3CCCC[C@H]3C3CCN(C(=O)c4cccc(F)c4[N+](=O)[O-])CC3)c2[nH]1 1828214245 GFQRAHBQTAXMRJ-QHCPKHFHSA-N 492.551 5.071 5 20 JKBD O=C(c1ccc(O)c([N+](=O)[O-])c1)N1CCC([C@@H]2CCCCN2C(=O)[C@@H]2CCC[C@@H]3CCCC[C@H]32)CC1 1828460975 VVJJDWLTSDGHQI-QVGHQYEOSA-N 497.636 5.140 5 20 JKBD O=C(c1ccc(-c2ccccc2)cc1)N1CCC([C@@H]2CCCCN2C(=O)c2ccc([N+](=O)[O-])[nH]2)CC1 1829838304 QZHCIFMDQXTJCE-VWLOTQADSA-N 486.572 5.137 5 20 JKBD CC(C)(C)CCCCCC(=O)N1CC2(CCCN2C(=O)c2ccc(Br)c([N+](=O)[O-])c2)C1 1845336497 KRAAXZJPYVRXJJ-UHFFFAOYSA-N 494.430 5.171 5 20 JKBD Cc1c(-c2ccccc2)sc(NC(=O)c2cc([N+](=O)[O-])ccc2Cl)c1C(=O)N1CCOCC1 14389729 LULPTAISDXXNFJ-UHFFFAOYSA-N 485.949 5.010 5 20 JKBD Cc1c(NC(=O)[C@H](C)Sc2nnc(-c3c[nH]c4ccccc34)n2C2CC2)cccc1[N+](=O)[O-] 26979943 PCXYSBOKIBULJV-AWEZNQCLSA-N 462.535 5.097 5 20 JKBD COc1ccc(CN(C)C(=O)c2ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])cc2)cc1OC 29261231 UQQBJCUWHMYCSR-UHFFFAOYSA-N 456.882 5.330 5 20 JKBD COc1cc(C(=O)Nc2cccc(OCc3ccc(F)cc3)c2)c([N+](=O)[O-])cc1OC(F)F 30391718 BVEWKYHQGIZDFE-UHFFFAOYSA-N 462.380 5.175 5 20 JKBD COc1ccc(Oc2ccc([N+](=O)[O-])cc2C(=O)Nc2cccc(NC(=O)c3ccncc3)c2)cc1 30889057 JJINCVQPYBIVMF-UHFFFAOYSA-N 484.468 5.295 5 20 JKBD C[C@H](OC(=O)c1ccccc1C(=O)c1ccc(Cl)c([N+](=O)[O-])c1)c1nnc(-c2cccs2)o1 104923056 OSEZPDQHYIJWRZ-LBPRGKRZSA-N 483.889 5.509 5 20 JKBD Cc1ccc(NC(=O)c2ccc(N[C@H](C)c3ccccn3)c([N+](=O)[O-])c2)c(OC[C@@H]2CCCO2)c1 108891229 VQDMKPRJCPVBLQ-QUCCMNQESA-N 476.533 5.281 5 20 JKBD COc1ccc([C@H](C)NC(=O)c2ccc(N[C@H](C)c3ccccn3)c([N+](=O)[O-])c2)cc1Br 115704253 LFAMHBYASUZBPR-LSDHHAIUSA-N 499.365 5.425 5 20 JKBD C[C@@H]1CCCN(Cc2ccc(CNC(=O)c3ccc(N[C@H](C)c4ccccn4)c([N+](=O)[O-])c3)cc2)C1 227342341 UIYLXQASYYWGKS-NHCUHLMSSA-N 487.604 5.325 5 20 JKBD O=C(N[C@H](c1ccccc1)c1nccs1)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 303160712 FFANWFOETZYGJX-HXUWFJFHSA-N 490.507 5.192 5 20 JKBD COc1cc([C@H](C)NC(=O)c2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)ccc1OCc1ccccc1 410057171 IXQXGEKJORRXNS-SFHVURJKSA-N 486.528 5.074 5 20 JKBD COc1ccc(Br)cc1NC(=O)c1ccc(N[C@@H](C)c2ccccn2)c([N+](=O)[O-])c1 410082984 OESSZVVZGUZCHX-ZDUSSCGKSA-N 471.311 5.186 5 20 JKBD CCOc1cccc2cc([C@H](C)NC(=O)c3ccc(Cn4nc(C)c([N+](=O)[O-])c4C)cc3)oc12 503159723 KXTGDSLTTKIKHJ-HNNXBMFYSA-N 462.506 5.092 5 20 JKBD CCOc1cc([N+](=O)[O-])c(C(=O)Nc2nc(-c3ccc(F)c(Cl)c3)cs2)cc1OC 511628812 YYJYYHVQLYCFPS-UHFFFAOYSA-N 451.863 5.170 5 20 JKBD COc1ccc(-c2[nH]c3ccccc3c2CCC(=O)N[C@@H](C)c2cccc([N+](=O)[O-])c2)c(OC)c1 512810941 AOUJBRHZKKHAOD-KRWDZBQOSA-N 473.529 5.570 5 20 JKBD COCCN(C(=O)CCc1ccc2ccccc2c1)c1nc(-c2ccc([N+](=O)[O-])cc2)cs1 515438088 OMNZHVFKDASDBL-UHFFFAOYSA-N 461.543 5.484 5 20 JKBD COCCN(C(=O)COc1ccc(Cl)c(Cl)c1)c1nc(-c2ccc([N+](=O)[O-])cc2)cs1 517302846 FJROZMUQNWRSSB-UHFFFAOYSA-N 482.345 5.084 5 20 JKBD Cc1ccc(Sc2ccc(NC(=O)CNC(=O)c3c(Cl)cccc3[N+](=O)[O-])cc2)cc1C 517451267 YWYCXDNRXGSPED-UHFFFAOYSA-N 469.950 5.385 5 20 JKBD COCCN(C(=O)[C@@H]1C[C@H]1c1ccc2ccccc2c1)c1nc(-c2ccc([N+](=O)[O-])cc2)cs1 518701608 UTWQJDAXUIQESM-XZOQPEGZSA-N 473.554 5.655 5 20 JKBD CCn1cnnc1-c1ccccc1NC(=O)c1ccc(NCc2ccccc2Cl)c([N+](=O)[O-])c1 521469797 ULASDRCBRNURIG-UHFFFAOYSA-N 476.924 5.391 5 20 JKBD Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)C[C@@H](NC(=O)c1ccccc1Cl)c1ccccc1 603501296 FOQPEZQNSMOONI-OAQYLSRUSA-N 451.910 5.365 5 20 JKBD CC(C)C(=O)Nc1cccc(NC(=O)c2ccc(NCc3ccccc3Cl)c([N+](=O)[O-])c2)c1 603570398 MCRNFIDSIFBGCT-UHFFFAOYSA-N 466.925 5.707 5 20 JKBD COC(=O)Cc1csc(NC(=O)c2ccccc2Sc2ccc(C(F)(F)F)cc2[N+](=O)[O-])n1 604572606 LPMZHDVCTABPMQ-UHFFFAOYSA-N 497.476 5.189 5 20 JKBD CC(C)(C(=O)Nc1ccc(Oc2ccccc2C(F)(F)F)c(F)c1)n1cc([N+](=O)[O-])cn1 608806457 KDGLVGXDCQPCAA-UHFFFAOYSA-N 452.364 5.115 5 20 JKBD O=C(C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)N1CCC[C@H]1CN1CCCC1 608813893 FMKVLUREOLRFKT-PTMWEUFISA-N 476.602 5.222 5 20 JKBD COc1ccc(CN[C@@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2ccccc2)c(C(F)(F)F)c1 608834648 LTKZYIMAVRLYGF-OAQYLSRUSA-N 493.869 5.745 5 20 JKBD COc1cccc(-c2cc(NCc3ccc(Oc4ccc(F)cc4)c([N+](=O)[O-])c3)n(CCO)n2)c1 608982687 HBVILNRURJANDV-UHFFFAOYSA-N 478.480 5.003 5 20 JKBD CCc1c(-c2ccncc2)n[nH]c1NC(=O)c1ccc(NCc2ccccc2Cl)c([N+](=O)[O-])c1 609110350 ZKHYMMQFIWZUHI-UHFFFAOYSA-N 476.924 5.460 5 20 JKBD C[C@H](NC(=O)c1ccccc1Sc1ccc(C(F)(F)F)cc1[N+](=O)[O-])c1nnc2ccccn12 610428530 NJPCCUUVTSHBDK-ZDUSSCGKSA-N 487.463 5.299 5 20 JKBD Cc1nn(Cc2ccc(C(=O)Oc3ccc(NC(=O)c4ccc(F)cc4)cc3)cc2)c(C)c1[N+](=O)[O-] 728244272 ANZAQHKDPQRIJP-UHFFFAOYSA-N 488.475 5.067 5 20 JKBD CCN(CC)C(=O)c1ccc(C(=O)Oc2ccc3c(-c4ccc([N+](=O)[O-])cc4)cc(=O)oc3c2)cc1 729169083 JMAGXYBEAVNSLI-UHFFFAOYSA-N 486.480 5.069 5 20 JKBD C[C@H](OC(=O)c1csc(-c2ccc([N+](=O)[O-])cc2)n1)C(=O)Nc1nc(-c2ccccc2)cs1 747956619 IEPUVTVDMWVFNQ-ZDUSSCGKSA-N 480.527 5.026 5 20 JKBD O=C(Nc1cc(Cl)ccc1Cl)[C@H]1CCCCN1C(=O)c1cc(Cl)ccc1[N+](=O)[O-] 751244990 BMOXCLZNGJHWQX-QGZVFWFLSA-N 456.713 5.188 5 20 JKBD O=C(Nc1nc2cc(C(F)(F)F)ccc2n1Cc1ccco1)c1cc(Cl)ccc1[N+](=O)[O-] 790910212 DVCJURYSKTXHLT-UHFFFAOYSA-N 464.787 5.510 5 20 JKBD O=C(COC(=O)c1cc(-c2ccccn2)nc2ccccc12)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 793171077 CMLORPUASJIDPZ-UHFFFAOYSA-N 496.401 5.019 5 20 JKBD O=C(Nc1cc([N+](=O)[O-])c(F)cc1F)c1cc([N+](=O)[O-])ccc1Sc1ccc(Cl)cc1 897468433 QLSRZMGFTNKATD-UHFFFAOYSA-N 465.821 5.838 5 20 JKBD O=[N+]([O-])c1ccc2c(ccn2Cc2nc(-c3cccc(Cn4cnc5ccccc54)c3)no2)c1 904491035 BXMMVPCTUOCFBF-UHFFFAOYSA-N 450.458 5.046 5 20 JKBD CC(C)c1ccc([C@@H](NC(=O)C(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)c2cccs2)cc1 915743593 STNOJBKLRBCYDU-HXUWFJFHSA-N 457.939 5.277 5 20 JKBD Cc1c(C(=O)Nc2ccc(NC(=O)c3ccccc3)cc2C(F)(F)F)cc([N+](=O)[O-])cc1[N+](=O)[O-] 915870945 SVYAWXFRSISRBY-UHFFFAOYSA-N 488.378 5.335 5 20 JKBD CC1=C(C(=O)Nc2ccc(F)cc2)[C@@H](c2ccc(-c3ccc([N+](=O)[O-])cc3Cl)o2)NC(=S)N1 916190932 ZMIDRBARPZPWFI-HXUWFJFHSA-N 486.912 5.079 5 20 JKBD CCOc1ccc(NC(=O)CNc2ccc(Oc3ncc(Cl)cc3Cl)cc2)c([N+](=O)[O-])c1 917819873 XZQUNOAVDSJADE-UHFFFAOYSA-N 477.304 5.538 5 20 JKBD COc1cc(C(=O)O[C@@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2C(F)(F)F)ccc1OC1CCCC1 919447955 LYGPRENXOHDUDP-ZDUSSCGKSA-N 496.438 5.128 5 20 JKBD Cn1c(C(=O)NC2(c3ccc(NC(=O)/C=C/c4ccc([N+](=O)[O-])o4)cc3)CCC2)cc2ccccc21 1786204403 DVJZABHHEUZGBE-ACCUITESSA-N 484.512 5.141 5 20 JKBD Cc1ccc(C(=O)NC2(c3ccc(NC(=O)Cn4ccc5ccc([N+](=O)[O-])cc54)cc3)CCC2)c(C)n1 1786277086 JQWIZOKQFJOGDR-UHFFFAOYSA-N 497.555 5.009 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)NC1(c2ccc(NC(=O)/C=C/c3ccco3)cc2)CCC1 1786915206 OVISUSMESLQTJB-FMIVXFBMSA-N 463.465 5.096 5 20 JKBD O=C(CC1CCCC1)Nc1ccc(C2(NC(=O)CSc3ccccc3[N+](=O)[O-])CCC2)cc1 1787616292 WQNPPTRMQVMOGY-UHFFFAOYSA-N 467.591 5.401 5 20 JKBD O=C(/C=C/c1cc2ccccc2o1)Nc1ccc(C2(NC(=O)/C=C/c3ccc([N+](=O)[O-])o3)CCC2)cc1 1789114794 RJQHMPGQKRXPEJ-CKNIOMRDSA-N 497.507 5.795 5 20 JKBD Cc1c(C(=O)Nc2ccc(C3(NC(=O)c4ccncc4F)CCC3)cc2)cc(Cl)cc1[N+](=O)[O-] 1790774611 NIESBMBZSWSVDK-UHFFFAOYSA-N 482.899 5.152 5 20 JKBD COc1cc(C(=O)Nc2ccc(C3(NC(=O)c4ccc5cnccc5c4)CCC3)cc2)ccc1[N+](=O)[O-] 1792164798 WSAXXEIVBXFZKM-UHFFFAOYSA-N 496.523 5.213 5 20 JKBD Cc1ccc(CC(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cc4c(Cl)cccc4s2)C3)cc1[N+](=O)[O-] 1800139002 WRYIIUIEKPISQK-BCDXTJNWSA-N 498.004 5.266 5 20 JKBD CC(C)[C@H](C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)/C=C/c1ccccc1[N+](=O)[O-])c1ccc(Cl)cc1 1804339018 YHIWHVHJHHXNOZ-CHLHZWNFSA-N 496.007 5.339 5 20 JKBD CC1(C)CCC(CC(=O)N2CC[C@@H](CNC(=O)c3ccc([N+](=O)[O-])cc3F)[C@@H]2c2cccnc2)CC1 1810749582 KOQMMFNHPBBVFE-CPJSRVTESA-N 496.583 5.055 5 20 JKBD CC(C)[C@@H](C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2ccc([N+](=O)[O-])[nH]2)n[nH]1)c1ccc(Cl)cc1 1820366101 AAZZCDZGTWODEC-DENIHFKCSA-N 498.971 5.045 5 20 JKBD Cc1cccc2[nH]c(C(=O)N3CCCC[C@H]3c3cc(NC(=O)/C=C/c4ccccc4[N+](=O)[O-])n[nH]3)cc12 1823505158 XBRBRPCWHFXQEE-BYUVYSIJSA-N 498.543 5.127 5 20 JKBD O=C(c1cc(F)cc(Cl)c1)N1CCC([C@@H]2CCCCN2C(=O)c2ccc([N+](=O)[O-])cc2F)CC1 1830497251 BUUHKXVCAWFITL-QFIPXVFZSA-N 491.922 5.074 5 20 JKBD CC[C@H](C)CC(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cccc(Br)c2[N+](=O)[O-])CC1 1830697440 BFNVLIYFSJNHCD-JXFKEZNVSA-N 494.430 5.027 5 20 JKBD Cc1ccc(/C=C/C(=O)N2CCCC[C@H]2C2CCN(C(=O)c3cccc(F)c3[N+](=O)[O-])CC2)s1 1832174013 PJSWZAQSONFEQI-NEQMZLFVSA-N 485.581 5.051 5 20 JKBD COc1cc([N+](=O)[O-])ccc1NC(=O)CSc1nnc(-c2ccc(Cl)cc2Cl)n1C(C)C 9826820 ZWCHEIAAJKWDEO-UHFFFAOYSA-N 496.376 5.480 5 20 JKBD CCOc1ccc2nc(S[C@H](C)C(=O)Nc3ccc([N+](=O)[O-])cc3C(F)(F)F)[nH]c2c1 10732443 JTLVOMQMQPMXDJ-SNVBAGLBSA-N 454.430 5.008 5 20 JKBD Cc1ccc(NC(=O)[C@H](Sc2nnc(C(C)C)n2Cc2ccco2)c2ccccc2)c([N+](=O)[O-])c1 10930604 QEYMGUWXHNUISJ-JOCHJYFZSA-N 491.573 5.732 5 20 JKBD Cc1ccc(NC(=O)[C@@H](Sc2nnc(C(C)C)n2Cc2ccco2)c2ccccc2)c([N+](=O)[O-])c1 10930616 QEYMGUWXHNUISJ-QFIPXVFZSA-N 491.573 5.732 5 20 JKBD O=C(Nc1ccc(NS(=O)(=O)c2c(Cl)cccc2Cl)cc1)c1ccc([N+](=O)[O-])s1 11325543 UFULEVVLMVXONC-UHFFFAOYSA-N 472.331 5.016 5 20 JKBD O=C(c1ccc([N+](=O)[O-])cc1)N(C[C@@H]1CCCO1)c1nc(-c2ccc(Br)cc2)cs1 14819590 ZBKXXHWWYXIBLP-SFHVURJKSA-N 488.363 5.307 5 20 JKBD c1ccc(-n2c(CN3CCCC3)nnc2SCc2nc3ccccc3c3ccccc23)cc1 20071815 LZSDZWJCIKNYTG-UHFFFAOYSA-N 451.599 5.857 5 20 JKBD CCn1c(SCc2nc(=O)c3c(-c4ccccc4)csc3[nH]2)nc2cc3ccccc3cc2c1=O 24890967 ONJIGDXPFOYVMW-UHFFFAOYSA-N 496.617 5.827 5 20 JKBD Nc1ccc(-c2ccc3ncc4ccc(=O)n(-c5ccc(F)c(C(F)(F)F)c5)c4c3c2)cn1 71329484 MXRMEHBVJBSIPI-UHFFFAOYSA-N 450.395 5.341 5 20 JKBD CCCN(C(=O)c1ccc(N[C@@H](C)c2ccccn2)c([N+](=O)[O-])c1)[C@H](C)C(=O)Nc1ccccc1 109891216 AKUGTTUTOPEOCC-RBUKOAKNSA-N 475.549 5.042 5 20 JKBD O=C(Nc1nc(-c2cc3ccccc3o2)cs1)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-] 476127945 AZNZVPRINWIUHY-UHFFFAOYSA-N 463.393 5.658 5 20 JKBD Cc1cc(C)c2nc(N(Cc3ccccc3)C(=O)c3ccc(-n4cncn4)c([N+](=O)[O-])c3)sc2c1 496643238 NSBSSCYOLWPTFS-UHFFFAOYSA-N 484.541 5.249 5 20 JKBD O=C(Nc1ccc(Cn2cnc3ccccc32)cc1)c1csc(-c2cccc([N+](=O)[O-])c2)n1 497100865 UZFOLDLELMFZSO-UHFFFAOYSA-N 455.499 5.369 5 20 JKBD Cc1ccc([N+](=O)[O-])cc1C(=O)N(CC(=O)Nc1ccc(Cl)cc1C(F)(F)F)C(C)C 504777470 XPABXUFNQRCNRB-UHFFFAOYSA-N 457.836 5.065 5 20 JKBD CC[C@H](C)c1ccc([C@@H](NC(=O)c2cc(OC)c(OC)cc2[N+](=O)[O-])c2cccs2)cc1 512408167 BPTTWKOIYUGLCE-NPMXOYFQSA-N 454.548 5.706 5 20 JKBD COc1ccc(-c2[nH]c3ccccc3c2CCC(=O)NCCc2ccc([N+](=O)[O-])cc2)c(OC)c1 512797125 LTJBXONYAWJAQG-UHFFFAOYSA-N 473.529 5.052 5 20 JKBD Cn1cnnc1-c1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2Sc2ccc(Cl)cc2)cc1 514558720 DTKZFXUPRLNGDO-UHFFFAOYSA-N 465.922 5.447 5 20 JKBD Cc1ccc(C(N)=O)cc1NC(=O)C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1 521185902 XQTXTCZFBHZJFF-PDGQHHTCSA-N 472.526 5.181 5 20 JKBD C[C@@H](Sc1nnc(-c2ccc(Cl)cc2)o1)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 588966203 KIYDHSQHMVUUML-SECBINFHSA-N 472.832 5.436 5 20 JKBD CCOc1ccc(C(=O)Nc2ccc(NC(=O)c3ccco3)cc2C(F)(F)F)cc1[N+](=O)[O-] 590871445 SSXGQQJBHRTWTI-UHFFFAOYSA-N 463.368 5.110 5 20 JKBD CN(Cc1cccnc1)C(=O)c1c2c(nc3ccccc13)/C(=C\c1cccc([N+](=O)[O-])c1)CCC2 600814187 AQEHZBHZSJYYTD-QNGOZBTKSA-N 464.525 5.687 5 20 JKBD C[C@H](c1nnc(SCc2nc(-c3ccc([N+](=O)[O-])cc3)no2)n1-c1ccccc1)N1CCCCC1 603748171 DELHBXHRCPOAHX-QGZVFWFLSA-N 491.577 5.065 5 20 JKBD Cc1nc(NC(=O)c2cc(OCC(F)(F)F)ccc2[N+](=O)[O-])sc1Cc1ccccc1 603816946 YPDRSYKCRPIBEL-UHFFFAOYSA-N 451.426 5.144 5 20 JKBD COc1cc(C(=O)N2CCC[C@@H]2c2cc(C)no2)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 603902955 UXMHJRPVBDWSHW-MRXNPFEDSA-N 457.870 5.323 5 20 JKBD CC(C)[C@@H](NCc1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1)c1nnc2ccccn12 608789136 XPWFZNZWGDWIIZ-JOCHJYFZSA-N 451.914 5.570 5 20 JKBD O=C(c1ccc(C(=O)N2CCC[C@@H]2c2cccs2)c([N+](=O)[O-])c1)N1CCC[C@@H]1c1cccs1 609043747 PUEFHFAAJDWVNN-RTBURBONSA-N 481.599 5.672 5 20 JKBD C[C@H](NC(=O)N[C@H]1c2cc(Br)ccc2SC[C@@H]1C)c1cccc([N+](=O)[O-])c1 609199867 RQFHEMNVNPCWKJ-OAVHHTNSSA-N 450.358 5.201 5 20 JKBD C[C@H](NCc1ccc(Oc2ccccc2Cl)c([N+](=O)[O-])c1)c1cccc(NS(C)(=O)=O)c1 725848974 FMIMINVQGAEMCB-HNNXBMFYSA-N 475.954 5.263 5 20 JKBD C/C(=C/C(=O)O[C@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F)c1ccccc1Cl 727574282 HPCGVZSSNGPZOM-UCQJPZFISA-N 456.804 5.241 5 20 JKBD CC(=O)Nc1cccc([C@@H](C)NC(=O)CCC(=O)c2ccc3ccc4cccc5ccc2c3c45)c1 727754371 QONDKVNKMAVOIR-GOSISDBHSA-N 462.549 6.383 5 20 JKBD Cc1nccn1-c1ccc(CNC(=O)CCC(=O)c2ccc3ccc4cccc5ccc2c3c45)cn1 727768139 UEMJOIYLPHQDHW-UHFFFAOYSA-N 472.548 5.752 5 20 JKBD CC(C)(C)OC(=O)Nc1cc(C(=O)Nc2nc(-c3cccc([N+](=O)[O-])c3)cs2)ccc1F 730449054 TYKUHNNFEQFFMQ-UHFFFAOYSA-N 458.471 5.457 5 20 JKBD O=C(Nc1cc(Cl)c([N+](=O)[O-])cc1OCc1ccccc1)[C@@H]1CCCN(C(=O)c2ccccc2)C1 731163021 MCDIFWWYOJMTKH-HXUWFJFHSA-N 493.947 5.318 5 20 JKBD Cc1nnc(SCc2c(C(=O)O[C@@H](C)c3cccc([N+](=O)[O-])c3)oc3ccccc23)s1 742955488 BFTKAMJHJXMDHK-LBPRGKRZSA-N 455.517 5.711 5 20 JKBD C[C@@H](OC(=O)CSc1ccc2c3c(cccc13)CC2)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 746095499 RLVHTWUXMOZDLL-CQSZACIVSA-N 461.499 5.293 5 20 JKBD Cc1c(C(=O)NC[C@@H](c2ccccc2)c2c[nH]c3ccccc23)cc([N+](=O)[O-])c(C)c1[N+](=O)[O-] 748605647 AQODPTDVGNLSFX-FQEVSTJZSA-N 458.474 5.163 5 20 JKBD C[C@H](OC(=O)[C@@H](C)SCc1nc(O)c2c(-c3ccccc3)csc2n1)c1ccccc1[N+](=O)[O-] 749053896 HOKKDLZPNFJARV-LSDHHAIUSA-N 495.582 5.898 5 20 JKBD O=C(Nc1nc(Cc2ccc(Br)cc2)cs1)c1c[nH]c2ccc([N+](=O)[O-])cc12 749733656 WSHXJSRZGQNXOB-UHFFFAOYSA-N 457.309 5.138 5 20 JKBD COc1ccc([C@H](Nc2cc([N+](=O)[O-])c(OC)c(Br)c2[N+](=O)[O-])C(C)C)cc1 836183456 WNENDHBEQXRWDF-MRXNPFEDSA-N 454.277 5.092 5 20 JKBD Cc1nc(CSc2ccccc2C(=O)OCc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)cs1 841990797 GQJBZZHYMODKFH-UHFFFAOYSA-N 468.516 5.059 5 20 JKBD Cc1ccc([N+](=O)[O-])cc1NC(=O)CSc1nc(NC(=O)c2ccccc2)c2c(C)c(C)oc2n1 878922990 NYNPIKPZRDVZHU-UHFFFAOYSA-N 491.529 5.039 5 20 JKBD C[C@@H](Sc1ccc([N+](=O)[O-])cc1)c1nc(-c2ccc(Cn3cnc4ccccc43)cc2)no1 904471357 DRJDTSGFZICTHS-MRXNPFEDSA-N 457.515 5.896 5 20 JKBD O=C(Nc1ccc(OC(=O)[C@H]2CCC[C@H](C(F)(F)F)C2)cc1)c1cc([N+](=O)[O-])ccc1Cl 916035723 GIZJVMPZEFMUKM-STQMWFEESA-N 470.831 5.775 5 20 JKBD CN(C(=O)c1c2c(nc3ccccc13)/C(=C/c1cccc([N+](=O)[O-])c1)CCC2)c1ccc(C(N)=O)cc1 917860394 JQROGQVQAAVUQV-CAPFRKAQSA-N 492.535 5.395 5 20 JKBD CC1=C(C(=O)OCc2ccccc2)[C@@H](c2csc([N+](=O)[O-])c2)NC(=O)N1Cc1cccs1 917960822 LTEFXNOEIYDIIK-HXUWFJFHSA-N 469.544 5.002 5 20 JKBD COc1ccc(CC(=O)NC2(c3ccc(NC(=O)/C=C/c4cccs4)cc3)CCC2)c([N+](=O)[O-])c1 1788163832 WKZWRCOGEUUTQY-VAWYXSNFSA-N 491.569 5.055 5 20 JKBD Cc1c(C(=O)Nc2ccc(C3(NC(=O)c4ccc(O)c([N+](=O)[O-])c4)CCC3)cc2)oc2ccccc12 1788967390 DUUNHGNMLRQXFA-UHFFFAOYSA-N 485.496 5.417 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)c3cc4ccoc4s3)CCC2)cc1)c1ccc(O)c([N+](=O)[O-])c1 1790619857 WYLSBUKZNJIXCU-UHFFFAOYSA-N 477.498 5.170 5 20 JKBD COc1ccc(C(=O)Nc2ccc(C3(NC(=O)/C=C/c4ccc([N+](=O)[O-])o4)CCC3)cc2)cc1Cl 1792140265 UZSIFXURLXEVFO-DHZHZOJOSA-N 495.919 5.311 5 20 JKBD CCC1(C(=O)NC[C@H]2CCN(C(=O)c3cc4cc([N+](=O)[O-])ccc4s3)[C@H]2c2cccnc2)CCC1 1809648495 AVQAVFHHANNMHQ-JPYJTQIMSA-N 492.601 5.104 5 20 JKBD Cc1c(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)C3CCCCC3)[nH]n2)cc(Cl)cc1[N+](=O)[O-] 1821291588 YXJISSPKULWWPX-IBGZPJMESA-N 473.961 5.166 5 20 JKBD O=C(Nc1cc([C@@H]2CCCCN2C(=O)CCc2cccc([N+](=O)[O-])c2)[nH]n1)c1ccc(C2CC2)cc1 1821301556 XTHKMEBORFOUAX-DEOSSOPVSA-N 487.560 5.134 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2ccc3ccoc3c2)n[nH]1 1821456925 GPDQFKYWDWLXRO-HXUWFJFHSA-N 491.479 5.131 5 20 JKBD O=C(c1ccc(Cl)c(Cl)c1)N1CCC([C@@H]2CCCCN2C(=O)c2ccc([N+](=O)[O-])o2)CC1 1823613625 GRFQJEQLRAJZFK-SFHVURJKSA-N 480.348 5.042 5 20 JKBD Cc1cc(F)ccc1C(=O)N1CCCC[C@@H]1C1CCN(C(=O)CSc2ccccc2[N+](=O)[O-])CC1 1832727770 XFMBAFOSWRGQIL-JOCHJYFZSA-N 499.608 5.068 5 20 JKBD CC[C@@H](C)c1ccc([C@H](NC(=O)c2ccc(S(C)(=O)=O)c([N+](=O)[O-])c2)c2cccs2)cc1 14316085 DYLABGJUFCWIRI-QRQCRPRQSA-N 472.588 5.093 5 20 JKBD O=C(Cn1c2ccccc2c(=O)c2ccccc21)Nc1ccnn1Cc1ccc(Cl)cc1Cl 14729766 YFJGKLPWAJRFES-UHFFFAOYSA-N 477.351 5.345 5 20 JKBD Cc1cccc(C)c1NC(=O)[C@H](C)Oc1ccc2c(-c3ccc([N+](=O)[O-])cc3)cc(=O)oc2c1 15370889 SLMMERUBNNHKKW-KRWDZBQOSA-N 458.470 5.391 5 20 JKBD Cc1c(NC(=O)[C@H](C)OC(=O)[C@H](Sc2ccccc2)c2ccccc2)cccc1[N+](=O)[O-] 23202243 MBVGCFVZCNRUDK-HTAPYJJXSA-N 450.516 5.307 5 20 JKBD COc1cc([N+](=O)[O-])ccc1NC(=O)CSc1nnc(-c2ccccc2F)n1-c1ccc(C)cc1 28387339 BENJRSBIEHGUAA-UHFFFAOYSA-N 493.520 5.029 5 20 JKBD C[C@H](Nc1ccc(Oc2ncc(Cl)cc2Cl)cc1)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl 71992614 CMDGTLGEVICDMK-NSHDSACASA-N 481.723 6.181 5 20 JKBD Cc1csc(Sc2ccc(C(=O)Nc3cnn(Cc4ccccc4)c3)cc2[N+](=O)[O-])n1 72005345 DLGXUVOQZHXGNX-UHFFFAOYSA-N 451.533 5.008 5 20 JKBD O=C(Nc1ccncc1)c1cccc(NC(=O)c2cc([N+](=O)[O-])ccc2Oc2ccccc2)c1 110038136 YCWQJBOLRRNMLJ-UHFFFAOYSA-N 454.442 5.287 5 20 JKBD CSc1ccc(C(=O)N[C@@H](C)c2ccc(NC(=O)c3ccc(F)cc3)cc2)cc1[N+](=O)[O-] 195533603 VXIVGCXDZWWUSF-AWEZNQCLSA-N 453.495 5.199 5 20 JKBD Cc1sc(NC(=O)c2ccc(CNC(=O)c3cccs3)cc2)nc1-c1cccc([N+](=O)[O-])c1 195704359 XPJCFHJMUPGRPE-UHFFFAOYSA-N 478.555 5.271 5 20 JKBD CC[C@@H](C)c1ccc([C@H](NC(=O)c2cc([N+](=O)[O-])cc(S(C)(=O)=O)c2)c2cccs2)cc1 410095408 QZNPOPGZYDJAIB-QRQCRPRQSA-N 472.588 5.093 5 20 JKBD C[C@H](Nc1ccc(C(=O)Nc2ccc(F)cc2-c2ccc(F)cc2)cc1[N+](=O)[O-])c1ccccn1 485731817 HHYKULIWZQAUNE-INIZCTEOSA-N 474.467 6.360 5 20 JKBD C[C@@H](Nc1ccc(C(=O)N2CCC(OC3CCCCC3)CC2)cc1[N+](=O)[O-])c1ccccn1 495682080 FPGTWSZPSCWQEA-GOSISDBHSA-N 452.555 5.117 5 20 JKBD CCc1c(C)sc2nc(Sc3ccc([N+](=O)[O-])c4cnccc34)n(C[C@@H]3CCCO3)c(=O)c12 497757028 CBQOXXOXUGPTCI-AWEZNQCLSA-N 482.587 5.115 5 20 JKBD CN(C(=O)Cc1ccc(NC(=O)c2csc(-c3cccc([N+](=O)[O-])c3)n2)cc1)c1ccccc1 498734396 MWTFZNFUSMSJJW-UHFFFAOYSA-N 472.526 5.176 5 20 JKBD Cc1nn(Cc2ccc(C(=O)N(c3ccc(Cl)c(Cl)c3)C(C)C)cc2)c(C)c1[N+](=O)[O-] 505078937 WLDKPADJUCRMLW-UHFFFAOYSA-N 461.349 5.818 5 20 JKBD C[C@H](Nc1ccc(C(=O)NCC2(N3CCCCC3)CCCCC2)cc1[N+](=O)[O-])c1ccccn1 506018075 XVWVCLJNCVTRDT-FQEVSTJZSA-N 465.598 5.082 5 20 JKBD C[C@H](Nc1ccc(C(=O)N[C@H](C)c2nc3ccccc3n2C(F)F)cc1[N+](=O)[O-])c1ccccn1 506069141 HXIFRFXWIAKKJU-LSDHHAIUSA-N 480.475 5.399 5 20 JKBD COc1cc(CN[C@H]2CCCOc3ccc(F)cc32)ccc1OCc1ccc([N+](=O)[O-])cc1 507894668 IYGLTDDCBSVDSV-QFIPXVFZSA-N 452.482 5.325 5 20 JKBD COc1ccc(CN[C@@H](c2ccc3c(c2)OCCO3)C2CC2)cc1OCc1ccc([N+](=O)[O-])cc1 507939839 JHYKCPPMYCBAGA-HHHXNRCGSA-N 476.529 5.195 5 20 JKBD CC(C)CSc1ccc([N+](=O)[O-])cc1C(=O)Nc1nc(-c2ccc3c(c2)CCC(=O)N3)cs1 508014333 MQPMPHWZQBXPGD-UHFFFAOYSA-N 482.587 5.603 5 20 JKBD COc1cc(C(=O)N(c2ccc(Cl)cc2)C(C)C)c([N+](=O)[O-])cc1OCc1cscn1 509151736 CCMGVRCQWQZQMP-UHFFFAOYSA-N 461.927 5.348 5 20 JKBD C[C@@H]1CCCCN1C(=O)c1ccc(NC(=O)CSc2ccc(C(F)(F)F)cc2[N+](=O)[O-])cc1 515697780 XIFDASXFAUVWSF-CQSZACIVSA-N 481.496 5.359 5 20 JKBD O=C(Nc1ccc(Br)cn1)[C@@H]1CCCN(C(=O)c2cc3ccccc3c3cccnc23)C1 515862345 PAHRYQIOQLQZEL-QGZVFWFLSA-N 489.373 5.036 5 20 JKBD CCCn1c(C)cc(-c2csc(NC(=O)c3cc(OCC(F)(F)F)ccc3[N+](=O)[O-])n2)c1C 516070005 CQFDTLGPNMICII-UHFFFAOYSA-N 482.484 5.740 5 20 JKBD O=C(Nc1ccc(CN2C(=O)Cc3ccc(Cl)cc32)cc1)c1ccc([N+](=O)[O-])cc1Cl 520126759 WAQVNEOYMLCZMI-UHFFFAOYSA-N 456.285 5.243 5 20 JKBD CN1CCC(CCNC(=O)c2ccccc2Sc2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 524269855 NTAYMLFWXGGAAZ-UHFFFAOYSA-N 467.513 5.227 5 20 JKBD O=C(Nc1ccc2scnc2c1)c1ccc(C(=O)Nc2ccc3scnc3c2)c([N+](=O)[O-])c1 524352616 NAZBVFAYOMSNCI-UHFFFAOYSA-N 475.511 5.319 5 20 JKBD COc1cc(C(=O)Nc2ncc(Cl)cc2Cl)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 585715275 JWAVQWJLRBEJRK-UHFFFAOYSA-N 468.680 6.003 5 20 JKBD O=C(c1cc([N+](=O)[O-])ccc1NCc1ccccc1)N1C[C@H]2CC[C@H]1[C@@H]1CN(Cc3ccccc3)C[C@@H]21 594657582 HBHALSFEFPWVFU-HCHRDEHUSA-N 496.611 5.190 5 20 JKBD C[C@@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)N[C@H](C)c1ccc(NC(=O)c2ccc(F)cc2)cc1 604443826 QHTFAMPJJWYBOS-HUUCEWRRSA-N 485.899 5.284 5 20 JKBD C[C@H](NC(=O)[C@@H](C)Oc1ccc(Cl)cc1[N+](=O)[O-])c1ccc(NC(=O)Nc2ccccc2)cc1 604446129 DVIMBDKVJDYGIF-JKSUJKDBSA-N 482.924 5.537 5 20 JKBD C[C@@H](Nc1ccc(NC(=O)CCNC(=O)c2ccc([N+](=O)[O-])cc2)cc1Cl)c1ccccc1 604512907 DIVUYXWYAKQRNZ-MRXNPFEDSA-N 466.925 5.180 5 20 JKBD Cc1csc(Sc2ccc(C(=O)N(C)C[C@H]3CCCO[C@H]3c3ccccc3)cc2[N+](=O)[O-])n1 604519101 JUTAXGDPNILWQR-KNQAVFIVSA-N 483.615 5.751 5 20 JKBD CCN(CCC(F)(F)F)C(=O)C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1 604524159 XQDNACXGOMTDMA-SSZFMOIBSA-N 463.481 5.936 5 20 JKBD CCOc1cc(CN[C@H](C)c2ccc(C)s2)ccc1OCc1cc([N+](=O)[O-])cc2c1OCOC2 725846399 HSMGITMFDQAJAI-QGZVFWFLSA-N 484.574 5.660 5 20 JKBD COc1ccc(CNc2cc([N+](=O)[O-])c(OC)c(Br)c2[N+](=O)[O-])cc1OC1CCCC1 728569174 OZIUMAHSNBYDJL-UHFFFAOYSA-N 496.314 5.216 5 20 JKBD COc1cc(/C=C(/Cl)c2nc(O)c3c(-c4ccccc4Cl)csc3n2)cc([N+](=O)[O-])c1O 747150133 APXRNJPTPQOPJN-MKMNVTDBSA-N 490.324 6.077 5 20 JKBD C[C@H](OC(=O)c1csc(-c2ccc([N+](=O)[O-])cc2)n1)C(=O)N[C@@H](C)c1cccc2ccccc12 747956663 JDRTVFZKBALHBR-HOTGVXAUSA-N 475.526 5.294 5 20 JKBD Cc1ccc(C(=O)COC(=O)c2ccccc2NC(=O)c2ccc([N+](=O)[O-])cc2Cl)c(C)c1 847375018 OVLXVYYVGOIJRD-UHFFFAOYSA-N 466.877 5.157 5 20 JKBD CC(C)N(Cc1nnc(-c2cccc([N+](=O)[O-])c2)o1)C(=O)c1ccc(C2SCCS2)cc1 864244852 QZYVXQBTVYNNMP-UHFFFAOYSA-N 470.576 5.174 5 20 JKBD Cn1cnnc1Sc1ccc(-c2nc(-c3ccccc3OCc3ccccc3)no2)cc1[N+](=O)[O-] 904463438 LKLDOPNJFZWDLX-UHFFFAOYSA-N 486.513 5.171 5 20 JKBD COc1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2N2CCC(C)CC2)cc1OCc1cccnc1 915158342 UHEIDMZMFRZACZ-UHFFFAOYSA-N 476.533 5.066 5 20 JKBD Cc1ccc(S(=O)(=O)Nc2ccc(Cl)cc2)cc1NC(=S)Nc1ccc([N+](=O)[O-])cc1 916115626 BUKYERHKVNISAZ-UHFFFAOYSA-N 476.967 5.166 5 20 JKBD C[C@H](Nc1ccc(C(=O)OCc2csc(Br)c2)cc1[N+](=O)[O-])c1ccccn1 920544385 LYOOEHJIKNYPNC-LBPRGKRZSA-N 462.325 5.344 5 20 JKBD C[C@@H](Nc1ccc(C(=O)OCc2nc(-c3ccc(Cl)cc3)no2)cc1[N+](=O)[O-])c1ccccn1 920548763 SFBYHVIXFUUYLG-CQSZACIVSA-N 479.880 5.223 5 20 JKBD CCN(Cc1ccccc1NC(=O)[C@H](C)Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)OC(C)(C)C 920822664 DAHSGJOCKOLAPR-HNNXBMFYSA-N 477.945 5.411 5 20 JKBD Cc1noc(-c2ccccc2)c1C(=O)NC1(c2ccc(NC(=O)c3ccc([N+](=O)[O-])o3)cc2)CCC1 1785748788 HKBIIKQPJASPEA-UHFFFAOYSA-N 486.484 5.213 5 20 JKBD CN1CCCC[C@@H]1C(=O)Nc1ccc(C2(NC(=O)c3cc4cc([N+](=O)[O-])ccc4s3)CCC2)cc1 1786149414 CCGKDRXGNNNSFS-OAQYLSRUSA-N 492.601 5.042 5 20 JKBD Cc1ccc(CC(=O)NC2(c3ccc(NC(=O)c4nccc5occc45)cc3)CCC2)cc1[N+](=O)[O-] 1788341236 BLJZTRRXMNANQN-UHFFFAOYSA-N 484.512 5.035 5 20 JKBD CCOc1cccc(C(=O)Nc2ccc(C3(NC(=O)/C=C/c4ccc([N+](=O)[O-])o4)CCC3)cc2)c1 1790341126 OTQJOGBBSJLMMD-ACCUITESSA-N 475.501 5.048 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)c3cc4sccc4[nH]3)CCC2)cc1)c1cc(F)cc([N+](=O)[O-])c1 1790697436 JRIXPZJURYGNAJ-UHFFFAOYSA-N 478.505 5.338 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)c3scnc3C3CC3)CCC2)cc1)c1cccc(F)c1[N+](=O)[O-] 1790698000 IYRVDXNMMNQRQR-UHFFFAOYSA-N 480.521 5.129 5 20 JKBD COc1cc(Cl)cc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cc4cc([N+](=O)[O-])ccc4s2)C3)c1 1803766936 OJACFHLPDDXIRM-BCDXTJNWSA-N 499.976 5.037 5 20 JKBD Cc1cc(Cl)ccc1C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cccc(F)c2[N+](=O)[O-])n[nH]1 1821168344 XNGUSLRPLLDZKD-LJQANCHMSA-N 485.903 5.039 5 20 JKBD CCOc1ccsc1C(=O)N1CCCC[C@@H]1C1CCN(C(=O)/C=C/c2ccccc2[N+](=O)[O-])CC1 1823648610 UQRQROHQDARKBA-RQWLHQTBSA-N 497.617 5.002 5 20 JKBD Cc1cccc2cc(C(=O)N3CCCC[C@H]3C3CCN(C(=O)c4ccc([N+](=O)[O-])cc4F)CC3)[nH]c12 1828549409 JSFQGQWEEHRBHG-DEOSSOPVSA-N 492.551 5.071 5 20 JKBD Cc1ccc(C(=O)N2CCC([C@H]3CCCCN3C(=O)c3cc(Cl)cc([N+](=O)[O-])c3C)CC2)nc1C 1830734155 AAXCWABMCHQNFA-HSZRJFAPSA-N 499.011 5.116 5 20 JKBD CC(C)(C)CCCCCC(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2ccc([N+](=O)[O-])[nH]2)CC1 1831578052 VXUFQUFXBXGNLH-OAQYLSRUSA-N 460.619 5.153 5 20 JKBD C[C@@H](OC(=O)c1ccc(COc2ccccc2)cc1)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl 9480464 CVFOQYFCIPGMIA-OAHLLOKOSA-N 454.866 5.011 5 20 JKBD O=C(c1ccccc1)C1CCN(C(=O)c2ccc(NCc3ccccc3Cl)c([N+](=O)[O-])c2)CC1 14410968 TZUMJTVVPGJLNR-UHFFFAOYSA-N 477.948 5.595 5 20 JKBD Cc1ccc(-c2ccsc2C(=O)OCC(=O)Nc2ccc([N+](=O)[O-])cc2C(F)(F)F)cc1 17897798 BTHLSXBBFIBKGI-UHFFFAOYSA-N 464.421 5.446 5 20 JKBD Cc1cc([N+](=O)[O-])ccc1NC(=O)CSc1nnc(-c2ccc(Cl)cc2)n1Cc1ccco1 23600642 BEMJLHIJJKLPGZ-UHFFFAOYSA-N 483.937 5.187 5 20 JKBD Cc1nc(CN2CCN(C(=O)c3cc([N+](=O)[O-])ccc3Sc3ccc(Cl)cc3)CC2)cs1 31258484 NLBWNVYFDAUCOS-UHFFFAOYSA-N 489.022 5.122 5 20 JKBD O=C(CSc1ccccc1C(=O)Nc1ccc([N+](=O)[O-])cc1)NC12CC3CC(CC(C3)C1)C2 57561716 DEUTZOCBUZUECP-UHFFFAOYSA-N 465.575 5.024 5 20 JKBD Cc1nn(Cc2ccc(C(=O)N[C@@H](COc3ccccc3F)c3ccccc3)cc2)c(C)c1[N+](=O)[O-] 69633828 SQIAPNIEKWPUMR-DEOSSOPVSA-N 488.519 5.146 5 20 JKBD CCOc1ccc(-c2noc(CCC(=O)Nc3nc(-c4cccc([N+](=O)[O-])c4)c(C)s3)n2)cc1 195704268 BTGSWCRVLVAXHR-UHFFFAOYSA-N 479.518 5.047 5 20 JKBD C[C@@H](Nc1ccc(C(=O)N(C)c2cccc(OC(F)(F)F)c2)cc1[N+](=O)[O-])c1ccccn1 485507923 CESUKSZQDAQQGC-CQSZACIVSA-N 460.412 5.338 5 20 JKBD Cc1csc(Sc2ccc(C(=O)Nc3ccc(F)cc3Br)cc2[N+](=O)[O-])n1 500095623 GPGJNOKONRTZSC-UHFFFAOYSA-N 468.329 5.665 5 20 JKBD O=[N+]([O-])c1cccc(F)c1CSc1nnc(Cn2cnc3ccccc32)n1-c1ccccc1Cl 504524733 QRMAMEKCAKQCQS-UHFFFAOYSA-N 494.939 5.658 5 20 JKBD Cc1cc(C(=O)Nc2ccc(Cl)c(S(=O)(=O)Nc3ccccc3Cl)c2)cc([N+](=O)[O-])c1 508744056 VZWCWGOAXJITNV-UHFFFAOYSA-N 480.329 5.263 5 20 JKBD C[C@@H](NCc1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1)c1ccc(NC(=O)C2CC2)cc1 512818167 ZXIZGLATFHVTAR-MRXNPFEDSA-N 465.937 6.240 5 20 JKBD CN(Cc1cccc(C(F)(F)F)c1)C(=O)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 521387191 RURAXMDXDSROJP-UHFFFAOYSA-N 489.416 5.507 5 20 JKBD CCCS(=O)(=O)Nc1cccc(NC(=O)c2cc([N+](=O)[O-])ccc2Oc2ccc(OC)cc2)c1C 524468117 NZMONAGEMGIABT-UHFFFAOYSA-N 499.545 5.108 5 20 JKBD COc1ccc(-n2c(SCc3nc(-c4ccc([N+](=O)[O-])cc4)no3)nnc2-c2ccccc2)cc1 603748428 QGBMIEFHNGAJQL-UHFFFAOYSA-N 486.513 5.193 5 20 JKBD COc1ccccc1-c1csc(NC(=O)c2ccc(N3CCC[C@H](C)C3)c([N+](=O)[O-])c2)n1 603880482 CXTFVEKAPJGJOL-HNNXBMFYSA-N 452.536 5.216 5 20 JKBD C[C@H](NC(=O)Nc1cc([N+](=O)[O-])ccc1OC(F)F)c1ccc(NC(=O)c2ccc(F)cc2)cc1 604084723 FMXUAKWKLKIJOU-ZDUSSCGKSA-N 488.422 5.470 5 20 JKBD COc1cc(CN[C@@H](c2ccc(Cl)cc2)c2nccn2C)ccc1OCc1ccc([N+](=O)[O-])cc1 604417858 DTCVSRLELOCLKR-VWLOTQADSA-N 492.963 5.449 5 20 JKBD CC(=O)N(C)c1ccc(NC(=O)c2ccccc2Sc2ccc(C(F)(F)F)cc2[N+](=O)[O-])cc1 604479167 ZLVOATMMSHGJNC-UHFFFAOYSA-N 489.475 6.000 5 20 JKBD Cc1cc([N+](=O)[O-])ccc1C(=O)Nc1cc(OCC(F)(F)F)cc(OCC(F)(F)F)c1 604562142 ADOAWXRIBFQHQR-UHFFFAOYSA-N 452.307 5.038 5 20 JKBD Cc1nn(C)cc1[C@@H](C)NC(=O)c1ccccc1Sc1ccc(C(F)(F)F)cc1[N+](=O)[O-] 609025936 UWIGTKJJBIULLO-GFCCVEGCSA-N 464.469 5.298 5 20 JKBD O=C(Nc1n[nH]c(-c2cccc([N+](=O)[O-])c2)n1)c1sc2cc(C(F)(F)F)ccc2c1Cl 609135780 ONZXAIQERIPMDA-UHFFFAOYSA-N 467.816 5.519 5 20 JKBD C[C@@H](NC(=O)CCC(=O)c1ccc2ccc3cccc4ccc1c2c34)c1ccc(NC(N)=O)cc1 727755583 AXUXFBBLKNRHPJ-QGZVFWFLSA-N 463.537 5.915 5 20 JKBD CCNC(=O)c1ccc(C)c(NC(=O)CCC(=O)c2ccc3ccc4cccc5ccc2c3c45)c1 729261037 SLZOTNMLYANPKC-UHFFFAOYSA-N 462.549 6.244 5 20 JKBD CC(C)N(Cc1nnc(-c2cccc([N+](=O)[O-])c2)o1)C(=O)[C@H]1C[C@@H]1c1cccc2ccccc12 730740504 SCNRAKFPLQDWMQ-PKTZIBPZSA-N 456.502 5.339 5 20 JKBD Cc1c(NC(=O)[C@@H](C)Sc2ncc(-c3ccccc3)n2CC(F)(F)F)cccc1[N+](=O)[O-] 748034614 SQLRYRBVWYCJFA-CQSZACIVSA-N 464.469 5.448 5 20 JKBD CC[C@H](C)C(=O)N1CCC[C@H](C(=O)Nc2cc(Cl)c([N+](=O)[O-])cc2OCc2ccccc2)C1 751062266 FJKNICVFNZZGGO-WMZOPIPTSA-N 473.957 5.050 5 20 JKBD Cc1cccc(C(C)C)c1NC(=O)[C@H](C)OC(=O)c1ccc(N2CCC[C@@H](C)C2)c([N+](=O)[O-])c1 783460930 KNFIOKSFENEFTJ-MJGOQNOKSA-N 467.566 5.447 5 20 JKBD Cc1cccc(C(C)C)c1NC(=O)[C@@H](C)OC(=O)c1ccc(N2CCC[C@H](C)C2)c([N+](=O)[O-])c1 783460931 KNFIOKSFENEFTJ-PKOBYXMFSA-N 467.566 5.447 5 20 JKBD Cc1ccccc1-c1cc(C(=O)O[C@@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2)c2cnn(C(C)C)c2n1 827238256 KFRWWJBXWUOBJJ-KRWDZBQOSA-N 487.516 5.080 5 20 JKBD O=[N+]([O-])c1ccc(/C=C(/Cc2nc(-c3ccc(F)cn3)no2)c2nc3ccccc3s2)cc1 904935080 VYHLCIUCLIMTHK-PTNGSMBKSA-N 459.462 5.572 5 20 JKBD NC(=O)c1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2N2CCC(Cc3ccccc3)CC2)cc1Cl 914731999 MBQIVXSNVFAMFN-UHFFFAOYSA-N 492.963 5.059 5 20 JKBD CCOc1cc([N+](=O)[O-])c(C(=O)O[C@@H](C(=O)Nc2cc(Cl)ccc2Cl)C(C)C)cc1OC 915374256 YYUQXEYXIPAQCB-LJQANCHMSA-N 485.320 5.129 5 20 JKBD O=C(Nc1cccc(CN2CCOC2=O)c1)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1 916078276 UQZKCSFNUZHLGW-UHFFFAOYSA-N 467.865 5.245 5 20 JKBD Cc1ccc[n+](/C(C(=S)Nc2ccccc2C(F)(F)F)=C(/O)c2ccc(C)c([N+](=O)[O-])c2)c1 916202236 ODLBJXHOACBIBY-UHFFFAOYSA-O 474.484 5.841 5 20 JKBD O=[N+]([O-])c1cccc(/C(O)=C(/C(=S)Nc2ccc3ccccc3c2)[n+]2ccc3c(c2)CCCC3)c1 917609668 CVOOVNFWMNLPAD-UHFFFAOYSA-O 482.585 6.238 5 20 JKBD O=C(Cc1csc(-c2cc(Br)cs2)n1)Nc1cc([N+](=O)[O-])c(F)cc1F 917631376 ONTQHFAZUSEAJA-UHFFFAOYSA-N 460.281 5.002 5 20 JKBD C[C@H](OC(=O)c1csc(-c2ccc(Cl)cc2Cl)n1)C(=O)Nc1ccc(F)c([N+](=O)[O-])c1 921226296 WPVZTJHKFZZZFD-VIFPVBQESA-N 484.292 5.348 5 20 JKBD O=C(/C=C/c1ccc([N+](=O)[O-])o1)Nc1ccc(C2(NC(=O)C3(C(F)(F)F)CCC3)CCC2)cc1 1786204709 OHHGIHFOTJPTOH-VQHVLOKHSA-N 477.439 5.068 5 20 JKBD O=C(CSc1ccccc1)Nc1ccc(C2(NC(=O)Cc3cc(F)ccc3[N+](=O)[O-])CCC2)cc1 1787777345 ZCWVWRUXUBNCGI-UHFFFAOYSA-N 493.560 5.203 5 20 JKBD CCCc1onc(C)c1C(=O)NC1(c2ccc(NC(=O)c3ccc([N+](=O)[O-])cc3F)cc2)CCC1 1790621814 IUOVLQXGIYWOMS-UHFFFAOYSA-N 480.496 5.044 5 20 JKBD CC(C)[C@@H](C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(F)cc([N+](=O)[O-])c1)c1ccc(Cl)cc1 1800526338 KYVYRSKBOMZJKT-ADYITMSISA-N 487.959 5.079 5 20 JKBD Cc1c(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cc(F)c(F)c(Cl)c2)C3)cc(Cl)cc1[N+](=O)[O-] 1800713226 IFGXIKWALQJEQU-QDMKHBRRSA-N 498.313 5.054 5 20 JKBD C/C(=C\c1cccs1)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)Cc2ccc(C)c([N+](=O)[O-])c2)CC1 1823718783 PPYFOXPIUGETNR-ZOSFRFIDSA-N 495.645 5.230 5 20 JKBD COc1cc(C(=O)N2CCC([C@@H]3CCCCN3C(=O)c3ccc(Cl)cc3C)CC2)ccc1[N+](=O)[O-] 1823913107 YGFZRMUDGAVBRB-QFIPXVFZSA-N 499.995 5.112 5 20 JKBD O=C(/C=C/C1CCCC1)N1CCC([C@H]2CCCCN2C(=O)Cc2ccc(Cl)cc2[N+](=O)[O-])CC1 1824160314 BWDXSMKQKXJRSM-OXHGWOFKSA-N 488.028 5.157 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)N1CCCC[C@@H]1C1CCN(C(=O)C23CCC(CC2)CC3)CC1 1830728470 CRQGBYOASJJEIL-AHKKLNPASA-N 485.600 5.246 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)N1CCCC[C@@H]1C1CCN(C(=O)[C@]2(F)CCCC=C2F)CC1 1830731493 WKQANLWKIVFRJB-NLFFAJNJSA-N 493.526 5.021 5 20 JKBD C/C=C(/C)C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)CC1 1831061265 QYRNHMNEEZOICL-PXWJFQKQSA-N 455.580 5.009 5 20 JKBD COc1ccc(NC(=O)CSc2nc(-c3cccs3)c(-c3cccs3)[nH]2)c([N+](=O)[O-])c1 9099378 CRVVLOMQDXFGMQ-UHFFFAOYSA-N 472.573 5.514 5 20 JKBD CCn1c(SCC(=O)Nc2c(C)cccc2[N+](=O)[O-])nc2scc(-c3cccs3)c2c1=O 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O=C(Nc1ccccc1)[C@@H]1CCc2ccccc2N1C(=O)c1csc(-c2cccc([N+](=O)[O-])c2)n1 303154968 NPRPIZDDCANRDV-QHCPKHFHSA-N 484.537 5.319 5 20 JKBD NC(=O)[C@H](Sc1nc2ccccc2c2nc3ccccc3n12)c1ccc(Br)cc1 303256250 GUWHODRDGSRZRU-LJQANCHMSA-N 463.360 5.117 5 20 JKBD O=C(Nc1ncc(Cc2cc(C(F)(F)F)cc(C(F)(F)F)c2)s1)c1cc([N+](=O)[O-])c[nH]1 487326048 XIXFXBHUAVKPLE-UHFFFAOYSA-N 464.347 5.260 5 20 JKBD Cc1nc(-c2ccc([C@@H](C)NC(=O)c3ccc(N[C@H](C)c4ccccn4)c([N+](=O)[O-])c3)cc2)cs1 506163485 KJBNUAPVNMBSIN-IAGOWNOFSA-N 487.585 6.086 5 20 JKBD NC(=O)Nc1cccc(CNC(=O)c2ccccc2Sc2ccc(C(F)(F)F)cc2[N+](=O)[O-])c1 512009857 OIWILPGNVRXJQH-UHFFFAOYSA-N 490.463 5.185 5 20 JKBD C[C@@H](COCC(F)(F)F)NC(=O)c1ccccc1Sc1ccc(C(F)(F)F)cc1[N+](=O)[O-] 520066012 PVJWJLGYYWSMAK-NSHDSACASA-N 482.402 5.462 5 20 JKBD CCn1cnnc1-c1ccccc1NC(=O)c1ccc(Sc2nc(C)cs2)c([N+](=O)[O-])c1 521469826 WKMMFVVJQRRLQY-UHFFFAOYSA-N 466.548 5.042 5 20 JKBD CC(C)CCN1Cc2cccc(N[C@@H](C)C(=O)Nc3ccc([N+](=O)[O-])cc3C(F)(F)F)c2C1 524405173 FPWGPHFBBXVUGY-HNNXBMFYSA-N 464.488 5.414 5 20 JKBD COc1cc(C(=O)NCc2ccc3ccccc3n2)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 603638239 CYURLRDGFYCSOF-UHFFFAOYSA-N 463.877 5.527 5 20 JKBD Cc1occc1C(=O)Nc1cc(NC(=O)c2ccc(N3C[C@@H](C)C[C@H](C)C3)c([N+](=O)[O-])c2)ccc1F 603896573 IWMPWVHYLVTUHN-HOTGVXAUSA-N 494.523 5.622 5 20 JKBD Cc1cc(NC(=O)c2cccc(F)c2)sc1C(=O)Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1 603946992 XZMQGPAULUYHAO-UHFFFAOYSA-N 482.518 5.732 5 20 JKBD CSc1ccc(C(=O)Nc2ccc(C(=O)N(C)C3CCCCC3)c(Cl)c2)cc1[N+](=O)[O-] 603982218 AQOJIMQOXDZBFF-UHFFFAOYSA-N 461.971 5.627 5 20 JKBD CCOc1ccc(NC(=O)c2ccccc2C(=O)c2ccc(SC)c([N+](=O)[O-])c2)c(C)c1 604000084 KOUJNHKTJYXTLP-UHFFFAOYSA-N 450.516 5.507 5 20 JKBD C[C@H](NCc1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1)c1ccc(NC(=O)C2CC2)cc1 608835629 GXDJIJYMAXHSQN-IBGZPJMESA-N 481.556 5.647 5 20 JKBD O=[N+]([O-])c1ccc(-c2ccc(CN[C@H]3CCOc4c(Cl)cccc43)o2)c(Br)c1 608836608 XWYSWJFWYZNYJU-SFHVURJKSA-N 463.715 5.884 5 20 JKBD CC[C@H](c1ccccc1)c1nnc(SCc2cc(OC)c(OC(F)F)cc2[N+](=O)[O-])o1 609018823 RRUGOQQYNHQTEQ-CQSZACIVSA-N 451.451 5.422 5 20 JKBD Cc1ccc(/C(O)=C(/C(=S)NCCc2cccs2)[n+]2ccc(C(C)(C)C)cc2)cc1[N+](=O)[O-] 727812129 GMHGLELPVULCIL-UHFFFAOYSA-O 482.651 5.593 5 20 JKBD CC1=C(C(=O)Nc2ccccc2C(F)(F)F)[C@H](c2ccc(C)c([N+](=O)[O-])c2)NC(=S)N1C1CC1 731672023 VYHAYMYYRIADLR-FQEVSTJZSA-N 490.507 5.228 5 20 JKBD O=C(COc1ccc([N+](=O)[O-])c(F)c1)Nc1ccccc1Oc1ncc(Cl)cc1Cl 745765509 AXMNMTYNQZWPFX-UHFFFAOYSA-N 452.225 5.246 5 20 JKBD O=C(Oc1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2Cl)cc1)c1cnn(-c2ccccc2F)c1 746763127 XWAOJAROUCVVRK-UHFFFAOYSA-N 480.839 5.045 5 20 JKBD CC(C)N(Cc1nnc(-c2cccc([N+](=O)[O-])c2)o1)C(=O)c1cc(-c2cccc(Cl)c2)no1 748605624 DYDAYTQQESJTKK-UHFFFAOYSA-N 467.869 5.004 5 20 JKBD COc1cc([C@@H]2NC(=O)c3sc4ccccc4c3N2)ccc1OCc1ccc([N+](=O)[O-])cc1 877853749 KLMJEBGQUNHIIB-QHCPKHFHSA-N 461.499 5.251 5 20 JKBD O=c1c2ccccc2n(Cc2nc(-c3ccc(Oc4ccc(F)cc4)nc3)no2)c2ccccc12 904510776 NRUNOXVKKZWUOE-UHFFFAOYSA-N 464.456 5.579 5 20 JKBD Cc1ccnc2sc(C(=O)Oc3ccc(NC(=O)c4cc([N+](=O)[O-])ccc4Cl)cc3)c(C)c12 914712037 RUWNGNQLUTXPJF-UHFFFAOYSA-N 481.917 5.946 5 20 JKBD CC(C)(C)Cc1noc2nc(C3CC3)cc(C(=O)OCC(=O)Nc3cc([N+](=O)[O-])ccc3Cl)c12 915579249 ZCLMMAHCNHYABV-UHFFFAOYSA-N 486.912 5.046 5 20 JKBD O=c1nc(/C(Cl)=C\c2csc([N+](=O)[O-])c2)[nH]c2c(Br)cc(Br)cc12 917143052 VHNQIQOSPZKKGJ-BCTAIJSYSA-N 491.548 5.155 5 20 JKBD COc1ccc(NC(=O)OC(C)(C)C)c(NC(=O)[C@H](C)Oc2ccc(Cl)cc2[N+](=O)[O-])c1 920819536 ROCBPHIPSWDEDZ-LBPRGKRZSA-N 465.890 5.010 5 20 JKBD O=C(Cn1ncc2ccc([N+](=O)[O-])cc21)Nc1ccc(Oc2ccccc2)cc1C(F)(F)F 921155547 WBSZWSQTDXUIKW-UHFFFAOYSA-N 456.380 5.394 5 20 JKBD CCCc1noc(COC(=O)C/C(=C/c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)n1 926631209 MNUJZQVFVLTHHV-VBKFSLOCSA-N 464.503 5.214 5 20 JKBD CC(F)(F)C(=O)Nc1ccc(C2(NC(=O)c3cc4cc([N+](=O)[O-])ccc4s3)CCC2)cc1 1787935641 VLFPKWRZXHHTQS-UHFFFAOYSA-N 459.474 5.212 5 20 JKBD O=C(NC1(c2ccc(NC(=O)c3ccc([N+](=O)[O-])[nH]3)cc2)CCC1)c1ccc2occ(Cl)c2c1 1790185556 GWFSMHCFQAYOOG-UHFFFAOYSA-N 478.892 5.384 5 20 JKBD COc1ccc(CC(=O)Nc2ccc(C3(NC(=O)[C@@H]4C[C@H]4c4ccccc4)CCC3)cc2)c([N+](=O)[O-])c1 1790572413 ZTRVMYKMWVTEBT-LOSJGSFVSA-N 499.567 5.084 5 20 JKBD CC[C@@H](C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2ccc([N+](=O)[O-])c(OC)c2)CC1)c1ccccc1 1826316640 CQWLCABVZLZVDB-RPWUZVMVSA-N 493.604 5.031 5 20 JKBD CC(C)/C=C/C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)CC1 1831062488 VUJKAPCQHYFWLR-JLXBBBJOSA-N 469.607 5.255 5 20 JKBD O=C(c1ccc(NS(=O)(=O)c2ccc(Cl)c([N+](=O)[O-])c2)cc1)N1CCC[C@@H]1c1ccccc1 9894956 GCMNHRITTDCIBQ-OAQYLSRUSA-N 485.949 5.026 5 20 JKBD C[C@H](OC(=O)Cn1c2ccccc2c(=O)c2ccccc21)C(=O)Nc1ccc(C(C)(C)C)cc1 11277550 DFUYNSBCSJPVSA-SFHVURJKSA-N 456.542 5.023 5 20 JKBD CS(=O)(=O)c1ccc(Cl)c(NC(=O)c2ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])cc2)c1 15910636 ROVCQFKGUABZCA-UHFFFAOYSA-N 481.313 5.350 5 20 JKBD COc1ccc(-c2nnc(SCC(=O)Nc3ccccc3[N+](=O)[O-])n2C2CCCCC2)cc1OC 20791601 XLESPHNIWZDNQY-UHFFFAOYSA-N 497.577 5.107 5 20 JKBD C[C@H](Sc1nc2cc3ccccc3cc2c(=O)n1C)C(=O)Nc1ccc(Cl)cc1Cl 22253178 FLGUHFSZDCVPTF-LBPRGKRZSA-N 458.370 5.513 5 20 JKBD C[C@@H](Sc1nnc(-c2ccccc2)n1Cc1ccc2c(c1)OCO2)c1cccc([N+](=O)[O-])c1 22649827 PDGZCNQBTCBZFB-MRXNPFEDSA-N 460.515 5.484 5 20 JKBD CC(=O)Nc1cccc([C@H](C)N(Cc2ccccc2)C(=O)[C@@H](C)Sc2ccc([N+](=O)[O-])cc2)c1 23193195 JUSXVABBXQVDIT-RBUKOAKNSA-N 477.586 5.824 5 20 JKBD O=C(OCC(=O)N1N=C(c2cc3ccccc3o2)C[C@H]1c1ccco1)c1cc(Cl)ccc1[N+](=O)[O-] 24460681 XBBSTPVZLDKUMQ-IBGZPJMESA-N 493.859 5.122 5 20 JKBD Cc1ccc(-c2csc(NC(=O)CCCc3nc(-c4ccc(F)cc4)no3)n2)cc1[N+](=O)[O-] 106284816 LRFABDPJZWYQTL-UHFFFAOYSA-N 467.482 5.177 5 20 JKBD C[C@@H](Nc1ccc(C(=O)N2CCC(c3nc4ccccc4s3)CC2)cc1[N+](=O)[O-])c1ccccn1 108753109 HRHJWDNZFSQGOB-QGZVFWFLSA-N 487.585 5.792 5 20 JKBD O=C(c1ccc(O)cc1)C1CCN(C(=O)c2ccc(NCc3ccccc3Cl)c([N+](=O)[O-])c2)CC1 115495198 MSLHMYQAWVKZFX-UHFFFAOYSA-N 493.947 5.301 5 20 JKBD O=C(NCc1ccccc1)c1nnc(/C(Cl)=C\c2ccc(-c3ccc([N+](=O)[O-])cc3)o2)s1 209131003 GKBRXQOXYKGPRK-LDADJPATSA-N 466.906 5.373 5 20 JKBD C[C@@H](Nc1ccc(C(=O)NCc2ccccc2CN2CCCC[C@H]2C)cc1[N+](=O)[O-])c1ccccn1 248088902 KXSDHFHINYTUPS-NHCUHLMSSA-N 487.604 5.467 5 20 JKBD Cc1ccc(C(=O)Nc2ccccc2)cc1NC(=O)c1ccc(N2CCC[C@@H](C)C2)c([N+](=O)[O-])c1 483300880 UJWAHYJDBDMCSM-GOSISDBHSA-N 472.545 5.644 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)N2c3ccccc3CC[C@@H]2C(=O)Nc2ccc(C)cc2)cc1SC 483699846 LMUGIWLXFCIHBF-OAQYLSRUSA-N 491.569 5.234 5 20 JKBD COc1cc(CN[C@H](c2ccccc2)c2cccnc2)ccc1OCc1ccc([N+](=O)[O-])cc1 488641175 KRWGZDZVZIYIAO-HHHXNRCGSA-N 455.514 5.457 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Cl)[C@H](c1ccccc1)N1CCC[C@@H](c2nccs2)C1 505250355 CKANWUZCBZVJQF-UZLBHIALSA-N 456.955 5.264 5 20 JKBD COC(=O)c1ccc([N+](=O)[O-])c(OCc2csc(N(C(C)=O)c3ccc(C(F)(F)F)cc3)n2)c1 505858163 BOGDIIZFJDRPRJ-UHFFFAOYSA-N 495.435 5.120 5 20 JKBD C[C@@H](Nc1ccc(C(=O)Nc2cccc(CN3CCCCC3)c2)cc1[N+](=O)[O-])c1ccccn1 506222317 YKBOIBKOIXVKEQ-LJQANCHMSA-N 459.550 5.401 5 20 JKBD O=C(CSCc1coc(-c2ccccc2)n1)N(Cc1ccccc1[N+](=O)[O-])CC(F)(F)F 514569978 PVLRCYILYKDRFJ-UHFFFAOYSA-N 465.453 5.074 5 20 JKBD CCCCc1ccc([C@H](NC(=O)C(=O)Nc2cccc([N+](=O)[O-])c2C)c2cccs2)cc1 515142687 KTIWWJXPEYLOEX-QFIPXVFZSA-N 451.548 5.152 5 20 JKBD COc1cc(C(=O)N[C@H]2CCCc3nc(-c4ccc(F)cc4)sc32)c([N+](=O)[O-])cc1OC(F)F 517854886 PPHDPQODYJJHIQ-AWEZNQCLSA-N 493.463 5.275 5 20 JKBD COCCN(C(=O)[C@H]1C[C@@H]1c1ccccc1C(F)(F)F)c1nc(-c2ccc([N+](=O)[O-])cc2)cs1 589197813 BOHWEWVPLQYZLK-MSOLQXFVSA-N 491.491 5.520 5 20 JKBD C[C@H]1CCCCN1CC(=O)Nc1ccc(F)c(NCc2ccc(C(F)(F)F)cc2[N+](=O)[O-])c1 600857794 SYEHIVDCEIFIQI-AWEZNQCLSA-N 468.451 5.178 5 20 JKBD Cc1nn(Cc2ccc(C(=O)N(Cc3cccc(C(F)(F)F)c3)C(C)C)cc2)c(C)c1[N+](=O)[O-] 603529277 YQXONWAVBIKWDB-UHFFFAOYSA-N 474.483 5.526 5 20 JKBD COc1cc(-c2nnc(SCc3csc([N+](=O)[O-])c3)n2C2CCCCC2)cc(OC)c1OC 603940550 DPBQXHZQKKMZCT-UHFFFAOYSA-N 490.607 5.738 5 20 JKBD Cc1cc(CN(C)C(=O)C2CCN(c3ccccc3[N+](=O)[O-])CC2)cc(C)c1OCC(F)(F)F 604018130 AROXFASMLFKTMZ-UHFFFAOYSA-N 479.499 5.028 5 20 JKBD C[C@@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)Nc1ccc(NC(=O)c2ccc(Cl)cc2)cc1 604445500 LTWTYVOYHGFDNL-CYBMUJFWSA-N 474.300 5.560 5 20 JKBD C[C@H](Nc1ccc(C(=O)Nc2ccc(Cn3cnc4ccccc43)cc2)cc1[N+](=O)[O-])c1ccccn1 604497948 BSWBLNQHUVDRPQ-IBGZPJMESA-N 492.539 5.813 5 20 JKBD O=C1CCCN1Cc1ccccc1CNCc1ccc(-c2ccc([N+](=O)[O-])cc2Br)o1 608836382 RWBDELUFLPUCMP-UHFFFAOYSA-N 484.350 5.030 5 20 JKBD Cc1ccc(C(=O)N2CCC(NC(=O)c3ccc(Oc4ccc(Cl)cc4[N+](=O)[O-])cc3)CC2)cc1 608964366 OGEMASLEBNHHPW-UHFFFAOYSA-N 493.947 5.384 5 20 JKBD C[C@H](OC(=O)c1csc(-c2ccccc2Cl)n1)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl 727563790 IZUWDSCXVVCDTI-JTQLQIEISA-N 466.302 5.209 5 20 JKBD C[C@H](Nc1ccc(C(=O)N2CCC[C@@H]2c2ccccc2C(F)(F)F)cc1[N+](=O)[O-])c1ccccn1 728033404 LMNOBMDGOYQAHP-KSFYIVLOSA-N 484.478 6.159 5 20 JKBD CCOC(=O)c1c(-c2ccc(C)cc2)csc1NC(=O)c1cc(OCC)c(OC)cc1[N+](=O)[O-] 747475908 UDJATEVDNXICOK-UHFFFAOYSA-N 484.530 5.468 5 20 JKBD CNC(=O)c1ccccc1NC(=O)C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1 750885385 PEUYWRFSMMHDSG-VKAVYKQESA-N 472.526 5.134 5 20 JKBD Cc1ccc(-n2nc(C)c(NC(=O)CSc3nc4ccc([N+](=O)[O-])cc4s3)c2C)cc1 787996601 WWZXZHKYHNBMIO-UHFFFAOYSA-N 453.549 5.046 5 20 JKBD O=C1/C(=C/c2ccc(-c3ccccc3[N+](=O)[O-])s2)c2ccccc2C(=O)N1Cc1ccccn1 810199738 BXNKGMNBJUYHEO-PXLXIMEGSA-N 467.506 5.442 5 20 JKBD Cc1noc2nc(-c3ccccc3C(F)(F)F)cc(C(=O)OCC(=O)c3cccc([N+](=O)[O-])c3)c12 813390351 XOWHMXGEQSONLQ-UHFFFAOYSA-N 485.374 5.165 5 20 JKBD O=C(c1cccc(NCc2ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])cc2)c1)N1CCC(CO)CC1 864027253 HJBMIOHDVZBREI-UHFFFAOYSA-N 495.963 5.497 5 20 JKBD CCOc1ccc(N2C(=S)N[C@@H](c3ccc([N+](=O)[O-])cc3)C(C(=O)Nc3ccccc3)=C2C)cc1 916170139 IMQIJENTUIKFMM-DEOSSOPVSA-N 488.569 5.342 5 20 JKBD C[C@@H](c1ccc(Cl)cc1)N(C)C(=O)COC(=O)c1ccc(N[C@H](C)c2ccccn2)c([N+](=O)[O-])c1 920544227 JUBABFMPHCCPMM-SJORKVTESA-N 496.951 5.193 5 20 JKBD CSCC[C@@H](NC(=O)c1ccc(Cl)c([N+](=O)[O-])c1)C(=O)OCc1csc2ccccc12 920824496 SGUUVFASPNJTRI-QGZVFWFLSA-N 478.979 5.058 5 20 JKBD Cc1cccc(Cl)c1C(=O)NC1(c2ccc(NC(=O)c3ccc([N+](=O)[O-])o3)cc2)CCC1 1785751054 LVTSWKHLICCHCE-UHFFFAOYSA-N 453.882 5.211 5 20 JKBD O=C(Cc1cccc([N+](=O)[O-])c1)Nc1ccc(C2(NC(=O)[C@H]3C[C@@H]3c3ccccc3)CCC2)cc1 1785795409 NETGZKQEXJLCCV-RPBOFIJWSA-N 469.541 5.075 5 20 JKBD Cc1ccc2cc(C(=O)NC3(c4ccc(NC(=O)c5cc(C)c([N+](=O)[O-])cn5)cc4)CCC3)ccc2n1 1788766396 KTYMVPYUJVDTLI-UHFFFAOYSA-N 495.539 5.216 5 20 JKBD CCc1cc(C(=O)Nc2ccc(C3(NC(=O)Cc4ccc(C)c([N+](=O)[O-])c4)CCC3)cc2)cc(C)n1 1788839897 VICULIDRNOKIHP-UHFFFAOYSA-N 486.572 5.159 5 20 JKBD Cc1ccc(SCC(=O)Nc2ccc(C3(NC(=O)c4ccc(O)c([N+](=O)[O-])c4)CCC3)cc2)cc1 1789109125 NXPLAQUJDWCWQV-UHFFFAOYSA-N 491.569 5.149 5 20 JKBD CC1=CC[C@@H](C(=O)Nc2ccc(C3(NC(=O)c4cc(F)cc([N+](=O)[O-])c4)CCC3)cc2)CC1 1789114519 HIEMNFPTTFUSJB-QGZVFWFLSA-N 451.498 5.228 5 20 JKBD O=C(NC1(c2ccc(NC(=O)c3ccc([N+](=O)[O-])[nH]3)cc2)CCC1)c1ccc(-c2cccnc2)cc1 1790187297 SDDSIRCLAOCPPS-UHFFFAOYSA-N 481.512 5.046 5 20 JKBD O=C(c1cc(F)cc([N+](=O)[O-])c1)N1CCC([C@@H]2CCCCN2C(=O)c2ccc(Cl)cc2F)CC1 1823898201 AXVOXWYTOISNGT-QFIPXVFZSA-N 491.922 5.074 5 20 JKBD C[C@@H](C(=O)N1CCC([C@H]2CCCCN2C(=O)Cc2ccc(Cl)cc2[N+](=O)[O-])CC1)c1ccccc1 1824157707 BERVBUKLANHEAW-NTKDMRAZSA-N 498.023 5.214 5 20 JKBD CC(C)[C@H](C(=O)N1CCCC[C@@H]1C1CCN(C(=O)Cc2cccc([N+](=O)[O-])c2)CC1)c1ccccc1 1824236881 YEJZPVOLVHLDRG-IAPPQJPRSA-N 491.632 5.197 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)N1CCCC[C@H]1C1CCN(C(=O)C[C@H]2C[C@@H]3CC[C@H]2C3)CC1 1830729038 IVARUTZDQGOQTR-QUFILJBYSA-N 485.600 5.102 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2ccc3cc[nH]c3c2)CC1 1830730029 SXRLMUAWHWWMHH-XMMPIXPASA-N 492.551 5.071 5 20 JKBD CCCCC[C@H](C)C(=O)N1CCC([C@@H]2CCCCN2C(=O)Cc2cc(F)ccc2[N+](=O)[O-])CC1 1832889353 WACFMTHKHLVKPF-CVDCTZTESA-N 475.605 5.113 5 20 JKBD O=C(c1cc(Cl)ccc1F)N1CCC([C@@H]2CCCCN2C(=O)/C=C/c2ccccc2[N+](=O)[O-])CC1 1832901404 SUDWCLPMXQEAON-HDFUYHJRSA-N 499.970 5.334 5 20 JKBD COc1ccc(Cl)cc1NC(=O)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 15419125 ZKEVNKMAGQNQGS-UHFFFAOYSA-N 457.836 5.131 5 20 JKBD C[C@@H](OC(=O)c1ccc(SC(F)(F)F)cc1)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 18656631 GLIUMZILXTZDPX-SECBINFHSA-N 482.358 5.410 5 20 JKBD C[C@@H](Sc1nc2ccccc2n1C(F)F)C(=O)Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1 25980083 MXPMOHOWEIBUQP-LLVKDONJSA-N 475.502 5.582 5 20 JKBD CSc1ccccc1NC(=O)CN(C)C(=O)c1ccc(SCCC(C)C)c([N+](=O)[O-])c1 31547074 VNVUODMHNVXUEO-UHFFFAOYSA-N 461.609 5.166 5 20 JKBD CCN(CC(=O)Nc1ccccc1C(F)(F)F)C(=O)c1cc([N+](=O)[O-])ccc1Oc1ccccc1 69640830 YGEYTUXBQCGQIZ-UHFFFAOYSA-N 487.434 5.507 5 20 JKBD C[C@@H](Sc1ncnc2cc(-c3ccc(F)cc3)sc12)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 69887867 IDCZOTVDOPDCRR-GFCCVEGCSA-N 479.518 6.309 5 20 JKBD C[C@@H]1CCC[C@H](OCc2cccc(NC(=O)Cn3c4ccccc4c(=O)c4ccccc43)c2)C1 72046317 DOVKSVGTSUSCSL-OFNKIYASSA-N 454.570 5.889 5 20 JKBD CCN(C(=O)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1)[C@H](C)c1cccc(OC)c1 105908274 ZNGGJFKSOPHWOG-MRXNPFEDSA-N 479.499 5.448 5 20 JKBD Cc1cc(Oc2ncccn2)ccc1NC(=O)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1 109179672 WASZCECJJJEMNE-UHFFFAOYSA-N 476.876 6.184 5 20 JKBD O=C(Cn1c2ccccc2c(=O)c2ccccc21)NCc1ccccc1COCc1ccccc1 480259876 TZXJBTURKHWEST-UHFFFAOYSA-N 462.549 5.188 5 20 JKBD CCOc1cc(C(=O)N[C@@H](C)c2ccc(NC(=O)Nc3ccccc3)cc2)c([N+](=O)[O-])cc1OC 480773077 DVNANSXNXGMWTE-INIZCTEOSA-N 478.505 5.137 5 20 JKBD COc1cc(C(=O)Nc2ccc(Oc3cccc(Cl)c3)cc2)c([N+](=O)[O-])cc1OC(F)F 489716249 OGVTZSGFZKOIBF-UHFFFAOYSA-N 464.808 5.903 5 20 JKBD Cc1nn(Cc2ccc(C(=O)N(C)[C@@H](C)c3ccc(C(F)(F)F)cc3)cc2)c(C)c1[N+](=O)[O-] 498943982 QPGALCMUQXVBDY-HNNXBMFYSA-N 460.456 5.308 5 20 JKBD O=C(Nc1ccc(CNc2ccc(C(=O)c3ccccc3)cc2[N+](=O)[O-])cc1)c1cccnc1 500540173 RDWYDVSCOPXFAY-UHFFFAOYSA-N 452.470 5.085 5 20 JKBD CC1CCN(c2ccc(C(=O)Nc3ccc(Sc4nncn4C)c(Cl)c3)cc2[N+](=O)[O-])CC1 502087595 IQRRLTIBWDHOIW-UHFFFAOYSA-N 486.985 5.017 5 20 JKBD COc1ccc(-c2csc(NC(=O)c3ccc(N[C@H](C)c4ccccn4)c([N+](=O)[O-])c3)n2)cc1 506233205 DSERCTFBDXQOBN-OAHLLOKOSA-N 475.530 5.547 5 20 JKBD Cc1csc(Sc2ccc(C(=O)Nc3c(C)cccc3C(=O)N3CCCC3)cc2[N+](=O)[O-])n1 512347958 RSBGVUWUAGYERW-UHFFFAOYSA-N 482.587 5.308 5 20 JKBD CC(C)OCc1ccc(N[C@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2ccccc2)cc1 513209405 IOIJYJLGCVVKHY-QHCPKHFHSA-N 453.926 5.965 5 20 JKBD O=C(Cc1csc2nc(-c3ccccc3)cn12)Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1 514853266 LXVILLFWICLGOS-UHFFFAOYSA-N 461.528 5.276 5 20 JKBD O=[N+]([O-])c1cc(Br)ccc1Sc1nnc(-c2cccnc2)n1Cc1ccccc1 524161614 GSEOPFGZGUTCFN-UHFFFAOYSA-N 468.336 5.210 5 20 JKBD COc1ccc(CNc2ccc(N=S3(=O)CCCC3)cc2)cc1OCc1ccc([N+](=O)[O-])cc1 600852298 SJPGTEHILRZLCE-UHFFFAOYSA-N 481.574 5.688 5 20 JKBD O=C1c2ccccc2N[C@H](c2csc(-c3cccc([N+](=O)[O-])c3)n2)N1c1ccc2c(c1)OCO2 602762696 YYQHUENCTPIKLE-QFIPXVFZSA-N 472.482 5.218 5 20 JKBD O=C(NCCCSc1ccccc1)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 603470578 YFOCZZHJLLAHLL-UHFFFAOYSA-N 467.513 5.129 5 20 JKBD CCOc1cc(C(=O)Nc2ccc(O[C@H](C)c3ccccc3)cc2C)c([N+](=O)[O-])cc1OC 609066325 CVQHPUBGFQUSIC-QGZVFWFLSA-N 450.491 5.703 5 20 JKBD C[C@@H](Nc1ccc(NC(=O)c2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)cc1Cl)c1ccccc1 609072658 XHDACOJTGGMTCQ-MRXNPFEDSA-N 475.936 6.074 5 20 JKBD C[C@H](NC(=O)N[C@H]1c2cc(Br)ccc2SC[C@H]1C)c1cccc([N+](=O)[O-])c1 609199866 RQFHEMNVNPCWKJ-FTLABTOESA-N 450.358 5.201 5 20 JKBD COc1cccc(C2(CN[C@H](C)C(=O)Nc3ccc([N+](=O)[O-])cc3C(F)(F)F)CCCC2)c1 609387707 HZAQCKNNOKHUFF-OAHLLOKOSA-N 465.472 5.051 5 20 JKBD CC(C)N(Cc1nnc(-c2cccc([N+](=O)[O-])c2)o1)C(=O)c1cc2sc3ccccc3c2s1 728083634 KTUNMWAAXKWORG-UHFFFAOYSA-N 478.555 6.125 5 20 JKBD CCCS(=O)(=O)c1ccccc1S[C@H](C)C(=O)OCc1nc2ccccc2c2ccccc12 730628887 YEJZRDASVBIVLT-GOSISDBHSA-N 479.623 5.796 5 20 JKBD C[C@@H](OC(=O)Cc1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1)c1nc(-c2ccccc2)no1 762299600 KLPFOUWYHAKKHK-GOSISDBHSA-N 495.495 5.344 5 20 JKBD O=[N+]([O-])c1ccc(/C=C\Sc2nnc(CN3CCCCC3)n2-c2ccc(OC(F)F)cc2)o1 913712753 XRYJBCLXXDIXSV-RAXLEYEMSA-N 477.493 5.119 5 20 JKBD CC(C)c1noc([C@H](C)OC(=O)C/C(=C/c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)n1 914897251 GHMPINJDCAQQFL-ZKMNFCBKSA-N 478.530 5.946 5 20 JKBD COc1ccc(Oc2ccc([N+](=O)[O-])cc2C(=O)OCc2nnc(-c3ccc(C)cc3)o2)cc1 915249281 IKLCCQXDLWOFPF-UHFFFAOYSA-N 461.430 5.111 5 20 JKBD Cc1ccc(NC(=O)[C@H](OC(=O)c2nc(-c3cccs3)oc2C)c2ccccc2)c([N+](=O)[O-])c1 915565649 WZHNCXXEAYHHPB-OAQYLSRUSA-N 477.498 5.465 5 20 JKBD Cc1ccc(NC(=O)[C@H](OC(=O)c2cc(-c3ccccc3)no2)c2ccccc2)c([N+](=O)[O-])c1 919188428 ZQWGMPUFXHNYRC-HSZRJFAPSA-N 457.442 5.095 5 20 JKBD COc1cc(C(=O)NC[C@H]2CCCC[C@H]2C(C)(C)C)c([N+](=O)[O-])cc1OCc1cscn1 920042573 ZEWACZIAHYKAGN-CRAIPNDOSA-N 461.584 5.221 5 20 JKBD Cc1nc(-c2ccc(Cl)s2)sc1C(=O)O[C@@H](C)C(=O)Nc1cccc([N+](=O)[O-])c1C 921103787 PQNTVFDTRPFRHA-NSHDSACASA-N 465.940 5.234 5 20 JKBD Cc1nc(-c2ccc(Cl)s2)sc1C(=O)OCC(=O)Nc1ccc([N+](=O)[O-])cc1Cl 921108499 WSBXQXOPIBQKPB-UHFFFAOYSA-N 472.331 5.191 5 20 JKBD CCSc1ncccc1C(=O)Nc1ccc(C2(NC(=O)Cc3cccc([N+](=O)[O-])c3)CCC2)cc1 1785779441 PHIJNPHJBYMPNW-UHFFFAOYSA-N 490.585 5.092 5 20 JKBD Cc1cc2cccc(C(=O)Nc3ccc(C4(NC(=O)c5ccc(O)c([N+](=O)[O-])c5)CCC4)cc3)c2[nH]1 1789019777 XDZFCHAESNWRKO-UHFFFAOYSA-N 484.512 5.152 5 20 JKBD CCOc1ccsc1C(=O)NC1(c2ccc(NC(=O)c3cc([N+](=O)[O-])c(O)cc3C)cc2)CCC1 1790807181 QTCRUOXBMKNDJB-UHFFFAOYSA-N 495.557 5.131 5 20 JKBD CC(C)c1nc(C(=O)NC2(c3ccc(NC(=O)CSc4ccccc4[N+](=O)[O-])cc3)CCC2)co1 1791521541 UDHFRGGRGCKDIP-UHFFFAOYSA-N 494.573 5.246 5 20 JKBD CC(C)[C@H](C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cc3cc([N+](=O)[O-])ccc3s1)C2)c1ccccc1 1793207347 MJEXOEYFOVDOSZ-PDFGSZSQSA-N 491.613 5.501 5 20 JKBD O=C(c1cc2cc([N+](=O)[O-])ccc2s1)N1CCC2(CCCN(C(=O)[C@@H](F)c3ccccc3)C2)CC1 1806524632 QAQDIJOIFIBOTB-QHCPKHFHSA-N 495.576 5.365 5 20 JKBD Cc1csc(C(=O)N2CCCC[C@H]2c2cc(NC(=O)c3cc4cc([N+](=O)[O-])ccc4s3)n[nH]2)c1 1821610971 KFIIQJGIACLBOT-KRWDZBQOSA-N 495.586 5.522 5 20 JKBD Cc1ccc(CC(=O)N2CCC([C@H]3CCCCN3C(=O)c3cccc4ccoc34)CC2)cc1[N+](=O)[O-] 1830990166 AGTNJMZNPZJITG-XMMPIXPASA-N 489.572 5.125 5 20 JKBD Cc1cccc(F)c1C(=O)N1CCCC[C@H]1C1CCN(C(=O)CSc2ccccc2[N+](=O)[O-])CC1 1832550644 DTGDHBQYAMPWLW-NRFANRHFSA-N 499.608 5.068 5 20 JKBD Cc1ccc(C(=O)N2CCCC[C@H]2C2CCN(C(=O)Cc3cccc([N+](=O)[O-])c3)CC2)c(Cl)c1 1832605394 UNUQGFHAEPMAPD-DEOSSOPVSA-N 483.996 5.033 5 20 JKBD O=C(c1ccc([N+](=O)[O-])o1)N1CCC([C@@H]2CCCCN2C(=O)c2cc(Cl)c(Cl)cc2F)CC1 1832712446 BNKYNQLINVAPIF-SFHVURJKSA-N 498.338 5.181 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Br)[C@H](c1ccccc1)N1CCc2sccc2C1 10761952 XLPDJCKTBUIFES-FQEVSTJZSA-N 472.364 5.157 5 20 JKBD CCN1C/C(=C/c2ccc(-c3ccc([N+](=O)[O-])cc3Cl)o2)c2nc3ccccc3c(C(=O)O)c2C1 13343302 SYTRZEORLILPGC-PTNGSMBKSA-N 489.915 6.131 5 20 JKBD Cc1nc(-c2ccc(F)cc2)sc1C(=O)O[C@@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 18018123 KMBRFXKYEBLNFD-NSHDSACASA-N 497.426 5.369 5 20 JKBD C[C@H](OC(=O)c1ccc(Cl)cc1[N+](=O)[O-])C(=O)Nc1ccc(Cl)cc1C(F)(F)F 23445172 MCODQBIGSDKUAY-QMMMGPOBSA-N 451.184 5.104 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Cl)[C@H](c1ccccc1)N1CCO[C@@H](c2ccccc2)C1 29533078 DAQWKRKUAAEULT-PKTZIBPZSA-N 451.910 5.002 5 20 JKBD Cc1cccn2cc(-c3ccc(NC(=O)C4CCN(c5ccccc5[N+](=O)[O-])CC4)cc3)nc12 59020254 DNOSUEJBFGLPIB-UHFFFAOYSA-N 455.518 5.073 5 20 JKBD O=C(CCc1ncc(-c2ccccc2Cl)o1)N(Cc1ccccc1[N+](=O)[O-])CC(F)(F)F 106187791 BWIOMFVHMGHXFN-UHFFFAOYSA-N 467.831 5.427 5 20 JKBD COc1ccccc1C1(CNC(=O)c2ccc(N[C@H](C)c3ccccn3)c([N+](=O)[O-])c2)CCCC1 108821598 MNXLIHJAKRVZIW-LJQANCHMSA-N 474.561 5.413 5 20 JKBD O=C(NCC[C@H]1C(=O)Nc2ccccc21)c1ccc(Sc2nc3ccccc3s2)c([N+](=O)[O-])c1 491107440 CKMPKJCSBMTTIA-MRXNPFEDSA-N 490.566 5.212 5 20 JKBD O=C(c1csc(-c2cccc([N+](=O)[O-])c2)n1)N(Cc1cc(Br)ccc1F)C1CC1 499052852 DPGYPZDXBLEESS-UHFFFAOYSA-N 476.327 5.425 5 20 JKBD C[C@H](Nc1ccc(C(=O)NCCCSc2ccc(F)cc2)cc1[N+](=O)[O-])c1ccccn1 506018281 ZSCFILJTLHFSSG-INIZCTEOSA-N 454.527 5.214 5 20 JKBD O=C(N[C@H](c1ccc(Cl)cc1)c1cccs1)c1ccc([N+](=O)[O-])cc1I 508957629 CCYHPCAFZSNVRC-QGZVFWFLSA-N 498.729 5.434 5 20 JKBD CCOc1ccc(C(=O)Nc2ccc(N(C)C(=O)c3ccc(Cl)cc3)cc2)cc1[N+](=O)[O-] 511603324 AIKRQVULPYAALW-UHFFFAOYSA-N 453.882 5.176 5 20 JKBD CC[C@@H](NC(=O)c1cc(OC)c(OCc2cscn2)cc1[N+](=O)[O-])c1ccc(Cl)cc1 512309740 NPVPZCWUVVCNFA-QGZVFWFLSA-N 461.927 5.173 5 20 JKBD C[C@H](Nc1ccc(C(=O)Nc2cc(-c3ccoc3)nn2-c2ccccc2)cc1[N+](=O)[O-])c1ccccn1 522098361 IUBJOOCGUSIMOC-SFHVURJKSA-N 494.511 5.861 5 20 JKBD O=C(Nc1cc([N+](=O)[O-])ccc1OC(F)F)c1oc2ccccc2c1CSc1cccs1 579134457 UUNCCAZAHCKTPD-UHFFFAOYSA-N 476.482 6.549 5 20 JKBD COC(=O)c1ccc(Cl)c(NC(=O)c2ccccc2C(=O)c2ccc(SC)c([N+](=O)[O-])c2)c1 603447252 VSMWDOUYISDTIX-UHFFFAOYSA-N 484.917 5.240 5 20 JKBD CCOC(=O)c1c(NC(=O)Cc2ccc([N+](=O)[O-])cc2)sc(C(=O)Nc2ccc(C)cc2C)c1C 603466300 DXECMGQMQCWKGZ-UHFFFAOYSA-N 495.557 5.192 5 20 JKBD C[C@@H](c1nc2ccccc2s1)N(C)C(=O)NCCNc1ccc(C(F)(F)F)cc1[N+](=O)[O-] 603748684 OWNJISAMRSDRRG-LBPRGKRZSA-N 467.473 5.038 5 20 JKBD Cc1cc(C)c(-c2csc(NC(=O)c3cc(OCC(F)(F)F)ccc3[N+](=O)[O-])n2)c(C)c1 603832925 MZSZNCPYHBZDKF-UHFFFAOYSA-N 465.453 5.837 5 20 JKBD Cc1c(NC(=O)c2ccccc2)cccc1N[C@@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 603954677 DDCYEEVNRKDBTN-HNNXBMFYSA-N 486.450 5.613 5 20 JKBD CCOc1cc(C(=O)N[C@@H](c2ccc(Br)cc2)C2CCC2)c([N+](=O)[O-])cc1OC 604017783 XUKCHCKNBSPVKU-HXUWFJFHSA-N 463.328 5.036 5 20 JKBD C[C@H](Nc1ccc(C(=O)Nc2cccc(-c3n[nH]c4c3CCCC4)c2)cc1[N+](=O)[O-])c1ccccn1 604335878 BINKLYIHIDMZOK-KRWDZBQOSA-N 482.544 5.684 5 20 JKBD C[C@@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)N[C@H](C)c1cccc(NC(=O)c2ccccc2)c1 604442731 QOOMEGVWTXROAN-HZPDHXFCSA-N 467.909 5.145 5 20 JKBD Cc1ccc(C)c(Oc2ccc(CNc3cnn(-c4ccc([N+](=O)[O-])cc4)c(=O)c3Cl)cn2)c1 608830904 GWFCYYDLSKQATC-UHFFFAOYSA-N 477.908 5.210 5 20 JKBD Cn1ccnc1[C@@H](NCc1ccc(-c2ccc([N+](=O)[O-])cc2Br)o1)c1ccc(F)cc1 608835836 XWBDQAOUZXILDK-NRFANRHFSA-N 485.313 5.369 5 20 JKBD C[C@@H](NCc1ccc(-c2cccc([N+](=O)[O-])c2)o1)c1cccc(NC(=O)Cc2ccccc2F)c1 608836158 MEKSUATVGDQKIY-GOSISDBHSA-N 473.504 6.026 5 20 JKBD CN1C(=O)CCc2cc(NC(=O)c3cc([N+](=O)[O-])ccc3Sc3ccc(Cl)cc3)ccc21 609185993 SAGZGDODDMMWRZ-UHFFFAOYSA-N 467.934 5.561 5 20 JKBD C[C@@H](NC(=O)N(CCCN(C)C)Cc1ccc(Cl)c(Cl)c1)c1cccc([N+](=O)[O-])c1 609211758 SIVHUIHMKHRXQC-OAHLLOKOSA-N 453.370 5.126 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)N[C@@H]2c3cc(Br)ccc3SC[C@@H]2C)cc1SC 609218993 BAQRKUBPBVEPCW-YPMLDQLKSA-N 483.409 5.301 5 20 JKBD O=C(Nc1cc2c(cc1Cl)OCCO2)c1ccc(NCc2ccccc2Cl)c([N+](=O)[O-])c1 619216601 UVWYQHRIZGVVDJ-UHFFFAOYSA-N 474.300 5.537 5 20 JKBD Cc1ccc(-c2csc(NC(=O)c3ccccc3OCc3cscn3)n2)cc1[N+](=O)[O-] 619729609 IHUQWFJXOSMXKQ-UHFFFAOYSA-N 452.517 5.315 5 20 JKBD O=C1CCCN1c1ccc(CNCc2ccc(-c3ccc([N+](=O)[O-])cc3Br)o2)cc1 726607236 KKZPLBPHWLRNKR-UHFFFAOYSA-N 470.323 5.034 5 20 JKBD O=C(Nc1ccc(N2C(=O)c3ccccc3C2=O)cc1)c1cc([N+](=O)[O-])ccc1Sc1ccccc1 728479645 RVLJXANNTZWQOH-UHFFFAOYSA-N 495.516 5.799 5 20 JKBD Cc1ccc(-c2csc(NC(=O)c3csc(-c4ccc([N+](=O)[O-])cc4)n3)n2)cc1[N+](=O)[O-] 747634172 GVEWLKCWQNRTIN-UHFFFAOYSA-N 467.488 5.311 5 20 JKBD CS(=O)(=O)c1ccc(S[C@@H](C(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)c2ccccc2)cc1 749751684 KKJZRKBYZNPVGB-HXUWFJFHSA-N 476.963 5.124 5 20 JKBD COC(=O)c1cc(C(=O)OCC(=O)N2c3ccccc3Sc3ccc(Cl)cc32)cc([N+](=O)[O-])c1 753974687 ZAQUJOOOUBQKQR-UHFFFAOYSA-N 498.900 5.021 5 20 JKBD COc1ccc(C23C[C@H]4C[C@@H](CC(C(=O)OCc5cc([N+](=O)[O-])cc6c5OCOC6)(C4)C2)C3)cc1 762618241 WNHQFDGCHVDKJD-HVRNZWLGSA-N 479.529 5.051 5 20 JKBD CCOc1cc([N+](=O)[O-])c(-c2nc(-c3ccc(Cn4cnc5ccccc54)cc3)no2)cc1OC 904475952 MEKCAWHEEXRQDT-UHFFFAOYSA-N 471.473 5.117 5 20 JKBD COc1cc(/C=C2\C(=O)Nc3cc(Cl)c([N+](=O)[O-])cc32)cc(Br)c1OC(F)F 917145165 LDYJKSRTLMNUBT-MBXJOHMKSA-N 475.629 5.113 5 20 JKBD CCn1c(-c2cccs2)nn(CN(Cc2ccccc2[N+](=O)[O-])CC(F)(F)F)c1=S 917450700 NPHMZYDVQLRVPH-UHFFFAOYSA-N 457.503 5.093 5 20 JKBD COc1cc(/C=C/C(=O)O[C@@H](C)c2ccc([N+](=O)[O-])cc2)ccc1OCc1c(C)noc1C 920155038 GZCYFYCXCHRWGB-JCSUNJAGSA-N 452.463 5.105 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)c3c(F)cccc3Cl)CCC2)cc1)c1ccc([N+](=O)[O-])o1 1785749672 HPTHLSUCBCJCQV-UHFFFAOYSA-N 457.845 5.042 5 20 JKBD Cc1ccc(C(=O)Nc2ccc(C3(NC(=O)c4ccc([N+](=O)[O-])o4)CCC3)cc2)cc1Cl 1785946204 MKTHXMJAEOQNCF-UHFFFAOYSA-N 453.882 5.211 5 20 JKBD COc1ccc([C@H](C)C(=O)Nc2ccc(C3(NC(=O)/C=C/c4ccc([N+](=O)[O-])o4)CCC3)cc2)cc1 1786036727 YIZWWTHSKPIEIJ-SZEUEKNRSA-N 489.528 5.147 5 20 JKBD Cc1ccc(CC(=O)NC2(c3ccc(NC(=O)Cc4ccc(Cl)cc4[N+](=O)[O-])cc3)CCC2)o1 1786116099 WPJFHSGMHRNNML-UHFFFAOYSA-N 481.936 5.069 5 20 JKBD O=C(NC1(c2ccc(NC(=O)[C@@H]3[C@@H]4C=CS[C@@H]34)cc2)CCC1)c1cc2cc([N+](=O)[O-])ccc2s1 1791093685 QFWUBXPEGRRQOM-VLCRHTCISA-N 491.594 5.432 5 20 JKBD Cc1c(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cc3sccc3s2)cc(Cl)cc1[N+](=O)[O-] 1798032608 DBEXUKZYPSYGOY-QDMKHBRRSA-N 490.006 5.398 5 20 JKBD Cc1c(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)[C@@H](c2ccccc2)C(C)C)C3)cc(Cl)cc1[N+](=O)[O-] 1800713083 PDLWNYKMFROHNM-OOICKAIWSA-N 483.996 5.248 5 20 JKBD CCC[C@H]1CC[C@H](C(=O)N2CC[C@@H](CNC(=O)c3ccc([N+](=O)[O-])cc3F)[C@H]2c2cccnc2)CC1 1810747652 WCOJFQSRYICZQY-SHNDDRJUSA-N 496.583 5.055 5 20 JKBD Cc1ccsc1C(=O)N1CCC([C@H]2CCCCN2C(=O)Cc2ccc(Cl)cc2[N+](=O)[O-])CC1 1824160134 DMWSYNZNJBNWQN-HXUWFJFHSA-N 490.025 5.094 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2sccc2Cl)CC1 1829448896 YDAVSWXXRCGYSA-IBGZPJMESA-N 493.988 5.304 5 20 JKBD O=C(COC(=O)CCc1ncc(-c2ccc(Cl)cc2Cl)o1)Nc1cc(Cl)ccc1[N+](=O)[O-] 12271965 IRJBIDYJFFTUIN-UHFFFAOYSA-N 498.706 5.325 5 20 JKBD COc1ccc(NC(=O)c2ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])c(OC)c2)cc1OC 17123587 ODGFTUOLOVWERR-UHFFFAOYSA-N 458.854 5.319 5 20 JKBD Cc1nc(COc2ccc(Cl)cc2)sc1C(=O)OCC(=O)Nc1cc(Cl)ccc1[N+](=O)[O-] 17733510 CDIZTPOEPYIFSY-UHFFFAOYSA-N 496.328 5.041 5 20 JKBD CCn1c(S[C@H](C)C(=O)Nc2cc([N+](=O)[O-])ccc2OC)nnc1-c1ccc(C(C)(C)C)cc1 23554472 NFPFRNXOARZHBD-OAHLLOKOSA-N 483.594 5.299 5 20 JKBD Cc1cc([N+](=O)[O-])ccc1NC(=O)CCSc1nnc(-c2cccs2)n1-c1ccccc1 26363021 IAEPEMMEWFFRPK-UHFFFAOYSA-N 465.560 5.333 5 20 JKBD COc1cc(C(=O)Nc2cccc(NC(=O)C3CC3)c2)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 105831268 UMIKZXCKQYSRMT-UHFFFAOYSA-N 481.892 5.650 5 20 JKBD Cc1cc(C)n(-c2ccc(CNC(=O)c3ccc(Oc4ccc(Cl)cc4[N+](=O)[O-])cc3)cn2)n1 107967696 VONMGASGJKHBFQ-UHFFFAOYSA-N 477.908 5.168 5 20 JKBD COc1cc(C(=O)Nc2ccc(CCN(C)C)cc2)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 110867068 OQNMATRDTUGKDV-UHFFFAOYSA-N 469.925 5.406 5 20 JKBD CC1CCN(c2ccc(C(=O)Nc3ccccc3NC(=O)C[C@H]3C=CCC3)cc2[N+](=O)[O-])CC1 409980128 NQJFELNAHUHHDD-IBGZPJMESA-N 462.550 5.378 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)NCc2nc(-c3ccc(Cl)cc3)c(C)s2)cc1SC 486688897 OXTNIQFRNLLZGN-UHFFFAOYSA-N 463.968 5.341 5 20 JKBD O=C(Nc1ncc(Cc2ccc(F)c(F)c2)s1)c1csc(-c2ccc([N+](=O)[O-])cc2)n1 496355267 CXFPLPSWYARIAN-UHFFFAOYSA-N 458.471 5.296 5 20 JKBD Cc1c(NC(=O)c2cc([N+](=O)[O-])ccc2Sc2ccccc2)cccc1C(=O)Nc1ccccc1 498476419 IHYATDGKOAQHJJ-UHFFFAOYSA-N 483.549 6.559 5 20 JKBD CCN(C(=O)c1cc(OC)ccc1[N+](=O)[O-])[C@@H]1CCSc2ccc(Br)cc21 504606346 MVSOMUUEJBHZNO-MRXNPFEDSA-N 451.342 5.065 5 20 JKBD O=C(CSc1ccc(C(F)(F)F)cc1[N+](=O)[O-])N[C@H](c1ccccc1)c1nccs1 505048056 LALLOICTLPNKCS-QGZVFWFLSA-N 453.467 5.068 5 20 JKBD Cc1noc([C@H]2CCCN(C(=O)C/C(=C/c3ccc([N+](=O)[O-])cc3)c3nc4ccccc4s3)C2)n1 509150549 IICOJDGBDKUFRB-UZNZLNSGSA-N 489.557 5.233 5 20 JKBD Cc1cc(C(=O)N2CCCC[C@@H]2C)ccc1NC(=O)N(Cc1ccc([N+](=O)[O-])cc1)C(C)C 509238000 WZNWVAHFWHAYNY-IBGZPJMESA-N 452.555 5.360 5 20 JKBD CC(C)Oc1ccc([N+](=O)[O-])cc1CSc1nnc([C@@H](C)N(C)C)n1-c1ccc(F)cc1 511046122 VEWKIJOMSAUJSY-OAHLLOKOSA-N 459.547 5.017 5 20 JKBD COc1ccc(Oc2cc(CNCc3ccc(-c4ccc(OC)cc4[N+](=O)[O-])o3)ccn2)cc1 518272927 TZCFYWKFQZPWDL-UHFFFAOYSA-N 461.474 5.349 5 20 JKBD COc1cc(C(=O)Nc2nc(-c3cc(Cl)ccc3Cl)cs2)c([N+](=O)[O-])cc1OC(F)F 585702018 JVTJYWHHOXFEEC-UHFFFAOYSA-N 490.271 5.887 5 20 JKBD O=C(Nc1ccc(S(=O)(=O)Nc2ccc(F)c(Cl)c2)cc1)c1ccc(Cl)cc1[N+](=O)[O-] 603937292 GADAQSYLRWMCDO-UHFFFAOYSA-N 484.292 5.094 5 20 JKBD CCn1c(S[C@@H](C)C(=O)N(c2nccs2)C2CCCCC2)nc2cc3ccccc3cc2c1=O 648454324 BZXRVXLQVUWFSR-KRWDZBQOSA-N 492.670 5.873 5 20 JKBD COc1ccc(C[C@@H](NCc2c(Br)cccc2[N+](=O)[O-])c2ccc(OC)cc2)cc1 725841890 QMEBOJRZYVFUCG-JOCHJYFZSA-N 471.351 5.448 5 20 JKBD CC(C)CCSc1ccc(C(=O)N2CC[C@H](CN(C)C(=O)OC(C)(C)C)C2)cc1[N+](=O)[O-] 729386646 BUPSYVXNOWBLAE-QGZVFWFLSA-N 465.616 5.062 5 20 JKBD C[C@H](CO)n1c(C(F)(F)F)nc2cc(NCc3cc([N+](=O)[O-])ccc3C(F)(F)F)ccc21 864039558 GZBIISHJPAUTSV-SNVBAGLBSA-N 462.350 5.148 5 20 JKBD Cc1ccccc1-c1nn(CN(C)Cc2cc([N+](=O)[O-])ccc2Cl)c(=S)n1Cc1ccco1 913059016 ZPHQCYDXVRQJFM-UHFFFAOYSA-N 483.981 5.682 5 20 JKBD O=C(NCc1cccc(COCc2ccccc2)c1)c1ccc(Br)c([N+](=O)[O-])c1 915600458 QAANEKRHNQWAHC-UHFFFAOYSA-N 455.308 5.004 5 20 JKBD Cc1c(-c2ccccc2)oc2c(C(=O)OCc3nc(-c4ccc([N+](=O)[O-])cc4)no3)cccc2c1=O 918803489 RRFRMPAFFVFPTF-UHFFFAOYSA-N 483.436 5.084 5 20 JKBD C[C@@H](Oc1ccc(C(=O)O[C@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)cn1)c1ccccc1 919214992 OLDLSYFZCDZTNK-HZPDHXFCSA-N 460.446 5.098 5 20 JKBD CCOC(=O)N(C)c1ccc(NC(=O)c2ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])cc2)cc1 919863004 XDNUGXHFACNVIA-UHFFFAOYSA-N 469.881 5.886 5 20 JKBD COc1cc2c(cc1OC)CN(Cc1ccccc1NC(=O)c1ccc(Cl)c([N+](=O)[O-])c1)CC2 921284168 BZGBZXDZTZUOHX-UHFFFAOYSA-N 481.936 5.076 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)c3scnc3C3CC3)CCC2)cc1)c1ccc([N+](=O)[O-])cc1F 1790622874 WAPDKDOZDHJWCC-UHFFFAOYSA-N 480.521 5.129 5 20 JKBD CCCCC[C@@H](C)C(=O)N1CCC2(CCCN(C(=O)Cc3ccc(Cl)cc3[N+](=O)[O-])C2)CC1 1805485008 MYZQYELWEVFCIZ-LJQANCHMSA-N 478.033 5.238 5 20 JKBD Cc1cc(Cl)c(Cl)cc1C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2ccc([N+](=O)[O-])o2)[nH]n1 1821336938 RIKRDWGVVBNRTL-MRXNPFEDSA-N 492.319 5.146 5 20 JKBD O=C(Nc1cc([C@@H]2CCCCN2C(=O)CCc2cccc([N+](=O)[O-])c2)[nH]n1)c1ccc2ccoc2c1 1821456125 DOEUZYMVHHISJL-QFIPXVFZSA-N 487.516 5.003 5 20 JKBD O=C(c1ccc([N+](=O)[O-])cc1F)N1CCC([C@H]2CCCCN2C(=O)/C=C/C2CCCCC2)CC1 1830356217 ZNPJZHRDYOSRRC-XJCKULRNSA-N 471.573 5.104 5 20 JKBD Cc1c(C(=O)N2CCCC[C@H]2C2CCN(C(=O)Cc3ccsc3)CC2)cc(Cl)cc1[N+](=O)[O-] 1830736257 UPNRWNKQRDMVAV-NRFANRHFSA-N 490.025 5.094 5 20 JKBD Cc1cc(O)c([N+](=O)[O-])cc1C(=O)N1CCCC[C@@H]1C1CCN(C(=O)C[C@H](C)c2ccccc2)CC1 1830789359 GWYXQORIOSOCAY-YADARESESA-N 493.604 5.036 5 20 JKBD Cc1oc(C(C)(C)C)cc1C(=O)N1CC2(CCCN2C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)C1 1845738761 VKJNHZLARJQNIB-UHFFFAOYSA-N 481.574 5.139 5 20 JKBD O=C(COC(=O)c1c(Cl)ccc(Cl)c1Cl)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 8629013 QIWWVHRCPSUKAT-UHFFFAOYSA-N 471.602 5.369 5 20 JKBD O=C(CSc1ccc(Cl)cc1)Nc1c(Br)cc([N+](=O)[O-])cc1Br 10671179 KNLHOYLVBVVBNX-UHFFFAOYSA-N 480.565 5.504 5 20 JKBD Cc1ccc(NC(=O)[C@@H](Sc2nnc(-c3ccccc3F)n2C)c2ccccc2)c([N+](=O)[O-])c1 22006730 KDHORBGLZNOHCD-NRFANRHFSA-N 477.521 5.310 5 20 JKBD CCCn1c(SCC(=O)Nc2ccc([N+](=O)[O-])cc2Br)nnc1-c1cccc(C)c1 23647807 JGNJRZQJFJWNAE-UHFFFAOYSA-N 490.383 5.065 5 20 JKBD C[C@H](Sc1nnc(CN2CCCCC2)n1-c1ccc(OC(F)F)cc1)c1cccc([N+](=O)[O-])c1 24226727 PCTITQYZXQMFIT-INIZCTEOSA-N 489.548 5.616 5 20 JKBD COc1cc(C(=O)Nc2ccc(C(=O)NC(C)(C)C)cc2)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 31071756 IHFWPFONKUUEAF-UHFFFAOYSA-N 497.935 5.830 5 20 JKBD COc1ccc(Oc2ccc([N+](=O)[O-])cc2C(=O)N2CCC(C(=O)c3ccc(C)cc3C)CC2)cc1 31143335 WCIKPSQRRFELJS-UHFFFAOYSA-N 488.540 5.748 5 20 JKBD CCc1cc(Sc2nnc(Cc3cccs3)n2C2CC2)nc(-c2ccc([N+](=O)[O-])cc2)n1 72018778 JMWYGLRVAPZHKY-UHFFFAOYSA-N 464.576 5.344 5 20 JKBD CCN(C(=O)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1)[C@@H](C)c1cccc(OC)c1 105908272 ZNGGJFKSOPHWOG-INIZCTEOSA-N 479.499 5.448 5 20 JKBD CC[C@H](C)Sc1ccc(NC(=O)c2ccc(Sc3nncn3C)c([N+](=O)[O-])c2)c(C)c1 109642863 XKTJVCJACRBBRZ-AWEZNQCLSA-N 457.581 5.326 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)Nc2nc(-c3cccc(C(F)(F)F)c3)cs2)cc1SC 482503824 LQUATZCGNDZGBT-UHFFFAOYSA-N 469.466 5.720 5 20 JKBD O=C(C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)Nc1ccc2c(c1)CCCC(=O)N2 483866235 LHNVOHAXOQAYAZ-XMHGGMMESA-N 498.564 6.049 5 20 JKBD Cc1cc(Br)ccc1N(C)C(=O)c1ccc(N[C@@H](C)c2ccccn2)c([N+](=O)[O-])c1 510059134 PQBATWYRGQKOCF-HNNXBMFYSA-N 469.339 5.510 5 20 JKBD Cc1ccc(Sc2ccc(C(=O)Nc3ccccc3CN3CCOCC3)cc2[N+](=O)[O-])cc1 511080711 HPJNEIUCTMGHAR-UHFFFAOYSA-N 463.559 5.139 5 20 JKBD O=C(Nc1cc([N+](=O)[O-])ccc1OC(F)F)N1CCC[C@@H]1c1cccc(Br)c1 511541808 UKQSABOCDGNBSZ-OAHLLOKOSA-N 456.243 5.328 5 20 JKBD Cc1cc(=O)c(C(=O)N(CC2CCCCC2)CC2CCCCC2)nn1-c1ccccc1[N+](=O)[O-] 512864549 NRGZEFYGZFJNJT-UHFFFAOYSA-N 466.582 5.052 5 20 JKBD O=C(NCc1ccc([N+](=O)[O-])cc1)N[C@@H](c1ccccc1)c1ccc(Br)cc1F 515747193 OFKCOBJYHIJMFD-FQEVSTJZSA-N 458.287 5.085 5 20 JKBD Cc1cccc(CN(Cc2ccccn2)C(=O)c2ccc(N[C@H](C)c3ccccn3)c([N+](=O)[O-])c2)c1 519087958 FACHRDFWDLPKBQ-OAQYLSRUSA-N 481.556 5.709 5 20 JKBD Cn1ccnc1C(=O)c1ccc(NCc2ccc(-c3nc4ccccc4s3)o2)c([N+](=O)[O-])c1 521499325 LCGNFSXWYPFCNX-UHFFFAOYSA-N 459.487 5.041 5 20 JKBD COC(=O)C[C@@H](NC(=O)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1)c1cccs1 591754490 PRAXKFDNUKUDMF-MRXNPFEDSA-N 460.895 5.136 5 20 JKBD O=C(CSc1nnc(-c2ccc(Cl)cc2)n1Cc1ccccc1)c1ccc([N+](=O)[O-])cc1 592658197 RAUNQSWVYPDLDF-UHFFFAOYSA-N 464.934 5.530 5 20 JKBD Cc1cc(Br)cc(Cl)c1NC(=O)c1ccc(Cn2nc(C)c([N+](=O)[O-])c2C)cc1 603743555 NFRMLEZIQRTSIH-UHFFFAOYSA-N 477.746 5.433 5 20 JKBD O=[N+]([O-])c1ccc(-c2noc(CSc3nnc(-c4ccc(F)cc4)c4ccccc34)n2)cc1 603748421 PTMNGUOHLCNGNA-UHFFFAOYSA-N 459.462 5.686 5 20 JKBD COCCOc1c(Cl)cccc1NC(=O)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1 604465033 YCSSTKLTRVLTLS-UHFFFAOYSA-N 477.300 5.971 5 20 JKBD O=C(C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)NCCc1ccc2c(c1)OCO2 604484973 ZAYYWMAKVNJKCO-CPNJWEJPSA-N 487.537 5.223 5 20 JKBD O=c1c(Cl)c(N[C@@H]2C[C@@H](C(F)(F)F)C[C@@H](C(F)(F)F)C2)cnn1-c1ccc([N+](=O)[O-])cc1 608830584 GNAZAMGZBPCPNK-URLYPYJESA-N 484.784 5.116 5 20 JKBD O=C(CC1CCCC1)NC1CCC(C(=O)Oc2ccc(-c3ccccc3)cc2[N+](=O)[O-])CC1 726327085 VBEYMTPKBKMTBQ-UHFFFAOYSA-N 450.535 5.423 5 20 JKBD O=C1O[C@H](c2ccccc2)Cc2cc(C(=O)N(CC3CC3)c3ccc(Cl)c([N+](=O)[O-])c3)ccc21 728167317 SOPSWOUGLGBOIQ-DEOSSOPVSA-N 476.916 5.759 5 20 JKBD C[C@@H](OC(=O)Cc1csc(-c2ccccc2Cl)n1)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 762248241 YFYMFRUVGWCZLU-GFCCVEGCSA-N 470.894 5.269 5 20 JKBD C[C@H](OC(=O)c1ccc(-c2nc3ccccc3s2)o1)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl 774001699 SOQISOCWRMTAEM-NSHDSACASA-N 471.878 5.302 5 20 JKBD C[C@@H](OC(=O)C1(c2cccc(C(F)(F)F)c2)CCCC1)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 792714281 AZIXKFOZJXOEIX-CQSZACIVSA-N 475.423 5.780 5 20 JKBD O=C(Cc1ccccc1)Nc1cc(NCc2c(Br)cccc2[N+](=O)[O-])ccc1F 863999803 YWVRIOIWHKKJPP-UHFFFAOYSA-N 458.287 5.290 5 20 JKBD CCc1cccc[n+]1/C(C(=S)Nc1cccc(NC(C)=O)c1)=C(/O)c1ccc(C)c([N+](=O)[O-])c1 913141219 IBLQKVBSCNURRN-UHFFFAOYSA-O 477.566 5.035 5 20 JKBD O=C(Nc1cc2c(cc1Br)OCCO2)c1cc([N+](=O)[O-])ccc1Oc1ccccc1 915822550 MWHCJGBIGSVVHO-UHFFFAOYSA-N 471.263 5.173 5 20 JKBD CC1=C(C(=O)Nc2cccc(C)c2C)[C@H](c2ccc([N+](=O)[O-])cc2)NC(=S)N1c1ccccc1 916162296 OQBXAMCPBUCEGC-DEOSSOPVSA-N 472.570 5.560 5 20 JKBD O=C(CCc1ccc2ccccc2n1)Oc1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2Cl)cc1 917511208 DYEOMJHGWOMBQV-UHFFFAOYSA-N 475.888 5.587 5 20 JKBD Cc1ccc(/C=C/S(=O)(=O)Oc2ccc(NC(=O)c3cc([N+](=O)[O-])ccc3Cl)cc2)cc1 917868625 VTZOQWCNDYSSHD-OUKQBFOZSA-N 472.906 5.188 5 20 JKBD O=C(Nc1ccccc1SCc1ccccc1)[C@@H]1CC(=O)N(c2ccc(F)c([N+](=O)[O-])c2)C1 918556790 MEOZVACLGXYVEU-QGZVFWFLSA-N 465.506 5.018 5 20 JKBD COCCOc1ccc(N[C@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2ccccc2)cc1Cl 918748097 WGANFNWFTXMVSL-QFIPXVFZSA-N 490.343 5.719 5 20 JKBD C[C@H](Oc1ccc(Cl)c(Cl)c1)C(=O)O[C@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 919443585 RXPDSFNUCHYMQV-ZJUUUORDSA-N 495.237 5.258 5 20 JKBD O=C(CSc1ccccc1[N+](=O)[O-])NC1(c2ccc(NC(=O)c3ccc(Cl)nc3)cc2)CCC1 1785760002 OVZYZBITSVLAPU-UHFFFAOYSA-N 496.976 5.183 5 20 JKBD COc1cc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2ccccc2-c2ccc(C)cc2)C3)ccc1[N+](=O)[O-] 1803821751 JMEFPJWLWDMRMM-NUNAXRQHSA-N 499.567 5.144 5 20 JKBD Cc1ccc(C(=O)N2CCCC3(CCN(C(=O)/C=C/c4ccccc4[N+](=O)[O-])CC3)C2)cc1Cl 1805083424 MGYSZBNDLKIJSE-MDZDMXLPSA-N 481.980 5.115 5 20 JKBD O=C(Nc1cc([C@H]2CCCCN2C(=O)/C=C/c2ccccc2[N+](=O)[O-])[nH]n1)c1ccc(Cl)cc1F 1814583182 KNZJFRUROUZYDP-OGECGYFKSA-N 497.914 5.130 5 20 JKBD Cc1cscc1C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cc3cc([N+](=O)[O-])ccc3s2)n[nH]1 1821609639 JOEXVAPIPUPQGY-SFHVURJKSA-N 495.586 5.522 5 20 JKBD C[C@H](C(=O)Nc1cc([C@H]2CCCCN2C(=O)Cc2ccc(Cl)cc2[N+](=O)[O-])[nH]n1)c1ccccc1 1823492492 XLLHWQCEPLWTGB-HRAATJIYSA-N 495.967 5.010 5 20 JKBD Cc1cc(Cl)cc(C(=O)N2CCC([C@@H]3CCCCN3C(=O)Cc3cccc([N+](=O)[O-])c3)CC2)c1 1823684278 UNHNRFDLNHDCNN-DEOSSOPVSA-N 483.996 5.033 5 20 JKBD Cc1c(C(=O)N2CCCC[C@H]2C2CCN(C(=O)c3ccsc3)CC2)cc(Cl)cc1[N+](=O)[O-] 1830734231 FVZAHSMJRCQRBU-FQEVSTJZSA-N 475.998 5.165 5 20 JKBD CCn1c(SCC(=O)Nc2ccc(F)c([N+](=O)[O-])c2)nnc1-c1ccc(C(C)(C)C)cc1 10177541 BIQCXGNNUWCTGB-UHFFFAOYSA-N 457.531 5.041 5 20 JKBD O=C(COC(=O)c1cc([N+](=O)[O-])ccc1Cl)Nc1c(Cl)c(Cl)cc(Cl)c1Cl 10665397 SLMULGGXNMKQPU-UHFFFAOYSA-N 472.495 5.657 5 20 JKBD C[C@H](Sc1nnc(Cc2cccs2)n1-c1ccccc1)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 17758964 WFILUXKVYQKVPS-HNNXBMFYSA-N 490.570 5.731 5 20 JKBD O=C(NCc1cccc(Cn2ccnc2)c1)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1 24747563 IRTUDTARODZBRJ-UHFFFAOYSA-N 462.893 5.215 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Cl)[C@H](NCc1cccc(CN2CCCC2)c1)c1ccccc1 27024452 ATPBFOBEJCDURN-RUZDIDTESA-N 478.980 5.314 5 20 JKBD O=C(NC1CCN(c2ccc(C(F)(F)F)cn2)CC1)c1cc2ccccc2c2cccnc12 107809444 YLXQALKYKGZIBL-UHFFFAOYSA-N 450.464 5.201 5 20 JKBD C[C@H](Nc1ccc(C(=O)N[C@@H](c2ccccc2)c2ccccn2)cc1[N+](=O)[O-])c1ccccn1 108754781 WAANRSACGNEDQF-BVZFJXPGSA-N 453.502 5.077 5 20 JKBD O=C(Nc1cccc(CN2CCCCC2=O)c1)c1ccc(NCc2ccccc2Cl)c([N+](=O)[O-])c1 109595468 IJBHQUSEAKDCFH-UHFFFAOYSA-N 492.963 5.625 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)Nc2sc3c(c2C(=O)c2ccco2)CC[C@@H](C)C3)cc1SC 482601028 FIGCJYLTKZIXFM-GFCCVEGCSA-N 486.571 5.588 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)Nc2ccc(Sc3nncs3)c(Cl)c2)cc1SC 484422327 BGRHWFNDZDEABX-UHFFFAOYSA-N 468.969 5.234 5 20 JKBD C[C@@H](NC(=O)c1cn(C)nc1-c1ccc([N+](=O)[O-])cc1)c1ccc(OCc2ccc(F)cc2)cc1 485570048 PWOWLJBFITYCDZ-QGZVFWFLSA-N 474.492 5.204 5 20 JKBD C[C@H](Nc1ccc(C(=O)Nc2ccccc2NC(=O)N2CCCC2)cc1[N+](=O)[O-])c1ccccn1 508949055 IGQQCFVLGMCNDX-KRWDZBQOSA-N 474.521 5.043 5 20 JKBD CCCC[C@@H](NC(=O)Nc1ccc([N+](=O)[O-])cc1Cl)C(=O)Nc1cccc(N2CCCC2)c1 510628619 PFCYRPCKDNAUGC-OAQYLSRUSA-N 473.961 5.167 5 20 JKBD O=C(Nc1ccccc1OC[C@H]1CCCCO1)c1cc([N+](=O)[O-])ccc1Sc1ccccc1 511397368 LWXQLHDCOJUDQK-LJQANCHMSA-N 464.543 5.946 5 20 JKBD O=C(N[C@@H](c1ccc(Cl)cc1)c1ccsc1)C1CCN(c2ccccc2[N+](=O)[O-])CC1 512278803 RNSSYJFKUOTWRV-QFIPXVFZSA-N 455.967 5.432 5 20 JKBD COc1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2Sc2ccccc2)cc1N1CCCC1=O 512495527 YIMWDWYFKGOXGO-UHFFFAOYSA-N 463.515 5.134 5 20 JKBD COc1cc(C(=O)Nc2nc(-c3ccc(C)cc3)c(C)s2)c([N+](=O)[O-])cc1OCc1cscn1 512594674 CHLFFCDVNSOWPP-UHFFFAOYSA-N 496.570 5.632 5 20 JKBD Cn1cc(C(=O)NC[C@@H](c2ccccc2)c2c[nH]c3ccccc23)c(-c2ccc([N+](=O)[O-])cc2)n1 516168051 WQURTPZTADZUEG-QFIPXVFZSA-N 465.513 5.039 5 20 JKBD Cn1ccnc1[C@H](NCc1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1)c1cccc(F)c1 518769614 JKQHXDRVHJOQJF-HSZRJFAPSA-N 466.900 5.792 5 20 JKBD C[C@H](c1cccnc1)N(C)C(=O)C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1 520103173 QIKPCTAWPSPLTN-LCJWNIEWSA-N 458.543 5.750 5 20 JKBD Cc1csc(Sc2ccc(C(=O)NCc3ncc(-c4ccccc4)o3)cc2[N+](=O)[O-])n1 520434103 ZWFHGRSDBZYYGL-UHFFFAOYSA-N 452.517 5.096 5 20 JKBD Cc1c(NC(=O)c2ccc(SCCC(C)C)c([N+](=O)[O-])c2)cccc1C(=O)N1CCCC1 522141833 GNPCHTBVGSECNN-UHFFFAOYSA-N 455.580 5.530 5 20 JKBD O=C(C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)NCCCN1CCCCCC1=O 603452315 QVTPPFHALJPAGN-LVZFUZTISA-N 492.601 5.044 5 20 JKBD CCN(Cc1cnn(C)c1)C(=O)c1c2c(nc3ccccc13)/C(=C/c1cccc([N+](=O)[O-])c1)CCC2 604482038 ZEIALYMPHZWFKE-KGENOOAVSA-N 481.556 5.416 5 20 JKBD CCOc1ccc(Oc2ccc(Cl)cc2NC(=O)Cn2cnc(-c3cccc([N+](=O)[O-])c3)n2)cc1 608868230 VEMBJBNIURZGMD-UHFFFAOYSA-N 493.907 5.336 5 20 JKBD C[C@H](NC(=O)Nc1ccc(CNC(=O)c2ccc(Br)cc2)cc1)c1cccc([N+](=O)[O-])c1 609356058 BRABNUDLGNFGLU-HNNXBMFYSA-N 497.349 5.170 5 20 JKBD CCCc1cc[n+](/C(C(=S)Nc2ccc(OC(C)C)cc2)=C(/O)c2ccc(C)c([N+](=O)[O-])c2)cc1 726573950 JUOJGCBDAWPIRI-UHFFFAOYSA-O 492.621 6.254 5 20 JKBD C[C@H](Oc1cc(Cl)cc(Cl)c1)C(=O)O[C@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 727217534 DVKPIPJLYGAPED-ZJUUUORDSA-N 495.237 5.258 5 20 JKBD O=C(OCc1cc([N+](=O)[O-])cc2c1OCOC2)c1csc(-c2ccc(Cl)c(Cl)c2)n1 744604743 ILYPNOQOGHNCKC-UHFFFAOYSA-N 467.286 5.249 5 20 JKBD C[C@H](OC(=O)Cn1ccc2cc([N+](=O)[O-])ccc21)C(=O)N1c2ccccc2Sc2ccccc21 744615442 QZPUOQOIJHBUTM-INIZCTEOSA-N 473.510 5.311 5 20 JKBD COc1ccc([C@H]2CCCCCN2C(=O)COC(=O)c2csc(-c3cccc([N+](=O)[O-])c3)n2)cc1 747954679 CWYNKHPCHUBTIX-JOCHJYFZSA-N 495.557 5.028 5 20 JKBD CCOc1ccc([N+](=O)[O-])cc1C=C(C(=O)Nc1ccccc1C)C(=O)Nc1ccccc1C 748583805 ICOHVTKBQSYNNR-UHFFFAOYSA-N 459.502 5.271 5 20 JKBD O=C(Nc1ccc(Oc2ccncc2)c(Cl)c1)c1cc([N+](=O)[O-])ccc1I 751129939 OKKVWBFGMVMWPU-UHFFFAOYSA-N 495.660 5.292 5 20 JKBD O=C(Nc1ccccc1)C1=S=C(/C(Cl)=C/c2ccc(-c3ccc([N+](=O)[O-])cc3)s2)N=N1 844254029 IGRRWDMKXDNUSX-ATVHPVEESA-N 468.947 6.001 5 20 JKBD C[C@@H](SC1=N/C(=C\c2ccccc2)C(=O)N1c1ccc(F)cc1)C(=O)Nc1ccccc1[N+](=O)[O-] 849191740 RQQDVHCUBLCNMF-KQRQPNSISA-N 490.516 5.238 5 20 JKBD O=[N+]([O-])c1ccc(/C=C(\Cc2nc(COc3ccccc3)no2)c2nc3ccccc3s2)cc1 904306745 LANANCMAGKMDDP-NBVRZTHBSA-N 470.510 5.950 5 20 JKBD COc1ccc(Oc2ccc(Cl)cc2NC(=O)c2cc([N+](=O)[O-])cc([N+](=O)[O-])c2C)cc1 912613243 IQPKBLYAYCLFLH-UHFFFAOYSA-N 457.826 5.518 5 20 JKBD C[C@@H](OC(=O)[C@@H](C)SCc1ncc(-c2ccc(Cl)cc2)o1)C(=O)Nc1cccc([N+](=O)[O-])c1 920673656 MSSYOFUUQLMQFH-ZIAGYGMSSA-N 489.937 5.095 5 20 JKBD Cc1cc(C(=O)OCC(=O)N2c3ccccc3Sc3ccc(Cl)cc32)cc([N+](=O)[O-])c1 920900296 NWEIFUSUYFHONL-UHFFFAOYSA-N 454.891 5.543 5 20 JKBD O=C(Cn1ccc2ccc([N+](=O)[O-])cc21)Nc1ccc(C2(NC(=O)c3sccc3F)CCC2)cc1 1786275350 DQEHFNXCTPALPS-UHFFFAOYSA-N 492.532 5.198 5 20 JKBD COc1cc(C(=O)Nc2ccc(C3(NC(=O)c4ccccc4Cl)CCC3)cc2)c([N+](=O)[O-])cc1O 1790083710 HXZYZWCSEFMJJJ-UHFFFAOYSA-N 495.919 5.024 5 20 JKBD COc1cc(C(=O)NC2(c3ccc(NC(=O)CCC=C(C)C)cc3)CCC2)cc([N+](=O)[O-])c1OC 1790452730 ORBXWEZQRXCMPA-UHFFFAOYSA-N 481.549 5.106 5 20 JKBD COc1cc(C(=O)NC2(c3ccc(NC(=O)C[C@H]4C[C@@H]5CC[C@H]4C5)cc3)CCC2)ccc1[N+](=O)[O-] 1791324034 NVRKHTDIVNXNQL-WSTZPKSXSA-N 477.561 5.177 5 20 JKBD C[C@H](Cc1ccccn1)C(=O)Nc1ccc(C2(NC(=O)/C=C/c3ccccc3[N+](=O)[O-])CCC2)cc1 1791767397 SEAJDQNYMAFDDG-XMUSRXTASA-N 484.556 5.016 5 20 JKBD CC(C)c1ccc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cc4cc([N+](=O)[O-])ccc4s2)C3)cc1 1799711783 GFPRWQDCCBNKNX-WKCHPHFGSA-N 477.586 5.499 5 20 JKBD C[C@]1(C(=O)N2CCC([C@H]3CCCCN3C(=O)Cc3ccc(Cl)cc3[N+](=O)[O-])CC2)CC=CCC1 1824159121 SODXDRCZUGMABV-GJZUVCINSA-N 488.028 5.157 5 20 JKBD CC(C)(C)c1ccc(C(=O)N2CCC([C@@H]3CCCCN3C(=O)/C=C/c3ccc([N+](=O)[O-])o3)CC2)s1 1824275731 BTGAPDXKBNAZMV-OEMHODTASA-N 499.633 5.494 5 20 JKBD Cc1cccc(Cl)c1C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2ccc([N+](=O)[O-])cc2F)CC1 1830595908 OKONOGIGSPPDDF-QFIPXVFZSA-N 487.959 5.243 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)N1CCCC[C@@H]1C1CCN(C(=O)[C@H]2CCc3ccccc32)CC1 1830729765 XDSRABAHQQJBGQ-WIOPSUGQSA-N 493.579 5.006 5 20 JKBD C[C@@H](C(=O)N1CCCC[C@H]1C1CCN(C(=O)/C=C/c2ccccc2[N+](=O)[O-])CC1)c1cccs1 1832147772 OELSTTNIWVOEBM-FYYCGKGUSA-N 481.618 5.093 5 20 JKBD O=C(c1ccc(Cl)s1)N1CCC([C@H]2CCCCN2C(=O)/C=C/c2ccccc2[N+](=O)[O-])CC1 1832902893 CSKXUVKFLFGBIV-UFUQCMIWSA-N 488.009 5.256 5 20 JKBD COc1ccc(-c2nnc(S[C@@H](C(=O)Nc3ccc(C)cc3[N+](=O)[O-])c3ccccc3)o2)cc1 8633410 JTULVNZGBZCEPV-OAQYLSRUSA-N 476.514 5.434 5 20 JKBD Cc1ccc(NC(=O)[C@H](Sc2nc3cc(Cl)cnc3[nH]2)c2ccccc2)c([N+](=O)[O-])c1 9552853 HSKYLVRAIBFKQW-GOSISDBHSA-N 453.911 5.300 5 20 JKBD O=C(Nc1nnc(SCc2c(Cl)cccc2Cl)s1)c1ccc([N+](=O)[O-])cc1Cl 14582287 AVUBPLAZHXFZDV-UHFFFAOYSA-N 475.766 5.951 5 20 JKBD Cc1c(-c2ccccc2)oc2c(C(=O)O[C@H](C)c3nnc(-c4ccc([N+](=O)[O-])cc4)o3)cccc2c1=O 17672517 VVHKMIKVQWAEGQ-MRXNPFEDSA-N 497.463 5.645 5 20 JKBD O=C(COC(=O)c1ccccc1-c1ncc(-c2ccccc2)o1)Nc1cc([N+](=O)[O-])ccc1Cl 19164786 IWEKUTUATWZBEM-UHFFFAOYSA-N 477.860 5.366 5 20 JKBD CCCn1c(C)cc(-c2csc(NC(=O)c3cc(OC)c(OCC)cc3[N+](=O)[O-])n2)c1C 28246514 SEBHDMPXLDKTFO-UHFFFAOYSA-N 458.540 5.206 5 20 JKBD Cc1csc(Sc2ccc(C(=O)NCc3cccc(OCc4ccccn4)c3)cc2[N+](=O)[O-])n1 107639699 MAYRRPJLXAMLNK-UHFFFAOYSA-N 492.582 5.415 5 20 JKBD C[C@H]1CN(c2ccc(NC(=O)CSc3ccc(C(F)(F)F)cc3[N+](=O)[O-])cc2F)C[C@H](C)O1 107963851 XSCSBMLBVXXUOC-STQMWFEESA-N 487.475 5.097 5 20 JKBD O=C(Nc1ccc(C(=O)NCc2ccccn2)c(Cl)c1)c1cc2cc([N+](=O)[O-])ccc2s1 195626400 UVPKZZJGOFDYTN-UHFFFAOYSA-N 466.906 5.040 5 20 JKBD Cc1ccc(C(=O)N2C[C@H](C)C[C@@H](C)C2)cc1NC(=O)[C@@H](C)Sc1ccc([N+](=O)[O-])cc1 195698813 DUZQEWMMHNEZKK-JFIYKMOQSA-N 455.580 5.141 5 20 JKBD Cc1csc(Sc2ccc(C(=O)Nc3ccc(Cn4cccn4)cc3)cc2[N+](=O)[O-])n1 486585989 NBEFIXKVYGSAHB-UHFFFAOYSA-N 451.533 5.008 5 20 JKBD O=C(Cc1csc(-c2ccc(Cl)cc2Cl)n1)Nc1cc2c(cc1[N+](=O)[O-])OCCCO2 488869818 XELYLEJSHYBLJV-UHFFFAOYSA-N 480.329 5.368 5 20 JKBD CC(C)COC1CCN(C(=O)C/C(=C\c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)CC1 490721171 JNCCJBMYJXFGIJ-HMMYKYKNSA-N 479.602 5.799 5 20 JKBD COCCOc1cc([N+](=O)[O-])c(C(=O)Nc2ccc(-c3cc4ccccc4o3)cc2)cc1OC 497192306 XTOHNORZBCWPKI-UHFFFAOYSA-N 462.458 5.294 5 20 JKBD COc1ccc(Oc2ccc([N+](=O)[O-])cc2C(=O)Nc2ccc(C(=O)N3CCCC3)cc2C)cc1 498493064 WJRNXDJEFNFZES-UHFFFAOYSA-N 475.501 5.192 5 20 JKBD O=[N+]([O-])c1ccc(-c2nnc(CSc3nc(-c4cccs4)c(-c4cccs4)[nH]3)o2)cc1 501824230 DOWIQGKINURASL-UHFFFAOYSA-N 467.557 6.117 5 20 JKBD O=C(Nc1nc(-c2cc(Cl)sc2Cl)cs1)c1cc2c(cc1[N+](=O)[O-])OCCO2 503187212 UIHWKLHHIYVCCO-UHFFFAOYSA-N 458.304 5.110 5 20 JKBD O=C(C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)Nc1ccc(-c2nnco2)cc1 511990278 JFHORBPIZBGCPF-QGOAFFKASA-N 483.509 5.824 5 20 JKBD CCc1ccc(OCc2nnc(Sc3ccc([N+](=O)[O-])cn3)n2[C@H](C)c2ccccc2)cc1 512742645 AYAADFWPFOGPFB-QGZVFWFLSA-N 461.547 5.483 5 20 JKBD Cc1ccc(CN2C(=O)c3ccccc3N[C@H]2c2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)cc1 517977051 OMKAJRYOAPKSNQ-RUZDIDTESA-N 453.502 5.070 5 20 JKBD C[C@H]1CCCCN1CCNC(=O)C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1 518044602 ZOSRSJSOCRHUMA-CSRGTXSUSA-N 464.591 5.126 5 20 JKBD C[C@@H](Nc1ccc(NC(=O)CCCn2c(=O)oc3cc([N+](=O)[O-])ccc32)cc1)c1ccccc1 518866120 PFOXVBZRPZGAGR-QGZVFWFLSA-N 460.490 5.095 5 20 JKBD CC[C@@H](C)NC(=O)c1ccc(NC(=O)c2ccc(NCc3ccccc3)c([N+](=O)[O-])c2)c(C)c1 519977763 SRVICJNGQQEHFI-GOSISDBHSA-N 460.534 5.296 5 20 JKBD COc1ccc(-c2cnc(CCC(=O)Nc3nc(-c4ccc(C)c([N+](=O)[O-])c4)cs3)o2)cc1 520081056 APNLVHJWVAAGBX-UHFFFAOYSA-N 464.503 5.262 5 20 JKBD CN(CCCCCc1cc(-c2cccc(F)c2)no1)C(=O)c1cc2cc([N+](=O)[O-])ccc2o1 520111893 IWFBIERTMABCPC-UHFFFAOYSA-N 451.454 5.620 5 20 JKBD Cc1nc(-c2ccc(F)cc2)sc1[C@H](C)NC(=O)c1cn(C)nc1-c1ccc([N+](=O)[O-])cc1 521503658 FLOCAEPOXBHAQA-ZDUSSCGKSA-N 465.510 5.057 5 20 JKBD Cc1ccc(NC(=O)NC[C@@H]2CCCN(C(=O)c3cc4ccccc4c4cccnc34)C2)cc1 590115026 SRYNNVBYTUQRPE-FQEVSTJZSA-N 452.558 5.370 5 20 JKBD C[C@@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccc(NC(=O)c2ccoc2)cc1C(F)(F)F 603761307 DEPRIHWPHGXVJY-GFCCVEGCSA-N 479.436 5.578 5 20 JKBD CSc1ccc(C(=O)c2ccccc2C(=O)Nc2ccc(C(=O)NCC(C)C)cc2)cc1[N+](=O)[O-] 603970301 SWLHDRFKAKYDOH-UHFFFAOYSA-N 491.569 5.186 5 20 JKBD CN1CCN(C(=O)C/C(=C/c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)[C@@H](c2ccccc2)C1 612591605 DJDCEZKCIUALJJ-YPKVGQCMSA-N 498.608 5.651 5 20 JKBD CCOc1cc(NC(=O)c2oc3ccc(CCC(C)=O)cc3c2C)c([N+](=O)[O-])cc1OCC 619212796 WIEOXXYNRIFFCB-UHFFFAOYSA-N 454.479 5.221 5 20 JKBD O=C(Nc1nc(-c2ccccc2OC(F)F)cs1)c1ccc(Br)c([N+](=O)[O-])c1 727715152 LDVAEUQYPOXGGL-UHFFFAOYSA-N 470.251 5.335 5 20 JKBD O=C(Nc1ccccc1-c1cccs1)c1ccc(I)c([N+](=O)[O-])c1 727747888 BRXSZQNPFRAJRY-UHFFFAOYSA-N 450.257 5.180 5 20 JKBD CC(C)(C)OC(=O)Nc1ccc(NCc2nc(-c3cccc([N+](=O)[O-])c3)no2)c(C(F)(F)F)c1 729675898 VYJXAVROZQQHOD-UHFFFAOYSA-N 479.415 5.623 5 20 JKBD C[C@@H](OC(=O)c1cc(-c2ccc(C(F)(F)F)cc2)no1)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 730858794 UQOUOXGGZPQRDI-LLVKDONJSA-N 474.351 5.237 5 20 JKBD Cc1c(NC(=O)[C@H](C)OC(=O)Cc2csc(-c3ccc(Cl)cc3Cl)n2)cccc1[N+](=O)[O-] 747258914 NSPHBRWXPFSJDY-LBPRGKRZSA-N 494.356 5.446 5 20 JKBD Cc1ccc(-c2ncc(C(=O)O[C@@H](C)C(=O)Nc3ccc([N+](=O)[O-])cc3Cl)s2)c(C)c1 747264659 NONLUMHVWKEZHT-ZDUSSCGKSA-N 459.911 5.173 5 20 JKBD C[C@@H](NC(=O)COC(=O)c1csc(-c2ccc([N+](=O)[O-])cc2)n1)c1ccc(Cl)cc1Cl 747956239 PRMDVMAPLHTYIC-LLVKDONJSA-N 480.329 5.059 5 20 JKBD O=C(Nc1nnc(SCc2ccc(Cl)cc2)s1)c1cc([N+](=O)[O-])ccc1Br 751048582 XPZRFBDBPJIXKR-UHFFFAOYSA-N 485.772 5.407 5 20 JKBD Cc1ccc(-c2nnc(COC(=O)c3ccccc3C(=O)c3ccc(Cl)c([N+](=O)[O-])c3)o2)cc1 914885073 UUCJHDWFVGYZIY-UHFFFAOYSA-N 477.860 5.195 5 20 JKBD CC(=O)N(c1ccc(C)cc1)c1nc(COC(=O)c2ccc(C(C)(C)C)c([N+](=O)[O-])c2)cs1 919000961 JEOOOGXGJLEYMB-UHFFFAOYSA-N 467.547 5.699 5 20 JKBD C[C@H](OC(=O)[C@H](C)Sc1ccc(Br)cc1)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl 919468178 JQFYQOKDBKLXCO-QWRGUYRKSA-N 487.759 5.062 5 20 JKBD CC(C)(C)C(=O)N1CCC[C@H](C(=O)Nc2cc(Cl)c([N+](=O)[O-])cc2OCc2ccccc2)C1 920342544 YHYMLXAQQULWRR-KRWDZBQOSA-N 473.957 5.050 5 20 JKBD COc1ccc(Oc2ccc([N+](=O)[O-])cc2C(=O)N2CCc3c(ncn3CCc3ccccc3)C2)cc1 929067950 XHTZNUVYDWBRAM-UHFFFAOYSA-N 498.539 5.033 5 20 JKBD O=C(Cc1cccc([N+](=O)[O-])c1)Nc1ccc(C2(NC(=O)c3cccc4ncccc34)CCC2)cc1 1785791640 IGBRCSMKDJPEAF-UHFFFAOYSA-N 480.524 5.133 5 20 JKBD Cc1cc(C(=O)NC2(c3ccc(NC(=O)CCc4cccc([N+](=O)[O-])c4)cc3)CCC2)c(C)o1 1786601691 MITQJGOZQUJIDQ-UHFFFAOYSA-N 461.518 5.185 5 20 JKBD C[C@H]1CCC[C@H]1C(=O)Nc1ccc(C2(NC(=O)Cn3ccc4ccc([N+](=O)[O-])cc43)CCC2)cc1 1789205341 HXZDDYIROJLAMZ-FDDCHVKYSA-N 474.561 5.120 5 20 JKBD CN(C)c1ccc([N+](=O)[O-])c(C(=O)NC2(c3ccc(NC(=O)c4ccc5ccoc5c4)cc3)CCC2)c1 1790892797 VJMLUKKPDSCRAG-UHFFFAOYSA-N 498.539 5.469 5 20 JKBD Cc1c(C(=O)N2CCC3(CCCN(C(=O)/C=C/c4cccs4)C3)CC2)cc(Cl)cc1[N+](=O)[O-] 1810002382 QDOKQCDCEOBSOC-AATRIKPKSA-N 488.009 5.176 5 20 JKBD CC(C)(C)CCCCCC(=O)NC[C@H]1CCN(C(=O)c2ccc(O)c([N+](=O)[O-])c2)[C@@H]1c1cccnc1 1812809413 QINYRTZIPZVWAP-PXDATVDWSA-N 496.608 5.012 5 20 JKBD CC1(C(=O)N2CCCC[C@H]2c2cc(NC(=O)C3(c4cccc([N+](=O)[O-])c4)CCC3)n[nH]2)CCCC1 1820841976 ZJTRKMJLQSEVGD-NRFANRHFSA-N 479.581 5.012 5 20 JKBD Cc1cc(Cl)ccc1C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cccc(F)c2[N+](=O)[O-])n[nH]1 1821168342 XNGUSLRPLLDZKD-IBGZPJMESA-N 485.903 5.039 5 20 JKBD Cc1ccc(CC(=O)N2CCC([C@H]3CCCCN3C(=O)c3ccc(Cl)s3)CC2)cc1[N+](=O)[O-] 1825856863 LMAMEDYCQJHWIY-LJQANCHMSA-N 490.025 5.094 5 20 JKBD COc1cccc(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3cc(Cl)cc([N+](=O)[O-])c3C)CC2)c1 1829985968 BJKMEPNLCVSWJL-HSZRJFAPSA-N 499.995 5.112 5 20 JKBD O=C(/C=C/C1CCCCC1)N1CCC([C@@H]2CCCCN2C(=O)c2cc(F)cc([N+](=O)[O-])c2)CC1 1830618044 JHGHVSGVISODPE-GTCGAKFVSA-N 471.573 5.104 5 20 JKBD CC1=CC[C@@H](C(=O)N2CCC([C@@H]3CCCCN3C(=O)c3cc4cc([N+](=O)[O-])ccc4s3)CC2)CC1 1831061579 WTFVKRLUQIMTDF-OFNKIYASSA-N 495.645 5.789 5 20 JKBD O=C(c1cc2cc([N+](=O)[O-])ccc2s1)N1CCCC12CN(C(=O)C1(c3ccc(Cl)cc3)CC1)C2 1845739613 TZSMTDWPLKYXDD-UHFFFAOYSA-N 495.988 5.012 5 20 JKBD C[C@@H](OC(=O)c1ccccc1C(=O)c1ccc(Cl)cc1)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl 10662363 DBOGUPFVOKGPLC-CYBMUJFWSA-N 487.295 5.317 5 20 JKBD COc1cccc(NC(=O)[C@H](OC(=O)Cn2c3ccccc3c(=O)c3ccccc32)c2ccccc2)c1 11276475 DHWHGCSTSIRRCM-GDLZYMKVSA-N 492.531 5.087 5 20 JKBD COc1cc(C(=O)NCC(=O)Nc2c(C)cc(C)cc2C)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 17960573 TXYSVCZLAOWPFL-UHFFFAOYSA-N 497.935 5.343 5 20 JKBD COc1ccc([C@@H](C)NC(=O)Cc2cn(-c3ccccc3)nc2-c2ccc([N+](=O)[O-])cc2)cc1F 24208868 DSEQCUBMRBXCDY-QGZVFWFLSA-N 474.492 5.015 5 20 JKBD O=C(C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1)N1CCC[C@H]1Cc1ccccc1 25041424 INKGYUQZUINWMN-FQEVSTJZSA-N 461.484 5.064 5 20 JKBD Cc1nn(Cc2ccc(C(=O)Nc3cccc(NC(=O)Nc4ccccc4)c3)cc2)c(C)c1[N+](=O)[O-] 25092824 OMWIXNCTKJNENK-UHFFFAOYSA-N 484.516 5.353 5 20 JKBD CCn1c(/C(Cl)=C/c2ccc(C(C)C)c([N+](=O)[O-])c2)nc2cc(S(=O)(=O)N(C)C)ccc21 26763158 BUGRVXKXTMEIEC-WQRHYEAKSA-N 476.986 5.075 5 20 JKBD C[C@H](Sc1nc2ccccc2c(=O)n1C1CCCC1)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl 36788028 BEFLNYVMEIWPSS-ZDUSSCGKSA-N 472.954 5.193 5 20 JKBD C[C@@H](Nc1ccc(C(=O)Nc2cc(C(C)(C)C)nn2C(C)(C)C)cc1[N+](=O)[O-])c1ccccn1 110565148 SEFHEOWMAXVXJA-MRXNPFEDSA-N 464.570 5.664 5 20 JKBD Fc1cc2nc3c4nc5cc(F)c(F)cc5nc4c4nc5cc(F)c(F)cc5nc4c3nc2cc1F 118441613 WNGXWBKFNJINFM-UHFFFAOYSA-N 492.342 5.810 5 20 JKBD Cc1cc(O[C@H](C)c2ccccc2)ccc1NC(=O)Cn1c2ccccc2c(=O)c2ccccc21 303210586 QYWUPISXYZKSNU-OAQYLSRUSA-N 462.549 6.242 5 20 JKBD COc1cc(C(=O)Nc2c(F)cccc2Oc2ccccc2)c([N+](=O)[O-])cc1OCc1cscn1 410039276 SLVSCFSLIYITFD-UHFFFAOYSA-N 495.488 5.823 5 20 JKBD C[C@@H](NC(=O)c1ccc(Cl)cc1[N+](=O)[O-])c1cccc(NC(=O)Cc2ccccc2F)c1 483264489 COMCGIMJGRVZJR-CQSZACIVSA-N 455.873 5.060 5 20 JKBD Cc1csc(Sc2ccc(C(=O)Nc3ccnn3Cc3ccc(F)cc3)cc2[N+](=O)[O-])n1 486890256 FYLPWKHNFUVJCO-UHFFFAOYSA-N 469.523 5.147 5 20 JKBD Cn1cc(C(=O)NC[C@H]2CC3c4ccccc4C2c2ccccc23)c(-c2ccc([N+](=O)[O-])cc2)n1 506075050 XQBYOMSLVSMKTO-UEXBFKPASA-N 464.525 5.022 5 20 JKBD Cc1occc1C(=O)Nc1cc(NC(=O)N(Cc2ccc([N+](=O)[O-])cc2)C(C)C)ccc1F 509597661 CFMWKVMZOHRTNF-UHFFFAOYSA-N 454.458 5.330 5 20 JKBD CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)c1cccc(NC(=O)CCCc2cccs2)c1 509731055 VUAITFSECTZWJB-UHFFFAOYSA-N 465.575 5.669 5 20 JKBD Cc1ccccc1C1(CN[C@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2ccccc2)CCOCC1 513183563 MNNXPNYIAQBOTO-VWLOTQADSA-N 493.991 5.574 5 20 JKBD O=C(NCc1nc2cc(Cl)ccc2s1)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 518840634 UAFSTXTVHSNJAR-UHFFFAOYSA-N 498.914 5.410 5 20 JKBD CC(C)C(=O)NC[C@@H]1CCCN(C(=O)c2cc([N+](=O)[O-])ccc2Sc2ccc(Cl)cc2)C1 523839242 JCUCMZDEPOBQTR-INIZCTEOSA-N 475.998 5.024 5 20 JKBD Cc1cnn([C@@H]2CCCc3ccccc32)c1NC(=O)[C@@H](C)Oc1ccc(Cl)cc1[N+](=O)[O-] 524377917 XUJLPVRSOQAFNO-DNVCBOLYSA-N 454.914 5.085 5 20 JKBD CCOC(=O)c1c(NC(=O)c2cc(OC)c(OC)cc2[N+](=O)[O-])sc(-c2ccccc2)c1C 603466338 LSEYSDNYACVNQL-UHFFFAOYSA-N 470.503 5.078 5 20 JKBD O=C(NC1CC1)c1cc(NC(=O)c2cc([N+](=O)[O-])ccc2NCc2ccccc2)ccc1Cl 603970283 PXPKUFGXDPKVCV-UHFFFAOYSA-N 464.909 5.005 5 20 JKBD CCOc1cc([N+](=O)[O-])c(C(=O)Nc2nc(C)c(Cc3ccccc3Cl)s2)cc1OC 603974764 DYZHGISSEZHOAH-UHFFFAOYSA-N 461.927 5.264 5 20 JKBD CC(C)NC(=O)c1ccc(Cl)c(NC(=O)c2ccc(N3C[C@@H](C)C[C@H](C)C3)c([N+](=O)[O-])c2)c1 603975396 YFURPYAIJKODDE-HOTGVXAUSA-N 472.973 5.121 5 20 JKBD O=[N+]([O-])c1cccc(-c2noc(CN[C@H](c3ccccc3)c3ccc(Cl)c(Cl)c3)n2)c1 604011035 RWGCQOPHVWAMAX-OAQYLSRUSA-N 455.301 5.831 5 20 JKBD CC(=O)Nc1cc(N[C@@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2ccccc2)ccc1C 604044849 DMULIFMPEWEDIT-JOCHJYFZSA-N 452.898 5.307 5 20 JKBD CCOc1cc(C(=O)Nc2cc(-c3ccccc3C)nn2Cc2ccccc2)c([N+](=O)[O-])cc1OC 608943418 MFMLAIQKNGQBKJ-UHFFFAOYSA-N 486.528 5.475 5 20 JKBD Cc1nc([N+](=O)[O-])cn1CCC(=O)N[C@H](Cc1ccc(Cl)cc1Cl)c1ccc(F)cc1 609375840 NTLMRDRLZIFAIE-LJQANCHMSA-N 465.312 5.036 5 20 JKBD COc1cc(C(=O)N[C@@H](c2ccc(CC(C)C)cc2)c2cccs2)c([N+](=O)[O-])cc1OC 747657776 XMTGBFGPEYBEGK-QHCPKHFHSA-N 454.548 5.391 5 20 JKBD CCOC(=O)c1c(-c2ccc(Br)cc2)csc1NC(=O)c1cc([N+](=O)[O-])cnc1C 750735430 XEHONXYYDDPOMR-UHFFFAOYSA-N 490.335 5.218 5 20 JKBD CSc1ccc(C(=O)c2ccccc2C(=O)N(C)Cc2cc([N+](=O)[O-])ccc2Cl)cc1[N+](=O)[O-] 772461650 QQFGMSZPHKEARX-UHFFFAOYSA-N 499.932 5.382 5 20 JKBD O=C(c1ccc(CNCc2ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])cc2)cc1)N1CCCC1 822294009 CUBPUJUVUXQZMF-UHFFFAOYSA-N 465.937 5.566 5 20 JKBD O=C(/C=C\c1cc(C(F)(F)F)ccc1Cl)OCc1nnc(-c2ccc([N+](=O)[O-])cc2)o1 825206752 YHXAWRJJBQBONW-BAQGIRSFSA-N 453.760 5.074 5 20 JKBD CC(C)(C)c1noc(COC(=O)C/C(=C/c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)n1 912646224 LDAWTWHRDGQWKV-VBKFSLOCSA-N 478.530 5.559 5 20 JKBD CCOc1ccc(-c2nc(CC(=O)O[C@@H](C)c3nnc(-c4ccc([N+](=O)[O-])cc4)o3)cs2)cc1 914631266 XXPPDXSRIQZGTK-AWEZNQCLSA-N 480.502 5.014 5 20 JKBD CCOc1ccc(-c2nc(C)c(C(=O)O[C@H](C)C(=O)Nc3cc([N+](=O)[O-])ccc3Cl)s2)cc1 914909741 KMGHQLANUKMTTQ-CYBMUJFWSA-N 489.937 5.263 5 20 JKBD CC1=C(C(=O)N(C)C)[C@H](c2ccc(Cl)c([N+](=O)[O-])c2)NC(=S)N1c1ccccc1C(F)(F)F 916166715 FBLFZMUUUTZZNW-SFHVURJKSA-N 498.914 5.065 5 20 JKBD CCC(=O)Nc1cccc(C(=O)O[C@@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2ccccc2)c1 917310746 FGQJLLNDBRYEBX-JOCHJYFZSA-N 481.892 5.134 5 20 JKBD COc1ccc(N[C@@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2)cc1NC(=O)c1ccc(Cl)cc1F 917937048 AECWTRKVYACMFH-ZDUSSCGKSA-N 486.887 5.087 5 20 JKBD COC(=O)c1oc2ccccc2c1COC(=O)c1ccc(N[C@@H](C)c2ccccn2)c([N+](=O)[O-])c1 920549348 XOIMHZZVKVNZIG-HNNXBMFYSA-N 475.457 5.053 5 20 JKBD Cc1ccc(CC(=O)Nc2ccc(C3(NC(=O)c4cc5ccoc5cn4)CCC3)cc2)cc1[N+](=O)[O-] 1790525220 GUEJCLNCMRZORG-UHFFFAOYSA-N 484.512 5.035 5 20 JKBD O=C(/C=C/c1ccccc1[N+](=O)[O-])NC1(c2ccc(NC(=O)c3cccc4ccncc34)cc2)CCC1 1790862063 HVTXKPJTGXCNJG-NTEUORMPSA-N 492.535 5.604 5 20 JKBD O=C(Cc1ccc([N+](=O)[O-])cc1F)Nc1ccc(C2(NC(=O)c3ccc4cnccc4c3)CCC2)cc1 1791183654 KZYNLZSDIZFEKI-UHFFFAOYSA-N 498.514 5.273 5 20 JKBD Cc1ccc(-c2ccccc2C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)Cc2cccc([N+](=O)[O-])c2)C3)cc1 1800603956 VUVSQGKALSJSIP-BKFWDETESA-N 483.568 5.065 5 20 JKBD O=C(/C=C/c1ccccc1[N+](=O)[O-])N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C1(c2ccc(Cl)cc2)CCC1 1801550636 JTBJXECAQRKNQP-GRGOBQFGSA-N 493.991 5.022 5 20 JKBD O=C(/C=C/c1cccs1)N1CCCC2(CCN(C(=O)C3(c4cccc([N+](=O)[O-])c4)CCC3)CC2)C1 1810002041 LLTARZQDCBLXBA-CMDGGOBGSA-N 493.629 5.023 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)N1CCC([C@@H]2CCCCN2C(=O)C23CCC(CC2)CC3)CC1 1832390132 LXJWOOIOZHTEQJ-OZGZLMSGSA-N 485.600 5.246 5 20 JKBD Cc1cc(CCCC(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)[C@@H]2CCC[C@H]3CCCC[C@H]32)c([N+](=O)[O-])cc1F 1847713844 DEVAVTINQKERPB-DHOCELGMSA-N 499.627 5.173 5 20 JKBD C[C@@]12CC3CC(C(=O)OCC(=O)Nc4ccc([N+](=O)[O-])cc4C(F)(F)F)(C1)C[C@](C)(C3)C2 9537790 HFRNBMKEBMAZTR-SWOGZVPRSA-N 454.445 5.092 5 20 JKBD CCOC(=O)C1CCN(C(=O)c2c3c(nc4ccccc24)/C(=C/c2ccc([N+](=O)[O-])cc2)CCC3)CC1 14213069 CQNWBVPXWSHZQE-DYTRJAOYSA-N 499.567 5.435 5 20 JKBD COc1cc(OC)c(NC(=O)c2ccc(Sc3nc(C)cs3)c([N+](=O)[O-])c2)cc1Cl 14716366 VWYDLQKLRLEOIL-UHFFFAOYSA-N 465.940 5.434 5 20 JKBD CSc1ccc([N+](=O)[O-])c(C(=O)Nc2nc(-c3ccc(Br)cc3)cs2)c1 26855964 AZHXWRJTUGDEJI-UHFFFAOYSA-N 450.339 5.455 5 20 JKBD Cc1ccc(-c2nnc3n2CCCCC3)cc1NC(=O)c1ccc(Cn2nc(C)c([N+](=O)[O-])c2C)cc1 27635131 MRWHZISHMJOWQX-UHFFFAOYSA-N 499.575 5.002 5 20 JKBD CSc1ccc([N+](=O)[O-])c(C(=O)Nc2ccc(CN3CCN(c4cccc(C)c4)CC3)cc2)c1 29416726 PLBCPPBYHAYFPB-UHFFFAOYSA-N 476.602 5.200 5 20 JKBD COc1ccc2[nH]cc(C3=CCN(C(=O)c4ccc(NCc5ccccc5)c([N+](=O)[O-])c4)CC3)c2c1 32318848 MRMOLQBTEDSOPQ-UHFFFAOYSA-N 482.540 5.626 5 20 JKBD C[C@H](Nc1ccc(C(=O)Nc2ccc(Br)cc2Cl)cc1[N+](=O)[O-])c1ccccn1 506221489 UKQBWIZSMLMXAF-LBPRGKRZSA-N 475.730 5.831 5 20 JKBD CC[C@@H](C)NC(=O)c1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2Oc2ccc(OC)cc2)cc1 507864805 QEOSFJKEPSJTTB-MRXNPFEDSA-N 463.490 5.176 5 20 JKBD Cc1noc([C@@H](C)NC(=O)c2c3c(nc4ccccc24)/C(=C/c2cccc([N+](=O)[O-])c2)CCC3)n1 509111140 HLTHUZHMPBGFBK-COYFKBPASA-N 469.501 5.202 5 20 JKBD Cc1ccc(Sc2ccc(C(=O)N3CCC(C(=O)N4CCC[C@H](C)C4)CC3)cc2[N+](=O)[O-])cc1 515197332 MAMXRBZTJPQIDD-IBGZPJMESA-N 481.618 5.165 5 20 JKBD COCCOc1cccc(NC(=O)C/C(=C\c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)c1 517458301 COWYFLWDSNPWHJ-XDJHFCHBSA-N 489.553 5.799 5 20 JKBD C[C@H](Nc1ccc(C(=O)Nc2ccc(-c3nc4ccccc4s3)cn2)cc1[N+](=O)[O-])c1ccccn1 518703022 CZDQXAAOUHHMAH-INIZCTEOSA-N 496.552 6.087 5 20 JKBD COc1cc(C(=O)N[C@H](c2ccc(F)cc2)C2CCC2)c([N+](=O)[O-])cc1OCc1cscn1 521533257 AFNXRJQSLZEKKK-QFIPXVFZSA-N 471.510 5.049 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Br)[C@H](NCc1c(F)cccc1Cl)c1ccccc1 521767164 LVGXXGRVEREZII-HXUWFJFHSA-N 492.732 5.619 5 20 JKBD O=C(Nc1nc(-c2ccc(Cl)s2)cs1)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-] 603727464 SDCANLARHGNXRK-UHFFFAOYSA-N 463.846 5.627 5 20 JKBD CCN(Cc1ccc(OCc2cccs2)c(OC)c1)C(=O)c1cc2cc([N+](=O)[O-])ccc2o1 603732482 OGXBNIUWFYDCFP-UHFFFAOYSA-N 466.515 5.652 5 20 JKBD C[C@@H](NC(=O)CSc1nnc(-c2ccc(Cl)cc2)n1Cc1ccco1)c1cccc([N+](=O)[O-])c1 603902244 WYNHVEDEIJOXPE-OAHLLOKOSA-N 497.964 5.118 5 20 JKBD CC[C@H](C)C(=O)Nc1cccc(CN[C@@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2ccccc2)c1 604044630 BFLZDMAEKRICHZ-BXKMTCNYSA-N 494.979 5.702 5 20 JKBD O=C(Nc1ccc(Sc2nncs2)cc1)c1cc([N+](=O)[O-])ccc1Sc1ccccc1 604119775 ZTZFMFULALTSLV-UHFFFAOYSA-N 466.569 6.001 5 20 JKBD O=C(c1cc([N+](=O)[O-])ccc1NCc1ccccc1)N1C[C@@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1 604258309 YFXIYRVKDSXGSC-GASCZTMLSA-N 475.389 5.410 5 20 JKBD C[C@@H](NC(=O)C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)c1nc2ccccc2[nH]1 604469152 OARXDBUYVBLNAZ-VVZNPABPSA-N 483.553 5.889 5 20 JKBD Cc1ccccc1NC(=O)[C@H]1CCc2ccccc2N1C(=O)c1ccc(Br)c([N+](=O)[O-])c1 726918218 BSCLBLMIVNUDNG-OAQYLSRUSA-N 494.345 5.266 5 20 JKBD Cc1ccsc1C(=O)Nc1ccc(OC(=O)[C@H](C)Oc2ccc(Cl)cc2[N+](=O)[O-])cc1 729216066 HWTGFQDRORSHAA-ZDUSSCGKSA-N 460.895 5.243 5 20 JKBD CCc1cccc[n+]1/C(C(=S)Nc1cc(C)ccc1F)=C(/O)c1ccc(C)c([N+](=O)[O-])c1 744116834 RQKUYQQAEMATHU-UHFFFAOYSA-O 452.531 5.524 5 20 JKBD COc1c(-c2nc(-c3ccc(Oc4ncc(C(F)(F)F)cc4Cl)cc3)no2)cccc1[N+](=O)[O-] 904669488 ZNTAKHSIRBBNEC-UHFFFAOYSA-N 492.797 6.180 5 20 JKBD O=C(OCc1nc(-c2cccc([N+](=O)[O-])c2)no1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 914796812 IIOQZYDXLAVMSN-UHFFFAOYSA-N 461.274 5.039 5 20 JKBD Cc1cc(C(=O)NC2CCCCC2)ccc1NC(=O)c1cc([N+](=O)[O-])ccc1N1CCCCC1 917720843 SNGNPJGSAVZAOZ-UHFFFAOYSA-N 464.566 5.208 5 20 JKBD CC1=C(C(=O)N(C)C)[C@@H](c2ccc(Cl)c([N+](=O)[O-])c2)NC(=S)N1c1ccc(C(F)(F)F)cc1 918105082 OAOYZROWQWOKMG-GOSISDBHSA-N 498.914 5.065 5 20 JKBD CC1(C)CCC(CC(=O)N2CCC3(CCCN(C(=O)/C=C/c4ccc([N+](=O)[O-])o4)C3)CC2)CC1 1805686637 SPNJDPKMKQPIGH-GQCTYLIASA-N 471.598 5.039 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2sccc2Cl)n[nH]1 1819957388 LCUIDXXMPKSYHM-MRXNPFEDSA-N 491.932 5.100 5 20 JKBD Cc1c(C(=O)N2CCC([C@@H]3CCCCN3C(=O)CCC3CCC3)CC2)cc(Cl)cc1[N+](=O)[O-] 1824352518 GGHGPWAUBKTDKO-QFIPXVFZSA-N 476.017 5.370 5 20 JKBD O=C(c1ccc(O)c([N+](=O)[O-])c1)N1CCC([C@@H]2CCCCN2C(=O)[C@@H]2CCC[C@H]3CCCC[C@H]32)CC1 1828460969 VVJJDWLTSDGHQI-CDIGIKMISA-N 497.636 5.140 5 20 JKBD COc1cc(C(=O)O[C@H](C)C(=O)Nc2cc([N+](=O)[O-])ccc2Cl)ccc1OCc1ccccc1 9180218 PPWWEBFPGBDFRI-OAHLLOKOSA-N 484.892 5.020 5 20 JKBD CSCc1c(C(=O)O[C@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2C(F)(F)F)oc2ccccc12 9786399 JBWUWDHBZKEXSU-LLVKDONJSA-N 482.436 5.407 5 20 JKBD C[C@@H](OC(=O)c1cc([N+](=O)[O-])ccc1Cl)C(=O)Nc1ccc(OCc2ccccc2)cc1 10666480 JTUPLLOSVIJIMM-OAHLLOKOSA-N 454.866 5.011 5 20 JKBD C[C@H](OC(=O)C1CCN(c2ccccc2[N+](=O)[O-])CC1)c1nc(-c2cccc(C(F)(F)F)c2)no1 11221649 ZYSUDBUUUCCTIY-AWEZNQCLSA-N 490.438 5.184 5 20 JKBD O=C(Oc1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2Cl)cc1)c1cc(-c2ccccc2)[nH]n1 15603237 SSGNOBJGPSIDAQ-UHFFFAOYSA-N 462.849 5.110 5 20 JKBD C[C@H](Sc1nnc(Nc2ccc(OC(F)(F)F)cc2)s1)C(=O)Nc1ccccc1[N+](=O)[O-] 22181164 DAYCUKDVHXULFM-JTQLQIEISA-N 485.469 5.208 5 20 JKBD CCOc1ccc(CN[C@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2ccccc2)cc1OC 30514778 AYSCNZXWISTTCN-QHCPKHFHSA-N 469.925 5.125 5 20 JKBD C[C@@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)Nc1cc(Br)ccc1Br 31950558 OAURFXBXOFNSMU-SECBINFHSA-N 460.147 5.239 5 20 JKBD CN(C)Cc1cccc(CNC(=O)C/C(=C/c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)c1 33089598 UHXOVAPAWATJMO-JCMHNJIXSA-N 486.597 5.513 5 20 JKBD Cc1c(NC(=O)c2ccccc2)cccc1NC(=O)c1cc([N+](=O)[O-])ccc1N1CCCCC1 59787172 MDXSQPDZZXAODJ-UHFFFAOYSA-N 458.518 5.398 5 20 JKBD COc1ccc(Cl)cc1-c1nn(CN(Cc2ccccc2[N+](=O)[O-])CC(F)(F)F)c(=S)[nH]1 71966585 MGWBMPLTXZCZPZ-UHFFFAOYSA-N 487.891 5.200 5 20 JKBD COc1cc(C(=O)Nc2c(F)cccc2N2CCCC2)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 110640298 UMBDIRYNQYTWMN-UHFFFAOYSA-N 485.899 6.041 5 20 JKBD Cn1cc(C(=O)Nc2ccc(OCc3ccccc3Cl)cc2)c(-c2ccc([N+](=O)[O-])cc2)n1 409893707 YIOWCLHTAAOYKN-UHFFFAOYSA-N 462.893 5.480 5 20 JKBD Cc1ccc([N+](=O)[O-])cc1NC(=O)c1ccccc1OCC(=O)Nc1cccc(C(F)(F)F)c1 481160828 AXWQIPZRWAGMHU-UHFFFAOYSA-N 473.407 5.192 5 20 JKBD O=C(CCCNc1ccc([N+](=O)[O-])cc1)Nc1ccc(Cl)c(-c2nnc3n2CCCCC3)c1 483366821 SJPKTIGZMRAECQ-UHFFFAOYSA-N 468.945 5.064 5 20 JKBD Cn1cnnc1Sc1ccc(C(=O)N2CCC[C@H]2c2ccc(Cl)c(Cl)c2)cc1[N+](=O)[O-] 487836936 GCHSBWFMMFSFJF-INIZCTEOSA-N 478.361 5.159 5 20 JKBD CN(C[C@H]1CCCCO1)C(=O)C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1 491922215 TYMSFDAQTLMOCW-BKHFDQEPSA-N 451.548 5.163 5 20 JKBD CC[C@H](C)Sc1ccc(NC(=O)COc2ccc([N+](=O)[O-])c(OC)c2)c(C(F)(F)F)c1 499593158 CFPCXIIIJZNIKC-LBPRGKRZSA-N 458.458 5.530 5 20 JKBD C[C@@H]1CCCN(C(=O)C2CCN(C(=O)c3ccc(Oc4ccc(Cl)cc4[N+](=O)[O-])cc3)CC2)C1 500281212 LPHXUVNIMDZLFZ-QGZVFWFLSA-N 485.968 5.151 5 20 JKBD COc1ccc([C@H](NC(=O)C2CCN(c3ccc(C(F)(F)F)cc3[N+](=O)[O-])CC2)C(C)C)cc1 503050375 KDTSRMHYYZYAMR-JOCHJYFZSA-N 479.499 5.352 5 20 JKBD CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)c1nc(-c2cccs2)n(-c2cccc(F)c2)n1 509702496 ZKIBZFXECRXGRN-UHFFFAOYSA-N 465.510 5.094 5 20 JKBD COc1cc2c(cc1OC)CCN(C(=O)c1ccc(NCc3ccccc3Cl)c([N+](=O)[O-])c1)CC2 510273039 SIPDBLWCBIDAIK-UHFFFAOYSA-N 495.963 5.119 5 20 JKBD COc1ccc([C@H](Cc2ccccc2C)NC(=O)c2ccc(Cl)cc2[N+](=O)[O-])cc1OC 521505771 GSHWVMAFSCQNFU-FQEVSTJZSA-N 454.910 5.288 5 20 JKBD Cc1cc(OCc2cccc(F)c2)ccc1NC(=O)c1cn(C)nc1-c1ccc([N+](=O)[O-])cc1 524387160 MVMJRUBDOFGDRZ-UHFFFAOYSA-N 460.465 5.274 5 20 JKBD COc1ccc(CNC(=O)C/C(=C\c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)cc1 603470932 QURNJWJEBYYKFZ-XMHGGMMESA-N 459.527 5.460 5 20 JKBD Cc1nn(Cc2ccc(C(=O)N(c3cccc(C(F)(F)F)c3)[C@H](C)C3CC3)cc2)c(C)c1[N+](=O)[O-] 603964338 FFEYGQVOSQAATQ-MRXNPFEDSA-N 486.494 5.921 5 20 JKBD CC(=O)Nc1ccc(S[C@@H](C)C(=O)Nc2nc(-c3cccc([N+](=O)[O-])c3)c(C)s2)cc1 603999035 QNFDEVLGUCWQCK-ZDUSSCGKSA-N 456.549 5.104 5 20 JKBD COc1cc2c(cc1OC)[C@@H](c1cccs1)N(C(=O)N[C@H](C)c1cccc([N+](=O)[O-])c1)CC2 604126282 LMOBZLHSDNQFRV-CMJOXMDJSA-N 467.547 5.092 5 20 JKBD C[C@H](NC(=O)N[C@@H](C)c1cccc([N+](=O)[O-])c1)c1cccc(NC(=O)Cc2ccccc2F)c1 604131128 VRWLMTKKOSQLJZ-IRXDYDNUSA-N 464.497 5.037 5 20 JKBD CCOc1cc(NC(=O)N(C)C[C@@H]2CCCO[C@H]2c2ccccc2)c([N+](=O)[O-])cc1OCC 604522379 XIMQRBJWCKRRFX-MBSDFSHPSA-N 457.527 5.024 5 20 JKBD C[C@@H](Nc1ccc(C(=O)NCC2(NC(=O)OC(C)(C)C)CCCCC2)cc1[N+](=O)[O-])c1ccccn1 725723306 HGXDRFJTPKDQFI-GOSISDBHSA-N 497.596 5.120 5 20 JKBD O=C(C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)OCc1ccnc(Cl)c1 726199467 FXUYUJHUTLQBJK-GZTJUZNOSA-N 465.918 5.927 5 20 JKBD COc1cccc(Cn2c(NC(=O)c3ccc(Br)c([N+](=O)[O-])c3)nc3ccccc32)c1 728003524 WWSRHUJMSLHTLB-UHFFFAOYSA-N 481.306 5.016 5 20 JKBD CCN(c1ccc(C(=O)O[C@@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2C(F)(F)F)cc1)C(C)C 746617959 DBZDLMATCPZOQT-AWEZNQCLSA-N 467.444 5.032 5 20 JKBD CC(=O)Nc1cccc([C@H](C)N(Cc2ccccc2)C(=O)c2cc([N+](=O)[O-])ccc2Br)c1 751072180 LKEUAAKEHIMCKM-INIZCTEOSA-N 496.361 5.719 5 20 JKBD O=C(NCc1ccc(-c2nc3ccccc3s2)o1)c1cc([N+](=O)[O-])ccc1Br 751072730 NRIZPVLVSYTBEC-UHFFFAOYSA-N 458.293 5.157 5 20 JKBD Cc1cc(C(=O)[C@@H](C)OC(=O)Cn2c3ccccc3c(=O)c3ccccc32)c(C)n1Cc1ccco1 841980023 VLSIMYYTRVNXNM-HXUWFJFHSA-N 482.536 5.029 5 20 JKBD CC(C)(C)c1nnc(COC(=O)c2ccc(Sc3nc4ccccc4s3)c([N+](=O)[O-])c2)o1 914886306 HDXHLUFVTIQSJL-UHFFFAOYSA-N 470.532 5.393 5 20 JKBD C[C@H](OC(=O)[C@H](C)Sc1ccc(Br)cc1)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl 919468531 WMZJQPIBSFCILL-QWRGUYRKSA-N 487.759 5.062 5 20 JKBD CC(=O)N(c1nc(COC(=O)c2cc3cccc([N+](=O)[O-])c3[nH]2)cs1)c1ccc(C)cc1C 919526081 CIUCOINLXBAWSU-UHFFFAOYSA-N 464.503 5.191 5 20 JKBD COc1cc(C(=O)N[C@H](c2ccccc2)C2CCCCC2)c([N+](=O)[O-])cc1OCc1cscn1 920002559 LHVPRVAXGFBNGK-XMMPIXPASA-N 481.574 5.690 5 20 JKBD O=C(NC1(c2ccc(NC(=O)c3ccc(Cl)o3)cc2)CCC1)c1cc(F)cc([N+](=O)[O-])c1 1788881209 WXLDULGDUAMIIZ-UHFFFAOYSA-N 457.845 5.042 5 20 JKBD O=C(/C=C/c1ccccc1[N+](=O)[O-])N1CCC2(CCCN(C(=O)CCCc3ccccc3F)C2)CC1 1805496851 CLEKSNOLHUTZEL-BUHFOSPRSA-N 493.579 5.001 5 20 JKBD CCC1(C(=O)Nc2cc([C@H]3CCCCN3C(=O)c3cc4cc([N+](=O)[O-])ccc4s3)[nH]n2)CCC1 1818950688 FEQVBGPOULUAAZ-GOSISDBHSA-N 481.578 5.419 5 20 JKBD O=C([C@@H]1CCC[C@H]2CCCC[C@H]21)N1CC2(CCCN2C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)C1 1845739027 FAXIXCMLUNMZIG-DUXKGJEZSA-N 481.618 5.233 5 20 JKBD C[C@H](OC(=O)c1c(Cl)ccc(Cl)c1Cl)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl 3458356 CCIWWROULOYOTL-ZETCQYMHSA-N 452.077 5.392 5 20 JKBD CCCn1c(SCC(=O)Nc2cc(Cl)ccc2[N+](=O)[O-])nnc1-c1ccc(Cl)cc1 9138823 RUBPZJIXKOGJQA-UHFFFAOYSA-N 466.350 5.301 5 20 JKBD Cc1ccc(-c2csc3nc(SCc4cc([N+](=O)[O-])cc5c4OCOC5)n(C)c(=O)c23)cc1C 10792814 ADTSZMVUBQBMGH-UHFFFAOYSA-N 495.582 5.346 5 20 JKBD C[C@@H](OC(=O)c1ccccc1OCc1ccccc1)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl 10863955 QPKYDMAMUJVCML-OAHLLOKOSA-N 454.866 5.011 5 20 JKBD O=C(COC(=O)c1csc(-c2cccc(Cl)c2)n1)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 17980607 KXPHKMHVEKCCAF-UHFFFAOYSA-N 485.827 5.186 5 20 JKBD C[C@@H](OC(=O)c1ccc(NC(=O)OC(C)(C)C)cc1)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 19426205 CUDULAUWMPUIPC-GFCCVEGCSA-N 497.426 5.145 5 20 JKBD O=C(C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)OCc1nnsc1Cl 22039782 RVMVNHYCFLFEOH-LCYFTJDESA-N 472.935 5.384 5 20 JKBD COc1ccc(NC(C)=O)cc1NC(=O)[C@H](C)OC(=O)c1c2ccccc2cc2ccccc12 22787448 NEFXFESVYHJLON-INIZCTEOSA-N 456.498 5.144 5 20 JKBD COc1ccc(-c2nnc(S[C@H](C)C(=O)Nc3cccc([N+](=O)[O-])c3C)n2-c2ccccc2)cc1 23293632 DEKVYKGPIGVISL-QGZVFWFLSA-N 489.557 5.279 5 20 JKBD CC(=O)N(c1cccc(C(F)(F)F)c1)c1nc(COC(=O)c2ccc([N+](=O)[O-])s2)cs1 23562553 LPQYQUBMJMAHCJ-UHFFFAOYSA-N 471.438 5.173 5 20 JKBD CCOc1ccccc1Nc1nnc(SCCC(=O)Nc2ccc([N+](=O)[O-])cc2C)s1 26367045 KYCBPEIYFRGPKF-UHFFFAOYSA-N 459.553 5.018 5 20 JKBD Cn1c(SCC(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)nc2scc(-c3cccs3)c2c1=O 28607662 BFQRTGCLZARFGL-UHFFFAOYSA-N 492.991 5.016 5 20 JKBD O=C(Cn1cnc([N+](=O)[O-])c1)Nc1cc(C(F)(F)F)ccc1Oc1ccc(Br)cc1 29210777 FIQGYQRVZUHLHQ-UHFFFAOYSA-N 485.216 5.004 5 20 JKBD CC(C)(C)OC(=O)Nc1ccc(F)c(NC(=O)Cn2c3ccccc3c(=O)c3ccccc32)c1 71885647 VNBGSLZOVTVPMQ-UHFFFAOYSA-N 461.493 5.280 5 20 JKBD COc1cc2c(cc1NC(=O)c1ccc(N[C@@H](C)c3ccccn3)c([N+](=O)[O-])c1)oc1ccccc12 108753888 RGLPMHKGCXGOPS-INIZCTEOSA-N 482.496 6.323 5 20 JKBD COc1cc(C(=O)Nc2ccnn2[C@H](C)C2CC2)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 195608737 RALSGIJKSIBWQI-CYBMUJFWSA-N 456.886 5.469 5 20 JKBD O=C(Cn1c2ccccc2c(=O)c2ccccc21)Nc1ccccc1SC[C@@H]1CC1(Cl)Cl 302967499 NHZRWFQSINMYJE-INIZCTEOSA-N 483.420 6.079 5 20 JKBD C[C@@H](Nc1ccc(C(=O)Nc2ccc3[nH]c(-c4ccco4)nc3c2)cc1[N+](=O)[O-])c1ccccn1 410085862 INWIUPSNCOBXJJ-OAHLLOKOSA-N 468.473 5.552 5 20 JKBD CCOC(=O)c1nc(N(CCc2ccccc2)C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)sc1C 490826150 YGICZKZHMKEPTJ-UHFFFAOYSA-N 495.582 5.641 5 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5.903 5 20 JKBD CN(C(=O)c1cccc(C(=O)Nc2nc(-c3cccc([N+](=O)[O-])c3)cs2)c1)c1ccccc1 521525350 JAFLHQPGYWRXNV-UHFFFAOYSA-N 458.499 5.247 5 20 JKBD Cc1cc(C)n([C@@H](C)C(=O)Nc2ccc(NC(=O)c3cc4cc([N+](=O)[O-])ccc4s3)cc2Cl)n1 521540184 RJMVLGOXNVVCAJ-AWEZNQCLSA-N 497.964 5.728 5 20 JKBD COc1ccccc1Oc1ccc(NC(=O)CSCc2ccc(OC)c([N+](=O)[O-])c2)cc1 603565916 DXHNIOJBNPNBIU-UHFFFAOYSA-N 454.504 5.276 5 20 JKBD Cc1c(NC(=O)c2ccc(N3CCC[C@H](C)C3)c([N+](=O)[O-])c2)cccc1-c1nnc2n1CCCCC2 603962178 JKBOVPISLZYCAW-SFHVURJKSA-N 488.592 5.377 5 20 JKBD C[C@@H](Nc1ccc(C(=O)NC[C@@H]2CCN(c3ccc(Cl)cc3)C2)cc1[N+](=O)[O-])c1ccccn1 604466670 VGTOZHXWLAYZOU-MSOLQXFVSA-N 479.968 5.073 5 20 JKBD C[C@H](NCc1ccc(-c2ccc([N+](=O)[O-])cc2Br)o1)c1ccc2c(c1)OCCO2 608835413 AUNGENKRVNFPGR-ZDUSSCGKSA-N 459.296 5.239 5 20 JKBD CCOc1cc([N+](=O)[O-])c(C(=O)Nc2ccc(Oc3cccc(F)c3)c3ccncc23)cc1OC 609106000 UQOUYVTZXYZYQA-UHFFFAOYSA-N 477.448 5.734 5 20 JKBD O=C(Nc1ccc(Cl)c([N+](=O)[O-])c1)N1CCC[C@H](c2nc(-c3ccc(Cl)cc3)no2)C1 726694035 XJYUEDWOWNBUKK-ZDUSSCGKSA-N 462.293 5.363 5 20 JKBD Cc1oc(-c2ccsc2)nc1COC(=O)c1ccc(N[C@H](C)c2ccccn2)c([N+](=O)[O-])c1 726812816 LVYSAZSHQUJEMM-CQSZACIVSA-N 464.503 5.545 5 20 JKBD Cc1ccc([C@@H](C)NC(=O)c2ccc(C(=O)N[C@H](C)c3ccc(C)s3)c([N+](=O)[O-])c2)s1 727851833 OGENIDXTELEXSJ-HUUCEWRRSA-N 457.577 5.317 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Cl)[C@H](c1ccccc1)N1CCC([C@H](O)c2ccc(F)cc2)CC1 731037820 LKNMBTLHOLICOO-LOSJGSFVSA-N 497.954 5.513 5 20 JKBD O=C(CCc1ncc(-c2ccc(F)cc2F)o1)N(CC1CC1)c1ccc(Cl)c([N+](=O)[O-])c1 745344395 BWLLOIRRFZIKBV-UHFFFAOYSA-N 461.852 5.557 5 20 JKBD COc1cc(/C=C(/Cl)c2nc(=O)c3cccc(C)c3[nH]2)ccc1OCc1ccc([N+](=O)[O-])cc1 747201220 RKYBOKRCWBAAHT-UDWIEESQSA-N 477.904 5.464 5 20 JKBD C[C@@H](OC(=O)c1csc(-c2ccc([N+](=O)[O-])cc2)n1)C(=O)Nc1ccccc1-c1ccccc1 747956277 QKGHSYPQLZENNE-MRXNPFEDSA-N 473.510 5.569 5 20 JKBD C[C@@H](OC(=O)c1csc(-c2cccc([N+](=O)[O-])c2)n1)C(=O)Nc1cccc(Cl)c1Cl 747964242 WDAJRBLALXACHO-SNVBAGLBSA-N 466.302 5.209 5 20 JKBD COc1cc(C(=O)O[C@H](C)c2ccc(NC(=O)c3ccccc3)cc2)c([N+](=O)[O-])cc1OC(F)F 748016191 STSSLACBHTWANC-CQSZACIVSA-N 486.427 5.375 5 20 JKBD O=C(C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)Nc1ccn(Cc2ccccn2)n1 748676724 QEKIEBKSZRHVAF-XDJHFCHBSA-N 496.552 5.414 5 20 JKBD CC(C)(C)OC(=O)N1CCC[C@@H]1[C@@H]1CCCN(C(=O)c2cc3ccccc3c3cccnc23)C1 749648339 NUIMNSAHGZSMCN-HYBUGGRVSA-N 459.590 5.640 5 20 JKBD Cc1c(C(=O)NC2(c3ccc(NC(=O)COC(C)(C)C)cc3)CCC2)cc(Cl)cc1[N+](=O)[O-] 1786636782 UIJAOBUWQJZPKH-UHFFFAOYSA-N 473.957 5.119 5 20 JKBD CC(C)c1nc(C(=O)Nc2ccc(C3(NC(=O)CCc4cccc([N+](=O)[O-])c4)CCC3)cc2)co1 1787024982 IPKDDMGXBIWXCA-UHFFFAOYSA-N 476.533 5.087 5 20 JKBD CC(C)=CCCC(=O)NC1(c2ccc(NC(=O)c3cc(N(C)C)ccc3[N+](=O)[O-])cc2)CCC1 1790056028 ASRCNGJHRBWWCN-UHFFFAOYSA-N 464.566 5.155 5 20 JKBD O=C(Cc1ccc2ncccc2c1)NC1(c2ccc(NC(=O)c3ccc([N+](=O)[O-])cc3F)cc2)CCC1 1790622826 SXLCPPQPSMYGLC-UHFFFAOYSA-N 498.514 5.273 5 20 JKBD CC1(C(=O)NC2(c3ccc(NC(=O)CSc4ccccc4[N+](=O)[O-])cc3)CCC2)CCC1 1791521664 IZUDUKGSOCFVLV-UHFFFAOYSA-N 453.564 5.011 5 20 JKBD O=C(Nc1cc([C@H]2CCCCN2C(=O)CCc2ccccc2Cl)[nH]n1)c1cccc(F)c1[N+](=O)[O-] 1821168807 DROJMDGOPBKCPF-HXUWFJFHSA-N 499.930 5.049 5 20 JKBD O=C(CCc1cccc([N+](=O)[O-])c1)N1CCC([C@@H]2CCCCN2C(=O)Cc2ccccc2Cl)CC1 1826471542 UFJMZLIMFZBRMI-VWLOTQADSA-N 498.023 5.043 5 20 JKBD Cc1cc(C(=O)N2CCC([C@@H]3CCCCN3C(=O)c3cc4cc([N+](=O)[O-])ccc4s3)CC2)cn1C 1831060624 BECQMHQWJWWOQC-QFIPXVFZSA-N 494.617 5.004 5 20 JKBD CCn1c(S[C@@H](C(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)c2ccccc2)nnc1-c1ccco1 8619990 RYAQMGIXYBNCHJ-LJQANCHMSA-N 483.937 5.592 5 20 JKBD Cc1csc(SCc2ccccc2C(=O)O[C@@H](C)C(=O)Nc2cc([N+](=O)[O-])ccc2Cl)n1 9622837 RBPHLUGSODHVPL-ZDUSSCGKSA-N 491.978 5.489 5 20 JKBD Cc1c(NC(=O)[C@@H](C)Sc2nnc(-c3ccc(Cl)cc3)n2Cc2ccco2)cccc1[N+](=O)[O-] 23610052 JMRWQCJUVDBLQV-OAHLLOKOSA-N 497.964 5.576 5 20 JKBD COc1ccc(Br)cc1-c1nc(COC(=O)c2c(C)cccc2[N+](=O)[O-])cs1 26118546 SPXBUIGEDJHFLV-UHFFFAOYSA-N 463.309 5.155 5 20 JKBD C[C@@H]1C[C@@H](C)CN(c2ccc(C(=O)Nc3cc(N4CCCC4=O)ccc3Cl)cc2[N+](=O)[O-])C1 485376039 IJRQZJFPGBVQJO-HZPDHXFCSA-N 470.957 5.110 5 20 JKBD O=C(Cn1c(COc2ccccc2)nc2ccccc21)N(Cc1ccccc1[N+](=O)[O-])CC(F)(F)F 486069298 MBPWJTFFYKRYSB-UHFFFAOYSA-N 498.461 5.115 5 20 JKBD O=C(Cc1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1)N[C@@H](c1ccccc1)c1ccco1 507019558 CZPSORGJBJIYGR-NDEPHWFRSA-N 478.508 5.489 5 20 JKBD COc1cc2c(cc1OC)[C@@H](c1cccs1)N(C(=O)c1cc3cc([N+](=O)[O-])ccc3o1)CC2 513831447 RMABPGKHZWTGCK-QHCPKHFHSA-N 464.499 5.208 5 20 JKBD C[C@H](Nc1ccc(C(=O)N2CCc3c(ccc(Cl)c3Cl)C2)cc1[N+](=O)[O-])c1ccccn1 523207493 IEBPBABSZKEIJW-AWEZNQCLSA-N 471.344 5.668 5 20 JKBD O=C(c1cc([N+](=O)[O-])ccc1NCc1ccccc1)N1C[C@H]2CC[C@H]1[C@H]1CN(Cc3ccccc3)C[C@H]21 594657585 HBHALSFEFPWVFU-YMFKDRQTSA-N 496.611 5.190 5 20 JKBD O=C(Cc1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1)N(Cc1cccnc1)Cc1ccco1 602220853 FEFCHGYAWBIJHR-UHFFFAOYSA-N 493.523 5.207 5 20 JKBD O=C(CSc1ccc([N+](=O)[O-])cc1)Nc1ccc(NC(=O)c2ccccc2)cc1C(F)(F)F 603743199 YFXQOASWLDVPCB-UHFFFAOYSA-N 475.448 5.597 5 20 JKBD O=C(NCc1ccc(-c2ccccc2)o1)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 603998224 YWKMOPMCECNXNJ-UHFFFAOYSA-N 473.451 5.406 5 20 JKBD COc1ccc([C@@H](Cc2ccccc2C)N[C@@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2C)cc1OC 604474115 PMHSZHAWRKQWNN-WMZHIEFXSA-N 477.561 5.129 5 20 JKBD COc1cc(C(=O)Nc2ccc(OCc3cccc(F)c3)cc2C)c([N+](=O)[O-])cc1OC(F)F 609064568 FPVHDBVJVQGFHB-UHFFFAOYSA-N 476.407 5.484 5 20 JKBD COc1cc(CCNC(=O)c2ccccc2CSc2nc3ccccc3o2)c([N+](=O)[O-])cc1OC 609603711 XXDBTWCGTQUEHE-UHFFFAOYSA-N 493.541 5.018 5 20 JKBD O=C(CNc1ccc(C(F)(F)F)cc1[N+](=O)[O-])OCc1nnc(-c2c(Cl)cccc2Cl)o1 726632501 XZPCBIRQBHZCFB-UHFFFAOYSA-N 491.209 5.126 5 20 JKBD C[C@H](Cc1ccc(Cl)cc1Cl)C(=O)OCC(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 730634906 GKCZOGDZQOLEGE-SNVBAGLBSA-N 479.238 5.281 5 20 JKBD COc1ccc(Oc2ccc([N+](=O)[O-])cc2C(=O)N2CCC([C@H](O)c3ccc(F)cc3)CC2)cc1 731054908 JMZUOYPULJYCMZ-RUZDIDTESA-N 480.492 5.121 5 20 JKBD C[C@@H](Nc1ccc(C(=O)Oc2cccc(C(=O)Nc3ccccc3)c2)cc1[N+](=O)[O-])c1ccccn1 746785739 JSRXJIAJUNIPCU-GOSISDBHSA-N 482.496 5.634 5 20 JKBD O=C(OCc1nnc(-c2ccco2)o1)c1cc([N+](=O)[O-])ccc1N1CCC(Cc2ccccc2)CC1 847014468 MTMOAUOWQCTMHS-UHFFFAOYSA-N 488.500 5.054 5 20 JKBD Cc1cc(N2CC3(CCOCC3)[C@H]2c2cnn(CC(C)C)c2)c([N+](=O)[O-])cc1C(F)(F)F 849479553 XDLYQFIDTTYXLJ-HXUWFJFHSA-N 452.477 5.133 5 20 JKBD CC(C)OCc1ccc(C(=O)O[C@@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2ccccc2)cc1 916535537 PDFUDLDJVCMAHR-HSZRJFAPSA-N 482.920 5.710 5 20 JKBD CCN(Cc1ccc(OCc2cccs2)c(OC)c1)C(=O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1C 917526583 UKMUXPINSHRCNR-UHFFFAOYSA-N 485.518 5.123 5 20 JKBD CCOc1ccc(NC(=O)c2ccccc2NC(=O)c2ccc([N+](=O)[O-])cc2Cl)cc1Cl 918622525 XRWPWDPWJJAFJK-UHFFFAOYSA-N 474.300 5.805 5 20 JKBD O=C(OCC[C@@H]1CCCCN1C(=O)CCCc1c[nH]c2ccccc12)c1cccc([N+](=O)[O-])c1 918637826 MFXNOXUMMXZGOJ-NRFANRHFSA-N 463.534 5.027 5 20 JKBD C[C@H](OC(=O)c1ccc(N[C@H](C)c2ccccn2)c([N+](=O)[O-])c1)C(=O)c1ccc(Cl)cc1 920548150 QDEFPQPTJHAOMZ-CABCVRRESA-N 453.882 5.245 5 20 JKBD Cc1nc(C)c(C(=O)NC2(c3ccc(NC(=O)Cc4ccc(Cl)cc4[N+](=O)[O-])cc3)CCC2)s1 1786116209 IQECKLDQQCYDTB-UHFFFAOYSA-N 498.992 5.312 5 20 JKBD CC(F)(F)C(C)(C)C(=O)NC1(c2ccc(NC(=O)Cn3ccc4ccc([N+](=O)[O-])cc43)cc2)CCC1 1786275958 RATSSHGUGUYOAG-UHFFFAOYSA-N 498.530 5.365 5 20 JKBD O=C(NC1(c2ccc(NC(=O)c3ccc([N+](=O)[O-])c4c3OCO4)cc2)CCC1)c1ccc(Cl)s1 1790094343 GDVWMFJCIFOXHX-UHFFFAOYSA-N 499.932 5.100 5 20 JKBD O=C(NC1(c2ccc(NC(=O)c3ccc([N+](=O)[O-])cc3F)cc2)CCC1)c1cc2cc(F)ccc2[nH]1 1790621694 CUQOZIGPAMNHEZ-UHFFFAOYSA-N 490.466 5.416 5 20 JKBD Cc1c(C(=O)Nc2ccc(C3(NC(=O)c4cnccc4F)CCC3)cc2)cc(Cl)cc1[N+](=O)[O-] 1790774773 ZWWFZRONVISKJF-UHFFFAOYSA-N 482.899 5.152 5 20 JKBD C[C@@H](C(=O)NC1(c2ccc(NC(=O)c3nc4cc([N+](=O)[O-])ccc4[nH]3)cc2)CCC1)c1ccccc1 1790828175 XDLYBSDALZUAKR-QGZVFWFLSA-N 483.528 5.023 5 20 JKBD O=C(/C=C/c1ccccc1[N+](=O)[O-])Nc1ccc(C2(NC(=O)C3(C(F)(F)F)CC3)CCC2)cc1 1792317818 QAOQOMGSLPJCCY-IZZDOVSWSA-N 473.451 5.085 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1c(F)cc(Cl)cc1Cl)C2 1800700352 QSNOHDDRIFHSDT-BTTYYORXSA-N 498.313 5.054 5 20 JKBD Cc1ccc(S/C=C/C(=O)N2CCC3(CCCN(C(=O)/C=C/c4ccc([N+](=O)[O-])o4)C3)CC2)cc1 1805684527 ODWUGKGNNDWAOA-XOCAJXSXSA-N 495.601 5.047 5 20 JKBD O=C(c1cc2cc([N+](=O)[O-])ccc2s1)N1CCC2(CCCN(C(=O)c3sccc3F)C2)CC1 1806318316 QSURQVKPLDXGSV-UHFFFAOYSA-N 487.578 5.169 5 20 JKBD O=C(CCc1cccc([N+](=O)[O-])c1)Nc1cc([C@@H]2CCCCN2C(=O)c2ccc(Cl)cc2F)[nH]n1 1815536071 MKHVPBIABWYZRX-NRFANRHFSA-N 499.930 5.049 5 20 JKBD O=C(Nc1cc([C@@H]2CCCCN2C(=O)CCc2ccccc2Cl)[nH]n1)c1cc(F)cc([N+](=O)[O-])c1 1821165179 HCZQSLPGBYWCTI-NRFANRHFSA-N 499.930 5.049 5 20 JKBD C/C(=C\c1cccs1)C(=O)N1CCCC[C@H]1C1CCN(C(=O)CCc2cccc([N+](=O)[O-])c2)CC1 1823714999 PNXLDIIOTLFXIB-ZOFLOHRWSA-N 495.645 5.312 5 20 JKBD Cc1ccc([C@@H](C)C(=O)N2CCCC[C@@H]2C2CCN(C(=O)Cc3cc(F)ccc3[N+](=O)[O-])CC2)cc1 1831528257 LZHWVAJMELNJKA-CJFMBICVSA-N 495.595 5.008 5 20 JKBD O=C(NC1CCN(C(=O)c2cc([N+](=O)[O-])ccc2Sc2ccc(Cl)cc2)CC1)c1ccccc1 10774633 GZHYGBQDJJENQV-UHFFFAOYSA-N 495.988 5.434 5 20 JKBD C[C@H](c1nc2ccccc2s1)N(C)C(=O)CSc1ccc(C(F)(F)F)cc1[N+](=O)[O-] 15094347 RHBKNTSCTBOBAR-LLVKDONJSA-N 455.483 5.535 5 20 JKBD CCCOc1c(Cl)cc(C(=O)O[C@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)cc1OC 17740537 PJYHUMJVWYZCCM-GFCCVEGCSA-N 461.858 5.014 5 20 JKBD C[C@@H](OC(=O)c1cc(F)c(Cl)cc1Cl)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 17751170 AMPQXGFHNNUBKB-SSDOTTSWSA-N 469.174 5.244 5 20 JKBD O=C(CSc1nnc(Cc2cccs2)n1-c1ccccc1)Nc1cc([N+](=O)[O-])ccc1Cl 17757853 ALCPMFQSHUWBML-UHFFFAOYSA-N 485.978 5.212 5 20 JKBD Cc1ccc(-c2nc(C(=O)O[C@H](C)C(=O)Nc3ccc([N+](=O)[O-])cc3C(F)(F)F)cs2)cc1 17939894 BWJWIHXGMSKZPG-GFCCVEGCSA-N 479.436 5.230 5 20 JKBD O=C(Nc1ccccc1C(=O)N1CCN(c2cccc(Cl)c2)CC1)c1ccc([N+](=O)[O-])cc1Cl 29566841 AQLMPPPZCXGNLG-UHFFFAOYSA-N 499.354 5.116 5 20 JKBD Cc1ccc([N+](=O)[O-])cc1C(=O)Nc1ccc(NC(=O)c2ccc(F)cc2)cc1C(F)(F)F 72042953 MNGDFBKLVHYLBG-UHFFFAOYSA-N 461.371 5.566 5 20 JKBD CN(Cc1cc([N+](=O)[O-])ccc1Cl)C(=O)C1CCN(c2ncc(C(F)(F)F)cc2Cl)CC1 248032553 IJFFMTFPNQSJAN-UHFFFAOYSA-N 491.297 5.190 5 20 JKBD COc1ccc([C@H]2[C@@H](C(=O)Nc3cccc([N+](=O)[O-])c3C)CCC(=O)N2c2ccc(OC)cc2)cc1 481380814 LTEZQYBUBQRPAA-NVQXNPDNSA-N 489.528 5.043 5 20 JKBD COc1ccc([C@H](C)NC(=O)N(Cc2ccc([N+](=O)[O-])cc2)C(C)C)cc1Br 509421448 YZAYAVZTJUVVEK-AWEZNQCLSA-N 450.333 5.047 5 20 JKBD CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)NCc1ccccc1-c1ccc(Cn2cccn2)cc1 509682149 FFNGFVMUNQAIMA-UHFFFAOYSA-N 483.572 5.627 5 20 JKBD CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)Cc1csc(-c2cc(Br)cs2)n1 509702523 ZUHRDGDHYJPZAO-UHFFFAOYSA-N 480.409 5.522 5 20 JKBD Cc1cccc(NC(=O)Nc2cccc(CNC(=O)N(Cc3ccc([N+](=O)[O-])cc3)C(C)C)c2)c1 509750079 HPWLVALSLHZBJK-UHFFFAOYSA-N 475.549 5.667 5 20 JKBD CC1CCN(c2ccc(C(=O)N(C[C@H]3CCCO3)c3nc4ccccc4s3)cc2[N+](=O)[O-])CC1 514471836 ANOSTLWYKREQHQ-LJQANCHMSA-N 480.590 5.267 5 20 JKBD CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccc(NC(=O)c2ccoc2)cc1C(F)(F)F 517779487 KLFOFJNPDPBWEI-UHFFFAOYSA-N 490.438 5.901 5 20 JKBD CCC(C)(C)NC(=O)c1ccc(NC(=O)C2CCN(c3ccccc3[N+](=O)[O-])CC2)cc1Cl 603986946 AWELKMQUDCUWBV-UHFFFAOYSA-N 472.973 5.022 5 20 JKBD O=C(c1ccccc1Sc1ccc(C(F)(F)F)cc1[N+](=O)[O-])N1CCC[C@H](c2cc[nH]n2)C1 608813463 WLPBFHINNKKMML-AWEZNQCLSA-N 476.480 5.508 5 20 JKBD CC[C@H](NC(=O)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1)c1nnc2n1CCCCC2 608866390 LIVZNXOSXJDJMQ-SFHVURJKSA-N 469.929 5.240 5 20 JKBD O=C(N[C@H]1CCc2nc(-c3ccccc3)ncc2C1)c1cc([N+](=O)[O-])ccc1Sc1ccccc1 608965280 YGWWRBAFPWNQEB-FQEVSTJZSA-N 482.565 5.490 5 20 JKBD C[C@@H](c1cccs1)N(C)C(=O)c1ccc(C(=O)N(C)[C@@H](C)c2cccs2)c([N+](=O)[O-])c1 609044972 XLOVENPDRXIFEK-GJZGRUSLSA-N 457.577 5.384 5 20 JKBD C[C@H]1CSc2ccc(Br)cc2[C@@H]1NC(=O)CSc1ccc([N+](=O)[O-])cc1 609192307 NISIGPXRSNIEOK-BBATYDOGSA-N 453.383 5.049 5 20 JKBD COCCOc1cc([N+](=O)[O-])c(C(=O)Nc2cccc(Sc3ccccc3)c2)cc1OC 609375247 QBRARRSRMTXYOA-UHFFFAOYSA-N 454.504 5.032 5 20 JKBD CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccccc1C(=O)N(C)C1CCCCC1 729034915 UDZJIWHPYDIJNE-UHFFFAOYSA-N 452.555 5.442 5 20 JKBD CCN(Cc1ccc(OC)cc1)C(=O)c1ccccc1NC(=O)c1ccc([N+](=O)[O-])cc1Cl 729838195 HZZGYKQOOBKZBS-UHFFFAOYSA-N 467.909 5.171 5 20 JKBD COc1ccc(NC(=O)[C@@H](OC(=O)c2csc(-c3ccc([N+](=O)[O-])cc3)n2)c2ccccc2)cc1 747955498 ASIQJXPIFFOODL-QFIPXVFZSA-N 489.509 5.264 5 20 JKBD Cc1cc(C(=O)OCC(=O)N2c3ccccc3Sc3ccc(Cl)cc32)ccc1[N+](=O)[O-] 792240493 BAILRXMRDDCKCE-UHFFFAOYSA-N 454.891 5.543 5 20 JKBD Cc1csc(Sc2ccc(-c3nc([C@@H]4CCC(=O)N(CC5CCCC5)C4)no3)cc2[N+](=O)[O-])n1 856581464 GBZJHMMGRDXYPW-QGZVFWFLSA-N 499.618 5.457 5 20 JKBD O=C(O[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1)c1cc2ccsc2[nH]1 914891335 IAPCZLHJXYIZER-SFHVURJKSA-N 455.879 5.328 5 20 JKBD O=C(Nc1cc([N+](=O)[O-])ccc1F)c1ccccc1SCc1ccc(Br)cc1 917610795 BSRVLPBEBGUYAL-UHFFFAOYSA-N 461.312 6.041 5 20 JKBD O=C(Nc1cc(Cl)c([N+](=O)[O-])cc1OCc1ccccc1)c1cccc(NC(=O)c2ccco2)c1 917610933 ZSWOEZRIBFCTNC-UHFFFAOYSA-N 491.887 5.925 5 20 JKBD CC(=O)N(c1ccc(F)cc1)c1nc(COC(=O)[C@H](C)Sc2ccc([N+](=O)[O-])cc2)cs1 918875180 NOXJPUGCCOKPDM-ZDUSSCGKSA-N 475.523 5.099 5 20 JKBD CC1CCN(c2ccc([N+](=O)[O-])cc2C(=O)Nc2ccccc2OC[C@@H]2CCCCO2)CC1 920012935 GFVKOLREJRDAMJ-FQEVSTJZSA-N 453.539 5.031 5 20 JKBD O=C(Oc1ccc(-c2ccccc2)cc1[N+](=O)[O-])C1CCN(C(=O)/C=C\c2ccccc2)CC1 920330930 QVHLRMFEKRYGDY-KAMYIIQDSA-N 456.498 5.119 5 20 JKBD COC1(CC(=O)Nc2ccc(C3(NC(=O)C4(c5cccc([N+](=O)[O-])c5)CCC4)CCC3)cc2)CCC1 1792053054 CUNOUIFMFRGCGO-UHFFFAOYSA-N 491.588 5.110 5 20 JKBD CC(C)[C@H]1CC[C@H](C(=O)Nc2cc([C@H]3CCCCN3C(=O)/C=C/c3ccc([N+](=O)[O-])o3)[nH]n2)CC1 1822100747 SSYSLSQBLLSALH-XAVXOPJASA-N 483.569 5.079 5 20 JKBD CCC[C@H]1CC[C@H](C(=O)N2CCCC[C@@H]2c2cc(NC(=O)c3ccc([N+](=O)[O-])c(OC)c3)n[nH]2)CC1 1823286638 DBEHJOXIPSQLML-DBXWQHBBSA-N 497.596 5.239 5 20 JKBD CCC[C@H]1CC[C@H](C(=O)N2CCC([C@@H]3CCCCN3C(=O)c3cc(O)cc([N+](=O)[O-])c3)CC2)CC1 1830706344 FUMJIQWBECHCTA-OWHZGTRUSA-N 485.625 5.140 5 20 JKBD O=C(C1CC(F)(F)C1)N1CCC([C@H]2CCCCN2C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)CC1 1831059456 GIPVDBPDHSWQLG-LJQANCHMSA-N 491.560 5.088 5 20 JKBD C[C@H](C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)CC1)n1cccc1 1831062632 WJPSQOZDAKHVKT-GCJKJVERSA-N 494.617 5.106 5 20 JKBD Cc1cc(Cl)cc(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3ccc([N+](=O)[O-])cc3F)CC2)c1 1832609460 DMMXPMCGHXQUHA-HSZRJFAPSA-N 487.959 5.243 5 20 JKBD Cc1ccc(NC(=O)[C@H](Sc2nnc(-c3ccc(C)c(C)c3)o2)c2ccccc2)c([N+](=O)[O-])c1 10842525 YHCFAZNMOQMYHF-JOCHJYFZSA-N 474.542 6.042 5 20 JKBD O=C(OCc1nnsc1Cl)c1ccc(Sc2nc3ccccc3s2)c([N+](=O)[O-])c1 21226127 GQZIUVGZZDVLDT-UHFFFAOYSA-N 464.937 5.218 5 20 JKBD O=C(Nc1cccc(Oc2cnccn2)c1)c1ccc(NCc2ccccc2Cl)c([N+](=O)[O-])c1 33137137 HSZIRGFZMNMHNP-UHFFFAOYSA-N 475.892 5.695 5 20 JKBD COc1cc(C(=O)Nc2ccc3oc(C(C)(C)C)nc3c2)c([N+](=O)[O-])cc1OCc1cscn1 68761806 BBDFUPWWRQVFOU-UHFFFAOYSA-N 482.518 5.330 5 20 JKBD Cc1ccc(-c2csc(NC(=O)c3ccc(N[C@H](C)c4ccccn4)c([N+](=O)[O-])c3)n2)s1 72016877 GYDRFIWQKGVTAO-CQSZACIVSA-N 465.560 5.909 5 20 JKBD C[C@@H](Nc1ccc(C(=O)N2CCn3cccc3[C@H]2c2ccccc2)cc1[N+](=O)[O-])c1ccccn1 108940259 RXOWPBYOBAZRCN-NIYFSFCBSA-N 467.529 5.210 5 20 JKBD COc1cc(C(=O)N(Cc2ccccc2[N+](=O)[O-])CC(F)(F)F)ccc1OC1CCCC1 195634370 HZWIIKMTCVWYMA-UHFFFAOYSA-N 452.429 5.130 5 20 JKBD O=C(c1cc([N+](=O)[O-])ccc1Oc1ccccc1)N1CCC[C@@H](c2nc(-c3ccc(F)cc3)no2)C1 303156091 UGGSZPNGLFXTTF-GOSISDBHSA-N 488.475 5.596 5 20 JKBD COc1ccc(CSCC(=O)NCc2ccc(-c3nc4ccccc4s3)o2)cc1[N+](=O)[O-] 478703557 OVVQFAUAFKRXMV-UHFFFAOYSA-N 469.544 5.023 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)Nc2ccc(C(=O)N(C)C3CCCCC3)c(Cl)c2)cc1SC 482794711 YJZRWXTXWUALHL-UHFFFAOYSA-N 491.997 5.636 5 20 JKBD O=C(C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)NCc1cccc2c1OCO2 490747442 SCQOKCQBACWZEW-PDGQHHTCSA-N 473.510 5.180 5 20 JKBD C[C@@H](c1cccc(C(F)(F)F)c1)N(C(=O)c1ccc(Sc2nncn2C)c([N+](=O)[O-])c1)C1CC1 502887151 KWOJBVNPFXKWOS-ZDUSSCGKSA-N 491.495 5.259 5 20 JKBD COc1ccc(Br)cc1[C@@H]1CCCN1C(=O)Cn1c2ccccc2c(=O)c2ccccc21 504920013 QBEYEZYQIPPDPM-QHCPKHFHSA-N 491.385 5.290 5 20 JKBD C[C@@H](NC[C@H](c1ccccc1)c1c[nH]c2ccccc12)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 510297340 KCZBSECZZXDHJF-VGOFRKELSA-N 453.502 5.609 5 20 JKBD C[C@H]([C@H]1C[C@H]2CC[C@H]1C2)n1c(SCc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)nnc1-c1ccco1 514298534 PHGCLEVBYBGRMU-WXSAJPJJSA-N 492.561 5.786 5 20 JKBD CN(C)c1ccc(NC(=O)C/C(=C/c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)nc1 519880606 QNYXHJUQHICZED-LGMDPLHJSA-N 459.531 5.235 5 20 JKBD COc1ccc(N(C)C(=O)c2ccc(Sc3nc4ccccc4s3)c([N+](=O)[O-])c2)cc1OC 520702436 LWEKPQJKPRZOSS-UHFFFAOYSA-N 481.555 5.650 5 20 JKBD CCN(C(=O)c1ccc(N[C@H](C)c2ccccn2)c([N+](=O)[O-])c1)[C@@H](C)Cc1ccc(OC)cc1 520914367 KUVCVPQOAASFNG-RBUKOAKNSA-N 462.550 5.265 5 20 JKBD O=C(c1cc(N2CCC[C@@H]2c2ccc(F)c(C(F)(F)F)c2)ccc1[N+](=O)[O-])N1CCCC1 600851002 DUPRUPBTULRVOU-LJQANCHMSA-N 451.420 5.330 5 20 JKBD C[C@@H]1CCC[C@@H](C)N1C(=O)c1cc(Cl)ccc1NC(=O)c1cnn(-c2ccc([N+](=O)[O-])cc2)c1 603738206 GLKJILVWPMAKEZ-HZPDHXFCSA-N 481.940 5.089 5 20 JKBD COCCOc1cc([N+](=O)[O-])c(C(=O)Nc2ccc(Oc3cc(C)cc(C)c3)cc2)cc1OC 604016156 FHWUSFVAUVRHLY-UHFFFAOYSA-N 466.490 5.290 5 20 JKBD O=C(Nc1ccc(Sc2nncs2)cc1)c1cc([N+](=O)[O-])ccc1NCc1ccccc1 604118652 BURALFCUSNYWMF-UHFFFAOYSA-N 463.544 5.462 5 20 JKBD C[C@H]1CCCN(c2ccc(C(=O)Nc3ccc(-c4noc(C(F)(F)F)n4)cc3)cc2[N+](=O)[O-])C1 608875822 VNZAEPUNVOJGRF-ZDUSSCGKSA-N 475.427 5.152 5 20 JKBD CCOC(=O)c1cc(-c2ccccc2)ccc1NC(=O)c1cc(OC)c(OCC)cc1[N+](=O)[O-] 748194076 GWUZQGZCWUHXCB-UHFFFAOYSA-N 464.474 5.098 5 20 JKBD CC(C)Oc1ccc(-c2nc(C(=O)O[C@@H](C)C(=O)Nc3ccc([N+](=O)[O-])cc3Cl)cs2)cc1 749315649 LOFIUFVAPPMBRH-ZDUSSCGKSA-N 489.937 5.343 5 20 JKBD Cc1oc(-c2cccs2)nc1CC(=O)Oc1ccc(NC(=O)c2cccc([N+](=O)[O-])c2)cc1 818826591 ANCMDRKLXYNQPZ-UHFFFAOYSA-N 463.471 5.020 5 20 JKBD O=C(CSc1ccccc1C(=O)Nc1cc([N+](=O)[O-])c(F)cc1F)NC1CCCCCCC1 825487621 GHSRNQRGSDPZNL-UHFFFAOYSA-N 477.533 5.447 5 20 JKBD CC1CCN(c2ccc([N+](=O)[O-])cc2C(=O)Nc2ccc(-c3nnc4n3CCCCC4)cc2)CC1 862003680 NOQADBRQIHZKLY-UHFFFAOYSA-N 474.565 5.068 5 20 JKBD Cc1ccc(NC(=O)Cc2noc(-c3ccc(Sc4nc(C)cs4)c([N+](=O)[O-])c3)n2)cc1 904253413 MRESOKCZMFGITN-UHFFFAOYSA-N 467.532 5.051 5 20 JKBD CN(C(=O)c1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2N2CCCC2)cc1Cl)C1CCCCC1 918644309 WSWDEQWICFKAKN-UHFFFAOYSA-N 484.984 5.505 5 20 JKBD Cc1cccc2cc(C(=O)NC3(c4ccc(NC(=O)/C=C/c5ccc([N+](=O)[O-])o5)cc4)CCC3)[nH]c12 1786207360 DMSQABUJNSZPOY-ZRDIBKRKSA-N 484.512 5.439 5 20 JKBD O=C(/C=C/c1ccc([N+](=O)[O-])o1)Nc1ccc(C2(NC(=O)c3ccc4scnc4c3)CCC2)cc1 1786207527 VEWPOBOTACPIRB-JXMROGBWSA-N 488.525 5.259 5 20 JKBD CN(C)c1ccc([N+](=O)[O-])c(C(=O)Nc2ccc(C3(NC(=O)c4cc5ccccc5o4)CCC3)cc2)c1 1790055737 NLKPFGZBSSJDTQ-UHFFFAOYSA-N 498.539 5.469 5 20 JKBD Cc1[nH]ccc1C(=O)NC1(c2ccc(NC(=O)c3cccc(Br)c3[N+](=O)[O-])cc2)CCC1 1790751447 FWWQDHIRBMYLJL-UHFFFAOYSA-N 497.349 5.055 5 20 JKBD O=C(/C=C/c1ccccc1[N+](=O)[O-])Nc1ccc(C2(NC(=O)c3nc4ccccc4o3)CCC2)cc1 1792317215 BTGDHMXUDVTCLE-XNTDXEJSSA-N 482.496 5.197 5 20 JKBD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C1(c2cccc([N+](=O)[O-])c2)CCC1)c1cc2sccc2s1 1800040750 DKXQDYONPFUZRE-BCDXTJNWSA-N 495.626 5.245 5 20 JKBD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc2cc([N+](=O)[O-])ccc2s1)c1cccc2ccccc12 1801206609 CESAKPLSDUUXMH-ACDBMABISA-N 485.565 5.528 5 20 JKBD Cc1ccc([C@H](C)C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)cc1 1801206752 HOJYOZJECTXDRO-DVWBAYGPSA-N 477.586 5.173 5 20 JKBD CC(C)(C)CCCCCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)/C=C/c1ccccc1[N+](=O)[O-])C2 1801833729 UZFYIXAMBAJGRH-CSXHJAHVSA-N 455.599 5.243 5 20 JKBD Cc1c(C(=O)NC[C@@H]2CCN(C(=O)/C=C/C3CCCC3)[C@H]2c2cccnc2)cc(Cl)cc1[N+](=O)[O-] 1811797636 VIJCLTYMBKDPLG-JJHGBTGXSA-N 496.995 5.018 5 20 JKBD O=C(Cc1ccccc1)Nc1cc([C@@H]2CCCCN2C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)[nH]n1 1816892829 PLZBNRQVXUSKEJ-FQEVSTJZSA-N 489.557 5.081 5 20 JKBD CC(C)(C)CCCCCC(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2ccc(O)c([N+](=O)[O-])c2)n[nH]1 1821046085 AGYQMGLMORAGEY-LJQANCHMSA-N 485.585 5.326 5 20 JKBD CCC1(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)c3cc4cc([N+](=O)[O-])ccc4s3)n[nH]2)CCC1 1821609667 KGMMRHWUJFTYKJ-GOSISDBHSA-N 481.578 5.419 5 20 JKBD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2sccc2F)[nH]n1)c1cc2cc([N+](=O)[O-])ccc2s1 1821612361 VVDUXQKXTJFJMF-INIZCTEOSA-N 499.549 5.353 5 20 JKBD Cc1c(C(=O)N2CCC([C@H]3CCCCN3C(=O)/C=C/c3ccco3)CC2)cc(Cl)cc1[N+](=O)[O-] 1825266825 NKQKHUWBLXAJHH-VQKOGROQSA-N 485.968 5.096 5 20 JKBD O=C(CCc1cccc([N+](=O)[O-])c1)N1CCC([C@H]2CCCCN2C(=O)Cc2ccc(Cl)cc2)CC1 1826500058 IMWFQURFRHPNMJ-RUZDIDTESA-N 498.023 5.043 5 20 JKBD C[C@@H](C(=O)N1CCCC[C@@H]1C1CCN(C(=O)/C=C/c2ccccc2[N+](=O)[O-])CC1)c1cccs1 1832147778 OELSTTNIWVOEBM-RJHNZLOYSA-N 481.618 5.093 5 20 JKBD COc1cc(-c2nnc(SCc3ccc([N+](=O)[O-])cc3)n2C2CCCCC2)cc(OC)c1OC 8645552 LFEXKPSCDZLKEM-UHFFFAOYSA-N 484.578 5.677 5 20 JKBD CCn1c(S[C@@H](C)C(=O)Nc2ccccc2[N+](=O)[O-])nc2scc(-c3cccs3)c2c1=O 9751456 MAMKAIWYBQDSBE-LBPRGKRZSA-N 486.600 5.234 5 20 JKBD CCn1c(SCC(=O)N[C@H](c2ccccc2)c2cccs2)nc2cc3ccccc3cc2c1=O 19241455 CUUUBWURPQKPML-RUZDIDTESA-N 485.634 5.629 5 20 JKBD C[C@@H](Sc1nnc(-c2cccc(Cl)c2)o1)C(=O)Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1 21547918 XSPVWYIULLOOAE-LLVKDONJSA-N 487.950 5.541 5 20 JKBD O=C(Nc1cc(Cl)cc(Cl)c1)[C@H]1CCCN1C(=O)Cn1c2ccccc2c(=O)c2ccccc21 33097505 QPFRGGAQNXNJGU-HSZRJFAPSA-N 494.378 5.091 5 20 JKBD O=C([C@@H]1C[C@H]1c1cccc(Br)c1)N(Cc1ccccc1[N+](=O)[O-])CC(F)(F)F 195747990 PFVPVTMVMPCTCI-JKSUJKDBSA-N 457.246 5.052 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)Nc2nc(-c3ccc(Br)cc3)cs2)cc1SC 482290560 BRIVSRTXGCXWQA-UHFFFAOYSA-N 480.365 5.464 5 20 JKBD C[C@H](Sc1nc2cc3ccccc3cc2c(=O)n1C)c1nc(O)c2c(-c3ccccc3)csc2n1 495389561 NUMFNYVDRXHCSX-HNNXBMFYSA-N 496.617 6.317 5 20 JKBD Cc1csc(Sc2ccc(C(=O)Nc3ccc(N4CCSCC4)cc3C)cc2[N+](=O)[O-])n1 497321324 WXNICKVIQWXYCP-UHFFFAOYSA-N 486.644 5.625 5 20 JKBD O=C(N[C@@H](c1ccccc1)c1nccs1)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1 505048740 QVSJYMOTFRRPDA-NRFANRHFSA-N 465.918 6.016 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Cl)[C@@H](c1ccccc1)N1CCC[C@@H](c2nccs2)C1 505250354 CKANWUZCBZVJQF-OXQOHEQNSA-N 456.955 5.264 5 20 JKBD C[C@H](Nc1ccc(C(=O)N2CCc3[nH]c4ccc(Cl)cc4c3C2)cc1[N+](=O)[O-])c1ccccn1 507394161 XQOCPCBVQINOFV-HNNXBMFYSA-N 475.936 5.496 5 20 JKBD CCN(C(=O)NCc1ccc(OC)c([N+](=O)[O-])c1)[C@@H]1CCSc2ccc(Br)cc21 508131852 LJQCBNYWGXQSBM-MRXNPFEDSA-N 480.384 5.135 5 20 JKBD O=C(c1c2c(nc3ccccc13)/C(=C/c1cccc([N+](=O)[O-])c1)CCC2)N1CCC(n2cncn2)CC1 509970171 ONSQLTILQPJUGX-HMMYKYKNSA-N 494.555 5.089 5 20 JKBD Cc1nnnn1-c1cccc(NC(=O)C/C(=C\c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)c1 512553759 IPHHUBHKILPXKW-QGOAFFKASA-N 497.540 5.058 5 20 JKBD Cc1csc(Sc2ccc(C(=O)N3CCC(n4c(O)nc5ccccc54)CC3)cc2[N+](=O)[O-])n1 514519547 RJZXXSMTZFICCL-UHFFFAOYSA-N 495.586 5.044 5 20 JKBD CCc1ccccc1N(C(C)=O)c1nc(COc2ccc(-c3ccccc3)cc2[N+](=O)[O-])cs1 516343721 SESDSKFRNFBUGR-UHFFFAOYSA-N 473.554 6.544 5 20 JKBD Cn1ccnc1[C@@H](NCc1ccc(-c2ccc([N+](=O)[O-])cc2Br)o1)c1ccccc1F 518272214 ZBWWPXFCJBYFQQ-NRFANRHFSA-N 485.313 5.369 5 20 JKBD COc1ccccc1N1CCC(NC(=O)c2ccc(NCc3ccccc3Cl)c([N+](=O)[O-])c2)CC1 519938444 GGWINXOVDJBSKJ-UHFFFAOYSA-N 494.979 5.268 5 20 JKBD C[C@@H](NCc1ccc(-c2ccccc2[N+](=O)[O-])s1)c1cc(F)ccc1N1CCN(C)CC1 520214582 LLQACRNSZSEBHS-QGZVFWFLSA-N 454.571 5.065 5 20 JKBD Cc1cc(C(=O)NC2CCCC2)ccc1NC(=O)c1ccc(N[C@H](C)c2ccccn2)c([N+](=O)[O-])c1 520481691 AMJVSMWUFBAJIV-GOSISDBHSA-N 487.560 5.396 5 20 JKBD O=C(Nc1ccc2nc([C@@H]3CCCO3)[nH]c2c1)c1cc([N+](=O)[O-])ccc1NCc1ccccc1 521953944 KILIFXYFVYKKPI-QHCPKHFHSA-N 457.490 5.187 5 20 JKBD O=C(NC1CCN(Cc2ccccn2)CC1)c1cc([N+](=O)[O-])ccc1Sc1ccc(Cl)cc1 603922041 WUZIZILTKSDHKE-UHFFFAOYSA-N 482.993 5.189 5 20 JKBD Cc1ccc(NC(=O)c2ccc(N3CCCN(C(=O)c4ccc(Cl)cc4)CC3)c([N+](=O)[O-])c2)cc1 608974561 KCDPNNKGZQMDNR-UHFFFAOYSA-N 492.963 5.161 5 20 JKBD O=C(O[C@@H](C(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1)c1ccccc1)c1oc2ccccc2c1CO 726018226 UWULKQHYIMNIPJ-OAQYLSRUSA-N 480.860 5.024 5 20 JKBD O=C(c1c2c(nc3ccccc13)/C(=C/c1ccc([N+](=O)[O-])cc1)CCC2)N1CCC(C2OCCO2)CC1 726773397 BMCLYKHGEIFLHV-DYTRJAOYSA-N 499.567 5.245 5 20 JKBD O=C(COC(=O)c1cc(F)ccc1[N+](=O)[O-])Nc1c(Cl)c(Cl)cc(Cl)c1Cl 743210063 LHOIBIICZFSFRN-UHFFFAOYSA-N 456.040 5.143 5 20 JKBD O=C(Nc1cccc(COCCc2ccccc2)c1)c1cc([N+](=O)[O-])ccc1Br 751108732 QQSUZRZSBYWOKH-UHFFFAOYSA-N 455.308 5.369 5 20 JKBD COc1c([N+](=O)[O-])cc(N[C@H]2CCSc3c(F)cccc32)c([N+](=O)[O-])c1Br 836198973 QHUUJNGAELQIBY-JTQLQIEISA-N 458.265 5.062 5 20 JKBD C[C@@H](OC(=O)/C=C\c1ccc(-c2ccc(F)cc2)s1)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 842099940 JRGMHMNASYYBKT-YBEMTRGBSA-N 465.462 5.830 5 20 JKBD Cc1csc(Sc2ccc(C(=O)O[C@@H](C)C(=O)Nc3c(C)cccc3C(C)C)cc2[N+](=O)[O-])n1 849120033 LVLQHMUMHJOJHX-INIZCTEOSA-N 499.614 6.127 5 20 JKBD CN(C)C(=O)c1ccc(Cl)c(NCc2ccc(Oc3ccccc3Cl)c([N+](=O)[O-])c2)c1 863995887 JGIVKRFICOVGIF-UHFFFAOYSA-N 460.317 6.008 5 20 JKBD O=C(Oc1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2Cl)cc1)c1cc2ccccc2c(Cl)n1 915132852 NUGCJJSKIQFGAU-UHFFFAOYSA-N 482.279 5.921 5 20 JKBD O=c1c2cc([N+](=O)[O-])ccc2nc2n1CC/C2=C\c1ccc(Oc2ccccc2Cl)c([N+](=O)[O-])c1 916127373 QRLORUOGAJVZKF-RVDMUPIBSA-N 490.859 5.603 5 20 JKBD CC[C@@H](C)N1C(=O)N[C@@H](c2ccc([N+](=O)[O-])cc2)C(C(=O)Nc2ccccc2C(F)(F)F)=C1C 916169721 HGVVTFYISMSBQT-XCLFUZPHSA-N 476.455 5.391 5 20 JKBD COc1ccc(-c2cc(NC(=O)c3cc([N+](=O)[O-])c(C)c([N+](=O)[O-])c3)ccc2OC(F)F)cc1 917365761 MKTBYSJNUKGAGR-UHFFFAOYSA-N 473.388 5.341 5 20 JKBD CC(C)[C@H](OC(=O)c1cc2cc([N+](=O)[O-])ccc2o1)C(=O)Nc1ccccc1C(F)(F)F 919212621 VISRLOMLBSELQY-SFHVURJKSA-N 450.369 5.180 5 20 JKBD Cc1ccc(/C(O)=C(/C(=S)Nc2cccc3ccccc23)[n+]2cc(O)ccc2C)cc1[N+](=O)[O-] 920483562 YQQRGGIILBYAQI-UHFFFAOYSA-O 472.546 5.681 5 20 JKBD CCOc1ccc(NC(=O)COC(=O)c2csc(-c3ccc(Cl)cc3Cl)n2)c([N+](=O)[O-])c1 921224538 QLPPCYXSMMVWQD-UHFFFAOYSA-N 496.328 5.219 5 20 JKBD CNc1ccc(C(=O)NC2(c3ccc(NC(=O)CCc4cccc([N+](=O)[O-])c4)cc3)CCC2)cc1 1786599905 DDKBDAIJOGDAPH-UHFFFAOYSA-N 472.545 5.017 5 20 JKBD O=C(Cc1ccc(Cl)s1)NC1(c2ccc(NC(=O)c3ccc(O)c([N+](=O)[O-])c3)cc2)CCC1 1790617238 ODHYHVSCBGDIGJ-UHFFFAOYSA-N 485.949 5.006 5 20 JKBD C/C(=C\c1ccc(C)o1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CCCc1cc(C)c(F)cc1[N+](=O)[O-] 1793403560 ZKYAQAQWXDPIGY-NQXDOIETSA-N 497.567 5.008 5 20 JKBD Cc1c(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)CC(C)(C)C)[nH]n2)cc(Cl)cc1[N+](=O)[O-] 1821290658 LVMQKGJZVGVCHJ-KRWDZBQOSA-N 461.950 5.022 5 20 JKBD Cc1c(C(=O)Nc2cc([C@H]3CCCCN3C(=O)C3(F)CCCCC3)[nH]n2)cc(Cl)cc1[N+](=O)[O-] 1821293088 GGQZNIWXOICESI-GOSISDBHSA-N 491.951 5.258 5 20 JKBD O=C(c1ccc([N+](=O)[O-])cc1F)N1CCC([C@H]2CCCCN2C(=O)c2c(F)cccc2Cl)CC1 1829898661 BFOUOOSLMSIXFO-OAQYLSRUSA-N 491.922 5.074 5 20 JKBD O=C(/C=C/c1ccccc1[N+](=O)[O-])N1CCC([C@H]2CCCCN2C(=O)c2cccc(Cl)c2)CC1 1829974290 RRXSTSNSWYJAHD-HRBBJJPOSA-N 481.980 5.195 5 20 JKBD O=C(c1cc(F)cc([N+](=O)[O-])c1)N1CCC([C@H]2CCCCN2C(=O)c2cc(F)ccc2Cl)CC1 1830579037 QDWLVAPJRKTOPP-JOCHJYFZSA-N 491.922 5.074 5 20 JKBD Cc1cc(C(=O)N2CCC([C@@H]3CCCCN3C(=O)c3cc(Cl)cc([N+](=O)[O-])c3C)CC2)cnc1C 1830734565 NOPHZZAOXSIBFD-QHCPKHFHSA-N 499.011 5.116 5 20 JKBD CC(C)C1(C(=O)N2CCCC[C@H]2C2CCN(C(=O)Cc3ccc(Cl)cc3[N+](=O)[O-])CC2)CCC1 1832489075 OVCXTRJGRHCNBW-QFIPXVFZSA-N 490.044 5.237 5 20 JKBD COc1cc(C(=O)Nc2nc(-c3ccc(Cl)cc3)cs2)c([N+](=O)[O-])cc1OC(F)F 10961746 JHLYPMMYPYJPLE-UHFFFAOYSA-N 455.826 5.234 5 20 JKBD COC(=O)c1sc2nc(C)nc(Oc3ccc(NC(=O)c4cccc([N+](=O)[O-])c4)cc3)c2c1C 15131418 LQMZQMUFXOXOCC-UHFFFAOYSA-N 478.486 5.048 5 20 JKBD C[C@H](OC(=O)CCc1ccc(-c2ccccc2F)o1)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 16320458 HCTBSILJSDEAMA-ZDUSSCGKSA-N 494.397 5.516 5 20 JKBD Cc1cccc(-n2ccnc2S[C@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2C(F)(F)F)c1 23083097 IAMCMCHCXZXQRL-CYBMUJFWSA-N 450.442 5.227 5 20 JKBD Cc1csc(Sc2ccc(C(=O)O[C@@H](C)C(=O)Nc3cc(F)ccc3C)cc2[N+](=O)[O-])n1 23968913 XKWDQMWAQZNWCW-ZDUSSCGKSA-N 475.523 5.142 5 20 JKBD Cc1c(NC(=O)[C@H](C)Sc2nnc(SCc3ccc(C(C)C)cc3)s2)cccc1[N+](=O)[O-] 24160945 BRNINAOPUDDMHB-HNNXBMFYSA-N 488.660 6.290 5 20 JKBD COC(=O)C[C@H](NC(=O)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])c(OC)c1)c1cccs1 25196069 KSXRAFWJUKGRSY-HNNXBMFYSA-N 490.921 5.145 5 20 JKBD Cc1cc(C)c(NC(=O)[C@@H](C)Sc2nc3cc4ccccc4cc3c(=O)n2C)c(Cl)c1 26580888 QPGUEAJXJQGFRI-OAHLLOKOSA-N 451.979 5.476 5 20 JKBD O=C(Nc1cccc(CN2CCCC2=O)c1)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1 29290096 YGPILTOYPNMRNP-UHFFFAOYSA-N 465.893 5.415 5 20 JKBD Cc1ccccc1CN(Cc1cccnc1)C(=O)c1ccc(Cn2nc(C)c([N+](=O)[O-])c2C)cc1 108694295 NUPURDCWUKJLEF-UHFFFAOYSA-N 469.545 5.002 5 20 JKBD COc1cc(C(=O)N[C@H]2CCCC[C@H]2Cc2ccccc2)c([N+](=O)[O-])cc1OCc1cscn1 476725641 DQFQTUMFQRHJCI-RXVVDRJESA-N 481.574 5.170 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)N[C@@H](c2cccc(C(F)(F)F)c2)C(C)(C)C)cc1SC 484417732 WKQPSTNOIQTOFA-SFHVURJKSA-N 456.486 5.861 5 20 JKBD CSc1ccc(C(=O)c2ccccc2C(=O)Nc2cc(NC(C)=O)ccc2C)cc1[N+](=O)[O-] 486065959 CAVZVJNCEXSVFV-UHFFFAOYSA-N 463.515 5.067 5 20 JKBD C[C@@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccc(N(C)C(=O)c2ccc(Cl)cc2)cc1 511603987 DEIYGKBHHLYSFM-OAHLLOKOSA-N 469.950 5.644 5 20 JKBD CCCN(C(=O)c1cc(OC)c(OCc2cscn2)cc1[N+](=O)[O-])[C@@H]1CCc2ccccc21 512404179 QVLIWWIRVFXEGP-HXUWFJFHSA-N 467.547 5.179 5 20 JKBD CCCc1nnc(NC(=O)C/C(=C\c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)s1 517461425 JYXQBNGRSBJKHG-NTCAYCPXSA-N 465.560 5.578 5 20 JKBD O=C(Nc1ccc2nc([C@H]3CCCO3)[nH]c2c1)c1cc([N+](=O)[O-])ccc1NCc1ccccc1 521953943 KILIFXYFVYKKPI-HSZRJFAPSA-N 457.490 5.187 5 20 JKBD CC(C)c1ccc(OC2CCN(C(=O)c3csc(-c4cccc([N+](=O)[O-])c4)n3)CC2)cc1 523303225 GQENILFBNOTHAW-UHFFFAOYSA-N 451.548 5.525 5 20 JKBD CC(C)(C)c1ccc(C(=O)N2CCC(C(=O)Nc3ccccc3Br)CC2)cc1[N+](=O)[O-] 523854068 XYKMTXZTHPCXQD-UHFFFAOYSA-N 488.382 5.146 5 20 JKBD Cc1ccc(-c2csc(N(C(=O)CCn3cc([N+](=O)[O-])cn3)c3cc(C)ccc3C)n2)cc1 557765792 HYZWTLNQYXJVPA-UHFFFAOYSA-N 461.547 5.595 5 20 JKBD CC1CCN(c2ccc(C(=O)Nc3ccc(C(=O)N4CCCCCC4)cc3)cc2[N+](=O)[O-])CC1 603990421 BZPONBPZRVGSTM-UHFFFAOYSA-N 464.566 5.100 5 20 JKBD Cc1ccc(NC(=O)c2cccc(C(F)(F)F)c2)cc1NC(=O)CCNc1ccccc1[N+](=O)[O-] 604449379 JXLDTVOAJBFQCR-UHFFFAOYSA-N 486.450 5.615 5 20 JKBD C[C@H](Nc1ccc(C(=O)N(C)C[C@@H]2CCCO[C@@H]2c2ccccc2)cc1[N+](=O)[O-])c1ccccn1 604519715 QVKKTBVHJPANCR-NDIWIEOSSA-N 474.561 5.403 5 20 JKBD Cc1ccc(CNC(=O)c2cccc(CNCc3ccc(-c4ccc([N+](=O)[O-])cc4)o3)c2)cc1 608835985 FBYJOEPMUDLRHP-UHFFFAOYSA-N 455.514 5.383 5 20 JKBD CCCOCc1ccccc1CNCc1ccc(-c2ccc([N+](=O)[O-])cc2Br)o1 608836208 OOYCJDCTTMXMQG-UHFFFAOYSA-N 459.340 5.834 5 20 JKBD O=C(c1c2c(nc3ccccc13)/C(=C/c1ccc([N+](=O)[O-])cc1)CCC2)N1CCC[C@H](n2ccnc2)C1 609131170 JJPCPTUNQSPRNI-WTKRLXQWSA-N 493.567 5.694 5 20 JKBD CC(C)c1nnc(COC(=O)c2c3c(nc4ccccc24)/C(=C\c2cccc([N+](=O)[O-])c2)CCC3)o1 726993220 UIOHNORKFUJCOQ-AQTBWJFISA-N 484.512 5.883 5 20 JKBD O=C(CC1CCCCC1)NC1CCC(C(=O)N(CC2CC2)c2ccc(Cl)c([N+](=O)[O-])c2)CC1 728164866 AKNXIMSWCHIITQ-UHFFFAOYSA-N 476.017 5.637 5 20 JKBD CC(C)[C@@H](CC(=O)O[C@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F)c1ccccc1 728640647 XHJJYVLWJKSPBL-RHSMWYFYSA-N 452.429 5.314 5 20 JKBD Cc1ccc(-c2nc(C)c(C(=O)O[C@@H](C)C(=O)Nc3cccc([N+](=O)[O-])c3C)s2)c(C)c1 746597633 RQHYWQVUHREAGF-INIZCTEOSA-N 453.520 5.136 5 20 JKBD CC(C)[C@@H](OC(=O)c1csc(-c2cccc([N+](=O)[O-])c2)n1)C(=O)N1CCSc2ccccc21 747961626 GVXGUVNPXYDHCZ-HXUWFJFHSA-N 483.571 5.039 5 20 JKBD O=C(C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)OCC(=O)c1ccccc1F 748579033 IBVNTCQQRLAIQL-GHRIWEEISA-N 476.485 5.700 5 20 JKBD Cc1c(C(=O)N[C@H](C)c2ccc(NC(=O)Nc3ccccc3)cc2)cc([N+](=O)[O-])c(C)c1[N+](=O)[O-] 748712869 ICAOSRJVZIARFG-MRXNPFEDSA-N 477.477 5.255 5 20 JKBD O=C1CC[C@H](c2noc(-c3ccc(Sc4ccc([N+](=O)[O-])cc4)cc3)n2)CN1CC1CCCC1 856574579 SOCUGOAUIUXUOB-IBGZPJMESA-N 478.574 5.692 5 20 JKBD COc1ccccc1[C@@H](NCc1ccc(Oc2ccc(F)cc2)c([N+](=O)[O-])c1)c1nccn1C 915226919 VTYZUVNNFYJEKN-XMMPIXPASA-N 462.481 5.148 5 20 JKBD CC(C)N(Cc1nnc(-c2cccc([N+](=O)[O-])c2)o1)C(=O)c1cc(C2CC2)nc2ccccc12 917206160 VJCWXOYVXFQNMD-UHFFFAOYSA-N 457.490 5.121 5 20 JKBD CC(=O)N(c1nc(COC(=O)c2cc([N+](=O)[O-])cc([N+](=O)[O-])c2C)cs1)c1c(C)cc(C)cc1C 919225410 DUNQWPFPKRGFEN-UHFFFAOYSA-N 498.517 5.235 5 20 JKBD Cc1cc(O[C@H](C)C(=O)O[C@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2C(F)(F)F)ccc1C(C)C 919406747 FEUGEBRCOTYRKH-HUUCEWRRSA-N 482.455 5.383 5 20 JKBD C[C@@H](Nc1ccc(C(=O)Oc2ccc(NC(=O)c3cccs3)cc2)cc1[N+](=O)[O-])c1ccccn1 919678985 JSVPMNXAFOLICV-MRXNPFEDSA-N 488.525 5.696 5 20 JKBD C[C@H](SCc1ncc(-c2ccc(Cl)cc2)o1)C(=O)O[C@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1 920671054 KNXIHNWCHAUVPP-KGLIPLIRSA-N 489.937 5.095 5 20 JKBD C[C@H](CC(=O)O[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Br)c1ccccc1)C1CC1 920721638 GSPLGKCOMJVRSI-XCLFUZPHSA-N 461.312 5.017 5 20 JKBD C[C@@H](C(=O)Nc1ccc(C2(NC(=O)c3cc4cc([N+](=O)[O-])ccc4s3)CCC2)cc1)n1ccnc1 1786234631 BKVDNXZPTROVKE-INIZCTEOSA-N 489.557 5.015 5 20 JKBD Cc1cc(C(=O)NC2(c3ccc(NC(=O)Cn4ccc5ccc([N+](=O)[O-])cc54)cc3)CCC2)ccc1O 1786276919 PURLKGBGCFFOAU-UHFFFAOYSA-N 498.539 5.011 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)c3cccc(F)c3[N+](=O)[O-])CCC2)cc1)c1cc(C(F)(F)F)c[nH]1 1788721576 PSCMJUMCRTWDNU-UHFFFAOYSA-N 490.413 5.142 5 20 JKBD O=C(NC1(c2ccc(NC(=O)c3cccc4cccnc34)cc2)CCC1)c1cccc(F)c1[N+](=O)[O-] 1788913590 PDEWAHHWTUUWFB-UHFFFAOYSA-N 484.487 5.344 5 20 JKBD COc1ccc(/C=C(\C)C(=O)Nc2ccc(C3(NC(=O)c4ccc([N+](=O)[O-])o4)CCC3)cc2)cc1 1791120812 CGRORCVZKGGASN-WUKNDPDISA-N 475.501 5.048 5 20 JKBD O=C(/C=C/c1ccc([N+](=O)[O-])o1)N1CCCC2(CCN(C(=O)c3cc4cccc(F)c4s3)CC2)C1 1805684782 WXLZSYCSGAXGEW-FNORWQNLSA-N 497.548 5.100 5 20 JKBD C/C(=C\c1cccs1)C(=O)N1CCCC[C@H]1C1CCN(C(=O)Cc2ccc([N+](=O)[O-])cc2F)CC1 1823720163 SJDWNCWHVRXABO-UFIOJNINSA-N 499.608 5.061 5 20 JKBD Cc1ccc([C@@H](C)C(=O)N2CCC([C@@H]3CCCCN3C(=O)c3cc(F)cc([N+](=O)[O-])c3)CC2)cc1 1830615428 FASARTVUVSYMDJ-CLOONOSVSA-N 481.568 5.079 5 20 JKBD Cc1cc(O)c([N+](=O)[O-])cc1C(=O)N1CCC([C@@H]2CCCCN2C(=O)C[C@@H](C)c2ccccc2)CC1 1831510059 QFBVEVNQFZBDIS-DVECYGJZSA-N 493.604 5.036 5 20 JKBD Cc1cc(C)cc(C(=O)N2CCC([C@H]3CCCCN3C(=O)CSc3ccccc3[N+](=O)[O-])CC2)c1 1831777373 QUHKXVYSVBKULV-HSZRJFAPSA-N 495.645 5.237 5 20 JKBD Cc1cccc([N+](=O)[O-])c1NC(=O)COC(=O)c1c(C)c(-c2ccccc2)nc2ccccc12 10444793 XOLQOSBURJMOMI-UHFFFAOYSA-N 455.470 5.222 5 20 JKBD CCOc1ccc([C@H](C)N[C@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Br)c2ccccc2)cc1 11707800 ZATCFHCSYAKQMW-HJPURHCSSA-N 498.377 5.787 5 20 JKBD O=C(c1ccc([N+](=O)[O-])cc1)N(C[C@H]1CCCO1)c1nc(-c2ccc(Cl)cc2Cl)cs1 14819633 PMHIDSCGXPZPGG-MRXNPFEDSA-N 478.357 5.851 5 20 JKBD COc1cc(NC(=O)CSc2ccc(C(F)(F)F)cc2[N+](=O)[O-])c(OC)cc1Cl 15474914 HOWAKOKBRNBECI-UHFFFAOYSA-N 450.822 5.015 5 20 JKBD CC(C)c1ccc(-c2nc(CC(=O)O[C@H](C)c3nnc(-c4ccc([N+](=O)[O-])cc4)o3)cs2)cc1 17726178 PDHMNZVMXLVIOM-OAHLLOKOSA-N 478.530 5.739 5 20 JKBD COc1ccc(-c2nnc(S[C@H](C)C(=O)Nc3cccc([N+](=O)[O-])c3C)n2C2CCCCC2)cc1 23417528 SVTJQJVRHGPFPQ-QGZVFWFLSA-N 495.605 5.795 5 20 JKBD O=C(C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)NCc1ccc(Cl)s1 25913308 GZHUIPXKIOXJJB-PTNGSMBKSA-N 469.975 6.167 5 20 JKBD O=C(Nc1ccccc1C(=O)N1CCCCC1)c1ccc(NCc2ccccc2)c([N+](=O)[O-])c1 27917642 MBECDFSJHWIXHQ-UHFFFAOYSA-N 458.518 5.085 5 20 JKBD COc1ccc(-c2nnc(SCc3nc(-c4cccc([N+](=O)[O-])c4)no3)n2C2CCCCC2)cc1 31842188 MZSKOCAKOGADNL-UHFFFAOYSA-N 492.561 5.709 5 20 JKBD C[C@@H](Sc1nnc(-c2ccncc2)n1Cc1ccccc1)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl 253494548 XYABYGOTPRIDNO-OAHLLOKOSA-N 494.964 5.069 5 20 JKBD O=C(c1csc(-c2cccc([N+](=O)[O-])c2)n1)N(C[C@@H]1CCCO1)c1nc2ccccc2s1 302977573 CJUNOWINGTUMJO-INIZCTEOSA-N 466.544 5.154 5 20 JKBD CCCCN(C(=O)Cn1cc([N+](=O)[O-])ccc1=O)c1nc(-c2ccc(Cl)cc2Cl)cs1 499305582 HBPWQXBNHMJLRF-UHFFFAOYSA-N 481.361 5.020 5 20 JKBD C[C@@H](Nc1ccc(C(=O)Nc2cc(Cl)c(Cl)cc2Cl)cc1[N+](=O)[O-])c1ccccn1 506159623 IXQAMWXGOYSATF-LLVKDONJSA-N 465.724 6.375 5 20 JKBD O=C(C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)N1CCCC[C@@H]1c1ncc[nH]1 509974898 ZSCXDTHFWGHAMA-BKBDBRRMSA-N 473.558 5.612 5 20 JKBD O=C(Nc1ccc(Br)c(C(F)(F)F)c1)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-] 515532392 COWNOQJMNZEYLH-UHFFFAOYSA-N 487.150 5.570 5 20 JKBD O=[N+]([O-])c1ccc(-c2ccc(CN[C@H](CC(F)(F)F)c3ccccc3)o2)c(Br)c1 517534187 NJDAHKFDKIFWDL-GOSISDBHSA-N 469.257 6.401 5 20 JKBD COc1ccc(NC(=O)c2ccc(OCc3ccc(Br)s3)c(OC)c2)c([N+](=O)[O-])c1 603637504 SAOXNACELJCVFZ-UHFFFAOYSA-N 493.335 5.267 5 20 JKBD COc1cc(/C=C2/CCn3c2nc2cc(Cl)ccc2c3=O)ccc1OCc1ccc([N+](=O)[O-])cc1 603781347 LUGWQJHDROVESX-PDGQHHTCSA-N 489.915 5.490 5 20 JKBD Cc1ccc(-c2noc(CCC(=O)Nc3nc(-c4ccc(C)c([N+](=O)[O-])c4)cs3)n2)cc1F 604115095 FIWIHQJSHVOULE-UHFFFAOYSA-N 467.482 5.096 5 20 JKBD C[C@@H](Nc1ccc(C(=O)Nc2ccc(-c3cn4cccnc4n3)cc2)cc1[N+](=O)[O-])c1ccccn1 604338031 DVEDFXGEHUXOFR-QGZVFWFLSA-N 479.500 5.125 5 20 JKBD C[C@@H](Sc1nnc(Cc2c(F)cccc2Cl)o1)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 608929575 FGKUTMLIWFYJGQ-SNVBAGLBSA-N 461.862 5.264 5 20 JKBD COc1cc(C(=O)OCC(=O)Nc2c(Cl)c(Cl)cc(Cl)c2Cl)ccc1[N+](=O)[O-] 725948655 PXFXVEOBIZTLSZ-UHFFFAOYSA-N 468.076 5.013 5 20 JKBD C[C@H](NCc1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1)c1ccc2c(c1)CCC(=O)N2 726607704 XLMMHJCKAYBQTN-SFHVURJKSA-N 467.529 5.183 5 20 JKBD O=C(OC[C@@H]1CCCN1C(=O)c1ccccc1[N+](=O)[O-])[C@H]1CC=CC[C@H]1c1nc2ccccc2s1 730704918 WHPYOLYMIOBJHS-OTWHNJEPSA-N 491.569 5.102 5 20 JKBD COc1cc(C(=O)O[C@H](C)c2ccc3c(c2)CC(=O)N3)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 748517800 QYWRZJKTBLKQEG-CYBMUJFWSA-N 482.876 5.462 5 20 JKBD CCOc1cc(-c2nc(-c3cccc(Cn4cnc5ccccc54)c3)no2)c([N+](=O)[O-])cc1OC 904491460 WBLNDFINAMHCNG-UHFFFAOYSA-N 471.473 5.117 5 20 JKBD C[C@H](OC(=O)/C=C/c1ccccc1OC(F)(F)F)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 914944096 YWELYLRXVUGHIC-LAHYYIKRSA-N 492.328 5.096 5 20 JKBD Cc1ccc(C(=O)N(C)Cc2cc([N+](=O)[O-])ccc2Cl)cc1NC(=O)c1ccccc1F 915289529 GZHYUFSHRBJGAB-UHFFFAOYSA-N 455.873 5.220 5 20 JKBD O=C(Nc1ccccc1SC[C@@H]1CC1(Cl)Cl)[C@H]1CC(=O)N(c2ccc(F)c([N+](=O)[O-])c2)C1 917751783 OUTZOOKFNMLZIP-STQMWFEESA-N 498.363 5.011 5 20 JKBD Cc1nc(NC(=O)c2ccc(N[C@H](C)c3ccccn3)c([N+](=O)[O-])c2)sc1-c1ccccc1 919745357 NBQMTRBZMBAQEB-OAHLLOKOSA-N 459.531 5.847 5 20 JKBD Cc1ncc(C(=O)NC2(c3ccc(NC(=O)Cc4ccc(Cl)cc4[N+](=O)[O-])cc3)CCC2)s1 1786116569 RICQNTJJWQHUET-UHFFFAOYSA-N 484.965 5.004 5 20 JKBD O=C(Cc1cc([N+](=O)[O-])ccc1F)Nc1ccc(C2(NC(=O)c3scnc3C3CC3)CCC2)cc1 1786672954 WKKRPYIKVBMSFA-UHFFFAOYSA-N 494.548 5.058 5 20 JKBD Cc1onc(-c2ccccc2)c1C(=O)Nc1ccc(C2(NC(=O)c3ccc([N+](=O)[O-])o3)CCC2)cc1 1787265746 BEOIUTXPKQRFRX-UHFFFAOYSA-N 486.484 5.213 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)c3cccc4cnccc34)CCC2)cc1)c1ccc([N+](=O)[O-])cc1F 1790621731 FCUBMTPJQYYUFF-UHFFFAOYSA-N 484.487 5.344 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)c3cccc4ncccc34)CCC2)cc1)c1cccc(F)c1[N+](=O)[O-] 1790698611 CSJJKSRUEGZRIF-UHFFFAOYSA-N 484.487 5.344 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)[C@@H](F)c3ccccc3)CCC2)cc1)c1cccc(F)c1[N+](=O)[O-] 1790699878 RDPLLBBTNHWKTL-NRFANRHFSA-N 465.456 5.192 5 20 JKBD COc1cccc(Cl)c1C(=O)Nc1ccc(C2(NC(=O)c3ccc(O)c([N+](=O)[O-])c3)CCC2)cc1 1792145967 DHVSRQSJLPPIAB-UHFFFAOYSA-N 495.919 5.024 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2ccc(Cl)cc2)CC1 1830028078 RXRZYWCQIMZOEZ-QFIPXVFZSA-N 487.959 5.243 5 20 JKBD Cc1ccc(CC(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3cccc(Cl)c3)CC2)cc1[N+](=O)[O-] 1830365092 MRMNNESXUWFZHD-HSZRJFAPSA-N 483.996 5.033 5 20 JKBD Cc1ccc(-c2nc(C)sc2CC(=O)Nc2nc(-c3cccc([N+](=O)[O-])c3)cs2)cc1 14376432 JRJWYGSZIDPBDR-UHFFFAOYSA-N 450.545 5.640 5 20 JKBD C[C@H](N[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Br)c1ccccc1)c1ccccc1 21818279 UUJNCBDMTOURNE-YCRPNKLZSA-N 454.324 5.388 5 20 JKBD C[C@H](OC(=O)c1ccc(NCc2ccccc2)c([N+](=O)[O-])c1)C(=O)N1CCC[C@@H]1c1cccs1 23768364 WVNBTQIPLQFBHO-LAUBAEHRSA-N 479.558 5.177 5 20 JKBD CSc1ccc(C(=O)c2ccccc2C(=O)Nc2ccc(C(=O)NC(C)(C)C)cc2)cc1[N+](=O)[O-] 27132663 CKMYOXSSYUKELC-UHFFFAOYSA-N 491.569 5.328 5 20 JKBD COc1ccccc1CN(C)[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Br)c1ccccc1 32800062 RHFVAZDPZFMFMX-QFIPXVFZSA-N 484.350 5.178 5 20 JKBD O=C(Nc1ccc(N2CCCC2=O)cc1)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1 32814285 LILPLTDYGVNQFY-UHFFFAOYSA-N 451.866 5.420 5 20 JKBD CCN(c1ccccc1)S(=O)(=O)c1ccc(N2CCC(OC3CCCCC3)CC2)c([N+](=O)[O-])c1 496185427 FZBRXZJBISLYBC-UHFFFAOYSA-N 487.622 5.128 5 20 JKBD C[C@@H](Nc1ccc(C(=O)N2CCN(c3cccc(C(F)(F)F)c3)CC2)cc1[N+](=O)[O-])c1ccccn1 506098963 HWUQTNPCTMWMRX-QGZVFWFLSA-N 499.493 5.144 5 20 JKBD CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccc(CC(=O)N(C)c2ccccc2)cc1 509235420 MVVCRZWURIZONF-UHFFFAOYSA-N 460.534 5.243 5 20 JKBD Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)c1ccccc1SCC(=O)N(C)C1CCCCC1 515165341 DDZYWARVPZFIIB-UHFFFAOYSA-N 455.580 5.347 5 20 JKBD O=C(Nc1cccc(CNC(=O)c2cc([N+](=O)[O-])ccc2Sc2ccccc2)c1)c1ccccn1 515445266 PZHZRYGOXABEEC-UHFFFAOYSA-N 484.537 5.323 5 20 JKBD Cc1csc(Sc2ccc(C(=O)Nc3ccccc3OCCn3ccnc3)cc2[N+](=O)[O-])n1 519881311 LAGKVIQNUZKHIZ-UHFFFAOYSA-N 481.559 5.039 5 20 JKBD COc1cc(C(=O)NCc2ccccc2Oc2cccc(F)c2)c([N+](=O)[O-])cc1OC(F)F 520804225 FUXRMAOOSXQZKA-UHFFFAOYSA-N 462.380 5.066 5 20 JKBD O=C(NCCCn1ccnc1)c1c2c(nc3ccccc13)/C(=C/c1ccc([N+](=O)[O-])cc1)CCC2 590781130 KNHVZCQUNHVLGQ-LVZFUZTISA-N 467.529 5.037 5 20 JKBD CN(Cc1ccccc1NC(=O)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-])C1CCCCC1 603735150 VMKSTGMREWWGTD-UHFFFAOYSA-N 465.472 5.553 5 20 JKBD O=[N+]([O-])c1cnc2ccc(Br)cc2c1N1C[C@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1 604270720 NNUWBPDTSSIKNQ-RKDXNWHRSA-N 472.183 5.473 5 20 JKBD Cc1sc(NC(=O)C2CCN(c3nc4ccccc4s3)CC2)nc1-c1cccc([N+](=O)[O-])c1 608940121 VRPPRKGWSRSQCZ-UHFFFAOYSA-N 479.587 5.492 5 20 JKBD C[C@H]1C[C@@H](C)CN(c2ccc(C(=O)N3CCC(c4nc(-c5ccccc5)no4)CC3)cc2[N+](=O)[O-])C1 609141890 PCOVCPCGOIALBB-KDURUIRLSA-N 489.576 5.147 5 20 JKBD CCC[C@@H](NC(=O)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])c(OC)c1)c1ccccn1 609179370 LFDDEFLWNWDRHZ-GOSISDBHSA-N 455.898 5.715 5 20 JKBD O=C1O[C@@H](c2ccccc2)Cc2cc(C(=O)N(CC3CC3)c3ccc(Cl)c([N+](=O)[O-])c3)ccc21 728167318 SOPSWOUGLGBOIQ-XMMPIXPASA-N 476.916 5.759 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)O[C@H](C(=O)Nc2ccccc2C(F)(F)F)C(C)C)cc1SC 728649596 NGMZJCIOOTWYLH-SFHVURJKSA-N 486.468 5.164 5 20 JKBD O=C(COC(=O)c1c(Cl)cccc1[N+](=O)[O-])Nc1c(Cl)c(Cl)cc(Cl)c1Cl 730642703 FQYAESYNXWUYRK-UHFFFAOYSA-N 472.495 5.657 5 20 JKBD O=c1nc(/C(Cl)=C/c2ccc(-c3ccccc3[N+](=O)[O-])o2)[nH]c2cc(C(F)(F)F)ccc12 746015530 YOCRJUMHFTUNIA-GDNBJRDFSA-N 461.783 5.847 5 20 JKBD Cc1nn(Cc2ccc(C(=O)O[C@@H](C)c3ccccc3NC(=O)c3ccccc3)cc2)c(C)c1[N+](=O)[O-] 748019605 ARYSCGCQYHKZJT-FQEVSTJZSA-N 498.539 5.627 5 20 JKBD O=C(COC(=O)C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)Nc1ccccc1F 748579219 KUZLELNXYVEHIN-GHRIWEEISA-N 491.500 5.456 5 20 JKBD C[C@@H](OC(=O)COc1ccc(Cl)c2ccccc12)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 749992277 RDMLXLAKPCNSKU-GFCCVEGCSA-N 496.825 5.369 5 20 JKBD Cn1ccnc1Sc1ccc(Cl)cc1NC(=O)c1cc([N+](=O)[O-])ccc1Br 751121310 HUWQBHDHAXPJSN-UHFFFAOYSA-N 467.732 5.148 5 20 JKBD CCOc1ccccc1NC(=O)[C@@H](OC(=O)c1c[nH]c2cc([N+](=O)[O-])ccc12)c1ccccc1 756765250 AHXDWGGFLHHKPU-QHCPKHFHSA-N 459.458 5.012 5 20 JKBD Cc1ccccc1-c1noc(CN(c2ccccc2)S(=O)(=O)c2ccc(Cl)c([N+](=O)[O-])c2)n1 849354599 RYVRXKWNHVWEAN-UHFFFAOYSA-N 484.921 5.002 5 20 JKBD COc1ccc(OC(=O)c2cc(-c3cc(OC)c(OC)c(OC)c3)nc3ccccc23)c([N+](=O)[O-])c1 899579605 WIFZELFOSTZRBI-UHFFFAOYSA-N 490.468 5.064 5 20 JKBD COC(=O)c1coc(-c2noc(C/C(=C\c3ccc([N+](=O)[O-])cc3)c3nc4ccccc4s3)n2)c1 904945158 VDMGBKHPWCCMCS-XNTDXEJSSA-N 488.481 5.417 5 20 JKBD O=C(O[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1)c1cc(-c2cccs2)[nH]n1 917259344 HFMDLVOYIGIGHN-FQEVSTJZSA-N 482.905 5.237 5 20 JKBD COc1ccc(CN(C)C(=O)C/C(=C/c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)cc1F 917353917 YLNNLUXOGJTPBP-UYRXBGFRSA-N 491.544 5.942 5 20 JKBD CSc1cc(C(=O)O[C@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2ccccc2)ccc1N 927936180 BECZTGARAUMTPJ-FQEVSTJZSA-N 471.922 5.089 5 20 JKBD O=C(NC1(c2ccc(NC(=O)[C@@H]3CCCCC3(F)F)cc2)CCC1)c1cccc(F)c1[N+](=O)[O-] 1786464741 GRAUBODUZIVYSB-SFHVURJKSA-N 475.467 5.307 5 20 JKBD O=C(Cc1cc(F)ccc1[N+](=O)[O-])Nc1ccc(C2(NC(=O)CCCCn3cccc3)CCC2)cc1 1792308708 CESJWVAUEPGWIQ-UHFFFAOYSA-N 492.551 5.083 5 20 JKBD CC1(C)CCC(CC(=O)NC[C@@H]2CCN(C(=O)c3cccc(F)c3[N+](=O)[O-])[C@@H]2c2cccnc2)CC1 1808901689 IEOWCPUOEYWEAM-GBXCKJPGSA-N 496.583 5.055 5 20 JKBD O=C(Nc1cc([C@H]2CCCCN2C(=O)c2sc3ccccc3c2Cl)[nH]n1)c1ccc([N+](=O)[O-])[nH]1 1820364706 FLWGWWJIQJWQMT-OAHLLOKOSA-N 498.952 5.134 5 20 JKBD O=C(c1cccc(F)c1[N+](=O)[O-])N1CCC([C@H]2CCCCN2C(=O)CCCc2ccccc2F)CC1 1824166598 LHTMMOLEPDBSDT-XMMPIXPASA-N 499.558 5.129 5 20 JKBD Cc1cc(CCCC(=O)N2CCCC[C@@H]2C2CCN(C(=O)[C@]3(C)C[C@H]3C)CC2)c([N+](=O)[O-])cc1F 1824369873 AVSVQAVWXJZFFQ-AUZMWRNASA-N 487.616 5.031 5 20 JKBD O=C(c1ccsc1)N1CCCC[C@@H]1C1CCN(C(=O)C2(c3cccc([N+](=O)[O-])c3)CCC2)CC1 1825795799 WZAHZEBBPNFKTF-HSZRJFAPSA-N 481.618 5.012 5 20 JKBD O=C(/C=C/c1ccccc1[N+](=O)[O-])N1CCC([C@H]2CCCCN2C(=O)c2ccc3cc[nH]c3c2)CC1 1828047924 OKRNFXAREJPGAS-CFQHJMILSA-N 486.572 5.023 5 20 JKBD O=C(/C=C/c1ccccc1[N+](=O)[O-])N1CCC([C@@H]2CCCCN2C(=O)c2ccc3cc[nH]c3c2)CC1 1828047925 OKRNFXAREJPGAS-VSFTXHECSA-N 486.572 5.023 5 20 JKBD O=[N+]([O-])c1cccc(CSc2nnc(Cn3cnc4ccccc43)n2-c2ccccc2Cl)c1 8760930 FMHBNBRMFQCBFD-UHFFFAOYSA-N 476.949 5.519 5 20 JKBD O=C(COC(=O)Cn1c2ccccc2c(=O)c2ccccc21)Nc1c(Cl)cc(Cl)cc1Cl 11275962 LGNTZRWMCLRLQL-UHFFFAOYSA-N 489.742 5.297 5 20 JKBD Cc1cc(Cl)ccc1NC(=O)c1ccc(NS(=O)(=O)c2ccc(Cl)c([N+](=O)[O-])c2)cc1 15625196 BGIUKLBGIZSIPJ-UHFFFAOYSA-N 480.329 5.263 5 20 JKBD O=C(Nc1ccccc1F)C(=Cc1cc([N+](=O)[O-])ccc1Cl)C(=O)Nc1ccccc1F 16441693 FCVWYHQVUOVKRN-UHFFFAOYSA-N 457.820 5.187 5 20 JKBD C[C@@H](Sc1nnc(-c2ccccc2)n1-c1ccc(F)cc1)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 17532879 SEFXUWZAEFLFJE-OAHLLOKOSA-N 488.504 5.885 5 20 JKBD C[C@@H](OC(=O)c1csc(-c2cccc(Cl)c2)n1)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 17981017 HRJRWMXGPVRVSJ-SNVBAGLBSA-N 499.854 5.575 5 20 JKBD COc1ccc([C@H](CNC(=O)COc2ccc(Cl)cc2[N+](=O)[O-])c2c[nH]c3ccccc23)cc1 19047043 ZEMMDYKLWILSTO-FQEVSTJZSA-N 479.920 5.065 5 20 JKBD O=C(CSc1ncnc2sc(-c3ccccc3)cc12)Nc1cc([N+](=O)[O-])ccc1Cl 28416555 UBPWVKFMQNVZOM-UHFFFAOYSA-N 456.936 5.651 5 20 JKBD Cc1ccc(Sc2ccc(C(=O)Nc3ccc4c(c3)NC(=O)CS4)cc2[N+](=O)[O-])cc1 28718204 CRHWYRWMWSNVTI-UHFFFAOYSA-N 451.529 5.351 5 20 JKBD O=C(c1ccc(NCc2ccccc2Cl)c([N+](=O)[O-])c1)N1CCO[C@@H](c2ccc(F)cc2)C1 29115394 DOBRARJXRNGBLC-HSZRJFAPSA-N 469.900 5.213 5 20 JKBD O=[N+]([O-])c1ccccc1CN(Cn1nc(-c2cccs2)n(C2CC2)c1=S)CC(F)(F)F 71966593 BGBADFRKNKEBRC-UHFFFAOYSA-N 469.514 5.408 5 20 JKBD Cc1c(C(C)(C)C)nn(-c2ccccc2)c1NC(=O)C1CCN(c2ccccc2[N+](=O)[O-])CC1 303257285 CQLXJASKGTZPTJ-UHFFFAOYSA-N 461.566 5.242 5 20 JKBD Cc1ccc(NC(=O)C2CCN(c3ccccc3[N+](=O)[O-])CC2)c(-c2nc3ccccc3[nH]2)c1 409615404 JWEZUBMWTZTZLJ-UHFFFAOYSA-N 455.518 5.302 5 20 JKBD O=[N+]([O-])c1ccc(-c2ccc(CN[C@@H](c3ccccc3)c3ccncc3)o2)c(Br)c1 488457411 JOLBZIADMIHSOE-QHCPKHFHSA-N 464.319 5.892 5 20 JKBD COCCN(C(=O)[C@H]1C[C@H]1c1cccc(Cl)c1)c1nc(-c2ccc([N+](=O)[O-])cc2)cs1 494100608 PDKYZUAKTXJYDA-OALUTQOASA-N 457.939 5.155 5 20 JKBD O=C(C1CCN(c2ccccc2[N+](=O)[O-])CC1)N(Cc1ccco1)C12CC3CC(CC(C3)C1)C2 498921863 BASRDGKAYGUHJL-UHFFFAOYSA-N 463.578 5.402 5 20 JKBD C[C@@H](Nc1ccc(C(=O)N2CCCc3cc(Br)cc(F)c32)cc1[N+](=O)[O-])c1ccccn1 502778421 DULCNIXWRIIKSU-CQSZACIVSA-N 499.340 5.658 5 20 JKBD O=C(Nc1cc([N+](=O)[O-])ccc1OC(F)F)[C@@H]1C[C@@H]2CCCC[C@H]2N1C(=O)c1ccc(Cl)cc1 508927860 OVLUKKDLHMXAPU-KYNGSXCRSA-N 493.894 5.262 5 20 JKBD COc1cc(C(=O)N[C@H](c2ccc(Cl)cc2)c2ccsc2)c([N+](=O)[O-])cc1OC(F)F 512750543 WJHLKGWJNHCOHU-GOSISDBHSA-N 468.865 5.439 5 20 JKBD CN(C(=O)c1ccc(NC(=O)C2CCN(c3ccccc3[N+](=O)[O-])CC2)cc1Cl)C1CCCCC1 515614119 KAPKBEDEODUITN-UHFFFAOYSA-N 499.011 5.508 5 20 JKBD CS(=O)(=O)c1ccc(C(=O)Nc2ccc(Oc3ccccc3)cc2C(F)(F)F)cc1[N+](=O)[O-] 520011711 GWGTUXXHDLOSSD-UHFFFAOYSA-N 480.420 5.062 5 20 JKBD COc1ccc(Oc2ccc([N+](=O)[O-])cc2C(=O)N2CCC(N3CCc4ccccc4C3)CC2)cc1 520813533 LBALMOAKZAAKGU-UHFFFAOYSA-N 487.556 5.059 5 20 JKBD O=C(COc1ccccc1[N+](=O)[O-])N(Cc1ccccc1)c1nc(-c2ccc(F)cc2)cs1 603463633 POJOZSACQXDSRI-UHFFFAOYSA-N 463.490 5.470 5 20 JKBD COc1ccc(CN(C)C)cc1NC(=O)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1 603589806 DUDVBMQOIAUPCT-UHFFFAOYSA-N 455.898 5.363 5 20 JKBD CS(=O)(=O)c1ccc2c(c1)N(C(=O)c1ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])cc1)CCC2 604564009 UJTSTKDEYVPPEE-UHFFFAOYSA-N 486.933 5.037 5 20 JKBD CN(C)[C@H](CNCc1ccc(-c2ccc([N+](=O)[O-])cc2Br)o1)c1cccs1 608835515 QCZVULWCKWJTEB-QGZVFWFLSA-N 450.358 5.071 5 20 JKBD C[C@@H](OC(=O)c1csc(-c2cccc(C(F)(F)F)c2)n1)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 725995076 VXLSONXVWAWACA-LLVKDONJSA-N 490.419 5.705 5 20 JKBD COc1ccc(NC(=S)/C(=C(/O)c2cccc([N+](=O)[O-])c2)[n+]2ccc3c(c2)CCCC3)cc1F 726576447 UNWHPYIYZDPIAB-UHFFFAOYSA-O 480.541 5.232 5 20 JKBD CC(=O)Nc1cc(NC(=O)CCC(=O)c2ccc3ccc4cccc5ccc2c3c45)ccc1F 727755089 WMTSPJUSYINDMJ-UHFFFAOYSA-N 452.485 6.283 5 20 JKBD C[C@H](OC(=O)CCSCc1nc(O)c2c3c(sc2n1)CCCC3)c1cccc([N+](=O)[O-])c1 729537518 DZNXRNFINKFJKP-ZDUSSCGKSA-N 473.576 5.112 5 20 JKBD CC(=O)c1cccc(O[C@@H](C)C(=O)O[C@H](C(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)c2ccccc2)c1 745230080 KJJVIGUVZWVRBK-HJPURHCSSA-N 496.903 5.141 5 20 JKBD C[C@H](OC(=O)Cc1csc(-c2ccc(Cl)cc2Cl)n1)C(=O)Nc1ccccc1[N+](=O)[O-] 747258048 FTYXRFHXIKUKEL-NSHDSACASA-N 480.329 5.138 5 20 JKBD CC(=O)NCc1ccc(C(=O)[C@@H](C)OC(=O)c2ccc(Sc3ccc(C)cc3)c([N+](=O)[O-])c2)s1 785318658 XMBVUJRJXHVQNO-OAHLLOKOSA-N 498.582 5.180 5 20 JKBD C[C@@H](Oc1ccc(F)cc1)C(=O)O[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1 825380211 MJWBLHYZWRQXBC-SZNDQCEHSA-N 472.856 5.078 5 20 JKBD O=C1CC[C@H](c2noc(-c3ccc(Nc4ccccc4)c([N+](=O)[O-])c3)n2)CN1CC1CCCC1 856579473 JTFAYYPALAPFRM-IBGZPJMESA-N 461.522 5.285 5 20 JKBD C[C@@H](OC(=O)/C=C\c1ccc2ccc(Cl)cc2n1)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl 912870359 RLRYBCWPSHGNEF-OJIASSBASA-N 460.273 5.033 5 20 JKBD O=C(Nc1ccccc1SC[C@@H]1CC1(Cl)Cl)N1CCN(c2ccccc2[N+](=O)[O-])CC1 916693707 DCSYQKXGCBPMTN-HNNXBMFYSA-N 481.405 5.235 5 20 JKBD O=[N+]([O-])c1cc(S(=O)(=O)C(F)(F)F)ccc1Sc1nnc(-c2ccc3ccccc3c2)o1 917082644 VNOJWEKDDYFDMH-UHFFFAOYSA-N 481.433 5.243 5 20 JKBD CC(=O)N(c1ccc(C)c(C)c1)c1nc(COC(=O)c2cc3cc([N+](=O)[O-])ccc3o2)cs1 919213091 HXOHLTARBXYGNQ-UHFFFAOYSA-N 465.487 5.456 5 20 JKBD C[C@@H](OC(=O)c1[nH]c2ccc(Br)cc2c1Cl)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 919337891 PCFPENXOXOQLTI-SECBINFHSA-N 491.685 5.460 5 20 JKBD C[C@@H](OC(=O)CCCc1ccc(Cl)c(Cl)c1)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 919487942 AVEDMLTXWVIAAR-GFCCVEGCSA-N 450.278 5.579 5 20 JKBD C[C@@H](OC(=O)c1ccc(Br)cc1Cl)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 919493209 PKKCVMSCPKZCDD-MRVPVSSYSA-N 495.635 5.214 5 20 JKBD Cc1cccc(C(C)C)c1NC(=O)COC(=O)c1ccc(N[C@H](C)c2ccccn2)c([N+](=O)[O-])c1 920545797 JLCSEEMZNLMZRF-GOSISDBHSA-N 476.533 5.390 5 20 JKBD O=C(/C=C/c1ccccc1[N+](=O)[O-])NC1(c2ccc(NC(=O)c3ccc(Cl)nc3)cc2)CCC1 1785760705 ONGFSKKBUQQFKX-NTUHNPAUSA-N 476.920 5.104 5 20 JKBD O=C(/C=C/c1ccc([N+](=O)[O-])o1)Nc1ccc(C2(NC(=O)c3cc4cc[nH]c4cc3F)CCC2)cc1 1786207970 WYJQCWDECNDMQC-SOFGYWHQSA-N 488.475 5.269 5 20 JKBD O=C(Cc1cc([N+](=O)[O-])ccc1F)Nc1ccc(C2(NC(=O)CCCC(F)(F)F)CCC2)cc1 1786669643 FFTIHOIIITXNNU-UHFFFAOYSA-N 481.446 5.143 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)NC1(c2ccc(NC(=O)/C=C/c3ccccc3N)cc2)CCC1 1788074330 ZPTKOWZXOBABQB-VGOFMYFVSA-N 488.519 5.086 5 20 JKBD Cc1cc2cccc(C(=O)Nc3ccc(C4(NC(=O)c5ccc([N+](=O)[O-])o5)CCC4)cc3)c2[nH]1 1789015911 TUGAANHXBRZTQE-UHFFFAOYSA-N 458.474 5.039 5 20 JKBD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)Cc1cccc([N+](=O)[O-])c1)c1cc(Cl)c(Cl)c(Cl)c1 1792481121 RUCBRUWQWFZTAD-MUJYYYPQSA-N 496.778 5.050 5 20 JKBD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2cccc3c2oc2ccccc23)[nH]n1)c1ccc([N+](=O)[O-])[nH]1 1820366701 GDWYOBRPKLHHPI-FQEVSTJZSA-N 498.499 5.165 5 20 JKBD O=C(c1ccc(C2CC2)cc1)N1CCC([C@H]2CCCCN2C(=O)c2cc(F)cc([N+](=O)[O-])c2)CC1 1830617523 CZPHOIILBODVCV-RUZDIDTESA-N 479.552 5.158 5 20 JKBD Cc1cc(O)c([N+](=O)[O-])cc1C(=O)N1CCC([C@H]2CCCCN2C(=O)c2ccc(C3CC3)cc2)CC1 1830750302 QMUIIILXUKIVCD-XMMPIXPASA-N 491.588 5.033 5 20 JKBD Cc1c(C(=O)N2CCC([C@H]3CCCCN3C(=O)CCc3ccoc3)CC2)cc(Cl)cc1[N+](=O)[O-] 1832349432 MXIZYOAQPHJOLH-JOCHJYFZSA-N 487.984 5.016 5 20 JKBD C[C@H](C(=O)N1CCCC12CN(C(=O)c1cc3cc([N+](=O)[O-])ccc3s1)C2)c1ccc(Cl)cc1 1841199331 UDOFWZIGTMBMOQ-HNNXBMFYSA-N 483.977 5.084 5 20 JKBD COc1ccc(-c2nc(C)c(C(=O)O[C@H](C)c3nnc(-c4ccc([N+](=O)[O-])cc4)o3)s2)cc1 19619728 QYGBCBWGWLXHEB-CYBMUJFWSA-N 466.475 5.003 5 20 JKBD CO[C@H](C)c1cccc(NC(=O)C2CCN(c3ccc(C(F)(F)F)cc3[N+](=O)[O-])CC2)c1 303153787 NGYZKEWLEVMOGT-CQSZACIVSA-N 451.445 5.176 5 20 JKBD CC(C)NC(=O)Cc1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2Sc2ccc(Cl)cc2)cc1 482446634 LMBPDFOZTAKQOF-UHFFFAOYSA-N 483.977 5.719 5 20 JKBD CCN(CC)C(=O)Cc1ccc(NC(=O)c2ccc(Sc3nc(C)cs3)c([N+](=O)[O-])c2)cc1 482560955 YVEAVTUDDOFKTR-UHFFFAOYSA-N 484.603 5.174 5 20 JKBD CCOc1cc(C(=O)N(C/C=C\c2ccccc2)c2ccc3c(c2)OCCO3)c([N+](=O)[O-])cc1OC 503149889 RBYKWQRZPLFCEG-YFHOEESVSA-N 490.512 5.134 5 20 JKBD COc1ccc([N+](=O)[O-])cc1CN[C@H](c1ccc(F)cc1)c1ccccc1I 504245998 XTEZLKPOXMCOBG-OAQYLSRUSA-N 492.288 5.226 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Br)[C@@H](NCc1cc2ccccc2s1)c1ccccc1 512912663 QERJHYVJZYYCRP-QFIPXVFZSA-N 496.386 6.042 5 20 JKBD CC1CCN(CCCCNC(=O)C/C(=C\c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)CC1 516325632 PTFKWMWQMCNJQM-RELWKKBWSA-N 492.645 5.764 5 20 JKBD COc1ccc([C@H](C)N[C@@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Br)c2ccccc2)cc1 521153042 JPJAUBQVIDNSQB-OYHNWAKOSA-N 484.350 5.397 5 20 JKBD CCN(C(=O)[C@@H](C)Sc1ccc([N+](=O)[O-])cc1)[C@@H](c1cccnc1)c1ccc(F)c(C)c1 521452056 NYOFKJFFUYWGDF-UZUQRXQVSA-N 453.539 5.556 5 20 JKBD O=C(Nc1nc(-c2ccc(Cl)cc2Cl)cs1)c1cc([N+](=O)[O-])cc2c1OCCO2 524289968 NDNSTYSVEAEXQX-UHFFFAOYSA-N 452.275 5.049 5 20 JKBD Cc1ccc(Sc2ccc(CNCc3cccc(S(=O)(=O)NC(C)C)c3)cc2[N+](=O)[O-])cc1 559871601 VNWBZJJUPRXLNZ-UHFFFAOYSA-N 485.631 5.031 5 20 JKBD Cn1c(CNC(=O)C/C(=C/c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)nc2ccccc21 590629430 INANSJCZHOMCND-JXAWBTAJSA-N 483.553 5.338 5 20 JKBD COc1cccc(CC(=O)N2CCc3ccc(NCc4ccc(C(F)(F)F)cc4[N+](=O)[O-])cc32)c1 600854680 WSLRHDTZUCRWEF-UHFFFAOYSA-N 485.462 5.366 5 20 JKBD O=C(c1cc(Br)cc(NCc2ccc(C(F)(F)F)cc2[N+](=O)[O-])c1)N1CCCC1 600858254 MCIYYPSKKVYROA-UHFFFAOYSA-N 472.261 5.224 5 20 JKBD COc1cc(OC)c(C2CCN(c3ccc(C(=O)c4ccccc4)cc3[N+](=O)[O-])CC2)c(OC)c1 603848843 XZJJROMUEWCXEW-UHFFFAOYSA-N 476.529 5.236 5 20 JKBD O=C(Nc1ccccn1)[C@@H]1CCCN(C(=O)c2cc([N+](=O)[O-])ccc2Sc2ccc(Cl)cc2)C1 604106036 ISWNDZALMICAFU-MRXNPFEDSA-N 496.976 5.285 5 20 JKBD Cc1ccc([N+](=O)[O-])cc1C(=O)N(C[C@H]1CCCO1)c1nc(-c2cccc(C(F)(F)F)c2)cs1 604470111 YEBNEGTWSIJXIP-GOSISDBHSA-N 491.491 5.871 5 20 JKBD Cc1nn(Cc2ccc(C(=O)N3CCCC[C@H]3c3cc4ccccc4[nH]3)cc2)c(C)c1[N+](=O)[O-] 609381588 QPQXCNJPLLWKGJ-DEOSSOPVSA-N 457.534 5.305 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])c(Cl)c1)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 727711978 SYEWMYCHJBFYDF-UHFFFAOYSA-N 472.807 5.030 5 20 JKBD O=C(CCC(=O)c1ccc2ccc3cccc4ccc1c2c34)NC1CCN(c2ccccn2)CC1 727766504 AHQSZUYZLBHYGE-UHFFFAOYSA-N 461.565 5.727 5 20 JKBD CC(=O)N(c1nc(COC(=O)c2cc(C)cc([N+](=O)[O-])c2N)cs1)c1c(C)cc(C)cc1Cl 727901503 YHRHINSZFVISLI-UHFFFAOYSA-N 488.953 5.254 5 20 JKBD COc1ccccc1NC(=O)c1cc2ccccc2cc1OC(=O)Cc1ccc(OC)c([N+](=O)[O-])c1 727953263 CCVWSVPXSWYDKM-UHFFFAOYSA-N 486.480 5.166 5 20 JKBD C[C@H](OC(=O)[C@@H](C)Oc1ccccc1Cc1ccccc1)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 728352034 WGAGZJDOOHGLNN-ZWKOTPCHSA-N 473.485 5.307 5 20 JKBD CC(C)(C)OC(=O)Nc1ccc(NC(=O)CSc2ccc(C(F)(F)F)cc2[N+](=O)[O-])cc1 729401403 PKDNEQCSEYZGDX-UHFFFAOYSA-N 471.457 5.691 5 20 JKBD O=C(OCC1CCN(c2ccc([N+](=O)[O-])cn2)CC1)c1nc(-c2ccccc2)oc1-c1ccccc1 731416310 PUMKOVSNCZRCKN-UHFFFAOYSA-N 484.512 5.385 5 20 JKBD CCOC(=O)/C=C/c1ccc(NC(=O)C2CCN(c3ccc(C(F)(F)F)cc3[N+](=O)[O-])CC2)cc1 759307888 YLNADFNCWLZKIJ-BJMVGYQFSA-N 491.466 5.045 5 20 JKBD O=C(CC[C@H]1Cc2ccccc2NC1=O)Nc1cc(Cl)c([N+](=O)[O-])cc1OCc1ccccc1 818893746 DLFYTBVIFQOGBZ-SFHVURJKSA-N 479.920 5.357 5 20 JKBD O=C(Nc1ccc(Cl)cc1Cl)[C@@H]1CCCCN1C(=O)c1cc([N+](=O)[O-])ccc1Cl 915159700 UJKXBBLZVGICJY-KRWDZBQOSA-N 456.713 5.188 5 20 JKBD COc1cc([C@H](C)Nc2c([N+](=O)[O-])cc(C(F)(F)F)cc2[N+](=O)[O-])ccc1OCc1ccncc1 917085582 VUOJHRGNMSPATN-ZDUSSCGKSA-N 492.410 5.678 5 20 JKBD COc1cc(C(=O)Nc2cccc(-n3ccnc3O)c2)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 917403287 OJIXPRQYWSHVFZ-UHFFFAOYSA-N 480.864 5.193 5 20 JKBD Cc1cc(C(=O)N2CCC(C)CC2)ccc1NC(=O)c1cc([N+](=O)[O-])ccc1N1CCCCC1 917778950 NDTRCYJJYXVYPW-UHFFFAOYSA-N 464.566 5.018 5 20 JKBD O=C(Nc1ccccc1C(=O)NCc1cc(-c2ccccc2)no1)c1ccc([N+](=O)[O-])cc1Cl 918139494 TUCWXHYAYZDVCR-UHFFFAOYSA-N 476.876 5.086 5 20 JKBD CCOc1ccc(CCC(=O)Oc2ccc(NC(=O)c3cc([N+](=O)[O-])ccc3Cl)cc2)cc1 919839527 CMNMFRMZZVEXDM-UHFFFAOYSA-N 468.893 5.437 5 20 JKBD CCOC(=O)c1c(-c2ccc(OC)c(OC)c2)csc1NC(=O)c1cc([N+](=O)[O-])ccc1C 921277383 XIELVVCQHWDDQC-UHFFFAOYSA-N 470.503 5.078 5 20 JKBD C[C@@H]1CCC[C@@H]1C(=O)Nc1ccc(C2(NC(=O)CSc3ccccc3[N+](=O)[O-])CCC2)cc1 1789213978 OEDOTKGTDVPANW-XLIONFOSSA-N 467.591 5.257 5 20 JKBD COc1cc(Cl)cc(C(=O)NC2(c3ccc(NC(=O)c4cc(O)cc([N+](=O)[O-])c4)cc3)CCC2)c1 1790757515 SQLOILDGXIJQTG-UHFFFAOYSA-N 495.919 5.024 5 20 JKBD O=C(CSc1ccccc1[N+](=O)[O-])Nc1ccc(C2(NC(=O)c3ccoc3Cl)CCC2)cc1 1791523797 UDQUQBCEHBXBKX-UHFFFAOYSA-N 485.949 5.381 5 20 JKBD CC(C)c1cc(C(=O)N2CCCC3(CCN(C(=O)c4cc5cc([N+](=O)[O-])ccc5s4)CC3)C2)no1 1808743181 VYVBBEREMHPMHN-UHFFFAOYSA-N 496.589 5.080 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2ccc3occc3c2)CC1 1828259142 YUJIZGDRTOMTDV-QHCPKHFHSA-N 493.535 5.336 5 20 JKBD CCCOc1ccc(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3cccc(F)c3[N+](=O)[O-])CC2)cc1 1830102194 AWAPOXFEKWFJKN-XMMPIXPASA-N 497.567 5.070 5 20 JKBD Cc1c(C(=O)N2CCCC[C@H]2C2CCN(C(=O)CCc3cccc([N+](=O)[O-])c3)CC2)ccc(F)c1F 1832617039 CSKBPLHQDJUVAN-DEOSSOPVSA-N 499.558 5.048 5 20 JKBD COc1ccc2cc(CNC(=O)c3ccccc3NC(=O)c3ccc([N+](=O)[O-])cc3Cl)ccc2c1 9941785 GXTMKBLKDZTFNP-UHFFFAOYSA-N 489.915 5.592 5 20 JKBD O=C(Cn1c2ccccc2c(=O)c2ccccc21)N[C@H](c1ccc(Br)cc1)C1CCC1 108425406 DIYMPEOHPOTJSQ-VWLOTQADSA-N 475.386 5.575 5 20 JKBD C[C@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)Nc1nc(-c2ccccc2OC(F)F)cs1 110601226 MPAAKBWLKVIUPL-NSHDSACASA-N 451.476 5.439 5 20 JKBD O=C(CCNc1ccc(C(F)(F)F)cc1[N+](=O)[O-])Nc1ccccc1NC(=O)Cc1cccs1 409981009 QILVRSPNONSLDY-UHFFFAOYSA-N 492.479 5.297 5 20 JKBD COc1ccc(Oc2ccc([N+](=O)[O-])cc2C(=O)Nc2nnc(Cc3cccc(OC)c3)s2)cc1 410296418 ALYHHCUFDFVMGP-UHFFFAOYSA-N 492.513 5.099 5 20 JKBD COc1cc(C(=O)N[C@@H]2CCCC[C@H]2Cc2ccccc2)c([N+](=O)[O-])cc1OCc1cscn1 476725639 DQFQTUMFQRHJCI-GHTZIAJQSA-N 481.574 5.170 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)Nc2ccc(Sc3nc(C)cs3)c(Cl)c2)cc1SC 484292626 QWTBROBUXFLSGZ-UHFFFAOYSA-N 482.008 6.147 5 20 JKBD Cc1nc([N+](=O)[O-])cn1CCC(=O)N1C[C@@H](c2ccccc2Cl)c2c([nH]c3ccccc23)[C@H]1C 488805033 LIVKCNZVUGYVDR-BEFAXECRSA-N 477.952 5.360 5 20 JKBD Cc1ccc2nc([C@H]3CCCN(C(=O)c4ccc(Sc5nc(C)cs5)c([N+](=O)[O-])c4)C3)[nH]c2c1 502983848 KQPGPZTYOHGAPR-KRWDZBQOSA-N 493.614 5.715 5 20 JKBD Cc1nnc(Sc2ccc(NC(=O)c3ccc(N4CCCC4)c([N+](=O)[O-])c3)c(C)c2)s1 505892406 BVOWICHGPLNMLR-UHFFFAOYSA-N 455.565 5.067 5 20 JKBD O=[N+]([O-])c1cc(CN[C@H](c2ccccc2)c2nccs2)ccc1Oc1ccccc1Cl 507915770 VQQLFZYXOJJRFZ-JOCHJYFZSA-N 451.935 6.376 5 20 JKBD C[C@H](Nc1ccc(C(=O)N(C2CC2)[C@@H](C)c2ccc(Cl)cc2)cc1[N+](=O)[O-])c1ccccn1 509245894 HORVXHNMNGNJLD-IRXDYDNUSA-N 464.953 6.182 5 20 JKBD CC(C)CNC(=O)c1ccc(NC(=O)c2ccc(N[C@H](C)c3ccccn3)c([N+](=O)[O-])c2)cc1Cl 509266136 XFDSEQQKOHRGOU-MRXNPFEDSA-N 495.967 5.454 5 20 JKBD O=C(NCCC(=O)N(c1cccc(Cl)c1)c1nc2ccccc2s1)c1ccc([N+](=O)[O-])cc1 514301497 MWDWKJIEHCXDBS-UHFFFAOYSA-N 480.933 5.343 5 20 JKBD Cc1ccc(NS(=O)(=O)c2ccc(NCC(=O)Nc3ccccc3C(C)C)c([N+](=O)[O-])c2)c(C)c1 514353287 AIZTUHIYXSFNJW-UHFFFAOYSA-N 496.589 5.186 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Br)[C@@H](NCCCOc1ccccc1)c1ccccc1 514691887 NJMRFHGPOVHVNC-QFIPXVFZSA-N 484.350 5.096 5 20 JKBD CCOc1cc(C(=O)Nc2cc(C(C)(C)C)nn2-c2cccc(Cl)c2)c([N+](=O)[O-])cc1OC 517379531 HFIJMIRAZPOPSD-UHFFFAOYSA-N 472.929 5.391 5 20 JKBD CSc1ccc(C(=O)c2ccccc2C(=O)Nc2ccn(Cc3ccccc3)n2)cc1[N+](=O)[O-] 519116331 STPFBSZOSVUINS-UHFFFAOYSA-N 472.526 5.045 5 20 JKBD O=C(Nc1ccc2c(c1)CCC(=O)N2Cc1ccc(Cl)cc1)c1cc2cc([N+](=O)[O-])ccc2o1 520100055 UNXAWKJBDZYEGA-UHFFFAOYSA-N 475.888 5.726 5 20 JKBD Cc1ccc(C(=O)Nc2cccc(C(F)(F)F)c2)cc1NC(=O)c1c[nH]c2cc([N+](=O)[O-])ccc12 520446880 KZTBLKMZCXELRD-UHFFFAOYSA-N 482.418 5.908 5 20 JKBD CC[C@H](C)c1ccc2nc(N(Cc3ccccc3)C(=O)Cn3cc([N+](=O)[O-])ccc3=O)sc2c1 521799171 GQSPTDLVADPPNV-KRWDZBQOSA-N 476.558 5.113 5 20 JKBD O=C(Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1)[C@@H]1C[C@H]2CCCC[C@@H]2N1C(=O)c1ccccc1 524290496 RCIXJFYVQKDOMF-COPCDDAFSA-N 476.558 5.130 5 20 JKBD COc1cc(C(=O)Nc2ncc(Br)s2)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 588676015 KHWSKAZXICQJSN-UHFFFAOYSA-N 484.715 5.520 5 20 JKBD O=C(c1ccc(O)cc1)C1CCN(C(=O)c2cc([N+](=O)[O-])ccc2Sc2ccc(Cl)cc2)CC1 591595716 ADPJGHWLHRASRM-UHFFFAOYSA-N 496.972 5.840 5 20 JKBD O=C(c1ccc([N+](=O)[O-])o1)N(C[C@@H]1CCCO1)c1nc(-c2ccc(Cl)cc2Cl)cs1 603462989 PEAJTXOODYAOLU-LBPRGKRZSA-N 468.318 5.444 5 20 JKBD CN(C(=O)c1cccc(NC(=O)CSc2ccc(C(F)(F)F)cc2[N+](=O)[O-])c1)c1ccccc1 603991212 KSYFOAIDNFXLLJ-UHFFFAOYSA-N 489.475 5.621 5 20 JKBD CC(C)Oc1ncccc1CN[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Br)c1ccccc1 604045549 STSOCMGTHSNKEW-NRFANRHFSA-N 499.365 5.009 5 20 JKBD C[C@H]1CCCN(c2ccc(C(=O)N(C)CCCc3cc(-c4ccc(F)cc4)no3)cc2[N+](=O)[O-])C1 604570282 NMGAYVXKLXUDPX-SFHVURJKSA-N 480.540 5.330 5 20 JKBD CC(C)N(Cc1nnc(-c2cccc([N+](=O)[O-])c2)o1)C(=O)/C=C\c1cccc(OC2CCCC2)c1 727661399 RPWOOKNPCZQPKI-YPKPFQOOSA-N 476.533 5.417 5 20 JKBD Cc1ccc(NC(=O)[C@H](C)OC(=O)C2CCN(c3ccc(C(F)(F)F)cc3[N+](=O)[O-])CC2)c(C)c1 729628323 ZEVTZQHWUMSCEV-INIZCTEOSA-N 493.482 5.017 5 20 JKBD C[C@H](OC(=O)[C@H]1C[C@H]1c1ccc2ccccc2c1)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 731272236 BEOPDJGZXGLQMQ-AGRHKRQWSA-N 472.419 5.441 5 20 JKBD O=C(OCc1csc(COc2ccc(F)cc2)n1)c1csc(-c2cccc([N+](=O)[O-])c2)n1 747961868 LNEHTEMFEOXPGC-UHFFFAOYSA-N 471.491 5.250 5 20 JKBD O=C(Cn1c2ccccc2c(=O)c2ccccc21)OCc1cccc(NC(=O)c2ccccc2)c1 750432050 NQUVVXMJFVPCJK-UHFFFAOYSA-N 462.505 5.150 5 20 JKBD CC(C)n1c(SCC(=O)Nc2ccc(F)c([N+](=O)[O-])c2)nnc1-c1ccc(Cl)cc1Cl 771720317 AZVIHQQISINYPP-UHFFFAOYSA-N 484.340 5.611 5 20 JKBD C[C@@H](OC(=O)c1cc(-c2ccco2)nn1-c1ccccc1)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 811762141 MMGXFNZIXFMAFZ-OAHLLOKOSA-N 471.429 5.009 5 20 JKBD Cc1noc(COC(=O)c2c3c(nc4ccccc24)/C(=C\c2cccc([N+](=O)[O-])c2)CCC3)n1 817860866 XXLRYUGSFNRXPA-ATVHPVEESA-N 456.458 5.068 5 20 JKBD CCN(C(=O)Cc1ccc(NCc2c(Br)cccc2[N+](=O)[O-])cc1)c1ccccc1 864026398 HMGOQNGHVBNCGC-UHFFFAOYSA-N 468.351 5.565 5 20 JKBD COc1cc(COC(=O)/C=C\c2ccc3ccc(Cl)cc3n2)c([N+](=O)[O-])cc1OC(F)F 912874256 SXPYJTJWPXPSSH-SREVYHEPSA-N 464.808 5.163 5 20 JKBD C[C@@H](OC(=O)c1cccc(OCc2cccs2)c1)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl 915464122 LOSLGQXZRNEAIG-CYBMUJFWSA-N 460.895 5.073 5 20 JKBD COCCOC(=O)c1sc2nc(/C(Cl)=C\c3ccc(C(C)C)c([N+](=O)[O-])c3)nc(O)c2c1C 916128368 YTOBTXFJHCBHCG-OQLLNIDSSA-N 491.953 5.277 5 20 JKBD Cc1sc2ncnc(Sc3ccccc3C(=O)Nc3cc([N+](=O)[O-])ccc3F)c2c1C 916667020 CYKSFKYUFJINAF-UHFFFAOYSA-N 454.508 5.759 5 20 JKBD O=C(Oc1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2Cl)cc1)c1cc2cccc([N+](=O)[O-])c2[nH]1 916950767 CPQNSOISTDNKLY-UHFFFAOYSA-N 480.820 5.109 5 20 JKBD COc1cc(/C=C2/NC(=S)N(c3ccccc3Cl)C2=O)ccc1OCc1ccc([N+](=O)[O-])cc1 917096210 JOBZCCPKDJNMKS-XDHOZWIPSA-N 495.944 5.098 5 20 JKBD C[C@@H](Nc1ccc(C(=O)OCC(=O)Nc2c(Cl)cccc2Cl)cc1[N+](=O)[O-])c1ccccn1 920545787 JKFXCDBYFCYJME-CYBMUJFWSA-N 489.315 5.265 5 20 JKBD Cc1cc(COc2ccc(C(=O)N(C)Cc3cc([N+](=O)[O-])ccc3Cl)cc2Br)on1 921306658 ZZZDLTZGWVWGJA-UHFFFAOYSA-N 494.729 5.158 5 20 JKBD C[C@H](Sc1cccs1)C(=O)NC1(c2ccc(NC(=O)c3ccc([N+](=O)[O-])o3)cc2)CCC1 1785750785 RGNFFMUHPQZFOY-AWEZNQCLSA-N 471.560 5.178 5 20 JKBD O=C(Cc1ccc([N+](=O)[O-])cc1F)Nc1ccc(C2(NC(=O)c3scnc3C3CC3)CCC2)cc1 1791183745 GOCZNYJZJJDHAU-UHFFFAOYSA-N 494.548 5.058 5 20 JKBD Cc1c(C(=O)NC[C@@H]2CCN(C(=O)[C@]3(C)CC=CCC3)[C@@H]2c2cccnc2)cc(Cl)cc1[N+](=O)[O-] 1811797873 XBWNRDRPCHNABC-RQADYFSKSA-N 496.995 5.018 5 20 JKBD Cc1cc(C(=O)Nc2cc([C@H]3CCCCN3C(=O)c3ccc(C(C)(C)C)s3)[nH]n2)ncc1[N+](=O)[O-] 1818263905 BXNRONXHOYXZCQ-QGZVFWFLSA-N 496.593 5.000 5 20 JKBD Cc1cc(C)cc(C(=O)N2CCCC[C@H]2C2CCN(C(=O)CSc3ccccc3[N+](=O)[O-])CC2)c1 1830012140 JQTCAHZQOVMKNM-QHCPKHFHSA-N 495.645 5.237 5 20 JKBD CC[C@H](C)CC(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cc(Br)ccc2[N+](=O)[O-])CC1 1830563473 BUILXVNYUPMYFC-JXFKEZNVSA-N 494.430 5.027 5 20 JKBD COc1ccccc1C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cc(Cl)cc([N+](=O)[O-])c2C)CC1 1830735715 KWURFFAXPZAXIY-JOCHJYFZSA-N 499.995 5.112 5 20 JKBD O=C(c1cc(F)cc([N+](=O)[O-])c1)N1CC[C@H]2[C@@H]1CCN2C(=O)C1CCC(c2ccc(Cl)cc2)CC1 1847618915 ADOQVGNBXCZEQJ-HPCWMKLOSA-N 499.970 5.177 5 20 JKBD C[C@H](Sc1nnc(-c2ccccc2F)n1Cc1ccccc1)C(=O)Nc1ccc([N+](=O)[O-])cc1 9331065 XLMIDQLNHWVVPX-INIZCTEOSA-N 477.521 5.160 5 20 JKBD CCCOc1cc(NC(=O)c2ccccc2I)c([N+](=O)[O-])cc1OCCC 10632283 NLNKMBIAYZDBRM-UHFFFAOYSA-N 484.290 5.029 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Br)[C@@H](c1ccccc1)N1CCc2sccc2C1 10761958 XLPDJCKTBUIFES-HXUWFJFHSA-N 472.364 5.157 5 20 JKBD Cc1ccc(C(=O)Nc2ccc(Cl)c(S(=O)(=O)Nc3ccccc3Cl)c2)cc1[N+](=O)[O-] 15501080 VBVBESVEPJEZLM-UHFFFAOYSA-N 480.329 5.263 5 20 JKBD Cc1nc(-c2ccc(CNC(=O)CSc3ccc(C(F)(F)F)cc3[N+](=O)[O-])s2)cs1 16775378 GDVKJCWVPILBAH-UHFFFAOYSA-N 473.523 5.516 5 20 JKBD C[C@H](OC(=O)c1cc(-c2ccco2)nc2ccccc12)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 17529490 TXRUPMIUFPOIHT-AWEZNQCLSA-N 456.414 5.371 5 20 JKBD Cc1ccc(-c2nc(C(=O)O[C@H](C)C(=O)Nc3nc(-c4cccc([N+](=O)[O-])c4)cs3)cs2)cc1 17939515 JWQZNSULYCSQNQ-CQSZACIVSA-N 494.554 5.334 5 20 JKBD COc1cc(C(=O)N(C)c2nc3ccccc3s2)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 26961233 UIQHEOZEMZHJOL-UHFFFAOYSA-N 469.906 5.935 5 20 JKBD COc1cccc(CCC(=O)Oc2ccc(NC(=O)c3cc([N+](=O)[O-])ccc3Cl)cc2)c1 27151812 RHIUUAABRRONFO-UHFFFAOYSA-N 454.866 5.047 5 20 JKBD CCN(c1ccccc1)S(=O)(=O)c1cc(NC(=O)c2cc([N+](=O)[O-])ccc2Cl)ccc1Cl 28469700 HNMYTUURBBSAFF-UHFFFAOYSA-N 494.356 5.369 5 20 JKBD C[C@@H](Nc1ccc(C(=O)N(C)Cc2ccc(Br)cc2)cc1[N+](=O)[O-])c1ccccn1 108756628 RTAXQCFQKMFPMM-OAHLLOKOSA-N 469.339 5.198 5 20 JKBD C[C@H](Nc1ccc(C(=O)NCC2(c3cccc(Cl)c3)CCOCC2)cc1[N+](=O)[O-])c1ccccn1 108813910 CMONMLAFUSZTKV-SFHVURJKSA-N 494.979 5.295 5 20 JKBD CCCC(=O)Nc1cccc(N[C@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2C(F)(F)F)c1C 109109598 HGNMUJAOYZBYJE-CYBMUJFWSA-N 452.433 5.100 5 20 JKBD COc1ccc(C[C@@H](NC(=O)c2cc(SC)c(OC)cc2[N+](=O)[O-])c2ccccc2)cc1OC 484355945 YZAXCFJMIBZISQ-LJQANCHMSA-N 482.558 5.056 5 20 JKBD Cc1c(NC(=O)C2CCN(c3ccccc3[N+](=O)[O-])CC2)cccc1C(=O)Nc1ccccc1 498469844 LHHZDQABKJJRPD-UHFFFAOYSA-N 458.518 5.011 5 20 JKBD CCN(C(=O)c1ccc(N[C@H](C)c2ccccn2)c([N+](=O)[O-])c1)[C@@H]1CCN([C@H](C)c2ccccc2)C1 500001992 HKFQELRVHPSCBI-PQNGQFLHSA-N 487.604 5.461 5 20 JKBD COc1cc(CN[C@@H]2CCOc3c(Cl)cccc32)ccc1OCc1ccc([N+](=O)[O-])cc1 507902500 KCAIWSZUYPSYNV-OAQYLSRUSA-N 454.910 5.449 5 20 JKBD Cc1sc(C(=O)Nc2ccc(Cl)c(S(=O)(=O)Nc3ccccc3Cl)c2)cc1[N+](=O)[O-] 508727451 RJYDSAANOKTEKU-UHFFFAOYSA-N 486.358 5.325 5 20 JKBD Cc1c(NC(=O)c2cc(OCC(F)(F)F)cc(OCC(F)(F)F)c2)cccc1[N+](=O)[O-] 508805740 HOFJKIGFJLTIKT-UHFFFAOYSA-N 452.307 5.038 5 20 JKBD Cc1nc(-c2ccccc2)sc1[C@@H](C)NC(=O)c1ccc([N+](=O)[O-])cc1I 511646975 OHRZJDHVEMJJEC-LLVKDONJSA-N 493.326 5.122 5 20 JKBD COc1ccc([C@H]2CCCCCN2C(=O)c2cc(OC)c(OCc3cscn3)cc2[N+](=O)[O-])cc1 512293515 MAOMHNALPJUXFU-OAQYLSRUSA-N 497.573 5.405 5 20 JKBD COc1cc2nc(NC(=O)c3ccc(N[C@H](C)c4ccccn4)c([N+](=O)[O-])c3)sc2cc1OC 516169897 ODLJPZHFQUYTKP-CYBMUJFWSA-N 479.518 5.042 5 20 JKBD COc1cccc(C[C@H]2CCCN2C(=O)c2ccc(Sc3nc(C)cs3)c([N+](=O)[O-])c2)c1 516528217 NAIYBWWDLKJDRZ-GOSISDBHSA-N 469.588 5.367 5 20 JKBD O=[N+]([O-])c1cc(CSc2nnc(-c3cccnc3)n2-c2ccc(Cl)c(Cl)c2)cs1 603938137 XIWHRDBCLKMLRC-UHFFFAOYSA-N 464.359 5.898 5 20 JKBD O=C(Nc1nc(-c2ccc(OC(F)F)cc2OC(F)F)cs1)c1ccc([N+](=O)[O-])cc1 604511008 JHKYPCYMXRQINF-UHFFFAOYSA-N 457.361 5.173 5 20 JKBD C[C@H](Nc1ccc(C(=O)N[C@@H]2C[C@@H]2c2cccc(Br)c2)cc1[N+](=O)[O-])c1ccccn1 608809386 FBGAVOCWJYKGCV-FIKMYACPSA-N 481.350 5.211 5 20 JKBD COc1cc2c(cc1CNCc1cn(-c3ccccc3)nc1-c1ccc([N+](=O)[O-])cc1)O[C@@H](C)C2 608835778 PJXQWAZVUOLSNA-SFHVURJKSA-N 470.529 5.069 5 20 JKBD Cc1csc(Sc2ccc(C(=O)N3C[C@@H](c4ccccc4)OC[C@H]3C)cc2[N+](=O)[O-])n1 608966177 GTRCWVVBCYBYIA-BEFAXECRSA-N 455.561 5.113 5 20 JKBD Cc1cc([N+](=O)[O-])ccc1C(=O)OCC(=O)Nc1c(Cl)c(Cl)cc(Cl)c1Cl 725987229 JKJLTELOSNUBHB-UHFFFAOYSA-N 452.077 5.312 5 20 JKBD Cc1cc(-c2cccc(Cl)c2)ccc1NC(=O)c1ccc(Sc2nncn2C)c([N+](=O)[O-])c1 726766474 UINACBAMMKOMEL-UHFFFAOYSA-N 479.949 5.756 5 20 JKBD C[C@H](OC(=O)[C@@H](C)Oc1cc(Cl)cc(Cl)c1)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 727217533 DVKPIPJLYGAPED-VHSXEESVSA-N 495.237 5.258 5 20 JKBD CC(C)c1noc2nc(-c3ccco3)cc(C(=O)O[C@H](C)C(=O)Nc3cc([N+](=O)[O-])ccc3Cl)c12 727919719 WUNICYXHUCYGQR-GFCCVEGCSA-N 498.879 5.352 5 20 JKBD Cc1ccc(C)c(NC(=O)[C@H](C)OC(=O)Cc2cn(-c3ccccc3)nc2-c2ccc([N+](=O)[O-])cc2)c1 729847912 XLYOHSFPWYEUNC-FQEVSTJZSA-N 498.539 5.177 5 20 JKBD O=C(OCC(=O)N1N=C(c2cc3ccccc3o2)C[C@H]1c1ccco1)c1c(Cl)cccc1[N+](=O)[O-] 730642968 JDNAOIGNMDFMGK-SFHVURJKSA-N 493.859 5.122 5 20 JKBD COc1cc(COC(=O)c2ccc3c(c2)C[C@@H](c2ccccc2)OC3=O)c([N+](=O)[O-])cc1OC(F)F 791402866 YRQJDHRZQCKTPA-FQEVSTJZSA-N 499.422 5.016 5 20 JKBD O=C(Nc1cc(N2CCCC2=O)ccc1F)c1ccc(NCc2ccccc2Cl)c([N+](=O)[O-])c1 917798374 PXKRYIUPEAUXJP-UHFFFAOYSA-N 482.899 5.379 5 20 JKBD O=[N+]([O-])c1cccc(-c2nccc(/C=C\c3csc(-c4ccc(C(F)(F)F)cc4)n3)[n+]2[O-])c1 918712314 JENMCXPNYRFKKR-HJWRWDBZSA-N 470.432 5.603 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)c3ccc4cc[nH]c4c3)CCC2)cc1)c1cc(F)cc([N+](=O)[O-])c1 1790696676 WHRNMXLIUMBIDK-UHFFFAOYSA-N 472.476 5.277 5 20 JKBD CC(C)[C@H]1CC[C@H](C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)C2(c3cccc([N+](=O)[O-])c3)CCC2)CC1 1800041771 SGTKRXQXOFDFBB-XQSHJJCOSA-N 481.637 5.117 5 20 JKBD CC(C)=CCCC(=O)NC[C@@H]1CCN(C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)[C@H]1c1cccnc1 1807997047 KNJSMODQTPGNTQ-DFBJGRDBSA-N 492.601 5.271 5 20 JKBD Cc1cc(C(=O)NC[C@H]2CCN(C(=O)CCCCCC(C)(C)C)[C@H]2c2cccnc2)ncc1[N+](=O)[O-] 1808669174 YFCLQMYZSYGUEG-BWKNWUBXSA-N 495.624 5.009 5 20 JKBD O=C(Nc1cc([C@@H]2CCCCN2C(=O)Cc2ccccc2)[nH]n1)c1cc2cc([N+](=O)[O-])ccc2s1 1821610162 UDRINUJQZLRHJO-FQEVSTJZSA-N 489.557 5.081 5 20 JKBD CC(C)c1ccc(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)Cc3cc(F)ccc3[N+](=O)[O-])n[nH]2)cc1 1823487250 AJHNVZPVDYHLAS-HSZRJFAPSA-N 493.539 5.129 5 20 JKBD Cc1cc(C)cc(CCC(=O)N2CCC([C@H]3CCCCN3C(=O)/C=C/c3ccc([N+](=O)[O-])o3)CC2)c1 1824279590 YBGPSALPWVAYAD-CZNRWDAFSA-N 493.604 5.070 5 20 JKBD O=C(/C=C/c1ccccc1[N+](=O)[O-])N1CCC([C@H]2CCCCN2C(=O)c2ccc3occc3c2)CC1 1828262320 VDTWVYLTIKHYQA-KMEWNKIWSA-N 487.556 5.288 5 20 JKBD Cc1ccc(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3ccc([N+](=O)[O-])cc3F)CC2)c(Cl)c1 1832608254 YTKYPHCZJRUAPD-HSZRJFAPSA-N 487.959 5.243 5 20 JKBD Cc1cc(C(=O)COC(=O)c2ccccc2C(=O)c2ccc(Cl)c([N+](=O)[O-])c2)c(C)n1C1CC1 11029385 BJOYORMOCUNMCA-UHFFFAOYSA-N 480.904 5.272 5 20 JKBD Cc1cc(C)c(NC(=O)CNC(=O)c2cc([N+](=O)[O-])ccc2Sc2ccc(Cl)cc2)c(C)c1 17960465 ZIROWGIDEGCKQD-UHFFFAOYSA-N 483.977 5.693 5 20 JKBD O=C(Nc1ccccc1C(=O)OCc1cc(-c2ccco2)on1)c1ccc([N+](=O)[O-])cc1Cl 18980655 KPNNZXFATAORAO-UHFFFAOYSA-N 467.821 5.106 5 20 JKBD Cc1ccc2nc(-c3ccc(NC(=O)Cn4cnc(-c5ccc([N+](=O)[O-])cc5)n4)cc3)sc2c1 72066294 PDEOZXZVRZASRX-UHFFFAOYSA-N 470.514 5.077 5 20 JKBD Cc1c([C@H](C)NC(=O)c2ccc(N[C@@H](C)c3ccccn3)c([N+](=O)[O-])c2)cnn1-c1ccc(F)cc1 108776997 GXGJNWLNHGSLBO-IRXDYDNUSA-N 488.523 5.287 5 20 JKBD CCOc1cc2c(cc1NC(=O)C1CCN(c3ccc(C(F)(F)F)cc3[N+](=O)[O-])CC1)O[C@@H](C)C2 302863388 BLHAKICKSNHTEW-AWEZNQCLSA-N 493.482 5.191 5 20 JKBD CCOc1cc2c(cc1[C@@H]1C[C@H]1C(=O)N(Cc1ccccc1[N+](=O)[O-])CC(F)(F)F)O[C@H](C)C2 409796340 XUBAEKLHUNJKAF-DKSSEZFCSA-N 478.467 5.012 5 20 JKBD O=C(NC[C@@H]1CCN(c2ccccc2)C1)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1 478189874 IYIMVDCMAHXWFL-KRWDZBQOSA-N 451.910 5.297 5 20 JKBD O=C(Nc1cccc(Cn2cncn2)c1)c1ccccc1Sc1ccc(C(F)(F)F)cc1[N+](=O)[O-] 487590570 MYGLPTZEFCYEFB-UHFFFAOYSA-N 499.474 5.657 5 20 JKBD Cc1csc(Sc2ccc(C(=O)Nc3ccccc3OCc3cscn3)cc2[N+](=O)[O-])n1 503469661 MLQMLEQJFYHHAU-UHFFFAOYSA-N 484.584 5.799 5 20 JKBD O=C(c1ccc(Cl)cc1)N1CCCN(C(=O)c2cc([N+](=O)[O-])ccc2Oc2ccccc2)CC1 508008972 LVZNJVHOIQZXJW-UHFFFAOYSA-N 479.920 5.029 5 20 JKBD COc1cc(C(=O)Nc2ccc(NC(=O)c3ccccc3F)cc2C(F)(F)F)ccc1[N+](=O)[O-] 508921537 JWXPTJIHRLJROK-UHFFFAOYSA-N 477.370 5.266 5 20 JKBD Cc1ccc(I)c(C(=O)Nc2nc(-c3cccc([N+](=O)[O-])c3)c(C)s2)c1 508951563 SUADMCCYIJYEPH-UHFFFAOYSA-N 479.299 5.192 5 20 JKBD O=C(N[C@@H]1CCOc2c(Cl)cccc21)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 509668851 DPMNRUVZYPCELF-QGZVFWFLSA-N 483.874 5.123 5 20 JKBD O=C(c1cccc(C(F)F)c1)N1CCN(Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)CC1 511480478 KDEMJRCHSVPVIN-UHFFFAOYSA-N 457.502 5.219 5 20 JKBD CC(C)N(Cc1cccc(Br)c1)C(=O)Cn1c2ccccc2c(=O)c2ccccc21 512236654 JOAIDVWTWQIBHB-UHFFFAOYSA-N 463.375 5.354 5 20 JKBD CCNc1ccc(C(=O)N(Cc2ccccc2)[C@H](C)c2cccc(NC(C)=O)c2)cc1[N+](=O)[O-] 514943205 KKHIGNUESRVESA-GOSISDBHSA-N 460.534 5.389 5 20 JKBD COc1cc(Cc2nc(O)c3cc4ccccc4cc3n2)cc(Br)c1OC(F)F 515646192 ZEHJIJFOJUVKHY-UHFFFAOYSA-N 461.262 5.452 5 20 JKBD Cc1c(C(=O)Nc2nc(-c3cccc([N+](=O)[O-])c3)cs2)cnn1-c1ccc(Br)cc1 517321596 KLIFLHUOJZBTTF-UHFFFAOYSA-N 484.335 5.227 5 20 JKBD C[C@@H](Nc1ccc(C(=O)Nc2c(F)cc(F)cc2-c2ccccc2)cc1[N+](=O)[O-])c1ccccn1 517908861 URJQUCOBYFBEPN-MRXNPFEDSA-N 474.467 6.360 5 20 JKBD O=C(c1ccc(Sc2nc3ccccc3s2)c([N+](=O)[O-])c1)N1CCCN(c2nccs2)CC1 519948805 ONHPPPXFXQPILS-UHFFFAOYSA-N 497.627 5.165 5 20 JKBD O=[N+]([O-])c1ccc(-c2ccc(CNC[C@H]3CCCO[C@@H]3c3ccccc3)o2)c(Br)c1 521830317 RXKKMFZMBYJMPW-UZUQRXQVSA-N 471.351 5.875 5 20 JKBD O=C(NCc1ccc(NC(=O)c2c[nH]c3cc([N+](=O)[O-])ccc23)cc1)c1ccc(C(F)(F)F)cc1 524612507 VINGZFVPQRCNKT-UHFFFAOYSA-N 482.418 5.277 5 20 JKBD O=[N+]([O-])c1ccc(-c2ccc(CN[C@H](c3ccccc3)[C@@H]3CCCO3)o2)c(Br)c1 555190341 AXEQLTWBEFGIRA-FCHUYYIVSA-N 457.324 5.627 5 20 JKBD COc1ccc([C@@H](NCc2ccc(Sc3ccc(C)cc3)c([N+](=O)[O-])c2)c2nccn2C)cc1 603633412 DDJSJPXWBXUYBS-RUZDIDTESA-N 474.586 5.676 5 20 JKBD O=C(C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)Nc1ccc2c[nH]nc2c1 609023157 FCQVZYQFSMLYOB-BOPFTXTBSA-N 455.499 5.650 5 20 JKBD O=C(c1c2c(nc3ccccc13)/C(=C\c1ccc([N+](=O)[O-])cc1)CCC2)N1CCC[C@@H](c2ncc[nH]2)C1 609025653 WNPHIPMXCDHJIK-OJLMNSMJSA-N 493.567 5.763 5 20 JKBD Cc1ccc(Cc2nnc(NC(=O)c3ccc(N[C@H](C)c4ccccn4)c([N+](=O)[O-])c3)s2)cc1 609381705 MVLIQEALVJHSKO-MRXNPFEDSA-N 474.546 5.166 5 20 JKBD COCCN(C(=O)c1cc2cc(C)ccc2nc1C)c1nc(-c2ccc([N+](=O)[O-])cc2)cs1 619564623 HXDLATLNXXJRGO-UHFFFAOYSA-N 462.531 5.177 5 20 JKBD O=C(Nc1ccccc1C(=O)NCc1ccc(F)c(Cl)c1)c1ccc([N+](=O)[O-])cc1Cl 725755101 DPMFUYXBUDOUIB-UHFFFAOYSA-N 462.264 5.223 5 20 JKBD CCOc1ccc(OCC)c(NC(=S)/C(=C(/O)c2ccc([N+](=O)[O-])cc2)[n+]2ccc(C)cc2)c1 726964117 SYNJUOVKTFLNLG-UHFFFAOYSA-O 480.566 5.311 5 20 JKBD COc1cc2c(cc1NC(=O)COC(=O)c1cc(SC)c(OC)cc1[N+](=O)[O-])oc1ccccc12 728651864 ZCRQLMXMWIFYPY-UHFFFAOYSA-N 496.497 5.029 5 20 JKBD O=C(OCc1csc(-c2ccoc2)n1)c1ccccc1C(=O)c1ccc(Cl)c([N+](=O)[O-])c1 731063247 OVTNZPXUMWVRBD-UHFFFAOYSA-N 468.874 5.553 5 20 JKBD O=C(Cn1ccc2cc([N+](=O)[O-])ccc21)Nc1ccccc1SC[C@@H]1CC1(Cl)Cl 743633100 VGFMRHZTDZFRDH-AWEZNQCLSA-N 450.347 5.474 5 20 JKBD O=C(Nc1nc(-c2ccc(OC(F)F)cc2OC(F)F)cs1)c1cc(F)ccc1[N+](=O)[O-] 751115582 FHONZYUTQYRUMU-UHFFFAOYSA-N 475.351 5.313 5 20 JKBD Cc1ccc(-c2nc(C)c(C(=O)O[C@@H](C)C(=O)Nc3ccc([N+](=O)[O-])cc3C(F)(F)F)s2)o1 915467463 SCXGHNCFQWXXND-NSHDSACASA-N 483.424 5.131 5 20 JKBD Cc1ccc(NC(=S)Nc2ccc([N+](=O)[O-])cc2)cc1S(=O)(=O)Nc1ccccc1Cl 916111205 DTHZDNJRMGIQGC-UHFFFAOYSA-N 476.967 5.166 5 20 JKBD CCOc1cc(/C=C\c2ccc3c([N+](=O)[O-])cccc3n2)ccc1OCCn1c([N+](=O)[O-])cnc1C 916153686 UHPZSFDUCJOETI-CLFYSBASSA-N 489.488 5.204 5 20 JKBD CN(Cc1cc([N+](=O)[O-])ccc1Cl)C(=O)c1c(NC(=O)c2cccnc2)sc2c1CCCC2 920438969 DNIQTZTWRFEZES-UHFFFAOYSA-N 484.965 5.108 5 20 JKBD Cc1cc2oc(=O)cc(COC(=O)c3ccc(N[C@@H](C)c4ccccn4)c([N+](=O)[O-])c3)c2cc1C 920543700 IAVCUFPFMYSKNW-KRWDZBQOSA-N 473.485 5.243 5 20 JKBD C[C@@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)O[C@H](C)c1nc(-c2cccc(C(F)(F)F)c2)no1 920778192 KYRKLUBUENSROB-GHMZBOCLSA-N 485.802 5.389 5 20 JKBD COc1ccc2[nH]cc(C(=O)NC3(c4ccc(NC(=O)Cc5cccc([N+](=O)[O-])c5)cc4)CCC3)c2c1 1785792413 XKDNGVBJKLDISY-UHFFFAOYSA-N 498.539 5.075 5 20 JKBD O=C(Cc1cccc2ncccc12)Nc1ccc(C2(NC(=O)c3cccc(F)c3[N+](=O)[O-])CCC2)cc1 1786345674 BOBCYSWUQZJSEE-UHFFFAOYSA-N 498.514 5.273 5 20 JKBD O=C(Cc1cc([N+](=O)[O-])ccc1F)NC1(c2ccc(NC(=O)[C@@H]3CCCCC3(F)F)cc2)CCC1 1786463066 YIEXWZLWEMGRRC-FQEVSTJZSA-N 489.494 5.236 5 20 JKBD O=C(/C=C/c1ccccc1[N+](=O)[O-])NC1(c2ccc(NC(=O)Cc3cccnc3Cl)cc2)CCC1 1786776256 VSRXHIWVTQSFAN-MDWZMJQESA-N 490.947 5.033 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)c3nc4cc([N+](=O)[O-])ccc4[nH]3)CCC2)cc1)c1cccc(Cl)c1 1790265527 NOMUIZMBXKMUPJ-UHFFFAOYSA-N 489.919 5.186 5 20 JKBD Cc1occc1C(=O)NC1(c2ccc(NC(=O)c3cc4cc([N+](=O)[O-])ccc4s3)cc2)CCC1 1791009946 CRVCYOGBFYJNCS-UHFFFAOYSA-N 475.526 5.772 5 20 JKBD C[C@H]1CC[C@H](C(=O)Nc2ccc(C3(NC(=O)/C=C/c4ccc([N+](=O)[O-])o4)CCC3)cc2)CC1 1791969208 NBNZTTNQXQOLAC-ATHRQNOSSA-N 451.523 5.161 5 20 JKBD Cc1cc2cccc(C(=O)N[C@@H]3C[C@@H]4CC[C@H](C3)N4C(=O)c3cc4cc([N+](=O)[O-])ccc4s3)c2[nH]1 1801207237 YUJPCOUQCCDAKK-REPLKXPHSA-N 488.569 5.165 5 20 JKBD C[C@@H](Cc1ccc(F)cc1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cc3cc([N+](=O)[O-])ccc3s1)C2 1801491028 YOLOJVLXZIFSNM-KQLYMOGASA-N 495.576 5.079 5 20 JKBD C/C(=C\c1cccs1)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)CCc2cccc([N+](=O)[O-])c2)[nH]n1 1814409734 FVKIUZAPSCVEHF-QMPJNXRZSA-N 493.589 5.108 5 20 JKBD CC(C)c1ccc(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)Cc3cc([N+](=O)[O-])ccc3F)[nH]n2)cc1 1820590538 XCKCWJVCOSOHPU-QHCPKHFHSA-N 493.539 5.129 5 20 JKBD CC1(C(=O)N2CCC([C@@H]3CCCCN3C(=O)CCc3cccc([N+](=O)[O-])c3)CC2)CCCCC1 1824841765 BIZQQNHKRVFMTB-DEOSSOPVSA-N 469.626 5.118 5 20 JKBD Cc1csc(Sc2ccc(C(=O)N[C@H](C)c3nc4ccccc4n3C(F)F)cc2[N+](=O)[O-])n1 9758970 DAZSONQRRZECGE-GFCCVEGCSA-N 489.529 5.747 5 20 JKBD CC(=O)N(c1nc(COC(=O)c2ccc(NC3CC3)c([N+](=O)[O-])c2)cs1)c1cccc(C)c1C 11227013 QFFYTOZXSDIAQN-UHFFFAOYSA-N 480.546 5.284 5 20 JKBD O=C(CCc1ncc(-c2ccc(Cl)cc2)o1)Oc1ccc(NC(=O)c2cccc([N+](=O)[O-])c2)cc1 12832675 YOFSTWIPCAGICX-UHFFFAOYSA-N 491.887 5.694 5 20 JKBD CCCOc1cc(NC(=O)c2ccc(C3SCCS3)cc2)c([N+](=O)[O-])cc1OCCC 17741941 GTVCBGABLBWRCO-UHFFFAOYSA-N 462.593 5.903 5 20 JKBD COc1cc2[nH]c(/C(Cl)=C/c3ccc(-c4ccc([N+](=O)[O-])cc4Cl)o3)nc(=O)c2cc1OC 21191194 JPGWGRAWLGNXLC-PXNMLYILSA-N 488.283 5.499 5 20 JKBD Cc1nn(C)c2sc(C(=O)O[C@@H](C(=O)Nc3ccc([N+](=O)[O-])cc3Cl)c3ccccc3)cc12 21697254 NSILUENKHNBDMV-LJQANCHMSA-N 484.921 5.042 5 20 JKBD Cc1c(NC(=O)[C@@H](C)Sc2nc3cc(Cl)ccc3c(=O)n2Cc2ccco2)cccc1[N+](=O)[O-] 24016433 RTPFBXJOPAXYEK-CQSZACIVSA-N 498.948 5.027 5 20 JKBD CCN(c1ccccc1)S(=O)(=O)c1cc(NC(=O)c2cc([N+](=O)[O-])ccc2C)ccc1Cl 72042749 MGLQZUMTHUYCOW-UHFFFAOYSA-N 473.938 5.024 5 20 JKBD Cc1nc([N+](=O)[O-])cn1CC(=O)NC[C@@H](c1ccccc1)c1c(-c2ccccc2)[nH]c2ccccc12 116042859 CEEJZIZQBKDDRF-QHCPKHFHSA-N 479.540 5.196 5 20 JKBD O=C(CSc1ccc(C(F)(F)F)cc1[N+](=O)[O-])Nc1ccccc1NC(=O)Cc1cccs1 409982239 VTDLNXVOSNVSSX-UHFFFAOYSA-N 495.504 5.587 5 20 JKBD CCCOc1c(Br)cc(C(=O)N(Cc2ccc([N+](=O)[O-])cc2)C(C)C)cc1OC 501979549 ONGAGUCOXJTZIS-UHFFFAOYSA-N 465.344 5.206 5 20 JKBD COc1ccc(Oc2ccc([N+](=O)[O-])cc2C(=O)Nc2cccc(C(=O)Nc3ccccn3)c2)cc1 505738772 YDRMTLSYZAOYMJ-UHFFFAOYSA-N 484.468 5.295 5 20 JKBD COc1cc([C@@H](C)NCc2ccc(Sc3ccc(C)cc3)c([N+](=O)[O-])c2)cc(OC)c1OC 508102715 MABVNANQRKZTNK-QGZVFWFLSA-N 468.575 5.931 5 20 JKBD COc1cc(C(=O)N[C@@H](C)c2cccc3ccccc23)c([N+](=O)[O-])cc1OCc1cscn1 509886220 OEVBGRRQROUXIR-HNNXBMFYSA-N 463.515 5.283 5 20 JKBD Cc1ccc(C(=O)Nc2nc(-c3ccc(C)c([N+](=O)[O-])c3)cs2)cc1NC(=O)c1ccccc1F 515098310 JIEHRCSNRQDADW-UHFFFAOYSA-N 490.516 5.979 5 20 JKBD O=C(C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)Nc1ccc2c(c1)OCC(=O)N2 517469971 SQVUAYJSVRQSFG-LFIBNONCSA-N 486.509 5.105 5 20 JKBD O=C(C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)NCCn1cnc2ccccc21 520167823 CSQNGMGSLAGLJI-XDJHFCHBSA-N 483.553 5.301 5 20 JKBD Cc1cnn([C@@H]2CCCc3ccccc32)c1NC(=O)[C@H](C)Oc1ccc(Cl)cc1[N+](=O)[O-] 524377918 XUJLPVRSOQAFNO-HNAYVOBHSA-N 454.914 5.085 5 20 JKBD COc1cc(C(=O)Nc2cc(C(F)(F)F)cnc2O)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 590532440 GEIPEPYNOIFZOR-UHFFFAOYSA-N 483.786 5.421 5 20 JKBD O=[N+]([O-])c1cc(CNCc2cccnc2OCC(F)(F)F)ccc1Oc1ccc(F)cc1 603633179 JIHBLLMFSPLILS-UHFFFAOYSA-N 451.376 5.152 5 20 JKBD Cc1ccc([N+](=O)[O-])cc1NC(=O)Cc1ccc(NC(=O)c2cccc(Br)c2)cc1 603750346 GZIWJCNDDKIHIG-UHFFFAOYSA-N 468.307 5.099 5 20 JKBD C[C@H](NC(=O)c1ccc(NC(=O)c2ccc(Br)cc2)cc1)c1cccc([N+](=O)[O-])c1 603966963 RSFWZDYLBKRYGZ-AWEZNQCLSA-N 468.307 5.101 5 20 JKBD CCNc1ccc(C(=O)Nc2ccc(OC)c(NC(=O)c3ccc(Cl)cc3F)c2)cc1[N+](=O)[O-] 603997646 ALSDVJFJMQOUPV-UHFFFAOYSA-N 486.887 5.332 5 20 JKBD O=C(Nc1cccc(Cn2cncn2)c1)c1cc([N+](=O)[O-])ccc1Sc1ccc(Cl)cc1 604105988 GLGWSQPOYWEYLH-UHFFFAOYSA-N 465.922 5.292 5 20 JKBD C[C@H](NC(=O)N[C@H](C)c1cccc([N+](=O)[O-])c1)c1cccc(NC(=O)Cc2ccccc2F)c1 604131126 VRWLMTKKOSQLJZ-DLBZAZTESA-N 464.497 5.037 5 20 JKBD C[C@@H]1CCCN(c2ccc(C(=O)N(C)C[C@H]3CCCO[C@@H]3c3ccccc3)cc2[N+](=O)[O-])C1 604519193 RTXTWNRJRFXLCB-OPJGWUQDSA-N 451.567 5.071 5 20 JKBD C[C@H](NCc1ccc(-c2ccc([N+](=O)[O-])cc2Br)o1)c1ccc(-n2cncn2)cc1 608835456 IQLHOIMLAFBQLQ-AWEZNQCLSA-N 468.311 5.049 5 20 JKBD COc1ccc(-c2nc(CN3CCN(C(=O)c4cc5ccccc5c5cccnc45)CC3)cs2)cc1 642519080 UOMDLEFAIWTGRC-UHFFFAOYSA-N 494.620 5.478 5 20 JKBD CC(=O)N(c1ccc(Cl)cc1)c1nc(COC(=O)c2c(Cl)cccc2[N+](=O)[O-])cs1 730645398 VZSUBLKUOCJLQR-UHFFFAOYSA-N 466.302 5.400 5 20 JKBD Cc1nc(COC(=O)C/C(=C/c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)cs1 748579287 NATAKXNPAMEOSO-YBEGLDIGSA-N 451.529 5.644 5 20 JKBD Cc1csc(Sc2ccc(C(=O)N3CC[C@H](Oc4ccc(C5CC5)cn4)C3)cc2[N+](=O)[O-])n1 858067834 JVHRFGDSIAXKEL-SFHVURJKSA-N 482.587 5.077 5 20 JKBD CCOc1cc(C(=O)O[C@H](C(=O)Nc2cc(Cl)ccc2Cl)C(C)C)c([N+](=O)[O-])cc1OC 915373949 PULSPWOEACYDBH-IBGZPJMESA-N 485.320 5.129 5 20 JKBD Cc1cc(NC(=O)c2ccccc2Cl)sc1C(=O)O[C@@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1 915579032 PFWBYEYYYDPDKT-ZDUSSCGKSA-N 487.921 5.054 5 20 JKBD CC(C)c1cccc(O[C@@H](C)C(=O)O[C@@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2C(F)(F)F)c1 919450902 PTCICFBKGCQEMD-KBPBESRZSA-N 468.428 5.075 5 20 JKBD O=C(/C=C/c1ccc([N+](=O)[O-])o1)NC1(c2ccc(NC(=O)c3cc4ccoc4s3)cc2)CCC1 1788413554 UHIXVIAWUVYRAU-SOFGYWHQSA-N 477.498 5.457 5 20 JKBD Cc1cc(C(=O)Nc2ccc(C3(NC(=O)/C=C/c4ccccc4[N+](=O)[O-])CCC3)cc2)c(C)n1C 1789977444 IRKYENKSCDOJCZ-NTEUORMPSA-N 472.545 5.011 5 20 JKBD COc1cccc(Cl)c1C(=O)NC1(c2ccc(NC(=O)c3cc(O)cc([N+](=O)[O-])c3)cc2)CCC1 1790757259 IDSPBGBBPUBDTH-UHFFFAOYSA-N 495.919 5.024 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)Nc1ccc(C2(NC(=O)c3cnc(Cl)s3)CCC2)cc1 1790772465 RXSYWJUZGCNZCK-UHFFFAOYSA-N 488.928 5.214 5 20 JKBD O=C(/C=C/c1ccc([N+](=O)[O-])o1)NC1(c2ccc(NC(=O)c3cccc4ccncc34)cc2)CCC1 1790856804 NYXGTQJCCWDRKD-PKNBQFBNSA-N 482.496 5.197 5 20 JKBD CC1=CC[C@H](C(=O)NC2(c3ccc(NC(=O)CSc4ccccc4[N+](=O)[O-])cc3)CCC2)CC1 1791522487 YAQBYIYPVSTJPE-IBGZPJMESA-N 479.602 5.567 5 20 JKBD Cc1nc2cccc(C(=O)N3[C@H]4CC[C@@H]3C[C@H](NC(=O)c3cc(Cl)cc([N+](=O)[O-])c3C)C4)c2s1 1797385120 HTZATXLPHLCONW-BJWYYQGGSA-N 498.992 5.040 5 20 JKBD CCC[C@H]1CC[C@H](C(=O)N2CCCC[C@H]2c2cc(NC(=O)/C=C/c3ccc([N+](=O)[O-])o3)n[nH]2)CC1 1814970005 NBVILVARVQNXES-FRIRNCEESA-N 483.569 5.223 5 20 JKBD CC(C)CCC(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cc3cc([N+](=O)[O-])ccc3s2)n[nH]1 1821610121 DDIOSAXFDIUWQK-SFHVURJKSA-N 469.567 5.275 5 20 JKBD CC(C)(C)c1ccc(C(=O)N2CCCC[C@H]2C2CCN(C(=O)c3ccc([N+](=O)[O-])o3)CC2)s1 1827907439 QTTCTKUBHJMLJT-KRWDZBQOSA-N 473.595 5.094 5 20 JKBD O=C(c1cc(O)cc([N+](=O)[O-])c1)N1CCC([C@@H]2CCCCN2C(=O)c2cccc3ccccc23)CC1 1828009751 LOADAYWOZGFKBB-SANMLTNESA-N 487.556 5.001 5 20 JKBD Cc1ccc(CC(=O)N2CCCC[C@H]2C2CCN(C(=O)C3(C)CCCCC3)CC2)cc1[N+](=O)[O-] 1830364877 WKTBDUJLDFCFMC-QHCPKHFHSA-N 469.626 5.036 5 20 JKBD Cc1ccc(C(=O)N2CCC([C@@H]3CCCCN3C(=O)c3cc(Cl)cc([N+](=O)[O-])c3C)CC2)c(C)n1 1830734274 AXKKUYAENAAKHG-QHCPKHFHSA-N 499.011 5.116 5 20 JKBD Cc1c(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)[C@@H]3CCC[C@@H]3C)CC2)cc(Cl)cc1[N+](=O)[O-] 1830736106 QQGOQACHPOYIBG-SAWYMBPVSA-N 476.017 5.226 5 20 JKBD O=C(/C=C/c1ccccc1[N+](=O)[O-])N1CCC([C@H]2CCCCN2C(=O)C23CCC(CC2)CC3)CC1 1832391302 XTTLPCCKXYAFDC-DVWLEDAASA-N 479.621 5.198 5 20 JKBD C[C@]1(C(=O)N2CCCC[C@H]2C2CCN(C(=O)Cc3ccc(Cl)cc3[N+](=O)[O-])CC2)CC=CCC1 1832402004 KNUPYMWWFFVYBH-NVQXNPDNSA-N 488.028 5.157 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)N1CCC([C@H]2CCCCN2C(=O)[C@@]2(C)CC=CCC2)CC1 1832407572 ZXHPNVTWTZXUEE-GJZUVCINSA-N 471.573 5.022 5 20 JKBD O=C(c1ccc([N+](=O)[O-])o1)N1CCC([C@H]2CCCCN2C(=O)c2cc(Cl)c(Cl)cc2F)CC1 1832712441 BNKYNQLINVAPIF-GOSISDBHSA-N 498.338 5.181 5 20 JKBD CC(=O)N(c1ccc(Cl)c(Cl)c1)c1nc(COC(=O)c2cccc([N+](=O)[O-])c2)cs1 11025692 AOFYGSSNHCMBCI-UHFFFAOYSA-N 466.302 5.400 5 20 JKBD CC(C)OCc1c(C(=O)OCC(=O)Nc2ccc([N+](=O)[O-])cc2C(F)(F)F)oc2ccccc12 11242801 LVWYGECDOPACRL-UHFFFAOYSA-N 480.395 5.080 5 20 JKBD COc1ccc(-c2[nH]c3ccccc3c2CCC(=O)OCc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)cc1 12700979 HADHDWOQNYLIFB-UHFFFAOYSA-N 498.495 5.478 5 20 JKBD O=C1c2ccccc2N[C@@H](c2ccc(Oc3ccc(F)cc3)c([N+](=O)[O-])c2)N1C[C@@H]1CCCO1 15503684 HXHFMWFSIUEVIB-YADARESESA-N 463.465 5.272 5 20 JKBD COc1ccc([N+](=O)[O-])cc1NC(=O)[C@H](C)OC(=O)c1ccc(COc2ccc3ccccc3c2)o1 25049842 WGBAXDSCVGFTSV-INIZCTEOSA-N 490.468 5.113 5 20 JKBD COc1ccc(-c2cc(C(=O)OCc3nnc(-c4ccc([N+](=O)[O-])cc4)o3)c3ccccc3n2)cc1 28614496 HHGMUUKHAAAXHM-UHFFFAOYSA-N 482.452 5.226 5 20 JKBD CC1(C)Oc2ccc(NC(=O)c3ccccc3NC(=O)c3ccc([N+](=O)[O-])cc3Cl)cc2O1 108604026 CSTCXPDYVOJWFI-UHFFFAOYSA-N 467.865 5.260 5 20 JKBD CCN(CC)C(=O)Cc1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2Sc2ccccc2)cc1 482453695 XZTFCJNESZXEPJ-UHFFFAOYSA-N 463.559 5.409 5 20 JKBD O=C(C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)Nc1ccc2oc(O)nc2c1 482929719 HYRXHBNUONUBLK-RVDMUPIBSA-N 472.482 5.621 5 20 JKBD C[C@@H](NC(=O)C(=O)Nc1ccc(Sc2ccc(Cl)cc2)cc1)c1cccc([N+](=O)[O-])c1 502692568 CETSWIOZVLJCIA-CQSZACIVSA-N 455.923 5.215 5 20 JKBD CC1CCN(Cc2ccc(CNC(=O)c3ccc(N[C@@H](C)c4ccccn4)c([N+](=O)[O-])c3)cc2)CC1 506181221 ZLXXYGDBHHUBSV-NRFANRHFSA-N 487.604 5.325 5 20 JKBD C[C@@H](NCc1ccc(Oc2ccccc2Cl)c([N+](=O)[O-])c1)c1ccc2c(c1)NC(=O)CO2 509601717 PUYLTTHTVSMNNI-CQSZACIVSA-N 453.882 5.222 5 20 JKBD COc1cc2c(cc1OC)CCN(C(=O)c1ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])cc1)CC2 510257693 NOKXEHGFNXLAEW-UHFFFAOYSA-N 482.920 5.299 5 20 JKBD C[C@H](NCc1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1)c1ccc(NC(=O)C2CC2)cc1 512818166 ZXIZGLATFHVTAR-INIZCTEOSA-N 465.937 6.240 5 20 JKBD O=C(Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1)[C@H]1CCCN(C(=O)c2cccc3ccccc23)C1 514312743 OFVVNJLIYRLIJR-IBGZPJMESA-N 486.553 5.362 5 20 JKBD CCN(Cc1ccccc1)C(=O)c1cc(NC(=O)c2ccc([N+](=O)[O-])cc2F)ccc1Cl 516533899 KDCFKPHLSBHUIS-UHFFFAOYSA-N 455.873 5.302 5 20 JKBD C[C@H](NC(=O)c1cccnc1Oc1ccc(F)cc1Br)c1cccc([N+](=O)[O-])c1 603966976 SIWCGVDSMHSDAC-LBPRGKRZSA-N 460.259 5.175 5 20 JKBD O=C(Nc1cnn(C[C@@H]2CCCO2)c1)c1ccccc1Sc1ccc(C(F)(F)F)cc1[N+](=O)[O-] 604243921 PGGQPCZDLSEMIA-INIZCTEOSA-N 492.479 5.393 5 20 JKBD O=C(c1cnc(-c2ccccc2Cl)s1)N(Cc1ccccc1[N+](=O)[O-])CC(F)(F)F 604517552 SLOFVPCOBJSYOI-UHFFFAOYSA-N 455.845 5.576 5 20 JKBD C[C@@H]1CCCN(c2ccc(C(=O)N(C)C[C@@H]3CCCO[C@@H]3c3ccccc3)cc2[N+](=O)[O-])C1 604519195 RTXTWNRJRFXLCB-RZTXVSJASA-N 451.567 5.071 5 20 JKBD CC[C@H](C)NC(=O)c1cccc(CNc2ccc(C(=O)Nc3ccc(C)cc3)cc2[N+](=O)[O-])c1 608972650 DZZURPLMKASCRD-SFHVURJKSA-N 460.534 5.296 5 20 JKBD O=C(c1ccccc1)c1ccc(Sc2nnc(-c3cccnc3)n2Cc2ccccc2)c([N+](=O)[O-])c1 619677252 XKJWSHSJJIRYDG-UHFFFAOYSA-N 493.548 5.679 5 20 JKBD Cc1nnc([C@H](C)OC(=O)C/C(=C\c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)o1 744497879 RVEAKSCNQUJMKG-XDUBLRSXSA-N 450.476 5.131 5 20 JKBD C[C@H](OC(=O)c1ccc2c(c1)-c1ccccc1C2)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 755868810 VLBYWWPUNSCBEC-ZDUSSCGKSA-N 470.403 5.369 5 20 JKBD COc1cc(CNc2ccc(N=S(C)(C)=O)cc2)ccc1OCc1ccc([N+](=O)[O-])cc1 864013636 ZMDLRENWDCRMCK-UHFFFAOYSA-N 455.536 5.154 5 20 JKBD Cc1nc(Cc2ccc(F)cc2)sc1C(=O)N(Cc1nnc(-c2cccc([N+](=O)[O-])c2)o1)C(C)C 915135690 QEZSSSTZGKNTSR-UHFFFAOYSA-N 495.536 5.190 5 20 JKBD CC1=C(C(=O)Nc2ccccc2)[C@H](c2cc([N+](=O)[O-])c(F)cc2F)NC(=S)N1c1cccc(C)c1 916723651 NZYNYIRUZAWPFL-QHCPKHFHSA-N 494.523 5.530 5 20 JKBD C[C@@H](Nc1ccc(C(=O)O[C@@H](c2ccccc2)c2ccncc2)cc1[N+](=O)[O-])c1ccccn1 920772480 NKHYLZSNLNTZFR-CJAUYULYSA-N 454.486 5.504 5 20 JKBD Cc1ccc(SCC(=O)NC2(c3ccc(NC(=O)/C=C/c4ccc([N+](=O)[O-])o4)cc3)CCC2)cc1 1786207474 QFGXBFYRDQKCQQ-UKTHLTGXSA-N 491.569 5.436 5 20 JKBD C[C@H](C(=O)Nc1ccc(C2(NC(=O)c3cc4cc([N+](=O)[O-])ccc4s3)CCC2)cc1)n1ccnc1 1786234632 BKVDNXZPTROVKE-MRXNPFEDSA-N 489.557 5.015 5 20 JKBD O=C(CCc1cccc([N+](=O)[O-])c1)Nc1ccc(C2(NC(=O)c3nc4ccccc4o3)CCC2)cc1 1786602872 XFZKYBDLHGDSFK-UHFFFAOYSA-N 484.512 5.117 5 20 JKBD O=C(/C=C/c1ccc([N+](=O)[O-])o1)NC1(c2ccc(NC(=O)Cc3ccc(Cl)cc3)cc2)CCC1 1787763146 BOCANAABBYDWMT-ZRDIBKRKSA-N 479.920 5.231 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)[C@@H]3C[C@@H]3c3ccc(Cl)cc3)CCC2)cc1)c1ccc([N+](=O)[O-])[nH]1 1790185755 DVPSCAFMVBDRSI-WOJBJXKFSA-N 478.936 5.128 5 20 JKBD CC[C@@H](C(=O)N1CCCC2(CCN(C(=O)CSc3ccccc3[N+](=O)[O-])CC2)C1)c1ccccc1 1809013071 JMJMAJQKFPVNEV-JOCHJYFZSA-N 495.645 5.112 5 20 JKBD O=C(Cc1cc(F)ccc1[N+](=O)[O-])N1CCC([C@H]2CCCCN2C(=O)/C=C/C2CCCCC2)CC1 1830356115 GWOCMYFSHLLETG-XJCKULRNSA-N 485.600 5.033 5 20 JKBD Cc1ncsc1C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)CC1 1831059014 AWPFAQBIXWXCCH-IBGZPJMESA-N 498.630 5.122 5 20 JKBD Cc1c(Cl)ccc(C(=O)N2CCCC[C@H]2C2CCN(C(=O)c3ccc([N+](=O)[O-])o3)CC2)c1Cl 1832562678 KIZIVTLALWDVSR-SFHVURJKSA-N 494.375 5.350 5 20 JKBD Cc1csc(Sc2ccc(C(=O)N3CCC(C(=O)Nc4ccccc4)CC3)cc2[N+](=O)[O-])n1 15182404 VUOJLNQSTSCZMH-UHFFFAOYSA-N 482.587 5.002 5 20 JKBD C[C@H](OC(=O)[C@@H](C)Sc1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccc(Cl)cc1C(F)(F)F 17048800 AIJNLFRUORNYLL-WDEREUQCSA-N 476.860 5.318 5 20 JKBD CCOc1ccc(Oc2ccc(NC(=O)c3cc(OC)c(OCC)cc3[N+](=O)[O-])cc2)cc1 19203133 XZCSYVKJDHKQQO-UHFFFAOYSA-N 452.463 5.445 5 20 JKBD C[C@H](Sc1nnc(-c2cccc(Br)c2)o1)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl 21322346 DIQVKVQBBWNLGR-VIFPVBQESA-N 483.731 5.180 5 20 JKBD COc1ccc([N+](=O)[O-])cc1NC(=O)[C@@H](C)Sc1nnc(-c2ccccc2)c2ccccc12 21607330 UBPLNYMWGNCOIB-OAHLLOKOSA-N 460.515 5.333 5 20 JKBD Cc1ccc(NC(=O)[C@@H](C)OC(=O)c2ccc(Sc3nc(C)cs3)c([N+](=O)[O-])c2)c(F)c1 23968916 NNFAYXIKOLEBCE-CYBMUJFWSA-N 475.523 5.142 5 20 JKBD COc1cc([N+](=O)[O-])ccc1NC(=O)CSc1nnc(SCc2ccc(C(C)C)cc2)s1 24849266 OEMTWJIYKHDCPK-UHFFFAOYSA-N 490.632 5.601 5 20 JKBD CCn1c(S[C@@H](C)C(=O)N(C)Cc2nc3ccccc3s2)nc2cc3ccccc3cc2c1=O 31747464 ZMBIQYJDGUGNBP-INIZCTEOSA-N 488.638 5.319 5 20 JKBD COc1cc(C(=O)NCc2nc3ccccc3s2)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 36835695 QUQQGFSKBBZINC-UHFFFAOYSA-N 469.906 5.589 5 20 JKBD Cc1noc(C)c1CSc1ncccc1C(=O)Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1 104847011 FQIQZDPGVZJMNM-UHFFFAOYSA-N 467.532 5.263 5 20 JKBD Cc1cc(CNC(=O)c2ccc(N[C@@H](C)c3ccccn3)c([N+](=O)[O-])c2)c2[nH]c(C)c(C)c2c1 116322081 SEBKCIWJNTWERQ-SFHVURJKSA-N 457.534 5.499 5 20 JKBD C[C@@H](Sc1nnc(-c2ccccc2Cl)n1Cc1ccccc1)C(=O)Nc1cccc([N+](=O)[O-])c1 409932228 JTDCTONSPPBZOX-MRXNPFEDSA-N 493.976 5.674 5 20 JKBD O=C(CN1C(=O)c2cccc([N+](=O)[O-])c2C1=O)Nc1ccccc1-c1ccc(-c2ccccc2)cc1 410037465 HNJXLHINWQKRAA-UHFFFAOYSA-N 477.476 5.164 5 20 JKBD CCc1cccc2c(C3CCN(C(=O)c4ccc(N[C@H](C)c5ccccn5)c([N+](=O)[O-])c4)CC3)c[nH]c12 410092311 YVSMPTKGPXDFJQ-LJQANCHMSA-N 497.599 6.226 5 20 JKBD CCOc1ccc([C@@H](NC(=O)c2cc(OCC(F)(F)F)ccc2[N+](=O)[O-])c2ccccc2)cc1 485477056 GPZNMUONGAFFJO-QFIPXVFZSA-N 474.435 5.454 5 20 JKBD Cc1cc(NC(=O)c2ccc(F)cc2Cl)sc1C(=O)N1c2ccc([N+](=O)[O-])cc2C[C@H]1C 504324872 NICKIHYNUHJNJH-GFCCVEGCSA-N 473.913 5.601 5 20 JKBD CCCCNC(=O)C1CCN(C(=O)c2cc([N+](=O)[O-])ccc2Sc2ccc(Cl)cc2)CC1 506248613 XFHZIBAUIOLVHT-UHFFFAOYSA-N 475.998 5.168 5 20 JKBD C[C@@H](Nc1ccc(C(=O)N(C)Cc2ccccc2-c2ccccc2)cc1[N+](=O)[O-])c1ccccn1 506561483 NPTJNYHYMBTNBU-HXUWFJFHSA-N 466.541 6.102 5 20 JKBD Cc1nc(NC(=O)c2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)sc1Cc1cccc(Cl)c1 507416731 CPMDKFVOIUAVRF-UHFFFAOYSA-N 467.938 5.257 5 20 JKBD CCN(Cc1ccccc1)C(=O)c1cc(NC(=O)c2ccc([N+](=O)[O-])c(OC)c2)ccc1Cl 508946072 GGOYPYTVHSGBSK-UHFFFAOYSA-N 467.909 5.171 5 20 JKBD COc1cc(C(=O)Nc2ccc(CN3CCC[C@@H](C)C3)cc2)c([N+](=O)[O-])cc1OCc1cscn1 509970164 PZGUDTTUXYDTOQ-QGZVFWFLSA-N 496.589 5.123 5 20 JKBD COc1ccccc1C[C@H](C)N(Cc1ccccc1)Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1 513962324 VPVPIITULKKLGU-IBGZPJMESA-N 458.518 5.287 5 20 JKBD CN(C)C(=O)c1cccc(NC(=O)c2ccc(Sc3nc4ccccc4s3)c([N+](=O)[O-])c2)c1 514935574 RFKIUBRFLXJIFE-UHFFFAOYSA-N 478.555 5.310 5 20 JKBD Cc1cc(NC(=O)c2sc(NC(=O)c3ccccc3Cl)cc2C)n(-c2ccc([N+](=O)[O-])cc2)n1 517724731 UWCQABIBYQRGHV-UHFFFAOYSA-N 495.948 5.617 5 20 JKBD CN(C)C[C@@H]1CCCCN1C(=O)C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1 517861742 LHQXEMGGDNYUPN-DQYQWZCESA-N 464.591 5.078 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Cl)[C@H](Nc1cccc(OC[C@@H]2CCCO2)c1)c1ccccc1 518994342 BGZGVPYXQSCNPG-XUZZJYLKSA-N 481.936 5.598 5 20 JKBD NC(=O)c1ccc(SCC(=O)Nc2ccc(Oc3ccccc3)cc2C(F)(F)F)c([N+](=O)[O-])c1 520677522 ZEXYIFMVKSSKFD-UHFFFAOYSA-N 491.447 5.236 5 20 JKBD Cc1ccc(NC(=O)c2ccc(N3CCC(C)CC3)c([N+](=O)[O-])c2)cc1NC(=O)c1ccncc1 521392774 IRUHUZBGIOZFPJ-UHFFFAOYSA-N 473.533 5.039 5 20 JKBD CC(C)[C@@H](NC(=O)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1)c1nnc2ccccn12 523557372 LMSWHVIBXWHETM-OAQYLSRUSA-N 465.897 5.210 5 20 JKBD Cc1cccc(N(CCC(N)=O)C(=O)c2ccc(Sc3nc4ccccc4s3)c([N+](=O)[O-])c2)c1 523578949 NLVIANHXHDJXBT-UHFFFAOYSA-N 492.582 5.186 5 20 JKBD CN(CC(=O)Nc1ccccc1)C(=O)C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1 603596645 REUGUJMFJKLQFI-XDJHFCHBSA-N 486.553 5.232 5 20 JKBD O=C(Nc1cc([N+](=O)[O-])ccc1OC(F)F)c1cn(-c2ccccc2)nc1-c1ccccc1 603638294 ATQQRLIVNWAJKR-UHFFFAOYSA-N 450.401 5.301 5 20 JKBD CN(C(=O)c1ccc(NC(=O)c2cc3cc([N+](=O)[O-])ccc3o2)cc1Cl)C1CCCCC1 603982623 LZHZNESJQOGHDZ-UHFFFAOYSA-N 455.898 5.651 5 20 JKBD COc1ccc(CN[C@H](C(=O)Nc2cccc(C(F)(F)F)c2)c2ccccc2)cc1[N+](=O)[O-] 604047372 PSGAPTQPORAWGA-NRFANRHFSA-N 459.424 5.092 5 20 JKBD O=C(Nc1nc(-c2cc(Cl)ccc2Cl)cs1)c1cc([N+](=O)[O-])cc2c1OCCO2 608931804 WFWMYQOBBMEZDM-UHFFFAOYSA-N 452.275 5.049 5 20 JKBD Cn1c(-c2ccc(NC(=O)c3cc(OCC(F)(F)F)ccc3[N+](=O)[O-])cc2)nc2ccccc21 608954230 DEGLBGGOHJNXPK-UHFFFAOYSA-N 470.407 5.342 5 20 JKBD CC(C)(NCc1ccc(-c2ccc([N+](=O)[O-])cc2Br)o1)C(=O)Nc1ccccc1 609392925 BLMGQAYNNGBIPV-UHFFFAOYSA-N 458.312 5.124 5 20 JKBD CC[C@@H]1c2ccsc2CCN1C(=O)CSc1nc2cc3ccccc3cc2c(=O)n1CC 670314804 NRKWUQPCAWVXBI-OAQYLSRUSA-N 463.628 5.259 5 20 JKBD O=C(C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)OCc1cccnc1Cl 729698354 CJJXOPVWXYXVIJ-SFQUDFHCSA-N 465.918 5.927 5 20 JKBD O=C(NCc1ccc(NC(=O)c2cc(Cl)ccc2[N+](=O)[O-])cc1)c1ccc(C(F)(F)F)cc1 730763006 SQHCRDORPACIMN-UHFFFAOYSA-N 477.826 5.449 5 20 JKBD O=C(Cc1coc2cc(O)ccc12)O[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1 779873842 ZSILDIBDMKQXIU-QHCPKHFHSA-N 480.860 5.166 5 20 JKBD CN(C)c1ccc(NC(=O)C/C(=C\c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)cc1 875540574 BJSJDYZBNVCGGN-OBGWFSINSA-N 458.543 5.840 5 20 JKBD COc1ccc(NC(=O)c2ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])c(OC)c2)c([N+](=O)[O-])c1 916665261 QHNZUSAYUBXNID-UHFFFAOYSA-N 473.825 5.218 5 20 JKBD O=C(C=C1CCCC1)O[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Br)c1ccccc1 917983401 BNPFRYCZMCVNGT-FQEVSTJZSA-N 459.296 5.081 5 20 JKBD C[C@H](SCc1nc(O)c2c(-c3ccccc3)csc2n1)C(=O)OCCc1ccc([N+](=O)[O-])cc1 918899183 DHHKIRCORBJKPU-HNNXBMFYSA-N 495.582 5.380 5 20 JKBD C[C@H](Nc1ccc(OC2CCCC2)c(Cl)c1)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 920061786 IBTWNXWBGIMOLD-LBPRGKRZSA-N 471.863 6.028 5 20 JKBD O=C(Cc1cccc([N+](=O)[O-])c1)Nc1ccc(C2(NC(=O)c3cccc4ncsc34)CCC2)cc1 1785791479 ADKCHDGXDNOJGP-UHFFFAOYSA-N 486.553 5.195 5 20 JKBD O=C(CCc1cccc([N+](=O)[O-])c1)Nc1ccc(C2(NC(=O)C(F)(F)c3ccco3)CCC2)cc1 1786602670 MHFHNBFOCAJOJH-UHFFFAOYSA-N 483.471 5.047 5 20 JKBD CCc1ccc(C(=O)Nc2ccc(C3(NC(=O)/C=C/c4ccccc4[N+](=O)[O-])CCC3)cc2)cn1 1787257569 FNCLTRFKFFODSH-OQLLNIDSSA-N 470.529 5.013 5 20 JKBD O=C(Cc1ccccc1F)Nc1ccc(C2(NC(=O)CSc3ccccc3[N+](=O)[O-])CCC2)cc1 1787745906 CRAQJHPFRZSZAX-UHFFFAOYSA-N 493.560 5.203 5 20 JKBD COc1cc(CC(=O)Nc2ccc(C3(NC(=O)[C@@H]4C[C@H]4c4ccccc4)CCC3)cc2)ccc1[N+](=O)[O-] 1790479164 AELHQRULHKVMFD-BJKOFHAPSA-N 499.567 5.084 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)[C@@]3(F)CCCC=C3F)CCC2)cc1)c1cccc(F)c1[N+](=O)[O-] 1790702498 ISRHOPMXUOEHLY-XMMPIXPASA-N 473.451 5.227 5 20 JKBD Cc1c(C(=O)N2CC[C@H](CNC(=O)C3(C)CCCCC3)[C@@H]2c2cccnc2)cc(Cl)cc1[N+](=O)[O-] 1813006584 YCGSAFFGUYGVME-XXBNENTESA-N 499.011 5.242 5 20 JKBD O=C(/C=C/c1ccccc1[N+](=O)[O-])N1CCC([C@@H]2CCCCN2C(=O)/C=C/c2ccsc2)CC1 1825304234 NWMHXXDRIWXHER-AGGCPREJSA-N 479.602 5.003 5 20 JKBD O=C(c1ccc(Cl)o1)N1CCCC[C@@H]1C1CCN(C(=O)C2(c3cccc([N+](=O)[O-])c3)CCC2)CC1 1827984399 AVJSFAVVYGXTGA-OAQYLSRUSA-N 499.995 5.196 5 20 JKBD Cc1cc2cccc(C(=O)N3CCCC[C@@H]3C3CCN(C(=O)c4cccc(F)c4[N+](=O)[O-])CC3)c2[nH]1 1828214241 GFQRAHBQTAXMRJ-HSZRJFAPSA-N 492.551 5.071 5 20 JKBD O=C(/C=C/C1CCCCC1)N1CCC([C@H]2CCCCN2C(=O)c2ccc([N+](=O)[O-])cc2F)CC1 1830499125 OXKFXLARMYRNNQ-XJCKULRNSA-N 471.573 5.104 5 20 JKBD CC(C)c1ccccc1-n1c(SCC(=O)N(C)c2ccc([N+](=O)[O-])cc2)nnc1-c1cccnc1 9804504 XKDKMLSMPOVVLQ-UHFFFAOYSA-N 488.573 5.116 5 20 JKBD C[C@H](OC(=O)c1ccccc1OCc1ccccc1)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl 10863879 VVWTURWUDKMFGM-HNNXBMFYSA-N 454.866 5.011 5 20 JKBD CCOc1cc([N+](=O)[O-])c(C(=O)Nc2ccc(-c3nc4ccc(C)cc4s3)cc2)cc1OC 15510875 PWPDTRNGVPVROI-UHFFFAOYSA-N 463.515 5.840 5 20 JKBD O=C(CSc1ccc(F)c(F)c1)Oc1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2Cl)cc1 15600294 QUSVKSSMGKQPNU-UHFFFAOYSA-N 478.860 5.476 5 20 JKBD COc1cc(C(=O)Nc2ccc(C(=O)N(C)C)cc2)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 16013488 MMRLJFDCGBDISV-UHFFFAOYSA-N 469.881 5.003 5 20 JKBD O=C(Nc1cccc(C2SCCS2)c1)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 18216351 FINZTUYAZJCXAI-UHFFFAOYSA-N 497.564 5.947 5 20 JKBD Cc1ccc(-n2c(SCC(=O)Nc3c(C)cccc3[N+](=O)[O-])nnc2-c2ccccc2F)cc1 20888466 CYXRTSATTBTBHU-UHFFFAOYSA-N 477.521 5.329 5 20 JKBD COc1ccc([N+](=O)[O-])cc1NC(=O)[C@H](C)Sc1ncnc2sc(-c3ccccc3)cc12 23560367 WMPBHOKXRXNGIQ-ZDUSSCGKSA-N 466.544 5.394 5 20 JKBD Cc1ccc(-c2csc3ncnc(SCC(=O)Nc4cc5c(cc4[N+](=O)[O-])OCO5)c23)cc1 26564973 MQNIIYLDMRCLII-UHFFFAOYSA-N 480.527 5.034 5 20 JKBD CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)[C@@H]1CCCN(C(=O)c2cccc3ccccc23)C1 302999726 KPEOGSKZHRJEFX-JOCHJYFZSA-N 459.546 5.037 5 20 JKBD O=C(C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)N[C@@H]1COc2ccccc2C1 480069829 NCQQENOTBRCJNS-DTBYZMGXSA-N 471.538 5.255 5 20 JKBD CCCN(CCC)C(=O)c1cccc(C(=O)Nc2nc(-c3ccc(C)c([N+](=O)[O-])c3)cs2)c1 482108893 WPJLZTVLKGLUMZ-UHFFFAOYSA-N 466.563 5.541 5 20 JKBD O=C(Nc1ccccc1NC(=O)N1CCCC1)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1 485122942 IHTVMLLQOPXKKW-UHFFFAOYSA-N 480.908 5.921 5 20 JKBD CCC(C)(C)NC(=O)c1ccc(NC(=O)c2csc(-c3cccc([N+](=O)[O-])c3)n2)cc1Cl 495504614 WCEMVSDQKFCQRT-UHFFFAOYSA-N 472.954 5.542 5 20 JKBD Cc1cccc(-n2c(S[C@H](C)c3nnc(-c4ccc([N+](=O)[O-])cc4)o3)nnc2-c2ccccc2)c1 501210489 NSWYUGMRVZLRSY-QGZVFWFLSA-N 484.541 6.054 5 20 JKBD Cc1ccc(C(=O)N(CC(=O)Nc2ccc(Cl)cc2C(F)(F)F)C(C)C)cc1[N+](=O)[O-] 504812998 JGTYWWRKBQPSPI-UHFFFAOYSA-N 457.836 5.065 5 20 JKBD CC(=O)N(c1ccc(C(F)(F)F)cc1)c1nc(COc2ccc(Cl)cc2[N+](=O)[O-])cs1 505843288 WQHJYLCGXHZZIK-UHFFFAOYSA-N 471.844 5.987 5 20 JKBD C[C@H](Nc1ccc(C(=O)Nc2nc(-c3ccccc3Cl)cs2)cc1[N+](=O)[O-])c1ccccn1 506236149 QCCQMXJBVVSHSG-AWEZNQCLSA-N 479.949 6.192 5 20 JKBD Cc1nc2ccccc2n1CCNC(=O)C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1 515185113 MLBOYMUCDQCHLN-CAPFRKAQSA-N 497.580 5.610 5 20 JKBD C[C@@H](Nc1ccc(F)c(NC(=O)Cc2ccccc2)c1)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl 515717376 GFBYLLVWFVFUPJ-CQSZACIVSA-N 470.888 5.008 5 20 JKBD C[C@@H](Nc1ccc(C(=O)Nc2cccc(-c3ccc4c(c3)CCO4)n2)cc1[N+](=O)[O-])c1ccccn1 518144100 GMIKMJFKDXZGDM-QGZVFWFLSA-N 481.512 5.412 5 20 JKBD O=C(Nc1ccc(Cn2cncn2)cc1)c1ccccc1Sc1ccc(C(F)(F)F)cc1[N+](=O)[O-] 603569633 SXDNSTFAMGFBMH-UHFFFAOYSA-N 499.474 5.657 5 20 JKBD COc1cc([C@H](C)NC(=O)c2ccc(N3CCCC3)c([N+](=O)[O-])c2)ccc1OC1CCCC1 603904100 IWAWFPYBTWXNJA-KRWDZBQOSA-N 453.539 5.016 5 20 JKBD O=C(NC[C@H]1CCCOC1)c1c2c(nc3ccccc13)/C(=C/c1cccc([N+](=O)[O-])c1)CCC2 604013662 CNCMJWGGLGACOB-YFQSIASUSA-N 457.530 5.176 5 20 JKBD CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)C[C@@H](NC(=O)c1ccccc1Cl)c1ccccc1 604388535 MSPZCVUDEIECQB-XMMPIXPASA-N 479.964 5.547 5 20 JKBD CN(CCCCCc1cc(-c2cccc(F)c2)n[nH]1)C(=O)Cn1c2ccccc2c(=O)c2ccccc21 617364107 PDRBAPSDLLJKBZ-UHFFFAOYSA-N 496.586 5.555 5 20 JKBD Cc1ccccc1NC(=O)[C@H]1CCc2ccccc2N1C(=O)c1cc([N+](=O)[O-])c(C)c([N+](=O)[O-])c1C 726918811 MAKVCUBQMQYULL-JOCHJYFZSA-N 488.500 5.029 5 20 JKBD O=C(Nc1cccc(C(=O)N(CC2CC2)c2ccc(Cl)c([N+](=O)[O-])c2)c1)[C@@H]1Cc2ccccc2O1 728166249 XYNSLMYCAYXQLE-DEOSSOPVSA-N 491.931 5.247 5 20 JKBD O=C(Nc1n[nH]c(-c2cccc([N+](=O)[O-])c2)n1)c1sc2cc(Br)ccc2c1Cl 729862403 ANARHPSJUYOGMQ-UHFFFAOYSA-N 478.715 5.263 5 20 JKBD CN(C(=O)c1ccccc1NC(=O)c1csc(-c2ccc([N+](=O)[O-])cc2)n1)C1CCCCC1 747643499 CXUBHAUKRXQQGV-UHFFFAOYSA-N 464.547 5.375 5 20 JKBD O=C(COC(=O)c1occc1CSc1ccccc1)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 792737067 GCOXUXPJJLJRKN-UHFFFAOYSA-N 480.420 5.294 5 20 JKBD O=[N+]([O-])c1ccc(-c2nn(-c3ccccc3)cc2Cc2nc(COc3ccccc3F)no2)cc1 904730533 RZGKDEFEMHNRGT-UHFFFAOYSA-N 471.448 5.139 5 20 JKBD CC(C)(C)OC(=O)Nc1ccc(F)c(NC(=O)c2cc(OCC(F)(F)F)ccc2[N+](=O)[O-])c1 915856286 JVWVRHYYCZONBT-UHFFFAOYSA-N 473.379 5.274 5 20 JKBD Cc1ccc(-c2nnc(SCC(=O)Nc3cc(Cl)ccc3[N+](=O)[O-])n2Cc2ccco2)cc1 916664869 QLLRPOISTXZTMP-UHFFFAOYSA-N 483.937 5.187 5 20 JKBD CN(C(=O)c1sc2cc(Cl)ccc2c1Cl)S(=O)(=O)c1ccc(Cl)c([N+](=O)[O-])c1 916991284 RYYKSPOFGGLRKB-UHFFFAOYSA-N 479.750 5.231 5 20 JKBD C[C@H](OC(=O)[C@H](C)Oc1ccc(Cl)c(Cl)c1)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 919443583 RXPDSFNUCHYMQV-UWVGGRQHSA-N 495.237 5.258 5 20 JKBD CSCC[C@H](NC(=O)c1cccc(C)c1)C(=O)Oc1ccc(-c2ccccc2)cc1[N+](=O)[O-] 920330363 ASKLDKWBXHUUPL-NRFANRHFSA-N 464.543 5.027 5 20 JKBD O=C(NC1(c2ccc(NC(=O)c3ccc([N+](=O)[O-])o3)cc2)CCC1)c1ccc(F)c(C(F)(F)F)c1 1785753000 ZFMWTNZDZRGUBK-UHFFFAOYSA-N 491.397 5.407 5 20 JKBD Cc1cc(C(=O)NC2(c3ccc(NC(=O)c4cc(Br)ccc4[N+](=O)[O-])cc3)CCC2)c[nH]1 1790664025 QMRUENRBTCNOOF-UHFFFAOYSA-N 497.349 5.055 5 20 JKBD O=C(NC1(c2ccc(NC(=O)c3cccc4ccoc34)cc2)CCC1)c1cc(F)cc([N+](=O)[O-])c1 1790956516 KWHDYXAMVDOYOE-UHFFFAOYSA-N 473.460 5.542 5 20 JKBD O=C(Cc1cc(F)ccc1[N+](=O)[O-])Nc1ccc(C2(NC(=O)c3cccc4cc[nH]c34)CCC2)cc1 1792308773 KLUVGGFGDZSZGB-UHFFFAOYSA-N 486.503 5.206 5 20 JKBD CCC[C@H]1CC[C@H](C(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3cc(C)c([N+](=O)[O-])cn3)CC2)CC1 1831560976 IQMIVYCZRKBMIV-KIFXHHALSA-N 484.641 5.138 5 20 JKBD COc1cc(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3ccc(C4CC4)cc3)CC2)ccc1[N+](=O)[O-] 1832696360 XKMBMKZQJLDTRW-XMMPIXPASA-N 491.588 5.028 5 20 JKBD CC(C)c1ccc(-c2nc(CC(=O)OCC(=O)Nc3ccc([N+](=O)[O-])cc3Cl)cs2)cc1 9554977 REZDJARYNCDPLB-UHFFFAOYSA-N 473.938 5.220 5 20 JKBD COc1ccc([N+](=O)[O-])cc1NC(=O)[C@@H](C)Sc1nc(-c2cccs2)nc2ccccc12 12424592 RVINESBRUJUMGN-CYBMUJFWSA-N 466.544 5.394 5 20 JKBD Cc1ccc(-n2c(SCC(=O)Nc3cc(Cl)ccc3[N+](=O)[O-])nnc2-c2ccncc2)cc1C 24672956 UVSXHBQUNRGDMJ-UHFFFAOYSA-N 494.964 5.239 5 20 JKBD Cc1ccc(Sc2ccc(C(=O)Nc3cccc(CN4CCCC4=O)c3)cc2[N+](=O)[O-])cc1 29286872 JJKSSTKPESGURW-UHFFFAOYSA-N 461.543 5.429 5 20 JKBD C[C@H](NC(=O)c1ccc(N2CCCC2)c([N+](=O)[O-])c1)c1ccc(NC(=O)c2ccc(F)cc2)cc1 68737196 QNXNNLQPKKFVLT-KRWDZBQOSA-N 476.508 5.077 5 20 JKBD Cc1noc2nc(-c3ccc(F)cc3)cc(C(=O)O[C@@H](C)C(=O)Nc3cc([N+](=O)[O-])ccc3Cl)c12 105432032 NVEHFHMGMXXJKC-LBPRGKRZSA-N 498.854 5.083 5 20 JKBD C[C@H](NC(=O)Cn1ccc2cc([N+](=O)[O-])ccc21)c1ccc(NC(=O)Nc2ccccc2)cc1 109347377 GKONHTFQCUNVJR-KRWDZBQOSA-N 457.490 5.071 5 20 JKBD C[C@@H](Sc1ncc(-c2ccccc2)n1CC(F)(F)F)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 109623143 WOOBZHMXUGTWSY-CYBMUJFWSA-N 475.452 5.924 5 20 JKBD O=C(C[C@H]1C=CCC1)Nc1ccccc1NC(=O)Cn1c2ccccc2c(=O)c2ccccc21 303317041 QKFTXIRBENXWQG-IBGZPJMESA-N 451.526 5.088 5 20 JKBD C[C@H]1C[C@H](C)CN(c2ccc(C(=O)Nc3cc(N4CCCC4=O)ccc3Cl)cc2[N+](=O)[O-])C1 485376038 IJRQZJFPGBVQJO-HOTGVXAUSA-N 470.957 5.110 5 20 JKBD CN(C)c1cccc(CNC(=O)C/C(=C/c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)c1 498532215 QQRYNFJKGNCYDO-ZHZULCJRSA-N 472.570 5.518 5 20 JKBD O=C(NCC1(c2ccc(F)cc2)CCC1)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 503853020 FWCQVNQLQDHUII-UHFFFAOYSA-N 479.474 5.207 5 20 JKBD CC[C@H](C)C(=O)Nc1cccc(CNC(=O)c2ccc(N[C@@H](C)c3ccccn3)c([N+](=O)[O-])c2)c1 507367883 MTGXFXPBQYPMAV-ROUUACIJSA-N 475.549 5.078 5 20 JKBD C[C@@H](Nc1ccc(C(=O)N[C@@H]2CCOc3c(Cl)cccc32)cc1[N+](=O)[O-])c1ccccn1 507891230 IBENDUNMIBYROM-AUUYWEPGSA-N 452.898 5.070 5 20 JKBD Cc1ccc(NC(=O)c2ccc(Sc3nc(C)cs3)c([N+](=O)[O-])c2)c(OC[C@@H]2CCCO2)c1 508006985 BUQJBWCSTVIQRJ-KRWDZBQOSA-N 485.587 5.629 5 20 JKBD COc1cc(C(=O)Nc2cc([N+](=O)[O-])ccc2OC(F)F)cc(OC)c1OCc1ccccc1 515098389 XMRABQJUPZPIIG-UHFFFAOYSA-N 474.416 5.045 5 20 JKBD CCOC(=O)c1cc(C(=O)N(Cc2ccc(Cl)c(Cl)c2)Cc2ccccn2)cc([N+](=O)[O-])c1 519067611 HDIMIUXVVMLCHL-UHFFFAOYSA-N 488.327 5.316 5 20 JKBD CN(C)c1ccc(NC(=O)C/C(=C\c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)nc1 519880605 QNYXHJUQHICZED-GHRIWEEISA-N 459.531 5.235 5 20 JKBD COc1cc(CN[C@H](c2ccccc2)c2ccccn2)ccc1OCc1ccc([N+](=O)[O-])cc1 521823087 CMHGSWUAMCRFLP-HHHXNRCGSA-N 455.514 5.457 5 20 JKBD Cc1nn(Cc2ccccc2Cl)c2sc(C(=O)N3CCc4ccc([N+](=O)[O-])cc43)cc12 589980552 ZHYHTFJRQBSHNV-UHFFFAOYSA-N 452.923 5.219 5 20 JKBD O=C1c2cc(Cl)ccc2N[C@@H](c2ccc(Br)cc2[N+](=O)[O-])N1c1ccncc1 602754018 AJMKFCCLGCKRNY-GOSISDBHSA-N 459.687 5.177 5 20 JKBD CN(CC(=O)Nc1c(Cl)cccc1Cl)C(=O)c1cc([N+](=O)[O-])ccc1Oc1ccccc1 603730424 CGWYOYYHNMUUPZ-UHFFFAOYSA-N 474.300 5.405 5 20 JKBD O=[N+]([O-])c1ccc(-c2ccc(CNC3C[C@H](C(F)(F)F)C[C@@H](C(F)(F)F)C3)s2)cc1 608835865 RAXYZRSOZUDYFE-CHWSQXEVSA-N 452.420 6.322 5 20 JKBD O=[N+]([O-])c1ccc(-c2nn(-c3ccccc3)cc2CNCc2csc(-c3ccccc3)n2)cc1 608836528 OYEPKXBRXQCRMP-UHFFFAOYSA-N 467.554 5.861 5 20 JKBD C[C@@H]1CN(C(=O)c2c3c(nc4ccccc24)/C(=C/c2cccc([N+](=O)[O-])c2)CCC3)CCCO1 608946300 IBXJVNMUUVLDHF-KETZHDHUSA-N 457.530 5.271 5 20 JKBD Cc1ccc(NC(=O)c2ccc(N[C@H](c3ccccc3F)c3nccn3C)c([N+](=O)[O-])c2)cc1 608971334 ICOPNFIKXAVBGW-HSZRJFAPSA-N 459.481 5.230 5 20 JKBD COc1ccc(C(=O)Nc2nc3ccccc3n2Cc2cccc(C(F)(F)F)c2)cc1[N+](=O)[O-] 609062698 DELFQNVZYSZCLZ-UHFFFAOYSA-N 470.407 5.273 5 20 JKBD O=C(c1ccc(I)c([N+](=O)[O-])c1)N1CCc2sccc2[C@@H]1c1cccs1 727748152 KBLUVAGGIGDPLH-QGZVFWFLSA-N 496.351 5.110 5 20 JKBD C[C@H](NC(=O)c1cc([N+](=O)[O-])ccc1Sc1ccc(Cl)cc1)c1ccc2c(c1)CC(=O)N2C 728254031 GLBRTGBKFYRATK-AWEZNQCLSA-N 481.961 5.409 5 20 JKBD O=C(OC[C@@H]1CCCN1C(=O)c1ccccc1[N+](=O)[O-])[C@@H]1CC=CC[C@@H]1c1nc2ccccc2s1 730704916 WHPYOLYMIOBJHS-GBESFXJTSA-N 491.569 5.102 5 20 JKBD C[C@H](c1cccc(C(F)(F)F)c1)N(Cn1nc(-c2cccc([N+](=O)[O-])c2)ccc1=O)C1CC1 747074255 NPBXJVSRAUIYPK-OAHLLOKOSA-N 458.440 5.020 5 20 JKBD C[C@@H](OC(=O)c1csc(-c2ccc([N+](=O)[O-])cc2)n1)C(=O)N[C@H](C)c1ccc2ccccc2c1 747956544 HJBDMCGGVOUTKW-HZPDHXFCSA-N 475.526 5.294 5 20 JKBD CC[C@@H](C)NC(=S)/C(=C(/O)c1ccc(C)c([N+](=O)[O-])c1)[n+]1ccc(Cc2ccccc2)cc1 749885129 FGHAFMYPYWQESC-LJQANCHMSA-O 462.595 5.381 5 20 JKBD CC(C)c1ccc(-c2nc(CC(=O)OCc3nc(-c4cccc([N+](=O)[O-])c4)no3)cs2)cc1 914884374 BTDSBHCRPFUWRD-UHFFFAOYSA-N 464.503 5.178 5 20 JKBD O=C(CSCc1coc(-c2ccccc2)n1)Oc1ccc(NC(=O)c2cccc([N+](=O)[O-])c2)cc1 916036306 NBIXVNOLRTZQNU-UHFFFAOYSA-N 489.509 5.341 5 20 JKBD CC(C)c1cccc(C(C)C)c1NC(=S)/C(=C(/O)c1ccc([N+](=O)[O-])cc1)[n+]1ccccc1 917609875 BYQRJOIPBMNBHM-UHFFFAOYSA-O 462.595 6.452 5 20 JKBD C[C@H](OC(=O)c1ccc(N[C@@H](C)c2ccccn2)c([N+](=O)[O-])c1)C(=O)N[C@@H](C)c1ccc(Cl)cc1 920548893 UUFFRMVDHOJOCK-ULQDDVLXSA-N 496.951 5.239 5 20 JKBD C[C@H](OC(=O)C1=NN(c2ccccc2)[C@H](c2ccccc2)C1)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl 934167057 IYUBYJTXMNEOQD-HJPURHCSSA-N 492.919 5.126 5 20 JKBD O=C(NC1(c2ccc(NC(=O)c3c[nH]c4cc(Cl)ccc34)cc2)CCC1)c1ccc([N+](=O)[O-])o1 1788981771 ODKPGHWYOPEIQP-UHFFFAOYSA-N 478.892 5.384 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)c3ccc([N+](=O)[O-])[nH]3)CCC2)cc1)c1ccc(Cl)c(Cl)c1 1790267149 DSTASGHUENKSEO-UHFFFAOYSA-N 473.316 5.291 5 20 JKBD C[C@H](CC(=O)Nc1ccc(C2(NC(=O)Cc3cccc([N+](=O)[O-])c3)CCC2)cc1)Oc1ccccc1 1791144117 KAJIPQCPUMAWEX-HXUWFJFHSA-N 487.556 5.129 5 20 JKBD CC(=O)Nc1ccc(C(=O)Nc2ccc(C3(NC(=O)/C=C/c4ccccc4[N+](=O)[O-])CCC3)cc2)cc1 1792136010 NUHYMQFSQVYXEJ-CXUHLZMHSA-N 498.539 5.014 5 20 JKBD CC[C@H](C)[C@@H](C(=O)N1CCC2(CCCN(C(=O)/C=C/c3ccc([N+](=O)[O-])o3)C2)CC1)c1ccccc1 1805681937 BGVJKVTUZKMEAV-KRQJIXKBSA-N 493.604 5.262 5 20 JKBD CC(C)=CCCC(=O)NC[C@H]1CCN(C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)[C@@H]1c1cccnc1 1807997048 KNJSMODQTPGNTQ-KBMIEXCESA-N 492.601 5.271 5 20 JKBD CC1(C(=O)N2CC[C@H](CNC(=O)c3cc4cc([N+](=O)[O-])ccc4s3)[C@@H]2c2cccnc2)CCCC1 1812304865 VJQGPBYBROZLMI-JPYJTQIMSA-N 492.601 5.104 5 20 JKBD O=C(Cc1cccs1)Nc1cc([C@H]2CCCCN2C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)[nH]n1 1817579981 LKEIARLJLZJCPE-GOSISDBHSA-N 495.586 5.143 5 20 JKBD C[C@H](CC(=O)Nc1cc([C@@H]2CCCCN2C(=O)CCc2cccc([N+](=O)[O-])c2)[nH]n1)c1ccccc1 1822040953 HKLVLBKOLCDJNT-DVECYGJZSA-N 489.576 5.137 5 20 JKBD Cc1cc(Cl)ccc1C(=O)N1CCC([C@H]2CCCCN2C(=O)Cc2cccc([N+](=O)[O-])c2)CC1 1823677352 WEDIBKHWHBEPSL-XMMPIXPASA-N 483.996 5.033 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2c[nH]c(C(C)(C)C)c2)CC1 1825439018 MHVHFEFJWUUKNC-QFIPXVFZSA-N 498.599 5.215 5 20 JKBD Cc1oc(C(C)(C)C)cc1C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cccc(F)c2[N+](=O)[O-])CC1 1825951440 QMTXVDSRYIBZGF-JOCHJYFZSA-N 499.583 5.480 5 20 JKBD O=C(c1cc(F)cc([N+](=O)[O-])c1)N1CCC([C@@H]2CCCCN2C(=O)c2cc3ccccc3o2)CC1 1828189798 BUBVVNRLLNJVKD-QFIPXVFZSA-N 479.508 5.027 5 20 JKBD Cc1cc(CCCC(=O)N2CCC([C@@H]3CCCCN3C(=O)[C@]3(C)C[C@@H]3C)CC2)c([N+](=O)[O-])cc1F 1830216703 SIRHISHZNMQALL-HLULCQHTSA-N 487.616 5.031 5 20 JKBD Cc1ccc(SCC(=O)N2CCC([C@@H]3CCCCN3C(=O)c3cc(F)cc([N+](=O)[O-])c3)CC2)cc1 1830617457 PWYDGDLUERFJKA-DEOSSOPVSA-N 499.608 5.068 5 20 JKBD Cc1cccc([N+](=O)[O-])c1NC(=O)CSc1nnc(-c2ccccc2Cl)n1-c1ccccc1F 8750297 SUQFTSRBSKYFLI-UHFFFAOYSA-N 497.939 5.674 5 20 JKBD Cc1cccc([N+](=O)[O-])c1NC(=O)COC(=O)c1ccccc1OCc1ccccc1Br 9746495 LDOLOLYTKOHDEK-UHFFFAOYSA-N 499.317 5.040 5 20 JKBD COc1ccccc1-n1c(S[C@@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2)nnc1-c1cccs1 23545689 DMQOMXCLUXNNMF-AWEZNQCLSA-N 481.559 5.032 5 20 JKBD O=C(Nc1ccccc1-c1cccs1)c1ccc(OS(=O)(=O)c2cccc([N+](=O)[O-])c2)cc1 24779724 FIDOHZZCUYXADP-UHFFFAOYSA-N 480.523 5.343 5 20 JKBD C[C@@H](NC(=O)c1ccc(NC2CC2)c([N+](=O)[O-])c1)c1ccc(NC(=O)Nc2ccccc2)cc1 480796926 YXLJMHWPOSEJBI-MRXNPFEDSA-N 459.506 5.304 5 20 JKBD COc1ccc(OC)c(-c2nn(-c3ccccc3)cc2C(=O)Nc2cc([N+](=O)[O-])ccc2C)c1 481162726 HCPGZXPGYOSKEX-UHFFFAOYSA-N 458.474 5.025 5 20 JKBD C[C@@H](Cc1cccs1)N(Cc1ccc(Cl)cc1)C(=O)c1ccc(-n2cncn2)c([N+](=O)[O-])c1 497035727 QNFVHYRMQFVAFF-INIZCTEOSA-N 481.965 5.164 5 20 JKBD COc1cc(C(=O)N(C2CC2)[C@@H](C)c2cccc(C(F)(F)F)c2)c([N+](=O)[O-])cc1OC(F)F 502887654 MYBMFANCLTUEHD-NSHDSACASA-N 474.382 5.589 5 20 JKBD CCc1cc(Sc2nnc(-c3ccccc3Br)o2)nc(-c2ccc([N+](=O)[O-])cc2)n1 507122186 SDDIHJMPQHGINX-UHFFFAOYSA-N 484.335 5.578 5 20 JKBD CCOc1cc([N+](=O)[O-])c(C(=O)Nc2ccc(Cl)cc2C(=O)N2[C@H](C)CCC[C@H]2C)cc1OC 508288231 MJSLYXBKJSZSAF-HUUCEWRRSA-N 489.956 5.311 5 20 JKBD COc1cc(C(=O)Nc2cc(-c3ccc(C)cc3)nn2-c2ccccc2)c([N+](=O)[O-])cc1OC 514735520 CGLWJAGZWKSFCY-UHFFFAOYSA-N 458.474 5.025 5 20 JKBD O=C(NC1CCN(C(=O)Nc2ccccc2)CC1)c1cc([N+](=O)[O-])ccc1Sc1ccccc1 514990437 NJXNHNTYOLFOHS-UHFFFAOYSA-N 476.558 5.172 5 20 JKBD O=C(Nc1ccc(Cl)cc1Cl)[C@@H]1CCCCN1C(=O)c1ccc(N2CCCC2)c([N+](=O)[O-])c1 517374523 VRFQMLXXQIJLAD-FQEVSTJZSA-N 491.375 5.135 5 20 JKBD Cc1ccc([N+](=O)[O-])cc1NC(=O)C(=O)N(Cc1ccc(-c2ccccc2C(F)(F)F)o1)C1CC1 518582642 LYOSZFZBKLUFCK-UHFFFAOYSA-N 487.434 5.312 5 20 JKBD CCCN(C(=O)c1ccc(N[C@H](C)c2ccccn2)c([N+](=O)[O-])c1)[C@H](C)c1ccccc1OC 519887097 RUAKLEQEEFYYTE-RTBURBONSA-N 462.550 5.785 5 20 JKBD CN(Cc1ccccc1[N+](=O)[O-])C(=O)Nc1ccc2c(c1)CCC(=O)N2Cc1ccc(Cl)cc1 520127926 LSVWQNBKRYYCGF-UHFFFAOYSA-N 478.936 5.392 5 20 JKBD CCOc1cc(NC(=O)N[C@H](c2ccccc2)c2nc3ccccc3n2C)c([N+](=O)[O-])cc1OCC 520438514 KLSPDDPXQDJZMQ-XMMPIXPASA-N 489.532 5.190 5 20 JKBD COc1ccc(CSCc2nc(O)c3c(-c4ccc(C)cc4)c(C)sc3n2)cc1[N+](=O)[O-] 520664463 CHNAPTKTKNEFKS-UHFFFAOYSA-N 467.572 6.031 5 20 JKBD COc1ccc(-c2ccc(CN[C@H](C)c3ccc(OCc4cccnc4)cc3)o2)c([N+](=O)[O-])c1 521815995 HPYUCFIDVCEQFD-GOSISDBHSA-N 459.502 5.688 5 20 JKBD C[C@H](Nc1ccc(C(=O)NCc2cccc(COC(C)(C)C)c2)cc1[N+](=O)[O-])c1ccccn1 523873072 DKQVONJUOVTZAP-SFHVURJKSA-N 462.550 5.408 5 20 JKBD O=C(CCc1ncc(-c2ccccc2Cl)o1)Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1 590613334 MTXKFDIJIBHCNQ-UHFFFAOYSA-N 454.895 5.598 5 20 JKBD C[C@H](NC(=O)c1ccc(C(=O)N[C@H](C)c2c(F)cccc2F)cc1[N+](=O)[O-])c1c(F)cccc1F 609044075 UWGKCJKAMOPMOX-OLZOCXBDSA-N 489.425 5.133 5 20 JKBD CC(=O)N(c1ccc(C(F)(F)F)cc1)c1nc(Cn2cnc(-c3cccc([N+](=O)[O-])c3)n2)cs1 609053486 CMGKAXRNPFYJQT-UHFFFAOYSA-N 488.451 5.062 5 20 JKBD CCOc1ccc(OCC)c(NC(=S)N(Cc2nnc(-c3cccc([N+](=O)[O-])c3)o2)C(C)C)c1 726897025 NPHCBNWLRRVJRP-UHFFFAOYSA-N 485.566 5.050 5 20 JKBD COc1ccc(-c2csc(NC(=O)c3cc([N+](=O)[O-])ccc3Br)n2)cc1Cl 751063550 XDRVRHIZCJTGSV-UHFFFAOYSA-N 468.716 5.395 5 20 JKBD CC(C)N(Cc1nnc(-c2cccc([N+](=O)[O-])c2)o1)C(=O)CSc1ccc(C(C)(C)C)cc1 822054017 JTUSJYVJCPVKQH-UHFFFAOYSA-N 468.579 5.472 5 20 JKBD COc1ccc([C@@H]2[C@@H](C(=O)Nc3cc([N+](=O)[O-])c(F)cc3F)CCC(=O)N2c2ccc(C)cc2)cc1 897500590 ZTHVIPNXNHCCIE-UQBPGWFLSA-N 495.482 5.313 5 20 JKBD O=C(Cc1noc(-c2ccc(NCc3ccccc3Cl)c([N+](=O)[O-])c2)n1)Nc1ccccc1 904382645 DYXITWHIDJLUQB-UHFFFAOYSA-N 463.881 5.092 5 20 JKBD O=C(Nc1ccc(OC[C@@H](O)COc2ccc3ccccc3c2)cc1)c1cc([N+](=O)[O-])ccc1Cl 912076726 XMDNFUMBXOKCGK-OAQYLSRUSA-N 492.915 5.472 5 20 JKBD C[C@@H](OC(=O)/C=C/c1ccc2ccc(Cl)cc2n1)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 912873972 RKNTZFJOXQFYRF-RUNBWSAHSA-N 450.838 5.164 5 20 JKBD COc1cc2c(cc1OC)[C@H](c1ccccc1)N(C(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1)CC2 915309336 VRAJCDYOAJUJQF-QHCPKHFHSA-N 467.909 5.445 5 20 JKBD O=C(Oc1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2Cl)cc1)c1ccc(Oc2ccccc2)nc1 916036281 LNDHAGFRIQLIHH-UHFFFAOYSA-N 489.871 5.907 5 20 JKBD CCN(C(=O)c1cccc([N+](=O)[O-])c1C)c1cccc(NC(=O)c2cccc([N+](=O)[O-])c2C)c1 916505893 LUOBOHIKURJKFJ-UHFFFAOYSA-N 462.462 5.039 5 20 JKBD C[C@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)O[C@H](C)c1nc(-c2cccc(C(F)(F)F)c2)no1 924160181 FFVJUOLANFIQSM-NEPJUHHUSA-N 467.425 5.449 5 20 JKBD Cc1ccc(CCC(=O)NC2(c3ccc(NC(=O)c4ccc([N+](=O)[O-])o4)cc3)CCC2)cc1F 1785748817 SIFIECPMKIPUQZ-UHFFFAOYSA-N 465.481 5.016 5 20 JKBD O=C(CSc1ccccc1[N+](=O)[O-])NC1(c2ccc(NC(=O)c3cc(C4CC4)on3)cc2)CCC1 1785967488 BSHNJRXAZVUOPO-UHFFFAOYSA-N 492.557 5.000 5 20 JKBD Cc1cc(O)c([N+](=O)[O-])cc1C(=O)NC1(c2ccc(NC(=O)c3cccc4cnccc34)cc2)CCC1 1789327727 JCBBBSDPQBMHAY-UHFFFAOYSA-N 496.523 5.219 5 20 JKBD O=C(Cc1cccc([N+](=O)[O-])c1)NC1(c2ccc(NC(=O)c3cc4sccc4[nH]3)cc2)CCC1 1789367301 CMQBQPXZKDXRHM-UHFFFAOYSA-N 474.542 5.128 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)C3CCC(F)(F)CC3)CCC2)cc1)c1cc(F)cc([N+](=O)[O-])c1 1790695302 KOTLIEMXESMRFK-UHFFFAOYSA-N 475.467 5.307 5 20 JKBD Cc1ccc(CC(=O)Nc2ccc(C3(NC(=O)Cc4ccc(Cl)cc4[N+](=O)[O-])CCC3)cc2)o1 1791943905 HVHBEOQYMFCENM-UHFFFAOYSA-N 481.936 5.069 5 20 JKBD O=C(Cc1cc([N+](=O)[O-])ccc1F)NC1(c2ccc(NC(=O)[C@@]3(F)CCCC=C3F)cc2)CCC1 1792374511 ZEAJBLJKULWPPL-RUZDIDTESA-N 487.478 5.156 5 20 JKBD CC[C@@H](C)[C@H](C(=O)N1CCCC2(CCN(C(=O)c3ccc([N+](=O)[O-])cc3F)CC2)C1)c1ccccc1 1809161981 IOYJGMJPMOXWBA-NLFFAJNJSA-N 495.595 5.409 5 20 JKBD Cc1cc(C)c(B2Nc3ccc4ccccc4c3-c3cc4ccc5cccc6ccc(c32)c4c56)c(C)c1 2332241063 COZDZBFRTDCTRN-UHFFFAOYSA-N 471.412 7.861 5 20 JKBD O=C(CSc1nnc(-c2ccc(Cl)cc2)n1-c1ccccc1)Nc1cc([N+](=O)[O-])ccc1F 8641613 NBPLMNSHUFSJNY-UHFFFAOYSA-N 483.912 5.366 5 20 JKBD CC(=O)N(c1ccc(C)c(C)c1)c1nc(CSc2nc3ccc([N+](=O)[O-])cc3s2)cs1 10592210 NRHIKJANENPNCS-UHFFFAOYSA-N 470.601 6.255 5 20 JKBD CCOc1cc(NC(=O)c2cccc(C)c2[N+](=O)[O-])c(OCC)cc1NC(=O)c1ccccc1 14717104 AMDZMSYHAUNORA-UHFFFAOYSA-N 463.490 5.205 5 20 JKBD O=C(C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)Nc1cccc(C(=O)NC2CC2)c1 16966157 IXQHLKNCNRYOJY-RGEXLXHISA-N 498.564 5.666 5 20 JKBD Cc1cccc(Nc2nnc(S[C@H](C)c3nnc(-c4ccc([N+](=O)[O-])cc4)o3)s2)c1C 17533479 MRYJMABPLBGYAZ-CYBMUJFWSA-N 454.537 5.710 5 20 JKBD O=C(CSc1nnc(-c2c[nH]c3ccccc23)n1C1CC1)Nc1ccc(Cl)c([N+](=O)[O-])c1 17881730 KYZLZHJISSRWDY-UHFFFAOYSA-N 468.926 5.054 5 20 JKBD CCn1c(SCC(=O)Nc2cc(Cl)ccc2Cl)nc2cc3ccccc3cc2c1=O 22177793 BDIOHVFCROFVQD-UHFFFAOYSA-N 458.370 5.607 5 20 JKBD CS(=O)(=O)Cc1cccc(C(=O)Nc2cc([N+](=O)[O-])ccc2Nc2cccc(C(F)(F)F)c2)c1 26366686 STOXQOBXUZKUJQ-UHFFFAOYSA-N 493.463 5.154 5 20 JKBD Cc1c(NC(=O)[C@H](C)Sc2nnc(Cc3ccccc3)n2-c2ccccc2)cccc1[N+](=O)[O-] 28785426 SKBJJKDGBGWTRT-SFHVURJKSA-N 473.558 5.194 5 20 JKBD Cc1cccc(NC(=O)Nc2cccc(CNC(=O)C3CCN(c4ccccc4[N+](=O)[O-])CC3)c2)c1 71940416 GOLTYVCCPLIQPA-UHFFFAOYSA-N 487.560 5.080 5 20 JKBD CC(C)(C)OC(=O)N1CCC(NC(=O)c2ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])cc2)CC1 109215061 OHJKLDOMPABVDE-UHFFFAOYSA-N 475.929 5.170 5 20 JKBD Cn1cnnc1Sc1ccc(C(=O)Nc2c(F)cccc2Oc2ccccc2)cc1[N+](=O)[O-] 410034723 APWYOYJYNGFFFH-UHFFFAOYSA-N 465.466 5.058 5 20 JKBD COC(=O)c1ccc2c(c1)CCN2C(=O)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1 477267599 VCCVKRWTSQOYDW-UHFFFAOYSA-N 452.850 5.030 5 20 JKBD COc1ccc([N+](=O)[O-])cc1NC(=O)NC[C@H](c1cccc(OC)c1OC)c1c[nH]c2ccccc12 503698129 HRIQKYZBIFNZMW-HXUWFJFHSA-N 490.516 5.056 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)N(C)[C@@H]2CCSc3ccc(Br)cc32)cc1SC 504571727 AUZBNIYTICHXBS-CQSZACIVSA-N 483.409 5.397 5 20 JKBD Cc1nnc(Sc2ccc(NC(=O)c3csc(-c4ccc([N+](=O)[O-])cc4)n3)c(C)c2)s1 505866072 KWUZJHGNJQUOSW-UHFFFAOYSA-N 469.573 5.590 5 20 JKBD CN(C(=O)Cn1c2ccccc2c(=O)c2ccccc21)c1ccc(Br)cc1Cl 508146222 JBOXRTMKMBAFCO-UHFFFAOYSA-N 455.739 5.234 5 20 JKBD CCOc1cc(NC(=O)Cc2csc(Cc3cccc(Cl)c3)n2)c([N+](=O)[O-])cc1OCC 512234400 PTHQNKSRTYACHE-UHFFFAOYSA-N 475.954 5.274 5 20 JKBD COc1cc(C(=O)Nc2sc3c(c2C(=O)OC(C)C)CC[C@@H](C)C3)c([N+](=O)[O-])cc1OC(F)F 514574812 XBTXQBVHYYFKAC-LLVKDONJSA-N 498.504 5.209 5 20 JKBD C[C@H](NC(=O)c1ccc(N[C@H](C)c2ccccn2)c([N+](=O)[O-])c1)c1ccc(OCc2cccnc2)cc1 516594385 ITWPMHIDOZDVJL-VQTJNVASSA-N 497.555 5.628 5 20 JKBD CSc1ccc(C(=O)c2ccccc2C(=O)NCc2cccc3cccnc23)cc1[N+](=O)[O-] 519876610 XRJYWXBWHUWDKU-UHFFFAOYSA-N 457.511 5.026 5 20 JKBD COc1cc(C(=O)N[C@@H](Cc2ccccc2Cl)c2ccccc2)c([N+](=O)[O-])cc1OC(F)F 519876914 JGBCKCCQQTTZNH-SFHVURJKSA-N 476.863 5.572 5 20 JKBD C[C@@H](NCc1ccc(-c2ccc([N+](=O)[O-])cc2Br)o1)c1ccc(OC(F)F)cc1 521807216 QHNLLZXLJRLXPI-GFCCVEGCSA-N 467.266 6.070 5 20 JKBD Cc1cccc2c1CC[C@H]2NC(=O)c1ccc(C(=O)N[C@@H]2CCc3c(C)cccc32)c([N+](=O)[O-])c1 552228014 AJTYCCGTKFCKTN-JWQCQUIFSA-N 469.541 5.046 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1F)c1ccc2c(c1)C(=O)N(c1ccc(Cl)c(Cl)c1)C2=O 559242859 DRGVVVAFHKNCPT-UHFFFAOYSA-N 474.231 5.094 5 20 JKBD CCC(=O)Nc1ccc(NC(=O)N2CCN(Cc3ccc(-c4ccccc4[N+](=O)[O-])s3)CC2)cc1 583099893 BRJSWRANSIEILK-UHFFFAOYSA-N 493.589 5.022 5 20 JKBD COCCN(C(=O)Cc1c(C)nc2ccccc2c1C)c1nc(-c2ccc([N+](=O)[O-])cc2)cs1 603461284 KYLIADZSKPFOAK-UHFFFAOYSA-N 476.558 5.105 5 20 JKBD COc1ccccc1-c1cc(NC(=O)c2cc3cc([N+](=O)[O-])ccc3o2)n(-c2ccccc2)n1 603760071 BHZTVIAUCIQSDU-UHFFFAOYSA-N 454.442 5.455 5 20 JKBD O=C(C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1)N1CCC[C@@H]1C1CCCCC1 603977368 UCGJLVOSQUYDQQ-LJQANCHMSA-N 453.505 5.401 5 20 JKBD CN(CCCCCc1cc(-c2cccc(F)c2)no1)C(=O)c1ccc(-n2ccnc2)c([N+](=O)[O-])c1 604490800 SCKABJNGVSWJSS-UHFFFAOYSA-N 477.496 5.060 5 20 JKBD Cc1ccc2nc([C@H]3CCCN(C(=O)c4ccc(N[C@@H](C)c5ccccn5)c([N+](=O)[O-])c4)C3)[nH]c2c1 608986981 PCPKFJSGNCWJTC-ICSRJNTNSA-N 484.560 5.367 5 20 JKBD CCC[C@H](NC(=O)Cc1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1)c1ccccn1 609179658 OSIWGZKDMGWSKE-DEOSSOPVSA-N 455.518 5.043 5 20 JKBD O=C(OC[C@H]1CCCN1C(=O)c1ccccc1[N+](=O)[O-])/C(=C/c1ccc(F)cc1)c1cccs1 730704148 NTCXHQAUMZHPHR-DDNKWHRWSA-N 480.517 5.184 5 20 JKBD O=C(NO[C@@H]1CCCCO1)c1c2c(nc3ccccc13)/C(=C/c1ccc([N+](=O)[O-])cc1)CCC2 749620680 WAJLHIRWJCPHJI-YJCCFKNTSA-N 459.502 5.208 5 20 JKBD O=C(CC1CCCC1)NC1CCC(C(=O)Oc2ccc(NC(=O)c3cccc([N+](=O)[O-])c3)cc2)CC1 751052581 CUUHRLUWEDKCIP-UHFFFAOYSA-N 493.560 5.008 5 20 JKBD C[C@H](OC(=O)c1cc2c3ccccc3n(C)c2s1)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl 762203879 KYJMMFXGYACROC-NSHDSACASA-N 457.895 5.139 5 20 JKBD CCCCCCN(C(=O)c1cc([N+](=O)[O-])ccc1N1CCOCC1)c1nc2ccccc2s1 872605125 PZCHZVJECXYUDP-UHFFFAOYSA-N 468.579 5.268 5 20 JKBD COc1cc(-c2cc(C(=O)Nc3cc([N+](=O)[O-])c(F)cc3F)c3ccccc3n2)cc(OC)c1OC 897444843 TZNGZQWRJLKXEH-UHFFFAOYSA-N 495.438 5.366 5 20 JKBD C[C@H](OC(=O)CNc1ccc(C(F)(F)F)cc1[N+](=O)[O-])c1nc2ccccc2n1C(F)F 917366719 JCLUQHXIVJBWTQ-JTQLQIEISA-N 458.343 5.075 5 20 JKBD Cc1cc(CC(=O)Nc2ccc(C3(NC(=O)c4cc5cc([N+](=O)[O-])ccc5s4)CCC3)cc2)on1 1786723604 YVLMGAMMKLGQOT-UHFFFAOYSA-N 490.541 5.096 5 20 JKBD O=C(NC1(c2ccc(NC(=O)c3scnc3C3CC3)cc2)CCC1)c1cccc(F)c1[N+](=O)[O-] 1787186549 RUQMEZKUEVPIAV-UHFFFAOYSA-N 480.521 5.129 5 20 JKBD COc1cc(C(=O)NC2(c3ccc(NC(=O)c4cccc5cccnc45)cc3)CCC2)ccc1[N+](=O)[O-] 1788912721 UKQSKBNELIXWEP-UHFFFAOYSA-N 496.523 5.213 5 20 JKBD COc1cc(CC(=O)Nc2ccc(C3(NC(=O)c4cccc5cc[nH]c45)CCC3)cc2)ccc1[N+](=O)[O-] 1790477920 IBNZVVHOMNONND-UHFFFAOYSA-N 498.539 5.075 5 20 JKBD Cc1csc(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)c3cc4cc([N+](=O)[O-])ccc4s3)[nH]n2)c1 1815379383 KCDOWQNNRNOYBO-KRWDZBQOSA-N 495.586 5.522 5 20 JKBD O=C(c1ccc([N+](=O)[O-])cc1F)N1CCC([C@H]2CCCCN2C(=O)c2cc3ccccc3o2)CC1 1828190718 NARJYMJFCIXCEM-JOCHJYFZSA-N 479.508 5.027 5 20 JKBD O=C(C1CC2(CCC2)C1)N1CCC([C@H]2CCCCN2C(=O)C2(c3cccc([N+](=O)[O-])c3)CCC2)CC1 1830295339 PSHPMZVLWWZMNT-RUZDIDTESA-N 493.648 5.217 5 20 JKBD C[C@@H]1C[C@]1(C)C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)CC1 1831061112 MRORSNZFLMHOKH-BXEPQMNJSA-N 469.607 5.089 5 20 JKBD Cc1cccc(C(=O)N2CCC([C@@H]3CCCCN3C(=O)CSc3ccccc3[N+](=O)[O-])CC2)c1F 1831776065 RLBBSYUQKYCHBX-NRFANRHFSA-N 499.608 5.068 5 20 JKBD Cc1cc(F)c(C(=O)N2CCCC[C@H]2C2CCN(C(=O)CCc3cccc([N+](=O)[O-])c3)CC2)cc1F 1832622477 CPBFKXOHRHMPFE-VWLOTQADSA-N 499.558 5.048 5 20 JKBD Cc1cc2ccccc2c2c1op(N1C[C@H](C)O[C@H](C)C1)oc1c(C)cc3ccccc3c12 2382215202 JZJCPVUIWMCYHM-BGYRXZFFSA-N 457.510 7.958 5 20 JKBD CS(=O)(=O)c1ccc(Sc2nc(-c3cccs3)c(-c3cccs3)[nH]2)c([N+](=O)[O-])c1 18900734 UEIAFHPUWRHTNZ-UHFFFAOYSA-N 463.587 5.330 5 20 JKBD CCOc1ccccc1Nc1nnc(S[C@H](C)C(=O)Nc2cc([N+](=O)[O-])ccc2Cl)s1 20882346 WJIGJXDMAZXUEJ-LLVKDONJSA-N 479.971 5.361 5 20 JKBD Cc1ccc(NC(=O)[C@@H](Sc2nnc(C)n2Cc2ccccc2)c2ccccc2)c([N+](=O)[O-])c1 28609130 PEOLJNDDSJKIGY-QHCPKHFHSA-N 473.558 5.324 5 20 JKBD CCCN(Cc1nnc(-c2ccccc2Cl)o1)C(=O)[C@@H](C)Sc1ccc([N+](=O)[O-])cc1 104791788 XUQDAPLYUKFMIX-CQSZACIVSA-N 460.943 5.218 5 20 JKBD COc1cccc(Oc2ccc(CNC(=O)c3ccc(N[C@@H](C)c4ccccn4)c([N+](=O)[O-])c3)cn2)c1 108828101 PFLRATRCZFFZHD-SFHVURJKSA-N 499.527 5.289 5 20 JKBD CCOc1cc(C(=O)NCc2nc(-c3ccc(Cl)cc3)c(C)s2)c([N+](=O)[O-])cc1OC 108896248 VZASIOXPGMRQAP-UHFFFAOYSA-N 461.927 5.017 5 20 JKBD CC(=O)c1ccc(Sc2nnc(-c3ccncc3)n2-c2cccc(Cl)c2C)c([N+](=O)[O-])c1 253384353 OOXQKZIHEULDBD-UHFFFAOYSA-N 465.922 5.553 5 20 JKBD CCN(c1ccccc1)S(=O)(=O)c1ccc(Oc2ccc(C(C)=O)cc2C)c([N+](=O)[O-])c1 476523187 YHZJYGGEEXJHEL-UHFFFAOYSA-N 454.504 5.113 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)NCc2cccc(NC(=O)Nc3cccc(C)c3)c2)cc1SC 483437445 JZFXNFUDRPHTOK-UHFFFAOYSA-N 480.546 5.208 5 20 JKBD CC(C)N(CC(=O)Nc1ccc(Cl)cc1C(F)(F)F)C(=O)c1cc2cc([N+](=O)[O-])ccc2o1 504789912 KYZYJJDHBFUKGI-UHFFFAOYSA-N 483.830 5.503 5 20 JKBD C[C@H](Nc1ccc(C(=O)N(C)Cc2ccc(Br)s2)cc1[N+](=O)[O-])c1ccccn1 505997977 XPDVGIDDIZABIO-ZDUSSCGKSA-N 475.368 5.259 5 20 JKBD COc1cc(C(=O)N(Cc2ccccc2)[C@@H](C)C2CC2)c([N+](=O)[O-])cc1OCc1cscn1 512663557 NFXSLJKRXUIPCB-INIZCTEOSA-N 467.547 5.080 5 20 JKBD O=C(C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)N[C@@H]1CCN(Cc2ccccc2)C1 515360168 HJDKHAYJRWHYTM-PLJYQOKSSA-N 498.608 5.526 5 20 JKBD CC(C)c1noc(-c2ccc(NC(=O)CSc3ccc(C(F)(F)F)cc3[N+](=O)[O-])cc2)n1 523242439 BCYSGAIXSABHHO-UHFFFAOYSA-N 466.441 5.518 5 20 JKBD COc1ccc(-c2[nH]c3ccccc3c2CCC(=O)Nc2ccc([N+](=O)[O-])cc2F)c(OC)c1 524228149 GLWQBCNQWSQQCS-UHFFFAOYSA-N 463.465 5.471 5 20 JKBD COc1ccc2ccccc2c1CN(Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1)C1CCCC1 524434951 VKBSSNHTBJCCLB-UHFFFAOYSA-N 458.518 5.751 5 20 JKBD CN(C)Cc1ccccc1NC(=O)c1ccc(Sc2nc3ccccc3s2)c([N+](=O)[O-])c1 581243627 OGUHTVWQLRQZIJ-UHFFFAOYSA-N 464.572 5.670 5 20 JKBD Cc1ccc(/C=C\c2nc(S[C@H](C)C(=O)Nc3nc(-c4cccc([N+](=O)[O-])c4)cs3)n[nH]2)o1 591374487 JHRDLIRTEUVMAE-LJTDUEICSA-N 482.547 5.028 5 20 JKBD O=C(COc1ccccc1[N+](=O)[O-])N(c1ccc(Cl)c(Cl)c1)c1nc2ccccc2s1 603000573 FLJDTUQXLYTJEW-UHFFFAOYSA-N 474.325 6.255 5 20 JKBD CN(Cc1ccccc1[N+](=O)[O-])C(=O)Nc1ncc(Cc2ccc(C(F)(F)F)cc2)s1 603649147 LPYZPMUDGFJLLK-UHFFFAOYSA-N 450.442 5.325 5 20 JKBD COc1ccc(CSCC(=O)N[C@H](C)c2ccc(NC(=O)c3ccc(F)cc3)cc2)cc1[N+](=O)[O-] 604016025 BJPMUTXFDLMEES-MRXNPFEDSA-N 497.548 5.105 5 20 JKBD Cc1nn(Cc2ccc(C(=O)N(CCc3ccccc3)c3ccccc3)cc2)c(C)c1[N+](=O)[O-] 604463923 QNAVIEWSYHNNRU-UHFFFAOYSA-N 454.530 5.346 5 20 JKBD CS(=O)(=O)Cc1ccc(NC(=O)c2ccc(Sc3nc4ccccc4s3)c([N+](=O)[O-])c2)cc1 604498327 OUPJDTFFKFOHNR-UHFFFAOYSA-N 499.595 5.153 5 20 JKBD Cc1ccc(C(=O)Nc2cccc(CNC(=O)Cn3c4ccccc4c(=O)c4ccccc43)c2)cc1 614984038 MUATTYXRRKKEQJ-UHFFFAOYSA-N 475.548 5.032 5 20 JKBD COC(=O)Nc1cc(N[C@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2ccccc2)ccc1F 727465158 UUQIOKQDWMBPLX-FQEVSTJZSA-N 472.860 5.358 5 20 JKBD Cc1ccc(C(C)C)c(Oc2ccc(CNCc3cccc(N4CCOC4=O)c3)cc2[N+](=O)[O-])c1 727467849 AGAXYALSNXSRTH-UHFFFAOYSA-N 475.545 6.065 5 20 JKBD Cc1cc[n+](/C(C(=S)Nc2c(Cl)ccc(C)c2Cl)=C(/O)c2cccc([N+](=O)[O-])c2)cc1 728558144 GEHDDKXIYJLUAM-UHFFFAOYSA-O 475.377 6.129 5 20 JKBD CN(Cc1ccccc1NC(=O)c1csc(-c2cccc([N+](=O)[O-])c2)n1)C(=O)OC(C)(C)C 747720766 HUCQLMWUUHTDJP-UHFFFAOYSA-N 468.535 5.338 5 20 JKBD C[C@H](OC(=O)c1csc(-c2ccc([N+](=O)[O-])cc2)n1)C(=O)Nc1cccc(Cl)c1Cl 747956739 YZDZSRLAASYHCC-JTQLQIEISA-N 466.302 5.209 5 20 JKBD CC(C)(C(=O)Oc1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2Cl)cc1)c1ccccc1F 751056012 ZOWAAUYULGSMLI-UHFFFAOYSA-N 456.857 5.523 5 20 JKBD O=C(Nc1ccccc1C(=O)Nc1ccc(N2CCCCC2)nc1)c1ccc([N+](=O)[O-])cc1Cl 828117528 PERRSFPJDIBQKV-UHFFFAOYSA-N 479.924 5.138 5 20 JKBD O=C(CSc1ccc(C(F)(F)F)cc1[N+](=O)[O-])Nc1nc(COc2ccccc2)cs1 884001987 MEUPZBBNTOUYEJ-UHFFFAOYSA-N 469.466 5.380 5 20 JKBD O=[N+]([O-])c1ccc(-c2nc(-c3cccc(OCc4cccnc4)c3)no2)c(Br)c1 904506976 UYVPHNFTIITZKQ-UHFFFAOYSA-N 453.252 5.048 5 20 JKBD CN(Cc1ccccc1[N+](=O)[O-])Cn1nc(Nc2ccc(SC(F)F)cc2)sc1=S 914783588 ZLRGPMXDONVJTF-UHFFFAOYSA-N 469.564 5.730 5 20 JKBD Cc1ccc(C(C)C)c(Oc2ccc(CNCc3cccnc3-n3ccnc3)cc2[N+](=O)[O-])c1 915228503 YMHWLJHBRQHDQM-UHFFFAOYSA-N 457.534 5.689 5 20 JKBD Cc1ccc([N+](=O)[O-])c(OCCC(=O)O[C@H](C)C(=O)Nc2c(Cl)cc(Cl)cc2Cl)c1 915443098 WKCHJRROHLUPIO-LLVKDONJSA-N 475.712 5.203 5 20 JKBD CC(C)C(=O)Nc1ccc(C(=O)COC(=O)c2cc([N+](=O)[O-])ccc2Oc2ccccc2)cc1 919192580 LZCKPBUFAPJZBA-UHFFFAOYSA-N 462.458 5.021 5 20 JKBD CC(C)Cn1cc(C(=O)O[C@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2C(F)(F)F)c2ccccc21 919484237 AIVTUFAKOKPZKI-CQSZACIVSA-N 477.439 5.408 5 20 JKBD CCCC(=O)Nc1c(Cl)cc(Cl)cc1C(=O)OCC(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1 919557496 BOBUSPTYOMMUHP-UHFFFAOYSA-N 488.711 5.089 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)c3c[nH]c4c(Cl)cccc34)CCC2)cc1)c1ccc([N+](=O)[O-])o1 1785751129 QHCWNLPLJOXWHD-UHFFFAOYSA-N 478.892 5.384 5 20 JKBD O=C(NC1(c2ccc(NC(=O)c3ccc([N+](=O)[O-])o3)cc2)CCC1)c1ccc2c(Cl)ccnc2c1 1785751249 UTWVHXPKBSEZDJ-UHFFFAOYSA-N 490.903 5.451 5 20 JKBD O=C(/C=C/c1ccc([N+](=O)[O-])o1)NC1(c2ccc(NC(=O)CCc3c[nH]c4ccccc34)cc2)CCC1 1788242896 RULBSQDMOPOCKL-SDNWHVSQSA-N 498.539 5.449 5 20 JKBD Cc1cc2cc(C(=O)NC3(c4ccc(NC(=O)c5cc(C)c([N+](=O)[O-])cn5)cc4)CCC3)ccc2[nH]1 1788766580 GLDDKLLFQZTPMS-UHFFFAOYSA-N 483.528 5.149 5 20 JKBD C[C@H]1CCC[C@H]1C(=O)Nc1ccc(C2(NC(=O)CSc3ccccc3[N+](=O)[O-])CCC2)cc1 1789213976 OEDOTKGTDVPANW-FXAWDEMLSA-N 467.591 5.257 5 20 JKBD COc1cc(C(=O)NC2(c3ccc(NC(=O)c4ccc(Cl)cc4)cc3)CCC2)c([N+](=O)[O-])cc1O 1790296010 VMWHANYCNPKKQT-UHFFFAOYSA-N 495.919 5.024 5 20 JKBD Cc1nc2ccncc2cc1C(=O)NC1(c2ccc(NC(=O)c3ccc([N+](=O)[O-])cc3F)cc2)CCC1 1790621749 FWGJNDJRYGTSKN-UHFFFAOYSA-N 499.502 5.047 5 20 JKBD O=C(NC1(c2ccc(NC(=O)c3nc4cc([N+](=O)[O-])ccc4[nH]3)cc2)CCC1)c1ccc(Cl)cc1 1790827331 KBLLNAJJPQJJKE-UHFFFAOYSA-N 489.919 5.186 5 20 JKBD CC(C)(C)CC(=O)NC1(c2ccc(NC(=O)CSc3ccccc3[N+](=O)[O-])cc2)CCC1 1791521478 LSOQIDAHHIKROQ-UHFFFAOYSA-N 455.580 5.257 5 20 JKBD C[C@@H](Sc1ccccc1)C(=O)N1CCCC[C@H]1C1CCN(C(=O)/C=C/c2ccc([N+](=O)[O-])o2)CC1 1824385579 SGOSLSZTZDPRQB-XSIWJGCBSA-N 497.617 5.002 5 20 JKBD O=C(c1ccc2ccoc2c1)N1CCC([C@H]2CCCCN2C(=O)CCc2cccc([N+](=O)[O-])c2)CC1 1824842446 IMEUJRJNOYWJAO-RUZDIDTESA-N 489.572 5.207 5 20 JKBD O=C(CCc1cccc([N+](=O)[O-])c1)N1CCC([C@H]2CCCCN2C(=O)c2cc3ccoc3s2)CC1 1827406973 GRVSWYMRYUUAME-JOCHJYFZSA-N 495.601 5.269 5 20 JKBD CNc1ccc(C(=O)N2CCC([C@@H]3CCCCN3C(=O)c3cc(Cl)cc([N+](=O)[O-])c3C)CC2)cc1 1830736353 WBWSVPKDOKEHRG-QHCPKHFHSA-N 499.011 5.145 5 20 JKBD C[C@H](C(=O)N1CCC([C@@H]2CCCCN2C(=O)/C=C/c2ccccc2[N+](=O)[O-])CC1)c1ccccc1 1832906884 NUHVWECKBFRWCN-QVSJGEDXSA-N 475.589 5.031 5 20 JKBD COc1ccc(-c2nnc(SCC(=O)Nc3cc([N+](=O)[O-])ccc3Cl)n2-c2ccccc2)cc1 10007429 MFSWBQKQOTVCAP-UHFFFAOYSA-N 495.948 5.235 5 20 JKBD CCCCCn1c(SCC(=O)Nc2c(C)cccc2[N+](=O)[O-])nc2cc(Cl)ccc2c1=O 11392160 MLBJRAOMWQXANO-UHFFFAOYSA-N 474.970 5.188 5 20 JKBD CCOc1ccc(NC(=O)Cc2cn(-c3ccccc3)nc2-c2ccc([N+](=O)[O-])cc2)cc1OC 15137982 LYFHLFPMGUYRTE-UHFFFAOYSA-N 472.501 5.036 5 20 JKBD CCOc1cc([N+](=O)[O-])c(C(=O)Nc2cc(Cl)cc(Br)c2OCC)cc1OC 22312537 WDEVFYMRNGJPKS-UHFFFAOYSA-N 473.707 5.069 5 20 JKBD COC(=O)COc1ccc(NC(=O)c2ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])cc2)c(C)c1 68736912 DUBNRFAWILTNLL-UHFFFAOYSA-N 470.865 5.153 5 20 JKBD CSc1ccc(C(=O)N2CCCC[C@H]2C(=O)Nc2ccc(Cl)cc2Cl)cc1[N+](=O)[O-] 195562332 UAYWBFQIDNTFPZ-INIZCTEOSA-N 468.362 5.257 5 20 JKBD CCOc1c(Br)cc(C(=O)Nc2nc(-c3cccc([N+](=O)[O-])c3)c(C)s2)cc1OC 195703799 JEGQHWSIDHKRRJ-UHFFFAOYSA-N 492.351 5.449 5 20 JKBD CCN(c1ccccc1)S(=O)(=O)c1cc(NC(=O)c2cccc(C)c2[N+](=O)[O-])ccc1Cl 255944365 OLVNANNKWJWPJZ-UHFFFAOYSA-N 473.938 5.024 5 20 JKBD C[C@H](Nc1ccc(C(=O)Nc2ccc(C(=O)N3CCCC[C@H]3C)cc2)cc1[N+](=O)[O-])c1ccccn1 303007855 OCZSABKQBQGLBL-MOPGFXCFSA-N 487.560 5.430 5 20 JKBD O=C(Nc1ccc(NCc2nc(-c3ccc([N+](=O)[O-])cc3)no2)c(C(F)(F)F)c1)c1ccoc1 303053991 VURDEEYNACZWEI-UHFFFAOYSA-N 473.367 5.121 5 20 JKBD COCCn1cc(NC(=O)c2c3c(nc4ccccc24)/C(=C\c2ccc([N+](=O)[O-])cc2)CCC3)cn1 486667511 ZLKXXPXMFSUVDH-CYVLTUHYSA-N 483.528 5.115 5 20 JKBD COc1ccc(-c2csc(NC(=O)C3CCN(c4ccccc4[N+](=O)[O-])CC3)n2)cc1Cl 499219661 QBNHNKXHQXPWCT-UHFFFAOYSA-N 472.954 5.235 5 20 JKBD C[C@@H](c1cccc(C(F)(F)F)c1)N(C(=O)Cn1c2ccccc2c(=O)c2ccccc21)C1CC1 502846510 QNCXTZROLMQFNU-KRWDZBQOSA-N 464.487 5.926 5 20 JKBD CCN(Cc1ccc(OCc2cccs2)c(OC)c1)C(=O)c1ccn(-c2ccc([N+](=O)[O-])cc2)n1 504371958 SMKNCXPQNZTREH-UHFFFAOYSA-N 492.557 5.092 5 20 JKBD C[C@H](Nc1ccc(C(=O)N[C@@H](C)c2nc3ccccc3n2C(F)F)cc1[N+](=O)[O-])c1ccccn1 506069138 HXIFRFXWIAKKJU-GJZGRUSLSA-N 480.475 5.399 5 20 JKBD C[C@H](NCc1ccc(Oc2ccccc2Cl)c([N+](=O)[O-])c1)c1ccc(NC(=O)NC2CC2)cc1 509593288 PLGKFAHVMIBPJW-INIZCTEOSA-N 480.952 6.175 5 20 JKBD C[C@@H](CNC(=O)Cc1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1)c1ccc(F)cc1 512823481 KWQUNSMHZTWDHW-SFHVURJKSA-N 458.493 5.049 5 20 JKBD O=C(COc1ccc(-c2ccccc2)cc1[N+](=O)[O-])N1N=C(c2ccco2)C[C@H]1c1ccco1 516787873 UUVLYWBKGVWWGY-FQEVSTJZSA-N 457.442 5.205 5 20 JKBD CSc1ccc([N+](=O)[O-])c(C(=O)Nc2ccc(NC(=O)[C@H](C)n3nc(C)cc3C)c(Cl)c2)c1 518823517 REGJSEOLAJGHCH-AWEZNQCLSA-N 487.969 5.235 5 20 JKBD O=C(Nc1ccc(F)cc1)N[C@H]1CCN(C(=O)c2ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])cc2)C1 523207337 ZJVIEXCFFWTTLX-IBGZPJMESA-N 498.898 5.216 5 20 JKBD O=C(c1ccc(Sc2nc3ccccc3s2)c([N+](=O)[O-])c1)N1CCN(c2ccc(O)cc2)CC1 603483926 PCCUHPJADDMUNS-UHFFFAOYSA-N 492.582 5.024 5 20 JKBD O=C(c1csc([N+](=O)[O-])c1)N(C[C@H]1CCCO1)c1nc(-c2ccc(Br)cc2)cs1 603750256 HOGFPAXDIPNWQA-OAHLLOKOSA-N 494.392 5.368 5 20 JKBD COc1cc(C(=O)Nc2cc(NC(=O)c3ccccc3)ccc2C)c([N+](=O)[O-])cc1OC(F)F 603774329 KHSNHWXLNMLPSJ-UHFFFAOYSA-N 471.416 5.018 5 20 JKBD CCN(Cc1ccncc1)C(=O)c1ccc(Sc2nc3ccccc3s2)c([N+](=O)[O-])c1 603924412 OLUFKSYNVJQUDY-UHFFFAOYSA-N 450.545 5.413 5 20 JKBD CCCOc1cc(NC(=O)c2cc(F)cc3nc(C)c(C)nc23)c([N+](=O)[O-])cc1OCCC 603951734 FAISFVHPOMJLQL-UHFFFAOYSA-N 456.474 5.124 5 20 JKBD C[C@H]1CCC[C@@H](C)N1C(=O)c1cc(Cl)ccc1NC(=O)CCOc1ccccc1[N+](=O)[O-] 603959584 DIERMDGDTWLEPP-IYBDPMFKSA-N 459.930 5.059 5 20 JKBD CN(C(=O)c1cc([N+](=O)[O-])ccc1Sc1ccc(Cl)cc1)c1ccc(Br)cn1 603962900 KBRYCRIEPCECBT-UHFFFAOYSA-N 478.755 5.834 5 20 JKBD C[C@@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)Nc1ccc(NC(=O)c2ccco2)c(Cl)c1 604443656 HOFKAABSJHVPOP-LLVKDONJSA-N 464.261 5.153 5 20 JKBD O=[N+]([O-])c1ccc(-c2ccc(CN[C@@H](c3ccccc3)c3ccco3)o2)c(Br)c1 608835666 JPHGKENAARSTFE-QFIPXVFZSA-N 453.292 6.090 5 20 JKBD CSc1ccc([N+](=O)[O-])c(C(=O)N2c3ccccc3CC[C@@H]2C(=O)Nc2ccc(F)cc2)c1 608871444 DBWOKUCECHSOEQ-JOCHJYFZSA-N 465.506 5.056 5 20 JKBD O=C(CCCn1c(=O)oc2cc([N+](=O)[O-])ccc21)N1CCCC[C@@H]1c1ccccc1C(F)(F)F 608945445 NQEAVJHVDWVRHI-GOSISDBHSA-N 477.439 5.056 5 20 JKBD Cc1noc(C2CCN(C(=O)CCC(=O)c3ccc4ccc5cccc6ccc3c4c56)CC2)n1 729259529 JXCFYGKTIOPEME-UHFFFAOYSA-N 451.526 5.645 5 20 JKBD Cc1ccc(NC(=O)[C@@H](C)OC(=O)Cc2cn(-c3ccccc3)nc2-c2ccc([N+](=O)[O-])cc2)c(C)c1 729847815 VZBCYWPGEARAKW-HXUWFJFHSA-N 498.539 5.177 5 20 JKBD Nc1c(Cl)cc(N[C@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2ccccc2)cc1Cl 746640479 XDTAUGYSCCEHLR-IBGZPJMESA-N 465.724 5.929 5 20 JKBD COc1cccc(-c2nc(COC(=O)c3csc(-c4cccc([N+](=O)[O-])c4)n3)cs2)c1OC 747956303 QWYXQJFEPSGMAD-UHFFFAOYSA-N 483.527 5.216 5 20 JKBD COc1ccc([C@H](CNc2c([N+](=O)[O-])cc(CO)c(C)c2[N+](=O)[O-])c2c[nH]c3ccccc23)cc1 796442100 DXYJGZNVAHQNIP-FQEVSTJZSA-N 476.489 5.038 5 20 JKBD Cc1ccc(NC(=O)[C@H](OC(=O)c2csc(Cc3ccccc3)n2)c2ccccc2)c([N+](=O)[O-])c1 915453885 HAFFPNONTBACIN-XMMPIXPASA-N 487.537 5.487 5 20 JKBD O=C(Nc1nc2ccc(Br)cc2s1)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-] 915808783 OVDODOQTZKUURB-UHFFFAOYSA-N 476.230 5.160 5 20 JKBD C[C@@H](OC(=O)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-])C(=O)Nc1cc(Cl)ccc1Cl 919195170 CZPNOJZXJQZVGU-SECBINFHSA-N 481.210 5.027 5 20 JKBD C[C@H](OC(=O)c1ccc(Oc2ccccc2)nc1)C(=O)Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1 919386687 VKQKXWQTQUSPEI-HNNXBMFYSA-N 490.497 5.090 5 20 JKBD C[C@@H](OC(=O)c1ccc(N[C@H](C)c2ccccn2)c([N+](=O)[O-])c1)C(=O)c1ccc(Br)cc1 920549282 XAAAJZDCUYFQGK-HUUCEWRRSA-N 498.333 5.354 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)c3cc4cc([N+](=O)[O-])ccc4s3)CCC2)cc1)c1ccns1 1787206773 GFVGIAQOQFLSIB-UHFFFAOYSA-N 478.555 5.328 5 20 JKBD CC(C)C1(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)Cc3ccc(Cl)cc3[N+](=O)[O-])[nH]n2)CCC1 1823064011 ZQZFEDJDSDVIPD-IBGZPJMESA-N 487.988 5.032 5 20 JKBD Cc1cc(C(=O)N2CCC([C@@H]3CCCCN3C(=O)c3cc4sccc4s3)CC2)ncc1[N+](=O)[O-] 1828551365 VCPDUDHAUZWPKD-SFHVURJKSA-N 498.630 5.122 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)N1CCC([C@@H]2CCCCN2C(=O)[C@@]2(C)CC=CCC2)CC1 1832407574 ZXHPNVTWTZXUEE-NVQXNPDNSA-N 471.573 5.022 5 20 JKBD CC(=O)Nc1ccc(S[C@H](C(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)c2ccccc2)cc1 16553343 BGLLBWITUHFYNC-NRFANRHFSA-N 455.923 5.679 5 20 JKBD CS(=O)(=O)c1cccc(NC(=O)c2cc([N+](=O)[O-])ccc2Sc2ccc(Cl)cc2)c1 16783259 DHSZYGMRSPFBGN-UHFFFAOYSA-N 462.936 5.055 5 20 JKBD COc1ccc([C@@H](CNC(=O)COc2ccc([N+](=O)[O-])cc2Cl)c2c[nH]c3ccccc23)cc1 19352755 NIMOZDUEMGKQLZ-HXUWFJFHSA-N 479.920 5.065 5 20 JKBD C[C@@H](OC(=O)c1ccc2[nH]c3c(c2c1)CCCC3)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 21365602 MSCHZGAHHCIXCY-GFCCVEGCSA-N 475.423 5.158 5 20 JKBD C[C@@H](OC(=O)c1ccc(COc2ccc(F)cc2)o1)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 25019260 FOVJMMQXFUEBKV-GFCCVEGCSA-N 496.369 5.109 5 20 JKBD O=C(Nc1cccc(CN2CCCC2=O)c1)c1ccc(NCc2ccccc2Cl)c([N+](=O)[O-])c1 29287472 CRQGEBRIBDPCTL-UHFFFAOYSA-N 478.936 5.235 5 20 JKBD O=C(Nc1ccccc1C(=O)NCc1ccccc1N1CCCC1)c1ccc([N+](=O)[O-])cc1Cl 108704168 AEJMLJOFLUOHPO-UHFFFAOYSA-N 478.936 5.031 5 20 JKBD C[C@@H](Nc1ccc(C(=O)N2CCC[C@H]2c2ccc(Cl)cc2)cc1[N+](=O)[O-])c1ccccn1 115710376 WOXZYCHFOVVTQP-ZHRRBRCNSA-N 450.926 5.794 5 20 JKBD C[C@@H](NC(=O)CCCNc1ccc([N+](=O)[O-])cc1)c1ccc(NC(=O)Nc2ccccc2)cc1 480771030 ARXQHHFGHYKCQA-GOSISDBHSA-N 461.522 5.308 5 20 JKBD O=C(C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)Nc1ccc(-c2cnco2)cc1 487562350 HDSZLFJGGQYYQR-CPNJWEJPSA-N 482.521 6.429 5 20 JKBD Cc1cc(NC(=O)c2ccc(N3CCC[C@H](C)C3)c([N+](=O)[O-])c2)ccc1NC(=O)c1ccco1 490141094 CGLJHCLKAAUWRA-INIZCTEOSA-N 462.506 5.237 5 20 JKBD CCOc1cc(-c2nnc(Sc3ccc([N+](=O)[O-])c4cnccc34)o2)cc(OCC)c1OCC 497732557 LYBSDJVUFSHPBP-UHFFFAOYSA-N 482.518 5.540 5 20 JKBD O=C(Cn1cnc([N+](=O)[O-])c1)Nc1nc(-c2ccccc2Cl)c(-c2ccccc2Cl)s1 501664384 MSFZOLZBXRXNLL-UHFFFAOYSA-N 474.329 5.527 5 20 JKBD COc1ccc([C@@H]2CCCN2C(=O)c2ccc(N[C@H](C)c3ccccn3)c([N+](=O)[O-])c2)cc1OC 506087096 SBULKRUWICCICV-VGSWGCGISA-N 476.533 5.157 5 20 JKBD Cc1ccc(C)n1C1CCN(C(=O)Cc2cn(-c3ccccc3)nc2-c2ccc([N+](=O)[O-])cc2)CC1 512624107 INVVSDKZNBCUCX-UHFFFAOYSA-N 483.572 5.272 5 20 JKBD C[C@@H](SCc1ncc(-c2ccc(Cl)cc2)o1)C(=O)Nc1cc([N+](=O)[O-])ccc1OC(F)F 512983534 SSBIIBQHZWSUAL-LLVKDONJSA-N 483.880 5.765 5 20 JKBD CC(C)CCSc1ccc(C(=O)Nc2ccc(Cl)c(C(=O)NC3CC3)c2)cc1[N+](=O)[O-] 515441816 VYHRDAQCPMCBQG-UHFFFAOYSA-N 461.971 5.531 5 20 JKBD Cc1ccc(Sc2ccc(CNCc3ccccc3CS(=O)(=O)NC(C)C)cc2[N+](=O)[O-])cc1 520957689 SLVQWCSXQHRPLY-UHFFFAOYSA-N 499.658 5.172 5 20 JKBD COc1ccc(C2(CNCc3cn(-c4ccccc4)nc3-c3ccc([N+](=O)[O-])cc3)CCOCC2)cc1 520960702 KPMAWNZQUVZCIF-UHFFFAOYSA-N 498.583 5.294 5 20 JKBD CSc1cccc(N(C)C(=O)c2ccccc2C(=O)c2ccc(SC)c([N+](=O)[O-])c2)c1 523839821 YLEJXYCOKKKEAK-UHFFFAOYSA-N 452.557 5.546 5 20 JKBD Cn1cc(/C=C(\CC(=O)O)c2nc3cc(Cl)ccc3s2)c(-c2ccc([N+](=O)[O-])cc2)n1 557433607 AIAXYRJKMACPHU-MDWZMJQESA-N 454.895 5.274 5 20 JKBD O=C(Cc1csc(Cc2cccc(Cl)c2)n1)Nc1cc([N+](=O)[O-])ccc1OC(F)F 603638761 UGFLXWQSYKIYER-UHFFFAOYSA-N 453.854 5.078 5 20 JKBD C[C@@H]1CCN(C(=O)c2ccn(-c3ccc([N+](=O)[O-])cc3)n2)c2cc(C(F)(F)F)ccc2S1 604470385 MUGYNPSXTFULNC-CYBMUJFWSA-N 462.453 5.330 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Cl)[C@H](NC[C@H]1CCCN(Cc2ccccc2)C1)c1ccccc1 604474095 HIWWNBYVPYXQGC-QFQXNSOFSA-N 493.007 5.430 5 20 JKBD CC[C@@H](c1ccccc1)c1nnc(SCc2cc(OC)c(OC(F)F)cc2[N+](=O)[O-])o1 609018822 RRUGOQQYNHQTEQ-AWEZNQCLSA-N 451.451 5.422 5 20 JKBD CCc1cccc[n+]1/C(C(=S)N[C@H](C)c1cccs1)=C(/O)c1ccc(C)c([N+](=O)[O-])c1 726579821 MFMQOEMDJYVWOZ-MRXNPFEDSA-O 454.597 5.377 5 20 JKBD CCN(c1ccccc1)S(=O)(=O)c1ccc(Cl)c(C(=O)Nc2ccc([N+](=O)[O-])c(Cl)c2)c1 727711220 FYRKALONMPMRJM-UHFFFAOYSA-N 494.356 5.369 5 20 JKBD CC(C)N(Cc1nnc(-c2cccc([N+](=O)[O-])c2)o1)C(=O)CCCc1ccc(Br)s1 746133079 CIQOCNSOVJPMTR-UHFFFAOYSA-N 493.383 5.229 5 20 JKBD C[C@@H](OC(=O)c1cc(-c2ccncc2)nc2ccccc12)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 813320302 RFUAMPUDXQXCHX-OAHLLOKOSA-N 467.441 5.173 5 20 JKBD CC1=C(C(=O)Nc2ccc([N+](=O)[O-])cc2)[C@@H](c2ccc3ncccc3c2)NC(=S)N1c1ccccc1 839439978 XEBYRWNUGIYXPF-RUZDIDTESA-N 495.564 5.492 5 20 JKBD O=C(OCC(=O)N1c2ccccc2Sc2ccccc21)C1CCN(c2ccccc2[N+](=O)[O-])CC1 844244171 CZWDXKXYKMVLTR-UHFFFAOYSA-N 489.553 5.184 5 20 JKBD O=C1CC[C@@H](c2noc(-c3ccc(Oc4ccc(Cl)cc4[N+](=O)[O-])cc3)n2)CN1CC1CCCC1 856582817 WCQZLQZKYDCCPH-GOSISDBHSA-N 496.951 5.987 5 20 JKBD O=C(Nc1ccc(Cl)cc1Cl)[C@@H]1CCCCN1C(=O)c1cc(Cl)ccc1[N+](=O)[O-] 915158920 FTJHKFHNPRXVGE-KRWDZBQOSA-N 456.713 5.188 5 20 JKBD CCOc1ccc(N(C(=O)Cn2ncc3ccc([N+](=O)[O-])cc32)c2nc3ccccc3s2)cc1 915277889 INDBOKQCXFBWTJ-UHFFFAOYSA-N 473.514 5.318 5 20 JKBD COc1ccc(-c2ccc(/C=C(/Cl)c3nc(=O)c4ccc(Cl)cc4[nH]3)o2)c([N+](=O)[O-])c1 916157498 MMZSIWMFTMAMEH-CXUHLZMHSA-N 458.257 5.490 5 20 JKBD Cc1nccn1-c1ccc(NC(=O)c2ccccc2Sc2ccc(C(F)(F)F)cc2[N+](=O)[O-])cn1 918588257 VWWPZBIHOALBGH-UHFFFAOYSA-N 499.474 5.906 5 20 JKBD O=C(CCc1cccc([N+](=O)[O-])c1)Nc1ccc(C2(NC(=O)[C@H]3CCC(F)(F)C3)CCC2)cc1 1786598834 ARYAPCHBBFFSLX-SFHVURJKSA-N 471.504 5.097 5 20 JKBD O=C(Cc1cc([N+](=O)[O-])ccc1F)Nc1ccc(C2(NC(=O)c3cccc4ccoc34)CCC2)cc1 1786671579 MMBCQNCBNRAFJQ-UHFFFAOYSA-N 487.487 5.471 5 20 JKBD COc1cc(Cl)cc(C(=O)NC2(c3ccc(NC(=O)c4ccc(O)c([N+](=O)[O-])c4)cc3)CCC2)c1 1790620870 PRUUHYZSQFKPHJ-UHFFFAOYSA-N 495.919 5.024 5 20 JKBD Cc1oc(C(C)(C)C)cc1C(=O)N1CCCC2(CCN(C(=O)c3cc(F)cc([N+](=O)[O-])c3)CC2)C1 1808383448 KGYFNMPXTFRIMD-UHFFFAOYSA-N 485.556 5.091 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)N1CCCC[C@@H]1c1cc(NC(=O)CCC2CCCC2)n[nH]1 1816696742 QJCLAOUXRSCLDZ-HXUWFJFHSA-N 471.533 5.042 5 20 JKBD O=C(c1cc(O)cc([N+](=O)[O-])c1)N1CCC([C@@H]2CCCCN2C(=O)[C@@H]2CCC[C@@H]3CCCC[C@H]32)CC1 1828460940 VDAWNHVTCHDFIG-PGTVGAIHSA-N 497.636 5.140 5 20 JKBD O=C(/C=C/c1ccccc1[N+](=O)[O-])N1CCC([C@@H]2CCCCN2C(=O)c2cc3sccc3[nH]2)CC1 1828714309 UUXRQYLWIQWBRB-UVIRAJKCSA-N 492.601 5.084 5 20 JKBD c1ccc2c(c1)C[C@H]1OC(c3cccc4cc5cccc(C6=N[C@H]7c8ccccc8C[C@H]7O6)c5nc34)=N[C@@H]21 1988188148 YIRZYKKAMFZDNI-MLHYWSLVSA-N 493.566 6.274 5 20 JKBD Cc1ccc(-n2c(S[C@H](C)C(=O)Nc3cc([N+](=O)[O-])ccc3Cl)nnc2-c2ccncc2)cc1 10730689 VUGCTJYBOOBXFJ-OAHLLOKOSA-N 494.964 5.319 5 20 JKBD COc1cc(C(=O)OCC(=O)Nc2c(C)cccc2C)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 10911989 JJIRWUSYVRDUIR-UHFFFAOYSA-N 484.892 5.461 5 20 JKBD CCOc1ccc([C@@H](CNC(=O)c2ccc(OC)c([N+](=O)[O-])c2)c2c[nH]c3ccccc23)cc1OC 16176439 UHXXGWLUPSFPGY-HXUWFJFHSA-N 489.528 5.054 5 20 JKBD O=C(O[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Br)c1ccccc1)c1c[nH]c2ccccc12 17117680 PMGAUIPZMQTSLG-NRFANRHFSA-N 494.301 5.375 5 20 JKBD COc1cc(C(=O)N[C@H](C)c2ccc(-n3cncn3)cc2)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 18158148 OWBFZNSLVVHWHW-OAHLLOKOSA-N 493.907 5.121 5 20 JKBD Cc1ccc(C)c(-n2ccnc2S[C@@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2C(F)(F)F)c1 21649373 ALWGFDLRMNXUJM-AWEZNQCLSA-N 464.469 5.535 5 20 JKBD C[C@H](Sc1nnc(NCc2ccc(F)cc2)s1)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 24507058 PRUDFBXMWQDNBN-NSHDSACASA-N 458.500 5.101 5 20 JKBD CC(C)CC(=O)Nc1ccc(NC(=O)c2ccccc2C(=O)c2ccc(N(C)C)c([N+](=O)[O-])c2)cc1 27269023 OHVTVGXOCLTDHB-UHFFFAOYSA-N 488.544 5.129 5 20 JKBD Cc1cc([N+](=O)[O-])ccc1NC(=O)CSc1nnc(-c2cccs2)n1Cc1ccccc1 39578456 HCJYJDUTRUDPBQ-UHFFFAOYSA-N 465.560 5.002 5 20 JKBD Cc1csc(Sc2ccc(C(=O)Nc3cccc(C)c3C(=O)N3CCCC3)cc2[N+](=O)[O-])n1 107863460 UKLQGLDMURWGHY-UHFFFAOYSA-N 482.587 5.308 5 20 JKBD COc1cc(C(=O)Nc2cc(-c3cc(C)c(C)cc3C)[nH]n2)c([N+](=O)[O-])cc1OCc1cscn1 490134391 BGHXQJRXKJFZJR-UHFFFAOYSA-N 493.545 5.207 5 20 JKBD COc1cc(C(=O)Nc2cccc(CO[C@H]3CCC[C@H](C)C3)c2)c([N+](=O)[O-])cc1OC(F)F 499196137 SOPMUICPZRNBSA-YOEHRIQHSA-N 464.465 5.552 5 20 JKBD O=C(CSc1nnc(-c2ccc(Cl)cc2Cl)n1Cc1ccco1)c1ccc([N+](=O)[O-])cc1 502591286 AAFXKTHFSFNBSG-UHFFFAOYSA-N 489.340 5.776 5 20 JKBD Cc1nc(-c2ccccc2)c(NC(=O)c2ccc(NS(=O)(=O)c3cccc([N+](=O)[O-])c3)cc2)s1 502736956 CBOXQBGDAGURPW-UHFFFAOYSA-N 494.554 5.080 5 20 JKBD Cc1ccc(Sc2ccc(C(=O)Nc3ccn(CCc4ccncc4)n3)cc2[N+](=O)[O-])cc1 503330814 DBXPWXGJAAZNNM-UHFFFAOYSA-N 459.531 5.141 5 20 JKBD C[C@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccc(CC(=O)N2CCCc3ccccc32)cc1 503486858 LOQLIHBEVHJNIV-SFHVURJKSA-N 475.570 5.236 5 20 JKBD Cc1ccc(NC(=O)c2ccc(N[C@H](C)c3ccccn3)c([N+](=O)[O-])c2)c(OCc2ccccc2)c1 509250152 WFFHSPBRMOAWHI-HXUWFJFHSA-N 482.540 6.303 5 20 JKBD CC(C)N(Cc1ccccc1F)C(=O)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 514495338 GDFYOAZCZXYFCI-UHFFFAOYSA-N 467.463 5.406 5 20 JKBD Cc1nc(NC(=O)c2ccc(NC3CC3)c([N+](=O)[O-])c2)sc1-c1nc2ccccc2n1C(F)F 520912710 MXMXWGOPBRMOGV-UHFFFAOYSA-N 484.488 5.598 5 20 JKBD CCN(C(=O)[C@@H](C)Sc1ccc([N+](=O)[O-])cc1)[C@H](c1cccnc1)c1ccc(F)c(C)c1 521452052 NYOFKJFFUYWGDF-HXOBKFHXSA-N 453.539 5.556 5 20 JKBD Cc1ccc2nc([C@H]3CCCN3C(=O)c3ccc(N[C@H](C)c4ccccn4)c([N+](=O)[O-])c3)[nH]c2c1 522040628 MCRUFBRDZKKXJK-UZUQRXQVSA-N 470.533 5.325 5 20 JKBD C[C@@H](c1ccccc1F)N(C)C(=O)c1ccc(C(=O)N(C)[C@H](C)c2ccccc2F)cc1[N+](=O)[O-] 524353039 HWCIVJJZMFEDJS-SJORKVTESA-N 481.499 5.539 5 20 JKBD C[C@H](Nc1ccc(NC(=O)c2ccc(Sc3nncn3C)c([N+](=O)[O-])c2)cc1)c1ccccc1 524421733 HYUMGEZSAQXDDP-INIZCTEOSA-N 474.546 5.300 5 20 JKBD COc1cc([C@@H](C)Nc2ccc([N+](=O)[O-])c(C(=O)N3CCCC3)c2)ccc1OCc1ccccc1 603944007 YBBLOKCZWHEEHC-LJQANCHMSA-N 475.545 5.592 5 20 JKBD Cc1nc(NS(=O)(=O)c2ccc([N+](=O)[O-])cc2Cl)sc1-c1nc2ccccc2n1C(F)F 604024238 UUAIJFZLESRNBL-UHFFFAOYSA-N 499.908 5.226 5 20 JKBD O=C(NC[C@H]1CCN(CC(F)(F)F)C1)c1cc([N+](=O)[O-])ccc1Sc1ccc(Cl)cc1 608812650 XVRASIXHHVVCQL-CYBMUJFWSA-N 473.904 5.013 5 20 JKBD O=[N+]([O-])c1ccccc1-c1ccc(CNC2C[C@@H](C(F)(F)F)C[C@H](C(F)(F)F)C2)s1 608835870 REXAAUSXNMXIPJ-RYUDHWBXSA-N 452.420 6.322 5 20 JKBD COc1ccccc1[C@@H]1CCCN1C(=O)Cc1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1 609036635 JTZXBPRMLRWGCR-VWLOTQADSA-N 482.540 5.362 5 20 JKBD C[C@@H](OC(=O)c1cc([N+](=O)[O-])ccc1Br)C(=O)Nc1c(Cl)cc(Cl)cc1Cl 725985220 ISKUVDJCWAOLRC-SSDOTTSWSA-N 496.528 5.502 5 20 JKBD COCCN(Cc1ccccn1)C(=O)CCC(=O)c1ccc2ccc3cccc4ccc1c2c34 729259786 QNOLKOZMPQYBEA-UHFFFAOYSA-N 450.538 5.617 5 20 JKBD CC(C)CCSc1ccc(C(=O)N2CCC(N(C)C(=O)OC(C)(C)C)CC2)cc1[N+](=O)[O-] 730562076 UKFGVAIKMJBBGT-UHFFFAOYSA-N 465.616 5.205 5 20 JKBD C[C@@H](OC(=O)c1ccc(NCc2ccccc2)c([N+](=O)[O-])c1)c1nnc(-c2ccc(F)cc2)o1 745967987 YQUFOASAXDPHKB-OAHLLOKOSA-N 462.437 5.314 5 20 JKBD Cc1ccc(NC(=O)[C@H](OC(=O)c2ccc(Cl)nc2Cl)c2ccccc2)c([N+](=O)[O-])c1 747937032 YJRFENFWKPKCIV-GOSISDBHSA-N 460.273 5.142 5 20 JKBD COc1ccc(-c2cc3[nH]c(/C(Cl)=C\c4ccc([N+](=O)[O-])c(O)c4)nc(=O)c3s2)cc1 748146549 JYANTNCBDPDZLF-RIYZIHGNSA-N 455.879 5.011 5 20 JKBD CC[C@H](C)C(=O)N1CCC[C@@H](C(=O)Nc2cc(Cl)c([N+](=O)[O-])cc2OCc2ccccc2)C1 751062260 FJKNICVFNZZGGO-FUHWJXTLSA-N 473.957 5.050 5 20 JKBD O=C(OCc1nnc(-c2ccc([N+](=O)[O-])cc2)o1)/C(=C/c1ccc(Cl)cc1)c1ccc(F)cc1 768133793 IJGKWEDHYLGYDP-FYJGNVAPSA-N 479.851 5.721 5 20 JKBD C[C@@H]1CCCN(c2ccc(C(=O)OCC(=O)Nc3ccc(Cl)cc3C(F)(F)F)cc2[N+](=O)[O-])C1 783513162 QAWIFQRLNMNZFG-CYBMUJFWSA-N 499.873 5.299 5 20 JKBD Cc1ccc(-c2nc(NC(=O)c3cc([N+](=O)[O-])ccc3I)sc2C)cc1 915276446 ZPWOKDWNNYBPPG-UHFFFAOYSA-N 479.299 5.192 5 20 JKBD O=C(Cn1ncc2ccc([N+](=O)[O-])cc21)NC[C@@H](c1ccccc1Cl)c1c[nH]c2ccccc12 915287321 FGSFRBQTKFPQPI-FQEVSTJZSA-N 473.920 5.028 5 20 JKBD COc1ccccc1OCc1ccc(C(=O)Oc2ccc(NC(=O)c3cccc([N+](=O)[O-])c3)cc2)o1 915811316 ORNPIYOZCGXHQD-UHFFFAOYSA-N 488.452 5.247 5 20 JKBD C[C@@H](OC(=O)[C@@H](C)Sc1ccc(Br)cc1)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl 919468176 JQFYQOKDBKLXCO-GHMZBOCLSA-N 487.759 5.062 5 20 JKBD C[C@H](Nc1ccc(C(=O)OCc2coc(-c3cccc(F)c3)n2)cc1[N+](=O)[O-])c1ccccn1 920543641 GSKMHOBDVXHGRY-HNNXBMFYSA-N 462.437 5.314 5 20 JKBD COc1nc(C(=O)Oc2ccc(NC(=O)c3cc([N+](=O)[O-])ccc3Cl)cc2)cc2ccccc12 921303633 KPRLGJXNVIERLD-UHFFFAOYSA-N 477.860 5.277 5 20 JKBD O=C(CC1CC1)Nc1ccc(C2(NC(=O)c3cc(F)cc([N+](=O)[O-])c3Br)CCC2)cc1 1787826271 LPHWVDMOCPZHAW-UHFFFAOYSA-N 490.329 5.044 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)[C@H]3C[C@@H]3C3CC3)CCC2)cc1)c1cccc(Br)c1[N+](=O)[O-] 1790751402 BVNCYNYDVHCBTL-MOPGFXCFSA-N 498.377 5.151 5 20 JKBD Cc1c(C(=O)Nc2ccc(C3(NC(=O)c4cccnc4)CCC3)cc2)cc(Cl)cc1[N+](=O)[O-] 1790773718 GJIHMYHNSGGKTD-UHFFFAOYSA-N 464.909 5.013 5 20 JKBD O=C(NC1(c2ccc(NC(=O)[C@@]3(F)CCCC=C3F)cc2)CCC1)c1ccc([N+](=O)[O-])cc1F 1792379556 KZDLJBKZDABACF-XMMPIXPASA-N 473.451 5.227 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)N1CCC([C@H]2CCCCN2C(=O)[C@@H]2CCCCC2(F)F)CC1 1824647770 GLLBGGNFUQWAKU-GHTZIAJQSA-N 495.542 5.101 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)N1CCCC[C@@H]1C1CCN(C(=O)[C@H](C)c2ccccc2)CC1 1830729558 QYXMZJLPESDORU-HOYKHHGWSA-N 481.568 5.079 5 20 JKBD O=C(/C=C/C1CCCCC1)N1CCC([C@@H]2CCCCN2C(=O)Cc2cc(F)ccc2[N+](=O)[O-])CC1 1832890107 FARINBHOWBMITH-LUFJGRFYSA-N 485.600 5.033 5 20 JKBD c1ccc(-c2c3ccccc3c(-c3cccc4oc5cc6ccccc6cc5c34)c3ccccc23)cc1 1857791466 YNXLMKRNPABHMC-UHFFFAOYSA-N 470.571 10.380 5 20 JKBD C[C@@H](OC(=O)c1cc(-c2ccco2)nc2ccccc12)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl 11398360 MJGICOXTPFQIKJ-CYBMUJFWSA-N 465.849 5.240 5 20 JKBD O=C(Nc1ccccc1I)c1cc([N+](=O)[O-])ccc1Sc1ccccc1 14429436 GBSVWMXEIAUZSA-UHFFFAOYSA-N 476.295 5.603 5 20 JKBD Cc1nn(Cc2ccc(C(=O)N3CCC[C@H](c4nc5ccccc5s4)C3)cc2)c(C)c1[N+](=O)[O-] 15020698 RVIGKSTUPNQLHU-FQEVSTJZSA-N 475.574 5.086 5 20 JKBD Cc1ccc(-n2c(S[C@@H](C)c3nnc(-c4ccc([N+](=O)[O-])cc4)o3)nc3ccccc3c2=O)cc1C 17532843 CBUJLQJDISMXTB-KRWDZBQOSA-N 499.552 5.814 5 20 JKBD O=C(NC1CCN(C(=O)c2ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])cc2)CC1)c1ccc(F)cc1 25740935 YWAGYWLUZLEMMS-UHFFFAOYSA-N 497.910 5.214 5 20 JKBD O=C(COC(=O)c1ccc(-c2nc3ccccc3s2)s1)Nc1ccc([N+](=O)[O-])cc1Cl 28305183 PYVYPMJRJYIRHP-UHFFFAOYSA-N 473.919 5.382 5 20 JKBD Cc1ccc(NC(=O)CNC(=O)c2ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])cc2)c(Cl)c1 195731658 NQMBIAQRMMFESB-UHFFFAOYSA-N 474.300 5.371 5 20 JKBD O=C(Nc1ncc(Cc2ccccc2Cl)s1)C1CCN(c2ccccc2[N+](=O)[O-])CC1 487704736 ZAJOZSBAFYREOS-UHFFFAOYSA-N 456.955 5.151 5 20 JKBD COc1ccc(CN[C@H](C)c2nc(-c3ccccc3)cs2)cc1OCc1ccc([N+](=O)[O-])cc1 501352060 QZKMUOPAHUIGRN-GOSISDBHSA-N 475.570 6.157 5 20 JKBD CN1CCC(Nc2ccccc2NC(=O)c2ccc(NCc3ccccc3Cl)c([N+](=O)[O-])c2)CC1 502612957 JKHAGJKAYUDXOH-UHFFFAOYSA-N 493.995 5.619 5 20 JKBD CC[C@H](C)n1c(SCC(=O)Nc2ccc([N+](=O)[O-])cc2C(F)(F)F)nnc1-c1ccccc1 504282675 VZXUBSBVMFBCCN-ZDUSSCGKSA-N 479.484 5.574 5 20 JKBD O=C(Nc1ccc(NC(=O)C2CCN(c3ccccc3[N+](=O)[O-])CC2)cc1)c1ccc(Cl)cc1 507613505 RKQCVTBPNCUJHA-UHFFFAOYSA-N 478.936 5.356 5 20 JKBD COc1ccc(CNCc2ccc(F)cc2C(F)(F)F)cc1OCc1ccc([N+](=O)[O-])cc1 509619511 PNUOPPMMANRFQW-UHFFFAOYSA-N 464.415 5.630 5 20 JKBD CCOc1cc(NC(=O)N2CCC(c3nc4cc(Cl)ccc4o3)CC2)c([N+](=O)[O-])cc1OCC 513952672 CQQSRAQYMYBJFB-UHFFFAOYSA-N 488.928 5.598 5 20 JKBD COc1cccc([C@H](CNC(=O)c2ccc(SC)c([N+](=O)[O-])c2)c2c[nH]c3ccccc23)c1OC 514718754 AXVUDPAXDQTBOZ-FQEVSTJZSA-N 491.569 5.377 5 20 JKBD CC(C)[C@H](NC(=O)c1ccc(Sc2nncn2C)c([N+](=O)[O-])c1)c1cccc(C(F)(F)F)c1 523269780 QBADQLRJIGLLGL-SFHVURJKSA-N 479.484 5.020 5 20 JKBD CC1CCN(c2ccc(C(=O)N[C@@H]3C[C@@H](C(F)(F)F)C[C@@H](C(F)(F)F)C3)cc2[N+](=O)[O-])CC1 603573233 YEJVTPZGDFDIGR-ZSHCYNCHSA-N 481.437 5.470 5 20 JKBD Cc1cc(C)n(-c2ccccc2NC(=O)C2CCN(c3ccc(C(F)(F)F)cc3[N+](=O)[O-])CC2)n1 603873546 KSDWLVIBOYGPJD-UHFFFAOYSA-N 487.482 5.271 5 20 JKBD Cc1csc(Sc2ccc(C(=O)Nc3ccc(Sc4nncs4)cc3)cc2[N+](=O)[O-])n1 604119564 WLRATUMKOIPRLQ-UHFFFAOYSA-N 487.613 5.766 5 20 JKBD O=C(Nc1ccnn1-c1ccc([N+](=O)[O-])cc1)c1oc2ccccc2c1COc1ccccc1 609151732 TYECRYBLYMHTAN-UHFFFAOYSA-N 454.442 5.358 5 20 JKBD CCc1nc(CNC(=O)C/C(=C/c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)cs1 609346352 HINKODCIFXAFAJ-WJDWOHSUSA-N 464.572 5.471 5 20 JKBD Cc1ccc[n+](/C(C(=S)N[C@@H](C)c2ccc(Cl)cc2Cl)=C(/O)c2ccc([N+](=O)[O-])cc2)c1 726570730 RRDARKSISDNHQV-HNNXBMFYSA-O 489.404 6.060 5 20 JKBD O=C(Nc1ccccc1OCc1ncc(-c2cccc(Cl)c2)o1)c1cc([N+](=O)[O-])ccc1F 726762876 FYZUQOJLHDETMD-UHFFFAOYSA-N 467.840 5.874 5 20 JKBD Cn1cnnc1Sc1ccc(NC(=O)CCC(=O)c2ccc3ccc4cccc5ccc2c3c45)cc1 727754006 AJHUZKANPZOHTK-UHFFFAOYSA-N 490.588 6.465 5 20 JKBD O=C(Nc1cccc(C(=O)N(CC2CC2)c2ccc(Cl)c([N+](=O)[O-])c2)c1)[C@H]1Cc2ccccc2O1 728166250 XYNSLMYCAYXQLE-XMMPIXPASA-N 491.931 5.247 5 20 JKBD CC(C)COc1ncccc1C(=O)Oc1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2Cl)cc1 728456670 NYYKABBOZXXGQR-UHFFFAOYSA-N 469.881 5.150 5 20 JKBD COc1ccccc1[C@@H](C)CC(=O)Oc1ccc2c(-c3ccc([N+](=O)[O-])cc3)cc(=O)oc2c1 728457962 SWQYLEKUIYDFPN-INIZCTEOSA-N 459.454 5.476 5 20 JKBD CN1C(=O)CCc2cc(NC(=O)c3cc([N+](=O)[O-])ccc3N3CCC(Cc4ccccc4)CC3)ccc21 729417805 QXOIYSNORWDNJI-UHFFFAOYSA-N 498.583 5.215 5 20 JKBD COc1ccc(NC(=O)CNc2ccc(NC(=O)OC(C)(C)C)cc2C(F)(F)F)c([N+](=O)[O-])c1 729675491 KVVRVXGTSJSECK-UHFFFAOYSA-N 484.431 5.020 5 20 JKBD O=C(OCc1nc(-c2ccc([N+](=O)[O-])cc2)no1)c1csc(-c2ccc(Cl)c(Cl)c2)n1 744595695 AHLUFORECWYQSM-UHFFFAOYSA-N 477.285 5.432 5 20 JKBD Cc1c(C(=O)Nc2ccc(Cl)cc2C(=O)N2[C@@H](C)CCC[C@@H]2C)cc([N+](=O)[O-])c(C)c1[N+](=O)[O-] 748617508 KTSWCLDBJCLMJA-STQMWFEESA-N 488.928 5.429 5 20 JKBD Cc1ccc(Sc2ccc(CNCc3ccc(C(=O)N4CCCC4)cc3)cc2[N+](=O)[O-])cc1 822289584 FJPBNJJTIHJYLR-UHFFFAOYSA-N 461.587 5.580 5 20 JKBD Cc1cc(C)c(NC(=O)[C@@H](C)Oc2ccc3c(-c4ccc([N+](=O)[O-])cc4)cc(=O)oc3c2)c(C)c1 844160306 HUTAOTHUXGZEMI-GOSISDBHSA-N 472.497 5.699 5 20 JKBD CC(C)Cn1cc([C@H]2N(Cc3ccc(-c4ccccc4[N+](=O)[O-])o3)CC23CCOCC3)cn1 849479980 ZZHFHGNIXGDUQK-XMMPIXPASA-N 450.539 5.061 5 20 JKBD CCN1C(=S)N[C@@H](c2ccc(C)c([N+](=O)[O-])c2)C(C(=O)Nc2ccccc2C(F)(F)F)=C1C 916163366 APJGBEVLHHLIKN-IBGZPJMESA-N 478.496 5.086 5 20 JKBD CCc1cccc[n+]1/C(C(=S)Nc1ccc2c(c1)OC(F)(F)O2)=C(/O)c1ccc([N+](=O)[O-])cc1 920397931 ZVDSLXFUMMTCLI-UHFFFAOYSA-O 486.476 5.090 5 20 JKBD C[C@H](NC(=O)COC(=O)c1ccc(N[C@H](C)c2ccccn2)c([N+](=O)[O-])c1)c1cccc2ccccc12 920544957 OJPUBJTXBXCVCO-RBUKOAKNSA-N 498.539 5.350 5 20 JKBD O=C(NC1(c2ccc(NC(=O)c3ccc([N+](=O)[O-])o3)cc2)CCC1)c1ccc(OCC2CC2)cc1 1785751863 MCMJQORFLGMMQA-UHFFFAOYSA-N 475.501 5.038 5 20 JKBD COc1ncccc1C(=O)Nc1ccc(C2(NC(=O)c3cc(Cl)cc([N+](=O)[O-])c3C)CCC2)cc1 1787361695 CKONPBNWQXREIJ-UHFFFAOYSA-N 494.935 5.022 5 20 JKBD O=C(NC1(c2ccc(NC(=O)c3ccc([N+](=O)[O-])[nH]3)cc2)CCC1)c1ccc(C(F)(F)F)c(F)c1 1790187305 SNCVRHKIMSURAH-UHFFFAOYSA-N 490.413 5.142 5 20 JKBD COc1ccc(CC(=O)Nc2ccc(C3(NC(=O)[C@H]4C[C@H]4c4ccccc4)CCC3)cc2)c([N+](=O)[O-])c1 1790572410 ZTRVMYKMWVTEBT-DQEYMECFSA-N 499.567 5.084 5 20 JKBD O=C(/C=C/c1cc2ccccc2o1)NC1(c2ccc(NC(=O)c3cc(O)cc([N+](=O)[O-])c3)cc2)CCC1 1790756123 MBIFNFQLVWROLU-ZHACJKMWSA-N 497.507 5.508 5 20 JKBD CC[C@H](C)CC(=O)N1CCCC2(CCN(C(=O)c3cc4cc([N+](=O)[O-])ccc4s3)CC2)C1 1805789147 IOKVBZYKVOGSDY-KRWDZBQOSA-N 457.596 5.091 5 20 JKBD Cc1cccc(Cl)c1C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cc(F)cc([N+](=O)[O-])c2)[nH]n1 1821144310 MCWXNIIHGABEHO-LJQANCHMSA-N 485.903 5.039 5 20 JKBD Cc1cc(CCCC(=O)N2CCC([C@@H]3CCCCN3C(=O)[C@H]3C[C@H]3C3CC3)CC2)c([N+](=O)[O-])cc1F 1824066346 VKENPPOQRFMZDT-LSQMVHIFSA-N 499.627 5.031 5 20 JKBD CC(C)=CCCC(=O)N1CCCC[C@@H]1C1CCN(C(=O)Cc2ccc(Cl)cc2[N+](=O)[O-])CC1 1830249379 FBCQQDZCEPQARO-JOCHJYFZSA-N 476.017 5.157 5 20 JKBD O=C(c1ccccc1C1CC1)N1CCC([C@H]2CCCCN2C(=O)c2ccc([N+](=O)[O-])cc2F)CC1 1830497414 FOATUWVEIZHCHM-RUZDIDTESA-N 479.552 5.158 5 20 JKBD Cc1cc([N+](=O)[O-])ccc1NC(=O)CSc1nnc(-c2ccccc2F)n1Cc1ccccc1 9330671 MZEIWPHPCMYMRV-UHFFFAOYSA-N 477.521 5.080 5 20 JKBD CC1=C(C(=O)N(C)C)[C@@H](c2ccc(Cl)c([N+](=O)[O-])c2)NC(=S)N1c1cccc(C(F)(F)F)c1 16060085 IZEHKTXZLBHIAJ-GOSISDBHSA-N 498.914 5.065 5 20 JKBD Cc1c(NC(=O)c2cc([N+](=O)[O-])ccc2Sc2ccc(Cl)cc2)c(=O)n(-c2ccccc2)n1C 17303033 GIEUGCHLCVMPTI-UHFFFAOYSA-N 494.960 5.450 5 20 JKBD c1ccc(Cn2c(SCc3nc4ccccc4c4ccccc34)nnc2N2CCOCC2)cc1 17957399 LLACTUFRQORWAJ-UHFFFAOYSA-N 467.598 5.157 5 20 JKBD CCn1c(-c2ccc3c(c2)OCCO3)cnc1S[C@@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl 23291166 KCKMCCFSTZKQPU-ZDUSSCGKSA-N 488.953 5.022 5 20 JKBD CC(=O)c1ccc(-c2ccc(C(=O)N3CCN(c4ccc(C(F)(F)F)cc4[N+](=O)[O-])CC3)o2)cc1 23558257 WFPIMYHFLYNFCK-UHFFFAOYSA-N 487.434 5.039 5 20 JKBD C[C@H](c1ccc(-n2cncn2)cc1)N(C)C(=O)c1cc([N+](=O)[O-])ccc1Sc1ccccc1 25918532 MZHVQXAVWSAKMB-QGZVFWFLSA-N 459.531 5.160 5 20 JKBD O=C(CSc1ccc(C(F)(F)F)cc1[N+](=O)[O-])Nc1ccc(-c2cn3cccnc3n2)cc1 108074928 ANWORUAXFWZNKH-UHFFFAOYSA-N 473.436 5.054 5 20 JKBD C[C@H](Nc1ccc(C(=O)Nc2nc(-c3ccc4c(c3)OCO4)cs2)cc1[N+](=O)[O-])c1ccccn1 108753095 WBFNBRUGVUIAOC-AWEZNQCLSA-N 489.513 5.267 5 20 JKBD Cc1occc1CN(C)[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Br)c1ccccc1 195616925 CHZXLGBLPCHWMQ-HXUWFJFHSA-N 458.312 5.071 5 20 JKBD Cc1ccc(NC(=O)CCNc2ccc(C(F)(F)F)cc2[N+](=O)[O-])cc1NC(=O)c1ccncc1 303072211 PMWSPABOMFTAGL-UHFFFAOYSA-N 487.438 5.010 5 20 JKBD CCN(CC(=O)Nc1c(Cl)cccc1Cl)C(=O)c1csc(-c2ccc([N+](=O)[O-])cc2)n1 496316942 YNWUJZHYFDDOGC-UHFFFAOYSA-N 479.345 5.126 5 20 JKBD COc1ccc([C@H](C)NC(=O)C/C(=C\c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)cc1 498854580 JZWHOQWIRYXHHA-AWZALFRUSA-N 473.554 6.021 5 20 JKBD CCOc1cc(C(=O)N(C)Cc2cn(-c3ccccc3)nc2-c2cccs2)c([N+](=O)[O-])cc1OC 503180872 DXXABMJONRYQDY-UHFFFAOYSA-N 492.557 5.189 5 20 JKBD C[C@@H](Nc1ccc(C(=O)Nc2nnc(CC3CCCCC3)s2)cc1[N+](=O)[O-])c1ccccn1 504567165 ZGXIPFNMDQBOAW-OAHLLOKOSA-N 466.567 5.390 5 20 JKBD CCOC(=O)c1sc(-c2cccc([N+](=O)[O-])c2)cc1NC(=O)CCc1nnc(-c2ccccc2)o1 506858382 BPFYOTGDIYFCBS-UHFFFAOYSA-N 492.513 5.121 5 20 JKBD CCOc1cc(CNCc2cccc(C)c2)ccc1OCc1cc([N+](=O)[O-])cc2c1OCOC2 509582736 IIYYQDVRICGNPS-UHFFFAOYSA-N 464.518 5.037 5 20 JKBD CCC(C)(C)NC(=O)c1ccc(NC(=O)Cn2c3ccccc3c(=O)c3ccccc32)cc1Cl 515616182 VRFQEXBJSSSBJY-UHFFFAOYSA-N 475.976 5.365 5 20 JKBD CSc1ccc(C(=O)c2ccccc2C(=O)N2C[C@@H](C)O[C@H](c3ccccc3)C2)cc1[N+](=O)[O-] 516322344 JDHWXNLPXWLFEW-HXOBKFHXSA-N 476.554 5.150 5 20 JKBD CCOc1ccc(NC(=O)N2CCN(Cc3ccc(-c4ccccc4[N+](=O)[O-])s3)CC2)cc1OC 520813822 IVADIOPIAKEQQJ-UHFFFAOYSA-N 496.589 5.080 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Br)[C@@H](NCc1c(F)cccc1Cl)c1ccccc1 521767149 LVGXXGRVEREZII-FQEVSTJZSA-N 492.732 5.619 5 20 JKBD CSc1ccc(C(=O)c2ccccc2C(=O)Nc2cc3c(cc2Cl)OCCCO3)cc1[N+](=O)[O-] 592754615 YSFTZMAHSRWOCY-UHFFFAOYSA-N 498.944 5.615 5 20 JKBD O=C(Nc1cccc(CN2CCCCC2)c1)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 603877968 RXFRDUKYECFZJB-UHFFFAOYSA-N 490.526 5.455 5 20 JKBD COc1ccc(C(=O)Nc2nc(-c3ccc(OC(F)F)cc3OC(F)F)cs2)cc1[N+](=O)[O-] 604511027 WECXMUHJTQOIKT-UHFFFAOYSA-N 487.387 5.182 5 20 JKBD Cc1csc(Sc2ccc(C(=O)N(C)C[C@@H]3CCCO[C@H]3c3ccccc3)cc2[N+](=O)[O-])n1 604519103 JUTAXGDPNILWQR-UGKGYDQZSA-N 483.615 5.751 5 20 JKBD O=C(Nc1ccccc1OCc1ncc(-c2cccc(Cl)c2)o1)c1cc2cccc([N+](=O)[O-])c2[nH]1 608855638 LQXJZSBIBCGTCQ-UHFFFAOYSA-N 488.887 6.216 5 20 JKBD COc1ccc([C@H](CNC(=O)c2c[nH]c3cc([N+](=O)[O-])ccc23)c2c[nH]c3ccccc23)cc1 609581185 FEWJYJPBRAOOOW-NRFANRHFSA-N 454.486 5.128 5 20 JKBD CC(=O)Nc1cc(Cl)ccc1C(=O)O[C@@H](C(=O)Nc1ccc(C)cc1[N+](=O)[O-])c1ccccc1 727529354 MVKIMABOLQOVLM-JOCHJYFZSA-N 481.892 5.052 5 20 JKBD CC(C)N(Cc1nnc(-c2cccc([N+](=O)[O-])c2)o1)C(=O)C[C@@H](c1ccccc1)C(F)(F)F 728458949 GQXGFASBXBFIGE-SFHVURJKSA-N 462.428 5.118 5 20 JKBD CN(C(=O)c1ccccc1NC(=O)c1ccc([N+](=O)[O-])cc1Cl)c1cccc(OC(F)(F)F)c1 728546916 KFDXEKOVPCSECE-UHFFFAOYSA-N 493.825 5.676 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Cl)[C@@H](Nc1ccc(OCc2cccnc2)cc1)c1ccccc1 728591934 ORPWXTUSPXVGLO-VWLOTQADSA-N 488.931 6.014 5 20 JKBD CC(C)(C)OC(=O)Nc1ccc(N[C@@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2ccccc2)cc1 729676445 NHJHKTRGHUJSHU-JOCHJYFZSA-N 496.951 6.387 5 20 JKBD C[C@@H](OC(=O)c1cc(-c2ccc(C(F)(F)F)cc2)no1)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl 730857996 IUWKPOQIXPSAIW-SNVBAGLBSA-N 483.786 5.106 5 20 JKBD O=C(Nc1ccc(-c2nc3ccccc3s2)cn1)c1cc([N+](=O)[O-])ccc1Br 731162543 DNWGDFPBUDGIDQ-UHFFFAOYSA-N 455.293 5.281 5 20 JKBD O=C(OCC(=O)N(Cc1ccccc1)c1ccccc1)c1csc(-c2cccc([N+](=O)[O-])c2)n1 747960901 DSTGITWXVRNZDW-UHFFFAOYSA-N 473.510 5.109 5 20 JKBD COc1cc(CSc2nnc3n(C(C)C)c4ccccc4n23)c([N+](=O)[O-])cc1OC(F)F 791290857 NDSWNYYBMHCZIS-UHFFFAOYSA-N 463.466 5.075 5 20 JKBD COc1ccc(-c2nnc(S[C@H](C)C(=O)Nc3cc([N+](=O)[O-])ccc3Cl)n2CC(C)C)cc1 792729139 PBEZYDMMILABHN-CQSZACIVSA-N 489.985 5.291 5 20 JKBD O=C(Nc1nc(-c2ccc(OC(F)F)cc2)cs1)c1ccc(Br)c([N+](=O)[O-])c1 914740310 AAMWEMSNKTXAGV-UHFFFAOYSA-N 470.251 5.335 5 20 JKBD COc1ccc(Oc2ccc([N+](=O)[O-])cc2C(=O)O[C@H](C)C(=O)Nc2cc(F)ccc2C)cc1 915250448 UNDCKQNKRWLNHK-OAHLLOKOSA-N 468.437 5.027 5 20 JKBD Cc1ccc(N2C(=O)CC[C@H](C(=O)N[C@@H](C)c3cccc([N+](=O)[O-])c3)[C@H]2c2cccs2)cc1 917699621 DETJJXNQUJENPK-JBUDQFAYSA-N 463.559 5.326 5 20 JKBD CC(=O)N(c1cccc(C(F)(F)F)c1)c1nc(COC(=O)c2csc([N+](=O)[O-])c2)cs1 919372217 WJWNDRJUVYZVEO-UHFFFAOYSA-N 471.438 5.173 5 20 JKBD Cc1c(C(=O)NCCN2C(=O)S/C(=C/c3ccc(Cl)c([N+](=O)[O-])c3)C2=O)oc2c(C)cccc12 919679620 ZDUXDANKFAXCKO-WOJGMQOQSA-N 499.932 5.078 5 20 JKBD O=C(Nc1ccc(F)c([N+](=O)[O-])c1)c1cc(-c2ccncc2)nc2ccc(Br)cc12 919985175 FJMXFZAVMNNNAM-UHFFFAOYSA-N 467.254 5.359 5 20 JKBD O=C(Cc1cccs1)Nc1nc(CC(=O)Oc2ccc(-c3ccccc3)cc2[N+](=O)[O-])cs1 920330996 SMRDUQQGPCJTAM-UHFFFAOYSA-N 479.539 5.109 5 20 JKBD O=C(Cc1cccc([N+](=O)[O-])c1)Nc1ccc(C2(NC(=O)c3cc4ccccc4o3)CCC2)cc1 1785791528 BNEFPOYXNBGECN-UHFFFAOYSA-N 469.497 5.331 5 20 JKBD O=C(CSc1ccccc1[N+](=O)[O-])NC1(c2ccc(NC(=O)[C@H](F)c3ccccc3)cc2)CCC1 1786615210 KUPNMGAAZYJWEM-XMMPIXPASA-N 493.560 5.532 5 20 JKBD CSc1ccc(CC(=O)Nc2ccc(C3(NC(=O)c4cc(O)cc([N+](=O)[O-])c4)CCC3)cc2)cc1 1791736760 VHUDJWFFBMXZFS-UHFFFAOYSA-N 491.569 5.013 5 20 JKBD Cc1cc(CCCC(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)C[C@H](C)c2ccccc2)c([N+](=O)[O-])cc1F 1801747483 GUWZDVHXEPYAIM-ABQRKTDGSA-N 495.595 5.197 5 20 JKBD O=C(c1cc(F)cc([N+](=O)[O-])c1)N1CCC([C@@H]2CCCCN2C(=O)/C=C/C2CCCCC2)CC1 1830355662 KVYJFJONBODRHQ-GTCGAKFVSA-N 471.573 5.104 5 20 JKBD Cc1ccc(CCC(=O)N2CCC([C@@H]3CCCCN3C(=O)c3cccc(F)c3[N+](=O)[O-])CC2)cc1F 1830616424 ILRUGIFCSKBJOR-DEOSSOPVSA-N 499.558 5.048 5 20 JKBD C[C@@H](CC(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2ccc([N+](=O)[O-])cc2F)CC1)c1ccccc1 1831507510 QMYYMTMKWJGBOO-UQBPGWFLSA-N 481.568 5.161 5 20 JKBD Cc1ccc(Nc2nnc(S[C@@H](C)C(=O)Nc3ccc([N+](=O)[O-])cc3C(F)(F)F)s2)cc1C 10212295 BZBKUQGTSCCWFK-LBPRGKRZSA-N 497.524 5.945 5 20 JKBD COc1ccc(C)cc1NC(=O)c1cc2ccccc2cc1OCC(=O)Nc1cc([N+](=O)[O-])ccc1C 10729655 OIYNCYVTEYHKJD-UHFFFAOYSA-N 499.523 5.643 5 20 JKBD C[C@H](Sc1nnc(-c2cccs2)n1-c1ccccc1)C(=O)Nc1ccc(F)c([N+](=O)[O-])c1 11209727 NOYYAMBYBHMDHI-ZDUSSCGKSA-N 469.523 5.162 5 20 JKBD C[C@@H](OC(=O)Cn1c2ccccc2c(=O)c2ccccc21)C(=O)Nc1cccc(Cl)c1Cl 11276514 YXPRDHQLBOEPTG-CQSZACIVSA-N 469.324 5.032 5 20 JKBD Cc1cccc(C)c1NC(=O)COC(=O)c1ccc(NCc2ccccc2Cl)c([N+](=O)[O-])c1 21606079 CLAMYXOXNGJANE-UHFFFAOYSA-N 467.909 5.273 5 20 JKBD COc1ccc(NC(=O)[C@@H](C)Sc2nc3ccccc3c3nc4ccccc4n23)c(OC)c1 21767909 ANBGKDCUPNYZCW-OAHLLOKOSA-N 458.543 5.172 5 20 JKBD O=C(CS[C@H](c1ccccc1)c1ccc(Cl)cc1)OCc1nnc(-c2ccc([N+](=O)[O-])cc2)o1 22525193 RUMKJQKFERVDOH-HSZRJFAPSA-N 495.944 5.864 5 20 JKBD Cc1noc(COC(=O)c2c3c(nc4ccccc24)/C(=C/c2cccc([N+](=O)[O-])c2)CCC3)n1 23374405 XXLRYUGSFNRXPA-SFQUDFHCSA-N 456.458 5.068 5 20 JKBD Cc1csc(Sc2ccc(C(=O)O[C@H](C)C(=O)Nc3cc(F)ccc3C)cc2[N+](=O)[O-])n1 23968912 XKWDQMWAQZNWCW-CYBMUJFWSA-N 475.523 5.142 5 20 JKBD Cc1occc1-c1nnc(S[C@@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2C)n1-c1ccccc1 24014053 WVAOZMRLIYAMKA-INIZCTEOSA-N 463.519 5.172 5 20 JKBD O=C(Nc1ccc(C(=O)Nc2nccs2)cc1)c1ccc(Nc2ccccc2)c([N+](=O)[O-])c1 24918412 YJDGXYZSXIWBAU-UHFFFAOYSA-N 459.487 5.300 5 20 JKBD CN(C)C(=O)Sc1ccccc1NC(=O)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1 110676187 NZVLCDJGCZKRHC-UHFFFAOYSA-N 471.922 6.067 5 20 JKBD CC(C)N1CCC(N(C)C(=O)c2ccc(Sc3nc4ccccc4s3)c([N+](=O)[O-])c2)CC1 476173839 VSSOFMIBOPNEHC-UHFFFAOYSA-N 470.620 5.301 5 20 JKBD O=C(N[C@@H]1CCN2CCCC[C@@H]12)c1ccccc1Sc1ccc(C(F)(F)F)cc1[N+](=O)[O-] 481415619 PAPBQUMPMOMLNJ-SJORKVTESA-N 465.497 5.121 5 20 JKBD CCOc1ccc2c(c1)[C@H](C)CC(C)(C)N2C(=O)c1ccc(Sc2nncn2C)c([N+](=O)[O-])c1 483330489 ABZOTMQEQOSRDL-OAHLLOKOSA-N 481.578 5.206 5 20 JKBD O=C(c1csc(-c2cccc([N+](=O)[O-])c2)n1)N(Cc1ccccn1)c1ccc(Br)cc1 496610973 JKUXGVRWJVFFSB-UHFFFAOYSA-N 495.358 5.723 5 20 JKBD C[C@H](Nc1ccc(C(=O)Nc2cccc(OCc3cscn3)c2)cc1[N+](=O)[O-])c1ccccn1 505057511 JNNXUTRSFZTYBU-INIZCTEOSA-N 475.530 5.451 5 20 JKBD C[C@@H](Nc1ccc(C(=O)N2CCO[C@H](c3ccccc3Cl)C2)cc1[N+](=O)[O-])c1ccccn1 505137113 QCZWHOHCMLTQID-MWTRTKDXSA-N 466.925 5.030 5 20 JKBD CN(CCC(F)(F)F)C(=O)c1c2c(nc3ccccc13)/C(=C\c1ccc([N+](=O)[O-])cc1)CCC2 511384312 ZWITUBAGGKTIRZ-ICFOKQHNSA-N 469.463 6.044 5 20 JKBD Cc1cc(CN(C)C(=O)c2c3c(nc4ccccc24)/C(=C\c2cccc([N+](=O)[O-])c2)CCC3)no1 512798216 SGSDFZCXGKRDDV-RGEXLXHISA-N 468.513 5.589 5 20 JKBD C[C@@H](Nc1cccc(OCc2cccnc2)c1)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 515715975 ZFNTXTWFZBFRTM-CQSZACIVSA-N 460.412 5.027 5 20 JKBD O=C(Nc1ccc(-c2csnn2)cc1)c1ccc(NCc2ccccc2Cl)c([N+](=O)[O-])c1 516696657 OQSFFZLIRJWNTH-UHFFFAOYSA-N 465.922 5.631 5 20 JKBD CC[C@@H](C)NC(=O)c1ccc(NC(=O)c2ccc(N[C@@H](C)c3ccccn3)c([N+](=O)[O-])c2)c(C)c1 519027624 WVGXDOPTOHVQTR-MSOLQXFVSA-N 475.549 5.252 5 20 JKBD Cc1nc(CNC(=O)c2cc([N+](=O)[O-])ccc2Sc2ccc(Cl)cc2)nc2ccccc12 522552862 KTRUORAVMPUIRO-UHFFFAOYSA-N 464.934 5.581 5 20 JKBD Cc1ccc2nc([C@H]3CCCN(C(=O)c4ccc(N5CCC[C@@H](C)C5)c([N+](=O)[O-])c4)C3)[nH]c2c1 551051766 ZPLJFFNLNWYZOZ-QUCCMNQESA-N 461.566 5.036 5 20 JKBD O=C(C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)NCc1cc2ccccc2[nH]1 562210427 CEKISYHHDJOABC-CPNJWEJPSA-N 468.538 5.933 5 20 JKBD C[C@@H](NC(=O)CSc1ccc(C(F)(F)F)cc1[N+](=O)[O-])c1cccc(OC(F)F)c1 603665235 SNMPYJNGYGYLGI-SNVBAGLBSA-N 450.385 5.185 5 20 JKBD COc1cc(C(=O)N[C@H](Cc2ccc(Cl)cc2)c2ccccc2)c([N+](=O)[O-])cc1OC(F)F 604118811 KAYUEQUSUNVECF-GOSISDBHSA-N 476.863 5.572 5 20 JKBD CSc1ccc(C(=O)N2CCC[C@H](c3nc(-c4ccc(Cl)cc4)no3)C2)cc1[N+](=O)[O-] 608817881 KYKIFFQSIHNAPX-HNNXBMFYSA-N 458.927 5.040 5 20 JKBD CC(=O)Nc1ccc(NC(=O)c2ccc(Sc3ccc(C)cc3)c([N+](=O)[O-])c2)c(Cl)c1 609018470 ATILIWOVDPZCGC-UHFFFAOYSA-N 455.923 5.919 5 20 JKBD CCOc1ccc(OC)cc1NC(=O)C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1 609182412 MYUCCIIJXBCUOY-NBVRZTHBSA-N 489.553 6.181 5 20 JKBD CCc1sc(NC(=O)c2cc(SC)c(OC)cc2[N+](=O)[O-])nc1-c1ccc(OC)cc1 609202662 PISDYRFDIXYOQS-UHFFFAOYSA-N 459.549 5.272 5 20 JKBD CCC(CC)c1cc[n+](/C(C(=S)N[C@H](C)c2cccs2)=C(/O)c2ccc(C)c([N+](=O)[O-])c2)cc1 726582035 ZWNKZPIZSMKYTO-GOSISDBHSA-O 496.678 6.718 5 20 JKBD CCOc1ccc(OCC)c(NC(=S)/C(=C(/O)c2ccc([N+](=O)[O-])cc2)[n+]2ccccc2)c1 726963418 NMLMXWXWZXJWBK-UHFFFAOYSA-O 466.539 5.003 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)Nc2nc(Cc3ccc(Br)cc3)cs2)cc1SC 728468236 CGVZVGNCZNWGLB-UHFFFAOYSA-N 494.392 5.387 5 20 JKBD CC(=O)N(c1ccc(C)c(C)c1)c1nc(/C=C2/N=C(c3c(Cl)cccc3[N+](=O)[O-])OC2=O)cs1 730957425 CQSZEFYUEDFXGI-VCHYOVAHSA-N 496.932 5.351 5 20 JKBD O=C(OCc1ccccc1[N+](=O)[O-])c1cnn(-c2ncc(C(F)(F)F)cc2Cl)c1C(F)F 731102872 QUHHQMXWVQNLCJ-UHFFFAOYSA-N 476.745 5.142 5 20 JKBD O=C(Nc1nc(-c2cc(Cl)ccc2Cl)cs1)c1cc([N+](=O)[O-])ccc1Br 751056226 YBDGJWSCMXEEQL-UHFFFAOYSA-N 473.135 6.040 5 20 JKBD COc1cc(C(=O)Nc2cccc(Cl)c2SC(F)F)c([N+](=O)[O-])cc1OC(F)F 751229932 MPBCLZQCSFTLFI-UHFFFAOYSA-N 454.785 5.425 5 20 JKBD O=C(Nc1cccnc1Cl)c1ccccc1Sc1ccc(C(F)(F)F)cc1[N+](=O)[O-] 819202499 KRVXQFVYWJZBOM-UHFFFAOYSA-N 453.829 6.066 5 20 JKBD Cc1csc(Sc2ccc(-c3nc([C@H]4CCC(=O)N(CC5CCC5)C4)no3)cc2[N+](=O)[O-])n1 856567742 YKDOGQJGDVNEQZ-INIZCTEOSA-N 485.591 5.067 5 20 JKBD CCOC(=O)c1c(-c2ccc(C)c(C)c2)csc1NC(=O)c1cc(OC)c(OC)cc1[N+](=O)[O-] 858085191 AKBMVRIAMWZXIK-UHFFFAOYSA-N 484.530 5.386 5 20 JKBD CC(C)N(Cc1nnc(-c2cccc([N+](=O)[O-])c2)o1)C(=O)c1cc(-c2ccccc2Cl)on1 914838049 LKVXARJMVXMGBX-UHFFFAOYSA-N 467.869 5.004 5 20 JKBD CN(Cc1cccc(NC(=O)c2cc(OCC(F)(F)F)ccc2[N+](=O)[O-])c1)C(=O)OC(C)(C)C 917111259 CBROPHQBDCGDTJ-UHFFFAOYSA-N 483.443 5.155 5 20 JKBD O=C(Cc1cccc([N+](=O)[O-])c1)Nc1ccc(C2(NC(=O)c3cc4cc[nH]c4cc3F)CCC2)cc1 1785793722 YOIRCURZMHKBCD-UHFFFAOYSA-N 486.503 5.206 5 20 JKBD O=C(CCc1cccc([N+](=O)[O-])c1)NC1(c2ccc(NC(=O)c3cnc(Cl)s3)cc2)CCC1 1789858866 MSFBHSVJJUVOND-UHFFFAOYSA-N 484.965 5.085 5 20 JKBD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2ccc([N+](=O)[O-])o2)[nH]n1)c1cccc2c1oc1ccccc12 1821609219 AYPGWWWDKRTCDV-IBGZPJMESA-N 499.483 5.430 5 20 JKBD O=C(/C=C/c1ccccc1[N+](=O)[O-])Nc1cc([C@H]2CCCCN2C(=O)c2cc(Cl)ccc2F)[nH]n1 1823501941 YBICZZKCCSXXAQ-OGECGYFKSA-N 497.914 5.130 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)N1CCC([C@@H]2CCCCN2C(=O)CSc2ccccc2)CC1 1826520542 BXZQMJLGUWKFDY-QHCPKHFHSA-N 499.608 5.068 5 20 JKBD Cc1c(C(=O)N2CCCC[C@H]2C2CCN(C(=O)c3ccc([N+](=O)[O-])cc3F)CC2)oc2ccccc12 1828128615 WVQRKICPPSDXSE-QHCPKHFHSA-N 493.535 5.336 5 20 JKBD Cc1cc2cc(C(=O)N3CCC([C@H]4CCCCN4C(=O)c4cccc(F)c4[N+](=O)[O-])CC3)ccc2[nH]1 1830621998 XPKGMEWIFUWHDW-XMMPIXPASA-N 492.551 5.071 5 20 JKBD Cc1cccnc1C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)CC1 1831059026 AXHWCROADJAGBP-OAQYLSRUSA-N 492.601 5.060 5 20 JKBD CC[C@H](C(=O)N1CCC([C@H]2CCCCN2C(=O)Cc2cc(F)ccc2[N+](=O)[O-])CC1)c1ccccc1 1832887810 YMGPAMHVIJHQSG-LOSJGSFVSA-N 495.595 5.090 5 20 JKBD Cc1c(-c2ccccc2)oc2c(C(=O)OCC(=O)Nc3cc([N+](=O)[O-])ccc3Cl)cccc2c1=O 9487080 ZFMOMYUZDVGZDG-UHFFFAOYSA-N 492.871 5.126 5 20 JKBD CC(=O)N(c1ccccc1)c1nc(COC(=O)Cn2c3ccccc3c(=O)c3ccccc32)cs1 10722987 QUDRJGWINHRIGJ-UHFFFAOYSA-N 483.549 5.039 5 20 JKBD O=C(COC(=O)c1nc(Cl)c(Cl)c(Cl)c1Cl)Nc1cc([N+](=O)[O-])ccc1Cl 12684213 CORKWUXIKBWHJV-UHFFFAOYSA-N 473.483 5.052 5 20 JKBD Cc1ccc(Sc2ccc(C(=O)N3CCC(C(=O)Nc4ccccc4)CC3)cc2[N+](=O)[O-])cc1 15182280 KMKZFXDWGPVKJF-UHFFFAOYSA-N 475.570 5.545 5 20 JKBD Cn1c(SCc2nc(=O)c3c(-c4ccccc4)csc3[nH]2)nc2cc3ccccc3cc2c1=O 24969816 KGQCOWBQJAKCFU-UHFFFAOYSA-N 482.590 5.344 5 20 JKBD CC[C@H](c1ccc(F)cc1)N(Cc1cccc(F)c1)C(=O)c1cc([N+](=O)[O-])cc(S(C)(=O)=O)c1 109032901 GISGYZAGHVLRLE-HSZRJFAPSA-N 488.512 5.070 5 20 JKBD C[C@@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)Nc1nc(-c2ccccc2OC(F)F)cs1 110601229 MPAAKBWLKVIUPL-LLVKDONJSA-N 451.476 5.439 5 20 JKBD O=[N+]([O-])c1ccc(-c2nn(-c3ccccc3)cc2CN[C@H](c2ccccc2)c2ccco2)cc1 215865120 CTIDHTHUUYVNEK-HHHXNRCGSA-N 450.498 5.920 5 20 JKBD O=C(c1ccccc1)c1cc([N+](=O)[O-])ccc1NC(=O)C1CCN(C(=O)c2ccc(Cl)s2)CC1 478137211 BCRVAKHRYOIQLL-UHFFFAOYSA-N 497.960 5.032 5 20 JKBD CCCOc1ccccc1Oc1ncccc1CNC(=O)Cn1c2ccccc2c(=O)c2ccccc21 502248714 MOUWEXAZEIWJEY-UHFFFAOYSA-N 493.563 5.447 5 20 JKBD O=C(Cc1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1)Nc1ccc(F)c(F)c1F 506648322 LDBJJAUQUXAMHA-UHFFFAOYSA-N 452.392 5.046 5 20 JKBD COc1cc(CNCc2ccccc2Br)c([N+](=O)[O-])cc1OCc1ccccc1 507895184 KJFWCRHPOZVIEG-UHFFFAOYSA-N 457.324 5.235 5 20 JKBD C[C@H](NC(=O)N(C)[C@@H]1CCSc2ccc(Br)cc21)c1cccc([N+](=O)[O-])c1 509479337 KSMNOUOTXGWTRW-YVEFUNNKSA-N 450.358 5.297 5 20 JKBD COc1cc(C(=O)N[C@@H](c2ccc(C(C)C)cc2)C(C)C)c([N+](=O)[O-])cc1OCc1cscn1 512306920 VTWXNRIRDLLUEE-XMMPIXPASA-N 483.590 5.889 5 20 JKBD C[C@H](Nc1ccc(C(=O)Nc2nnc(-c3ccccc3Cl)s2)cc1[N+](=O)[O-])c1ccccn1 516211708 WLQBZKRZKOZWLU-ZDUSSCGKSA-N 480.937 5.587 5 20 JKBD Cn1ccnc1[C@@H](NCc1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1)c1cccc(F)c1 518769615 JKQHXDRVHJOQJF-QHCPKHFHSA-N 466.900 5.792 5 20 JKBD C[C@@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)Nc1cc(Br)ccc1Br 520440676 OVXBXPGJHYUUKL-MRVPVSSYSA-N 478.524 5.179 5 20 JKBD Cc1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2NCc2ccccc2)cc1NC(=O)c1ccncc1 521392696 DFPDUWZSPFIEMO-UHFFFAOYSA-N 481.512 5.415 5 20 JKBD O=C(NCC1(c2cccc(C(F)(F)F)c2)CC1)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-] 524056756 AHNIRVHJWZXBSW-UHFFFAOYSA-N 462.346 5.016 5 20 JKBD CCCN(Cc1nnc(-c2ccccc2Cl)o1)C(=O)c1ccc(N2CCC[C@@H](C)C2)c([N+](=O)[O-])c1 603820952 BFYACGBNGBCQFC-QGZVFWFLSA-N 497.983 5.587 5 20 JKBD COc1ccc(CNCC2(c3ccccc3C)CCOCC2)cc1OCc1ccc([N+](=O)[O-])cc1 604419122 LLWVMZGYMPRFEG-UHFFFAOYSA-N 476.573 5.329 5 20 JKBD CSc1ccc(C(=O)N2CCC[C@@H](c3nc(-c4ccc(Cl)cc4)no3)C2)cc1[N+](=O)[O-] 608817884 KYKIFFQSIHNAPX-OAHLLOKOSA-N 458.927 5.040 5 20 JKBD Cc1ccc(NC(=O)c2ccc(N3CCC(C(=O)Nc4ccccc4)CC3)c([N+](=O)[O-])c2)cc1 608971308 HCSCJVCJWFCWTC-UHFFFAOYSA-N 458.518 5.011 5 20 JKBD O=C(Nc1nc(-c2ccccc2OC(F)F)cs1)c1csc(-c2cccc([N+](=O)[O-])c2)n1 609021482 DVXJXJRVHIGDMR-UHFFFAOYSA-N 474.470 5.696 5 20 JKBD Cc1nc(COc2ccc(NC(=O)c3ccc(Oc4ccc(Cl)cc4[N+](=O)[O-])cc3)cc2)no1 609376350 LLPZLAZKLBMPRH-UHFFFAOYSA-N 480.864 5.563 5 20 JKBD COC(=O)c1ccc(NC(=O)CSc2ccccc2C(=O)Nc2ccc([N+](=O)[O-])c(Cl)c2)cc1 727712214 RUBJEXSQCYRDIJ-UHFFFAOYSA-N 499.932 5.018 5 20 JKBD Cc1ccc(C)c(NC(=O)[C@@H](OC(=O)Cn2ccc3cc([N+](=O)[O-])ccc32)c2ccccc2)c1 744623196 MESIEZCRUXDLLR-VWLOTQADSA-N 457.486 5.090 5 20 JKBD C[C@@H](OC(=O)c1ccc(-c2nc3ccccc3s2)o1)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 746138705 SDSJLFWESKSJNN-GFCCVEGCSA-N 462.443 5.433 5 20 JKBD COc1cc(/C=C(/Cl)c2nc(O)c3c(-c4ccc(C)s4)csc3n2)cc([N+](=O)[O-])c1O 747168126 LCPWZCPZHHQVBD-LFYBBSHMSA-N 475.935 5.793 5 20 JKBD COc1ccc(NC(=O)OC(C)(C)C)c(NC(=O)c2csc(-c3ccc([N+](=O)[O-])cc3)n2)c1 747640406 UORBIZDIJMERLL-UHFFFAOYSA-N 470.507 5.326 5 20 JKBD Cc1c(C(=O)O[C@H](C)C(=O)Nc2ccccc2Oc2ccccc2)cc([N+](=O)[O-])c(C)c1[N+](=O)[O-] 748952109 VGLNXHPDLYQUGQ-MRXNPFEDSA-N 479.445 5.096 5 20 JKBD COc1cc(COC(=O)c2ccc3c(c2)C[C@H](c2ccccc2)OC3=O)c([N+](=O)[O-])cc1OC(F)F 791402867 YRQJDHRZQCKTPA-HXUWFJFHSA-N 499.422 5.016 5 20 JKBD O=C(COC(=O)CSc1ccc2c3c(cccc13)CC2)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 846257181 WMYIEYKGLNKEMV-UHFFFAOYSA-N 490.459 5.139 5 20 JKBD C[C@H](OC(=O)c1sc(-c2ccco2)nc1-c1ccccc1)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 900284724 UWICDGFKVZPAMG-AWEZNQCLSA-N 488.481 5.946 5 20 JKBD C[C@H](Nc1ccc(C(=O)O[C@@H](C(=O)N2CCCCC2)c2ccccc2)cc1[N+](=O)[O-])c1ccccn1 920545435 RDNDZQPYXCKNGO-UQBPGWFLSA-N 488.544 5.074 5 20 JKBD COc1cc(C(=O)OCc2c(C)cc(C)c(C(C)=O)c2C)c([N+](=O)[O-])cc1OCc1cscn1 920654359 XTUNRIXBJCCRPV-UHFFFAOYSA-N 484.530 5.124 5 20 JKBD COc1cc(C(=O)NC2(c3ccc(NC(=O)CSc4ccccc4)cc3)CCC2)ccc1[N+](=O)[O-] 1787777308 WJXCQDJOWUQQBI-UHFFFAOYSA-N 491.569 5.143 5 20 JKBD Cc1ccncc1C(=O)Nc1ccc(C2(NC(=O)C3(c4cccc([N+](=O)[O-])c4)CCC3)CCC2)cc1 1788822773 LESQCQHFECZPGJ-UHFFFAOYSA-N 484.556 5.168 5 20 JKBD CC1=CC[C@H](C(=O)Nc2ccc(C3(NC(=O)c4cc([N+](=O)[O-])ccc4N(C)C)CCC3)cc2)CC1 1789115176 OOLBACOHJROUAM-IBGZPJMESA-N 476.577 5.155 5 20 JKBD O=C(/C=C/c1ccccc1[N+](=O)[O-])Nc1ccc(C2(NC(=O)c3cccc4cnccc34)CCC2)cc1 1792317873 WCHORNXFDCEMRB-NTEUORMPSA-N 492.535 5.604 5 20 JKBD CC(C)[C@H](C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)/C=C/c1ccccc1[N+](=O)[O-])C2)c1ccc(Cl)cc1 1793222995 JWIVMWUEIVUFHI-CHLHZWNFSA-N 496.007 5.339 5 20 JKBD Cc1c(C(=O)N2CCCC[C@H]2c2cc(NC(=O)CC(C)(C)C)n[nH]2)cc(Cl)cc1[N+](=O)[O-] 1816760960 OMXWBBSEUYSMEA-KRWDZBQOSA-N 461.950 5.022 5 20 JKBD O=C(c1cc2cc([N+](=O)[O-])ccc2s1)N1CCCC[C@H]1c1cc(NC(=O)C2(F)CCCCC2)n[nH]1 1818883295 UOMSJZHAWSGNOF-SFHVURJKSA-N 499.568 5.511 5 20 JKBD Cc1c(C(=O)N2CCC([C@H]3CCCCN3C(=O)c3ccc(Cl)o3)CC2)cc(Cl)cc1[N+](=O)[O-] 1827984464 FSTJPDDABNTGDZ-GOSISDBHSA-N 494.375 5.350 5 20 JKBD O=C(c1cc2cc([N+](=O)[O-])ccc2s1)N1CCC([C@H]2CCCCN2C(=O)[C@H]2CC=CCC2)CC1 1830280545 OJORTQFNLVNFDI-SIKLNZKXSA-N 481.618 5.399 5 20 JKBD CC1=CC[C@H](C(=O)N2CCC([C@@H]3CCCCN3C(=O)CSc3ccccc3[N+](=O)[O-])CC2)CC1 1831776114 JDNKQHSFONKPNU-VXKWHMMOSA-N 485.650 5.053 5 20 JKBD COc1ccc(N2C(=O)/C(=C\c3cccs3)N=C2SCc2ccc([N+](=O)[O-])cc2)cc1Cl 8953130 ROJVSUUFUJOEKC-XDHOZWIPSA-N 485.974 5.995 5 20 JKBD Cc1nc(CSc2ccc(C(=O)O[C@H](C)C(=O)Nc3cc([N+](=O)[O-])ccc3Cl)cc2)cs1 11699814 BNTYQJQKXOIYBU-GFCCVEGCSA-N 491.978 5.489 5 20 JKBD Cc1ccccc1CN[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Br)c1ccccc1 18942376 CIOXTGJLLRGCFS-OAQYLSRUSA-N 454.324 5.135 5 20 JKBD C[C@H](Sc1nn(-c2ccc(Cl)cc2)c(=S)s1)C(=O)Nc1cccc([N+](=O)[O-])c1 20852153 CHGQFLFZCFRHHB-JTQLQIEISA-N 452.970 5.344 5 20 JKBD CC(C)c1ccccc1NC(=O)COC(=O)c1ccccc1NC(=O)c1ccc([N+](=O)[O-])cc1Cl 21686964 BMAVMBZUSQEOET-UHFFFAOYSA-N 495.919 5.419 5 20 JKBD Cc1csc(Sc2ccc(C(=O)Nc3cccc(Oc4cnccn4)c3)cc2[N+](=O)[O-])n1 43773129 QIAOVTMABLWETQ-UHFFFAOYSA-N 465.516 5.346 5 20 JKBD C[C@@H](Nc1ccc(C(=O)NC2CC2)cc1[N+](=O)[O-])c1ccc(NC(=O)c2ccc(F)cc2)cc1 59420566 SBCFUNVLYGCQQM-OAHLLOKOSA-N 462.481 5.052 5 20 JKBD Cn1cnnc1Sc1ccc(C(=O)N2CCC[C@H]2c2cccc3ccccc23)cc1[N+](=O)[O-] 72024317 KYSGCSZVUIJFNA-FQEVSTJZSA-N 459.531 5.005 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)Nc2cc(-c3ccoc3)nn2-c2ccccc2)cc1SC 112532428 NYEWRMXDMPPENF-UHFFFAOYSA-N 450.476 5.023 5 20 JKBD COc1ccc(NC(=O)c2cc3cc([N+](=O)[O-])ccc3s2)cc1NC(=O)c1cccc(F)c1 117134245 OKFZKLDUBWWRCI-UHFFFAOYSA-N 465.462 5.462 5 20 JKBD O=[N+]([O-])c1ccc(-c2noc(CN[C@H](c3ccccc3)c3ccc(Br)cc3)n2)cc1 303015690 KPSBPWASFDCVAH-OAQYLSRUSA-N 465.307 5.287 5 20 JKBD Cn1cnnc1-c1cccc(NC(=O)C/C(=C\c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)c1 483221436 FSUZVRCXEXSXOS-CPNJWEJPSA-N 496.552 5.569 5 20 JKBD O=C(NCc1nccs1)c1c2c(nc3ccccc13)/C(=C/c1cccc([N+](=O)[O-])c1)CCC2 483639462 BTVXMNCOWVYGOC-GHRIWEEISA-N 456.527 5.406 5 20 JKBD CC(=O)Nc1cc(NC(=O)C/C(=C/c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)ccc1C 484263729 FVDOQGOMGCWWPL-UYRXBGFRSA-N 486.553 6.041 5 20 JKBD CCN(C(=O)c1ccc(N[C@H](C)c2ccccn2)c([N+](=O)[O-])c1)[C@H]1CCN([C@@H](C)c2ccccc2)C1 500001988 HKFQELRVHPSCBI-DPLHUUCSSA-N 487.604 5.461 5 20 JKBD O=C(CSc1ccc(C(F)(F)F)cc1[N+](=O)[O-])Nc1cc(F)ccc1OC[C@H]1CCCO1 502318019 OBGDOESKPAFSMH-CQSZACIVSA-N 474.432 5.041 5 20 JKBD CC(C)N(CC(=O)Nc1ccc(Cl)cc1C(F)(F)F)C(=O)c1c[nH]c2cc([N+](=O)[O-])ccc12 505356497 XCMFXMURTMYXLP-UHFFFAOYSA-N 482.846 5.238 5 20 JKBD C[C@H](Nc1ccc(C(=O)Nc2ccc3c(c2)OC2(CCCC2)O3)cc1[N+](=O)[O-])c1ccccn1 505991609 MQGCBUJPIKFDEF-INIZCTEOSA-N 460.490 5.457 5 20 JKBD CN1CCC(N2CCC(NCc3ccc(Oc4ccc(C(C)(C)C)cc4)c([N+](=O)[O-])c3)CC2)CC1 507896986 RNANTRIRGNTFMD-UHFFFAOYSA-N 480.653 5.333 5 20 JKBD C[C@H]1CN(C(=O)c2ccc(CNCc3ccc(Oc4ccc(F)cc4)c([N+](=O)[O-])c3)cc2)C[C@@H](C)O1 507904665 QWIZBKPNRZXROC-KDURUIRLSA-N 493.535 5.065 5 20 JKBD COc1cc(C(=O)N(Cc2ccccc2F)CC(C)C)c([N+](=O)[O-])cc1OCc1cscn1 512420582 LTYIIAARAZVCAS-UHFFFAOYSA-N 473.526 5.076 5 20 JKBD O=[N+]([O-])c1ccc(CS(=O)(=O)NCc2ccc(Oc3ccc(Oc4ccccc4)cc3)nc2)cc1 515709317 QFJOSNDXHJNNKE-UHFFFAOYSA-N 491.525 5.194 5 20 JKBD CC(C)[C@@H](NC(=O)c1ccc(N[C@H](C)c2ccccn2)c([N+](=O)[O-])c1)c1nc2ccccc2[nH]1 516178555 JHPYDPUNGWQYMK-WAIKUNEKSA-N 458.522 5.166 5 20 JKBD COCCOc1cccc(NC(=O)C/C(=C/c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)c1 517458299 COWYFLWDSNPWHJ-CYVLTUHYSA-N 489.553 5.799 5 20 JKBD COc1cc(CNCC2(c3cccc(Cl)c3)CCOCC2)c([N+](=O)[O-])cc1OCC(F)(F)F 518759851 VEZGCAMXGWLKAN-UHFFFAOYSA-N 488.890 5.036 5 20 JKBD Cc1ccc(C[C@@H]2CCCN(C(=O)c3ccc(N[C@H](C)c4ccccn4)c([N+](=O)[O-])c3)C2)cc1 580668698 NFUBVKFRUPMHQD-IRLDBZIGSA-N 458.562 5.566 5 20 JKBD O=C(C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)Nc1ccc(C(=O)NC2CC2)cc1 589735509 WEDVOJNFOBVYOT-XDJHFCHBSA-N 498.564 5.666 5 20 JKBD O=C(Nc1ccc(N2CCNC2=O)cc1)c1cc([N+](=O)[O-])ccc1Sc1ccc(Cl)cc1 589737217 ZHRDKIRRERICKJ-UHFFFAOYSA-N 468.922 5.181 5 20 JKBD Cc1nn(-c2ccc(Cl)c(Cl)c2)c(C)c1CC(=O)Nc1cc([N+](=O)[O-])ccc1OC(F)F 603637982 VIISUFQYUGVNNM-UHFFFAOYSA-N 485.274 5.487 5 20 JKBD O=C(Nc1ccc(NC(=O)c2cccs2)cc1)c1csc(-c2ccc([N+](=O)[O-])cc2)n1 604533687 OPRHMHMBLUOWHE-UHFFFAOYSA-N 450.501 5.284 5 20 JKBD Cc1c(C(=O)Nc2ccccc2OCc2ncc(-c3cccc(Cl)c3)o2)cccc1[N+](=O)[O-] 608851036 QLQRFSGAJREQGE-UHFFFAOYSA-N 463.877 6.043 5 20 JKBD COc1ccc(Br)c(NC(=O)c2ccc(NCc3ccccc3)c([N+](=O)[O-])c2)c1 609035450 GVSSMPJUUWUIKQ-UHFFFAOYSA-N 456.296 5.230 5 20 JKBD O=[N+]([O-])c1ccc(/C(O)=C(/C(=S)NCCc2ccc(Cl)cc2Cl)[n+]2ccccc2)cc1 726572809 GHQMCKQKAGYMIE-UHFFFAOYSA-O 475.377 5.233 5 20 JKBD C[C@H](Oc1ccc(F)c(F)c1)C(=O)Oc1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2Cl)cc1 743607678 PDKNZIDUPVASOT-LBPRGKRZSA-N 476.819 5.152 5 20 JKBD O=[N+]([O-])c1cc(/C=C(/Cl)c2nc(O)c3c(-c4ccccc4Cl)csc3n2)ccc1O 747151534 RXGJNDCUOMXNGY-VGOFMYFVSA-N 460.298 6.068 5 20 JKBD O=C(COC(=O)c1csc(-c2cccc([N+](=O)[O-])c2)n1)Nc1c(Cl)cc(Cl)cc1Cl 747964193 SXEFQGLIILCILS-UHFFFAOYSA-N 486.720 5.474 5 20 JKBD COc1ccc(-c2nc(Cc3noc(-c4cc([N+](=O)[O-])ccc4N4CCC(C)CC4)n3)co2)cc1 904330300 IDZDFIYQKQMHTE-UHFFFAOYSA-N 475.505 5.136 5 20 JKBD C[C@H](OC(=O)c1ccc(Br)cc1Cl)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 919493219 PKKCVMSCPKZCDD-QMMMGPOBSA-N 495.635 5.214 5 20 JKBD COc1ccc([C@H](C)C(=O)NC2(c3ccc(NC(=O)Cc4cccc([N+](=O)[O-])c4)cc3)CCC2)cc1 1785791581 HANLIVCIMJHAFN-IBGZPJMESA-N 487.556 5.084 5 20 JKBD Cc1cc(O)c([N+](=O)[O-])cc1C(=O)NC1(c2ccc(NC(=O)c3ccc4cc[nH]c4c3)cc2)CCC1 1788913891 OHVVBSNTSYEYEI-UHFFFAOYSA-N 484.512 5.152 5 20 JKBD O=C(NC1(c2ccc(NC(=O)c3ccccc3C(F)(F)F)cc2)CCC1)c1ccc([N+](=O)[O-])o1 1790248669 LESCJKXVZNFXJY-UHFFFAOYSA-N 473.407 5.268 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)C34CCC(CC3)CC4)CCC2)cc1)c1ccc(O)c([N+](=O)[O-])c1 1790622885 JZGWWUJITKHHJH-UHFFFAOYSA-N 463.534 5.019 5 20 JKBD Cc1ccc(CC(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)[C@@H](c2ccc(Cl)cc2)C(C)C)C3)cc1[N+](=O)[O-] 1800139994 NJGFLVXGXMZXSX-ZGXDEKTJSA-N 498.023 5.177 5 20 JKBD O=C(Cc1cccs1)Nc1cc([C@@H]2CCCCN2C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)[nH]n1 1817579982 LKEIARLJLZJCPE-SFHVURJKSA-N 495.586 5.143 5 20 JKBD Cc1cccc2cc(C(=O)N3CCCC[C@@H]3c3cc(NC(=O)/C=C/c4ccccc4[N+](=O)[O-])n[nH]3)[nH]c12 1823505101 VJKHRNUTYOVMRU-MDRMPYQZSA-N 498.543 5.127 5 20 JKBD O=C(CSc1nnc(Cc2ccccc2)n1-c1ccccc1)Nc1cc(Cl)ccc1[N+](=O)[O-] 12105407 XJVKXHTXRDVLDQ-UHFFFAOYSA-N 479.949 5.151 5 20 JKBD Cc1oc(-c2ccccc2)nc1COC(=O)c1ccccc1C(=O)c1ccc(Cl)c([N+](=O)[O-])c1 12259712 QOCBDACXEIDZNP-UHFFFAOYSA-N 476.872 5.800 5 20 JKBD CCOc1ccc(NC(=O)c2ccc(NC(=O)c3ccc(Br)c([N+](=O)[O-])c3)cc2)cc1 15737121 NQJUOMNGVYVVEH-UHFFFAOYSA-N 484.306 5.261 5 20 JKBD COc1ccc(Oc2ccc([N+](=O)[O-])cc2C(=O)N2CCC(OCc3ccccc3)CC2)cc1 25867144 KVWLOLDBIXJUQV-UHFFFAOYSA-N 462.502 5.217 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)Nc2nc(Cc3ccccc3)c(-c3ccccc3)s2)cc1SC 112533239 HUDNUDGRKQAUSD-UHFFFAOYSA-N 491.594 6.292 5 20 JKBD CCN(CC(=O)Nc1c(Cl)cccc1Cl)C(=O)c1cc([N+](=O)[O-])ccc1N1CCC(C)CC1 248233001 CKEBMZUMSWUVQA-UHFFFAOYSA-N 493.391 5.239 5 20 JKBD CCC(C)(C)NC(=O)c1ccc(NC(=O)c2ccc(NCc3ccccc3)c([N+](=O)[O-])c2)cc1Cl 489682432 IDAWRGRXFMAZSE-UHFFFAOYSA-N 494.979 6.031 5 20 JKBD C[C@@H](c1ccc(C(F)(F)F)cc1)N(C)C(=O)c1ccc(N[C@H](C)c2ccccn2)c([N+](=O)[O-])c1 506188062 GOHHUSIZJIDBPC-CVEARBPZSA-N 472.467 6.015 5 20 JKBD O=C(Cc1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1)Nc1ccccc1OC(F)F 506758268 LAMHHRXAVVENLM-UHFFFAOYSA-N 464.428 5.230 5 20 JKBD O=C(NC1CCN(c2ccccc2)CC1)c1ccc(NCc2ccccc2Cl)c([N+](=O)[O-])c1 507651991 VRCCGTAFYSQLKD-UHFFFAOYSA-N 464.953 5.259 5 20 JKBD O=c1c2cc([N+](=O)[O-])ccc2nc2n1CC/C2=C/c1ccc(-c2ccc(C(F)(F)F)cc2)o1 513521171 RFFHBDPOAOKTQQ-KAMYIIQDSA-N 453.376 5.528 5 20 JKBD COc1ccc(C(=O)Nc2cc(NC(=O)c3cccc(C(F)(F)F)c3)ccc2C)cc1[N+](=O)[O-] 518887355 OMUZMJLYPXPMGE-UHFFFAOYSA-N 473.407 5.435 5 20 JKBD Cc1cccc(COc2ccc(NC(=O)[C@H]3CCCN3C(=O)c3ccc([N+](=O)[O-])c(C)c3)c(C)c2)c1 520637858 LJYXWVQVBGVEEN-AREMUKBSSA-N 487.556 5.342 5 20 JKBD O=C(c1csc(-c2cccc([N+](=O)[O-])c2)n1)N1CCC[C@@H](c2nc3ccccc3s2)C1 522639738 LVJDPNQMJDTESV-OAHLLOKOSA-N 450.545 5.348 5 20 JKBD Cc1nn(Cc2ccccc2Cl)c2sc(C(=O)N3CCc4cc([N+](=O)[O-])ccc43)cc12 612645871 XEBKRINVRGYZHB-UHFFFAOYSA-N 452.923 5.219 5 20 JKBD COc1ccccc1[C@H](NCc1ccc(Oc2ccccc2Cl)c([N+](=O)[O-])c1)c1nccn1C 725845349 YUHXRODRJINWLW-DEOSSOPVSA-N 478.936 5.662 5 20 JKBD C[C@@H](CC(=O)Oc1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2Cl)cc1)c1ccccc1F 726751632 CNKMAANTJAACOX-AWEZNQCLSA-N 456.857 5.739 5 20 JKBD CCOc1cc([N+](=O)[O-])c(C(=O)Nc2cc(C(F)(F)F)ccc2NC(=O)OC(C)(C)C)cc1OC 727790317 BMJMCQNEUFLNGN-UHFFFAOYSA-N 499.442 5.620 5 20 JKBD CSc1ccc([N+](=O)[O-])c(C(=O)Nc2ccc(N3C[C@H](C)O[C@H](C)C3)c(C(F)(F)F)c2)c1 728013498 MYSSKIMSKVDCQE-BETUJISGSA-N 469.485 5.201 5 20 JKBD COC(=O)c1occc1COC(=O)C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1 791524391 WIQQVFWWMLJMTK-ATVHPVEESA-N 478.482 5.258 5 20 JKBD COc1ccccc1-c1nc(COC(=O)c2cc([N+](=O)[O-])ccc2N2CCCCC2)cs1 823299741 DHZVTVIMFLNTLY-UHFFFAOYSA-N 453.520 5.074 5 20 JKBD COc1ccc(NC(=O)c2nnc(/C(Cl)=C\c3ccc(-c4ccc([N+](=O)[O-])cc4)o3)s2)cc1 912963175 CWFBRGLYYLZGDI-LDADJPATSA-N 482.905 5.704 5 20 JKBD Cc1ccc(NC(=O)[C@H](OC(=O)c2cc3ccccc3c(Cl)n2)c2ccccc2)c([N+](=O)[O-])c1 915446108 RTOFRWGGEBYPPS-JOCHJYFZSA-N 475.888 5.642 5 20 JKBD O=[N+]([O-])c1ccc(-c2noc(CSc3nn(-c4ccc(Cl)cc4)c(=S)s3)n2)cc1 915669779 RXXQTGFTNSXJBB-UHFFFAOYSA-N 463.953 5.567 5 20 JKBD CC(C)c1cccc(C(C)C)c1NC(=S)/C(=C(/O)c1cccc([N+](=O)[O-])c1)[n+]1cccc(O)c1 917611283 YSANOCPCINBYTI-UHFFFAOYSA-O 478.594 6.158 5 20 JKBD Cc1nc(C)c(C(=O)NC2(c3ccc(NC(=O)CSc4ccccc4[N+](=O)[O-])cc3)CCC2)s1 1791521471 LGSBHWRRLNXPEL-UHFFFAOYSA-N 496.614 5.208 5 20 JKBD COc1cc(C(=O)Nc2ccc(C3(NC(=O)C[C@H]4C[C@@H]5CC[C@H]4C5)CCC3)cc2)ccc1[N+](=O)[O-] 1792165815 NEPZOMVZVBBVEI-WSTZPKSXSA-N 477.561 5.177 5 20 JKBD C/C(=C\c1cccs1)C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2ccc([N+](=O)[O-])cc2F)CC1 1830493168 ULXBPDBTLYLDND-GGJDQLKOSA-N 485.581 5.132 5 20 JKBD CCC(C)(C)C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cccc([N+](=O)[O-])c2Br)CC1 1830516477 DJVLNDFIDFSQKX-SFHVURJKSA-N 494.430 5.027 5 20 JKBD Cc1cc2cccc(C(=O)N3CCC([C@H]4CCCCN4C(=O)c4cc(F)cc([N+](=O)[O-])c4)CC3)c2[nH]1 1830616603 DLQSRALSXANMHO-XMMPIXPASA-N 492.551 5.071 5 20 JKBD O=C(CCC1CCC1)N1CCC([C@@H]2CCCCN2C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)CC1 1831060538 YXSRNIOFKPLGMK-QFIPXVFZSA-N 483.634 5.623 5 20 JKBD Cc1nc(-c2ccccc2)ccc1C(=O)O[C@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 16166543 TUXZVWVHPBTMGW-CQSZACIVSA-N 473.407 5.168 5 20 JKBD Cc1cc(C)c(NC(=O)[C@@H](C)OC(=O)c2ccc(NCc3ccccc3)c([N+](=O)[O-])c2)c(C)c1 23934832 QNUAPEHUQHODOB-LJQANCHMSA-N 461.518 5.316 5 20 JKBD CC(C)CCSc1ccc(C(=O)O[C@H](C)C(=O)Nc2c(F)cccc2F)cc1[N+](=O)[O-] 24083516 CBJBDUKFYLQIBA-CYBMUJFWSA-N 452.479 5.195 5 20 JKBD CC(C)CCSc1ccc(C(=O)Nc2ccc(NC(=O)NC[C@H]3CCCO3)cc2)cc1[N+](=O)[O-] 27853330 VJRICNRQQNSXSZ-HXUWFJFHSA-N 486.594 5.286 5 20 JKBD Cc1sc2nc(S[C@@H](C)C(=O)Nc3cc([N+](=O)[O-])ccc3Cl)n(C(C)C)c(=O)c2c1C 36818469 FIIOESIDLKGQDA-LBPRGKRZSA-N 480.999 5.337 5 20 JKBD C[C@H](Nc1ccc(C(=O)Nc2ccc(Nc3ccccc3)nc2)cc1[N+](=O)[O-])c1ccccn1 60336485 BTNGGNCSURHQAL-KRWDZBQOSA-N 454.490 5.554 5 20 JKBD CCN(Cc1ccc(OCc2cccs2)c(OC)c1)C(=O)c1cc([N+](=O)[O-])ccc1N1CCCC1 104833303 IGFAGIQVIANBSG-UHFFFAOYSA-N 495.601 5.506 5 20 JKBD C[C@H](NC(=O)c1ccccc1NC(=O)c1ccccc1Br)c1cccc([N+](=O)[O-])c1 109137139 VKZGQZJHGZBWMB-AWEZNQCLSA-N 468.307 5.101 5 20 JKBD CSc1ccc([N+](=O)[O-])c(C(=O)N[C@H](C)c2ccc(NC(=O)Nc3ccccc3)cc2)c1 480803823 HFULYJWKYVJKBO-OAHLLOKOSA-N 450.520 5.452 5 20 JKBD O=C(Nc1ccc(Oc2ncc(Cl)cc2Cl)cc1)c1cc2c(cc1[N+](=O)[O-])OCCO2 500373422 BDLCFUCAXBKJLF-UHFFFAOYSA-N 462.245 5.112 5 20 JKBD CCOc1cc(Br)c(NC(=O)N[C@H](C)c2cccc([N+](=O)[O-])c2)cc1OCC 510642982 FALYBYVPOUZMNQ-GFCCVEGCSA-N 452.305 5.037 5 20 JKBD O=C(Cn1c2ccccc2c(=O)c2ccccc21)N(Cc1ccccn1)c1ccc(Br)cc1 511074246 JHMRMMLPAMOZLH-UHFFFAOYSA-N 498.380 5.546 5 20 JKBD CC[C@@H](C)N(Cc1ccccc1)C(=O)c1cc(OC)c(OCc2cscn2)cc1[N+](=O)[O-] 512591250 VZPXPFFSDVWDKL-MRXNPFEDSA-N 455.536 5.080 5 20 JKBD O=[N+]([O-])c1ccc(-c2noc(CSc3nnc(-c4cccs4)n3Cc3ccccc3)n2)cc1 515244558 ZGQFYVUQMFSNMF-UHFFFAOYSA-N 476.543 5.305 5 20 JKBD Cc1nn(Cc2ccc(C(=O)N(C3CC3)[C@H](C)c3ccc(Cl)cc3)cc2)c(C)c1[N+](=O)[O-] 515589576 DXFIHYMOSKBPSC-MRXNPFEDSA-N 452.942 5.476 5 20 JKBD COc1ccc(NC(=O)Nc2ccc([N+](=O)[O-])cc2Cl)cc1NC(=O)c1ccc(Cl)cc1F 516273086 QGICOZIMFFNEPD-UHFFFAOYSA-N 493.278 5.946 5 20 JKBD Cc1noc(-c2ccc(C)c(NC(=O)c3ccc(N[C@@H](C)c4ccccn4)c([N+](=O)[O-])c3)c2)n1 516623372 JOMRUFRRBSKXJQ-HNNXBMFYSA-N 458.478 5.082 5 20 JKBD Cc1csc(Sc2ccc(C(=O)Nc3ccc(Oc4ncccn4)cc3C)cc2[N+](=O)[O-])n1 518933772 JSDLLQLGFYMULH-UHFFFAOYSA-N 479.543 5.654 5 20 JKBD COc1ccc(CC[C@H]2CCCCN2C(=O)[C@@H](C)Sc2ccc([N+](=O)[O-])cc2)cc1OC 522368762 DEMUVMXBSWXGCR-IEBWSBKVSA-N 458.580 5.107 5 20 JKBD COc1ccc(NC(=O)CSc2nnc(-c3ccco3)n2[C@H](C)[C@H]2C[C@H]3CC[C@H]2C3)c([N+](=O)[O-])c1 594534403 FWSWZYSPDJUTHN-MUQADHOPSA-N 497.577 5.183 5 20 JKBD Cc1ccc(-c2csc(NC(=O)c3cnn(-c4ccc(F)cc4F)c3C)n2)cc1[N+](=O)[O-] 603616874 UNEOWKHIKQGPKZ-UHFFFAOYSA-N 455.446 5.051 5 20 JKBD O=C(Nc1ccc(NC(=O)c2cc3cc([N+](=O)[O-])ccc3s2)c(C(F)(F)F)c1)c1ccccc1 603742852 HBCPHCHTILQLHS-UHFFFAOYSA-N 485.443 6.333 5 20 JKBD Cc1csc(Sc2ccc(C(=O)N(C)C[C@H]3CCCO[C@@H]3c3ccccc3)cc2[N+](=O)[O-])n1 604519100 JUTAXGDPNILWQR-DENIHFKCSA-N 483.615 5.751 5 20 JKBD Cc1ccccc1OCCCC(=O)Nc1ccc(CNC(=O)c2c[nH]c3ccc([N+](=O)[O-])cc23)cc1 604546002 ANTRFBYHTMLXRU-UHFFFAOYSA-N 486.528 5.112 5 20 JKBD Cc1ccc(C(=O)Nc2nc3ccc(NC(=O)Cc4ccc([N+](=O)[O-])cc4)cc3s2)s1 608818023 SKNWVYAHISGLCP-UHFFFAOYSA-N 452.517 5.008 5 20 JKBD Cn1ccnc1[C@@H](NCc1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1)c1ccccc1F 608835764 OBYLJEHILJBYIG-SANMLTNESA-N 482.519 5.199 5 20 JKBD O=[N+]([O-])c1ccc(-c2nn(-c3ccccc3)cc2CN[C@H](c2ccccc2)c2ccccn2)cc1 608841060 JKBYLQLTMHCHHS-MUUNZHRXSA-N 461.525 5.722 5 20 JKBD CC(=O)N(c1ccc(C(F)(F)F)cc1)c1nc(Cn2cnc(-c3ccc([N+](=O)[O-])cc3)n2)cs1 608869893 WUYCMTKJIBHMEU-UHFFFAOYSA-N 488.451 5.062 5 20 JKBD Cc1ccc(NC(=O)c2ccc(N3CCC(c4nc5ccccc5[nH]4)CC3)c([N+](=O)[O-])c2)cc1 608972366 CHPGUEYFCPTKGH-UHFFFAOYSA-N 455.518 5.416 5 20 JKBD CC(C)Oc1ccc(NC(=O)c2ccc(C(=O)Nc3ccc(OC(C)C)cc3)c([N+](=O)[O-])c2)cc1 609044496 JYIRNKCFMOHTQN-UHFFFAOYSA-N 477.517 5.674 5 20 JKBD Cc1cc(C)cc(Oc2ccc(NC(=O)CNC(=O)c3c(Cl)cccc3[N+](=O)[O-])cc2)c1 609392063 OOGDXXZWPJZQEP-UHFFFAOYSA-N 453.882 5.026 5 20 JKBD Cn1c(SCc2nc(-c3cccc(C(F)(F)F)c3)no2)nc2cc3ccccc3cc2c1=O 648454387 QLRUXHQQVFRGJP-UHFFFAOYSA-N 468.460 5.448 5 20 JKBD C[C@@H](OC(=O)c1csc(-c2ccccc2Cl)n1)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 727562800 GLQPPPAMDDXKCA-LLVKDONJSA-N 456.867 5.340 5 20 JKBD CCN(Cc1ccccc1)C(=O)c1cc(NC(=O)c2cc(F)c(F)cc2[N+](=O)[O-])ccc1Cl 727708657 YTICXXSFPHAOLX-UHFFFAOYSA-N 473.863 5.441 5 20 JKBD O=C(CC1CCCC1)NC1CCC(C(=O)N(CC2CC2)c2ccc(Cl)c([N+](=O)[O-])c2)CC1 728165710 PVTIXWUWMKYAOE-UHFFFAOYSA-N 461.990 5.247 5 20 JKBD C[C@@H](OC(=O)c1csc(-c2cccc([N+](=O)[O-])c2)n1)C(=O)NC(c1ccccc1)c1ccccc1 747961864 LDCRLAJWUGIDHB-QGZVFWFLSA-N 487.537 5.169 5 20 JKBD CC(C)Cn1ncc2cc(C(=O)Nc3cc(Cl)c([N+](=O)[O-])cc3OCc3ccccc3)cnc21 748166655 CTAQJYLRJRPCBY-UHFFFAOYSA-N 479.924 5.480 5 20 JKBD O=C(Nc1ccc(CN2C(=O)CSC2=O)cc1)c1cc([N+](=O)[O-])ccc1Sc1ccccc1 751129932 JQTKEFFZFZOJMD-UHFFFAOYSA-N 479.539 5.194 5 20 JKBD O=C(/C=C/c1ccc([N+](=O)[O-])cc1)OCC(=O)N1c2ccccc2Sc2ccc(Cl)cc21 798129515 PWODDJJANUSCPN-KPKJPENVSA-N 466.902 5.634 5 20 JKBD CCc1cccc[n+]1/C(C(=S)Nc1ccc2ccccc2c1)=C(/O)c1ccc(C)c([N+](=O)[O-])c1 917609843 GOEXFTAVBBTLGR-UHFFFAOYSA-O 470.574 6.230 5 20 JKBD O=[N+]([O-])c1ccc(NC(=S)N(Cc2ccc(-c3ccccc3C(F)(F)F)o2)C2CC2)cc1 920076461 LDGOQBXQVODVMJ-UHFFFAOYSA-N 461.465 6.235 5 20 JKBD O=C(Nc1ccc2oc(O)nc2c1)c1cc([N+](=O)[O-])ccc1N1CCC(Cc2ccccc2)CC1 920447894 XUIKKWVWSQNMSU-UHFFFAOYSA-N 472.501 5.153 5 20 JKBD CN(C)c1ccc(C(=O)NC2(c3ccc(NC(=O)c4ccc([N+](=O)[O-])o4)cc3)CCC2)c2ccccc12 1785748654 ALFBJFYTAYJJPG-UHFFFAOYSA-N 498.539 5.469 5 20 JKBD COc1cc(C)c(C)cc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cc3cc([N+](=O)[O-])ccc3s1)C2 1800798999 WLWZBDPMMOYTJJ-REPLKXPHSA-N 493.585 5.001 5 20 JKBD Cc1c(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)c3cc(F)cc([N+](=O)[O-])c3)[nH]n2)oc2ccccc12 1818569903 QCKHBIFOEOWLMJ-FQEVSTJZSA-N 491.479 5.131 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)Nc1cc([C@H]2CCCCN2C(=O)C[C@@H](C)c2ccccc2)[nH]n1 1821285404 CWCAKDMHWJHCBJ-OPAMFIHVSA-N 493.539 5.265 5 20 JKBD Cc1c(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)CCC(C)C)n[nH]2)cc(Cl)cc1[N+](=O)[O-] 1821932763 MPXCPQMXZXXMKH-GOSISDBHSA-N 461.950 5.022 5 20 JKBD CC[C@@H](C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cc([N+](=O)[O-])c(O)cc2C)CC1)c1ccccc1 1826314273 AJZLVIFZDGNWEY-ISKFKSNPSA-N 493.604 5.036 5 20 JKBD Cc1ccc2[nH]c(C(=O)N3CCC([C@@H]4CCCCN4C(=O)c4cc(F)cc([N+](=O)[O-])c4)CC3)cc2c1 1830617422 OLVXZYHQIJZXBV-VWLOTQADSA-N 492.551 5.071 5 20 JKBD O=C(/C=C/c1ccc([N+](=O)[O-])o1)N1CCC([C@@H]2CCCCN2C(=O)c2ccc(C3CC3)cc2)CC1 1830745890 SVPHLVQTPDJJQE-YKATVRGKSA-N 477.561 5.012 5 20 JKBD O=C(c1cccc(F)c1[N+](=O)[O-])N1CCC([C@H]2CCCCN2C(=O)C2(c3ccccc3)CCC2)CC1 1831781885 KALRSWFVLZBZSG-XMMPIXPASA-N 493.579 5.089 5 20 JKBD C[C@H](C(=O)N1CCCC[C@@H]1C1CCN(C(=O)/C=C/c2ccccc2[N+](=O)[O-])CC1)c1cccs1 1832147774 OELSTTNIWVOEBM-KSAVBPPNSA-N 481.618 5.093 5 20 JKBD CC(C)=CC(=O)Nc1scc(-c2ccccc2)c1C(=O)OCC(=O)Nc1cc([N+](=O)[O-])ccc1F 9747443 QUBPGWJXUXWYDD-UHFFFAOYSA-N 497.504 5.163 5 20 JKBD O=C(CCc1c(-c2ccc(F)cc2)[nH]c2ccccc12)OCc1nnc(-c2ccc([N+](=O)[O-])cc2)o1 10693423 BDRNPFUDJHPACI-UHFFFAOYSA-N 486.459 5.608 5 20 JKBD C[C@@H](Sc1nnc(Cc2ccccc2)n1-c1ccccc1)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl 12105392 PNFIZBFFIORJHD-MRXNPFEDSA-N 493.976 5.539 5 20 JKBD COc1ccccc1/C=C(/C(=O)O[C@@H](C)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)c1ccccc1 17540978 DLWHZJKQUSARCD-JMMZKRSASA-N 471.469 5.498 5 20 JKBD C[C@@H](OC(=O)c1ccc(-c2ccc(F)cc2)o1)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 21499799 HHUOAHBVINKFSF-LLVKDONJSA-N 466.343 5.197 5 20 JKBD Cc1c(NC(=O)[C@@H](C)Sc2nc3ccc(Cl)cc3c(=O)n2CC(C)C)cccc1[N+](=O)[O-] 22054345 FZLZWYCQGIYQNO-CQSZACIVSA-N 474.970 5.042 5 20 JKBD Cc1cc(Br)ccc1NC(=O)c1ccc(N[C@@H](C)c2ccccn2)c([N+](=O)[O-])c1 108756621 YQGULRXROXWZSY-AWEZNQCLSA-N 455.312 5.486 5 20 JKBD COc1ccc(NC(=O)C2CCN(c3ccc(C(F)(F)F)cc3[N+](=O)[O-])CC2)c2cccnc12 115766409 GOKAJVJLSWELNM-UHFFFAOYSA-N 474.439 5.026 5 20 JKBD COc1ccc(F)cc1[C@H](C)NC(=O)Cc1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1 117311029 GOZNOJAKBJTKHC-KRWDZBQOSA-N 474.492 5.015 5 20 JKBD Cc1sc(NC(=O)CCc2nc(-c3ccc(Cl)cc3)no2)nc1-c1cccc([N+](=O)[O-])c1 195704018 PBMAGKMFUXQWRB-UHFFFAOYSA-N 469.910 5.301 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)Nc2cc(C)nn2-c2cccc(C(F)(F)F)c2)cc1SC 482026032 PHPNENCEISRGCF-UHFFFAOYSA-N 466.441 5.091 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)Nc2ccc(Oc3cccc(F)c3)c3ccncc23)cc1SC 484353049 RUUGLAMNZXMQLZ-UHFFFAOYSA-N 479.489 6.057 5 20 JKBD CN(C)c1ccc(C(=O)c2ccccc2C(=O)Nc2cccc(-c3nccs3)c2)cc1[N+](=O)[O-] 489706712 MNKFTHHGHBOYKA-UHFFFAOYSA-N 472.526 5.268 5 20 JKBD COc1ccc(Oc2ccc([N+](=O)[O-])cc2C(=O)Nc2cccc(NC(=O)c3ccoc3)c2)cc1 499613451 CXJRBYWRBUGNNJ-UHFFFAOYSA-N 473.441 5.493 5 20 JKBD C[C@@H]1Cc2cc([N+](=O)[O-])ccc2N1C(=O)Cc1csc(-c2cc(Br)cs2)n1 504401565 PLXAICOQLKKQCN-SNVBAGLBSA-N 464.366 5.063 5 20 JKBD C[C@@H](Nc1ccc(C(=O)N2CCC(Cc3ccc(F)cc3)CC2)cc1[N+](=O)[O-])c1ccccn1 504928508 CTEBQHHNALPULZ-GOSISDBHSA-N 462.525 5.397 5 20 JKBD O=C1CCc2cc([N+](=O)[O-])c(NCc3ccccc3-c3ccc(Cn4ccnc4)cc3)cc2N1 505603905 BFYXUDPONGRBPB-UHFFFAOYSA-N 453.502 5.003 5 20 JKBD O=C(Nc1ccc(CNCc2ccc(Oc3ccc(F)cc3)c([N+](=O)[O-])c2)cc1)c1cccnc1 507898342 XVOXWYLEQBXLKX-UHFFFAOYSA-N 472.476 5.463 5 20 JKBD Cc1nc(-c2ccc(F)cc2)sc1[C@H](C)Nc1ccc([N+](=O)[O-])cc1S(=O)(=O)N1CCCC1 511415267 OOYMNRXMFBGCEZ-AWEZNQCLSA-N 490.582 5.123 5 20 JKBD COc1ccccc1NC(=O)c1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2Oc2ccccc2)cc1 514428585 XUYAAEOZQNISRE-UHFFFAOYSA-N 483.480 5.900 5 20 JKBD COc1cc(C(=O)Nc2c(F)cc(F)cc2-c2ccccc2)c([N+](=O)[O-])cc1OCc1cscn1 516340042 FXULLNVXOALRFX-UHFFFAOYSA-N 497.479 5.836 5 20 JKBD C[C@@H](NC(=O)c1ccc(N[C@H](C)c2ccccn2)c([N+](=O)[O-])c1)c1ccc(OCc2cccnc2)cc1 516594386 ITWPMHIDOZDVJL-WOJBJXKFSA-N 497.555 5.628 5 20 JKBD CCOc1ccc(C(F)(F)F)cc1NC(=O)c1cc(OC)c(OCc2cscn2)cc1[N+](=O)[O-] 516782711 AHZGIOVLUOEMEV-UHFFFAOYSA-N 497.451 5.309 5 20 JKBD O=[N+]([O-])c1ccc(-c2nn(-c3ccccc3)cc2CNCc2ccc(OCC(F)(F)F)nc2)cc1 518264841 JMIVKXRBIUFBSQ-UHFFFAOYSA-N 483.450 5.073 5 20 JKBD CCn1c(CCNC(=O)c2ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])cc2)nc2ccccc21 524447751 FCZGROHTENGZET-UHFFFAOYSA-N 464.909 5.383 5 20 JKBD O=C(CCc1ncc(-c2ccccc2F)o1)Nc1ccc([N+](=O)[O-])cc1C(=O)c1ccccc1 590646516 GTHDBYQLXSWTOF-UHFFFAOYSA-N 459.433 5.191 5 20 JKBD Cc1nn(Cc2ccc(C(=O)Nc3ccc(NC(=O)Nc4ccccc4)cc3)cc2)c(C)c1[N+](=O)[O-] 591275510 SANJQZDTZVGDSR-UHFFFAOYSA-N 484.516 5.353 5 20 JKBD CCN(Cc1cnn(C)c1)C(=O)c1c2c(nc3ccccc13)/C(=C\c1ccc([N+](=O)[O-])cc1)CCC2 604481893 FIOFVBPZKJCNOP-QNGOZBTKSA-N 481.556 5.416 5 20 JKBD COc1ccc(Oc2ccc([N+](=O)[O-])cc2C(=O)OCc2nnc(-c3cccc(C)c3)o2)cc1 727776510 WUZJFHUQKAYRFI-UHFFFAOYSA-N 461.430 5.111 5 20 JKBD Cc1nc(-c2ccc(F)cc2)sc1[C@@H](C)NC(=O)c1cc([N+](=O)[O-])ccc1N1CCCC1 729419508 MNNOFIQECKTMLZ-CQSZACIVSA-N 454.527 5.257 5 20 JKBD Cc1nnc([C@@H](C)OC(=O)C/C(=C/c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)o1 744497883 RVEAKSCNQUJMKG-YYTPVVGHSA-N 450.476 5.131 5 20 JKBD CC(=O)N(c1nc(COC(=O)c2c[nH]c3ccc([N+](=O)[O-])cc23)cs1)c1c(C)cc(C)cc1Cl 749314490 FAPFWCCXQQNQNP-UHFFFAOYSA-N 498.948 5.844 5 20 JKBD O=[N+]([O-])c1cc(C(F)(F)F)c(Cl)cc1Sc1nnc(-c2cccnc2)n1Cc1ccco1 799790097 HSJQJZWNOMHWCT-UHFFFAOYSA-N 481.843 5.713 5 20 JKBD O=C(Cc1cnn(-c2ccccc2)c1)Nc1cc(Cl)c([N+](=O)[O-])cc1OCc1ccccc1 818895836 XUGOBWAFWYWVHO-UHFFFAOYSA-N 462.893 5.194 5 20 JKBD Cc1c(Br)cc([N+](=O)[O-])cc1-c1nc(C2(NC(=O)OC(C)(C)C)CCCC2)no1 904418026 DVMRVKAOYBROHC-UHFFFAOYSA-N 467.320 5.010 5 20 JKBD C[C@@H](Oc1ccc(Cl)cc1[N+](=O)[O-])c1nc(-c2cccc(OCc3cccnc3)c2)no1 904502120 XYLCQTPNVFSREF-CQSZACIVSA-N 452.854 5.412 5 20 JKBD CC(C)(C)OC(=O)NC1(c2noc(-c3ccn(-c4c(Cl)cc([N+](=O)[O-])cc4Cl)n3)n2)CCC1 904557486 MYYSTLYWYCYLRX-UHFFFAOYSA-N 495.323 5.041 5 20 JKBD Cc1ccc(-n2c(-c3ccccn3)nn(CN(C)Cc3ccccc3[N+](=O)[O-])c2=S)c(C)c1 917429408 TVRPLNWKUVSFHB-UHFFFAOYSA-N 460.563 5.080 5 20 JKBD CC(C)c1cccc(C(C)C)c1NC(=O)COC(=O)c1cn(C)nc1-c1ccc([N+](=O)[O-])cc1 920552160 QNSDSZAGJIEVCS-UHFFFAOYSA-N 464.522 5.038 5 20 JKBD COc1ccc([C@H](Cc2ccc(F)cc2)N[C@@H](C)C(=O)Nc2cc([N+](=O)[O-])ccc2Cl)cc1 921065401 ACYKWAYAKYVXPQ-NYHFZMIOSA-N 471.916 5.297 5 20 JKBD Cn1c(SCC(=O)N(Cc2ccco2)C2=CCCCC2)nc2cc3ccccc3cc2c1=O 921180640 UFKWASIZDUYBCG-UHFFFAOYSA-N 459.571 5.259 5 20 JKBD COc1ccc(-c2csc(NC(=O)c3cc([N+](=O)[O-])ccc3N3CCCCC3)n2)cc1F 921198868 VTZZLBKSXNEZQB-UHFFFAOYSA-N 456.499 5.109 5 20 JKBD O=C(C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)OCc1nccn1C(F)F 926629487 OAIAOBKCFMQBOX-PTNGSMBKSA-N 470.457 5.470 5 20 JKBD COc1ccsc1C(=O)NC1(c2ccc(NC(=O)Cc3ccc(Cl)cc3[N+](=O)[O-])cc2)CCC1 1786115917 MJOORUNFQSFFKK-UHFFFAOYSA-N 499.976 5.309 5 20 JKBD CO[C@@H](C(=O)Nc1ccc(C2(NC(=O)CCc3cccc([N+](=O)[O-])c3)CCC2)cc1)c1ccccc1 1787712567 CNIPXWJDXAIVGA-AREMUKBSSA-N 487.556 5.049 5 20 JKBD O=C(CCc1cccc([N+](=O)[O-])c1)NC1(c2ccc(NC(=O)c3cc(Cl)ccn3)cc2)CCC1 1789718980 WKVRLYTWPKUMMQ-UHFFFAOYSA-N 478.936 5.024 5 20 JKBD O=C(NC1(c2ccc(NC(=O)c3cccc(C(F)(F)F)c3F)cc2)CCC1)c1ccc([N+](=O)[O-])[nH]1 1790649877 MDFWSHLOXFENKP-UHFFFAOYSA-N 490.413 5.142 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)[C@@H]3C[C@H]3c3ccccc3)CCC2)cc1)c1nc2cc([N+](=O)[O-])ccc2[nH]1 1790827795 SGLLGVNSKZVTFM-FCHUYYIVSA-N 495.539 5.023 5 20 JKBD COc1cc(C(=O)Nc2ccc(C3(NC(=O)c4ccnc5ccccc45)CCC3)cc2)ccc1[N+](=O)[O-] 1792164741 TVMHOGZCQXDHLX-UHFFFAOYSA-N 496.523 5.213 5 20 JKBD Cc1cccc(C)c1C(=O)Nc1cc([C@H]2CCCCN2C(=O)CSc2ccccc2[N+](=O)[O-])[nH]n1 1821193480 ZCAUHQBLJZKZDA-LJQANCHMSA-N 493.589 5.033 5 20 JKBD Cc1ccc(CCC(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3cc(F)cc([N+](=O)[O-])c3)CC2)cc1F 1824458257 WGFUYJNFWPJVDH-RUZDIDTESA-N 499.558 5.048 5 20 JKBD CC(C)Cn1c(SCC(=O)Nc2ccc(Cl)cc2[N+](=O)[O-])nnc1-c1ccccc1F 8651383 DHOCGQIYFPFLMC-UHFFFAOYSA-N 463.922 5.033 5 20 JKBD CCOC(=O)Nc1ccc(C(=O)O[C@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2ccccc2)cc1 10702082 IZJYPIIVDDGTKF-NRFANRHFSA-N 497.891 5.353 5 20 JKBD O=C(Nc1ccc(Br)cc1Br)c1ccc(Br)c([N+](=O)[O-])c1 15303460 WPHMWBLUQBCERR-UHFFFAOYSA-N 478.922 5.135 5 20 JKBD CCOc1ccc([C@H](CNC(=O)c2ccc(Cl)cc2[N+](=O)[O-])c2c[nH]c3ccccc23)cc1OC 16176394 FNGQBVHMIKWCMK-FQEVSTJZSA-N 493.947 5.699 5 20 JKBD COc1ccc(C[C@H](NC(=O)c2cc(SC)ccc2[N+](=O)[O-])c2ccc(OC)cc2)cc1 18232035 JOWHOAWPCIXJPS-QFIPXVFZSA-N 452.532 5.048 5 20 JKBD C[C@@H](SC1=N/C(=C\c2ccccc2)C(=O)N1c1ccc(F)cc1)C(=O)Nc1cccc([N+](=O)[O-])c1 23646952 SHQJXMBCHAMQNB-LRSOKBAUSA-N 490.516 5.238 5 20 JKBD COc1ccc([N+](=O)[O-])cc1NC(=O)CCSc1nnc(-c2ccccc2)n1-c1ccc(F)cc1 26361553 OXXXONRZFXSZNV-UHFFFAOYSA-N 493.520 5.111 5 20 JKBD Cc1csc(Sc2ccc(C(=O)Nc3cccc(OC[C@H]4CCCO4)c3)cc2[N+](=O)[O-])n1 31263858 ZEEWGQUMEJBNCI-GOSISDBHSA-N 471.560 5.321 5 20 JKBD CCNc1nc(S[C@@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2C(F)(F)F)nc2ccccc12 31766450 HRHNNQFETRJKIF-NSHDSACASA-N 465.457 5.108 5 20 JKBD COc1cccc([C@@H](CNc2ccc([N+](=O)[O-])c3cnccc23)c2c[nH]c3ccccc23)c1OC 104733159 IGLGOFZSLHGJGA-OAQYLSRUSA-N 468.513 5.886 5 20 JKBD Cc1cc(C)c(-c2csc(NC(=O)c3cc(OCC(F)(F)F)ccc3[N+](=O)[O-])n2)cc1C 107761638 RCYMBFNEEFPNQO-UHFFFAOYSA-N 465.453 5.837 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)Nc2cc(C(F)(F)F)ccc2N2CCCCC2)cc1SC 112530103 INJQFLTWBGTTPA-UHFFFAOYSA-N 469.485 5.587 5 20 JKBD Cc1cc(CNC(=O)c2ccc(N[C@H](C)c3ccccn3)c([N+](=O)[O-])c2)c2[nH]c(C)c(C)c2c1 116322084 SEBKCIWJNTWERQ-GOSISDBHSA-N 457.534 5.499 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)Nc2cc(C(C)(C)C)nn2-c2ccc(C)cc2)cc1SC 483063982 XVAQOQHXZBYBJH-UHFFFAOYSA-N 454.552 5.369 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)N[C@@H](Cc2ccc(Cl)cc2)c2ccccc2)cc1SC 483322672 NGDFYNRJFWVFOQ-IBGZPJMESA-N 456.951 5.693 5 20 JKBD CC(=O)N1CCc2cc(NC(=O)c3ccc(NCc4ccccc4Cl)c([N+](=O)[O-])c3)ccc21 492336893 UEXJKESGUXOOMO-UHFFFAOYSA-N 464.909 5.022 5 20 JKBD CCCCc1oc2ccccc2c1CN(C)C(=O)c1ccc(Sc2nncn2C)c([N+](=O)[O-])c1 499224024 UJIWDORGUKGFJU-UHFFFAOYSA-N 479.562 5.236 5 20 JKBD Cc1c(NC(=O)c2cc([N+](=O)[O-])ccc2Sc2ccc(Cl)cc2)cccc1C(=O)N1CCCC1 499566829 ZGZDTGRFROSHGA-UHFFFAOYSA-N 495.988 6.196 5 20 JKBD Cc1csc(Sc2ccc(C(=O)Nc3ccccc3CN3C[C@H](C)O[C@@H](C)C3)cc2[N+](=O)[O-])n1 501480447 OIRVUOLIVMCPST-IRXDYDNUSA-N 498.630 5.372 5 20 JKBD Cc1ccc2nc([C@@H]3CCCN(C(=O)CCNc4ccc(C(F)(F)F)cc4[N+](=O)[O-])C3)[nH]c2c1 502964673 IUVDGOULDXTURQ-OAHLLOKOSA-N 475.471 5.007 5 20 JKBD COCCSc1ccc([C@H](C)NCc2ccc(-c3ccc([N+](=O)[O-])cc3Br)o2)cc1 504033113 TWPOPZZPTJUTMK-HNNXBMFYSA-N 491.407 6.207 5 20 JKBD O=C(c1cc(NCc2ccccc2-c2ccc(Cn3ccnc3)cc2)ccc1[N+](=O)[O-])N1CCCC1 505614340 WDCOZMWUNXAUSY-UHFFFAOYSA-N 481.556 5.355 5 20 JKBD CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)N[C@H](C)c1cccc(NC(=O)c2ccccc2)c1 509294028 MRQQBEWCHCBYPU-LJQANCHMSA-N 460.534 5.528 5 20 JKBD COc1cc(C(=O)NC(c2ccc(F)cc2)c2ccc(F)cc2)c([N+](=O)[O-])cc1OC(F)F 511599507 ZMZVQPUPKYBMMK-UHFFFAOYSA-N 464.371 5.002 5 20 JKBD CCCN(Cc1c(F)cccc1Cl)C(=O)c1cc(OC)c(OCc2cscn2)cc1[N+](=O)[O-] 512403768 OADLADMTAFFTNQ-UHFFFAOYSA-N 493.944 5.484 5 20 JKBD COc1ccc([C@H](NC(=O)c2cc(OCC(F)(F)F)ccc2[N+](=O)[O-])c2ccc(C)cc2)cc1 512939537 FIWJMICOTBEBQN-JOCHJYFZSA-N 474.435 5.372 5 20 JKBD O=C(CSc1ccc([N+](=O)[O-])cc1)C(c1nc2ccccc2s1)c1nc2ccccc2s1 513691728 GROZZNNNGABVNO-UHFFFAOYSA-N 477.592 6.308 5 20 JKBD C[C@H]1CCCN(c2ccc(C(=O)N(C[C@@H]3CCCO3)c3nc4ccccc4s3)cc2[N+](=O)[O-])C1 602756136 FPEDUDUXSABVJL-HKUYNNGSSA-N 480.590 5.267 5 20 JKBD CS(=O)(=O)c1ccc(NC(=O)c2ccc(Sc3nc4ccccc4s3)c([N+](=O)[O-])c2)cc1 603459969 LHSAMRQSTDEQCT-UHFFFAOYSA-N 485.568 5.012 5 20 JKBD O=C(C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)NCCOc1ccccc1F 603468607 QRACXJGKSWAWNP-OBGWFSINSA-N 477.517 5.470 5 20 JKBD COc1ccc(CN(C)C)cc1NC(=O)c1ccc(NCc2ccccc2Cl)c([N+](=O)[O-])c1 603589822 FYWJGOWONIXLCT-UHFFFAOYSA-N 468.941 5.183 5 20 JKBD Cc1cc(NC(=O)c2cc(OCC(F)(F)F)ccc2[N+](=O)[O-])n(-c2cccc(C(F)(F)F)c2)n1 603735037 ZXSOSHVBXWSTPO-UHFFFAOYSA-N 488.344 5.301 5 20 JKBD Cc1ccc(-n2nc(C)c(CC(=O)Nc3cc([N+](=O)[O-])ccc3OC(F)F)c2C)cc1Cl 603743017 YWFSKQWCLIQTGE-UHFFFAOYSA-N 464.856 5.142 5 20 JKBD CNC(=O)c1ccc(OC)c(NC(=O)c2cc([N+](=O)[O-])ccc2Sc2ccc(Cl)cc2)c1 603775631 IWZPORCRPQATJL-UHFFFAOYSA-N 471.922 5.020 5 20 JKBD O=C(C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)N1CCC[C@@H]1CN1CCCC1 608813889 FMKVLUREOLRFKT-JXAXNMIRSA-N 476.602 5.222 5 20 JKBD Cc1ccc(C(=O)Nc2nc3ccc(NC(=O)c4ccc([N+](=O)[O-])cc4Cl)cc3s2)s1 608817957 OCMBQDCOFSJPNP-UHFFFAOYSA-N 472.935 5.732 5 20 JKBD COc1cc(C(=O)Nc2c(C(N)=O)oc3ccccc23)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 728303112 CPTMJWAMMKVGJF-UHFFFAOYSA-N 481.848 5.147 5 20 JKBD C[C@H](OC(=O)c1csc(-c2cccc([N+](=O)[O-])c2)n1)C(=O)N[C@H](C)c1ccc(Cl)cc1Cl 747962886 VXOTZWYXLYBHPP-NEPJUHHUSA-N 494.356 5.448 5 20 JKBD O=C(OCC[C@H]1CCCCN1C(=O)c1ccnc(Oc2ccccc2)c1)c1cccc([N+](=O)[O-])c1 749171946 JLGAKZBSJKRGCA-OAQYLSRUSA-N 475.501 5.024 5 20 JKBD CCOc1ccc([C@H](NC(=O)c2cc([N+](=O)[O-])ccc2Br)c2ccccc2)cc1 751082586 BOKIPXNNDQLDJW-OAQYLSRUSA-N 455.308 5.275 5 20 JKBD O=C(N[C@H](c1ccc(Cl)cc1)c1cccs1)c1cc([N+](=O)[O-])ccc1Br 751090123 XEZOXGVNQJYKMF-QGZVFWFLSA-N 451.729 5.592 5 20 JKBD CC(=O)N(c1ccc(Cl)c(Cl)c1)c1nc(COC(=O)/C=C\c2ccc([N+](=O)[O-])cc2)cs1 798127903 WCRVWAQUKSMRJR-WTKPLQERSA-N 492.340 5.799 5 20 JKBD O=C1CC[C@H](c2noc(-c3ccc(NCc4ccccc4)c([N+](=O)[O-])c3)n2)CN1CC1CCCC1 856582756 VGEZFATWIICOPP-NRFANRHFSA-N 475.549 5.153 5 20 JKBD O=C(Nc1ccc(Cl)c([N+](=O)[O-])c1)c1cnn(-c2cccc(C(F)(F)F)c2)c1C(F)(F)F 888532252 AYFXQLUZFLPXLO-UHFFFAOYSA-N 478.736 5.724 5 20 JKBD Cc1csc(Sc2ccc(NC(=O)c3cc([N+](=O)[O-])ccc3I)cc2)n1 918159588 JXNGUWLMZHEMFA-UHFFFAOYSA-N 497.339 5.368 5 20 JKBD Cc1cc(C(=O)NC2(c3ccc(NC(=O)CCC4CCCC4)cc3)CCC2)ncc1[N+](=O)[O-] 1787617991 XLBMEOPNXIUXIH-UHFFFAOYSA-N 450.539 5.016 5 20 JKBD O=C(CSC1CCCC1)NC1(c2ccc(NC(=O)c3ccc([N+](=O)[O-])cc3F)cc2)CCC1 1790621182 NCEJAESBWMPMKP-UHFFFAOYSA-N 471.554 5.157 5 20 JKBD C[C@H](Sc1ccccn1)C(=O)NC1(c2ccc(NC(=O)c3cccc(F)c3[N+](=O)[O-])cc2)CCC1 1790702775 YGPKWAATKSELHP-INIZCTEOSA-N 494.548 5.057 5 20 JKBD O=C(Cc1cccc([N+](=O)[O-])c1)NC1(c2ccc(NC(=O)c3cccc4nscc34)cc2)CCC1 1790940962 FDNAKHYYIYJNTH-UHFFFAOYSA-N 486.553 5.195 5 20 JKBD O=C(Cc1cc(F)ccc1[N+](=O)[O-])Nc1ccc(C2(NC(=O)c3cccc4ncccc34)CCC2)cc1 1792308829 PRWWHXBCDHYVIY-UHFFFAOYSA-N 498.514 5.273 5 20 JKBD CC(C)c1ccc(CC(=O)N2CCC3(CCCN(C(=O)CCc4cccc([N+](=O)[O-])c4)C3)CC2)cc1 1806494086 CMWBRJTWIREGJC-UHFFFAOYSA-N 491.632 5.125 5 20 JKBD Cc1ccc(CC(=O)N2CCC3(CCCN(C(=O)c4cc(C(C)(C)C)oc4C)C3)CC2)cc1[N+](=O)[O-] 1808383637 UISIFLXVBUFDAZ-UHFFFAOYSA-N 495.620 5.190 5 20 JKBD CC[C@@H](C(=O)N1CCCC2(CCN(C(=O)/C=C/c3ccccc3[N+](=O)[O-])CC2)C1)c1ccccc1 1809012245 DANIDUNWCPLXOU-XIQMRYHBSA-N 475.589 5.033 5 20 JKBD CC(C)(C)CCCCCC(=O)NC[C@@H]1CCN(C(=O)c2ccc(O)c([N+](=O)[O-])c2)[C@@H]1c1cccnc1 1812809414 QINYRTZIPZVWAP-SQJMNOBHSA-N 496.608 5.012 5 20 JKBD C[C@@H](C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cc(F)cc([N+](=O)[O-])c2)[nH]n1)c1ccc(Cl)cc1 1814662094 YXISGRZJOKMPBV-SZNDQCEHSA-N 499.930 5.220 5 20 JKBD Cc1ccc(CC(=O)Nc2cc([C@@H]3CCCCN3C(=O)c3ccc(C4CC4)cc3)[nH]n2)cc1[N+](=O)[O-] 1820918462 BAARRFOXLZHEMM-QHCPKHFHSA-N 487.560 5.052 5 20 JKBD CSc1ccc(C(=O)OCc2csc(N(C(C)=O)c3cccc(Cl)c3)n2)cc1[N+](=O)[O-] 9620847 OGZMVOGKILZGAP-UHFFFAOYSA-N 477.951 5.468 5 20 JKBD COc1cc([C@@H]2Nc3ccccc3C(=O)N2Cc2ccco2)ccc1OCc1ccc([N+](=O)[O-])cc1 15248854 YNCWXYYDMIFIQH-AREMUKBSSA-N 485.496 5.542 5 20 JKBD CS(=O)(=O)c1cccc(NC(=O)c2ccc(Sc3nc4ccccc4s3)c([N+](=O)[O-])c2)c1 16783072 JDAUSXSPIAHJKC-UHFFFAOYSA-N 485.568 5.012 5 20 JKBD Cc1ccc(NC(=O)[C@@H](OC(=O)/C=C/c2ccc3ccccc3n2)c2ccccc2)c([N+](=O)[O-])c1 20974679 VOFNZMIERVJRSK-FPBAGDOUSA-N 467.481 5.388 5 20 JKBD CC(C)n1c(S[C@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)nc2cc(Cl)ccc2c1=O 21463480 YKGLJQZFBBLCHL-LLVKDONJSA-N 481.361 5.312 5 20 JKBD O=C(OCc1nnc(-c2ccc([N+](=O)[O-])cc2)o1)c1cc(-c2ccco2)n(-c2ccc(Cl)cc2)n1 25777398 GLCDAYZYEVUPTN-UHFFFAOYSA-N 491.847 5.101 5 20 JKBD O=C(NCCc1nccn1Cc1ccccc1)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1 27474309 XAWQRYRGGNWOFR-UHFFFAOYSA-N 476.920 5.258 5 20 JKBD Cc1ccc(NC(=O)C2CC2)cc1NC(=O)c1ccc(N[C@@H](C)c2ccccn2)c([N+](=O)[O-])c1 108830468 WUJKUIAXICMIGP-INIZCTEOSA-N 459.506 5.072 5 20 JKBD O=C(c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1)N1CC=C(c2ccc(O)cc2)CC1 216850444 SFCVVFGEPFBGSM-UHFFFAOYSA-N 450.878 5.676 5 20 JKBD CC(=O)N(c1nc(CSc2nc3ccccc3c3nc4ccccc4n23)cs1)c1ccccc1F 255927022 BXMDMSLMOODZBJ-UHFFFAOYSA-N 499.596 6.608 5 20 JKBD O=C(c1ccn(-c2cccc([N+](=O)[O-])c2)n1)N(Cc1ccc(Cl)c(Cl)c1)Cc1ccccn1 303019069 LFFZONGZFZDDHQ-UHFFFAOYSA-N 482.327 5.325 5 20 JKBD CCN(Cc1ccc(C(=O)N(C)C)cc1)C(=O)c1ccc(SCCC(C)C)c([N+](=O)[O-])c1 476507182 BSDXDDTZHCOOQF-UHFFFAOYSA-N 457.596 5.097 5 20 JKBD Cc1sc(NC(=O)CSc2nnc(-c3cccs3)n2C2CC2)nc1-c1cccc([N+](=O)[O-])c1 483385823 YSFZMPUUHJAWSA-UHFFFAOYSA-N 498.615 5.412 5 20 JKBD Cc1cccc(NC(=O)N2CCN(C(=O)c3ccc(SCCC(C)C)c([N+](=O)[O-])c3)CC2)c1 486247352 WRPBEOPPFNPOJR-UHFFFAOYSA-N 470.595 5.031 5 20 JKBD C[C@@H](c1c(F)cccc1F)N(C)C(=O)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 498497886 SOVNHFVRKXJYQM-ZDUSSCGKSA-N 471.426 5.328 5 20 JKBD O=C(c1ccc(NCc2ccccc2)c([N+](=O)[O-])c1)N1CCO[C@@H](c2cccc(Br)c2)C1 500237747 RBZXTENDXQAXKU-HSZRJFAPSA-N 496.361 5.183 5 20 JKBD CC(C)(CNC(=O)Cn1c2ccccc2c(=O)c2ccccc21)c1cccc(Br)c1 507090037 XFHNGCCNUQOLQU-UHFFFAOYSA-N 463.375 5.011 5 20 JKBD CSCC[C@@H](NC(=O)c1cccc([N+](=O)[O-])c1)C(=O)Nc1ccc(OC2CCCC2)c(Cl)c1 508265841 UBTYVMUKQXKKAK-HXUWFJFHSA-N 491.997 5.060 5 20 JKBD Cc1noc(C2CCN(C(=O)c3ccc(Sc4nc5ccccc5s4)c([N+](=O)[O-])c3)CC2)n1 509139125 OHKJJWPJRWOKHJ-UHFFFAOYSA-N 481.559 5.067 5 20 JKBD COc1cc(C(=O)N[C@H](c2ccc(F)cc2)C2CCCC2)c([N+](=O)[O-])cc1OCc1cscn1 512198478 SVBMJIUFNQRLJQ-QHCPKHFHSA-N 485.537 5.439 5 20 JKBD COc1cc(C(=O)N(C)[C@H](C)c2ccc(C(F)(F)F)cc2)c([N+](=O)[O-])cc1OCc1cscn1 512402596 DBUXAHVUVFJLHN-CYBMUJFWSA-N 495.479 5.491 5 20 JKBD COc1cc(C(=O)N(C2CC2)[C@H](C)c2ccccc2Cl)c([N+](=O)[O-])cc1OCc1cscn1 512415840 PFNDXLFDMFTYDE-CQSZACIVSA-N 487.965 5.658 5 20 JKBD COc1cc(C(=O)N2CCC(OCc3ccccc3)CC2)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 515033484 IGPIUYOMZZQEPU-UHFFFAOYSA-N 496.947 5.871 5 20 JKBD CCOc1ccc(NC(=O)CNc2ccccc2Oc2ncc(Cl)cc2Cl)c([N+](=O)[O-])c1 515662781 JBJMDYAZJPNURA-UHFFFAOYSA-N 477.304 5.538 5 20 JKBD COc1ccccc1-c1cc(NC(=O)C2CCN(c3ccccc3[N+](=O)[O-])CC2)n(-c2ccccc2)n1 517404414 SILNDQPOLMIIFX-UHFFFAOYSA-N 497.555 5.311 5 20 JKBD COc1cc(/C=C(/c2ccncc2)c2ccc([N+](=O)[O-])cc2)cc(I)c1OC 520116002 CEPVCZJQYQWYAV-WOJGMQOQSA-N 488.281 5.201 5 20 JKBD COc1ccc(COc2cccc(F)c2)cc1NC(=O)c1ccc(NC2CC2)c([N+](=O)[O-])c1 521530355 KSFNWKLHJGUAHY-UHFFFAOYSA-N 451.454 5.148 5 20 JKBD COc1ccc(-c2csc(NC(=O)c3csc(-c4ccc([N+](=O)[O-])cc4)n3)n2)cc1F 522091616 AFHBJGPYJNTCCF-UHFFFAOYSA-N 456.480 5.242 5 20 JKBD COC1CCN(C2(CNCc3ccc(Oc4ccc(F)cc4)c([N+](=O)[O-])c3)CCCC2)CC1 561098228 UUARPVBLYDFYJR-UHFFFAOYSA-N 457.546 5.039 5 20 JKBD CCS(=O)(=O)c1ccccc1NC(=O)c1ccc(Sc2ccc(C)cc2)c([N+](=O)[O-])c1 603572111 MBQDHLMYJWOSBB-UHFFFAOYSA-N 456.545 5.100 5 20 JKBD COc1ccc([N+](=O)[O-])cc1NC(=O)[C@H](Oc1cccc(Br)c1)c1ccccc1 603750642 VRESULXZLYKWHD-HXUWFJFHSA-N 457.280 5.125 5 20 JKBD CN(C(=O)c1ccc(NC(=O)c2ccn(-c3cccc([N+](=O)[O-])c3)n2)cc1Cl)C1CCCCC1 603982370 IMCOAIGAARXNHY-UHFFFAOYSA-N 481.940 5.091 5 20 JKBD CCCOc1ncccc1CNC(=O)C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1 604441302 PHHXYOGBPISTCL-HMMYKYKNSA-N 488.569 5.635 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)O[C@@H](C)C(=O)N[C@@H](C)c2ccc(Cl)cc2Cl)cc1SC 728651022 OYWQRFVNSLRPIR-QWRGUYRKSA-N 487.361 5.055 5 20 JKBD C[C@@H](OC(=O)CSc1cc(Cl)ccc1Cl)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 789876551 GEHINVVRAOJFJH-SECBINFHSA-N 497.278 5.583 5 20 JKBD Cc1csc(Sc2ccc(C(=O)Nc3ccc(N4CCCC4=O)c(Cl)c3)cc2[N+](=O)[O-])n1 825172451 UCTOQQUEWNCOKG-UHFFFAOYSA-N 488.978 5.543 5 20 JKBD O=[N+]([O-])c1cc(S(=O)(=O)N(Cc2nc3ccccc3s2)c2ccccc2)ccc1Cl 849348630 UHZZZANBIWIOBH-UHFFFAOYSA-N 459.936 5.253 5 20 JKBD O=C(c1ccc(NCc2c(Br)cccc2[N+](=O)[O-])cc1Cl)N1CCCCC1 864042144 YBPQRGXIERQDPI-UHFFFAOYSA-N 452.736 5.249 5 20 JKBD C/C(=C/c1nc(-c2ccc(N3CCN(c4ccc(F)cc4)CC3)nc2)no1)c1ccc([N+](=O)[O-])cc1 904642842 TUIVFESTZWCMOY-VLGSPTGOSA-N 486.507 5.066 5 20 JKBD C[C@@H](Nc1ccc(-c2nc(-c3ccccc3Br)no2)cc1[N+](=O)[O-])c1ccccn1 904967047 VRGLVGFOXKDMKT-CYBMUJFWSA-N 466.295 5.642 5 20 JKBD CC(C)(C)Cc1noc2nc(C3CC3)cc(C(=O)OCc3nnc(-c4ccc([N+](=O)[O-])cc4)o3)c12 915582498 SYZCWMJUWPJQDT-UHFFFAOYSA-N 477.477 5.004 5 20 JKBD Cc1ccc([N+](=O)[O-])cc1NC(=O)C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1 916665429 FBXNMBDKCLKAKT-ATVHPVEESA-N 474.498 5.991 5 20 JKBD O=C(Nc1cccc(COCC(F)(F)C(F)F)c1)c1cc([N+](=O)[O-])ccc1N1CCCCC1 917387429 YLDFSSHXIYRMMI-UHFFFAOYSA-N 469.435 5.254 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Cl)[C@@H](Nc1ccc(OC[C@H]2CCCO2)cc1)c1ccccc1 917937295 DAMAFYNIHLTSNU-QPPBQGQZSA-N 481.936 5.598 5 20 JKBD C[C@@H]1CCCN(c2ccc(C(=O)Nc3cc(NC(=O)OC(C)(C)C)ccc3F)cc2[N+](=O)[O-])C1 918600032 JXZSSTINXPXFNY-OAHLLOKOSA-N 472.517 5.570 5 20 JKBD COc1cc(-c2cc(C(=O)OCc3csc([N+](=O)[O-])c3)c3ccccc3n2)cc(OC)c1OC 918870096 SDFPWNNINDBCBT-UHFFFAOYSA-N 480.498 5.254 5 20 JKBD C[C@@H](OC(=O)c1ccc(Oc2ccccc2)nc1)C(=O)Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1 919386688 VKQKXWQTQUSPEI-OAHLLOKOSA-N 490.497 5.090 5 20 JKBD O=C(COC(=O)C1(c2ccc(F)cc2)CCCCC1)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 920685716 CWEKWAAIKRGFLM-UHFFFAOYSA-N 468.403 5.137 5 20 JKBD CC(C)Cc1ccc(C(=O)N2CCCC[C@H]2c2cc(NC(=O)/C=C/c3ccc([N+](=O)[O-])o3)n[nH]2)cc1 1814969140 ABHKRWSMYIFRQO-YUAYGMJFSA-N 491.548 5.129 5 20 JKBD CCCCC[C@@H](C)C(=O)Nc1cc([C@H]2CCCCN2C(=O)CSc2ccccc2[N+](=O)[O-])[nH]n1 1822004992 HKSWIKOXTOXQGM-IEBWSBKVSA-N 487.626 5.319 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)N1CCC([C@H]2CCCCN2C(=O)c2ccc3occc3c2)CC1 1828259141 YUJIZGDRTOMTDV-HSZRJFAPSA-N 493.535 5.336 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cccc3ccoc23)CC1 1830729782 XNQQGXZZZAYXDQ-HSZRJFAPSA-N 493.535 5.336 5 20 JKBD Cc1cc(O)c([N+](=O)[O-])cc1C(=O)N1CCCC[C@@H]1C1CCN(C(=O)CC2CCC(C)(C)CC2)CC1 1830788689 BYEYHXXWSNBPDG-HSZRJFAPSA-N 499.652 5.449 5 20 JKBD O=C(CCc1ccco1)N1CCC([C@H]2CCCCN2C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)CC1 1831059441 FYCVRNJCYZIHFR-JOCHJYFZSA-N 495.601 5.269 5 20 JKBD Cc1cc(CCCC(=O)N2CC3(CCCN3C(=O)c3cc(C(C)(C)C)oc3C)C2)c([N+](=O)[O-])cc1F 1842451965 DSEMOTJTCHTANZ-UHFFFAOYSA-N 499.583 5.081 5 20 JKBD COc1ccc(-n2c(SCC(=O)Nc3cc([N+](=O)[O-])ccc3Cl)nnc2-c2ccccc2)cc1 11197177 KBBQQCYDLLILIP-UHFFFAOYSA-N 495.948 5.235 5 20 JKBD C[C@@H](OC(=O)CCc1ncc(-c2ccc(Cl)cc2Cl)o1)C(=O)Nc1ccccc1[N+](=O)[O-] 12272324 VFZOVHPPHJCYKS-GFCCVEGCSA-N 478.288 5.060 5 20 JKBD C[C@@H](Sc1nnc(Cc2cccs2)n1CCc1ccccc1)C(=O)Nc1ccc([N+](=O)[O-])cc1 12744174 IPXMHZWBMRGOMB-QGZVFWFLSA-N 493.614 5.201 5 20 JKBD CC(=O)c1c(C)[nH]c(C(=O)[C@H](C)OC(=O)c2ccccc2C(=O)c2ccc(Cl)c([N+](=O)[O-])c2)c1C 14754868 HBOWRPREEHFZPJ-HNNXBMFYSA-N 496.903 5.055 5 20 JKBD O=C(c1cccc([N+](=O)[O-])c1)N(C[C@@H]1CCCO1)c1nc(-c2ccc(Br)cc2)cs1 14819582 RBZOXBUVCLWBFV-SFHVURJKSA-N 488.363 5.307 5 20 JKBD C[C@@H](Oc1ccc2c(-c3ccc([N+](=O)[O-])cc3)cc(=O)oc2c1)C(=O)Nc1ccc(F)cc1F 15370851 APWPKGUAWZERMR-CYBMUJFWSA-N 466.396 5.052 5 20 JKBD CCCN(CC(=O)Nc1ccc(Cl)cc1Cl)C(=O)c1cc2cc([N+](=O)[O-])ccc2s1 18004482 IPZRIFIXOCFNEK-UHFFFAOYSA-N 466.346 5.607 5 20 JKBD C[C@H](Sc1ccc(Cl)cc1)C(=O)O[C@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 21457613 PJOBHQAZLMVHJD-MNOVXSKESA-N 476.860 5.318 5 20 JKBD CC(C)CC(=O)Nc1ccc(C(=O)CSc2nc3cc4ccccc4cc3c(=O)n2C)cc1 22253543 KCOQFFCMHIWHOR-UHFFFAOYSA-N 459.571 5.046 5 20 JKBD COc1ccccc1-n1c(S[C@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2C)nnc1-c1cccs1 23341457 VUOKGVLAUMCCOI-OAHLLOKOSA-N 495.586 5.340 5 20 JKBD Cc1nnc(S[C@@H](C(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)c2ccccc2)n1Cc1ccccc1 28609138 LZVPXFDAGOFMPA-JOCHJYFZSA-N 493.976 5.669 5 20 JKBD CCn1c(S[C@@H](C(=O)Nc2ccc(C)cc2[N+](=O)[O-])c2ccccc2)nnc1-c1cccs1 36184237 PKWSMXUJYSBXCL-HXUWFJFHSA-N 479.587 5.715 5 20 JKBD Cc1cccc(-c2nc(C(C)C)no2)c1NC(=O)c1ccc(N2CCC(C)CC2)c([N+](=O)[O-])c1 110639702 RKDMMFZITANQOR-UHFFFAOYSA-N 463.538 5.565 5 20 JKBD Cc1noc([C@H]2CCCN(C(=O)c3cc([N+](=O)[O-])ccc3Sc3ccc(Cl)cc3)C2)n1 410079213 WPJYBYOVPNHYTG-AWEZNQCLSA-N 458.927 5.111 5 20 JKBD CC(C)N1CCC(N(C)C(=O)c2c3c(nc4ccccc24)/C(=C/c2cccc([N+](=O)[O-])c2)CCC3)CC1 476181253 OLTVESQONOJFEN-RELWKKBWSA-N 498.627 5.965 5 20 JKBD COCc1ccccc1NC(=O)C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1 481880447 UQFSHLZGGDJNSO-XMHGGMMESA-N 459.527 5.920 5 20 JKBD O=C(CCCOc1ccccc1Br)N(Cc1ccccc1[N+](=O)[O-])CC(F)(F)F 486080555 ZVEUWARXZGQECX-UHFFFAOYSA-N 475.261 5.107 5 20 JKBD COc1ccccc1C1(CN[C@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2ccccc2)CC1 504434541 NPTPQYRBXZLTNV-QHCPKHFHSA-N 465.937 5.258 5 20 JKBD COc1cccc(NCc2nnc(SCc3c(F)cccc3[N+](=O)[O-])n2C2CCCCC2)c1 504512431 GRPBWKPOQRHXJQ-UHFFFAOYSA-N 471.558 5.744 5 20 JKBD CC[C@@H](NCc1cc(OC)c(OCc2ccccc2)cc1[N+](=O)[O-])c1ccc2c(c1)OCCO2 509582490 HKRZOFWXZWTFLD-OAQYLSRUSA-N 464.518 5.195 5 20 JKBD O=C(Nc1cc([N+](=O)[O-])ccc1Nc1cccc(C(F)(F)F)c1)c1cccc(CN2CCCC2=O)c1 512169726 PTKPHSVWJKGVHM-UHFFFAOYSA-N 498.461 5.732 5 20 JKBD COc1ccc(OCCNC(=O)C/C(=C/c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)cc1 512389432 LSPJOORTKOYTSF-MNDPQUGUSA-N 489.553 5.339 5 20 JKBD COc1ccc(CSCC(=O)Nc2ccc(Sc3nc(C)cs3)cc2)cc1[N+](=O)[O-] 515904384 DBHYDIKCBDGNOP-UHFFFAOYSA-N 461.590 5.391 5 20 JKBD CC(C)N(Cc1nc(O)c2ccccc2n1)C(=O)c1ccc(Nc2ccccc2)c([N+](=O)[O-])c1 517489374 NHOHUNKSRHEQJN-UHFFFAOYSA-N 457.490 5.038 5 20 JKBD CC[C@@H](NCc1ccc(-c2ccccc2[N+](=O)[O-])s1)c1ccccc1OCC(=O)N1CCCC1 518263505 PUOYMOUQAKQGEC-JOCHJYFZSA-N 479.602 5.565 5 20 JKBD Cn1ccnc1[C@@H](NCc1ccc(Oc2ccc(F)cc2)c([N+](=O)[O-])c1)c1cccc(F)c1 520209906 PFHQVIJSZWTWME-QHCPKHFHSA-N 450.445 5.278 5 20 JKBD O=C(N[C@H]1CCCc2nc(O)ccc21)c1ccc(Sc2nc3ccccc3s2)c([N+](=O)[O-])c1 603011115 SVHPLTDPXLAALI-INIZCTEOSA-N 478.555 5.264 5 20 JKBD CCCCc1ccc([C@@H](NC(=O)C(=O)Nc2cc([N+](=O)[O-])ccc2C)c2cccs2)cc1 603706271 VKLWNWBBVYPCAV-JOCHJYFZSA-N 451.548 5.152 5 20 JKBD C[C@H]1C[C@H](C)CN(c2nnc(Sc3ccc([N+](=O)[O-])c4cnccc34)n2Cc2ccco2)C1 603846949 MANPUGUBSJMKBS-HOTGVXAUSA-N 464.551 5.009 5 20 JKBD CC1CCN(Cc2ccc(NC(=O)c3cc(OCC(F)(F)F)ccc3[N+](=O)[O-])cc2)CC1 603910668 XENAHJKEKPDMCG-UHFFFAOYSA-N 451.445 5.020 5 20 JKBD Cc1ccc(Sc2ccc(C(=O)N(C)c3ccc(Br)cn3)cc2[N+](=O)[O-])cc1 603962888 IHGBIKBHWKHUBF-UHFFFAOYSA-N 458.337 5.489 5 20 JKBD CC(C)N(C(=O)CSc1ccc(C(F)(F)F)cc1[N+](=O)[O-])c1ccc(Br)cn1 603998648 PZQYRIOAQPDGQI-UHFFFAOYSA-N 478.290 5.305 5 20 JKBD COc1cccc(CN(CC(C)C)C(=O)c2ccc(N[C@@H](C)c3ccccn3)c([N+](=O)[O-])c2)c1 604490824 GEMPBCUEDLQRPL-IBGZPJMESA-N 462.550 5.470 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1F)c1ccc2c(c1)C(=O)N(c1cc(Cl)ccc1Cl)C2=O 608870876 MCBBRJRFJAHCSO-UHFFFAOYSA-N 474.231 5.094 5 20 JKBD Cc1csc(CCCCNC(=O)C/C(=C\c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)n1 608908790 DXCVVUURNUCARW-XMHGGMMESA-N 492.626 6.039 5 20 JKBD C[C@H](OC(=O)CCc1ccc(Cl)c(Cl)c1)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 725981633 XOZPXDAEFNIAOD-JTQLQIEISA-N 479.238 5.423 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)O[C@H](C)C(=O)N2c3ccccc3Sc3ccccc32)cc1SC 728650458 HAUJDZFFPTUARQ-CQSZACIVSA-N 496.566 5.700 5 20 JKBD C[C@H](OC(=O)c1occc1CN1c2ccccc2C[C@@H]1C)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 728688308 OKABTLUGNBNWDW-HOTGVXAUSA-N 474.473 5.107 5 20 JKBD C[C@@H](OC(=O)c1csc(-c2ccc(Cl)c(Cl)c2)n1)C(=O)Nc1cccc([N+](=O)[O-])c1 744604862 LONIUMZDOHLTDM-SNVBAGLBSA-N 466.302 5.209 5 20 JKBD Nc1ccc(Cl)c(C(=O)O[C@@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2ccccc2)c1 745515093 KWWTVQSEOPTSIX-LJQANCHMSA-N 460.273 5.021 5 20 JKBD C[C@H](NC(=O)[C@@H](C)OC(=O)c1csc(-c2cccc([N+](=O)[O-])c2)n1)c1cccc2ccccc12 747962831 UYPXMBJXCAFYHJ-JKSUJKDBSA-N 475.526 5.294 5 20 JKBD Cc1c(C(=O)Nc2nc(-c3sccc3Br)cs2)cc([N+](=O)[O-])c(C)c1[N+](=O)[O-] 748621639 VVNSAVVGBKBXHQ-UHFFFAOYSA-N 483.325 5.320 5 20 JKBD Cc1c(C(=O)O[C@@H](C)C(=O)N2c3ccccc3Sc3ccccc32)cc([N+](=O)[O-])c(C)c1[N+](=O)[O-] 748952465 VOWZUVKSQSMTPV-HNNXBMFYSA-N 493.497 5.495 5 20 JKBD O=[N+]([O-])c1cc(-c2nc(-c3ccc(Cn4cnc5ccccc54)cc3)no2)ccc1OC(F)F 904472253 INQOJJQCWKWPID-UHFFFAOYSA-N 463.400 5.311 5 20 JKBD COc1ccc(Oc2ccc([N+](=O)[O-])cc2C(=O)OCC(=O)Nc2c(C)cc(C)cc2C)cc1 915442691 PIMCGJLUEUCWIF-UHFFFAOYSA-N 464.474 5.116 5 20 JKBD O=C(OCc1nc2ccccc2c2ccccc12)[C@@H]1CCCN1C(=O)c1ccccc1OC(F)F 915531811 DNZCYZNMQCFCPW-QHCPKHFHSA-N 476.479 5.337 5 20 JKBD O=C(Nc1nc(Cc2ccc(Br)cc2)cs1)c1cc(Cl)ccc1[N+](=O)[O-] 917714490 RYVQZIOYPHVDID-UHFFFAOYSA-N 452.717 5.310 5 20 JKBD COc1ccc2[nH]cc(C3=CCN(C(=O)c4cc([N+](=O)[O-])ccc4N4CCCCC4)CC3)c2c1 918114709 NSDBWGGGHVVMLF-UHFFFAOYSA-N 460.534 5.005 5 20 JKBD Cc1sc2nc(CS[C@H](C)C(=O)Oc3ccc(-c4ccccc4)cc3[N+](=O)[O-])nc(O)c2c1C 920331401 YTJSAFADMUNTTR-OAHLLOKOSA-N 495.582 5.816 5 20 JKBD O=C(CCc1c[nH]c2ccccc12)NC1(c2ccc(NC(=O)c3ccc([N+](=O)[O-])o3)cc2)CCC1 1785748617 VCMGKNDRYHKITC-UHFFFAOYSA-N 472.501 5.050 5 20 JKBD COc1cc(C(=O)NC2(c3ccc(NC(=O)c4cc(C)cs4)cc3)CCC2)ccc1[N+](=O)[O-] 1786488682 RMBCHRYXWOEHHR-UHFFFAOYSA-N 465.531 5.035 5 20 JKBD O=C(Cc1cc([N+](=O)[O-])ccc1F)Nc1ccc(C2(NC(=O)c3ccnc4ccccc34)CCC2)cc1 1786671230 VQVQVCSDMOGCQN-UHFFFAOYSA-N 498.514 5.273 5 20 JKBD O=C(CCc1cccc([N+](=O)[O-])c1)NC1(c2ccc(NC(=O)c3nccc4occc34)cc2)CCC1 1788339104 PFBPDIKDGYCISB-UHFFFAOYSA-N 484.512 5.117 5 20 JKBD O=C(NC1(c2ccc(NC(=O)c3cccc4ncccc34)cc2)CCC1)c1ccc([N+](=O)[O-])cc1F 1788906552 VFNAXCPWLGQLKT-UHFFFAOYSA-N 484.487 5.344 5 20 JKBD CC(C)=CCCC(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cc(Cl)cc([N+](=O)[O-])c2C)[nH]n1 1820804612 RALJPHFGVLJYQW-IBGZPJMESA-N 473.961 5.332 5 20 JKBD Cc1ccc(CC(=O)Nc2cc([C@H]3CCCCN3C(=O)C[C@H](C)c3ccccc3)[nH]n2)cc1[N+](=O)[O-] 1820918573 IFFRLZBFKVFXRF-WMZHIEFXSA-N 489.576 5.055 5 20 JKBD Cc1c(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)c3cc(F)cc([N+](=O)[O-])c3)n[nH]2)oc2ccccc12 1821165540 DLNMEBHIUYRRKX-HXUWFJFHSA-N 491.479 5.131 5 20 JKBD O=C(c1cc2cc([N+](=O)[O-])ccc2s1)N1CCC([C@@H]2CCCCN2C(=O)[C@@H]2CC=CCC2)CC1 1824104276 OJORTQFNLVNFDI-KNQAVFIVSA-N 481.618 5.399 5 20 JKBD CC[C@@H](C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2ccc([N+](=O)[O-])c(OC)c2)CC1)c1ccccc1 1826316639 CQWLCABVZLZVDB-DNQXCXABSA-N 493.604 5.031 5 20 JKBD Cc1c(C(=O)N2CCC([C@H]3CCCCN3C(=O)c3ccc(F)cc3)CC2)cc(Cl)cc1[N+](=O)[O-] 1830021678 OMSDYABRTWAWDC-JOCHJYFZSA-N 487.959 5.243 5 20 JKBD CSc1ccc2cc(COC(=O)Cn3c4ccccc4c(=O)c4ccccc43)c(Cl)nc2c1 11278359 OPZWNBLFEPTJLK-UHFFFAOYSA-N 474.969 5.822 5 20 JKBD C[C@@H](Sc1nnc(-c2ccco2)n1-c1ccccc1)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl 20819416 QDJYKESHRUDVQQ-CYBMUJFWSA-N 469.910 5.208 5 20 JKBD O=C(Nc1ccc(OC(=O)c2ccccc2C(=O)c2ccccc2)cc1)c1cccc([N+](=O)[O-])c1 27383303 QJLJAVDNHBOOBX-UHFFFAOYSA-N 466.449 5.297 5 20 JKBD O=C(Cn1c2ccccc2c(=O)c2ccccc21)Nc1cc(Cl)ccc1OC[C@H]1CCCO1 72023748 UCSKYLMXSOIWKH-GOSISDBHSA-N 462.933 5.005 5 20 JKBD C[C@H](Sc1ncc(-c2ccccc2)n1CC(F)(F)F)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl 109622978 YRKLTULKRLABJT-LBPRGKRZSA-N 484.887 5.793 5 20 JKBD O=C(Nc1cccc(CSc2ccccn2)c1)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-] 110107157 ZIYFPEBURIMYPI-UHFFFAOYSA-N 463.437 5.476 5 20 JKBD C[C@@H](Nc1ccc(C(=O)Nc2ncc(Cc3ccc(F)c(F)c3)s2)cc1[N+](=O)[O-])c1ccccn1 410039693 CMMGZGKOCUXZJE-CQSZACIVSA-N 495.511 5.741 5 20 JKBD COc1cc(C(=O)N2CCC(c3cccc4ccccc34)CC2)c([N+](=O)[O-])cc1OC(F)F 476133044 DBTPMROOPOQVCO-UHFFFAOYSA-N 456.445 5.378 5 20 JKBD Cc1ccc([N+](=O)[O-])cc1NC(=O)c1ccccc1Sc1ncnc2sc(C)c(C)c12 481204890 ZTVVBZBCVRHZNC-UHFFFAOYSA-N 450.545 5.928 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)N[C@@H](C)c2ccc(NC(=O)c3ccc(F)cc3)cc2)cc1SC 483406184 GDCBFNJGSSSCOE-AWEZNQCLSA-N 483.521 5.208 5 20 JKBD C[C@H]1CCCN(c2ccc(C(=O)Nc3ccc(NC(=O)N4CCCCCC4)cc3)cc2[N+](=O)[O-])C1 498532182 QJSAPTOGJFJJFT-IBGZPJMESA-N 479.581 5.491 5 20 JKBD COc1cccc(Oc2ccc(CNC(=O)CSc3ccc(C(F)(F)F)cc3[N+](=O)[O-])cn2)c1 501410680 ZCKKGNMRCWQEFX-UHFFFAOYSA-N 493.463 5.218 5 20 JKBD COc1ccc(C(=O)N2CCCCCC2)cc1NC(=O)c1cc2ccccc2c2cccnc12 501706912 NBWLETBMMYDJBX-UHFFFAOYSA-N 453.542 5.665 5 20 JKBD C[C@@H]1Cc2cc([N+](=O)[O-])ccc2N1C(=O)c1ccc2c(c1)C(=O)N(c1cc(Cl)ccc1Cl)C2=O 504347070 FXXBXAUASBVCGF-GFCCVEGCSA-N 496.306 5.294 5 20 JKBD COCc1c(Br)cccc1NC(=O)c1ccc(N[C@H](C)c2ccccn2)c([N+](=O)[O-])c1 505399635 KRSVHTIVABFSTA-CQSZACIVSA-N 485.338 5.324 5 20 JKBD CCOc1cc(CNCc2sccc2C)ccc1OCc1cc([N+](=O)[O-])cc2c1OCOC2 509584934 TXGUQJYGIDUTAA-UHFFFAOYSA-N 470.547 5.099 5 20 JKBD CC[C@@H]1c2ccsc2CCN1C(=O)C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1 515078623 YHGCCUKMJWETCV-WQEMPZKUSA-N 489.622 6.733 5 20 JKBD CC(C)C[C@@H](C)n1nccc1NC(=O)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 515650572 BZCPAPROWWLUNE-OAHLLOKOSA-N 467.492 5.272 5 20 JKBD CSc1ccc(C(=O)c2ccccc2C(=O)Nc2ccc(C)c(C(=O)NC(C)C)c2)cc1[N+](=O)[O-] 518185617 XCCMPIRARTZIEI-UHFFFAOYSA-N 491.569 5.247 5 20 JKBD CN(CCc1ccccn1)C(=O)c1c2c(nc3ccccc13)/C(=C/c1ccc([N+](=O)[O-])cc1)CCC2 565789357 VAZAYGBUJYDMNL-XUTLUUPISA-N 478.552 5.730 5 20 JKBD COc1ccc(C(C)(C)C)cc1NC(=O)c1cc(OC)c(OCc2cscn2)cc1[N+](=O)[O-] 604382518 QFJVANINIHZYLD-UHFFFAOYSA-N 471.535 5.197 5 20 JKBD COc1ccc(-c2ccc(CNC3C[C@@H](C(F)(F)F)C[C@H](C(F)(F)F)C3)o2)c([N+](=O)[O-])c1 608835920 YXEKFRAOCIPIFV-RYUDHWBXSA-N 466.378 5.863 5 20 JKBD CCOc1ccccc1Oc1ccc(CNCc2ccc(-c3ccccc3[N+](=O)[O-])s2)cn1 608836221 PWJHCVHVJFVBPN-UHFFFAOYSA-N 461.543 6.199 5 20 JKBD Cc1ccc(NC(=O)c2ccc(N3CCC[C@H](C(=O)Nc4ccccc4)C3)c([N+](=O)[O-])c2)cc1 608972426 JGHYFMHTAAUIBT-FQEVSTJZSA-N 458.518 5.011 5 20 JKBD O=C(CSc1nnc(-c2ccc(Cl)cc2)n1Cc1ccccc1)c1cccc([N+](=O)[O-])c1 612289882 OFKFPZBGLNIKDN-UHFFFAOYSA-N 464.934 5.530 5 20 JKBD Cc1ccc(/C(O)=C(/C(=S)Nc2ccccc2-c2ccccc2)[n+]2cccc(CO)c2)cc1[N+](=O)[O-] 725764496 XJLLGCXMWUWPPM-UHFFFAOYSA-O 498.584 5.673 5 20 JKBD O=C(O[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1)c1c(Cl)cccc1[N+](=O)[O-] 730645410 WJCVNJIYYCKKRY-IBGZPJMESA-N 490.255 5.347 5 20 JKBD O=C(Oc1cccc([N+](=O)[O-])c1)c1cnn(-c2ncc(C(F)(F)F)cc2Cl)c1C(F)F 730955508 PXOXVSSXSQKACA-UHFFFAOYSA-N 462.718 5.005 5 20 JKBD C[C@@H](Oc1ccc(F)c(F)c1)C(=O)O[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1 744595995 DXEPQEINYPGRQZ-LRTDBIEQSA-N 490.846 5.217 5 20 JKBD COc1ccc([N+](=O)[O-])cc1NC(=O)[C@H](C)OC(=O)c1csc(-c2ccc(Cl)c(Cl)c2)n1 744604838 LIPRUGWMAKCXFI-JTQLQIEISA-N 496.328 5.218 5 20 JKBD Cc1ccc(Cc2cnc(NC(=O)c3cc([N+](=O)[O-])ccc3Br)s2)cc1F 751080595 ZRUNWWAJFBZHIM-UHFFFAOYSA-N 450.289 5.104 5 20 JKBD O=C(Nc1cccc(C(=O)Nc2cc([N+](=O)[O-])c(F)cc2F)c1)c1cccc(Br)c1 916042946 NNYPZJCYXATADU-UHFFFAOYSA-N 476.233 5.140 5 20 JKBD Cc1noc(C)c1COc1cc2ccccc2cc1C(=O)OCCOc1ccccc1[N+](=O)[O-] 918819750 ARLSICKAIXJWRL-UHFFFAOYSA-N 462.458 5.168 5 20 JKBD O=C(CCc1ncc(-c2ccc(Cl)cc2Cl)o1)OCc1nc(-c2ccc([N+](=O)[O-])cc2)no1 919054718 OAAUGDXNGZBLKJ-UHFFFAOYSA-N 489.271 5.283 5 20 JKBD O=C(OCC(=O)N1c2ccccc2Sc2ccc(Cl)cc21)c1ccc([N+](=O)[O-])cc1F 919567316 DWJVIRLEUOCDPN-UHFFFAOYSA-N 458.854 5.374 5 20 JKBD CSc1nc(C(=O)Oc2ccc(NC(=O)c3cc([N+](=O)[O-])ccc3Cl)cc2)c2ccccn12 920286473 XALHNQYBTRROMC-UHFFFAOYSA-N 482.905 5.089 5 20 JKBD Cc1ccc(-c2nnc([C@@H](C)OC(=O)c3ccc(N[C@@H](C)c4ccccn4)c([N+](=O)[O-])c3)o2)cc1 920545823 JNTQNZMZWMEXMX-DLBZAZTESA-N 473.489 5.439 5 20 JKBD CCOC(=O)c1sc2nc(/C(Cl)=C\c3ccc(Cl)c([N+](=O)[O-])c3)nc(O)c2c1C 1115813299 AHJLHANJZQDJPU-IZZDOVSWSA-N 454.291 5.181 5 20 JKBD O=C(CCN1CCCC1)NC1(c2ccc(NC(=O)c3cc4cc([N+](=O)[O-])ccc4s3)cc2)CCC1 1791009911 CUNQTPLBAZDFNA-UHFFFAOYSA-N 492.601 5.043 5 20 JKBD Cc1ccc(CC(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2ccc(Cl)c(C)c2Cl)cc1[N+](=O)[O-] 1803536798 BHLMTIQMKVZADU-BCDXTJNWSA-N 490.387 5.013 5 20 JKBD Cc1cc(O)c([N+](=O)[O-])cc1C(=O)Nc1cc([C@@H]2CCCCN2C(=O)CC2CCC(C)(C)CC2)[nH]n1 1821345515 KWKIRXAKICFEAF-FQEVSTJZSA-N 497.596 5.244 5 20 JKBD Cc1cccc(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)c3cc(F)cc([N+](=O)[O-])c3)[nH]n2)c1Cl 1823183550 DSTOKOAZGGTMNN-IBGZPJMESA-N 485.903 5.039 5 20 JKBD Cc1ncc(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3cc4cc([N+](=O)[O-])ccc4s3)CC2)s1 1827967601 HZSVXIGYGCAFPR-LJQANCHMSA-N 498.630 5.122 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cc3sccc3[nH]2)CC1 1828711478 OSVZFKATSRDBAY-OAQYLSRUSA-N 498.580 5.132 5 20 JKBD O=C(c1cccc(F)c1[N+](=O)[O-])N1CCC([C@H]2CCCCN2C(=O)c2cc(F)ccc2Cl)CC1 1830578039 DRAKQWKOECSMDU-OAQYLSRUSA-N 491.922 5.074 5 20 JKBD C[C@@H](Sc1nnc(-c2ccccc2Cl)n1C1CCCC1)C(=O)Nc1ccc(F)c([N+](=O)[O-])c1 8988875 SRNPLUZDXDSMQI-CYBMUJFWSA-N 489.960 5.880 5 20 JKBD COc1ccc(/C=C(\CC(=O)O)c2nc3ccccc3s2)cc1OCc1ccc([N+](=O)[O-])cc1 13078094 QUSWKKYEFYOPGW-LDADJPATSA-N 476.510 5.807 5 20 JKBD O=C(Nc1ccc(Cl)c([N+](=O)[O-])c1)[C@@H](Sc1nnc(C2CC2)n1C1CC1)c1ccccc1 17279576 LWDKBAJADYQGHA-IBGZPJMESA-N 469.954 5.524 5 20 JKBD O=C(N[C@H]1CCSc2ccccc21)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 21900314 DQYLHLWDNUGRIR-KRWDZBQOSA-N 465.497 5.183 5 20 JKBD O=C(Oc1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2Cl)cc1)c1ccc(C(F)(F)F)nc1 26365493 FYEJSYDMVLSRNL-UHFFFAOYSA-N 465.771 5.134 5 20 JKBD C[C@@H](OC(=O)c1ccccc1Oc1cccnc1)C(=O)Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1 110831975 DZGXOLYDOTXCJT-OAHLLOKOSA-N 490.497 5.090 5 20 JKBD Cc1cc(C)cc(C(=O)N2CCC[C@@H](C(=O)Nc3nc(-c4cccc([N+](=O)[O-])c4)c(C)s3)C2)c1 195704382 KDDAPRCAVXZCRK-LJQANCHMSA-N 478.574 5.134 5 20 JKBD C[C@H]1CCC[C@@H](C)N1C(=O)c1cc(Cl)ccc1NC(=O)c1ccc([N+](=O)[O-])cc1Cl 302941843 LJDUIECMKGKSTK-BETUJISGSA-N 450.322 5.557 5 20 JKBD Cc1nn(CCC(=O)N(CCc2ccccc2)c2nc(-c3ccccc3)cs2)c(C)c1[N+](=O)[O-] 303151255 NSKBHGRJHNEJLK-UHFFFAOYSA-N 475.574 5.198 5 20 JKBD COc1cc(C(=O)N[C@@H](C)c2oc3ccccc3c2C)c([N+](=O)[O-])cc1OCc1cscn1 409550622 AULFDVAKSAKYOS-AWEZNQCLSA-N 467.503 5.185 5 20 JKBD CCC(=O)Nc1ccc(Cl)c(NC(=O)c2ccc(N3C[C@@H](C)C[C@H](C)C3)c([N+](=O)[O-])c2)c1 488564628 DVCBIDZBWYDLJM-GJZGRUSLSA-N 458.946 5.331 5 20 JKBD Cc1cc([N+](=O)[O-])ccc1C(=O)N(C[C@H]1CCCO1)c1nc(-c2cccc(C(F)(F)F)c2)cs1 508801115 HBSXJNMBBDCPSJ-GOSISDBHSA-N 491.491 5.871 5 20 JKBD CCCNC(=O)c1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2Oc2ccc(OC)cc2)cc1Cl 509373004 NNSPCFFGHSJWRC-UHFFFAOYSA-N 483.908 5.441 5 20 JKBD COc1cc(CNCc2csc(Br)c2)c([N+](=O)[O-])cc1OCc1ccccc1 509567544 DYZQUSQWLVISSH-UHFFFAOYSA-N 463.353 5.296 5 20 JKBD COCCN(C(=O)c1ccc(Br)cc1Cl)c1nc(-c2ccc([N+](=O)[O-])cc2)cs1 515437881 GYRGKGGKJDTRNW-UHFFFAOYSA-N 496.770 5.427 5 20 JKBD CN(C)[C@@H](CNCc1ccc(-c2ccc([N+](=O)[O-])cc2Br)o1)c1ccsc1 518767562 HWTMXZHGHRKVBN-SFHVURJKSA-N 450.358 5.071 5 20 JKBD CCCN(CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1)CC(=O)Nc1ccc(Cl)cc1Cl 557015804 PVNQAMYXPVONGQ-UHFFFAOYSA-N 477.348 5.450 5 20 JKBD C[C@H]1CCCN(Cc2csc(NC(=O)c3cc([N+](=O)[O-])ccc3Sc3ccccc3)n2)C1 589659825 WZVNUHLQDUHHQC-INIZCTEOSA-N 468.604 5.687 5 20 JKBD COCCN(C(=O)COc1ccc(Cl)cc1Cl)c1nc(-c2ccc([N+](=O)[O-])cc2)cs1 603461416 PQSNZGOSBAKVEB-UHFFFAOYSA-N 482.345 5.084 5 20 JKBD COCCN(C(=O)c1cc(C(C)C)n(C(C)(C)C)n1)c1nc(-c2ccc([N+](=O)[O-])cc2)cs1 603750215 AKWBQVYJGIYZBP-UHFFFAOYSA-N 471.583 5.086 5 20 JKBD CC(C)N(Cc1nnc(-c2ccccc2Cl)o1)C(=O)[C@H](C)Oc1ccc(Cl)cc1[N+](=O)[O-] 604445707 FDDZLIRHLRIKIN-ZDUSSCGKSA-N 479.320 5.156 5 20 JKBD CO[C@@H](C)c1cccc(NC(=O)c2ccccc2C(=O)c2ccc(SC)c([N+](=O)[O-])c2)c1 608874543 FZQNHNSTVAJIAW-HNNXBMFYSA-N 450.516 5.507 5 20 JKBD Cc1ccc(C(=O)Nc2nc3ccc(NC(=O)c4cc(F)ccc4[N+](=O)[O-])cc3s2)s1 726537082 FTAQNVHGQYJGRU-UHFFFAOYSA-N 456.480 5.218 5 20 JKBD CC[C@H](Cc1ccccc1)NC(=O)c1ccccc1NC(=O)c1ccc([N+](=O)[O-])cc1Cl 727810640 BMDLEWVJBZVSNE-QGZVFWFLSA-N 451.910 5.252 5 20 JKBD Cc1nc2ccc(C(=O)O[C@@H](C(=O)Nc3ccc([N+](=O)[O-])cc3Cl)c3ccccc3)cc2nc1C 746180555 RAQFLWHDBRVZHX-HSZRJFAPSA-N 490.903 5.345 5 20 JKBD O=C(Nc1ccc(Cl)c([N+](=O)[O-])c1)[C@@H](Sc1n[nH]c(-c2ccccc2O)n1)c1ccccc1 914868285 YMKSSFDEBJVVOM-IBGZPJMESA-N 481.921 5.211 5 20 JKBD CC(C)Cc1ccc([C@H](NC(=O)C(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)c2cccs2)cc1 915740941 ZRZDEFTXCQCTMZ-NRFANRHFSA-N 471.966 5.353 5 20 JKBD CC(C)c1ccccc1N(C(=O)Cn1ncc2ccc([N+](=O)[O-])cc21)c1nc2ccccc2s1 918541600 LFMNEFLAVMEIKF-UHFFFAOYSA-N 471.542 6.043 5 20 JKBD C[C@@H](Nc1ccc(C(=O)OCC(=O)Nc2ccc(Cl)c(Cl)c2)cc1[N+](=O)[O-])c1ccccn1 920547068 NVGHIOLSTNOSTF-CYBMUJFWSA-N 489.315 5.265 5 20 JKBD CN(Cc1cc([N+](=O)[O-])ccc1Cl)C(=O)[C@H]1CCC(=O)N(Cc2ccccc2)[C@@H]1c1ccccc1 920884979 MDZJZBMMKGKMLT-JYFHCDHNSA-N 491.975 5.387 5 20 JKBD C[C@H]1CN(C(=O)C/C(=C\c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)Cc2ccccc21 922310754 UNGWFYMBXAWEPA-SXZORUHJSA-N 469.566 6.281 5 20 JKBD O=C(Cc1cccc([N+](=O)[O-])c1)Nc1ccc(C2(NC(=O)c3cc4cc(F)ccc4[nH]3)CCC2)cc1 1785791520 AQVVNMPLPHXXKV-UHFFFAOYSA-N 486.503 5.206 5 20 JKBD O=C(NC1(c2ccc(NC(=O)c3cc(Cl)nc4ccccc34)cc2)CCC1)c1ccc([N+](=O)[O-])o1 1788988667 BTWOQRWOOLZAQN-UHFFFAOYSA-N 490.903 5.451 5 20 JKBD O=C(C[C@@H]1C[C@@H]2CC[C@H]1C2)NC1(c2ccc(NC(=O)c3cc([N+](=O)[O-])cc4c3OCC4)cc2)CCC1 1790045129 HSPDAQIBTZEBHU-HBFSDRIKSA-N 489.572 5.104 5 20 JKBD O=C(/C=C/c1ccc([N+](=O)[O-])o1)NC1(c2ccc(NC(=O)[C@@H]3CCc4ccccc43)cc2)CCC1 1791688356 MSXBWKOVGGQBBY-RBNVVWFDSA-N 471.513 5.065 5 20 JKBD Cc1c(Cl)cccc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cc(Cl)cc([N+](=O)[O-])c1C)C2 1792745012 CRNNEVNORJOYTH-BJWYYQGGSA-N 476.360 5.084 5 20 JKBD Cc1cc(CCCC(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2ccc(Cl)s2)c([N+](=O)[O-])cc1F 1795037007 KBTUFUJKUKUSNN-BJWYYQGGSA-N 493.988 5.032 5 20 JKBD Cc1cc(CCCC(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cc3ccoc3s2)c([N+](=O)[O-])cc1F 1796579524 ULDWJXRXJCKVSB-REPLKXPHSA-N 499.564 5.125 5 20 JKBD C[C@H](C(=O)Nc1cc([C@@H]2CCCCN2C(=O)Cc2cccc([N+](=O)[O-])c2)[nH]n1)c1ccc(Cl)cc1 1814656222 RNYWVFFMDPGQOP-AOMKIAJQSA-N 495.967 5.010 5 20 JKBD CC(C)CCC(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cc3cc([N+](=O)[O-])ccc3s2)n[nH]1 1821610120 DDIOSAXFDIUWQK-GOSISDBHSA-N 469.567 5.275 5 20 JKBD Cc1cc(Cl)c(Cl)cc1C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2ccc([N+](=O)[O-])[nH]2)CC1 1829835354 VUEGHUXKNAJHSW-FQEVSTJZSA-N 493.391 5.085 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)N1CCCC[C@@H]1C1CCN(C(=O)[C@H]2CCCCC2(F)F)CC1 1830728360 KMVSRIGROVSCRT-WIYYLYMNSA-N 495.542 5.101 5 20 JKBD O=C(O[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Br)c1ccccc1)c1ccc(F)cc1 11116328 PCIQJCSJOUXLNA-LJQANCHMSA-N 473.254 5.033 5 20 JKBD CC[C@H](C)c1ccc([C@@H](NC(=O)CSc2ccc(C(N)=O)cc2[N+](=O)[O-])c2cccs2)cc1 15616423 HCVSSPGIPRBEKL-NPMXOYFQSA-N 483.615 5.267 5 20 JKBD O=C(Nc1ccc(Cl)c([N+](=O)[O-])c1)[C@@H](Sc1nnc(NC2CC2)s1)c1ccccc1 22173041 IXQWACLAFVPGOZ-INIZCTEOSA-N 461.956 5.146 5 20 JKBD Cc1nn(Cc2ccc(C(=O)Nc3ccc(-c4cnc(C5CC5)o4)cc3)cc2)c(C)c1[N+](=O)[O-] 25932624 QBWZJDDKSMDQPK-UHFFFAOYSA-N 457.490 5.241 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Br)[C@H](NCc1ccc(Cl)s1)c1ccccc1 28374238 UVAOCTZHZUZHHQ-GOSISDBHSA-N 480.771 5.542 5 20 JKBD Cn1c(S[C@H](C(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)c2ccccc2)nnc1-c1ccccc1 115024052 PJOWJKRHZLTXNM-FQEVSTJZSA-N 479.949 5.516 5 20 JKBD Cc1ccc(C(=O)NCC(F)(F)F)cc1NC(=O)c1ccc(NCc2ccccc2)c([N+](=O)[O-])c1 117726617 RWMCRIQISHQMEW-UHFFFAOYSA-N 486.450 5.060 5 20 JKBD O=C(CSc1nnc(-c2cccnc2)n1-c1ccc(Cl)c(Cl)c1)c1cccc([N+](=O)[O-])c1 216804384 KROXSQKHAFFXIK-UHFFFAOYSA-N 486.340 5.519 5 20 JKBD CC(C)[C@@H](NC(=O)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1)c1nc(-c2cccnc2)no1 303198267 WVNYCESQPUMUSZ-OAQYLSRUSA-N 493.907 5.613 5 20 JKBD O=C(Nc1ccc(Sc2nncs2)c(Cl)c1)c1ccc(N2CCCC2)c([N+](=O)[O-])c1 303216970 TUOJFOVSPYSDNX-UHFFFAOYSA-N 461.956 5.103 5 20 JKBD Cc1ccc(C(=O)C2CCN(C(=O)c3ccc(N[C@H](C)c4ccccn4)c([N+](=O)[O-])c3)CC2)cc1 409910667 MKKGSFNAOSJQPT-LJQANCHMSA-N 472.545 5.206 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)Nc2ccc(NC(=O)Nc3ccccc3)cc2)cc1SC 482069381 QVIRKNUSGDIFQO-UHFFFAOYSA-N 452.492 5.222 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)Nc2ccc(CC(=O)N3CCCc4ccccc43)cc2)cc1SC 483496171 OVHHDJKUJAINQR-UHFFFAOYSA-N 491.569 5.100 5 20 JKBD C[C@@H](NC(=O)c1cc([N+](=O)[O-])ccc1Sc1ccc(Cl)cc1)c1ccc2c(c1)CCC(=O)N2 500099023 RHLSUQJSQYQGBA-CQSZACIVSA-N 481.961 5.775 5 20 JKBD Cn1c([C@@H](NC(=O)c2csc(-c3cccc([N+](=O)[O-])c3)n2)c2ccccc2)nc2ccccc21 503148317 UTSDVLMBJDOJKT-QFIPXVFZSA-N 469.526 5.124 5 20 JKBD CCN(C(=O)c1ccn(-c2cccc([N+](=O)[O-])c2)n1)[C@@H]1CCSc2ccc(Br)cc21 504552883 MAXVMNCQERAKJO-LJQANCHMSA-N 487.379 5.242 5 20 JKBD COc1cc(C(=O)Nc2ccc(Sc3nc4ccccc4[nH]3)cc2)c([N+](=O)[O-])cc1OC(F)F 505069854 CBMOUVFVNHJIDW-UHFFFAOYSA-N 486.456 5.485 5 20 JKBD O=C(Nc1cccc(Br)c1)C1CCN(C(=O)c2cc3ccccc3c3cccnc23)CC1 505209580 HPFSTPGQEVKUEA-UHFFFAOYSA-N 488.385 5.641 5 20 JKBD COc1ccc(CCCN[C@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2ccccc2)cc1 511424405 RCNGZTLVJFHAKI-QHCPKHFHSA-N 453.926 5.159 5 20 JKBD CN(C[C@H]1CCCOC1)C(=O)c1c2c(nc3ccccc13)/C(=C/c1cccc([N+](=O)[O-])c1)CCC2 518083087 KXJAVGJNWYBYNW-LNKKFFRNSA-N 471.557 5.519 5 20 JKBD O=C(C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)N1CCC(N2CCCCC2)CC1 521182628 RFBURNNVVVGILD-UZYVYHOESA-N 490.629 5.612 5 20 JKBD Cc1cc(C)n([C@@H](C)C(=O)Nc2ccc(NCc3ccc(C(F)(F)F)cc3[N+](=O)[O-])cc2Cl)n1 600854782 XMNWXQPNYGTHMI-AWEZNQCLSA-N 495.889 5.892 5 20 JKBD Cc1ccc(C(=O)NC2CC2)cc1NC(=O)c1cc([N+](=O)[O-])ccc1Sc1ccc(Cl)cc1 603772287 DKNZASZONPQBRV-UHFFFAOYSA-N 481.961 5.852 5 20 JKBD CCC(=O)Nc1cccc(CNC(=O)c2ccc(NCc3ccccc3Cl)c([N+](=O)[O-])c2)c1 603813166 XNCCREIVCIEITN-UHFFFAOYSA-N 466.925 5.139 5 20 JKBD C[C@@H]1CCCN(c2ccc(C(=O)Nc3ccc(C(=O)N4CCCCCC4)cc3)cc2[N+](=O)[O-])C1 603991015 SOFRESHOJHBZGG-LJQANCHMSA-N 464.566 5.100 5 20 JKBD O=C(c1nc(-c2ccccc2)n(-c2cccc(C(F)(F)F)c2)n1)N1CCc2cc([N+](=O)[O-])ccc21 604232632 PHCVDJLCKBTFBI-UHFFFAOYSA-N 479.418 5.064 5 20 JKBD Cc1ccccc1NC(=O)[C@H]1CCc2ccccc2N1C(=O)c1cc2cc([N+](=O)[O-])ccc2s1 608872775 QIEGBBMWGJVEFD-JOCHJYFZSA-N 471.538 5.718 5 20 JKBD O=C(O)C/C(=C\c1cc2c(cc1[N+](=O)[O-])OCCO2)c1nc2cc(C(F)(F)F)ccc2s1 609323179 YASFPAQYPYBLMF-VZUCSPMQSA-N 466.393 5.010 5 20 JKBD C[C@@H]([C@H]1C[C@H]2CC[C@H]1C2)n1c(SCC(=O)N(C)c2ccc([N+](=O)[O-])cc2)nnc1-c1ccco1 619816340 DRPKITYFGFLMSY-OGNFBWPZSA-N 481.578 5.199 5 20 JKBD c1ccc2c(c1)nc(CSc1nnc(N3CCCCC3)n1C[C@@H]1CCCO1)c1ccccc12 641883279 WGWCAMVHNGJHOG-IBGZPJMESA-N 459.619 5.441 5 20 JKBD Cc1ccc(Sc2ccc(CN[C@H](C)c3cccc(NS(C)(=O)=O)c3)cc2[N+](=O)[O-])cc1 725849545 PWYJDOFAQPCGNI-QGZVFWFLSA-N 471.604 5.277 5 20 JKBD C[C@H](OC(=O)c1cc(F)c(F)cc1[N+](=O)[O-])C(=O)Nc1ccccc1Sc1ccccc1 725936758 ITQDWCNUPVMJFT-ZDUSSCGKSA-N 458.442 5.208 5 20 JKBD COC1CCN(c2ccc(NC(=O)c3cc([N+](=O)[O-])ccc3Cl)cc2C(F)(F)F)CC1 728012921 NXTSZGSNFJCDAK-UHFFFAOYSA-N 457.836 5.135 5 20 JKBD C[C@@H](OC(=O)c1c(Cl)cccc1[N+](=O)[O-])C(=O)Nc1ccc(Cl)c(C(F)(F)F)c1 730644242 KWVNQBZIZKUVCO-MRVPVSSYSA-N 451.184 5.104 5 20 JKBD Cc1nc2cc(F)ccc2cc1C(=O)Oc1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2Cl)cc1 799761422 YQFHSADYUYHJSW-UHFFFAOYSA-N 479.851 5.715 5 20 JKBD Cc1nn(Cc2ccc(-c3nc(-c4ccc(OCc5cccnc5)cc4)no3)cc2)c(C)c1[N+](=O)[O-] 904465472 LFVWIDFSUBDEPJ-UHFFFAOYSA-N 482.500 5.147 5 20 JKBD COc1cc(-c2nc(CCNC(=O)OC(C)(C)C)no2)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 904764812 RZAGMKDYBNLMTJ-UHFFFAOYSA-N 490.900 5.166 5 20 JKBD Cc1onc(-c2c(Cl)cccc2Cl)c1C(=O)OCc1nnc(-c2ccc([N+](=O)[O-])cc2)o1 913350749 ZQURDJSGUYKQSW-UHFFFAOYSA-N 475.244 5.272 5 20 JKBD Cc1csc(SCc2c(C(=O)Nc3cc([N+](=O)[O-])ccc3OC(F)F)oc3ccccc23)n1 915283328 LNUJJKCUEBTRKJ-UHFFFAOYSA-N 491.497 6.252 5 20 JKBD C[C@H](OC(=O)c1cc([N+](=O)[O-])ccc1Oc1ccccc1)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 919193630 ZCXPHJJIEIMESJ-AWEZNQCLSA-N 476.401 5.263 5 20 JKBD C[C@H](Nc1ccc(C(=O)OCc2nc(-c3ccccc3)cs2)cc1[N+](=O)[O-])c1ccccn1 920121247 WNKRUDGHQDCPNN-INIZCTEOSA-N 460.515 5.643 5 20 JKBD COc1ccc([C@@H](CNC(=O)COc2cc(Cl)ccc2[N+](=O)[O-])c2c[nH]c3ccccc23)cc1 920993223 ZDRWEQFBEINHQI-HXUWFJFHSA-N 479.920 5.065 5 20 JKBD COc1ccc([C@@H](Cc2ccc(F)cc2)N[C@H](C)C(=O)Nc2cc([N+](=O)[O-])ccc2Cl)cc1 921065399 ACYKWAYAKYVXPQ-IVZQSRNASA-N 471.916 5.297 5 20 JKBD COc1cccc2[nH]cc(C(=O)NC3(c4ccc(NC(=O)Cc5cccc([N+](=O)[O-])c5)cc4)CCC3)c12 1785795393 LANZVQLMQBZIBU-UHFFFAOYSA-N 498.539 5.075 5 20 JKBD Cc1c(C(=O)NC2(c3ccc(NC(=O)c4cnccc4F)cc3)CCC2)cc(Cl)cc1[N+](=O)[O-] 1788355000 KRLYDRXWXCPXTO-UHFFFAOYSA-N 482.899 5.152 5 20 JKBD COc1c(C(=O)NC2(c3ccc(NC(=O)c4cccc(F)c4[N+](=O)[O-])cc3)CCC2)ccc(F)c1F 1790699208 WXZRBYBRKMBOMQ-UHFFFAOYSA-N 499.445 5.082 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)[C@H]3[C@H]4SC=C[C@H]43)CCC2)cc1)c1cc2cc([N+](=O)[O-])ccc2s1 1791010390 MXMWBMMBMMJOSL-BWAGFHJFSA-N 491.594 5.432 5 20 JKBD COc1ccc(CC(=O)NC2(c3ccc(NC(=O)[C@@]4(C)CC=CCC4)cc3)CCC2)c([N+](=O)[O-])c1 1791991912 NQXAFMJRYKSQSF-SANMLTNESA-N 477.561 5.026 5 20 JKBD CC(C)(C)CCCCCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CSc1ccccc1[N+](=O)[O-])C2 1801833393 PUHFKVZUCPNYRM-ACDBMABISA-N 475.655 5.322 5 20 JKBD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)/C=C/c1ccccc1[N+](=O)[O-])c1ccc(Oc2ccccc2)cc1 1804345446 LZZBWHOCZBRPHR-NQZMGVAGSA-N 497.551 5.352 5 20 JKBD CC(C)[C@@H](C(=O)N1CCCC2(CCN(C(=O)/C=C/c3ccccc3[N+](=O)[O-])CC2)C1)c1ccccc1 1805623371 MXKVIQXKIKWJPL-FQFCXHBISA-N 489.616 5.279 5 20 JKBD O=C(Cc1cc([N+](=O)[O-])ccc1F)N1CCCC2(CCN(C(=O)[C@@H]3CCC[C@H]4CCCC[C@H]43)CC2)C1 1806655525 GNXWCJZJOCCMQW-AGILITTLSA-N 499.627 5.114 5 20 JKBD CC[C@H]1CC[C@H](C(=O)N2CCC([C@@H]3CCCCN3C(=O)c3cc(N(C)C)ccc3[N+](=O)[O-])CC2)CC1 1829648327 IISUFDMWXGOTIU-XTJBDQBJSA-N 498.668 5.111 5 20 JKBD O=C(c1cc2cc([N+](=O)[O-])ccc2s1)N1CCC([C@@H]2CCCCN2C(=O)c2ccccc2F)CC1 1829880069 ZIBLKEWGYAQMDO-QFIPXVFZSA-N 495.576 5.496 5 20 JKBD Cc1cc(C(=O)N2CCC([C@H]3CCCCN3C(=O)c3cc(Cl)cc([N+](=O)[O-])c3C)CC2)c(C)o1 1830734594 PCIPEFYBDHXWPV-JOCHJYFZSA-N 487.984 5.314 5 20 JKBD O=C([C@@H]1CCCCC1(F)F)N1CCC([C@@H]2CCCCN2C(=O)/C=C/c2ccccc2[N+](=O)[O-])CC1 1832899723 FKPUPBZVCGITNZ-KFDAMUOLSA-N 489.563 5.053 5 20 JKBD COc1ccc(C)cc1NC(=O)[C@H](OC(=O)c1ccc(Br)c([N+](=O)[O-])c1)c1ccccc1 9848916 PFSQGQWLDOFBBA-OAQYLSRUSA-N 499.317 5.211 5 20 JKBD Cc1c(NC(=O)CSc2nnc(-c3ccc(F)cc3)n2-c2ccccc2)cccc1[N+](=O)[O-] 9928166 BOPWTORDURBSTB-UHFFFAOYSA-N 463.494 5.021 5 20 JKBD Cc1ccc(-c2csc3nc(SCC(=O)Nc4cc([N+](=O)[O-])ccc4F)n(C)c(=O)c23)cc1C 10793054 IRUIPMKVJIJJGK-UHFFFAOYSA-N 498.561 5.057 5 20 JKBD CC(C)n1ncc2c(C(=O)OCC(=O)Nc3cc([N+](=O)[O-])ccc3Cl)cc(-c3cccs3)nc21 11049286 FSPWEKNKXCHUGJ-UHFFFAOYSA-N 499.936 5.098 5 20 JKBD O=C1/C(=C/c2ccc(-c3ccc([N+](=O)[O-])cc3Br)o2)NC(=S)N1C1CCCCC1 15260286 OKMVVNGAWRUFJO-BOPFTXTBSA-N 476.352 5.008 5 20 JKBD CC(=O)c1ccc(NC(=O)c2ccccc2Sc2ccc(C(F)(F)F)cc2[N+](=O)[O-])cc1 16023560 PTTUEFDSIHXAQH-UHFFFAOYSA-N 460.433 6.220 5 20 JKBD CCOc1ccccc1NC(=O)[C@H](C)OC(=O)c1ccc(Sc2nc(C)cs2)c([N+](=O)[O-])c1 16903623 YXYYHQGJFYAQDJ-AWEZNQCLSA-N 487.559 5.094 5 20 JKBD Cc1occc1-c1nnc(SCC(=O)Nc2ccc(Cl)cc2[N+](=O)[O-])n1Cc1ccccc1 21743657 KVPSTLJNQPDGQL-UHFFFAOYSA-N 483.937 5.187 5 20 JKBD CSc1ccc([N+](=O)[O-])c(C(=O)NC[C@@H](c2ccc(N(C)C)cc2)c2c[nH]c3ccccc23)c1 24486569 RCOLYDBUHKSQFA-QFIPXVFZSA-N 474.586 5.426 5 20 JKBD COc1cc(C(=O)Nc2nc(-c3cccc(C(F)(F)F)c3)cs2)c([N+](=O)[O-])cc1OC(F)F 29013565 JRUUWSBDPHZRRC-UHFFFAOYSA-N 489.378 5.599 5 20 JKBD O=C(c1ccn(-c2cccc([N+](=O)[O-])c2)n1)N1CCC(c2nc3cc(Cl)ccc3s2)CC1 31283127 JOOUKLHYPLOTIV-UHFFFAOYSA-N 467.938 5.063 5 20 JKBD O=[N+]([O-])c1cc(C(F)(F)F)c(Nc2ncc(C(F)(F)F)cc2Cl)c([N+](=O)[O-])c1Cl 103284050 JCSKTPQMDQWTBV-UHFFFAOYSA-N 465.093 5.986 5 20 JKBD in-vitro CC1CCN(c2ccc([N+](=O)[O-])cc2C(=O)Nc2ccc(F)c(-c3nnc4n3CCCCC4)c2)CC1 105650151 GPGFSLKJWMUEAH-UHFFFAOYSA-N 492.555 5.207 5 20 JKBD Cc1cc(NC(=O)c2ccc(Cn3nc(C)c([N+](=O)[O-])c3C)cc2)ccc1Oc1cccnc1 108944359 FRFXNHQXCWXEAH-UHFFFAOYSA-N 457.490 5.204 5 20 JKBD Cc1cc(C(=O)N2CCC[C@@H]2C(=O)Nc2cccc(CO[C@H]3CCC[C@@H](C)C3)c2)ccc1[N+](=O)[O-] 216622311 NMTVSGYCWLYZKR-FMNCTDSISA-N 479.577 5.242 5 20 JKBD O=C(c1ccccc1)N1CCC(NCc2ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])cc2)CC1 217023328 QZGUWMIPVBNKPP-UHFFFAOYSA-N 465.937 5.435 5 20 JKBD Cc1ccc(NC(=O)CNC(=O)c2ccc(NCc3ccccc3Cl)c([N+](=O)[O-])c2)c(Cl)c1 302991408 MNERQTDBHAAGKS-UHFFFAOYSA-N 487.343 5.191 5 20 JKBD O=C(N[C@@H](c1ccccc1)c1nccs1)c1ccc(NCc2ccccc2Cl)c([N+](=O)[O-])c1 303182129 IJUXBKKLRGFGKX-QFIPXVFZSA-N 478.961 5.836 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)Nc2cc(C(C)(C)C)nn2Cc2ccccc2)cc1SC 482517805 BWOSFAOCQAUKEN-UHFFFAOYSA-N 454.552 5.120 5 20 JKBD CCN(C(=O)c1csc(-c2cccc([N+](=O)[O-])c2)n1)[C@@H]1CCN([C@@H](C)c2ccccc2)C1 501942155 BKQCNXLNRGCLKC-LAUBAEHRSA-N 450.564 5.016 5 20 JKBD CCn1c(SCC(=O)c2ccc([N+](=O)[O-])cc2)nc2scc(-c3cccs3)c2c1=O 502742520 VWKRGNMJYNMCMW-UHFFFAOYSA-N 457.558 5.090 5 20 JKBD C[C@@H]1CCCN(c2ccc(C(=O)Nc3cc(Cl)ccc3OC[C@H]3CCCO3)cc2[N+](=O)[O-])C1 509790316 XHHLAROJGUEUEP-VQIMIIECSA-N 473.957 5.295 5 20 JKBD C[C@@H](NC(=O)Nc1cc([N+](=O)[O-])ccc1OC(F)F)c1cccc(NC(=O)c2ccccc2)c1 510867114 HCLNZAZFURZNQD-CQSZACIVSA-N 470.432 5.331 5 20 JKBD COc1ccc(-c2[nH]c3ccccc3c2CCC(=O)Nc2ccc(OC)cc2[N+](=O)[O-])c(OC)c1 512971548 IFMNPOUCNJBABF-UHFFFAOYSA-N 475.501 5.340 5 20 JKBD Cc1nc(NC(=O)c2ccc(Cl)cc2[N+](=O)[O-])sc1Cc1cccc(Br)c1 515969021 DXJGLDMEHLIBPY-UHFFFAOYSA-N 466.744 5.619 5 20 JKBD CC(C)c1nc2ccc(N[C@@H](C)C(=O)Nc3ccc([N+](=O)[O-])cc3C(F)(F)F)cc2s1 519165495 DKQMVTSMZRUTRW-NSHDSACASA-N 452.458 5.786 5 20 JKBD O=[N+]([O-])c1ccc(-c2ccc(CNc3cc(-c4cccs4)nn3CCO)o2)c(Br)c1 520218732 UOVGUQAYRBULRQ-UHFFFAOYSA-N 489.351 5.147 5 20 JKBD CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)N[C@@H]1CCCc2nc(-c3ccc(F)cc3)sc21 520611566 REBANBXGTQGMIH-OAQYLSRUSA-N 468.554 5.855 5 20 JKBD COc1cc2c(cc1OC)CN(Cc1ccccc1NC(=O)c1ccc(SC)c([N+](=O)[O-])c1)CC2 521390191 MLOVCSACJYHFDO-UHFFFAOYSA-N 493.585 5.145 5 20 JKBD C[C@@H]1CCCN(c2ccc(C(=O)NC3C[C@H](C(F)(F)F)C[C@@H](C(F)(F)F)C3)cc2[N+](=O)[O-])C1 603572877 KNRCABMGMRMOSB-BPLDGKMQSA-N 481.437 5.470 5 20 JKBD O=C(c1csc([N+](=O)[O-])c1)N(C[C@@H]1CCCO1)c1nc(-c2cccc(C(F)(F)F)c2)cs1 603754455 TYVZWOCXPKTHRO-HNNXBMFYSA-N 483.493 5.624 5 20 JKBD Cc1nc(NC(=O)c2cc(OCC(F)(F)F)ccc2[N+](=O)[O-])sc1Cc1cccc(Cl)c1 603973400 GMGALIFNKVNIJF-UHFFFAOYSA-N 485.871 5.797 5 20 JKBD CN(Cc1cn(-c2ccccc2)nc1-c1cccs1)C(=O)c1c[nH]c2ccc([N+](=O)[O-])cc12 604545801 MPWMEVZGEOMXKI-UHFFFAOYSA-N 457.515 5.263 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)N[C@H]2c3cc(Br)ccc3SC[C@@H]2C)cc1SC 609218992 BAQRKUBPBVEPCW-XTZNXHDOSA-N 483.409 5.301 5 20 JKBD O=C(O)C/C(=C/c1cc2c(cc1[N+](=O)[O-])OCCO2)c1nc2cc(C(F)(F)F)ccc2s1 609323180 YASFPAQYPYBLMF-WZUFQYTHSA-N 466.393 5.010 5 20 JKBD CCOc1cc(NC(=O)c2cc3c(C)nn(-c4ccccc4)c3s2)c([N+](=O)[O-])cc1OCC 619212970 HPOHOQIHHKHFNI-UHFFFAOYSA-N 466.519 5.353 5 20 JKBD O=C(O[C@H](C(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1)c1ccccc1)c1oc2ccccc2c1CO 726018224 UWULKQHYIMNIPJ-NRFANRHFSA-N 480.860 5.024 5 20 JKBD O=[N+]([O-])c1ccc2nc(Sc3nnc(-c4c[nH]c5ccccc45)n3C[C@@H]3CCCO3)sc2c1 731208778 LGDSKKLHLBRZKQ-AWEZNQCLSA-N 478.559 5.275 5 20 JKBD CC(C)N(Cc1nnc(-c2cccc([N+](=O)[O-])c2)o1)C(=S)Nc1ccccc1-c1ccccc1 750987377 POIYFPDQCCHHQU-UHFFFAOYSA-N 473.558 5.919 5 20 JKBD Cc1onc(-c2ccccc2Cl)c1C(=O)O[C@H](C)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl 763060700 XDKVDSKBVDGFBE-LLVKDONJSA-N 464.261 5.049 5 20 JKBD O=C(Nc1ccccc1C(=O)NCc1coc(-c2cccs2)n1)c1ccc([N+](=O)[O-])cc1Cl 841879111 YINKNQYZGAMZQF-UHFFFAOYSA-N 482.905 5.147 5 20 JKBD Cc1cc[n+](/C(C(=S)Nc2ccccc2C(F)(F)F)=C(/O)c2ccc(C)c([N+](=O)[O-])c2)cc1 912791410 MBSMWZCNPLCSTE-UHFFFAOYSA-O 474.484 5.841 5 20 JKBD O=C(COC(=O)c1c(Cl)cc(C(F)(F)F)cc1Cl)Nc1ccc(Cl)cc1[N+](=O)[O-] 919296216 IFIJCKSLINYCJM-UHFFFAOYSA-N 471.602 5.369 5 20 JKBD Cc1ccc(NC(=O)c2ccc(Br)c([N+](=O)[O-])c2)c(-c2nc3ccccc3[nH]2)c1 920245490 UWTRZOMFJJICTQ-UHFFFAOYSA-N 451.280 5.461 5 20 JKBD C[C@H](OC(=O)c1ccc(N[C@@H](C)c2ccccn2)c([N+](=O)[O-])c1)C(=O)N1c2ccccc2CC[C@H]1C 920546476 YLDTWYSIISYCPT-QYZOEREBSA-N 488.544 5.076 5 20 JKBD CC[C@H](C)CC(=O)NC1(c2ccc(NC(=O)Cn3ccc4ccc([N+](=O)[O-])cc43)cc2)CCC1 1786275407 HHKMHCRSHMFDCT-SFHVURJKSA-N 462.550 5.120 5 20 JKBD C[C@@H](C(=O)NC1(c2ccc(NC(=O)c3cc4cc([N+](=O)[O-])ccc4s3)cc2)CCC1)C1(O)CCC1 1791008575 KPAPHULHUTUJQZ-INIZCTEOSA-N 493.585 5.108 5 20 JKBD O=C(/C=C/c1ccc(O)cc1Cl)Nc1ccc(C2(NC(=O)c3ccc([N+](=O)[O-])o3)CCC2)cc1 1791521724 PGVARRWKKPCWRB-XCVCLJGOSA-N 481.892 5.008 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)Nc1cc([C@@H]2CCCCN2C(=O)C23CCC(CC2)CC3)[nH]n1 1821285408 DDEOBAXMPHBSMS-RDEMWXPNSA-N 483.544 5.042 5 20 JKBD CC(C)c1ccc(CC(=O)Nc2cc([C@@H]3CCCCN3C(=O)c3cc(F)cc([N+](=O)[O-])c3)[nH]n2)cc1 1822138004 ICXDPUSZLSBYMD-QHCPKHFHSA-N 493.539 5.129 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)N1CCC([C@H]2CCCCN2C(=O)/C=C/c2ccsc2)CC1 1825302366 KYMRFLMNRWNGIM-QNBZTBGESA-N 485.581 5.051 5 20 JKBD Cc1nc(C(=O)N2CCCC[C@H]2C2CCN(C(=O)c3cc4cc([N+](=O)[O-])ccc4s3)CC2)cs1 1826130014 XQHNLQFWYZFSBJ-FQEVSTJZSA-N 498.630 5.122 5 20 JKBD O=C([C@@H]1CCc2cccc(Cl)c21)N1CC2(CCCN2C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)C1 1845739600 RDNNWOVSNBEHKD-GOSISDBHSA-N 495.988 5.010 5 20 JKBD COc1cc(-c2nnc(SCc3ccc([N+](=O)[O-])cc3)n2-c2ccccc2F)cc(OC)c1OC 8622113 VBBKNKDBLBODOY-UHFFFAOYSA-N 496.520 5.300 5 20 JKBD CC(=O)CCc1ccc2oc(C(=O)O[C@@H](C)C(=O)Nc3ccc([N+](=O)[O-])cc3Cl)c(C)c2c1 8807208 ZVDVUVBCWSXUMI-AWEZNQCLSA-N 472.881 5.008 5 20 JKBD CSc1ccc(C(=O)c2ccccc2C(=O)OCC(=O)Nc2ccc(C)cc2Cl)cc1[N+](=O)[O-] 10155097 ATXYWMPXLRRTAK-UHFFFAOYSA-N 498.944 5.305 5 20 JKBD CCN(CC(=O)Nc1c(Cl)cccc1Cl)C(=O)c1cc2cc([N+](=O)[O-])ccc2s1 12483790 XXTDHKBXAXAEET-UHFFFAOYSA-N 452.319 5.217 5 20 JKBD Cc1ccc(NC(=O)[C@H](Sc2nnc(-c3ccc(F)cc3)o2)c2ccccc2)c([N+](=O)[O-])c1 12677814 HJGLCYYEMGIUSQ-HXUWFJFHSA-N 464.478 5.564 5 20 JKBD CCOc1ccc([C@H](CNC(=O)c2ccc(NC)c([N+](=O)[O-])c2)c2c[nH]c3ccccc23)cc1OC 16176662 PJAIIWFTXGGVLI-FQEVSTJZSA-N 488.544 5.087 5 20 JKBD C[C@@H](OC(=O)/C=C/c1cc(C(F)(F)F)ccc1Cl)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 17726573 IRPUSJBJVAWFID-VCFDLTMXSA-N 467.787 5.635 5 20 JKBD Cc1cccc(NC(=O)[C@@H](C)OC(=O)c2ccccc2C(=O)c2ccc(Cl)c([N+](=O)[O-])c2)c1C 22669795 GGMWAJHDLSXKRM-MRXNPFEDSA-N 480.904 5.280 5 20 JKBD COc1ccc(CSc2nnc(S[C@H](C)C(=O)Nc3cc([N+](=O)[O-])ccc3Cl)s2)cc1 23555541 QNNVWVITZZWESD-LLVKDONJSA-N 497.023 5.520 5 20 JKBD O=C(COc1cc(Cl)ccc1[N+](=O)[O-])c1cc(Br)sc1Br 49918393 ODKDUZJHWRSGQF-UHFFFAOYSA-N 455.511 5.096 5 20 JKBD Cc1ccc(-n2c(SCC(=O)Nc3ccc(Cl)cc3[N+](=O)[O-])nnc2-c2ccccn2)c(C)c1 68728078 QCQUUCGISCMNMW-UHFFFAOYSA-N 494.964 5.239 5 20 JKBD COc1cccc([C@H](CNc2ccc([N+](=O)[O-])c3cnccc23)c2c[nH]c3ccccc23)c1OC 104733165 IGLGOFZSLHGJGA-NRFANRHFSA-N 468.513 5.886 5 20 JKBD COc1cc(C(=O)Nc2ccc3oc(C(C)C)nc3c2)c([N+](=O)[O-])cc1OCc1cscn1 108906892 QPBDWJLYTYCLEO-UHFFFAOYSA-N 468.491 5.156 5 20 JKBD COc1ccc([C@@H](CNC(=O)CSc2ccc([N+](=O)[O-])cc2)c2c[nH]c3ccccc23)cc1 139822927 IEFKNKWGDPDHDL-JOCHJYFZSA-N 461.543 5.125 5 20 JKBD COc1ccccc1CC1CCN(C(=O)c2ccc(N[C@H](C)c3ccccn3)c([N+](=O)[O-])c2)CC1 303120593 IIWCSGNIJJFQIG-LJQANCHMSA-N 474.561 5.266 5 20 JKBD Cc1nc([N+](=O)[O-])cn1CCC(=O)N(Cc1ccccc1)c1nc2c(C(C)C)cccc2s1 488374345 RQQRFWJSRROYAM-UHFFFAOYSA-N 463.563 5.456 5 20 JKBD Cc1cc(CNC(=O)c2c3c(nc4ccccc24)/C(=C\c2cccc([N+](=O)[O-])c2)CCC3)on1 496613507 VINSKCKLOFRLBR-AQTBWJFISA-N 454.486 5.246 5 20 JKBD Cc1c(NC(=O)[C@@H](C)Oc2ccc(Cl)cc2[N+](=O)[O-])cccc1C(=O)Nc1ccccc1 498464003 NIYMABBGUBXFKX-OAHLLOKOSA-N 453.882 5.215 5 20 JKBD COc1cc(C(=O)N(Cc2ccccc2C(F)(F)F)C2CC2)c([N+](=O)[O-])cc1OC(F)F 499141967 NZQXIUHATRNXPA-UHFFFAOYSA-N 460.355 5.028 5 20 JKBD O=C(Nc1cccc(NC(=O)c2ccc(NCc3ccccc3Cl)c([N+](=O)[O-])c2)c1)c1ccoc1 499531955 VEZIVOAIKQGMEQ-UHFFFAOYSA-N 490.903 5.958 5 20 JKBD CCc1cc(O)nc(-c2cccc(NC(=O)c3cc([N+](=O)[O-])ccc3Oc3ccccc3)c2)n1 500349091 XZFRJVGHFMEKET-UHFFFAOYSA-N 456.458 5.364 5 20 JKBD COc1ccc(CN[C@H](C)c2cccc(N3CCCC3=O)c2)cc1OCc1ccc([N+](=O)[O-])cc1 507902884 LCUDLHNZACAVQQ-LJQANCHMSA-N 475.545 5.160 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Br)[C@H](N[C@@H]1CCc2cc(F)ccc21)c1ccccc1 513182564 HDVNXOBRTUSOEA-IFMALSPDSA-N 484.325 5.453 5 20 JKBD O=[N+]([O-])c1cc2c(O)ncnc2cc1NC[C@H](c1ccc(Cl)cc1)N1CCc2sccc2C1 515550418 KPTLMESXBMABQY-OAQYLSRUSA-N 481.965 5.170 5 20 JKBD O=C(c1ccc(Sc2nc3ccccc3s2)c([N+](=O)[O-])c1)N1CCCN(CC(F)(F)F)CC1 519993598 AAEZLHXTUVOWEW-UHFFFAOYSA-N 496.536 5.066 5 20 JKBD O=C(NCc1ccc(-c2nc3ccccc3[nH]2)cc1)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-] 521785125 PHNWBWMZMMVXRI-UHFFFAOYSA-N 470.407 5.009 5 20 JKBD COc1ccc(CC[C@@H]2CCCCN2C(=O)[C@@H](C)Sc2ccc([N+](=O)[O-])cc2)cc1OC 522368763 DEMUVMXBSWXGCR-MJGOQNOKSA-N 458.580 5.107 5 20 JKBD Cc1cc(C(=O)N2CCC[C@H]2C(=O)Nc2ccc(N[C@@H](C)c3ccccc3)cc2)ccc1[N+](=O)[O-] 523288489 VNFWIUMZDBAUMV-DFBJGRDBSA-N 472.545 5.320 5 20 JKBD C[C@@H]1CCCN(c2ccc(C(=O)N3CCC[C@H]3c3nc4ccccc4s3)cc2[N+](=O)[O-])C1 598675168 UHJJZJBQSAARJL-UZLBHIALSA-N 450.564 5.418 5 20 JKBD O=C(c1ccc(NCc2ccccc2Cl)c([N+](=O)[O-])c1)N(Cc1cccnc1)Cc1ccco1 602220896 FVEBZTAEASQENF-UHFFFAOYSA-N 476.920 5.691 5 20 JKBD O=[N+]([O-])c1cccc(-c2noc(CSc3nnc(-c4ccccc4)n3-c3ccccc3)n2)c1 603562531 RXNOFQOETIHTMS-UHFFFAOYSA-N 456.487 5.185 5 20 JKBD Cc1cc(C)c(NC(=O)CN[C@@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2ccccc2)c(C)c1 603744581 TZRMOWCSPNKXAO-XMMPIXPASA-N 480.952 5.082 5 20 JKBD CCNC(=O)c1ccc(NC(=O)c2ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])cc2)c(C)c1 603993348 QRGUNJGOWARJKS-UHFFFAOYSA-N 453.882 5.351 5 20 JKBD Cn1c(C(=O)Nc2ccccc2OCc2ncc(-c3cccc(Cl)c3)o2)ccc1[N+](=O)[O-] 608850843 LWJRAHROITYRSI-UHFFFAOYSA-N 452.854 5.073 5 20 JKBD O=C(C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)Nc1ccc(-n2ccnn2)cc1 608874592 PWZCWNNPVXMINS-OBGWFSINSA-N 482.525 5.355 5 20 JKBD COc1ccc(CC(=O)Nc2sc(-c3ccccc3)c(C)c2C(=O)N2CCCCC2)cc1[N+](=O)[O-] 609010057 PUHMUQXRZSFCGJ-UHFFFAOYSA-N 493.585 5.448 5 20 JKBD O=C(c1ccc(CNCc2ccc(-c3ccc([N+](=O)[O-])cc3Br)o2)cc1)N1CCCC1 726607065 NTMRSYSZBAJYEY-UHFFFAOYSA-N 484.350 5.143 5 20 JKBD COC(=O)Nc1cc(NC(=O)c2ccccc2NC(=O)c2ccc([N+](=O)[O-])cc2Cl)ccc1F 727403556 GVPBBNPFBFXBED-UHFFFAOYSA-N 486.843 5.070 5 20 JKBD C[C@H](OC(=O)/C=C\c1cccc(OC2CCCC2)c1)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 727887186 QCCYQMMLNJQXPA-LMRWQKIVSA-N 492.450 5.519 5 20 JKBD CCOc1ccc(-c2nc(CC(=O)O[C@H](C)c3nnc(-c4ccc([N+](=O)[O-])cc4)o3)cs2)cc1 914631267 XXPPDXSRIQZGTK-CQSZACIVSA-N 480.502 5.014 5 20 JKBD O=C(Nc1ccccc1Cl)C(=Cc1csc([N+](=O)[O-])c1)C(=O)Nc1ccccc1Cl 917144629 JRGPVGCEUJVREN-UHFFFAOYSA-N 462.314 5.624 5 20 JKBD C[C@@H](NC(=S)/C(=C(/O)c1cccc([N+](=O)[O-])c1)[n+]1ccc(C(C)(C)C)cc1)c1ccccc1 917612400 JJHFUAOHDDVYPD-GOSISDBHSA-O 462.595 5.742 5 20 JKBD O=C(/C=C\c1cc(Br)ccc1F)N(Cc1ccccc1[N+](=O)[O-])CC(F)(F)F 918611587 GSCATNHUVCLKDJ-YVMONPNESA-N 461.209 5.101 5 20 JKBD Cc1cccc(OC[C@@H](C)NC(=O)c2ccccc2NC(=O)c2ccc([N+](=O)[O-])cc2Cl)c1 919853907 VJNKYXUEAISMPE-MRXNPFEDSA-N 467.909 5.006 5 20 JKBD O=C(Cc1csc(NC(=O)c2ccccc2)n1)Oc1ccc(-c2ccccc2)cc1[N+](=O)[O-] 920329246 DHXRXANRDRQKDS-UHFFFAOYSA-N 459.483 5.119 5 20 JKBD C[C@H](Nc1ccc(C(=O)OCc2nnc(-c3ccc(Cl)cc3)o2)cc1[N+](=O)[O-])c1ccccn1 920546576 KZDMEMHLZFHJEI-AWEZNQCLSA-N 479.880 5.223 5 20 JKBD Cc1ccc2[nH]cc(CC(=O)Nc3ccc(C4(NC(=O)c5ccc(O)c([N+](=O)[O-])c5)CCC4)cc3)c2c1 1786780426 HKWWNAGGGZUKHY-UHFFFAOYSA-N 498.539 5.081 5 20 JKBD COc1ccc(Cl)cc1C(=O)NC1(c2ccc(NC(=O)c3cc(C)c([N+](=O)[O-])cn3)cc2)CCC1 1788766637 MPODEAYUAJRYLL-UHFFFAOYSA-N 494.935 5.022 5 20 JKBD CC1=CC[C@H](C(=O)Nc2cc([C@H]3CCCCN3C(=O)c3cc4cc([N+](=O)[O-])ccc4s3)[nH]n2)CC1 1818809337 XTKIOBOWRJYYNM-OXJNMPFZSA-N 493.589 5.585 5 20 JKBD CC(C)Cc1ccc(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)/C=C/c3ccc([N+](=O)[O-])o3)[nH]n2)cc1 1821248316 QZGLZHYLHOODGC-YUAYGMJFSA-N 491.548 5.129 5 20 JKBD Cc1oc(C(C)(C)C)cc1C(=O)N1CCC([C@H]2CCCCN2C(=O)/C=C/c2ccc([N+](=O)[O-])o2)CC1 1824274906 PNEFMLINCGMWTI-DQACCSDVSA-N 497.592 5.333 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)N1CCC([C@H]2CCCCN2C(=O)[C@H]2CCCCC2(F)F)CC1 1824647782 GLLBGGNFUQWAKU-WIYYLYMNSA-N 495.542 5.101 5 20 JKBD O=C(/C=C/c1ccc([N+](=O)[O-])o1)N1CCC([C@@H]2CCCCN2C(=O)c2cccc3ccccc23)CC1 1828008053 XAHVESBENNXANN-BVYAJCBJSA-N 487.556 5.288 5 20 JKBD O=C(/C=C/c1ccccc1[N+](=O)[O-])N1CCC([C@@H]2CCCCN2C(=O)c2ccc(Cl)c(F)c2)CC1 1830486607 HPCSITJDSUYXKG-NMXNWIABSA-N 499.970 5.334 5 20 JKBD Cc1cc(F)c(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)CCc3cccc([N+](=O)[O-])c3)CC2)cc1F 1832622476 CPBFKXOHRHMPFE-RUZDIDTESA-N 499.558 5.048 5 20 JKBD CCOc1cc2c(cc1NC(=O)CSc1ccc(C(F)(F)F)cc1[N+](=O)[O-])O[C@@H](C)C2 16302784 TXKJNJXDNNJJDX-NSHDSACASA-N 456.442 5.067 5 20 JKBD CCCCCn1c(S[C@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)nc2cc(Cl)ccc2c1=O 17728091 VOLODYNPODJCNC-CQSZACIVSA-N 499.980 6.052 5 20 JKBD C[C@@H](Sc1nn(-c2ccc(Cl)cc2)c(=S)s1)C(=O)Nc1ccccc1[N+](=O)[O-] 21741647 XQJKZZGJDWWEPO-SNVBAGLBSA-N 452.970 5.344 5 20 JKBD O=C(OCc1nnc(-c2ccc([N+](=O)[O-])cc2)o1)c1cc(-c2cccs2)nc2ccccc12 28614427 SFOUVCWOXPCAEI-UHFFFAOYSA-N 458.455 5.279 5 20 JKBD O=[N+]([O-])c1ccc(-c2nnc(CSc3nc4ccccc4n3CCc3ccccc3)o2)cc1 28614817 SGYBFSXQWNXWII-UHFFFAOYSA-N 457.515 5.530 5 20 JKBD O=C(Cn1c2ccccc2c(=O)c2ccccc21)N(Cc1ccc(C(F)(F)F)cc1)C1CC1 30300460 IXYWRJKDQBWLDF-UHFFFAOYSA-N 450.460 5.365 5 20 JKBD O=C(Cn1c2ccccc2c(=O)c2ccccc21)NCc1ccc(OCc2cccc(F)c2)cc1 31312688 FGPCTGJEGRERBK-UHFFFAOYSA-N 466.512 5.189 5 20 JKBD COc1ccc([C@H]2[C@@H](C(=O)Nc3cc([N+](=O)[O-])ccc3C)CCC(=O)N2c2ccc(OC)cc2)cc1 36774298 OFDYNUWQVXOAMF-OZXSUGGESA-N 489.528 5.043 5 20 JKBD CCOc1ccc([C@@H](C)NC(=O)C2CCN(c3ccc(C(F)(F)F)cc3[N+](=O)[O-])CC2)cc1OC 46623794 DUGCXNWPCDXOBL-OAHLLOKOSA-N 495.498 5.115 5 20 JKBD CN(Cc1cn(-c2ccccc2)nc1-c1ccccc1)C(=O)Cn1c2ccccc2c(=O)c2ccccc21 105447254 GHAGEQMUJFHHMJ-UHFFFAOYSA-N 498.586 5.666 5 20 JKBD Cc1ccc(NC(=O)c2c[nH]c3ccc([N+](=O)[O-])cc23)cc1S(=O)(=O)Nc1ccccc1Cl 109885801 ANMVVMDZFQBQOF-UHFFFAOYSA-N 484.921 5.091 5 20 JKBD C[C@@H](Nc1ccc(C(=O)N[C@@H]2CCCc3cc(OC(F)F)ccc32)cc1[N+](=O)[O-])c1ccccn1 302973696 IZXXXECEDVWYTI-QVKFZJNVSA-N 482.487 5.572 5 20 JKBD Cc1sc(NC(=O)CSCc2cc(-c3cccs3)on2)nc1-c1cccc([N+](=O)[O-])c1 488674372 UDGZWVJLCLZUOJ-UHFFFAOYSA-N 472.573 5.615 5 20 JKBD Cc1cc(NC(=O)c2cc([N+](=O)[O-])ccc2Oc2ccccc2)ccc1NC(=O)c1ccco1 490129754 SYLKTSGVPKMXSS-UHFFFAOYSA-N 457.442 5.793 5 20 JKBD Cn1c(SCC(=O)N(Cc2ccccc2)Cc2ccco2)nc2cc3ccccc3cc2c1=O 505776202 IOFFRSTUFAMRKP-UHFFFAOYSA-N 469.566 5.001 5 20 JKBD COc1cc(CNCc2csc(-c3ccccc3)n2)ccc1OCc1ccc([N+](=O)[O-])cc1 507951546 ROABKZZNMFWRCV-UHFFFAOYSA-N 461.543 5.596 5 20 JKBD COc1ccc(CCCNC(=O)C/C(=C/c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)cc1 511640192 ONCHAZPGQWDANJ-FXBPSFAMSA-N 487.581 5.893 5 20 JKBD COc1cc(C(=O)N(Cc2ccccc2)[C@H](C)C2CC2)c([N+](=O)[O-])cc1OCc1cscn1 512663558 NFXSLJKRXUIPCB-MRXNPFEDSA-N 467.547 5.080 5 20 JKBD CCCC(=O)Nc1cccc(NC(=O)CCNc2ccc(C(F)(F)F)cc2[N+](=O)[O-])c1C 518661052 SMORDKZXMVKNCA-UHFFFAOYSA-N 452.433 5.101 5 20 JKBD COc1ccc([C@H](Cc2ccc(F)cc2)N[C@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)cc1 520627533 RKIAXECUYFKXCH-CMJOXMDJSA-N 471.916 5.297 5 20 JKBD CCOc1cc(CNCc2ccccc2Cl)ccc1OCc1cc([N+](=O)[O-])cc2c1OCOC2 520933232 VKVQLYNBLKIMOH-UHFFFAOYSA-N 484.936 5.382 5 20 JKBD CC(C)c1noc(CCCNC(=O)C/C(=C/c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)n1 522036910 VVWKWYYVXJPDCH-JXAWBTAJSA-N 491.573 5.391 5 20 JKBD CC(C)(Cc1ccc(Br)cc1)NC(=O)Cn1c2ccccc2c(=O)c2ccccc21 524056960 OILRCNJXAMEPRG-UHFFFAOYSA-N 463.375 5.055 5 20 JKBD CC(=O)N(c1ccc(F)cc1)c1nc(/C=C(\c2ccncc2)c2ccc([N+](=O)[O-])cc2)cs1 603945542 FCSGRFLQYHNODK-UCQKPKSFSA-N 460.490 5.859 5 20 JKBD O=C([C@@H]1CCCN(c2nc3ccccc3s2)C1)N(Cc1ccccc1[N+](=O)[O-])CC(F)(F)F 604242903 LYYDDXZZIDWKAM-MRXNPFEDSA-N 478.496 5.012 5 20 JKBD Cc1ccc(NC(=O)c2ccccc2)cc1NC(=O)Cn1c2ccccc2c(=O)c2ccccc21 611974359 RFGKOHPRZDGNHG-UHFFFAOYSA-N 461.521 5.354 5 20 JKBD Cc1cc[n+](/C(C(=S)Nc2ccccc2-c2ccccc2)=C(/O)c2ccc([N+](=O)[O-])cc2)cc1 725763317 JOEZRNAYAYWYTI-UHFFFAOYSA-O 468.558 6.181 5 20 JKBD CCn1c(COC(=O)c2ccc(N[C@H](C)c3ccccn3)c([N+](=O)[O-])c2)nc2c(F)cccc21 728625244 ZAQCYOJFIZFAKV-OAHLLOKOSA-N 463.469 5.029 5 20 JKBD O=C(Nc1ccc(Cn2cnc3ccccc32)cc1)c1cc([N+](=O)[O-])ccc1N1CCCCC1 746387152 FBZSKDYIEYMIRJ-UHFFFAOYSA-N 455.518 5.235 5 20 JKBD Cc1c(C(=O)Nc2nc(-c3ccc(OC(F)F)cc3)cs2)cc([N+](=O)[O-])c(C)c1[N+](=O)[O-] 748618942 ZHRIOWNONWLSRX-UHFFFAOYSA-N 464.406 5.097 5 20 JKBD Cc1onc(-c2c(Cl)cccc2Cl)c1C(=O)OCC1CCN(c2ccc([N+](=O)[O-])cn2)CC1 750427057 JSPMQUFVCKUROG-UHFFFAOYSA-N 491.331 5.333 5 20 JKBD Cc1cc(SC(C)(C)C)ccc1NC(=O)c1cc([N+](=O)[O-])ccc1I 751252569 PZVSKIMNHPUULL-UHFFFAOYSA-N 470.332 5.651 5 20 JKBD Cc1nc2ccccc2c(-c2ccccc2)c1CC(=O)O[C@H](C)C(=O)Nc1cccc([N+](=O)[O-])c1C 855747588 PGLRIRDOWSYKDW-LJQANCHMSA-N 483.524 5.540 5 20 JKBD CC(C)c1cccc(NC(=O)COC(=O)c2ccc(N[C@@H](C)c3ccccn3)c([N+](=O)[O-])c2)c1 920543653 HDJDNZVVVVVGHZ-KRWDZBQOSA-N 462.506 5.082 5 20 JKBD Cc1cc(C(=O)NC2(c3ccc(NC(=O)[C@H](C)Sc4cccs4)cc3)CCC2)ncc1[N+](=O)[O-] 1789416962 ATUBGSKKYXQVTF-INIZCTEOSA-N 496.614 5.288 5 20 JKBD O=C(/C=C/c1cc2ccccc2o1)NC1(c2ccc(NC(=O)c3ccc([N+](=O)[O-])[nH]3)cc2)CCC1 1790186429 SJJRQKHODQUCQV-JLHYYAGUSA-N 470.485 5.130 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)c3ccc4occc4c3)CCC2)cc1)c1cc(O)cc([N+](=O)[O-])c1 1790756286 XCEPDYYZNWHKPE-UHFFFAOYSA-N 471.469 5.108 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)c3cc(F)cc([N+](=O)[O-])c3)CCC2)cc1)c1ccc(-c2ncc[nH]2)cc1 1792154829 RIBYXDKDDAVXHG-UHFFFAOYSA-N 499.502 5.186 5 20 JKBD CC[C@H](C)[C@@H](C(=O)N1CCCC2(CCN(C(=O)c3ccc([N+](=O)[O-])cc3F)CC2)C1)c1ccccc1 1809161980 IOYJGMJPMOXWBA-NBGIEHNGSA-N 495.595 5.409 5 20 JKBD CCCCC[C@H](C)C(=O)NC[C@@H]1CCN(C(=O)CSc2ccccc2[N+](=O)[O-])[C@@H]1c1cccnc1 1812699624 BDOOEWRZVCNIMC-QYXIYQDXSA-N 498.649 5.004 5 20 JKBD O=C(/C=C/c1ccccc1[N+](=O)[O-])N1CCC([C@@H]2CCCCN2C(=O)c2ccnc3ccccc23)CC1 1828002339 FVSWWHVATFFOOX-JYSHFMIGSA-N 498.583 5.090 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)N1CCCC[C@@H]1C1CCN(C(=O)[C@@H]2CCc3ccccc32)CC1 1830729763 XDSRABAHQQJBGQ-RCZVLFRGSA-N 493.579 5.006 5 20 JKBD CCCCC[C@H](C)C(=O)N1CCC([C@H]2CCCCN2C(=O)Cc2cc(F)ccc2[N+](=O)[O-])CC1 1832889355 WACFMTHKHLVKPF-WMZHIEFXSA-N 475.605 5.113 5 20 JKBD CC(=O)N(c1ccc(C)c(C)c1)c1nc(COC(=O)c2ccc(N3CCCC3)c([N+](=O)[O-])c2)cs1 10733530 ZAEKAHIAZKYDIY-UHFFFAOYSA-N 494.573 5.310 5 20 JKBD O=C(c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1)N1CCC[C@@H](c2nnc3n2CCCCC3)C1 11547176 PWLIGSQVUSDEOI-GOSISDBHSA-N 495.967 5.378 5 20 JKBD COCCN(C(=O)COc1c(Cl)cccc1Cl)c1nc(-c2ccc([N+](=O)[O-])cc2)cs1 14790482 JBPGQVWAMAZBLI-UHFFFAOYSA-N 482.345 5.084 5 20 JKBD COc1cc2nc(/C(Cl)=C/c3ccc(-c4ccc([N+](=O)[O-])cc4)o3)nc(O)c2cc1OC 16385253 POIJTOAHUQHQPV-SXGWCWSVSA-N 453.838 5.258 5 20 JKBD Cc1cccc(-c2nnc(S[C@H](C)c3nnc(-c4ccc([N+](=O)[O-])cc4)o3)n2Cc2ccco2)c1 17708701 CKBLFMSCPSETHU-MRXNPFEDSA-N 488.529 5.706 5 20 JKBD CC(=O)N(c1ccc(C)c(C)c1)c1nc(COC(=O)c2cc([N+](=O)[O-])ccc2N2CCCC2)cs1 26642512 UKMWHTOSKVXPTL-UHFFFAOYSA-N 494.573 5.310 5 20 JKBD CC(C)OCc1ccccc1CN[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1 28340834 OHGFOMUSYKNNRH-DEOSSOPVSA-N 467.953 5.643 5 20 JKBD CCc1nnc(NC(=O)C/C(=C\c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)s1 96536829 BJSFZFCNCBOBSN-SDNWHVSQSA-N 451.533 5.188 5 20 JKBD CCn1cc(NC(=O)c2c3c(nc4ccccc24)/C(=C\c2cccc([N+](=O)[O-])c2)CCC3)ccc1=O 486922493 BHZBKBHWEPKCNZ-CYVLTUHYSA-N 480.524 5.454 5 20 JKBD CC(C)(C)c1ccc(C(=O)N(Cc2nnc(-c3ccc(Cl)cc3)o2)C2CC2)cc1[N+](=O)[O-] 490744293 JJZCWKONBKFASM-UHFFFAOYSA-N 454.914 5.401 5 20 JKBD Cc1ccc(-c2nnc3n2CCCCC3)cc1NC(=O)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-] 493992996 FXYMFMLWSZOWHC-UHFFFAOYSA-N 489.454 5.082 5 20 JKBD O=C(CSc1ccc(C(F)(F)F)cc1[N+](=O)[O-])N1CCCC[C@H]1c1nc(-c2ccccc2)no1 505333048 ZKNLYNSXLYLPSP-INIZCTEOSA-N 492.479 5.510 5 20 JKBD CC(=O)Nc1ccc(NC(=O)c2ccc(N[C@H](C)c3ccccn3)c([N+](=O)[O-])c2)cc1Cl 506074296 ZRSNKJVFQQGASU-CYBMUJFWSA-N 453.886 5.027 5 20 JKBD O=C(Cc1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1)N1CCC[C@@H]1c1cccs1 506960283 BIJXSSZVZRBQTH-JOCHJYFZSA-N 458.543 5.415 5 20 JKBD C[C@@H](Nc1ccc(C(=O)N(C)c2ccc(Br)cc2Cl)cc1[N+](=O)[O-])c1ccccn1 508155933 CCNQNQQLCHRARU-CYBMUJFWSA-N 489.757 5.855 5 20 JKBD Cc1c(Cl)cccc1-n1c(SCC(=O)c2ccc([N+](=O)[O-])cc2)nnc1-c1ccncc1 513767735 MXHIDBRKSMQOBD-UHFFFAOYSA-N 465.922 5.174 5 20 JKBD O=C(C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)NCc1ccc2ccccc2n1 514502464 IEWMTULHNGRWOB-HMMYKYKNSA-N 480.549 6.000 5 20 JKBD C[C@H](NC(=O)Cn1c2ccccc2c(=O)c2ccccc21)c1cccc(OCc2ccccn2)c1 515613800 VBMUEQDSLMTPFX-FQEVSTJZSA-N 463.537 5.006 5 20 JKBD C[C@H]1CCN(C(=O)c2ccn(-c3cccc([N+](=O)[O-])c3)n2)c2cc(C(F)(F)F)ccc2S1 515703094 GIYVEXFMQGJUKW-ZDUSSCGKSA-N 462.453 5.330 5 20 JKBD O=[N+]([O-])c1ccc(-c2ccc(CN[C@H](c3ccc(F)cc3)[C@@H]3CCCO3)o2)c(Br)c1 517553186 UOHXVDAKZDVCFZ-FCHUYYIVSA-N 475.314 5.766 5 20 JKBD C[C@@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)Nc1ccc(=O)n(Cc2ccc(Cl)c(Cl)c2)c1 520097748 SEBXGZGSQRANAU-GFCCVEGCSA-N 496.734 5.171 5 20 JKBD Cc1cc(C(=O)Nc2ccc(NS(=O)(=O)c3c(Cl)cccc3Cl)cc2)cc([N+](=O)[O-])c1 520455241 QJMFJOYEPRZQOK-UHFFFAOYSA-N 480.329 5.263 5 20 JKBD O=C(Nc1ccc(-c2nc3ccccc3s2)cn1)c1csc(-c2ccc([N+](=O)[O-])cc2)n1 520879280 WPARAWDQMPEUTH-UHFFFAOYSA-N 459.512 5.642 5 20 JKBD Cc1ccc(C(C)C)c(Oc2ccc(CNCc3cccc(C(=O)N(C)C)c3)cc2[N+](=O)[O-])c1 521819449 JATIRGPMVUMVPF-UHFFFAOYSA-N 461.562 5.811 5 20 JKBD O=C(Cn1c2ccccc2c(=O)c2ccccc21)N1CCC[C@@H](c2nc(-c3ccc(Cl)cc3)no2)C1 523977329 KEPXNZIDSHEPJF-LJQANCHMSA-N 498.970 5.264 5 20 JKBD O=C(C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)NCc1ccc(Cl)o1 591721859 NLZXEFYBSRTGSG-PTNGSMBKSA-N 453.907 5.698 5 20 JKBD Cc1c(NC(=O)[C@H](C)Sc2nnc(COc3ccc(Cl)cc3Cl)o2)cccc1[N+](=O)[O-] 598877394 AXHFTUZSNWLOHP-NSHDSACASA-N 483.333 5.291 5 20 JKBD CCCOc1ccccc1Oc1ncccc1CNC(=O)N[C@@H](C)c1cccc([N+](=O)[O-])c1 604127475 PLQICAZBLOMJAD-KRWDZBQOSA-N 450.495 5.131 5 20 JKBD CN(C[C@@H]1CCCO[C@H]1c1ccccc1)C(=O)CCNc1ccc(C(F)(F)F)cc1[N+](=O)[O-] 604519045 GHVBAXRETVGENR-JTSKRJEESA-N 465.472 5.042 5 20 JKBD CN(Cc1nc(-c2cccc([N+](=O)[O-])c2)no1)[C@H]1CCSc2ccc(Br)cc21 609157486 VKVRKALWFGBSCM-INIZCTEOSA-N 461.341 5.076 5 20 JKBD C[C@@H](OC(=O)c1cc([N+](=O)[O-])ccc1Br)C(=O)N[C@H](C)c1ccc(Cl)cc1Cl 725984990 NIKPSAZGAOUIPR-NXEZZACHSA-N 490.137 5.087 5 20 JKBD COc1ccccc1[C@@H](C)CC(=O)O[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1 728657706 CKHQXOPJYSUNMX-UPCLLVRISA-N 482.920 5.674 5 20 JKBD Cc1nc(-c2ccc(F)cc2)sc1[C@H](C)NC(=O)c1cc([N+](=O)[O-])ccc1N1CCCC1 729419507 MNNOFIQECKTMLZ-AWEZNQCLSA-N 454.527 5.257 5 20 JKBD Cc1onc(-c2c(Cl)cccc2Cl)c1C(=O)OCC1CCN(c2ncccc2[N+](=O)[O-])CC1 749358818 LORDZILRCUZRQM-UHFFFAOYSA-N 491.331 5.333 5 20 JKBD CCCOc1ccc(-c2nc(C(=O)O[C@H](C)c3nnc(-c4ccc([N+](=O)[O-])cc4)o3)cs2)cc1 750276107 NTQQMTDCLYJFMM-CQSZACIVSA-N 480.502 5.475 5 20 JKBD CC[C@H](C)Sc1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2Br)c(C(F)(F)F)c1 751126452 ZAQPOIYYLQYRIV-JTQLQIEISA-N 477.302 6.519 5 20 JKBD Cc1c(-c2ccccc2)oc2c(C(=O)N(C)Cc3cc([N+](=O)[O-])ccc3Cl)cccc2c1=O 811478481 INXUEJKNIQVDOI-UHFFFAOYSA-N 462.889 5.602 5 20 JKBD Cc1cccc(C(C)C)c1NC(=O)[C@H](C)OC(=O)c1cc([N+](=O)[O-])ccc1N1CCCCC1 823259936 RQNPEQUTWFKNHE-SFHVURJKSA-N 453.539 5.201 5 20 JKBD Cc1ccccc1OCCCC(=O)Oc1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2Cl)cc1 871596631 WJPIAVRMJCORNF-UHFFFAOYSA-N 468.893 5.574 5 20 JKBD CN(Cc1cccc2ccccc12)C(=O)c1ccccc1NC(=O)c1ccc([N+](=O)[O-])cc1Cl 914478797 HFSNXXIFPGXGBJ-UHFFFAOYSA-N 473.916 5.926 5 20 JKBD O=C(Nc1ccc(OC[C@H](O)c2cccc(Br)c2)cc1)c1cc([N+](=O)[O-])ccc1Cl 914683767 JUVLQNYHZNHUOG-FQEVSTJZSA-N 491.725 5.375 5 20 JKBD COc1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2N2CCC(C)CC2)cc1OCC(F)(F)F 914742383 DPRZREGUSKINPC-UHFFFAOYSA-N 467.444 5.033 5 20 JKBD COc1ccc(/C=C2/N=C(SCc3cccc([N+](=O)[O-])c3C)N(c3cccc(OC)c3)C2=O)cc1 915791367 AWFVGPZXCGIIRV-OEAKJJBVSA-N 489.553 5.598 5 20 JKBD O=[N+]([O-])c1cccc(-c2nccc(/C=C\c3ccc(-c4ccc([N+](=O)[O-])cc4Cl)o3)[n+]2[O-])c1 915988020 PLTHVYSEOXDUOC-XQRVVYSFSA-N 464.821 5.282 5 20 JKBD CCc1cc[n+](/C(C(=S)Nc2ccc3ccccc3c2)=C(/O)c2ccc([N+](=O)[O-])cc2)cc1 917609842 GMJZYBGKJOIQEV-UHFFFAOYSA-O 456.547 5.921 5 20 JKBD COc1ccc(NC(=O)c2ccc(N[C@@H](C)c3ccccn3)c([N+](=O)[O-])c2)cc1OC1CCCC1 919710693 SQWHFKOOHTYCAA-KRWDZBQOSA-N 476.533 5.745 5 20 JKBD C[C@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)O[C@H](C)C(=O)N1c2ccccc2Sc2ccccc21 920777388 KVGGQFSKCQSMLR-CABCVRRESA-N 498.944 5.777 5 20 JKBD Cc1cnc(Cl)c(C(=O)Nc2ccc(C3(NC(=O)Cc4ccc([N+](=O)[O-])cc4F)CCC3)cc2)c1 1787568295 LAPVBQBKOKRCNJ-UHFFFAOYSA-N 496.926 5.081 5 20 JKBD Cc1ccc2cc(C(=O)Nc3ccc(C4(NC(=O)Cc5cccc([N+](=O)[O-])c5)CCC4)cc3)ccc2n1 1789030283 IUXFXSRQRRHYAQ-UHFFFAOYSA-N 494.551 5.442 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)Nc1ccc(C2(NC(=O)/C=C/c3ccco3)CCC2)cc1 1790770386 BDMZUOKJDJRADB-FMIVXFBMSA-N 463.465 5.096 5 20 JKBD Cc1c(C(=O)Nc2ccc(C3(NC(=O)[C@H]4[C@H]5SC=C[C@H]54)CCC3)cc2)cc(Cl)cc1[N+](=O)[O-] 1790774683 OIBRDYGNLPMZQP-WMQCIHAUSA-N 483.977 5.179 5 20 JKBD Cc1cc(O)c([N+](=O)[O-])cc1C(=O)Nc1ccc(C2(NC(=O)c3scnc3C3CC3)CCC2)cc1 1790806686 VFVADEOYYNXGIK-UHFFFAOYSA-N 492.557 5.004 5 20 JKBD C[C@H](C(=O)NC1(c2ccc(NC(=O)c3nc4cc([N+](=O)[O-])ccc4[nH]3)cc2)CCC1)c1ccccc1 1790828173 XDLYBSDALZUAKR-KRWDZBQOSA-N 483.528 5.023 5 20 JKBD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc(F)c1[N+](=O)[O-])c1ccc(-c2ccccc2)c(F)c1 1800532070 JLDPMJSKAQUWSV-ACDBMABISA-N 491.494 5.106 5 20 JKBD CC1(C(=O)N2CCCC3(CCN(C(=O)c4cc5cc([N+](=O)[O-])ccc5s4)CC3)C2)CCCC1 1804991213 POCITARPWMRBMY-UHFFFAOYSA-N 469.607 5.235 5 20 JKBD Cc1c(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)[C@H]3CCC[C@@H]3C)n[nH]2)cc(Cl)cc1[N+](=O)[O-] 1818958878 IKSKDHNEUIPOIY-IYJAJMOOSA-N 473.961 5.022 5 20 JKBD O=C(c1ccccc1C1CC1)N1CCC([C@H]2CCCCN2C(=O)CCc2cccc([N+](=O)[O-])c2)CC1 1824841836 CBMIVWWHXWBFIX-HHHXNRCGSA-N 489.616 5.338 5 20 JKBD C[C@@H](Sc1ccccc1)C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2ccc([N+](=O)[O-])cc2F)CC1 1830492298 BKLSNKNPBPXBMC-KOSHJBKYSA-N 499.608 5.148 5 20 JKBD Cc1ccc(-c2nnc(S[C@@H](C)C(=O)Nc3nc(-c4cccc([N+](=O)[O-])c4)cs3)o2)cc1C 10842752 KIMJRKCWIRZMDM-AWEZNQCLSA-N 481.559 5.504 5 20 JKBD CCOc1ccc(-n2c(SCC(=O)Nc3cc([N+](=O)[O-])ccc3F)nnc2-c2ccccc2)cc1 11197358 HCTKSEFZQOBVGW-UHFFFAOYSA-N 493.520 5.111 5 20 JKBD O=C(O[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1)[C@H]1Cc2cc(Cl)ccc2O1 12643536 SBNOAMUWYBTQCG-NHCUHLMSSA-N 487.295 5.128 5 20 JKBD O=C(NCCc1nc2ccccc2[nH]1)c1cc([N+](=O)[O-])ccc1Sc1ccc(Cl)cc1 12818032 KQFCQJLDXDATFD-UHFFFAOYSA-N 452.923 5.248 5 20 JKBD Cc1ccc(NC(=O)[C@H](Sc2nnc(-c3cccs3)n2C2CC2)c2ccccc2)c([N+](=O)[O-])c1 17270052 PJVFDSORTLMQKA-OAQYLSRUSA-N 491.598 6.030 5 20 JKBD COc1ccc(N2C(=O)CC[C@@H](C(=O)Nc3cccc([N+](=O)[O-])c3C)[C@@H]2c2ccccc2OC)cc1 19164869 KFIKAKLUTHHCCR-RLWLMLJZSA-N 489.528 5.043 5 20 JKBD O=[N+]([O-])c1cc(S(=O)(=O)N(Cc2cccc3cccnc23)c2ccccc2)ccc1Cl 22134484 VSQUWTOWFPGRFS-UHFFFAOYSA-N 453.907 5.192 5 20 JKBD O=C(COC(=O)c1ccc(COc2ccc3ccccc3c2)o1)Nc1ccc([N+](=O)[O-])cc1Cl 24775066 HBCJQKLUSHDTES-UHFFFAOYSA-N 480.860 5.369 5 20 JKBD COc1cc(CN(C)C(=O)Cn2c3ccccc3c(=O)c3ccccc32)ccc1OCc1ccccc1 25281427 PSVIGKOCAYGEJX-UHFFFAOYSA-N 492.575 5.401 5 20 JKBD CC(=O)Nc1ccc(Cl)cc1NC(=O)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 72048246 OLRGVLBQMOSEEV-UHFFFAOYSA-N 484.862 5.081 5 20 JKBD Cc1cccc(COc2ccc(NC(=O)CCCn3c(=O)oc4cc([N+](=O)[O-])ccc43)c(C)c2)c1 303274411 KNVZTVXICRGEES-UHFFFAOYSA-N 475.501 5.117 5 20 JKBD C[C@@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)N[C@H](Cn1cnc2ccccc21)c1ccc(F)cc1 484051113 WMAUVJZGKRWVQB-OPAMFIHVSA-N 464.522 5.122 5 20 JKBD CN(C)[C@H](CNC(=O)C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)c1ccsc1 499990747 HQMKIXVDGIDQQX-OOIVEFLKSA-N 492.626 5.616 5 20 JKBD C[C@@H](Nc1ccc(C(=O)N[C@H](c2ccccc2)c2ccc(F)cc2)cc1[N+](=O)[O-])c1ccccn1 506178430 KHLHKAQUYWVHFZ-WXTAPIANSA-N 470.504 5.821 5 20 JKBD Cc1nc(C)c(-c2csc(NC(=O)c3ccc(N[C@H](C)c4ccccn4)c([N+](=O)[O-])c3)n2)s1 507370490 WOYKODPYIAOFCT-GFCCVEGCSA-N 480.575 5.612 5 20 JKBD CCOc1cc(NC(=O)c2ccc([N+](=O)[O-])cc2C)c(OCC)cc1NC(=O)c1ccccc1 508893507 JOTIWXDXZCZDCL-UHFFFAOYSA-N 463.490 5.205 5 20 JKBD COCCN(Cc1ccccn1)C(=O)c1ccc(Sc2nc3ccccc3s2)c([N+](=O)[O-])c1 512068599 SEFSXJVKVHDNIY-UHFFFAOYSA-N 480.571 5.040 5 20 JKBD COc1ccc(CSc2nnc(-c3cccnc3)n2-c2ccc(Br)cc2)cc1[N+](=O)[O-] 515287940 AWRAMXRXHMHKBH-UHFFFAOYSA-N 498.362 5.301 5 20 JKBD C[C@H](Nc1ccc(C(=O)N(Cc2cscn2)c2ccccc2)cc1[N+](=O)[O-])c1ccccn1 518188649 KZBPREBDEICNNI-KRWDZBQOSA-N 459.531 5.466 5 20 JKBD CC(C)(C)n1cc(NC(=O)C/C(=C\c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)cn1 520110829 NDJSICPTZVBFBX-SFQUDFHCSA-N 461.547 5.725 5 20 JKBD O=C(NCc1cccc(CN2CCCC2=O)c1)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1 520812171 QVNTWVSXFYJYOT-UHFFFAOYSA-N 479.920 5.093 5 20 JKBD COc1cc(C(=O)NCc2ncc(-c3ccccc3)o2)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 521204176 VQCHBNMLYABAOM-UHFFFAOYSA-N 479.876 5.634 5 20 JKBD Cc1[nH]nc(NC(=O)Cc2cn(-c3ccccc3)nc2-c2ccc([N+](=O)[O-])cc2)c1-c1ccccc1 522812176 ZAAIKRKVHGVVDL-UHFFFAOYSA-N 478.512 5.327 5 20 JKBD CC(C)C(=O)N1CCC(C(=O)Nc2cc([N+](=O)[O-])ccc2Nc2cccc(C(F)(F)F)c2)CC1 603440617 LZWUXKZILVVRMB-UHFFFAOYSA-N 478.471 5.190 5 20 JKBD CC[C@@H](C)c1ccc([C@H](NC(=O)C(=O)Nc2ccc(C)c([N+](=O)[O-])c2)c2cccs2)cc1 603706233 OZQOPAMPKGFPHS-QRQCRPRQSA-N 451.548 5.323 5 20 JKBD CCO[C@H]1CCCN(C(=O)C/C(=C\c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)C1 604427857 DKQMBPNCDOYACQ-GJPUVDBCSA-N 451.548 5.163 5 20 JKBD CN(Cc1ccccc1[N+](=O)[O-])C(=O)Nc1cc(OCC(F)(F)F)cc(OCC(F)(F)F)c1 604456045 YOIOYSVSIUWRHM-UHFFFAOYSA-N 481.349 5.141 5 20 JKBD O=[N+]([O-])c1cc(CNCc2ccc(OCC(F)(F)F)nc2)ccc1Oc1ccccc1Cl 608781909 DATYLZGWYAUYBK-UHFFFAOYSA-N 467.831 5.666 5 20 JKBD CC1CCN(c2ccc(C(=O)N3CCC[C@H](c4nc(-c5cccc(F)c5)no4)C3)cc2[N+](=O)[O-])CC1 608817305 MVZQYZHMFYKKNH-FQEVSTJZSA-N 493.539 5.040 5 20 JKBD Cc1nc(-c2ccc(F)cc2)sc1[C@@H](C)NC(=O)C1CCN(c2ccccc2[N+](=O)[O-])CC1 609186394 LWXPUUOOGDKBMH-OAHLLOKOSA-N 468.554 5.260 5 20 JKBD O=C(Nc1ccc(Oc2ccnc3cc(Cl)ccc23)c(F)c1)c1cc(F)ccc1[N+](=O)[O-] 728009233 VYMRWVXXSGIMOA-UHFFFAOYSA-N 455.804 6.119 5 20 JKBD Cc1ccc2c(Cl)c(C(=O)OCCNC(=O)c3ccc([N+](=O)[O-])cc3Cl)sc2c1 729191254 WLZAQOWNWXGUCZ-UHFFFAOYSA-N 453.303 5.012 5 20 JKBD Cc1ccc(-c2nc(C)c(C(=O)O[C@@H](C)c3nnc(-c4ccc([N+](=O)[O-])cc4)o3)s2)c(C)c1 746597566 OORJEOPLKPOFDP-HNNXBMFYSA-N 464.503 5.612 5 20 JKBD C[C@H](Sc1nc2ccc([N+](=O)[O-])cc2s1)c1nc(O)c2c(-c3ccco3)csc2n1 760107617 CQQHYUAWKNEJMN-VIFPVBQESA-N 456.530 6.028 5 20 JKBD CCOc1ccc(CC(=O)O[C@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2ccccc2)cc1 780482864 BHZYBDBUKUKNNK-QHCPKHFHSA-N 468.893 5.113 5 20 JKBD CCNC(=O)N(C)c1cccc(NCc2ccc(Oc3ccccc3Cl)c([N+](=O)[O-])c2)c1 864035391 JZUZAJUFQCCGEE-UHFFFAOYSA-N 454.914 5.818 5 20 JKBD C[C@@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)OCc1cccc(C(=O)Nc2ccccc2)c1 920776923 BEFYFSPBIZSSSA-OAHLLOKOSA-N 454.866 5.011 5 20 JKBD CCSc1cccnc1C(=O)NC1(c2ccc(NC(=O)Cc3cccc([N+](=O)[O-])c3)cc2)CCC1 1785793541 FQOXLKROPHXVMB-UHFFFAOYSA-N 490.585 5.092 5 20 JKBD Cc1ccc(CC(=O)Nc2ccc(C3(NC(=O)c4cnc(Cl)s4)CCC3)cc2)cc1[N+](=O)[O-] 1790524871 SFPOCLWTQBDGNU-UHFFFAOYSA-N 484.965 5.004 5 20 JKBD COc1cc(C(=O)NC2(c3ccc(NC(=O)c4ccc5[nH]c(C)cc5c4)cc3)CCC2)ccc1[N+](=O)[O-] 1790989640 OFHAUQFQKPKMOE-UHFFFAOYSA-N 498.539 5.455 5 20 JKBD O=C(/C=C/c1ccco1)NC1(c2ccc(NC(=O)CSc3ccccc3[N+](=O)[O-])cc2)CCC1 1791521226 APYAUFYTAKNISZ-OUKQBFOZSA-N 477.542 5.127 5 20 JKBD Cc1ccc(F)cc1C(=O)N1CCCC2(CCN(C(=O)C3(c4cccc([N+](=O)[O-])c4)CCC3)CC2)C1 1805062465 VHCWRPWEXTZHEJ-UHFFFAOYSA-N 493.579 5.009 5 20 JKBD CC[C@H](C)[C@@H](C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2ccc([N+](=O)[O-])o2)n[nH]1)c1ccccc1 1814310234 SYQGYXHVEFMRIR-BTCOZLQPSA-N 479.537 5.047 5 20 JKBD Cc1ccc(C(=O)N2CCC([C@@H]3CCCCN3C(=O)Cc3cccc([N+](=O)[O-])c3)CC2)cc1Cl 1823676710 BRIYEPAUQTVVKU-DEOSSOPVSA-N 483.996 5.033 5 20 JKBD O=C(Cc1cccc([N+](=O)[O-])c1)N1CCC([C@@H]2CCCCN2C(=O)Cc2ccc3ccccc3c2)CC1 1826396288 LFOMTZWZUYNQHT-NDEPHWFRSA-N 499.611 5.153 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)N1CCCC[C@H]1C1CCN(C(=O)[C@@H](C)c2cccs2)CC1 1830728498 DLGWHVQHJROYNH-UWJYYQICSA-N 487.597 5.141 5 20 JKBD Cc1ccc(CC(=O)N2CCC([C@H]3CCCCN3C(=O)C[C@H](C)c3ccccc3)CC2)cc1[N+](=O)[O-] 1831506579 JIDPBPUKUXBPIO-BKMJKUGQSA-N 491.632 5.259 5 20 JKBD CC1(C)CCC(CC(=O)N2CC3(CCCN3C(=O)c3cc4cc([N+](=O)[O-])ccc4s3)C2)CC1 1845739387 QUPHKOXTUDDMCB-UHFFFAOYSA-N 469.607 5.233 5 20 JKBD COc1cc(C(=O)O[C@@H](C)c2nc3ccccc3c(=O)[nH]2)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 10912165 DZPBKOCIYJGIIS-ZDUSSCGKSA-N 495.875 5.204 5 20 JKBD COc1cc(C(=O)N(C)CC(=O)Nc2c(C)cccc2C)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 15473412 OZIJJYVZIVJIET-UHFFFAOYSA-N 497.935 5.377 5 20 JKBD COc1ccc(/C=C2\N=C(S[C@@H](C)c3cccc([N+](=O)[O-])c3)N(c3cccc(OC)c3)C2=O)cc1 21603725 CZLVIUYSFGHQSX-PDESAOGPSA-N 489.553 5.850 5 20 JKBD COc1ccc(-c2nnc(S[C@@H](C)C(=O)Nc3ccccc3[N+](=O)[O-])n2C2CCCCC2)cc1 21740449 CRUXBLJHVWMJKT-INIZCTEOSA-N 481.578 5.486 5 20 JKBD Cc1ccc(N2C(=O)CC[C@@H](C(=O)Nc3cc([N+](=O)[O-])ccc3F)[C@H]2c2cccs2)cc1 57564584 XFLDMDULLDKLLJ-VGSWGCGISA-N 453.495 5.227 5 20 JKBD O=C(Nc1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2Cl)c(C(F)(F)F)c1)c1ccco1 105427890 YDQLVGPTHHIRJH-UHFFFAOYSA-N 453.760 5.365 5 20 JKBD COc1cccc([C@@H](CNc2nc3sccn3c2[N+](=O)[O-])c2c[nH]c3ccccc23)c1OC 247904805 HNBFZQLBHKUHAY-QGZVFWFLSA-N 463.519 5.047 5 20 JKBD C[C@H]1CCCN(c2ccc(C(=O)Nc3ccccc3OCc3cscn3)cc2[N+](=O)[O-])C1 503509949 VUYRZGINGSTDNM-INIZCTEOSA-N 452.536 5.119 5 20 JKBD C[C@H]1CCCN(c2ccc(C(=O)Nc3ccccc3OC[C@@H]3CCCCO3)cc2[N+](=O)[O-])C1 510010637 AUYITQJSZIYARH-ICSRJNTNSA-N 453.539 5.031 5 20 JKBD COc1cc(C(=O)N(Cc2ccc(F)cc2)C2CCCCC2)c([N+](=O)[O-])cc1OCc1cscn1 512590763 RPDCIVQJDIPSQR-UHFFFAOYSA-N 499.564 5.753 5 20 JKBD C[C@@H](N[C@@H](CCc1ccccc1)c1ccccc1)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 515431933 RHROHHHKSVXUQT-VGSWGCGISA-N 471.479 5.904 5 20 JKBD Cc1c(NC(=O)CSc2ccc(C(F)(F)F)cc2[N+](=O)[O-])cccc1NC(=O)c1ccccc1 515657279 PGVACWDUPTXBMI-UHFFFAOYSA-N 489.475 5.905 5 20 JKBD O=C(C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)NCCCN1CCCCC1 516378576 HZAFQPBQKZGBJU-JZJYNLBNSA-N 464.591 5.127 5 20 JKBD CC(=O)N(c1nc(Cn2cc(-c3ccc([N+](=O)[O-])cc3)cn2)cs1)c1c(C)cc(C)cc1Cl 517797082 IYPIZJRAOOEDHT-UHFFFAOYSA-N 481.965 5.918 5 20 JKBD COCCOc1c(Cl)cccc1NC(=O)c1ccc(N[C@H](C)c2ccccn2)c([N+](=O)[O-])c1 520011022 HEGKENRXXZBGJC-OAHLLOKOSA-N 470.913 5.094 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Cl)[C@@H](Nc1cccc(COCC2CC2)c1)c1ccccc1 520468632 AYNNGQYPWFXOCX-DEOSSOPVSA-N 465.937 5.967 5 20 JKBD Cc1c(C(=O)Nc2cc([N+](=O)[O-])ccc2OC(F)F)nnn1-c1ccc(-c2ccccc2)cc1 521282308 JTUAICAFWGXQNA-UHFFFAOYSA-N 465.416 5.005 5 20 JKBD Cn1ccnc1[C@H](NCc1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1)c1cccc(F)c1 521821422 QXEWFJUPUDHVEQ-AREMUKBSSA-N 482.519 5.199 5 20 JKBD CC(C)(C)OCc1cccc(CN[C@@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2ccccc2)c1 522441253 XEKAWVZXVVUQMS-XMMPIXPASA-N 481.980 6.033 5 20 JKBD C[C@@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)N1CCC[C@@H](c2nc(-c3ccc(Cl)cc3)no2)C1 522506099 KNJLUXKZQDNIJM-GDBMZVCRSA-N 472.954 5.185 5 20 JKBD Cc1cccc([N+](=O)[O-])c1C(=O)Nc1cc(OCC(F)(F)F)cc(OCC(F)(F)F)c1 590665394 HJHUVQQNMONKMK-UHFFFAOYSA-N 452.307 5.038 5 20 JKBD Cc1nn(C)c2ncc(NC(=O)C/C(=C\c3ccc([N+](=O)[O-])cc3)c3nc4ccccc4s3)cc12 591687432 HCSPHSIABUKQJC-GZTJUZNOSA-N 484.541 5.364 5 20 JKBD COCCN(C(=O)CSCc1ccc(Cl)cc1)c1nc(-c2ccc([N+](=O)[O-])cc2)cs1 603461212 FMSOPMBDEIMPQE-UHFFFAOYSA-N 477.995 5.285 5 20 JKBD C[C@H](NC(=O)c1cccc(NC(=O)Cc2ccc(Br)cc2)c1)c1cccc([N+](=O)[O-])c1 603966874 IWQPVSGJLATKCE-HNNXBMFYSA-N 482.334 5.030 5 20 JKBD C[C@H](NC(=O)c1cccc(NC(=O)c2ccc(Br)cc2)c1)c1cccc([N+](=O)[O-])c1 603966906 LIXIDWXVABFHSD-AWEZNQCLSA-N 468.307 5.101 5 20 JKBD Cc1ccc2nc([C@H]3CCCN(C(=O)c4ccc(N[C@H](C)c5ccccn5)c([N+](=O)[O-])c4)C3)[nH]c2c1 608986982 PCPKFJSGNCWJTC-QUCCMNQESA-N 484.560 5.367 5 20 JKBD CCOc1cc(NC(=O)c2cc(-c3ccccc3)nc3c2cnn3C(C)C)c([N+](=O)[O-])cc1OCC 619213075 KMMCGCFHBZDCOH-UHFFFAOYSA-N 489.532 5.637 5 20 JKBD Cc1ccc([N+](=O)[O-])cc1C(=O)OCC(=O)Nc1c(Cl)c(Cl)cc(Cl)c1Cl 742997876 ISYLFZDCIUAHKW-UHFFFAOYSA-N 452.077 5.312 5 20 JKBD C[C@H](OC(=O)c1cc([N+](=O)[O-])ccc1N1CCCCC1)C(=O)Nc1cccc(Cl)c1Cl 823194363 DQMZHGPGHAYXGZ-ZDUSSCGKSA-N 466.321 5.076 5 20 JKBD CC(=O)CCc1ccc2oc(C(=O)N(Cc3nnc(-c4cccc([N+](=O)[O-])c4)o3)C(C)C)c(C)c2c1 864242318 BOSRBFLWQOOZCK-UHFFFAOYSA-N 490.516 5.272 5 20 JKBD COc1cc(COC(=O)c2cnc3ccccc3c2C(F)(F)F)c([N+](=O)[O-])cc1OC(F)F 875251854 SFFZIIIVXQNLKH-UHFFFAOYSA-N 472.322 5.129 5 20 JKBD CC1=C(C(=O)Nc2ccc(F)cc2)[C@H](c2ccc([N+](=O)[O-])o2)NC(=S)N1c1cccc(Cl)c1 901385435 XOBUVSFCWWEUDP-FQEVSTJZSA-N 486.912 5.329 5 20 JKBD Cc1c(I)cc([N+](=O)[O-])cc1-c1nc(-c2sccc2Br)no1 904892419 DOLKRIUFMLAHER-UHFFFAOYSA-N 492.092 5.049 5 20 JKBD O=C(CCC(=O)c1ccc(-c2ccccc2)cc1)OCc1nc(-c2cccc([N+](=O)[O-])c2)no1 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O=C(NC1(c2ccc(NC(=O)[C@H]3C[C@H]3c3ccc(Cl)cc3)cc2)CCC1)c1ccc([N+](=O)[O-])o1 1789151389 LCOHHJBNJYEPJF-PMACEKPBSA-N 479.920 5.393 5 20 JKBD Cc1ccc(C(=O)Nc2ccc(C3(NC(=O)Cn4ccc5ccc([N+](=O)[O-])cc54)CCC3)cc2)c(C)n1 1789964584 LOMQZFHQJVVGEP-UHFFFAOYSA-N 497.555 5.009 5 20 JKBD CC[C@@H](C)[C@@H](C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1c(F)ccc([N+](=O)[O-])c1C)C2)c1ccccc1 1795575133 WIGHSKSYTGXHOQ-OREFEKLXSA-N 481.568 5.124 5 20 JKBD Cc1c(C(=O)N2CCCC[C@H]2C2CCN(C(=O)c3cccc(F)c3[N+](=O)[O-])CC2)oc2ccccc12 1828128482 SNHHGFSKEXOFGQ-QFIPXVFZSA-N 493.535 5.336 5 20 JKBD CC[C@H]1CC[C@H](C(=O)N2CCCC[C@H]2C2CCN(C(=O)c3ccc([N+](=O)[O-])c(OC)c3)CC2)CC1 1831696099 YDBSMOABSUZCLF-RRPUWOKSSA-N 485.625 5.053 5 20 JKBD CC(=O)N(c1cccc(C(F)(F)F)c1)c1nc(COc2ccc([N+](=O)[O-])c(C)c2)cs1 10320440 DKGCYTXCNOWJJY-UHFFFAOYSA-N 451.426 5.642 5 20 JKBD Cc1ccc(NC(=O)[C@@H](Sc2nnc(-c3ccc(C)c(C)c3)o2)c2ccccc2)c([N+](=O)[O-])c1 10842533 YHCFAZNMOQMYHF-QFIPXVFZSA-N 474.542 6.042 5 20 JKBD Cc1cc([N+](=O)[O-])ccc1NC(=O)CSc1nnc(-c2ccc(F)cc2)n1Cc1ccccc1 23599547 XKERRDKOKHUWJM-UHFFFAOYSA-N 477.521 5.080 5 20 JKBD COc1ccc([N+](=O)[O-])cc1NC(=O)[C@@H](C)OC(=O)c1ccc(-c2nc3ccccc3s2)s1 28305188 CAQYKZFIDFNXOQ-GFCCVEGCSA-N 483.527 5.126 5 20 JKBD CC(C)CCSc1ccc(C(=O)N2CCC[C@@H](c3nnc4n3CCCCC4)C2)cc1[N+](=O)[O-] 30623584 HQXIJKWGSDZUIO-LJQANCHMSA-N 471.627 5.071 5 20 JKBD COc1ccc(Oc2ccc([N+](=O)[O-])cc2C(=O)Nc2cc(C(=O)N(C)C)ccc2Cl)cc1 33174132 OFTNRFMMJOXTFW-UHFFFAOYSA-N 469.881 5.003 5 20 JKBD C[C@@H](Sc1nnc(-c2cccs2)n1Cc1ccccc1)C(=O)Nc1cccc([N+](=O)[O-])c1 36859547 SGHPWFVQUFWTGU-OAHLLOKOSA-N 465.560 5.082 5 20 JKBD C[C@H](c1ccc(F)c(F)c1)N(C)C(=O)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 45777361 OFXPIIYNXDSFQG-CYBMUJFWSA-N 471.426 5.328 5 20 JKBD COc1cccc([C@@H](CNC(=O)N[C@H](C)c2cccc([N+](=O)[O-])c2)c2c[nH]c3ccccc23)c1OC 195559674 ZQGGCSPODGXBGP-UZUQRXQVSA-N 488.544 5.286 5 20 JKBD C[C@@H]1[C@@H](n2c(SCc3nnc(-c4ccc([N+](=O)[O-])cc4)o3)nc3ccccc3c2=O)CCC[C@H]1C 248148063 IKBVEMRYEKQUAO-XFQAVAEZSA-N 491.573 5.644 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)Nc2ccc(Sc3nc4ccccc4[nH]3)cc2)cc1SC 482330954 FERGNMYKVQAHBQ-UHFFFAOYSA-N 466.544 5.605 5 20 JKBD COc1cc([C@@H](C)NC(=O)c2ccc(NCc3ccccc3Cl)c([N+](=O)[O-])c2)cc(OC)c1OC 482544575 RMGBNNKTLPILDR-OAHLLOKOSA-N 499.951 5.377 5 20 JKBD COc1cc(C(=O)N(C)[C@@H](c2ccccc2)C(F)(F)F)c([N+](=O)[O-])cc1OCc1cscn1 485252854 CZHUJUSDBPJPRX-IBGZPJMESA-N 481.452 5.015 5 20 JKBD O=C(Nc1ccccc1CN1CCSCC1)c1ccc(NCc2ccccc2)c([N+](=O)[O-])c1 489383289 GPMUEGFKFRDWQS-UHFFFAOYSA-N 462.575 5.008 5 20 JKBD CCCNC(=O)[C@@H]1CCCN(C(=O)c2ccccc2Sc2ccc(C(F)(F)F)cc2[N+](=O)[O-])C1 495741984 LJJDVKMTWOOISP-OAHLLOKOSA-N 495.523 5.143 5 20 JKBD CC(=O)Nc1ccc(-c2csc(NC(=O)c3csc(-c4cccc([N+](=O)[O-])c4)n3)n2)c(F)c1 496398098 ZFSUPSGRRLBQTF-UHFFFAOYSA-N 483.506 5.192 5 20 JKBD COc1cc([C@H](C)NC(=O)Cn2ccc3cc([N+](=O)[O-])ccc32)ccc1OCc1ccccc1 498724431 IZTWVSDAXOWRFR-SFHVURJKSA-N 459.502 5.015 5 20 JKBD Cc1ccc(Sc2ccc(C(=O)N3CCC(C(=O)Nc4cccc(F)c4)CC3)cc2[N+](=O)[O-])cc1 505252617 AOSVBQIYGBMMIE-UHFFFAOYSA-N 493.560 5.684 5 20 JKBD CCOc1ccc([C@H]2CCCN2C(=O)c2ccc(N[C@H](C)c3ccccn3)c([N+](=O)[O-])c2)cc1 506071221 PIWNNMNSCCAMFO-HOYKHHGWSA-N 460.534 5.539 5 20 JKBD COc1cc([C@@H](C)NC(=O)N(Cc2ccc([N+](=O)[O-])cc2)C(C)C)ccc1OCc1ccccc1 509765334 XIUNMAVVRUGQGJ-HXUWFJFHSA-N 477.561 5.864 5 20 JKBD C[C@@H](NC(=O)C(=O)Nc1cc(Cl)ccc1Sc1ccccc1)c1cccc([N+](=O)[O-])c1 516049354 ZAEORUGSIIGNIB-CQSZACIVSA-N 455.923 5.215 5 20 JKBD COc1ccc(-c2ccc(CN[C@@H](C)c3cccc(NC(=O)c4ccccc4)c3)o2)c([N+](=O)[O-])c1 521816324 UZKCOIJLXZXNEI-SFHVURJKSA-N 471.513 5.967 5 20 JKBD Cc1sc(NC(=O)CCc2nnc(-c3cc4ccccc4o3)o2)nc1-c1cccc([N+](=O)[O-])c1 523584482 ZPDUHXNXCCRMCO-UHFFFAOYSA-N 475.486 5.394 5 20 JKBD O=C(C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1)N(Cc1ccsc1)c1cccnc1 523980717 SXJHZAXQASSUQS-UHFFFAOYSA-N 490.507 5.520 5 20 JKBD O=C(NCc1nccn1CC(F)(F)F)c1cc([N+](=O)[O-])ccc1Sc1ccc(Cl)cc1 524343982 KVJMAPVOKYXIIA-UHFFFAOYSA-N 470.860 5.088 5 20 JKBD COc1ccccc1OCC(=O)Nc1cccc(NCc2ccc(C(F)(F)F)cc2[N+](=O)[O-])c1 600852294 OSKQRMSWYTXRKZ-UHFFFAOYSA-N 475.423 5.252 5 20 JKBD COc1ccc(S(N)(=O)=O)cc1NCc1ccc(Oc2cc(C)ccc2C(C)C)c([N+](=O)[O-])c1 600859577 VYHVMGZYMTYROM-UHFFFAOYSA-N 485.562 5.087 5 20 JKBD COc1ccc([C@@H](CNC(=O)c2cc3cc([N+](=O)[O-])ccc3o2)c2c[nH]c3ccccc23)cc1 603779053 DVZULYDZQXTGNT-OAQYLSRUSA-N 455.470 5.393 5 20 JKBD CCC(=O)Nc1cccc(CNC(=O)c2ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])c(OC)c2)c1 603813038 LRALJHNXQQAXPX-UHFFFAOYSA-N 483.908 5.328 5 20 JKBD CCCOc1cc(NC(=O)N2CCC[C@H]2c2cccc3c2OCCO3)c([N+](=O)[O-])cc1OCCC 608993602 FHLWGLNDZZMGLX-IBGZPJMESA-N 485.537 5.313 5 20 JKBD O=C(c1ccc(NCc2ccccc2Cl)c([N+](=O)[O-])c1)N1CCCO[C@H](c2ccccc2)C1 609230293 CDQDDDNNMIGUJI-DEOSSOPVSA-N 465.937 5.464 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Cl)[C@H](NCCc1nc2ccccc2s1)c1ccccc1 610556466 GTXWQJMUCFIJIO-JOCHJYFZSA-N 466.950 5.370 5 20 JKBD CCCn1c(C)cc(-c2csc(NC(=O)Cn3c4ccccc4c(=O)c4ccccc43)n2)c1C 652103251 DWZOUMRFIHHFKJ-UHFFFAOYSA-N 470.598 5.745 5 20 JKBD Cc1cc(Br)ccc1NC(=O)N1CCN(c2ccc([N+](=O)[O-])cc2C(F)(F)F)CC1 727585261 AWWDJMPGIYEZCM-UHFFFAOYSA-N 487.276 5.039 5 20 JKBD Cc1ccc(/C(O)=C(/C(=S)Nc2cccc(Br)c2)[n+]2ccccc2)cc1[N+](=O)[O-] 747876978 KOTVBKGINLOQTI-UHFFFAOYSA-O 471.356 5.277 5 20 JKBD Cc1noc(C)c1COc1cc2ccccc2cc1C(=O)O[C@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1 775389979 VDJMKBHTNWSIAH-QGZVFWFLSA-N 489.484 5.116 5 20 JKBD CC(C)N(Cc1nnc(-c2cccc([N+](=O)[O-])c2)o1)C(=O)c1sc2cc(Cl)ccc2c1Cl 864244950 VZWMVRGHPQMMTL-UHFFFAOYSA-N 491.356 6.217 5 20 JKBD CC(C)COc1ccc(N[C@@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2C(F)(F)F)cc1Cl 914794379 ZKVRHLILUOCPQN-LBPRGKRZSA-N 459.852 5.741 5 20 JKBD C[C@@H](OC(=O)CCOc1ccc2ccccc2c1)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 914913463 YPMOIXZIDQWFQK-CQSZACIVSA-N 476.407 5.106 5 20 JKBD COc1cc2c(cc1NC(=O)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-])oc1ccccc12 915803434 CIYRXGVULVDGBW-UHFFFAOYSA-N 460.364 5.696 5 20 JKBD O=C(Cc1csc(NC(=O)c2ccccc2F)n1)Oc1ccc(-c2ccccc2)cc1[N+](=O)[O-] 920330408 CJGJDPKDLZXXJJ-UHFFFAOYSA-N 477.473 5.258 5 20 JKBD O=C(/C=C/c1ccc([N+](=O)[O-])o1)Nc1ccc(C2(NC(=O)c3cc(-c4ccccc4)on3)CCC2)cc1 1786205640 MPBRFDJTYWDIAP-ACCUITESSA-N 498.495 5.304 5 20 JKBD CC1=CC[C@H](C(=O)Nc2ccc(C3(NC(=O)c4ccc([N+](=O)[O-])cc4F)CCC3)cc2)CC1 1789115210 QJBLNCLHBDYYRC-KRWDZBQOSA-N 451.498 5.228 5 20 JKBD Cc1cccc2cc(C(=O)Nc3ccc(C4(NC(=O)c5ccc([N+](=O)[O-])o5)CCC4)cc3)[nH]c12 1789253698 IVWSKBQDXTYOTD-UHFFFAOYSA-N 458.474 5.039 5 20 JKBD O=C(CSc1ccccc1[N+](=O)[O-])NC1(c2ccc(NC(=O)c3cccc(F)c3)cc2)CCC1 1790261890 XDJOQNXYLJVRRT-UHFFFAOYSA-N 479.533 5.274 5 20 JKBD COc1cc(CC(=O)NC2(c3ccc(NC(=O)[C@@H]4C[C@@H]4c4ccccc4)cc3)CCC2)ccc1[N+](=O)[O-] 1791534336 SFICIJOVOIBVGU-DNQXCXABSA-N 499.567 5.084 5 20 JKBD Cc1ccc(CCC(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2ccc([N+](=O)[O-])cc2F)c2ccccc12 1800351792 DBYQBFJNPKSXBK-WKCHPHFGSA-N 489.547 5.080 5 20 JKBD CC1(C)CCC(CC(=O)Nc2cc([C@@H]3CCCCN3C(=O)Cc3cc([N+](=O)[O-])ccc3F)[nH]n2)CC1 1820974951 IXXVFVYMQICKJJ-QFIPXVFZSA-N 499.587 5.298 5 20 JKBD CC(C)c1ccc(CC(=O)N2CCCC[C@H]2c2cc(NC(=O)c3cccc(F)c3[N+](=O)[O-])n[nH]2)cc1 1821174700 KSIZBFXLWRNMCJ-QFIPXVFZSA-N 493.539 5.129 5 20 JKBD O=C(/C=C/c1ccccc1[N+](=O)[O-])N1CCC([C@@H]2CCCCN2C(=O)[C@H]2CCCCC2(F)F)CC1 1824651108 KHYXEHRCBOUXHF-LVIAPQIJSA-N 489.563 5.053 5 20 JKBD CC(C)=CCCC(=O)N1CCC([C@H]2CCCCN2C(=O)C2(c3cccc([N+](=O)[O-])c3)CCC2)CC1 1830293189 VGOUBCDTYFTQJE-RUZDIDTESA-N 481.637 5.383 5 20 JKBD COc1cc([N+](=O)[O-])ccc1NC(=O)COC(=O)c1c2c(nc3ccccc13)/C(=C/c1ccco1)CC2 8620860 XULCHQKTCZNISK-DTQAZKPQSA-N 499.479 5.027 5 20 JKBD CC(=O)N(c1nc(COC(=O)c2cccc(C)c2[N+](=O)[O-])cs1)c1c(C)cc(C)cc1C 9022296 FYFYBKOTASRIBI-UHFFFAOYSA-N 453.520 5.327 5 20 JKBD C[C@@H](NC(=O)c1cc([N+](=O)[O-])ccc1Sc1ccccc1)c1nc2ccccc2n1C(F)F 14368316 BWBKPGBIYRXHLC-CQSZACIVSA-N 468.485 5.982 5 20 JKBD CCSc1nnc(NC(=O)c2cc([N+](=O)[O-])ccc2Sc2ccc(Cl)cc2)s1 14739984 NGCYIVIIXCIERN-UHFFFAOYSA-N 452.970 5.615 5 20 JKBD C[C@H](OC(=O)COc1ccc(-c2ccccc2)cc1Cl)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 17892174 PZTADKSNUUFDSB-HNNXBMFYSA-N 479.876 5.648 5 20 JKBD CC(C)c1ccccc1-n1c(SCC(=O)Nc2ccc(F)c([N+](=O)[O-])c2)nnc1-c1cccnc1 20788074 VDCYDOBEBJFTOC-UHFFFAOYSA-N 492.536 5.231 5 20 JKBD COc1cc(C(=O)Nc2ccc(Oc3ccccc3Cl)cc2)c([N+](=O)[O-])cc1OC(F)F 22131360 AHAQTIRUDPKNEK-UHFFFAOYSA-N 464.808 5.903 5 20 JKBD O=C(O[C@H](C(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1)c1ccccc1)c1ccc(C(F)(F)F)nc1 26434630 DUTIRNBVOAVWGF-SFHVURJKSA-N 479.798 5.199 5 20 JKBD Cc1ccc(NC(=O)[C@@H](Sc2ccc(C(=O)N3CCCC3)cn2)c2ccccc2)c([N+](=O)[O-])c1 69547822 NLEOWNLRYSGVSO-QHCPKHFHSA-N 476.558 5.006 5 20 JKBD Cc1c(NC(=O)c2ccccc2)cccc1NC(=O)c1ccc(Nc2ccccc2)c([N+](=O)[O-])c1 409494155 NEDKETIDEGNEAL-UHFFFAOYSA-N 466.497 6.151 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)Nc2ccc(Cl)c(C(=O)NC3CCCCC3)c2)cc1SC 483347975 GVCVZJXIMVCIJQ-UHFFFAOYSA-N 477.970 5.294 5 20 JKBD CC(C)Oc1ccc(-c2csc(NC(=O)c3cc(OCC(F)(F)F)ccc3[N+](=O)[O-])n2)cc1 490142395 IAPLRBIHCOAFMJ-UHFFFAOYSA-N 481.452 5.699 5 20 JKBD O=C(c1csc(-c2ccc([N+](=O)[O-])cc2)n1)N1CCc2sccc2[C@@H]1c1cccs1 497541633 XASMMTNKNUHLKO-LJQANCHMSA-N 453.570 5.629 5 20 JKBD CCC[C@@H](NC(=O)c1ccc(NCc2ccccc2Cl)c([N+](=O)[O-])c1)c1nnc2ccccn12 504699275 UAYILKHWCDXZNT-HXUWFJFHSA-N 478.940 5.174 5 20 JKBD O=[N+]([O-])c1cc(CNCc2ccnc(OCC(F)(F)F)c2)ccc1Oc1ccc(F)cc1 509601039 NSJAOQGRTZQWNA-UHFFFAOYSA-N 451.376 5.152 5 20 JKBD CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)NCc1ccccc1-c1ccc(Cn2cncn2)cc1 509764331 UUHIMGBKQUOBIM-UHFFFAOYSA-N 484.560 5.022 5 20 JKBD COc1cc(C(=O)Nc2ccc(Oc3cccc(F)c3)cc2)c([N+](=O)[O-])cc1OCc1cscn1 509915028 MRZOPTFXZMPWFP-UHFFFAOYSA-N 495.488 5.823 5 20 JKBD CCOc1cc(Br)c(NC(=O)N[C@@H](C)c2cccc([N+](=O)[O-])c2)cc1OCC 510642983 FALYBYVPOUZMNQ-LBPRGKRZSA-N 452.305 5.037 5 20 JKBD C[C@H](Nc1ccc(C(=O)N2CCC(CCc3ccc(O)cc3)CC2)cc1[N+](=O)[O-])c1ccccn1 518035995 NXFRNXIDPFKONK-IBGZPJMESA-N 474.561 5.354 5 20 JKBD O=[N+]([O-])c1ccc(OC(F)F)c(CNCC2(c3cccc(C(F)(F)F)c3)CCOCC2)c1 518761308 KJTCECVIYAQSQA-UHFFFAOYSA-N 460.399 5.053 5 20 JKBD CCNC(=O)Nc1cccc(NC(=O)c2ccc(NCc3ccccc3Cl)c([N+](=O)[O-])c2)c1 520062897 LMLUOCYJEJEMNB-UHFFFAOYSA-N 467.913 5.254 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)N[C@H]2CCCc3nc(-c4ccc(F)cc4)sc32)cc1SC 520538621 IFKMYMBBGZROGA-HNNXBMFYSA-N 473.551 5.395 5 20 JKBD CC1(C)CC(NC(=O)C/C(=C\c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)CC(C)(C)N1 603466531 GMIGMOHYZOVKFJ-QGOAFFKASA-N 478.618 5.561 5 20 JKBD Cc1cnn([C@H]2CCCc3ccccc32)c1NC(=O)c1csc(-c2cccc([N+](=O)[O-])c2)n1 609059770 OXJQWTDJWFXZRW-NRFANRHFSA-N 459.531 5.401 5 20 JKBD C[C@H](SCCCOc1ccc([N+](=O)[O-])cc1)c1nc(O)c2c(-c3ccco3)csc2n1 609235665 JOLIDIRQBPDELL-ZDUSSCGKSA-N 457.533 5.828 5 20 JKBD COc1ccc([N+](=O)[O-])cc1NC(=O)[C@H](Oc1ccc(Br)cc1F)c1ccccc1 609326589 UHPQSAWWVZWUGW-HXUWFJFHSA-N 475.270 5.264 5 20 JKBD CC(=O)c1ccc(-c2ccc(C(=O)N3CCN(c4ccc([N+](=O)[O-])cc4C(F)(F)F)CC3)o2)cc1 727329004 LMHMQYIJLPKBBR-UHFFFAOYSA-N 487.434 5.039 5 20 JKBD CN(C(N)=O)c1ccc(OC(=O)c2cc([N+](=O)[O-])ccc2Sc2ccc(Cl)cc2)cc1 728276045 RAEWKLVDSWCENK-UHFFFAOYSA-N 457.895 5.134 5 20 JKBD Cc1c(-c2ccccc2)oc2c(C(=O)Nc3ccnn3-c3ccc([N+](=O)[O-])cc3)cccc2c1=O 729245138 UHYUVZFPDMUUQM-UHFFFAOYSA-N 466.453 5.115 5 20 JKBD CC(=O)N(c1ccc(Cl)c(Cl)c1)c1nc(COC(=O)c2cc([N+](=O)[O-])ccc2C)cs1 743000422 NRXNKWMIGUHXKB-UHFFFAOYSA-N 480.329 5.708 5 20 JKBD CCOc1ccc(NC(=O)c2ccc(NC(=O)c3cc([N+](=O)[O-])c(C)c([N+](=O)[O-])c3C)cc2)cc1 748602459 QULDDSWDSQAXPG-UHFFFAOYSA-N 478.461 5.023 5 20 JKBD O=C(COc1ccc(C(=O)Nc2cc([N+](=O)[O-])c(F)cc2F)cc1)Nc1cccc(C(F)(F)F)c1 897462937 XWQUDSCPQLHNHT-UHFFFAOYSA-N 495.360 5.162 5 20 JKBD Cc1c(NC(=O)[C@@H](C)OC(=O)c2cc(C3CC3)nc3onc(CC(C)(C)C)c23)cccc1[N+](=O)[O-] 915581802 LZGLNTPWEXIWHS-CQSZACIVSA-N 480.521 5.089 5 20 JKBD Cc1ccc(C(=O)Nc2nc3ccc(NC(=O)c4cc([N+](=O)[O-])ccc4Cl)cc3s2)s1 916728262 YIDMSCLDEBNVKB-UHFFFAOYSA-N 472.935 5.732 5 20 JKBD O=C(Nc1cc(Cl)c([N+](=O)[O-])cc1OCc1ccccc1)c1cc([N+](=O)[O-])ccc1Cl 916827611 LSYCYYKUKPSFDV-UHFFFAOYSA-N 462.245 5.641 5 20 JKBD CC1=C(C(=O)Nc2ccc(F)cc2)[C@H](c2csc([N+](=O)[O-])c2)NC(=S)N1c1ccccc1 917373828 GNXYBYNZFYQRNO-FQEVSTJZSA-N 468.535 5.144 5 20 JKBD CCC(CC)c1cc[n+](/C(C(=S)Nc2cccc(C(C)C)c2)=C(/O)c2ccc([N+](=O)[O-])cc2)cc1 917614544 FUTIHNKNWLICOI-UHFFFAOYSA-O 490.649 7.233 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)c3cc4sccc4s3)CCC2)cc1)c1ccc([N+](=O)[O-])o1 1785750758 QJNVXJRHCIGYHU-UHFFFAOYSA-N 467.528 5.526 5 20 JKBD O=C(Cn1ccc2ccc([N+](=O)[O-])cc21)NC1(c2ccc(NC(=O)[C@@H]3CCC(F)(F)C3)cc2)CCC1 1785799560 FICBGMZIZQNWGM-GOSISDBHSA-N 496.514 5.119 5 20 JKBD Cc1ccncc1CCC(=O)Nc1ccc(C2(NC(=O)/C=C/c3ccccc3[N+](=O)[O-])CCC2)cc1 1786879881 IJKBTHVMNCDEBW-VGOFMYFVSA-N 484.556 5.078 5 20 JKBD O=C(Cc1cc([N+](=O)[O-])ccc1F)NC1(c2ccc(NC(=O)c3cccc4cc[nH]c34)cc2)CCC1 1789090760 YEQIGHCBEUGWDD-UHFFFAOYSA-N 486.503 5.206 5 20 JKBD COc1ccc(C(=O)Nc2ccc(C3(NC(=O)/C=C/c4ccc([N+](=O)[O-])o4)CCC3)cc2)c(Cl)c1 1792142871 JNSKAIQMSHEFMZ-DHZHZOJOSA-N 495.919 5.311 5 20 JKBD O=C(Cc1ccc([N+](=O)[O-])cc1F)NC1(c2ccc(NC(=O)[C@@]3(F)CCCC=C3F)cc2)CCC1 1792377400 CVJCILVVHAJVIY-RUZDIDTESA-N 487.478 5.156 5 20 JKBD CC1=CC[C@H](C(=O)N2CCC3(CCCN(C(=O)CCCc4cc(C)c(F)cc4[N+](=O)[O-])C3)CC2)CC1 1805821097 HOJRGCGRILYGMQ-QFIPXVFZSA-N 499.627 5.343 5 20 JKBD CC(C)(C)CCCCCC(=O)N1CC[C@@H](CNC(=O)c2cccc(F)c2[N+](=O)[O-])[C@@H]1c1cccnc1 1811323505 PKTJXSCYFATDQP-RDPSFJRHSA-N 498.599 5.445 5 20 JKBD CC(C)[C@H]1CC[C@H](C(=O)N2CCCC[C@H]2c2cc(NC(=O)c3ccc([N+](=O)[O-])cc3F)n[nH]2)CC1 1821050776 QCYXLTIYHDGIPY-HOIFWPIMSA-N 485.560 5.225 5 20 JKBD Cc1cccc(C)c1SCC(=O)N1CCCC12CN(C(=O)c1cc3cc([N+](=O)[O-])ccc3s1)C2 1844375381 IQXCEKIXYHXTQL-UHFFFAOYSA-N 495.626 5.036 5 20 JKBD O=[N+]([O-])c1cc(C(F)(F)F)ccc1Oc1ccc(Oc2nc3ccc(Cl)cc3s2)cc1 4290541 PKZXTBOCXAYDKO-UHFFFAOYSA-N 466.824 7.461 5 20 JKBD C[C@@H](c1ccccc1)n1c(SCC(=O)Nc2ccc([N+](=O)[O-])cc2Cl)nc2ccccc2c1=O 20893056 NVLQKHQYXSGLDN-HNNXBMFYSA-N 494.960 5.298 5 20 JKBD C[C@@H]1CCC[C@@H](n2c(SCc3nnc(-c4ccc([N+](=O)[O-])cc4)o3)nc3ccccc3c2=O)[C@@H]1C 22522914 IKBVEMRYEKQUAO-WHSLLNHNSA-N 491.573 5.644 5 20 JKBD Cc1ccccc1OCc1nnc(S[C@H](C)C(=O)Nc2ccccc2[N+](=O)[O-])n1-c1ccccc1 22667974 QVOWRYOYGIPKRI-GOSISDBHSA-N 489.557 5.182 5 20 JKBD CC(C)c1ccc(CSc2nnc(SCCC(=O)Nc3ccccc3[N+](=O)[O-])s2)cc1 26407478 IJOBAKQKBHWKKX-UHFFFAOYSA-N 474.633 5.983 5 20 JKBD CCc1ccc(-c2csc(NC(=O)c3cc([N+](=O)[O-])ccc3I)n2)cc1 31682390 NMMSGIPXHSYLQN-UHFFFAOYSA-N 479.299 5.138 5 20 JKBD CC(C)N(Cc1nnc(-c2ccccc2Cl)o1)C(=O)[C@H](C)Sc1ccc([N+](=O)[O-])cc1 104781182 SOIRHSNKELMODI-AWEZNQCLSA-N 460.943 5.216 5 20 JKBD Cc1nc2ccccc2c2c(NC(=O)CCc3nnc(-c4ccsc4)o3)c3ccccc3n12 105722131 LSWZWZGAKXEALI-UHFFFAOYSA-N 453.527 5.632 5 20 JKBD Cc1csc(Sc2ccc(NC(=O)c3cnn(-c4ccc([N+](=O)[O-])cc4)c3)c(C)c2)n1 110129917 PZVUEELAQVTKEL-UHFFFAOYSA-N 451.533 5.257 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)Nc2nc(-c3ccc(Cl)cc3Cl)cs2)cc1SC 112529553 ZEUBJCWEQVKWCF-UHFFFAOYSA-N 470.359 6.008 5 20 JKBD O=C(Nc1ccccc1Oc1ncc(Cl)cc1Cl)c1ccn(-c2cccc([N+](=O)[O-])c2)n1 195612771 UIVMDVRPAVLJDN-UHFFFAOYSA-N 470.272 5.527 5 20 JKBD O=C(c1csc(-c2cccc([N+](=O)[O-])c2)n1)N1CCC[C@@H]1c1cccc(Br)c1 215800704 RFMISTPDVSSOBQ-GOSISDBHSA-N 458.337 5.458 5 20 JKBD C[C@@H](Nc1ccc(C(=O)Nc2cccc(C(=O)N3CCCCC3)c2)cc1[N+](=O)[O-])c1ccccn1 410085345 ICISZXQRVYYTHF-GOSISDBHSA-N 473.533 5.041 5 20 JKBD COc1ccccc1CN(Cc1cccs1)C(=O)c1cc(SC)c(OC)cc1[N+](=O)[O-] 482118194 BQLLEEJLWNYMPM-UHFFFAOYSA-N 458.561 5.238 5 20 JKBD O=C(Nc1ccc(Oc2cccc(Cl)c2)cc1)N1CCN(C(=O)c2ccc([N+](=O)[O-])s2)CC1 490899823 KGHJJBIPEDSHCU-UHFFFAOYSA-N 486.937 5.092 5 20 JKBD CC1(C)C[C@H]2C[C@@](C)(CN2C(=O)c2ccccc2NC(=O)c2ccc([N+](=O)[O-])cc2Cl)C1 506309943 XOLCZFOZLLJJNN-UPCLLVRISA-N 455.942 5.541 5 20 JKBD COC(=O)c1ccc(Cl)c(NC(=O)Cc2cn(-c3ccccc3)nc2-c2ccc([N+](=O)[O-])cc2)c1 506979485 SDVMQQLOGDGKGG-UHFFFAOYSA-N 490.903 5.069 5 20 JKBD COc1ccc([N+](=O)[O-])cc1NC(=O)[C@@H]1C[C@H]2CCCC[C@H]2N1C(=O)c1ccc2ccccc2c1 508778686 NOMNBYJYFKOQKD-FOVJLYNBSA-N 473.529 5.169 5 20 JKBD CN(Cc1ccccc1[N+](=O)[O-])C(=O)Nc1cccc(NC(=O)c2cccc(C(F)(F)F)c2)c1 509860248 AGFDFKPAACDIQR-UHFFFAOYSA-N 472.423 5.530 5 20 JKBD CCC(=O)N1CCCN(C(=O)c2c3c(nc4ccccc24)/C(=C/c2cccc([N+](=O)[O-])c2)CCC3)CC1 517433483 ZSJVMQOYFMXXOV-DYTRJAOYSA-N 498.583 5.104 5 20 JKBD Cc1cccc2c1CC[C@@H]2NC(=O)c1ccc(C(=O)N[C@@H]2CCc3c(C)cccc32)c([N+](=O)[O-])c1 552228015 AJTYCCGTKFCKTN-LOSJGSFVSA-N 469.541 5.046 5 20 JKBD CC(=O)Nc1ccc(NC(=O)c2ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])cc2)c(C(F)(F)F)c1 590766532 RQDVQQCWSCNMFL-UHFFFAOYSA-N 493.825 6.270 5 20 JKBD CC(C)N(C)CCCNC(=O)c1ccccc1Sc1ccc(C(F)(F)F)cc1[N+](=O)[O-] 603621663 JGKPEZCYKPVPJS-UHFFFAOYSA-N 455.502 5.225 5 20 JKBD O=C(OCC(=O)N(Cc1ccc(F)cc1)c1nc(-c2ccccc2)cs1)c1ccc([N+](=O)[O-])s1 748123480 LPKGUCWQDITPKD-UHFFFAOYSA-N 497.529 5.309 5 20 JKBD CC(C)N(Cc1nnc(-c2cccc([N+](=O)[O-])c2)o1)C(=O)CSc1cccc2cccc(Cl)c12 864244750 LUAHITKVMVYMDK-UHFFFAOYSA-N 496.976 5.981 5 20 JKBD C[C@H]1CCC[C@@H](C)N1NC(=O)C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1 864846227 LOXOEFQAKQTOFA-HQNHUHBZSA-N 450.564 5.429 5 20 JKBD Cc1oc(-c2ccccc2)nc1C(=O)Oc1ccc2c(-c3ccc([N+](=O)[O-])cc3)cc(=O)oc2c1 890281440 OSTXVURXQAYHOG-UHFFFAOYSA-N 468.421 5.551 5 20 JKBD CC(C)c1ccc(-c2nc(C(=O)O[C@@H](C)C(=O)Nc3ccc([N+](=O)[O-])cc3Cl)cs2)cc1 900227316 YJWZBSSJTOAYSG-ZDUSSCGKSA-N 473.938 5.679 5 20 JKBD C[C@@H](Nc1ccc(-c2nc(-c3ccc(N4CCCCC4)nc3)no2)cc1[N+](=O)[O-])c1ccccn1 904427547 SPTPXZGFHUZKSU-QGZVFWFLSA-N 471.521 5.265 5 20 JKBD O=C(Cc1ccc(NC(=O)c2cccc(Br)c2)cc1)OCc1cc(F)ccc1[N+](=O)[O-] 919397825 WQRZXSVTASKXQY-UHFFFAOYSA-N 487.281 5.035 5 20 JKBD COC(=O)/C=C\c1ccc(Sc2nnc(-c3ccccc3C)n2Cc2ccco2)c([N+](=O)[O-])c1 931421761 LDJWOJXELLFUEF-BENRWUELSA-N 476.514 5.140 5 20 JKBD O=C(Cn1ccc2ccc([N+](=O)[O-])cc21)Nc1ccc(C2(NC(=O)C3CC4(CCC4)C3)CCC2)cc1 1786276613 CUUXOHZQTOESGA-UHFFFAOYSA-N 486.572 5.264 5 20 JKBD C[C@@H]1CCC[C@@H]1C(=O)NC1(c2ccc(NC(=O)Cn3ccc4ccc([N+](=O)[O-])cc43)cc2)CCC1 1786277842 WWQHDBYTJWULJW-JPYJTQIMSA-N 474.561 5.120 5 20 JKBD O=C(Cc1cc([N+](=O)[O-])ccc1F)NC1(c2ccc(NC(=O)[C@@H](F)c3ccccc3)cc2)CCC1 1786610841 FPBQMQKCDJAJSH-DEOSSOPVSA-N 479.483 5.121 5 20 JKBD Cc1ncccc1CCC(=O)NC1(c2ccc(NC(=O)c3c(F)ccc([N+](=O)[O-])c3C)cc2)CCC1 1790770597 JICHVJAJVWTNQB-UHFFFAOYSA-N 490.535 5.126 5 20 JKBD Cc1cc(Cl)ccc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cc(Cl)cc([N+](=O)[O-])c1C)C2 1792738584 ZNJSJBFMCRCPCT-BCDXTJNWSA-N 476.360 5.084 5 20 JKBD CC(C)[C@H](C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc([N+](=O)[O-])cc1F)c1ccc(Cl)cc1 1800348566 LFASCIRGKYYIOH-YWNPBTLJSA-N 487.959 5.079 5 20 JKBD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(F)cc([N+](=O)[O-])c1)c1sc2ccccc2c1Cl 1800523054 ZXDNUGMTDZFIDC-MUJYYYPQSA-N 487.940 5.168 5 20 JKBD COc1c(C)cc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)cc1C 1801207256 RKCUQJCABCRHOT-ACDBMABISA-N 493.585 5.001 5 20 JKBD CCCOc1ccc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)cc1 1801207345 WTCYANPIBXWUOC-ACDBMABISA-N 493.585 5.164 5 20 JKBD O=C(Nc1cc([C@H]2CCCCN2C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)[nH]n1)c1ccccc1 1820405736 ISZVQAQCJHPWIU-LJQANCHMSA-N 475.530 5.152 5 20 JKBD CC(C)=CCCC(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cc(Cl)cc([N+](=O)[O-])c2C)n[nH]1 1821294622 RMNNCBMECSFZAG-LJQANCHMSA-N 473.961 5.332 5 20 JKBD Cc1cc(Cl)cc(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)c3cccc(F)c3[N+](=O)[O-])[nH]n2)c1 1823191673 FZLOYRAPDOEZCG-IBGZPJMESA-N 485.903 5.039 5 20 JKBD O=C(c1cccc2ccccc12)N1CCC([C@H]2CCCCN2C(=O)Cc2cccc([N+](=O)[O-])c2)CC1 1823679890 UYYCIEONKBSRCL-HHHXNRCGSA-N 485.584 5.224 5 20 JKBD O=C(c1cc2cc([N+](=O)[O-])ccc2s1)N1CC2(CCCN2C(=O)[C@@H]2CCC[C@@H]3CCCC[C@H]32)C1 1843941395 WSSZTDHEWUKJFJ-IOMROCGXSA-N 481.618 5.233 5 20 JKBD CC(C)OCc1c(C(=O)O[C@@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)oc2ccccc12 10915136 XJWIBGDVGOLYSQ-ZDUSSCGKSA-N 460.870 5.103 5 20 JKBD O=C(OCc1coc(-c2cccs2)n1)c1ccccc1C(=O)c1ccc(Cl)c([N+](=O)[O-])c1 11029176 NLZODJNHIURUMI-UHFFFAOYSA-N 468.874 5.553 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Br)[C@@H](NCCc1ccccc1F)c1ccccc1 18942300 VOPUVDULTUWUEX-NRFANRHFSA-N 472.314 5.009 5 20 JKBD CCOc1ccccc1NC(=O)[C@@H](OC(=O)c1ccc(SC)c([N+](=O)[O-])c1)c1ccccc1 21243173 ZAZCTMLBVWKDBD-QFIPXVFZSA-N 466.515 5.252 5 20 JKBD CNC(=O)c1cccc(NC(=O)c2ccccc2Sc2ccc(C(F)(F)F)cc2[N+](=O)[O-])c1 24039525 YVNUNTHLRJMMTB-UHFFFAOYSA-N 475.448 5.377 5 20 JKBD Cc1ccc([N+](=O)[O-])cc1NC(=O)COC(=O)c1ccc(COc2ccc3ccccc3c2)o1 24719594 MQKMYXRHNJVJRW-UHFFFAOYSA-N 460.442 5.024 5 20 JKBD COc1ccc(SCCC(=O)Oc2ccc(NC(=O)c3cc([N+](=O)[O-])ccc3Cl)cc2)cc1 27151821 GYSNQUPCHODYOT-UHFFFAOYSA-N 486.933 5.597 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Cl)[C@@H](N[C@H]1CCSc2c(F)cccc21)c1ccccc1 30504653 DXVIFLBEBOIDEU-FPOVZHCZSA-N 471.941 5.894 5 20 JKBD CC(C)NC(=O)Cc1ccc(NC(=O)c2ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])cc2)cc1 32455183 VGUHEEUUCVVSJC-UHFFFAOYSA-N 467.909 5.360 5 20 JKBD COc1cc(C(=O)Nc2ncc(Cc3cccc(C)c3Cl)s2)c([N+](=O)[O-])cc1OC(F)F 46566368 WCWNWHXCDOSDPH-UHFFFAOYSA-N 483.880 5.466 5 20 JKBD O=C(C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1)N(Cc1cccnc1)Cc1ccco1 71835490 TZQICEBXTTXCQL-UHFFFAOYSA-N 488.466 5.047 5 20 JKBD C[C@H](Nc1ccc(C(=O)N(Cc2cccc(F)c2)C[C@@H]2CCCO2)cc1[N+](=O)[O-])c1ccccn1 109589167 AQLUSWIYUOIMGQ-AVRDEDQJSA-N 478.524 5.123 5 20 JKBD O=C(Nc1ccc(N2CCc3sccc3C2)cc1)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-] 109725579 UERHZTCFDIBPOO-UHFFFAOYSA-N 477.464 5.412 5 20 JKBD O=C(Nc1ccccc1)c1nnc(/C(Cl)=C\c2ccc(-c3ccccc3[N+](=O)[O-])s2)s1 213058813 RARFICXYXFOWGY-FOWTUZBSSA-N 468.947 6.164 5 20 JKBD COc1ccccc1CC1CCN(C(=O)c2ccc(N[C@@H](C)c3ccccn3)c([N+](=O)[O-])c2)CC1 303120591 IIWCSGNIJJFQIG-IBGZPJMESA-N 474.561 5.266 5 20 JKBD O=C(Nc1ccccc1)[C@H]1CCc2ccccc2N1C(=O)c1csc(-c2cccc([N+](=O)[O-])c2)n1 303154967 NPRPIZDDCANRDV-HSZRJFAPSA-N 484.537 5.319 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)N2CCCC[C@@H]2C(=O)Nc2ccc(Cl)c(Cl)c2)cc1SC 482722331 HMSNXDXLBLTBCI-MRXNPFEDSA-N 498.388 5.266 5 20 JKBD Cc1csc(Sc2ccc(C(=O)Nc3ccccc3CN3CCSCC3)cc2[N+](=O)[O-])n1 489379838 NSNUXYNYCLUWSK-UHFFFAOYSA-N 486.644 5.312 5 20 JKBD Cc1ccsc1CN(C)C(=O)C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1 490801570 KNXBOWQKKZFIEC-AQTBWJFISA-N 463.584 6.164 5 20 JKBD C[C@H]1C[C@H](C)CN(c2ccc(C(=O)Nc3cccc(OCc4cscn4)c3)cc2[N+](=O)[O-])C1 504983457 QSDHYVFCDQGOCG-IRXDYDNUSA-N 466.563 5.365 5 20 JKBD COc1cc(CNCc2ccccc2Br)ccc1OCc1ccc([N+](=O)[O-])cc1 507901592 GJGMBPWCVZOKGD-UHFFFAOYSA-N 457.324 5.235 5 20 JKBD C[C@@H](NC(=O)Nc1ccc(N(C)C(=O)c2ccc(Cl)cc2)cc1)c1cccc([N+](=O)[O-])c1 510999115 MGIOVQTUFQPNBN-OAHLLOKOSA-N 452.898 5.408 5 20 JKBD COc1ccc(Cl)cc1-n1c(Sc2c([N+](=O)[O-])ncn2C)nnc1-c1cccc(Cl)c1 514883220 IRDBUXSBSGCMGY-UHFFFAOYSA-N 477.333 5.043 5 20 JKBD Cc1ccc([N+](=O)[O-])cc1NC(=O)CN[C@@H](c1ccccc1)c1ccc(Br)cc1F 518460245 RGQUMFHNXVESQH-QFIPXVFZSA-N 472.314 5.123 5 20 JKBD C[C@@H](Nc1ccc(C(=O)Nc2ccc(-c3nc4ccccc4s3)cn2)cc1[N+](=O)[O-])c1ccccn1 518703023 CZDQXAAOUHHMAH-MRXNPFEDSA-N 496.552 6.087 5 20 JKBD CC(=O)Nc1ccc(C(F)(F)F)cc1NC(=O)c1ccc(NCc2ccccc2)c([N+](=O)[O-])c1 521250732 IAVBNLCWZMVJFZ-UHFFFAOYSA-N 472.423 5.436 5 20 JKBD O=C(Cc1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1)Nc1ccccc1OCC(F)(F)F 590767695 DNLNWICYQGBVRU-UHFFFAOYSA-N 496.445 5.570 5 20 JKBD CC(=O)N(C)c1ccc(NC(=O)c2ccc(Sc3nc4ccccc4s3)c([N+](=O)[O-])c2)cc1 604478959 OJTAVTWEGDOIBW-UHFFFAOYSA-N 478.555 5.591 5 20 JKBD CCOC(=O)c1sc(-c2ccc(F)cc2)cc1NC(=O)c1cc(OCC)c(OC)cc1[N+](=O)[O-] 604514236 WRRJTRJOGSHQNK-UHFFFAOYSA-N 488.493 5.299 5 20 JKBD COc1cc(C(=O)Nc2cccc(SC(F)F)c2)c([N+](=O)[O-])cc1OCc1cscn1 727345917 QPJFWSQOXYCQFF-UHFFFAOYSA-N 467.475 5.206 5 20 JKBD C[C@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)Nc1ccccc1CN(C)C(=O)OC(C)(C)C 742514176 BDRHEMNFUOBBGV-AWEZNQCLSA-N 463.918 5.021 5 20 JKBD O=C(COC(=O)/C(=C\c1ccc(F)cc1)c1cccs1)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 772144379 BMXQXBZJQMMVRZ-YBEGLDIGSA-N 494.422 5.537 5 20 JKBD Cc1ccc(Oc2ccc(OCC(=O)O[C@H](C)c3nnc(-c4ccc([N+](=O)[O-])cc4)o3)cc2)cc1 844503379 GFISOUXQYRHPGS-QGZVFWFLSA-N 475.457 5.429 5 20 JKBD C[C@H](Nc1ccc(-c2nc(-c3ccc(OCc4cccnc4)cc3)no2)cc1[N+](=O)[O-])c1ccccn1 904464744 HVZBYOXFMYPSRW-SFHVURJKSA-N 494.511 5.854 5 20 JKBD Cc1cc(C)n(-c2ccc(C(=O)Nc3cc(Cl)c([N+](=O)[O-])cc3OCc3ccccc3)cn2)n1 915139257 YHYSMIRFUGAUGE-UHFFFAOYSA-N 477.908 5.277 5 20 JKBD Cc1ccc(/C(O)=C(/C(=S)Nc2c(C(C)C)cccc2C(C)C)[n+]2cccc(O)c2)cc1[N+](=O)[O-] 917610632 OFTUDXSEDLFUHA-UHFFFAOYSA-O 492.621 6.466 5 20 JKBD O=C(NC1(c2ccc(NC(=O)c3cccnc3-c3ccccc3)cc2)CCC1)c1ccc([N+](=O)[O-])[nH]1 1788738180 OVZYHSAEZVZIAJ-UHFFFAOYSA-N 481.512 5.046 5 20 JKBD Cc1ccc(S/C=C/C(=O)Nc2ccc(C3(NC(=O)c4ccc([N+](=O)[O-])o4)CCC3)cc2)cc1 1789489895 BNNHZICEMGHGJV-DTQAZKPQSA-N 477.542 5.550 5 20 JKBD CCCOc1ccc(C(=O)Nc2ccc(C3(NC(=O)c4ccc([N+](=O)[O-])o4)CCC3)cc2)cc1 1790337807 PGNDZVMKHHSLAB-UHFFFAOYSA-N 463.490 5.038 5 20 JKBD CCOc1cccc(C(=O)Nc2ccc(C3(NC(=O)Cc4cc(F)ccc4[N+](=O)[O-])CCC3)cc2)c1 1790342917 NAWXQBSHKMYLEI-UHFFFAOYSA-N 491.519 5.123 5 20 JKBD O=C(NC1(c2ccc(NC(=O)c3ccc(OCC4CC4)cc3F)cc2)CCC1)c1ccc([N+](=O)[O-])o1 1790585525 OTXGFVMNRDKJDH-UHFFFAOYSA-N 493.491 5.177 5 20 JKBD Cc1c(C(=O)Nc2ccc(C3(NC(=O)CCc4cccnc4)CCC3)cc2)cc(Cl)cc1[N+](=O)[O-] 1790774585 SENDJOGJUJGMFH-UHFFFAOYSA-N 492.963 5.332 5 20 JKBD Cc1c(Cl)ccc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)/C=C/c2ccccc2[N+](=O)[O-])c1Cl 1804345626 FXKKHVVIZCDTFL-SJXSPGMASA-N 488.371 5.175 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2c[nH]c(C(C)(C)C)c2)n[nH]1 1816112229 WTGMBOQJZLPNEY-IBGZPJMESA-N 496.543 5.011 5 20 JKBD O=C(Nc1cc([C@H]2CCCCN2C(=O)C2(c3cccc([N+](=O)[O-])c3)CCC2)[nH]n1)C1CCCCC1 1816710818 UZAZKEPBTJMPEH-JOCHJYFZSA-N 479.581 5.012 5 20 JKBD Cc1cc2cccc(C(=O)N3CCC([C@H]4CCCCN4C(=O)c4cccc(F)c4[N+](=O)[O-])CC3)c2[nH]1 1830621521 LXOSULUTWCWEJD-HSZRJFAPSA-N 492.551 5.071 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)N1CCC([C@H]2CCCCN2C(=O)c2ccc3ccoc3c2)CC1 1830912117 NQJZCJWHONFSDP-HSZRJFAPSA-N 493.535 5.336 5 20 JKBD O=C(Cc1cc(F)ccc1[N+](=O)[O-])N1CCC([C@H]2CCCCN2C(=O)c2ccccc2C2CC2)CC1 1832556828 FCOPLDHTVFACGP-RUZDIDTESA-N 493.579 5.087 5 20 JKBD CCn1c(SCC(=O)Nc2cc([N+](=O)[O-])ccc2F)nnc1-c1ccc(Cl)cc1Cl 9848754 FEYXCNVQSDTWSD-UHFFFAOYSA-N 470.313 5.050 5 20 JKBD CC(=O)N(c1cccc(Cl)c1)c1nc(COC(=O)c2ccc(NC3CC3)c([N+](=O)[O-])c2)cs1 11227100 CSZFBKUENWVTTM-UHFFFAOYSA-N 486.937 5.321 5 20 JKBD Cn1cnnc1Sc1ccc(C(=O)Nc2nc(-c3ccc4ccccc4c3)cs2)cc1[N+](=O)[O-] 14580432 CATADFVECCMLHN-UHFFFAOYSA-N 488.554 5.404 5 20 JKBD O=C(Nc1cccc(N2CCCC2=O)c1)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1 15176587 QOQNGGTTXBAZHU-UHFFFAOYSA-N 451.866 5.420 5 20 JKBD CC[C@@H](C)c1ccc([C@@H](NC(=O)CSc2ccc(C(N)=O)cc2[N+](=O)[O-])c2cccs2)cc1 15616421 HCVSSPGIPRBEKL-IQMFZBJNSA-N 483.615 5.267 5 20 JKBD O=C(COC(=O)c1ccc(SC(F)(F)F)cc1)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 18656269 NGTJISGEEKSMCY-UHFFFAOYSA-N 468.331 5.021 5 20 JKBD C[C@@H](OC(=O)CCc1ncc(-c2ccc(Cl)cc2Cl)o1)C(=O)Nc1ccc(F)c([N+](=O)[O-])c1 21802236 SKPGGEXBTVRWNI-LLVKDONJSA-N 496.278 5.199 5 20 JKBD CC(=O)N(c1ccccc1)c1nc(COC(=O)c2cc([N+](=O)[O-])ccc2N2CCCCC2)cs1 23969257 WRSSWKCCGNNBSU-UHFFFAOYSA-N 480.546 5.083 5 20 JKBD Cc1ccc(NC(=O)[C@@H](Sc2nnc3sc4ccccc4n23)c2ccccc2)c([N+](=O)[O-])c1 28416655 BICGVUHJZLNCAM-FQEVSTJZSA-N 475.555 5.633 5 20 JKBD CCn1c(S[C@H](C(=O)Nc2ccc(C)cc2[N+](=O)[O-])c2ccccc2)nc2ccccc2c1=O 36787814 SZDRESHNYMHIJY-QFIPXVFZSA-N 474.542 5.105 5 20 JKBD O=C(COc1ccc([N+](=O)[O-])cc1C(F)(F)F)N1N=C(c2ccco2)C[C@H]1c1cccs1 72033597 ROISQFACJSWNMM-HNNXBMFYSA-N 465.409 5.025 5 20 JKBD Cc1csc(Sc2ccc(NC(=O)c3cc(OCC(F)(F)F)ccc3[N+](=O)[O-])cc2)n1 108437107 VHSDHCUSXMTDNO-UHFFFAOYSA-N 469.466 5.704 5 20 JKBD Cn1c([C@H]2CCCCN2C(=O)CCNc2ccc(C(F)(F)F)cc2[N+](=O)[O-])nc2ccccc21 115757249 NXEOQTGHXPIRJQ-LJQANCHMSA-N 475.471 5.056 5 20 JKBD O=C(CSc1ncnc2sc3c(c12)CCCC3)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 255941494 OMTSLNPIQBRSIS-UHFFFAOYSA-N 468.482 5.228 5 20 JKBD COc1ccc(OC(F)F)c(NC(=O)c2ccc(Sc3nc(C)cs3)c([N+](=O)[O-])c2)c1 482164900 QCYYJQVOKWEPPP-UHFFFAOYSA-N 467.475 5.373 5 20 JKBD COc1cc(C(=O)Nc2cccc(NC(C)=O)c2C)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 484089418 QKBVOKFVLFBXDF-UHFFFAOYSA-N 469.881 5.568 5 20 JKBD COc1cc(C(=O)Nc2ccc(Cn3cccn3)cc2)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 486608992 WUCXCGDGBDFZAA-UHFFFAOYSA-N 478.892 5.546 5 20 JKBD COc1cc(CCC2CCN(C(=O)c3csc(-c4ccc([N+](=O)[O-])cc4)n3)CC2)cc(OC)c1 495410898 BQQCWPYCVPVDMP-UHFFFAOYSA-N 481.574 5.221 5 20 JKBD CCn1c(SCC(=O)c2ccc(CC[C@@H](C)NC(C)=O)cc2)nc2cc3ccccc3cc2c1=O 495450971 ZBKSTQARCJLMND-GOSISDBHSA-N 487.625 5.002 5 20 JKBD O=C(Nc1ccc(Oc2ncc(Cl)cc2Cl)cc1)c1ccc(-n2ccnc2)c([N+](=O)[O-])c1 500332086 LCXABPVUJRCFRY-UHFFFAOYSA-N 470.272 5.527 5 20 JKBD O=C(Nc1ccc(CNc2ccc(C(=O)c3ccccc3)cc2[N+](=O)[O-])cc1)c1ccncc1 502298186 ULLOCLZCZZZFHW-UHFFFAOYSA-N 452.470 5.085 5 20 JKBD Cc1c(NC(=O)c2cnn(-c3ncc(Cl)cc3Cl)c2C(F)(F)F)cccc1[N+](=O)[O-] 503077971 YFOXQRSDZVVEET-UHFFFAOYSA-N 460.199 5.062 5 20 JKBD CC(C)c1nc(C(=O)N2c3ccc([N+](=O)[O-])cc3C[C@H]2C)nn1-c1c(Cl)cccc1Cl 504393628 IHFQLWWXLCTDAR-GFCCVEGCSA-N 460.321 5.197 5 20 JKBD O=C(Cc1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1)N[C@@H]1CCCOc2ccccc21 504730448 BNRXBLXCNFDLDI-XMMPIXPASA-N 468.513 5.020 5 20 JKBD C[C@H](NC(=O)CSc1ccc(C(F)(F)F)cc1[N+](=O)[O-])c1nc2ccccc2n1C(F)F 514768916 ODULAVGHODBGBX-JTQLQIEISA-N 474.411 5.328 5 20 JKBD O=C1CCCN1C[C@H](NCc1ccc(-c2ccc([N+](=O)[O-])cc2)o1)c1cccc(C(F)(F)F)c1 518764665 YNODUHNNOSNLOH-NRFANRHFSA-N 473.451 5.327 5 20 JKBD O=C(Nc1cc(F)c(F)cc1F)N1CCN(Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)CC1 520599940 RUXFGNHIBRTLHE-UHFFFAOYSA-N 476.480 5.090 5 20 JKBD O=C(C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)N1CCn2c1nc1ccccc12 520952140 DGIFGLJLAWMTEM-OBGWFSINSA-N 481.537 5.532 5 20 JKBD O=[N+]([O-])c1ccc(CN(Cc2ccco2)S(=O)(=O)c2cc(C(F)(F)F)ccc2Cl)cc1 595277539 NGVAPAGAVLBZOP-UHFFFAOYSA-N 474.844 5.251 5 20 JKBD CCOc1cc(NC(=O)N[C@H](C)c2nc3ccccc3n2C(F)F)c([N+](=O)[O-])cc1OCC 603651258 CXLHXQQXBUFNNH-GFCCVEGCSA-N 463.441 5.020 5 20 JKBD C[C@H](Nc1ccc([N+](=O)[O-])c(C(=O)N2CCCC2)c1)c1cccc(NC(=O)Cc2ccccc2F)c1 603943409 CORDARGLPCXUDD-SFHVURJKSA-N 490.535 5.324 5 20 JKBD COc1ccc(NC(=O)CSc2ccc([N+](=O)[O-])cc2)cc1NC(=O)c1ccc(Cl)cc1F 603998284 VVEAEUKGFAWBBR-UHFFFAOYSA-N 489.912 5.379 5 20 JKBD O=[N+]([O-])c1cccc(-c2noc(CN[C@@H](c3ccccc3)c3ccc(Cl)c(Cl)c3)n2)c1 604011033 RWGCQOPHVWAMAX-NRFANRHFSA-N 455.301 5.831 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Br)[C@H](NCc1cc2ccccc2o1)c1ccccc1 604045599 ZDTTWENGQUTCCG-JOCHJYFZSA-N 480.318 5.573 5 20 JKBD COc1ccc([C@@H](Cc2ccc(F)cc2)NC(=O)c2cc(OC)c(OC(F)F)cc2[N+](=O)[O-])cc1 604456859 PMYBIZABCDKOFJ-LJQANCHMSA-N 490.434 5.066 5 20 JKBD COc1cc(/C=C\C(=O)O[C@@H](C)c2cccc([N+](=O)[O-])c2)ccc1OCc1c(C)noc1C 729475316 RCCZYMVOFNFSDA-SLWQEBJJSA-N 452.463 5.105 5 20 JKBD CN(Cc1cc([N+](=O)[O-])ccc1Cl)C(=O)Cc1csc(Cc2cccc(Cl)c2)n1 729650656 HDPBPEXACQGQSI-UHFFFAOYSA-N 450.347 5.150 5 20 JKBD COc1ccccc1C(=O)Nc1ccc(OC(=O)c2csc(-c3cccc([N+](=O)[O-])c3)n2)cc1 747624784 AHJIPZLEFJEDNQ-UHFFFAOYSA-N 475.482 5.198 5 20 JKBD CC(=O)[C@H](OC(=O)C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)c1ccccc1 748579057 JTMGYSUAFBXUEU-JLNBVAMESA-N 472.522 6.009 5 20 JKBD O=C(Cc1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1)OCc1coc(-c2ccccc2)n1 750485386 NBOCKZGRILXPRT-UHFFFAOYSA-N 480.480 5.388 5 20 JKBD O=C(Nc1cc(Cl)ccc1OCC(F)(F)F)c1cc([N+](=O)[O-])ccc1Br 751071675 FLHXGSSYACHKAG-UHFFFAOYSA-N 453.598 5.204 5 20 JKBD COc1ccccc1[C@H]1[C@@H](C(=O)N(C)Cc2ccccc2[N+](=O)[O-])CCC(=O)N1c1ccc(C)cc1 914728683 GZKDIJNQHVIJHY-HOFKKMOUSA-N 487.556 5.055 5 20 JKBD Cc1ccc(OCCCC(=O)Nc2ccc(CNC(=O)c3cc([N+](=O)[O-])ccc3Cl)cc2)cc1 916070532 OVZLLLBLFJPRAG-UHFFFAOYSA-N 481.936 5.284 5 20 JKBD Cc1csc(SCc2c(C(=O)N3CCN(c4cccc([N+](=O)[O-])c4)CC3)oc3ccccc23)n1 916071420 YILNHJDAMHNIFH-UHFFFAOYSA-N 494.598 5.361 5 20 JKBD O=c1cc(-c2ccc([N+](=O)[O-])cc2)c2ccc(Oc3ccc([N+](=O)[O-])c4cnccc34)cc2o1 916608776 KVXZMOVKJDFETD-UHFFFAOYSA-N 455.382 5.617 5 20 JKBD Cc1cc(-c2cc(C(=O)OCc3nc(-c4ccc([N+](=O)[O-])cc4)no3)c3c(C)noc3n2)c(C)s1 919051064 UYOQLDRKGKJIBP-UHFFFAOYSA-N 491.485 5.192 5 20 JKBD O=C(OCC(=O)N1c2ccccc2Sc2ccc(Cl)cc21)c1cc2cccc([N+](=O)[O-])c2[nH]1 919523827 YWDOCMLNQLXDTE-UHFFFAOYSA-N 479.901 5.716 5 20 JKBD C[C@H](OC(=O)[C@@H](C)SCc1nc(O)c2c(-c3ccccc3)csc2n1)c1ccc([N+](=O)[O-])cc1 920155594 XWPDUDFGZQTPHJ-LSDHHAIUSA-N 495.582 5.898 5 20 JKBD COc1cc(/C=C/C(=O)Oc2cc(Cl)ccc2[N+](=O)[O-])ccc1OCc1c(C)noc1C 921136466 ILKQVIPOOYGHIV-WEVVVXLNSA-N 458.854 5.059 5 20 JKBD O=C(Nc1ccccc1C(=O)Nc1nc(-c2ccncc2)cs1)c1ccc([N+](=O)[O-])cc1Cl 929338629 XCYIVEGXONXPRP-UHFFFAOYSA-N 479.905 5.271 5 20 JKBD O=C(/C=C/c1ccc([N+](=O)[O-])o1)Nc1ccc(C2(NC(=O)CSc3ccccc3)CCC2)cc1 1786206163 AVAVVWSXRZJJAN-ACCUITESSA-N 477.542 5.127 5 20 JKBD CNc1ccc(C(=O)NC2(c3ccc(NC(=O)/C=C/c4ccccc4[N+](=O)[O-])cc3)CCC2)cc1 1792315704 SIEXJJMLSQDANX-CXUHLZMHSA-N 470.529 5.098 5 20 JKBD O=C([C@@H]1CCC[C@H]2CCCC[C@H]21)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)C1(c3cccc([N+](=O)[O-])c3)CCC1)C2 1797874200 JKIZXIZMJAJENE-SZJVGWFLSA-N 493.648 5.261 5 20 JKBD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C1(c2cccc([N+](=O)[O-])c2)CCC1)[C@@H]1CCC[C@@H]2CCCC[C@@H]21 1800040815 LQNJJDDKZGPMLW-YQMVKYCNSA-N 493.648 5.261 5 20 JKBD CC(C)[C@H](C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc2cc([N+](=O)[O-])ccc2s1)c1ccccc1 1801206323 XVXIOWHPPDMNAI-PDFGSZSQSA-N 491.613 5.501 5 20 JKBD Cc1cccc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cc4cc([N+](=O)[O-])ccc4s2)C3)c1Cl 1803622921 OJEJTXNMBSASNQ-BJWYYQGGSA-N 483.977 5.337 5 20 JKBD CC[C@H](C)CC(=O)N1CCC2(CCCN(C(=O)CCCc3cc(C)c(F)cc3[N+](=O)[O-])C2)CC1 1805820763 ISWZMCXDKRBCHQ-IBGZPJMESA-N 475.605 5.032 5 20 JKBD O=C(CCC(F)(F)F)Nc1cc([C@H]2CCCCN2C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)[nH]n1 1817098054 BJOCEVNCRCFZMT-OAHLLOKOSA-N 495.483 5.181 5 20 JKBD Cc1cc(C(=O)N2CCC([C@H]3CCCCN3C(=O)CSc3ccccc3[N+](=O)[O-])CC2)ccc1F 1831777146 FVLVRTKJYAFGIT-JOCHJYFZSA-N 499.608 5.068 5 20 JKBD Cc1cc(C(=O)N2CCC([C@@H]3CCCCN3C(=O)CSc3ccccc3[N+](=O)[O-])CC2)ccc1F 1831777147 FVLVRTKJYAFGIT-QFIPXVFZSA-N 499.608 5.068 5 20 JKBD C[C@H](OC(=O)c1ccc(OCc2ccccc2)cc1)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 8952367 YKUJLPFBIPLWOV-HNNXBMFYSA-N 488.418 5.377 5 20 JKBD COc1cc(C(=O)O[C@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)ccc1OCc1ccccc1 9179906 WGEIIXFAIMOCCL-OAHLLOKOSA-N 484.892 5.020 5 20 JKBD O=C(COC(=O)c1cc2c(s1)-c1ccccc1OC2)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 9817797 VGJHNOLSMHWZLM-UHFFFAOYSA-N 478.404 5.030 5 20 JKBD COc1ccc(C)cc1NC(=O)[C@@H](OC(=O)c1cc([N+](=O)[O-])ccc1Cl)c1ccccc1 10665316 OWFWUJNBPFDPFM-NRFANRHFSA-N 454.866 5.102 5 20 JKBD C[C@H](OCCCNC(=O)c1ccccc1NC(=O)c1ccc([N+](=O)[O-])cc1Cl)c1ccccc1 15372878 QNYBUMLHHNNOFD-KRWDZBQOSA-N 481.936 5.398 5 20 JKBD O=C(CSc1nc2ccc([N+](=O)[O-])cc2s1)N[C@H](c1ccc(F)cc1)c1cccs1 18275319 WWJGZROSMCANNC-LJQANCHMSA-N 459.549 5.403 5 20 JKBD C[C@@H](Sc1nnc(-c2ccccc2)c(-c2ccccc2)n1)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl 20753392 FNLOMJADQGASMI-OAHLLOKOSA-N 491.960 5.887 5 20 JKBD C[C@H](Sc1nnc(-c2ccccc2)c(-c2ccccc2)n1)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl 20753395 FNLOMJADQGASMI-HNNXBMFYSA-N 491.960 5.887 5 20 JKBD CC(=O)NCCc1ccc(C(=O)[C@H](C)Sc2nc3ccccc3c3nc4ccccc4n23)cc1 32387731 MBDAMUSAMONBJE-KRWDZBQOSA-N 468.582 5.078 5 20 JKBD Cc1ccc(-n2c(SCc3nc(-c4cccc([N+](=O)[O-])c4)no3)nnc2-c2ccccn2)c(C)c1 108245470 PXOJZFVQVJDJQE-UHFFFAOYSA-N 485.529 5.197 5 20 JKBD Cc1ccc(-c2csc(NC(=O)[C@@H](NC(=O)c3ccccc3Cl)C(C)C)n2)cc1[N+](=O)[O-] 108461213 GQCCFIPFZGIFOT-IBGZPJMESA-N 472.954 5.073 5 20 JKBD C[C@H]1CCCN(Cc2ccc(CNC(=O)c3ccc(N[C@@H](C)c4ccccn4)c([N+](=O)[O-])c3)cc2)C1 108782804 UIYLXQASYYWGKS-SFTDATJTSA-N 487.604 5.325 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)N[C@H](c2ccccc2)c2ccc(Br)cc2)cc1SC 112533228 WADHUJYSTGAADG-OAQYLSRUSA-N 487.375 5.607 5 20 JKBD COCc1c(Br)cccc1NC(=O)c1ccc(N2C[C@H](C)C[C@@H](C)C2)c([N+](=O)[O-])c1 303142813 RIBMABYCMDJEKN-HUUCEWRRSA-N 476.371 5.238 5 20 JKBD Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)C1CCN(c2ncc(C(F)(F)F)cc2Cl)CC1 481376287 HHBCWDMQHBBKBJ-UHFFFAOYSA-N 456.852 5.134 5 20 JKBD CC(C)CN(CC(F)(F)F)C(=O)Cc1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1 485896146 VMOSZCYIFSZJKR-UHFFFAOYSA-N 460.456 5.037 5 20 JKBD CCNC(=O)c1ccc(NC(=O)C/C(=C/c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)cc1 501078801 QPXXDHPIPPKRDP-CYVLTUHYSA-N 486.553 5.524 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Cl)[C@@H](c1ccccc1)N1CCC[C@H](c2nccs2)C1 505250353 CKANWUZCBZVJQF-OXJNMPFZSA-N 456.955 5.264 5 20 JKBD C[C@@H]1c2[nH]c3ccccc3c2[C@H](c2ccccc2Cl)CN1C(=O)CCn1cc([N+](=O)[O-])cn1 508804632 BVAUOUMKTVVEBQ-BEFAXECRSA-N 463.925 5.051 5 20 JKBD CCOc1cc(CN[C@@H](C)c2ccc(C)cc2)ccc1OCc1cc([N+](=O)[O-])cc2c1OCOC2 509597549 BJSMRPOKLMGWHG-IBGZPJMESA-N 478.545 5.598 5 20 JKBD CSc1ccc(C(=O)N[C@H](C)c2cccc(NC(=O)Cc3ccccc3F)c2)cc1[N+](=O)[O-] 515161874 PHSATAFXXVBUQO-OAHLLOKOSA-N 467.522 5.128 5 20 JKBD O=C(c1ccc(Nc2ccccc2)c([N+](=O)[O-])c1)N1CCC(N2CCc3ccccc3C2)CC1 518652995 PIECXNNPCZDYMQ-UHFFFAOYSA-N 456.546 5.001 5 20 JKBD COCCc1ccc(Oc2ccc(NC(=O)C3CCN(c4ccccc4[N+](=O)[O-])CC3)cc2)cc1 520806394 BUWDBCSIFCQJTK-UHFFFAOYSA-N 475.545 5.431 5 20 JKBD COc1ccc(Br)cc1-c1nc(Cn2cc(-c3ccc([N+](=O)[O-])cc3)cn2)cs1 521232733 ASGPZSFFJRSBCW-UHFFFAOYSA-N 471.336 5.401 5 20 JKBD C[C@H](COCC(F)(F)F)NC(=O)C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1 521504810 QPODLUCBMBYEST-KWZJRMENSA-N 479.480 5.219 5 20 JKBD Cn1ccnc1[C@H](NCc1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1)c1ccc(F)cc1 550812366 IMUIMODNJZZSDO-HSZRJFAPSA-N 466.900 5.792 5 20 JKBD Cc1ccc(S(=O)(=O)Nc2ccc(NC(=O)c3cc(Cl)ccc3Cl)cc2)cc1[N+](=O)[O-] 603502003 MPNLHZDMADYFCA-UHFFFAOYSA-N 480.329 5.263 5 20 JKBD CNC(=O)c1ccc(NC(=O)c2ccc(Sc3nc4ccccc4s3)c([N+](=O)[O-])c2)cc1Cl 604013515 MKJGMTJNOURTQW-UHFFFAOYSA-N 498.973 5.621 5 20 JKBD O=C(Nc1ccc(Sc2nncs2)cc1)c1cc([N+](=O)[O-])ccc1Oc1ccccc1 604119010 LLQDLRBMAOWYKN-UHFFFAOYSA-N 450.501 5.642 5 20 JKBD CN(C[C@H]1CCCO[C@@H]1c1ccccc1)C(=O)CCNc1ccc(C(F)(F)F)cc1[N+](=O)[O-] 604519046 GHVBAXRETVGENR-VGOFRKELSA-N 465.472 5.042 5 20 JKBD CN(CCOc1ccccc1Cl)C(=O)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 609609212 LIBRUKDHOYHMQA-UHFFFAOYSA-N 485.890 5.021 5 20 JKBD Cc1ccccc1NC(=O)[C@@H]1CCc2ccccc2N1C(=O)c1ccc(Br)c([N+](=O)[O-])c1 726918215 BSCLBLMIVNUDNG-NRFANRHFSA-N 494.345 5.266 5 20 JKBD CCOc1ccc(OCC)c(NC(=S)/C(=C(/O)c2ccc(C)c([N+](=O)[O-])c2)[n+]2cccc(O)c2)c1 726964425 XBALMTGXSDVECA-UHFFFAOYSA-O 496.565 5.017 5 20 JKBD COc1ccc([C@@H](NC(=O)c2cc(F)ccc2[N+](=O)[O-])c2ccccc2)cc1Br 728498772 OIPBBJABPGXWSO-FQEVSTJZSA-N 459.271 5.024 5 20 JKBD O=C(CCC(=O)c1ccc2ccc3cccc4ccc1c2c34)Nc1cc(C(F)(F)F)cnc1O 729260309 FNORYPPKKBJENS-UHFFFAOYSA-N 462.427 6.305 5 20 JKBD CN(C[C@H]1CCN(C(=O)c2cc([N+](=O)[O-])ccc2Sc2ccccc2)C1)C(=O)OC(C)(C)C 729392199 HZMKXIBSZWDOAH-QGZVFWFLSA-N 471.579 5.075 5 20 JKBD Cc1ccccc1[C@H](OC(=O)c1ccc(Sc2nncn2C)c([N+](=O)[O-])c1)c1cccs1 748502651 ICFYEYLMODGYNK-FQEVSTJZSA-N 466.544 5.191 5 20 JKBD COc1ccc(-c2nc(COC(=O)c3cc([N+](=O)[O-])ccc3N3CCCCC3)cs2)c(OC)c1 823314909 HTUOUOAMNMJDOX-UHFFFAOYSA-N 483.546 5.083 5 20 JKBD Cc1oc2cc(OS(=O)(=O)c3cccc([N+](=O)[O-])c3)ccc2c(=O)c1-c1ccccc1Cl 832442667 ROCYDZVRJREFSQ-UHFFFAOYSA-N 471.874 5.098 5 20 JKBD C[C@H](Nc1ccc(C(=O)N2CCC[C@H](Oc3ccc(C4CC4)cn3)C2)cc1[N+](=O)[O-])c1ccccn1 858034281 YHJAGLFPMMBGSZ-AVRDEDQJSA-N 487.560 5.119 5 20 JKBD Cc1cc(C(N)=O)ccc1NC(=O)c1c2c(nc3ccccc13)/C(=C/c1cccc([N+](=O)[O-])c1)CCC2 915177441 WVZICLNMJWVWCG-XDJHFCHBSA-N 492.535 5.680 5 20 JKBD COc1cc(C(=O)Nc2ccc(SC(F)F)cc2)c([N+](=O)[O-])cc1OCc1cscn1 919880790 RHIYHGZJCSDZNQ-UHFFFAOYSA-N 467.475 5.206 5 20 JKBD O=C(CCc1cccc([N+](=O)[O-])c1)NC1(c2ccc(NC(=O)c3c(F)ccnc3Cl)cc2)CCC1 1786989414 PICQUVYRYNEDOW-UHFFFAOYSA-N 496.926 5.163 5 20 JKBD O=C(NC1(c2ccc(NC(=O)c3sc4ccccc4c3Cl)cc2)CCC1)c1n[nH]cc1[N+](=O)[O-] 1788990271 IFXGWYMJSZJVIY-UHFFFAOYSA-N 495.948 5.248 5 20 JKBD COc1cccc(C(=O)Nc2ccc(C3(NC(=O)CSc4ccccc4[N+](=O)[O-])CCC3)cc2)c1 1790274484 FJUGYMUCWBABNX-UHFFFAOYSA-N 491.569 5.143 5 20 JKBD O=C(Cc1ccc([N+](=O)[O-])cc1F)Nc1ccc(C2(NC(=O)c3cccc4cccnc34)CCC2)cc1 1791183666 LGEWGRMPSQCMSR-UHFFFAOYSA-N 498.514 5.273 5 20 JKBD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(-c2ccccc2)c(F)c1)c1cc(F)cc([N+](=O)[O-])c1 1799342248 HFVVMMHEDGHVRQ-KOUNCHBCSA-N 491.494 5.106 5 20 JKBD CC1(C)CCC(CC(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)C2(c3cccc([N+](=O)[O-])c3)CCC2)CC1 1800040380 MFVJOYYHBXSBNT-NUNAXRQHSA-N 481.637 5.261 5 20 JKBD O=C(c1cc(F)cc(Cl)c1)N1CCC([C@H]2CCCCN2C(=O)c2ccc([N+](=O)[O-])cc2F)CC1 1830497250 BUUHKXVCAWFITL-JOCHJYFZSA-N 491.922 5.074 5 20 JKBD Cc1cccc(Cl)c1C(=O)N1CCCC[C@@H]1C1CCN(C(=O)/C=C/c2ccc([N+](=O)[O-])o2)CC1 1830593856 MLOLYRZCLZWLCF-ZQAUEJBPSA-N 485.968 5.096 5 20 JKBD Cc1c(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)C(C)(C)C(C)(F)F)CC2)cc(Cl)cc1[N+](=O)[O-] 1830734416 JMYRKTXIRRZOPB-LJQANCHMSA-N 499.986 5.471 5 20 JKBD COc1ccc(NC(=O)CSc2nnc(-c3ccc(Cl)cc3Cl)n2C(C)C)c([N+](=O)[O-])c1 9826794 IWGZFLICZGIBIB-UHFFFAOYSA-N 496.376 5.480 5 20 JKBD Cc1nn(-c2ccccc2)c(C)c1NC(=O)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1 10539819 HRPOJSNSSYEIBY-UHFFFAOYSA-N 462.893 6.095 5 20 JKBD O=[N+]([O-])c1ccc(-c2nnc(CSc3nnc(Cc4ccccc4)n3-c3ccccc3)o2)cc1 12105450 MFIMSQWBAXJSPP-UHFFFAOYSA-N 470.514 5.109 5 20 JKBD COc1cc(C(=O)Nc2cc([N+](=O)[O-])ccc2C)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 15410446 JDVGDPKNAUKVNS-UHFFFAOYSA-N 457.826 5.518 5 20 JKBD Cc1ccccc1NC(=O)Cc1nc(COc2ccc([N+](=O)[O-])cc2Cc2ccccc2)cs1 16458941 URKNZZRLECTCCU-UHFFFAOYSA-N 473.554 5.711 5 20 JKBD C[C@H](OC(=O)COc1ccc(C2SCCCS2)cc1)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl 17268165 GHQUQJMSHMGMJX-ZDUSSCGKSA-N 496.994 5.066 5 20 JKBD COc1cc(COC(=O)c2cc(C(C)C)nc3c2cnn3C(C)C)c([N+](=O)[O-])cc1OC(F)F 25030521 AULSAZGPYXHEQO-UHFFFAOYSA-N 478.452 5.011 5 20 JKBD Cc1noc(C)c1CN(c1cccc(C(F)(F)F)c1)S(=O)(=O)c1ccc(Cl)c([N+](=O)[O-])c1 28942964 WYXKZQVNYNSJRG-UHFFFAOYSA-N 489.859 5.267 5 20 JKBD C[C@H](Sc1nnc(-c2ccccc2)c(-c2ccccc2)n1)C(=O)Nc1ccc(F)c([N+](=O)[O-])c1 36801987 WRRCXWNMKSJTBO-HNNXBMFYSA-N 475.505 5.372 5 20 JKBD CN(C(=O)c1csc(-c2cccc([N+](=O)[O-])c2)n1)c1ccc(Br)cc1Cl 303006953 IPHFUASQWNEYBB-UHFFFAOYSA-N 452.717 5.411 5 20 JKBD Cc1nc(-c2ccccc2)sc1[C@@H](C)N[C@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 303025416 PTMIIEMVOYINMH-TZMCWYRMSA-N 478.496 5.723 5 20 JKBD COc1cc(C(=O)Nc2ccccc2-c2ccc(-c3ccccc3)cc2)c([N+](=O)[O-])cc1OC(F)F 410046526 LLRTTWLPATXWBO-UHFFFAOYSA-N 490.462 6.791 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)N2CCCC[C@H]2C(=O)Nc2cc(Cl)ccc2Cl)cc1SC 483665255 GOHJIMFYSPRHLU-INIZCTEOSA-N 498.388 5.266 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)N[C@@H](C)c2ccc(OCc3cccc(C)c3)cc2)cc1SC 484364181 RXPKRIMUUGNDEK-KRWDZBQOSA-N 466.559 5.704 5 20 JKBD O=C(c1csc(-c2cccc([N+](=O)[O-])c2)n1)N1CCCC[C@H]1c1nc(-c2ccccc2)no1 505312583 AHYWMFLDRDTKJR-IBGZPJMESA-N 461.503 5.136 5 20 JKBD O=[N+]([O-])c1cc(S(=O)(=O)Nc2ccccc2)ccc1N[C@@H](c1ccccc1)c1nccs1 505571422 ZHPSLBZPSLRMLJ-NRFANRHFSA-N 466.544 5.054 5 20 JKBD CCOc1cc([N+](=O)[O-])c(C(=O)N(C/C=C\c2ccccc2)c2ccc3c(c2)OCCO3)cc1OC 507072714 UIJUNJLSPBCBBW-YFHOEESVSA-N 490.512 5.134 5 20 JKBD CN(CCC(F)(F)F)C(=O)c1c2c(nc3ccccc13)/C(=C/c1ccc([N+](=O)[O-])cc1)CCC2 511384311 ZWITUBAGGKTIRZ-BMRADRMJSA-N 469.463 6.044 5 20 JKBD Cc1oncc1C(=O)Nc1ccc(NC(=O)c2ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])cc2)cc1 512552554 PXQZKMSVOOGUMO-UHFFFAOYSA-N 492.875 5.842 5 20 JKBD COc1cc(CNCc2cc(Br)cs2)ccc1OCc1ccc([N+](=O)[O-])cc1 512856881 SYANMLDDJZOLRW-UHFFFAOYSA-N 463.353 5.296 5 20 JKBD CCCOc1ccc(CNCc2ccc(-c3ccc([N+](=O)[O-])cc3Br)o2)cc1OC 518271392 WTZXATAQXNDLRM-UHFFFAOYSA-N 475.339 5.705 5 20 JKBD Cc1[nH]nc2ncc(NC(=O)C/C(=C\c3ccc([N+](=O)[O-])cc3)c3nc4ccccc4s3)cc12 518531590 KZDZVHDSFNXNLH-MHWRWJLKSA-N 470.514 5.354 5 20 JKBD CC[C@H](NC(=O)C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)c1nc(C)cs1 519122775 XAQUOWHNDKMQFA-WPNIOXTASA-N 478.599 6.168 5 20 JKBD Cc1cc(C)n(-c2ccc(CNCc3cc([N+](=O)[O-])ccc3OC(F)F)c(C(F)(F)F)c2)n1 521830184 BWGOMTKTACKLEC-UHFFFAOYSA-N 470.398 5.307 5 20 JKBD CSc1ccccc1NC(=O)CN(C)C(=O)c1cc([N+](=O)[O-])ccc1Sc1ccccc1 598931428 VEKWHRPPMIJVMP-UHFFFAOYSA-N 467.572 5.179 5 20 JKBD O=C(c1ccc(NCc2ccccc2Cl)c([N+](=O)[O-])c1)N1CCC[C@@H](OCC(F)(F)F)C1 603981758 LMXUYLFTBQRUOF-MRXNPFEDSA-N 471.863 5.044 5 20 JKBD O=C(c1cc2cc([N+](=O)[O-])ccc2o1)N(Cc1cccnc1)c1ccc(Br)cc1 603990276 LDVGOXGZYMUANC-UHFFFAOYSA-N 452.264 5.346 5 20 JKBD O=C(Nc1cnn(Cc2ccccn2)c1)c1ccccc1Sc1ccc(C(F)(F)F)cc1[N+](=O)[O-] 604548924 KGRBOYAPJOVLHZ-UHFFFAOYSA-N 499.474 5.657 5 20 JKBD C[C@@H](NCc1ccc(Oc2ccccc2Cl)c([N+](=O)[O-])c1)c1ccc(N2CCCC2=O)cc1 725848639 ZORKIWAWGQGACL-QGZVFWFLSA-N 465.937 6.018 5 20 JKBD O=C(OCC(=O)N1CCC[C@@H]1c1ccc(Cl)c(Cl)c1)c1c(Cl)cccc1[N+](=O)[O-] 730646804 MQWWANPYXPHKNK-OAHLLOKOSA-N 457.697 5.076 5 20 JKBD C[C@H](Oc1ccc(F)c(F)c1)C(=O)O[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1 744595996 DXEPQEINYPGRQZ-YEJXKQKISA-N 490.846 5.217 5 20 JKBD COc1ccc(-c2nc(C)c(C(=O)N(Cc3nnc(-c4cccc([N+](=O)[O-])c4)o3)C(C)C)s2)cc1 747574598 VJOTWUOQFCEGTO-UHFFFAOYSA-N 493.545 5.136 5 20 JKBD CCc1noc(C[C@]2(O)CCCN(C(=O)CCC(=O)c3ccc4ccc5cccc6ccc3c4c56)C2)n1 856703949 NKRHYXIWQACEKT-SSEXGKCCSA-N 495.579 5.089 5 20 JKBD O=C(Nc1cc([N+](=O)[O-])c(F)cc1F)c1ccccc1Sc1ccc(C(F)(F)F)cc1[N+](=O)[O-] 897465185 WKOMWMVARJWOBO-UHFFFAOYSA-N 499.373 6.204 5 20 JKBD COc1ccc(CSCc2nc(-c3cccc(OCc4cccnc4)c3)no2)cc1[N+](=O)[O-] 904500446 LYDAPGQXKIFJBS-UHFFFAOYSA-N 464.503 5.061 5 20 JKBD Cc1cc(-c2nnc(COC(=O)c3ccccc3C(=O)c3ccc(Cl)c([N+](=O)[O-])c3)o2)c(C)o1 916443048 VILHEJSGMOVSJD-UHFFFAOYSA-N 481.848 5.096 5 20 JKBD O=C(COc1ccccc1C(=O)Nc1ccc(F)c([N+](=O)[O-])c1)Nc1cccc(C(F)(F)F)c1 916667014 BIVQZBQMUFURIC-UHFFFAOYSA-N 477.370 5.023 5 20 JKBD Cc1nn(C(C)(C)C)c2nc(C3CC3)cc(C(=O)O[C@@H](C)C(=O)Nc3cc([N+](=O)[O-])ccc3Cl)c12 919195347 UZAQTLMKTZATEA-ZDUSSCGKSA-N 499.955 5.118 5 20 JKBD CC(C)COC(=O)Nc1cccc(NC(=O)CSc2ccc(C(F)(F)F)cc2[N+](=O)[O-])c1 920224946 OSVCZXHDMNJTBA-UHFFFAOYSA-N 471.457 5.549 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)c3ccc([N+](=O)[O-])cc3F)CCC2)cc1)c1cc2sccc2[nH]1 1789370328 SVVKCJYSZCWCCI-UHFFFAOYSA-N 478.505 5.338 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)c3ccoc3Cl)CCC2)cc1)c1ccc([N+](=O)[O-])cc1F 1790625783 NVDKQGNYRNVFDS-UHFFFAOYSA-N 457.845 5.042 5 20 JKBD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc2cc([N+](=O)[O-])ccc2s1)c1cccc2ccoc12 1801207143 LOZACBATZKCEJV-BCDXTJNWSA-N 475.526 5.121 5 20 JKBD Cc1cc(CCCC(=O)N2CCCC3(CCN(C(=O)CC(C)(C)C)CC3)C2)c([N+](=O)[O-])cc1F 1805821051 GEQCVIDADHDJFN-UHFFFAOYSA-N 475.605 5.032 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2ccccc2Cl)n[nH]1 1820428701 ZQNXNPILXDZSKO-LJQANCHMSA-N 485.903 5.039 5 20 JKBD CC1=CC[C@@H](C(=O)N2CCC([C@H]3CCCCN3C(=O)Cc3ccc(Cl)cc3[N+](=O)[O-])CC2)CC1 1824160290 BPCINOACDDHRFB-NFBKMPQASA-N 488.028 5.157 5 20 JKBD CCCCC[C@@H](C)C(=O)N1CCC([C@@H]2CCCCN2C(=O)/C=C/c2ccc([N+](=O)[O-])o2)CC1 1824279377 VNGOBNBJTJWJQH-VOIFRGJBSA-N 459.587 5.037 5 20 JKBD O=C(c1cc2ccoc2s1)N1CCC([C@@H]2CCCCN2C(=O)CCc2cccc([N+](=O)[O-])c2)CC1 1824839988 QYOMNWINUIXMBQ-QFIPXVFZSA-N 495.601 5.269 5 20 JKBD C[C@@H](Sc1ccccc1)C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cccc(F)c2[N+](=O)[O-])CC1 1830617570 VUPPHUBXQJQFJJ-JPYJTQIMSA-N 499.608 5.148 5 20 JKBD O=C(c1cccc(Cl)c1)N1CCC([C@@H]2CCCCN2C(=O)/C=C/c2ccccc2[N+](=O)[O-])CC1 1832904625 OGCWAWJIKMVTKF-RGPPVUSESA-N 481.980 5.195 5 20 JKBD Cc1ccc(NC(=O)[C@H](OC(=O)c2cc(C)nc3c2cnn3C(C)C)c2ccccc2)c([N+](=O)[O-])c1 10205699 BYEDNLSDMSFOTG-HSZRJFAPSA-N 487.516 5.074 5 20 JKBD O=C(C[C@H](C(=O)O)c1ccccc1)Nc1cc(Cl)c([N+](=O)[O-])cc1OCc1ccccc1 13467816 UJPBLERTNHKEQX-KRWDZBQOSA-N 454.866 5.024 5 20 JKBD O=C(Cn1c2ccccc2c(=O)c2ccccc21)Nc1nc2ccc(Br)cc2s1 14222793 HMZQLBQKBRIVAA-UHFFFAOYSA-N 464.344 5.166 5 20 JKBD CCOC(=O)c1c(NC(=O)c2cccc([N+](=O)[O-])c2C)sc(C(=O)Nc2ccc(C)cc2C)c1C 14862884 ZVDHPGVPADUIBM-UHFFFAOYSA-N 495.557 5.571 5 20 JKBD COc1cc2c(cc1OC)[C@@H](c1ccccc1)N(C(=O)c1ccc([N+](=O)[O-])cc1Cl)CC2 16002269 UQKYHKXSCADEAM-HSZRJFAPSA-N 452.894 5.053 5 20 JKBD CC(=O)NCCc1ccc(-c2nc3ccc([N+](=O)[O-])cc3c(-c3ccccc3)c2Cl)s1 17700932 MVTBNFJHFWGTJR-UHFFFAOYSA-N 451.935 5.871 5 20 JKBD Cc1csc(Sc2ccc(C(=O)Nc3cccc(OC[C@@H]4CCCO4)c3)cc2[N+](=O)[O-])n1 31263855 ZEEWGQUMEJBNCI-SFHVURJKSA-N 471.560 5.321 5 20 JKBD O=C(COc1cccc([N+](=O)[O-])c1)Nc1ccc(NC(=O)c2ccccc2F)cc1C(F)(F)F 69643770 WFQTXLOGTXHIJR-UHFFFAOYSA-N 477.370 5.023 5 20 JKBD CC(C)N(Cc1nnc(-c2ccccc2Cl)o1)C(=O)[C@@H](C)Sc1ccc([N+](=O)[O-])cc1 104781181 SOIRHSNKELMODI-CQSZACIVSA-N 460.943 5.216 5 20 JKBD COc1cc(C(=O)Nc2cc(-c3ccc4c(c3)CCC4)nn2-c2ccccc2)c([N+](=O)[O-])cc1OC 497893768 VHJUXMHCAUKHGF-UHFFFAOYSA-N 484.512 5.206 5 20 JKBD CCOc1ccc(Oc2ccccc2NC(=O)c2ccc(Cn3nc(C)c([N+](=O)[O-])c3C)cc2)cc1 499147226 AICQRVBQQUONGL-UHFFFAOYSA-N 486.528 5.900 5 20 JKBD CCN(Cc1ccccc1NC(=O)c1ccc(Sc2nc(C)cs2)c([N+](=O)[O-])c1)C(C)=O 509526485 BBCSUIZEMNNNLC-UHFFFAOYSA-N 470.576 5.132 5 20 JKBD COc1cc(C)ccc1Oc1ccc(NC(=O)N(Cc2ccc([N+](=O)[O-])cc2)C(C)C)cn1 509572691 CZCINPDOYPJYCO-UHFFFAOYSA-N 450.495 5.542 5 20 JKBD C[C@@H](Nc1ccc(C(=O)N(C)c2ccc(Br)cc2F)cc1[N+](=O)[O-])c1ccccn1 509699809 RLYHNYRUUFPVQL-CYBMUJFWSA-N 473.302 5.341 5 20 JKBD CCn1c(SCC(=O)N(Cc2ccc([N+](=O)[O-])cc2)C(C)C)nnc1-c1ccc(Cl)cc1 509704737 QOWHVCJMCTWAJU-UHFFFAOYSA-N 473.986 5.056 5 20 JKBD O=C(c1c2c(nc3ccccc13)/C(=C\c1ccc([N+](=O)[O-])cc1)CCC2)N1CCC(c2ncc[nH]2)CC1 509950802 BGUNESWHQCTMCE-UZYVYHOESA-N 493.567 5.763 5 20 JKBD O=C(N[C@@H](c1ccc(Cl)cc1)c1ccsc1)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-] 512750982 ZCGPGLKGTQQWIX-SFHVURJKSA-N 470.856 5.770 5 20 JKBD O=C(COc1cccc([N+](=O)[O-])c1)C(c1nc2ccccc2s1)c1nc2ccccc2s1 513676997 ORKZAGXDTUYOBO-UHFFFAOYSA-N 461.524 5.594 5 20 JKBD O=[N+]([O-])c1ccc(-c2nnc(CSc3nnc(-c4ccncc4)n3-c3ccc(Cl)cc3)o2)cc1 513845721 ZGCCWCMRCNUEJR-UHFFFAOYSA-N 491.920 5.233 5 20 JKBD O=C(CSc1ccc(C(F)(F)F)cc1[N+](=O)[O-])Nc1cccc(OCC(F)(F)F)c1 520013040 KTPBGUAZYFFBMN-UHFFFAOYSA-N 454.348 5.286 5 20 JKBD O=C(Nc1nnc(Cc2ccccc2F)s1)c1cc([N+](=O)[O-])ccc1Sc1ccccc1 520805805 ZEUJTLFVKMRUDS-UHFFFAOYSA-N 466.519 5.580 5 20 JKBD O=C(Nc1ccc(CN2CCCCCC2)cc1)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-] 521004368 ZADNJWUJUKAAMG-UHFFFAOYSA-N 451.445 5.164 5 20 JKBD Cc1nc(CNCc2ccc(-c3ccc([N+](=O)[O-])cc3Br)o2)nc2ccccc12 521831636 CHBYKLGWYBCISZ-UHFFFAOYSA-N 453.296 5.159 5 20 JKBD CN(CCc1ccccn1)C(=O)c1ccccc1Sc1ccc(C(F)(F)F)cc1[N+](=O)[O-] 524488796 XNFJLDRUSPABBG-UHFFFAOYSA-N 461.465 5.475 5 20 JKBD COc1ccccc1CCNC(=O)C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1 603448788 WAMCVHHEFZIRBF-CAPFRKAQSA-N 473.554 5.503 5 20 JKBD C[C@H]1CCCN(c2ccc(C(=O)N3CCC(C(=O)c4ccc(Cl)cc4)CC3)cc2[N+](=O)[O-])C1 604195969 XMADNXHAMYYOJF-KRWDZBQOSA-N 469.969 5.220 5 20 JKBD CC(=O)N(C)c1ccc(NC(=O)c2ccc(NCc3ccccc3Cl)c([N+](=O)[O-])c2)cc1 604478825 AWHLHMSSBPSSFF-UHFFFAOYSA-N 452.898 5.095 5 20 JKBD CCc1ccc([N+](=O)[O-])cc1S(=O)(=O)Nc1nc(C)c(-c2nc3ccccc3n2C(F)F)s1 608927710 IBXOJZNJDBAAHK-UHFFFAOYSA-N 493.517 5.135 5 20 JKBD O=C(Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1)C1CCN(c2nc3ccccc3s2)CC1 608931335 ARQYQCWVLFXIER-UHFFFAOYSA-N 465.560 5.183 5 20 JKBD C[C@H](OC(=O)c1csc(-c2ccc([N+](=O)[O-])cc2)n1)C(=O)Nc1ccc(C(C)(C)C)cc1 747958440 NAFWAPVVPRZOQF-AWEZNQCLSA-N 453.520 5.200 5 20 JKBD CCn1cc(CC(=O)Oc2ccc(NC(=O)c3cc([N+](=O)[O-])ccc3Cl)cc2)c2ccccc21 748160538 IQRYQLYIFAHWPB-UHFFFAOYSA-N 477.904 5.623 5 20 JKBD Cc1c(C(=O)N(C)CCCCCc2cc(-c3ccc(F)cc3)n[nH]2)cc([N+](=O)[O-])c(C)c1[N+](=O)[O-] 748725058 WVZFJZMQQZSBAY-UHFFFAOYSA-N 483.500 5.134 5 20 JKBD O=C(OCC(=O)N1c2ccccc2Sc2ccc(Cl)cc21)c1c[nH]c2ccc([N+](=O)[O-])cc12 749314556 IKAZVCOMQCCXIN-UHFFFAOYSA-N 479.901 5.716 5 20 JKBD C[C@H]1C[C@H](C)CN(c2ccc(C(=O)OCC(=O)Nc3c(Cl)cccc3Cl)cc2[N+](=O)[O-])C1 787458027 ZGNLZNRSRKPDHD-KBPBESRZSA-N 480.348 5.179 5 20 JKBD Cc1ccc(NC(=O)[C@H](OC(=O)/C=C\c2nc3ccccc3s2)c2ccccc2)c([N+](=O)[O-])c1 849190031 VEYJZRGFWOFZSH-QDGLUTFLSA-N 473.510 5.449 5 20 JKBD O=C(Oc1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2Cl)cc1)c1cnc(-c2ccccc2F)s1 920275646 OPJCVEMIVOKSLN-UHFFFAOYSA-N 497.891 5.982 5 20 JKBD Cc1ccoc1C(=O)NC1(c2ccc(NC(=O)Cc3ccc(Cl)cc3[N+](=O)[O-])cc2)CCC1 1786116186 GFFVPUHSMVWPEL-UHFFFAOYSA-N 467.909 5.140 5 20 JKBD O=C(/C=C/c1ccc([N+](=O)[O-])o1)NC1(c2ccc(NC(=O)[C@H]3CCCCC3(F)F)cc2)CCC1 1786461340 FABNQKGUURFEPH-SINXNMPMSA-N 473.476 5.161 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)NC1(c2ccc(NC(=O)c3nccc4occc34)cc2)CCC1 1788341642 TVRJPEIYBKPXHR-UHFFFAOYSA-N 488.475 5.245 5 20 JKBD Cc1ncc(C(=O)Nc2ccc(C3(NC(=O)C4(c5cccc([N+](=O)[O-])c5)CCC4)CCC3)cc2)s1 1788866381 OGELBVSWIDUYBV-UHFFFAOYSA-N 490.585 5.229 5 20 JKBD O=C(CCc1cccc([N+](=O)[O-])c1)NC1(c2ccc(NC(=O)c3ccoc3Cl)cc2)CCC1 1790204384 AAOGWYWBMVDDQP-UHFFFAOYSA-N 467.909 5.222 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)NC1(c2ccc(NC(=O)c3ccoc3Cl)cc2)CCC1 1790206566 BXMQRNZYYGLCKY-UHFFFAOYSA-N 471.872 5.350 5 20 JKBD O=C(CCc1ccsc1)NC1(c2ccc(NC(=O)c3cc(F)cc([N+](=O)[O-])c3)cc2)CCC1 1790696636 QGUGLEPRLXBWQG-UHFFFAOYSA-N 467.522 5.176 5 20 JKBD Cc1c(Cl)ccc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2c(F)ccc([N+](=O)[O-])c2C)c1Cl 1800698719 CDLFETKYRTWWCR-QDMKHBRRSA-N 494.350 5.223 5 20 JKBD Cc1ccc(C(=O)Nc2cc([C@H]3CCCCN3C(=O)CSc3ccccc3[N+](=O)[O-])[nH]n2)cc1C 1820539650 KXKMHHVXMKWDDV-HXUWFJFHSA-N 493.589 5.033 5 20 JKBD O=C(c1ccc2occc2c1)N1CCC([C@@H]2CCCCN2C(=O)c2cc(F)cc([N+](=O)[O-])c2)CC1 1830618156 YVNWQENSXNTJEC-QHCPKHFHSA-N 479.508 5.027 5 20 JKBD O=C(c1cccc2cnccc12)N1CCC([C@@H]2CCCCN2C(=O)/C=C/c2ccccc2[N+](=O)[O-])CC1 1832906623 DJZWAAUXBVYUDU-GIPLCNRYSA-N 498.583 5.090 5 20 JKBD Cc1c(-c2ccccc2)oc2c(C(=O)Nc3cc4c(cc3[N+](=O)[O-])OCCCO4)cccc2c1=O 10964629 CAQBKJZMJJUCPI-UHFFFAOYSA-N 472.453 5.090 5 20 JKBD COc1ccc(C)cc1-c1csc(NC(=O)Cn2c3ccccc3c(=O)c3ccccc32)n1 14335065 MDAFRZKBORJWKH-UHFFFAOYSA-N 455.539 5.234 5 20 JKBD O=[N+]([O-])c1ccc(-c2nnc(CSc3nnc(Cc4cccs4)n3-c3ccccc3)o2)cc1 17758068 UIVPXSPUWVRZPF-UHFFFAOYSA-N 476.543 5.170 5 20 JKBD Cc1c(NC(=O)[C@@H](C)Sc2nnc(-c3ccccc3F)n2Cc2ccccc2)cccc1[N+](=O)[O-] 21750665 WWRAOWXFPDEMGV-QGZVFWFLSA-N 491.548 5.468 5 20 JKBD Cc1nn(Cc2ccc(C(=O)Nc3ccccc3CN(C)C3CCCCC3)cc2)c(C)c1[N+](=O)[O-] 23352688 XUPBPAVDFADKEW-UHFFFAOYSA-N 475.593 5.473 5 20 JKBD O=C(Nc1ncc(Cc2cccc(C(F)(F)F)c2)s1)c1ccn(-c2cccc([N+](=O)[O-])c2)n1 106203227 IFXVNCZCCLHQGV-UHFFFAOYSA-N 473.436 5.099 5 20 JKBD COc1ccc([C@H](CNC(=O)c2c[nH]c3ccc([N+](=O)[O-])cc23)c2c[nH]c3ccccc23)cc1 109869807 MPWCPBMECBBBAY-NRFANRHFSA-N 454.486 5.128 5 20 JKBD COc1cc(C(=O)Nc2ccn(CCc3ccncc3)n2)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 116427812 FEKDSBYZHSIFEZ-UHFFFAOYSA-N 493.907 5.136 5 20 JKBD C[C@H]1CCC[C@H](C)N1C(=O)c1cc(Cl)ccc1NC(=O)c1ccc([N+](=O)[O-])cc1Cl 302941848 LJDUIECMKGKSTK-STQMWFEESA-N 450.322 5.557 5 20 JKBD C[C@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)N[C@H](C)c1ccc(NC(=O)Nc2ccccc2)cc1 480747246 ZWXMRHZIVMNNHW-SJORKVTESA-N 464.547 5.597 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)Nc2nc(-c3ccc4c(c3)CCCC4)cs2)cc1SC 482153056 NBXAKNKXMHTWFD-UHFFFAOYSA-N 455.561 5.580 5 20 JKBD CCCN(CCC)C(=O)c1cccc(C(=O)Nc2nc(-c3cccc([N+](=O)[O-])c3)c(C)s2)c1 483384930 WIYGVXPRNVPRRI-UHFFFAOYSA-N 466.563 5.541 5 20 JKBD Cc1[nH]c2ccc(Br)cc2c1CC(=O)N(Cc1ccccc1[N+](=O)[O-])CC(F)(F)F 486071082 QMVXKYMMLOJMRA-UHFFFAOYSA-N 484.272 5.281 5 20 JKBD Cc1cc(N2CCSCC2)ccc1NC(=O)c1ccc(NCc2ccccc2)c([N+](=O)[O-])c1 497439304 JSEIYPSFIFXSMB-UHFFFAOYSA-N 462.575 5.321 5 20 JKBD CC(=O)NCc1ccc(C(=O)Nc2cc([N+](=O)[O-])ccc2Nc2cccc(C(F)(F)F)c2)cc1 498728841 GQNKWCQTVQHIAS-UHFFFAOYSA-N 472.423 5.246 5 20 JKBD C[C@H](Nc1ccc(C(=O)N2CCN([C@H](C)c3ccccc3Cl)CC2)cc1[N+](=O)[O-])c1ccccn1 506160132 MPMWHEGAPXCFAY-RBUKOAKNSA-N 493.995 5.335 5 20 JKBD C[C@@H](Nc1ccc(C(=O)N(C)Cc2ccccc2N2CCCC2)cc1[N+](=O)[O-])c1ccccn1 507158397 DNYFVBVRQXNCTE-LJQANCHMSA-N 459.550 5.035 5 20 JKBD COc1cc([C@H](C)NCc2ccc(Sc3ccc(C)cc3)c([N+](=O)[O-])c2)cc(OC)c1OC 508102713 MABVNANQRKZTNK-KRWDZBQOSA-N 468.575 5.931 5 20 JKBD COc1ccc(NC(C)=O)c(NC(=O)c2ccc(Sc3ccc(C)cc3)c([N+](=O)[O-])c2)c1 509836032 CHHONCBMTGORGN-UHFFFAOYSA-N 451.504 5.274 5 20 JKBD COc1cc(C(=O)N[C@H](c2ccccc2)c2ccc(F)cc2)c([N+](=O)[O-])cc1OCc1cscn1 512184696 IHBMZQHUHYYEBS-XMMPIXPASA-N 493.516 5.297 5 20 JKBD COc1ccc([C@@H]2CCCN2C(=O)Cc2cn(-c3ccccc3)nc2-c2ccc([N+](=O)[O-])cc2)cc1 514488234 PULSFWXJTQYOIA-SANMLTNESA-N 482.540 5.362 5 20 JKBD COc1cc(C)ccc1Oc1ccc(F)cc1NCc1nc(-c2cccc([N+](=O)[O-])c2)no1 516367444 VPTUPUZGVWGFFD-UHFFFAOYSA-N 450.426 5.505 5 20 JKBD Cc1ccc2sc(N(Cc3ccccc3)C(=O)CSc3ncccc3[N+](=O)[O-])nc2c1C 520939715 IHSRQJNAKPSVCC-UHFFFAOYSA-N 464.572 5.542 5 20 JKBD CCOc1cc(C(=O)Nc2ccc(OCc3cccc(C)c3)cc2C)c([N+](=O)[O-])cc1OC 521537765 IJCLWFPFTSOQMP-UHFFFAOYSA-N 450.491 5.450 5 20 JKBD COc1ccc(NC(=O)NCc2ccc(OC)c([N+](=O)[O-])c2)cc1OCc1ccc2ccccc2n1 524439863 MRHFRQLYNFFNBX-UHFFFAOYSA-N 488.500 5.061 5 20 JKBD CC(=O)Nc1ccc(NC(=O)c2ccc(Sc3nc(C)cs3)c([N+](=O)[O-])c2)c(C(F)(F)F)c1 556960178 KUSJTZZGZFUGJG-UHFFFAOYSA-N 496.492 5.740 5 20 JKBD CC(=O)NC1CCC(NC(=O)c2c3c(nc4ccccc24)/C(=C\c2cccc([N+](=O)[O-])c2)CCC3)CC1 570908933 PMZPUUWSAPCHGY-SILNSSARSA-N 498.583 5.197 5 20 JKBD O=C(C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)NCc1ccc2c(c1)OCO2 601105135 AZBRKTJOTIYHMQ-WOJGMQOQSA-N 473.510 5.180 5 20 JKBD O=C(C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)NCc1ccc(-n2cccn2)cc1 603741966 OWOFHBANBOIHMR-PGMHBOJBSA-N 495.564 5.637 5 20 JKBD COc1ccccc1-c1csc(NC(=O)c2ccc(N3CCC[C@@H](C)C3)c([N+](=O)[O-])c2)n1 603880483 CXTFVEKAPJGJOL-OAHLLOKOSA-N 452.536 5.216 5 20 JKBD Cc1cc(OC(C)C)ccc1NC(=O)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 603993694 NVCDVRNDQOFRAD-UHFFFAOYSA-N 465.472 5.564 5 20 JKBD CCOc1cc(C(=O)N[C@H](c2ccc(C(C)(C)C)cc2)C(F)(F)F)c([N+](=O)[O-])cc1OC 604257411 IIBJHBQVMHWDRQ-LJQANCHMSA-N 454.445 5.333 5 20 JKBD O=C(Nc1ccc(-c2noc(C(F)(F)F)n2)cc1)c1csc(-c2ccc([N+](=O)[O-])cc2)n1 608875811 VHRIFBFZQAQGMR-UHFFFAOYSA-N 461.381 5.039 5 20 JKBD O=C(c1c2c(nc3ccccc13)/C(=C/c1ccc([N+](=O)[O-])cc1)CCC2)N1CCC[C@@H](c2ncc[nH]2)C1 609025645 WNPHIPMXCDHJIK-DHUDHEQZSA-N 493.567 5.763 5 20 JKBD Cc1nc(C)c(CCNC(=O)C/C(=C/c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)s1 609382679 MZYJHZBWQTXCKT-AQTBWJFISA-N 478.599 5.567 5 20 JKBD C[C@H]1CCCCN1C(=O)c1ccc(NC(=O)Cn2c3ccccc3c(=O)c3ccccc32)cc1Cl 614889273 KHLPLOLZKIVTNS-SFHVURJKSA-N 487.987 5.461 5 20 JKBD O=[N+]([O-])c1ccc(/C(O)=C(/C(=S)Nc2ccccc2-c2ccccc2)[n+]2cccc(O)c2)cc1 725763244 IIONTUHMDABSSS-UHFFFAOYSA-O 470.530 5.578 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1F)c1ccc(-n2nc(SCc3ccccc3)sc2=S)cc1 726914925 CXYMYWYUWBCAKR-UHFFFAOYSA-N 498.586 6.255 5 20 JKBD C[C@H](OC(=O)Cc1csc(-c2ccc(Cl)cc2Cl)n1)C(=O)Nc1ccc([N+](=O)[O-])cc1 747259870 WGJWXAZJQSXCPB-NSHDSACASA-N 480.329 5.138 5 20 JKBD O=C(O[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1)c1ccnc2ccccc12 750041836 NIZGKNKIQCEFJF-QFIPXVFZSA-N 461.861 5.333 5 20 JKBD C[C@H](OC(=O)c1c(-n2cccc2)sc2c1CCSC2)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 762807961 JWJPOTNPNZENPN-ZDUSSCGKSA-N 482.543 5.204 5 20 JKBD O=C(CCNc1ccccc1[N+](=O)[O-])Oc1ccc(NC(=O)c2ccccc2Br)cc1 818827357 INKJESYQZAFMNH-UHFFFAOYSA-N 484.306 5.017 5 20 JKBD CCc1ccccc1N(C(C)=O)c1nc(COC(=O)CSc2ccccc2[N+](=O)[O-])cs1 819010546 CULQTFHOESACJW-UHFFFAOYSA-N 471.560 5.134 5 20 JKBD C[C@H](OC(=O)c1ccc(Cl)cc1[N+](=O)[O-])C(=O)N1c2ccccc2Sc2ccccc21 822336492 HJWQQUDGWDSINI-ZDUSSCGKSA-N 454.891 5.623 5 20 JKBD O=C(C[C@@H](NC(=O)c1ccccc1Cl)c1ccccc1)Nc1cc([N+](=O)[O-])c(F)cc1F 825487633 HNAPSXBEJOGSDH-GOSISDBHSA-N 459.836 5.026 5 20 JKBD C[C@H](Nc1ccc(-c2nc(C[C@H](C)N(C)C(=O)OC(C)(C)C)no2)cc1[N+](=O)[O-])c1ccccn1 904654834 IIETYGXVIDKVLU-HOTGVXAUSA-N 482.541 5.011 5 20 JKBD O=C(COc1ccccc1C(=O)Nc1ccc([N+](=O)[O-])cc1)Nc1ccc(SC(F)F)cc1 916665348 FYEMTRUZBJGCRC-UHFFFAOYSA-N 473.457 5.179 5 20 JKBD CCOc1cc([N+](=O)[O-])c(C(=O)NCCCN2c3ccccc3Sc3ccccc32)cc1OC 918091424 GPBNVPMOBXEZJW-UHFFFAOYSA-N 479.558 5.425 5 20 JKBD O=C(Nc1ccccc1SCc1ccccc1)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-] 918556670 IZRJJPTXKFBFAX-UHFFFAOYSA-N 462.449 6.081 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)c3cccc4c3oc3ccccc34)CCC2)cc1)c1ccc([N+](=O)[O-])o1 1785750986 BDULUULLKCMGDW-UHFFFAOYSA-N 495.491 6.149 5 20 JKBD O=C(/C=C/c1ccc([N+](=O)[O-])o1)NC1(c2ccc(NC(=O)COc3cccc(Cl)c3)cc2)CCC1 1785990966 QUGAZXHZKPRJPN-PKNBQFBNSA-N 495.919 5.068 5 20 JKBD Cc1[nH]ccc1C(=O)Nc1ccc(C2(NC(=O)c3cccc([N+](=O)[O-])c3Br)CCC2)cc1 1788806598 YSAVXMKGJZPITN-UHFFFAOYSA-N 497.349 5.055 5 20 JKBD COc1cc(C(=O)NC2(c3ccc(NC(=O)[C@H]4CC[C@H](C)CC4)cc3)CCC2)cc([N+](=O)[O-])c1OC 1791970989 BHSCLXSRVMKMGS-IYARVYRRSA-N 495.576 5.186 5 20 JKBD O=C(Cc1cc(F)ccc1[N+](=O)[O-])Nc1ccc(C2(NC(=O)c3cccc4cnccc34)CCC2)cc1 1792308852 SIIHJAGUZWPWOS-UHFFFAOYSA-N 498.514 5.273 5 20 JKBD O=C(/C=C/c1ccccc1[N+](=O)[O-])Nc1ccc(C2(NC(=O)c3cnc(Cl)s3)CCC2)cc1 1792317483 WAUHXDZYMSMBQQ-IZZDOVSWSA-N 482.949 5.166 5 20 JKBD C[C@H](C(=O)N1CCCC2(CCN(C(=O)c3cccc(F)c3[N+](=O)[O-])CC2)C1)c1ccc(Cl)cc1 1805198674 QVTFRSCPBQHKKR-KRWDZBQOSA-N 487.959 5.036 5 20 JKBD Cc1ccc(C(=O)Nc2cc([C@H]3CCCCN3C(=O)c3cc4cc([N+](=O)[O-])ccc4s3)[nH]n2)o1 1815386216 BJEONRLBTYMSKB-QGZVFWFLSA-N 479.518 5.054 5 20 JKBD Cc1ccoc1C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)[nH]n1 1818172950 TZYORTIGUXRDOH-KRWDZBQOSA-N 479.518 5.054 5 20 JKBD CC1(C)CCC(CC(=O)N2CCCC[C@@H]2c2cc(NC(=O)Cc3cc(F)ccc3[N+](=O)[O-])n[nH]2)CC1 1823487581 NJTJRYVPKWHBRV-JOCHJYFZSA-N 499.587 5.298 5 20 JKBD CC1(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)CSc3ccccc3[N+](=O)[O-])CC2)CCCCC1 1831794302 DAGKIVCXQGNWCF-OAQYLSRUSA-N 487.666 5.277 5 20 JKBD C[C@H](Sc1nnc(-c2ccccc2F)n1Cc1ccccc1)C(=O)Nc1ccccc1[N+](=O)[O-] 9331080 BBDMNVUIMWSKGH-INIZCTEOSA-N 477.521 5.160 5 20 JKBD CCCCn1c(S[C@@H](C)C(=O)Nc2cc([N+](=O)[O-])ccc2Cl)nnc1-c1ccc(OC)cc1 9482754 WBYAAJGUXYKLTF-AWEZNQCLSA-N 489.985 5.435 5 20 JKBD Cc1ccc([N+](=O)[O-])cc1NC(=O)CSc1nnc(-c2ccccc2)n1-c1ccc(F)cc1F 10317000 JLGGCTLAPLECPL-UHFFFAOYSA-N 481.484 5.160 5 20 JKBD CC(=O)N(c1cccc(Cl)c1)c1nc(COC(=O)c2ccc([N+](=O)[O-])cc2Cl)cs1 11028712 BBCYJFRKTFUKGY-UHFFFAOYSA-N 466.302 5.400 5 20 JKBD C[C@H](OC(=O)COc1ccc(Oc2ccccc2)cc1)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 12844338 KFFJSTOGNBXQEO-INIZCTEOSA-N 461.430 5.120 5 20 JKBD CCOc1ccc(NC(=O)c2ccc(NC(=O)c3cc(SC)ccc3[N+](=O)[O-])cc2)cc1 16227028 WKXRMCKPPYSAHF-UHFFFAOYSA-N 451.504 5.220 5 20 JKBD CCCn1c(S[C@@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)nnc1-c1ccc(Cl)cc1 17656596 QABQDZNNLJOWKZ-ZDUSSCGKSA-N 470.942 5.820 5 20 JKBD O=C(/C=C/c1cc(C(F)(F)F)cc(C(F)(F)F)c1)OCc1nnc(-c2ccc([N+](=O)[O-])cc2)o1 25209387 BZJTZJWZBQSTBF-LZCJLJQNSA-N 487.312 5.439 5 20 JKBD Cc1ccc(-n2c(SCc3nnc(-c4ccc([N+](=O)[O-])cc4)o3)nc3ccccc3c2=O)c(C)c1 28614596 AEGRHNWBYCMQHK-UHFFFAOYSA-N 485.525 5.253 5 20 JKBD CN(C(=O)Cc1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1)[C@H]1CCc2ccccc21 30979484 WMOAWVKOANXJDT-VWLOTQADSA-N 452.514 5.136 5 20 JKBD COc1ccc(-c2cc(C(=O)N3CCc4ccc([N+](=O)[O-])cc43)c3ccccc3n2)cc1OC 58493361 BBJFUIVABNDYML-UHFFFAOYSA-N 455.470 5.030 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)N[C@@H](c2ccccc2)c2ccc(Br)cc2)cc1SC 112533226 WADHUJYSTGAADG-NRFANRHFSA-N 487.375 5.607 5 20 JKBD O=C(Nc1cc2c(cc1Cl)OCCCO2)c1ccc(NCc2ccccc2)c([N+](=O)[O-])c1 115348982 ZTOUODXYYFVVBE-UHFFFAOYSA-N 453.882 5.274 5 20 JKBD Cc1nc([N+](=O)[O-])cn1CCC(=O)Nc1ccc(Oc2ccccc2C(F)(F)F)c(F)c1 303000142 OBIULCKKXIUHCP-UHFFFAOYSA-N 452.364 5.079 5 20 JKBD COc1cc(C(=O)N2CC[C@H](c3ccccc3)C2)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 476177455 ZBDMGICCCAMOEE-SFHVURJKSA-N 452.894 5.679 5 20 JKBD COc1ccc(CSCC(=O)N2CCC(C(=O)c3ccc(CC(C)C)cc3)CC2)cc1[N+](=O)[O-] 479979145 NEDBJMJAYBUWDM-UHFFFAOYSA-N 484.618 5.157 5 20 JKBD CCCNC(=O)[C@H]1CCCN(C(=O)c2ccccc2Sc2ccc(C(F)(F)F)cc2[N+](=O)[O-])C1 495741983 LJJDVKMTWOOISP-HNNXBMFYSA-N 495.523 5.143 5 20 JKBD COc1ccc(CNC(=O)C/C(=C/c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)c(OC)c1 498872027 LMFMNSRXLYYSAZ-UYRXBGFRSA-N 489.553 5.469 5 20 JKBD COc1cc([C@@H](C)NC(=O)c2cc3ccccc3c3cccnc23)ccc1OCc1ccncc1 502729264 XGHCSKPSTWRGMH-LJQANCHMSA-N 463.537 5.862 5 20 JKBD O=C(NC1CC1)c1cc(NC(=O)c2cc([N+](=O)[O-])ccc2Oc2ccccc2)ccc1Cl 515645683 LXTLOLVHPWEXMA-UHFFFAOYSA-N 451.866 5.185 5 20 JKBD CC(C)(C)c1cc(NC(=O)c2ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])cc2)n(-c2ncccn2)n1 518701513 NUHUADXCUSZROM-UHFFFAOYSA-N 492.923 5.566 5 20 JKBD CN(Cc1ccncc1)C(=O)c1c2c(nc3ccccc13)/C(=C\c1cccc([N+](=O)[O-])c1)CCC2 601966354 CUAVJBAPWKSDOO-PGMHBOJBSA-N 464.525 5.687 5 20 JKBD CCC(=O)Nc1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2Sc2ccc(Cl)cc2)cc1 603775677 VQUYZLPURGPLRB-UHFFFAOYSA-N 455.923 6.000 5 20 JKBD CCOc1ccc(Oc2ccc(C(F)(F)F)cc2NC(=O)c2cc3c(cc2[N+](=O)[O-])OCO3)cc1 603941508 HPIKIVXAGKCUCI-UHFFFAOYSA-N 490.390 5.786 5 20 JKBD O=C(Nc1cc(-c2nnc3n2CCCCC3)ccc1F)c1csc(-c2cccc([N+](=O)[O-])c2)n1 604517178 HEWMPAOIFVPOCC-UHFFFAOYSA-N 478.509 5.095 5 20 JKBD CCN(CC)S(=O)(=O)c1ccc([C@@H](C)NCc2ccc(-c3ccccc3[N+](=O)[O-])s2)cc1 604539206 YVSSKCUBGXAHGM-QGZVFWFLSA-N 473.620 5.205 5 20 JKBD O=C(C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)Nc1cccc2[nH]ccc12 608879848 BDDMOEWABDVDDB-SAPNQHFASA-N 454.511 6.255 5 20 JKBD CN(Cc1cn(-c2ccccc2)nc1-c1cccs1)C(=O)c1c[nH]c2cc([N+](=O)[O-])ccc12 609600319 XZWXSZFAKRKADD-UHFFFAOYSA-N 457.515 5.263 5 20 JKBD C[C@@H](OC(=O)c1csc(-c2cccc(C(F)(F)F)c2)n1)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl 725997729 QGCQGYKBJUUITP-SNVBAGLBSA-N 499.854 5.575 5 20 JKBD O=C(Cc1c[nH]c2cc(Cl)ccc12)Oc1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2Cl)cc1 727706223 MXPBTPVENOTVEP-UHFFFAOYSA-N 484.295 5.783 5 20 JKBD COc1ccc(/C=C2/N=C(SCc3c(F)cccc3[N+](=O)[O-])N(c3cccc(OC)c3)C2=O)cc1 728787758 WSXCZBGQAVJVEF-LPYMAVHISA-N 493.516 5.428 5 20 JKBD Cc1ccc2nc(-c3cccnc3)cc(C(=O)O[C@H](C)C(=O)Nc3cccc([N+](=O)[O-])c3C)c2c1 730441619 IYAQURNCHPSFEB-QGZVFWFLSA-N 470.485 5.006 5 20 JKBD Cc1c(NC(=O)[C@H](C)Sc2ncc(-c3ccccc3)n2CC(F)(F)F)cccc1[N+](=O)[O-] 748034600 SQLRYRBVWYCJFA-AWEZNQCLSA-N 464.469 5.448 5 20 JKBD Cc1c(C(=O)Nc2nc(-c3ccc(Br)s3)cs2)cc([N+](=O)[O-])c(C)c1[N+](=O)[O-] 748612738 CLXUQYAINDLWIC-UHFFFAOYSA-N 483.325 5.320 5 20 JKBD Cc1c(C(=O)Nc2ncc(Cc3ccc(C(F)(F)F)cc3)s2)cc([N+](=O)[O-])cc1[N+](=O)[O-] 875009922 XZASDSDDCPYYIX-UHFFFAOYSA-N 466.397 5.130 5 20 JKBD O=C(NCc1nc(-c2cccc(Oc3ccccc3)c2)no1)c1c(Cl)cccc1[N+](=O)[O-] 904590350 OQRPBKNZWUWCRR-UHFFFAOYSA-N 450.838 5.021 5 20 JKBD Cc1sc2nc(CS[C@H](C)C(=O)OCc3nc4ccccc4c4ccccc34)nc(O)c2c1C 913212338 UDDPALIVISMYJB-MRXNPFEDSA-N 489.622 6.080 5 20 JKBD Cc1cc(O[C@H](C)C(=O)N(Cc2nnc(-c3cccc([N+](=O)[O-])c3)o2)C(C)C)ccc1C(C)C 916036167 FITJRLHLZURRFY-GOSISDBHSA-N 466.538 5.281 5 20 JKBD CC(C)Oc1cccc(CN[C@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2ccccc2)c1 917937733 BKMFMMIHUVDZPG-QHCPKHFHSA-N 453.926 5.505 5 20 JKBD O=[N+]([O-])c1cccc(-c2nccc(/C=C\c3csc(COc4ccc(Cl)cc4)n3)[n+]2[O-])c1 918712058 GQEJMVJBUBLYQO-SREVYHEPSA-N 466.906 5.150 5 20 JKBD COc1ccc(NC(=O)c2ccc(N[C@H](C)c3ccccn3)c([N+](=O)[O-])c2)cc1OC1CCCC1 919710694 SQWHFKOOHTYCAA-QGZVFWFLSA-N 476.533 5.745 5 20 JKBD C[C@H](Nc1ccc(C(=O)OCc2ncc(-c3ccc(Cl)cc3)o2)cc1[N+](=O)[O-])c1ccccn1 920545176 GMDSZXVCUXWADC-HNNXBMFYSA-N 478.892 5.828 5 20 JKBD CCCCOc1ncccc1CNC(=O)c1ccccc1NC(=O)c1ccc([N+](=O)[O-])cc1Cl 920747074 GLMDSDOTCUZDIV-UHFFFAOYSA-N 482.924 5.004 5 20 JKBD C[C@@H](OC(=O)c1ccc(-n2cnc3ccccc32)cc1)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 921175927 CJVAROKRDNQBGG-CQSZACIVSA-N 498.417 5.137 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)c3c[nH]c4cccc(Cl)c34)CCC2)cc1)c1ccc([N+](=O)[O-])o1 1785750822 UMQNWOCKEDKUJN-UHFFFAOYSA-N 478.892 5.384 5 20 JKBD CO/C=C(\C)C(=O)Nc1ccc(C2(NC(=O)CCCc3cc(C)c(F)cc3[N+](=O)[O-])CCC2)cc1 1789429524 SDGKJDHIWWSHGH-FBMGVBCBSA-N 483.540 5.049 5 20 JKBD O=C(Cc1ccc(Cl)cc1[N+](=O)[O-])NC1(c2ccc(NC(=O)c3cc(Cl)ccn3)cc2)CCC1 1789718907 PQIYGRMFQXUDBY-UHFFFAOYSA-N 499.354 5.287 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)[C@@H]3CCC[C@H]4CCCC[C@H]43)CCC2)cc1)c1ccc([N+](=O)[O-])[nH]1 1790185379 AAVQKWXEGPNFPJ-DUXKGJEZSA-N 464.566 5.277 5 20 JKBD COc1ccccc1C(=O)Nc1ccc(C2(NC(=O)Cn3ccc4ccc([N+](=O)[O-])cc43)CCC2)cc1 1790229538 AUKRXJHBQSLNGC-UHFFFAOYSA-N 498.539 5.006 5 20 JKBD COc1cc(CC(=O)NC2(c3ccc(NC(=O)[C@H]4C[C@@H]4c4ccccc4)cc3)CCC2)ccc1[N+](=O)[O-] 1791534338 SFICIJOVOIBVGU-RPWUZVMVSA-N 499.567 5.084 5 20 JKBD O=C(Cc1cc(F)ccc1[N+](=O)[O-])Nc1ccc(C2(NC(=O)c3ccc4occc4c3)CCC2)cc1 1792308718 CWBQKXATDSKKHS-UHFFFAOYSA-N 487.487 5.471 5 20 JKBD O=C(Nc1cc([C@@H]2CCCCN2C(=O)C2CCCCC2)[nH]n1)c1cc2cc([N+](=O)[O-])ccc2s1 1821610439 ZEPWKDBLJWFAFL-IBGZPJMESA-N 481.578 5.419 5 20 JKBD CC(C)[C@@H](C(=O)N1CCC([C@H]2CCCCN2C(=O)/C=C/c2ccc([N+](=O)[O-])o2)CC1)c1ccccc1 1824275533 CZBAVNYKMYAGBS-QIPWJXNQSA-N 493.604 5.261 5 20 JKBD Cc1c(C(=O)N2CC3(CCCN3C(=O)c3cc4cccc(F)c4s3)C2)cc(Cl)cc1[N+](=O)[O-] 1843702841 UDLFPTTYFPZGCW-UHFFFAOYSA-N 487.940 5.041 5 20 JKBD O=C(c1c[nH]c2cccc(Cl)c12)N1CC2(CCCN2C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)C1 1845739109 LTOXWIGELNWRMG-UHFFFAOYSA-N 494.960 5.075 5 20 JKBD O=C(Nc1cc2c(cc1[N+](=O)[O-])OCCCO2)c1nc(Cl)c(Cl)c(Cl)c1Cl 10964329 NNFJPXWKWLTTHH-UHFFFAOYSA-N 453.065 5.017 5 20 JKBD COc1ccccc1Oc1ccc(NC(=O)Cn2c3ccccc3c(=O)c3ccccc32)cc1 14344107 YWVVOOUFBRWSIX-UHFFFAOYSA-N 450.494 5.594 5 20 JKBD C[C@@H](OC(=O)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1)C(=O)Nc1ccccc1Cl 17109874 JSFJVHDMRDMSLX-CYBMUJFWSA-N 499.873 5.054 5 20 JKBD CCOc1ccccc1Nc1nnc(S[C@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)s1 20789657 UDMWDJHOFJDFNB-LLVKDONJSA-N 479.971 5.361 5 20 JKBD CC(=O)Nc1cccc(-n2c(Sc3ccc(C(=O)c4ccccc4)cc3[N+](=O)[O-])nnc2C2CC2)c1 26723849 YMEHPEZGEWDZSM-UHFFFAOYSA-N 499.552 5.394 5 20 JKBD Cc1onc(-c2ccccc2Cl)c1C(=O)OCC(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 28810683 SQAQIWSKNLBLBK-UHFFFAOYSA-N 483.786 5.026 5 20 JKBD COc1cc2c(cc1OC)[C@@H](c1cccs1)N(C(=O)c1ccc(N3CCCC3)c([N+](=O)[O-])c1)CC2 39203795 AXUJALGJPIMGJR-VWLOTQADSA-N 493.585 5.062 5 20 JKBD Cc1sc(NC(=O)CCCc2nc(-c3cccs3)no2)nc1-c1cccc([N+](=O)[O-])c1 195704333 PZNUNOJZNSDBEU-UHFFFAOYSA-N 455.521 5.100 5 20 JKBD C[C@@H](NC(=O)c1csc(-c2cccc([N+](=O)[O-])c2)n1)c1cccc(OCc2ccccn2)c1 215725153 XQGUUWBDPBBTKV-MRXNPFEDSA-N 460.515 5.183 5 20 JKBD C[C@H](Nc1ccc(C(=O)Nc2ccc3[nH]c(C4CCC4)nc3c2)cc1[N+](=O)[O-])c1ccccn1 303078750 BULZOVPSGKJCGZ-HNNXBMFYSA-N 456.506 5.559 5 20 JKBD C[C@@H](Nc1ccc(C(=O)Nc2ccc3[nH]c(C4CCC4)nc3c2)cc1[N+](=O)[O-])c1ccccn1 303078753 BULZOVPSGKJCGZ-OAHLLOKOSA-N 456.506 5.559 5 20 JKBD O=C(NC[C@@H]1CCCN(C(=O)c2ccc(Nc3ccccc3)c([N+](=O)[O-])c2)C1)Nc1cccc(F)c1 303174039 RZBWUNJKNJQJHX-SFHVURJKSA-N 491.523 5.151 5 20 JKBD COc1ccc(CN(C)C(=O)c2ccc(Sc3nc(C)cs3)c([N+](=O)[O-])c2)cc1OC(F)F 482638913 LZLYABADUNUPOM-UHFFFAOYSA-N 495.529 5.393 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)Nc2ccc(OCc3cccc(Cl)c3)cc2C)cc1SC 484334958 PDSDNNRBPUGQON-UHFFFAOYSA-N 472.950 6.118 5 20 JKBD CC(C)CCSc1ccc(C(=O)N(C)[C@H](C)c2ccc(-n3cncn3)cc2)cc1[N+](=O)[O-] 499193492 NWGBCUDNTPOQRK-QGZVFWFLSA-N 453.568 5.147 5 20 JKBD COc1cc([C@H](C)NC(=O)Cn2c3ccccc3c(=O)c3ccccc32)ccc1OCc1ccncc1 502695952 HNCKUYKCJIKZNX-FQEVSTJZSA-N 493.563 5.015 5 20 JKBD C[C@H](Nc1ccc(C(=O)N(C)[C@@H](C)c2nc3ccccc3s2)cc1[N+](=O)[O-])c1ccccn1 504280405 PPYSBUIEPGXFOZ-HOTGVXAUSA-N 461.547 5.606 5 20 JKBD CC[C@H](C)c1ccc([C@H](NC(=O)c2cc(OC)c(OC)cc2[N+](=O)[O-])c2cccs2)cc1 512408168 BPTTWKOIYUGLCE-WNSKOXEYSA-N 454.548 5.706 5 20 JKBD Cn1ncc2c1CCC[C@H]2NC(=O)c1ccccc1Sc1ccc(C(F)(F)F)cc1[N+](=O)[O-] 512787240 GGOXNIQFJPGIOR-MRXNPFEDSA-N 476.480 5.306 5 20 JKBD COc1cc(C(=O)Nc2cc(F)ccc2Oc2ccc(C)cc2OC)c([N+](=O)[O-])cc1OC 513038000 VYYNXAYOHRXPIM-UHFFFAOYSA-N 456.426 5.113 5 20 JKBD COc1cc(CNc2cc(NC(=O)C3CC3)ccc2C)ccc1OCc1ccc([N+](=O)[O-])cc1 513573834 YLULKPKZYGXDDU-UHFFFAOYSA-N 461.518 5.451 5 20 JKBD COc1ccc([N+](=O)[O-])cc1NC(=O)[C@H](C)Nc1ccc(Oc2ncc(Cl)cc2Cl)cc1 515762715 MUHUNNMYZQTYCX-LBPRGKRZSA-N 477.304 5.537 5 20 JKBD C[C@H]1C[C@H](C)CN(c2ccc(C(=O)N3CCC(C(=O)c4ccc(Cl)cc4)CC3)cc2[N+](=O)[O-])C1 515988698 FXGIREMBIBZGBQ-ROUUACIJSA-N 483.996 5.466 5 20 JKBD Cc1ccc(NC(=O)NC[C@H]2CCCN(C(=O)c3cc4ccccc4c4cccnc34)C2)cc1 590115027 SRYNNVBYTUQRPE-HXUWFJFHSA-N 452.558 5.370 5 20 JKBD O=C(CCSc1nnc(-c2ccccc2Cl)n1C1CCCC1)Nc1ccc([N+](=O)[O-])cc1 592993791 UMGXLWMBUOORMP-UHFFFAOYSA-N 471.970 5.743 5 20 JKBD CC(C)Sc1ccc([N+](=O)[O-])cc1C(=O)N1C[C@H]2CC[C@H]1[C@H]1CN(Cc3ccccc3)C[C@@H]21 594660285 KFJQJHJRPSMJAY-DLTYFMDKSA-N 465.619 5.078 5 20 JKBD COc1ccc(NC(=O)c2ccc(OCc3ccc(Br)cc3)c(OC)c2)c([N+](=O)[O-])c1 603732733 UQWROVVLPTZQSV-UHFFFAOYSA-N 487.306 5.206 5 20 JKBD CCOC(=O)c1sc(NC(=O)c2cc(OCC(F)(F)F)ccc2[N+](=O)[O-])nc1-c1ccccc1 603734100 NUQHAYBFJRNQOR-UHFFFAOYSA-N 495.435 5.088 5 20 JKBD Cc1ccc(NC(=O)c2ccccc2)cc1NC(=O)c1cc([N+](=O)[O-])ccc1Sc1ccccc1 603774368 PDLJURWIMAPFKF-UHFFFAOYSA-N 483.549 6.559 5 20 JKBD CC(=O)Nc1cc(NC(=O)c2ccc(NCc3ccccc3Cl)c([N+](=O)[O-])c2)ccc1C 603774503 VDVYTFLJTYCFRK-UHFFFAOYSA-N 452.898 5.379 5 20 JKBD C[C@H](Nc1ccc(C(=O)Nc2ccnc(Sc3ccccn3)c2)cc1[N+](=O)[O-])c1ccccn1 608807094 PNNXEXWOCORMPP-INIZCTEOSA-N 472.530 5.356 5 20 JKBD O=C(C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)N(Cc1ccccn1)C1CC1 619218326 VYHIXKPQHNFYNL-XDJHFCHBSA-N 470.554 5.721 5 20 JKBD COC1CCN(c2ccc(NC(=O)N[C@H](C)c3cccc([N+](=O)[O-])c3)cc2C(F)(F)F)CC1 728125097 RACNBTYZMYNVMS-CQSZACIVSA-N 466.460 5.112 5 20 JKBD COc1ccc(NC(=O)[C@H](OC(=O)c2csc(-c3cccc([N+](=O)[O-])c3)n2)c2ccccc2)cc1 747963582 WMIVYKRCAGAWNY-JOCHJYFZSA-N 489.509 5.264 5 20 JKBD COc1ccc(C23C[C@H]4C[C@@H](CC(C(=O)OCc5nnc(-c6ccc([N+](=O)[O-])cc6)o5)(C4)C2)C3)cc1 792214465 FYSQHZAEMWBZKD-HVRNZWLGSA-N 489.528 5.235 5 20 JKBD Cc1csc(Sc2ccc([N+](=O)[O-])cc2C(=O)O[C@@H](C)C(=O)Nc2ccc(F)cc2Cl)n1 849132403 IOOBPFCFQNNFQI-NSHDSACASA-N 495.941 5.487 5 20 JKBD Nc1ncc([N+](=O)[O-])cc1-c1nc(-c2ccc(Oc3ncc(C(F)(F)F)cc3Cl)cc2)no1 904670265 KLGPEFKUUQZVNT-UHFFFAOYSA-N 478.774 5.149 5 20 JKBD Cc1ccc(-c2nc(C(=O)Oc3ccc4c(-c5ccc([N+](=O)[O-])cc5)cc(=O)oc4c3)cs2)o1 915132182 CNDAMOBTSQYMRT-UHFFFAOYSA-N 474.450 5.612 5 20 JKBD COc1ccc(COC(=O)c2cccnc2Oc2ccc(F)cc2Br)cc1[N+](=O)[O-] 917299486 BRLHWTUCWNCROP-UHFFFAOYSA-N 477.242 5.049 5 20 JKBD CC(=O)N(c1ccc(Cl)cc1)c1nc(COC(=O)c2cc(Cl)ccc2[N+](=O)[O-])cs1 918863447 QEWNMKHIXZRXKA-UHFFFAOYSA-N 466.302 5.400 5 20 JKBD Cc1sc(=O)n(CC(=O)OCc2nc3ccccc3c3ccccc23)c1-c1ccc(F)cc1 919171320 WKMIXJCIWLMXFP-UHFFFAOYSA-N 458.514 5.469 5 20 JKBD CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 919867240 IIXCAHLVVUMAGO-UHFFFAOYSA-N 494.470 5.175 5 20 JKBD O=C(Cc1cccc([N+](=O)[O-])c1)NC1(c2ccc(NC(=O)c3c(Cl)cncc3Cl)cc2)CCC1 1785786947 FSSRBPSAYBJZTC-UHFFFAOYSA-N 499.354 5.287 5 20 JKBD O=C(Cc1ccc(Cl)cc1[N+](=O)[O-])Nc1ccc(C2(NC(=O)Cc3ccsc3)CCC2)cc1 1786116599 VPKBXGVXKUAJJC-UHFFFAOYSA-N 483.977 5.229 5 20 JKBD CC(C)(C)CC(=O)Nc1ccc(C2(NC(=O)CSc3ccccc3[N+](=O)[O-])CCC2)cc1 1787660843 ZDGLOGCOEHTZSZ-UHFFFAOYSA-N 455.580 5.257 5 20 JKBD O=C(Cc1ccc([N+](=O)[O-])cc1F)NC1(c2ccc(NC(=O)c3cccc4cc[nH]c34)cc2)CCC1 1789092962 MJENYMJPLMLLSA-UHFFFAOYSA-N 486.503 5.206 5 20 JKBD CC(C)O[C@H](C)C(=O)Nc1ccc(C2(NC(=O)c3cc4cc([N+](=O)[O-])ccc4s3)CCC2)cc1 1789596953 KACQZRIYFMVLSB-MRXNPFEDSA-N 481.574 5.371 5 20 JKBD CN(C)c1ccc(C(=O)NC2(c3ccc(NC(=O)c4ccc([N+](=O)[O-])[nH]4)cc3)CCC2)c2ccccc12 1790185828 GQRBHSFLSLNWAP-UHFFFAOYSA-N 497.555 5.204 5 20 JKBD CC[C@@H](C)[C@@H](C(=O)N1CCCC2(CCN(C(=O)c3ccc([N+](=O)[O-])cc3F)CC2)C1)c1ccccc1 1809161978 IOYJGMJPMOXWBA-CJFMBICVSA-N 495.595 5.409 5 20 JKBD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2cc(F)cc([N+](=O)[O-])c2)[nH]n1)[C@@H]1CCC[C@H]2CCCC[C@H]21 1818930902 DJGQUISICRNXDT-SUIZVZERSA-N 497.571 5.369 5 20 JKBD CC(C)c1ccc(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)c3cccc(F)c3[N+](=O)[O-])[nH]n2)cc1 1820591570 CTUKQUDDAUCVHO-NRFANRHFSA-N 479.512 5.200 5 20 JKBD O=C(c1cc(F)cc([N+](=O)[O-])c1)N1CCC([C@H]2CCCCN2C(=O)c2cccc3ccoc23)CC1 1830990810 KUBBMPJYXDQYSI-HSZRJFAPSA-N 479.508 5.027 5 20 JKBD Cc1cccc(C(=O)N2CCCC[C@H]2C2CCN(C(=O)/C=C/c3ccc([N+](=O)[O-])o3)CC2)c1Cl 1832604872 XCNBFOBIWFUDGL-DJGBTNNQSA-N 485.968 5.096 5 20 JKBD CC(C)c1csc(C(=O)N2CCC([C@@H]3CCCCN3C(=O)/C=C/c3ccccc3[N+](=O)[O-])CC2)n1 1832902929 FUYFGESBELOMJY-NEQMZLFVSA-N 496.633 5.121 5 20 JKBD Cc1cc(C(=O)COC(=O)Cn2c3ccccc3c(=O)c3ccccc32)c(C)n1CCc1cccs1 11278499 VIRPOASXEVXQQP-UHFFFAOYSA-N 498.604 5.303 5 20 JKBD CCN1C/C(=C\c2ccc(Oc3ccc(F)cc3)c([N+](=O)[O-])c2)c2nc3ccccc3c(C(=O)O)c2C1 13343306 CMXBXNWXSWVUAY-QGOAFFKASA-N 499.498 6.149 5 20 JKBD CC(C)c1ccc(Nc2nnc(S[C@H](C)c3nnc(-c4ccc([N+](=O)[O-])cc4)o3)s2)cc1 17537897 UIZJIIMGNPCXDA-CYBMUJFWSA-N 468.564 6.217 5 20 JKBD CCCc1ccc(-c2nc(NC(=O)c3cc(OCC)c(OC)cc3[N+](=O)[O-])sc2C)cc1 27147609 UCTNYWYNANMIIK-UHFFFAOYSA-N 455.536 5.639 5 20 JKBD CCN(CC)C(=O)c1ccc(NC(=O)c2ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])cc2)cc1 27222411 BNRAUYZBODLDRO-UHFFFAOYSA-N 467.909 5.775 5 20 JKBD CCOc1cc([N+](=O)[O-])c(C(=O)Nc2nc(-c3cccc(C(F)(F)F)c3)cs2)cc1OC 29013485 HPGBEOSEOYZQLQ-UHFFFAOYSA-N 467.425 5.397 5 20 JKBD CCN(CC)C(=O)c1ccc(CNC(=O)c2cc([N+](=O)[O-])ccc2Sc2ccc(Cl)cc2)cc1 31797198 OWUIVHBJHAUGNV-UHFFFAOYSA-N 498.004 5.811 5 20 JKBD C[C@@H](Nc1ccc(C(=O)N(C)Cc2ccccc2Br)cc1[N+](=O)[O-])c1ccccn1 108753956 HXSCBQZNUKXNDW-OAHLLOKOSA-N 469.339 5.198 5 20 JKBD O=C(C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)N1CC[C@H](c2ccccc2F)C1 410290403 RLRVCLAGXROKNR-AZGFIHASSA-N 487.556 6.290 5 20 JKBD Cc1cc(N(C)C)ccc1NC(=O)C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1 482462261 GHHYLSBOECRORK-XDJHFCHBSA-N 472.570 6.148 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)N2CC[C@@H](C)Sc3ccc(C(F)(F)F)cc32)cc1SC 482993284 LZIIHWIDFCAAGQ-LLVKDONJSA-N 472.510 5.875 5 20 JKBD O=C(Nc1ccc(S(=O)(=O)Nc2ccc(F)cc2F)cc1)c1cc2cc([N+](=O)[O-])ccc2s1 490775836 SWQLJLPULNXKPR-UHFFFAOYSA-N 489.481 5.141 5 20 JKBD Cc1ccc(NC(=O)[C@@H](c2ccccc2)N2CCC(OC3CCCCC3)CC2)c([N+](=O)[O-])c1 497406101 MYHGIXGPZOYGKJ-RUZDIDTESA-N 451.567 5.397 5 20 JKBD Cc1c(NC(=O)c2cc([N+](=O)[O-])ccc2NCc2ccccc2)cccc1C(=O)Nc1ccccc1 498437598 ZPWYVKZFQSPLND-UHFFFAOYSA-N 480.524 6.020 5 20 JKBD CCCN1CCC(CNC(=O)C/C(=C/c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)CC1 500219222 VTBKCFGWBXZLDA-PGMHBOJBSA-N 478.618 5.373 5 20 JKBD CCCN(C(=O)c1ccc(Sc2nncn2C)c([N+](=O)[O-])c1)[C@H](C)c1ccc(Cl)c(Cl)c1 502825171 PUZIWGRNGNKQKD-CYBMUJFWSA-N 494.404 5.795 5 20 JKBD CCOC(=O)c1cc(C(=O)Nc2ccc(Cl)cc2C(=O)N2[C@@H](C)CCC[C@@H]2C)cc([N+](=O)[O-])c1 508305909 MUPSKQBWKVULHC-GJZGRUSLSA-N 487.940 5.080 5 20 JKBD CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)Nc1cccc(OCC(=O)Nc2ccccc2)c1 509548603 IVJZRGWZBBOATR-UHFFFAOYSA-N 462.506 5.055 5 20 JKBD COc1cc(C(=O)N(C)CCc2ccc(F)cc2)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 509656092 ICFNWWBRDNFXAB-UHFFFAOYSA-N 458.873 5.503 5 20 JKBD COc1cc(C(=O)Nc2cccc(-c3n[nH]c(C)n3)c2)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 511372546 IXOHEQGLEUZLCW-UHFFFAOYSA-N 479.880 5.395 5 20 JKBD COc1c(Cl)cccc1NC(=O)c1ccccc1C(=O)c1ccc(SC)c([N+](=O)[O-])c1 512815382 QUJQSMTWQXEBJK-UHFFFAOYSA-N 456.907 5.462 5 20 JKBD COc1ccc(Cl)cc1-c1cc(NC(=O)c2csc(-c3ccc([N+](=O)[O-])cc3)n2)n[nH]1 512845666 LUBSWTIKGXXNFU-UHFFFAOYSA-N 455.883 5.023 5 20 JKBD O=C(Nc1ccc(Br)cn1)[C@H]1CCCN(C(=O)c2cc3ccccc3c3cccnc23)C1 515862344 PAHRYQIOQLQZEL-KRWDZBQOSA-N 489.373 5.036 5 20 JKBD Cc1ccc(S(=O)(=O)Nc2ccc(C(=O)Nc3scnc3-c3ccccc3)cc2)cc1[N+](=O)[O-] 551358288 UXTIYRMYUQGOOX-UHFFFAOYSA-N 494.554 5.080 5 20 JKBD O=C(C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)NCCCc1nc2ccccc2[nH]1 561046830 VFUDVCOZWGMMGK-KNTRCKAVSA-N 497.580 5.761 5 20 JKBD COc1cc(CN(C)C(=O)c2cc([N+](=O)[O-])ccc2NCc2ccccc2)ccc1OC(F)F 598796539 NPZMVNYZOVLMFE-UHFFFAOYSA-N 471.460 5.089 5 20 JKBD O=C(NC[C@@H]1CCCc2ccccc21)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 603477622 HHQFFOUOUMGKQU-SFHVURJKSA-N 461.484 5.066 5 20 JKBD Cc1csc(CCNC(=O)c2ccc(Sc3nc4ccccc4s3)c([N+](=O)[O-])c2)n1 603558723 RFPLKXFNKAMMCG-UHFFFAOYSA-N 456.574 5.093 5 20 JKBD COCCN(C(=O)c1cnc(-c2ccccc2)s1)c1nc(-c2ccc([N+](=O)[O-])cc2)cs1 603730775 OCFVRTWZNUTETD-UHFFFAOYSA-N 466.544 5.135 5 20 JKBD O=C(Nc1nc2cc(C(F)(F)F)ccc2n1Cc1ccco1)c1cnn(-c2ccc([N+](=O)[O-])cc2)c1 603837341 CDOXTJCFEHXXOG-UHFFFAOYSA-N 496.405 5.043 5 20 JKBD Cc1ccc([N+](=O)[O-])cc1NC(=O)CSc1nnc(-c2ccccc2)n1[C@@H](C)c1ccccc1 603917258 JKXXMHHKXDAZCC-SFHVURJKSA-N 473.558 5.502 5 20 JKBD C[C@H](N[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Br)c1ccccc1)c1c(F)cccc1F 604047857 NUVREFIEAMTYAN-YEJXKQKISA-N 490.304 5.666 5 20 JKBD COc1cc(CNCc2ccc(-c3nc4ccccc4s3)o2)c([N+](=O)[O-])cc1OCC(F)(F)F 604532469 VSELSMSDRAZNKB-UHFFFAOYSA-N 493.463 5.704 5 20 JKBD COc1ccc(C[C@@H](NC(=O)c2cc(SC)ccc2[N+](=O)[O-])c2ccccc2)cc1OC 608948470 AEPFUUNXFCSWEO-HXUWFJFHSA-N 452.532 5.048 5 20 JKBD Cc1ccc(NC(=O)c2ccc(N3CCCN(C(=O)c4cccc(Cl)c4)CC3)c([N+](=O)[O-])c2)cc1 608974557 JWTQHWXQIALQIQ-UHFFFAOYSA-N 492.963 5.161 5 20 JKBD Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)[C@@H](C)SCc1nc(O)c2c(-c3ccccc3)csc2n1 610860165 GUOCHXILORLXHA-OAHLLOKOSA-N 494.598 5.849 5 20 JKBD C[C@H]1CN(c2ccc(NC(=O)c3cc([N+](=O)[O-])ccc3Cl)cc2C(F)(F)F)C[C@H](C)O1 728010150 FHMZKFHKJRXGEW-RYUDHWBXSA-N 457.836 5.133 5 20 JKBD C[C@@H](OC(=O)COc1ccc(C2SCCCS2)cc1)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 746244726 AGNFSWADSDITMH-CQSZACIVSA-N 487.559 5.197 5 20 JKBD CCC(CC)c1cc[n+](/C(C(=S)NCc2cccs2)=C(/O)c2ccc(C)c([N+](=O)[O-])c2)cc1 839412837 BNHODKRRVAOJIP-UHFFFAOYSA-O 482.651 6.157 5 20 JKBD Cc1ccccc1-c1cc(C(=O)Nc2cc([N+](=O)[O-])c(F)cc2F)c2cnn(C(C)C)c2n1 897592757 WPFSBLGGVJHCBB-UHFFFAOYSA-N 451.433 5.426 5 20 JKBD Cc1nc([N+](=O)[O-])cn1CCc1nc(-c2ccc(Oc3ncc(C(F)(F)F)cc3Cl)cc2)no1 904668830 PCNXKFANJZGPLP-UHFFFAOYSA-N 494.817 5.252 5 20 JKBD O=[N+]([O-])c1cc(C(F)(F)F)ccc1N1CCC(c2nc(-c3ccc(F)cc3F)no2)CC1 904802244 GNWLRNWIGCXZST-UHFFFAOYSA-N 454.355 5.326 5 20 JKBD CC(C)(C)OC(=O)NC1(c2noc(-c3ccc(NCc4ccccc4Cl)c([N+](=O)[O-])c3)n2)CC1 904998542 XIWNHLFTQAOCMY-UHFFFAOYSA-N 485.928 5.424 5 20 JKBD CC(C)c1noc2nc(C3CC3)cc(C(=O)Oc3ccc(NC(=O)c4cccc([N+](=O)[O-])c4)cc3)c12 915811573 XBMURGYVUIQPQY-UHFFFAOYSA-N 486.484 5.603 5 20 JKBD Cc1ccc(NC(=O)CSCC(=O)Nc2cc(Cl)c([N+](=O)[O-])cc2OCc2ccccc2)cc1 916827692 QZVSUUDVUFBGSM-UHFFFAOYSA-N 499.976 5.446 5 20 JKBD C[C@@H](OC(=O)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-])C(=O)Nc1cccc(Cl)c1Cl 919195454 IHSGKAOUYKBYFZ-SECBINFHSA-N 481.210 5.027 5 20 JKBD C[C@H](OC(=O)c1ccc(N[C@@H](C)c2ccccn2)c([N+](=O)[O-])c1)C(=O)Nc1cccc2ccccc12 920543659 HIQIUPGTUGPULC-ROUUACIJSA-N 484.512 5.500 5 20 JKBD O=C(NC1(c2ccc(NC(=O)[C@@H]3CCCCC3(F)F)cc2)CCC1)c1nc2cc([N+](=O)[O-])ccc2[nH]1 1786464606 FMIKGOAJLBOQND-SFHVURJKSA-N 497.502 5.044 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)c3sc4ccccc4c3Cl)CCC2)cc1)c1nc[nH]c1[N+](=O)[O-] 1788612265 KWKDUZCSSLYDAH-UHFFFAOYSA-N 495.948 5.248 5 20 JKBD Cc1c(C(=O)Nc2ccc(C3(NC(=O)c4ccccn4)CCC3)cc2)cc(Cl)cc1[N+](=O)[O-] 1790774672 WPSJMPIWFXWSBP-UHFFFAOYSA-N 464.909 5.013 5 20 JKBD O=C(Cc1ccc(Cl)cc1[N+](=O)[O-])NC1(c2ccc(NC(=O)[C@H]3CCCSC3)cc2)CCC1 1792283463 OBAJSRHKZJYHFZ-KRWDZBQOSA-N 488.009 5.068 5 20 JKBD O=C(Cc1cc(F)ccc1[N+](=O)[O-])Nc1ccc(C2(NC(=O)c3cccc4ccoc34)CCC2)cc1 1792310255 WRZXGRXKERPEQZ-UHFFFAOYSA-N 487.487 5.471 5 20 JKBD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)/C=C/c1ccc([N+](=O)[O-])o1)c1cc2c(Cl)cccc2s1 1793274193 SEJLMWLHEGIRAP-XTPKAHCJSA-N 485.949 5.021 5 20 JKBD O=C(/C=C/c1ccccc1[N+](=O)[O-])Nc1cc([C@@H]2CCCCN2C(=O)c2c(F)cccc2Cl)[nH]n1 1823502576 BIDLRXZULRNSIT-SGWGQVFISA-N 497.914 5.130 5 20 JKBD Cc1cc(Cl)ccc1C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cccc(F)c2[N+](=O)[O-])CC1 1823911956 HHUFPGKGVKPXDJ-JOCHJYFZSA-N 487.959 5.243 5 20 JKBD Cc1cc(C)cc(C(=O)N2CCC([C@@H]3CCCCN3C(=O)CSc3ccccc3[N+](=O)[O-])CC2)c1 1831777374 QUHKXVYSVBKULV-QHCPKHFHSA-N 495.645 5.237 5 20 JKBD COc1ccc(CN(C)[C@@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Br)c2ccccc2)cc1 16554749 YUJBNFALOZSMLI-JOCHJYFZSA-N 484.350 5.178 5 20 JKBD C[C@H](OC(=O)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1)c1nc2ccccc2c(=O)[nH]1 23634563 JXCLOUQALNMIRQ-ZDUSSCGKSA-N 465.849 5.195 5 20 JKBD O=[N+]([O-])c1ccc(-c2noc(CSc3nnc(-c4ccc(F)cc4)n3Cc3ccccc3)n2)cc1 46865022 HCXADOMCNYGEEN-UHFFFAOYSA-N 488.504 5.383 5 20 JKBD COCCOc1cc([N+](=O)[O-])c(C(=O)Nc2ccc3nc(-c4ccccc4Cl)[nH]c3c2)cc1OC 68729045 YYMCBJXRIJOURS-UHFFFAOYSA-N 496.907 5.078 5 20 JKBD CC[C@@H](C)Sc1ccc(NC(=O)CCCn2c(=O)oc3cc([N+](=O)[O-])ccc32)c(C(F)(F)F)c1 109734580 PMCPJACTJYUKOA-CYBMUJFWSA-N 497.495 5.831 5 20 JKBD Cc1nn(Cc2ccc(C(=O)Nc3cc(Cl)ccc3Sc3nccn3C)cc2)c(C)c1[N+](=O)[O-] 110103942 GXECYNWDRRGJPK-UHFFFAOYSA-N 496.980 5.247 5 20 JKBD Cc1sc(NC(=O)Cc2csc(-c3cccc(F)c3)n2)nc1-c1cccc([N+](=O)[O-])c1 195703943 LGEFDZZMVYETSW-UHFFFAOYSA-N 454.508 5.471 5 20 JKBD CN(C(=O)c1cccc(NC(=O)c2csc(-c3ccc([N+](=O)[O-])cc3)n2)c1)c1ccccc1 303036749 PCMMNMHMWJZJJG-UHFFFAOYSA-N 458.499 5.247 5 20 JKBD Cc1c(NC(=O)Cn2c3ccccc3c(=O)c3ccccc32)cccc1NC(=O)c1ccccc1 409508919 GQBOLYUFCOWZNH-UHFFFAOYSA-N 461.521 5.354 5 20 JKBD O=C(Nc1ccccc1-c1ccc(-c2ccccc2)cc1)c1ccc(-n2cncn2)c([N+](=O)[O-])c1 410035938 BFMVBPUIQMMTEO-UHFFFAOYSA-N 461.481 5.762 5 20 JKBD CCOc1ccc(-n2c(SCC(=O)Nc3ccccc3[N+](=O)[O-])nnc2-c2ccc(F)cc2)cc1 479899536 WNEBTOJXLKFJTB-UHFFFAOYSA-N 493.520 5.111 5 20 JKBD Cc1ccc(-c2cnc(-c3ccccc3C(=O)Nc3cc([N+](=O)[O-])ccc3OC(F)F)o2)cc1 483014464 OLHYEZWGDBWAAT-UHFFFAOYSA-N 465.412 6.079 5 20 JKBD Cc1nc(SCc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)n([C@@H](C)[C@H]2C[C@H]3CC[C@H]2C3)c1C 485044194 HRTHWVDJHMCQIG-ZTTFOMCMSA-N 453.568 5.748 5 20 JKBD O=C(C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)Nc1ccnn1C[C@@H]1CCOC1 486244880 MPHZZYPNOUZIOK-UZNZLNSGSA-N 489.557 5.007 5 20 JKBD COC(=O)c1cc(C(=O)N(CCc2ccccc2)c2nc(-c3ccccc3)cs2)cc([N+](=O)[O-])c1 491197022 ULMKRWCKYLIMQE-UHFFFAOYSA-N 487.537 5.394 5 20 JKBD Cc1cc(C(=O)NCC(C)C)ccc1NC(=O)CSc1ccc(C(F)(F)F)cc1[N+](=O)[O-] 495681866 DCMJMEBEPGZDBA-UHFFFAOYSA-N 469.485 5.039 5 20 JKBD Cc1ccc(Sc2ccc(C(=O)N3CCC(NC(=O)c4ccc(C)s4)CC3)cc2[N+](=O)[O-])cc1 497311713 OJRAFVJJPANJLY-UHFFFAOYSA-N 495.626 5.459 5 20 JKBD CCN(C(=O)c1ccc(N[C@H](C)c2ccccn2)c([N+](=O)[O-])c1)c1cccc(Br)c1 506204125 OJFXQIGUDHAVHU-OAHLLOKOSA-N 469.339 5.592 5 20 JKBD COc1ccc([C@H](NCc2ccc(Oc3ccccc3Cl)c([N+](=O)[O-])c2)c2nccn2C)cc1 509615634 FEUFSRGXNDMQCR-DEOSSOPVSA-N 478.936 5.662 5 20 JKBD O=C(Nc1nc2ccc(OC(F)(F)F)cc2s1)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-] 512149892 SGOQCOBSXRWEAR-UHFFFAOYSA-N 481.330 5.297 5 20 JKBD COc1cc(C(=O)N(C)[C@H](C)c2ccc(Cl)cc2Cl)c([N+](=O)[O-])cc1OCc1cscn1 512408565 IUWVXSBRWKRJSN-GFCCVEGCSA-N 496.372 5.779 5 20 JKBD CCOc1cc(-c2nc3cnccc3s2)ccc1OCc1cc([N+](=O)[O-])cc2c1OCOC2 513864619 WDRVNFVOBBSSQN-UHFFFAOYSA-N 465.487 5.111 5 20 JKBD C[C@H](C1CC1)N(C(=O)c1ccc(Sc2nncn2C)c([N+](=O)[O-])c1)c1cccc(C(F)(F)F)c1 515679992 DHQMGPXGGFSISE-CYBMUJFWSA-N 491.495 5.339 5 20 JKBD CCOC(=O)c1c(NC(=O)c2cc([N+](=O)[O-])ccc2C)sc(C(=O)Nc2ccc(C)cc2C)c1C 519110367 WCYFPKBSVCNAPS-UHFFFAOYSA-N 495.557 5.571 5 20 JKBD CCN(C(=O)Cn1c2ccccc2c(=O)c2ccccc21)[C@@H](c1cccnc1)c1ccc(F)c(F)c1 591039932 QGTPGUCUDWNUGM-MUUNZHRXSA-N 483.518 5.466 5 20 JKBD COc1ccc(CSCC(=O)Nc2ccnn2Cc2cccc(Cl)c2Cl)cc1[N+](=O)[O-] 603566577 YFCOWJXCJUWMBZ-UHFFFAOYSA-N 481.361 5.027 5 20 JKBD COc1cc([C@@H](C)NC(=O)C2CCN(c3ccccc3[N+](=O)[O-])CC2)ccc1OCCC(C)C 603921232 QVGWMVLDACXGIB-LJQANCHMSA-N 469.582 5.122 5 20 JKBD O=C(Nc1cccc(-c2cn3cccnc3n2)c1)c1cc([N+](=O)[O-])ccc1Sc1ccccc1 603980862 XPHFZGVKUOGQEY-UHFFFAOYSA-N 467.510 5.708 5 20 JKBD O=C(c1ccc(Sc2nc3ccccc3s2)c([N+](=O)[O-])c1)N1CCC[C@H]1CN1CCCC1 608813091 WSXYLIRBZNOAGK-KRWDZBQOSA-N 468.604 5.056 5 20 JKBD O=C(Nc1ccc(OCc2ccncc2)cc1)c1cc([N+](=O)[O-])ccc1Sc1ccccc1 609178190 JOIGURVSWLCQHQ-UHFFFAOYSA-N 457.511 5.972 5 20 JKBD CN(CCCCCc1cc(-c2cccc(F)c2)no1)C(=O)c1cc([N+](=O)[O-])ccc1Br 751113421 JOQABSGGIOUNCG-UHFFFAOYSA-N 490.329 5.636 5 20 JKBD O=C(Nc1cc([N+](=O)[O-])ccc1F)c1c2c(nc3ccccc13)CCN(Cc1ccccc1)C2 916667120 UNVABDGRSLSAIY-UHFFFAOYSA-N 456.477 5.093 5 20 JKBD C[C@@H](NC(=O)NC[C@H](c1ccc(N(C)C)cc1)c1c[nH]c2ccccc12)c1cccc([N+](=O)[O-])c1 918169640 UBJHDXZKELSFNG-HOYKHHGWSA-N 471.561 5.334 5 20 JKBD CC(C)(C)c1ccc(N2CCC(Nc3ccc([N+](=O)[O-])c(C(=O)N4CCCC4)c3)CC2)cc1 919722914 QRYFJVAGHGZTKC-UHFFFAOYSA-N 450.583 5.209 5 20 JKBD COc1ccc(NC(=O)c2c(NC(=O)c3ccccc3[N+](=O)[O-])sc3c2CCCC3)cc1 929064389 MWIQKRAMPFVMOK-UHFFFAOYSA-N 451.504 5.048 5 20 JKBD Cc1ccc2oc(C(=O)Nc3ccc(C4(NC(=O)CCc5cccc([N+](=O)[O-])c5)CCC4)cc3)cc2n1 1788320930 PGASUYJEVAFSJK-UHFFFAOYSA-N 498.539 5.425 5 20 JKBD CCc1nc(C(=O)Nc2ccc(C3(NC(=O)c4cc(Cl)cc([N+](=O)[O-])c4C)CCC3)cc2)co1 1789852243 WGVYFMXBYFPOLS-UHFFFAOYSA-N 482.924 5.169 5 20 JKBD O=C(NC1(c2ccc(NC(=O)c3cc([N+](=O)[O-])cc4c3OCC4)cc2)CCC1)c1cc2ccccc2o1 1790046567 NKZFPDOBJDLWAB-UHFFFAOYSA-N 497.507 5.337 5 20 JKBD CC(C)=CCCC(=O)Nc1ccc(C2(NC(=O)c3cc([N+](=O)[O-])c(O)cc3C)CCC2)cc1 1790452461 AUHIIHDKSQEQIN-UHFFFAOYSA-N 451.523 5.103 5 20 JKBD Cn1c(S[C@H](C(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)c2ccccc2)nnc1-c1ccco1 10014182 AQTVAIOGVSGDCA-SFHVURJKSA-N 469.910 5.109 5 20 JKBD C[C@@H](Sc1nnc(Cc2ccccc2)n1-c1ccccc1)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 12105882 AFQYQILUOSCSJZ-QGZVFWFLSA-N 484.541 5.670 5 20 JKBD CC(=O)c1ccc(C(=O)O[C@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2ccccc2)s1 25267034 YEESOUMAQNUEQR-IBGZPJMESA-N 458.879 5.049 5 20 JKBD Cc1ccc(NC(=O)[C@H](Sc2nc(-c3ccc(Cl)cc3)n[nH]2)c2ccccc2)c([N+](=O)[O-])c1 28806905 WSFRQTALTTVPJA-HXUWFJFHSA-N 479.949 5.814 5 20 JKBD C[C@H](Sc1ncc(-c2ccccc2)n1C[C@H]1CCCO1)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl 29072047 FQUHECQNZUNQKD-MAUKXSAKSA-N 486.981 5.410 5 20 JKBD Cc1csc(Sc2ccc(C(=O)Nc3nnc(-c4ccsc4)s3)cc2[N+](=O)[O-])n1 108450154 JRYXFLUAQZMYGO-UHFFFAOYSA-N 461.575 5.343 5 20 JKBD Cc1ccc(-c2nnc3n2CCCCC3)cc1NC(=O)c1cc([N+](=O)[O-])ccc1Sc1ccccc1 477740001 JHXTUTTWNYDJHL-UHFFFAOYSA-N 499.596 6.292 5 20 JKBD Cc1ccccc1OCCCC(=O)Nc1ccc(CNC(=O)c2c[nH]c3cc([N+](=O)[O-])ccc23)cc1 482725008 NXLAEIKRZZPRHU-UHFFFAOYSA-N 486.528 5.112 5 20 JKBD CCC[C@@H](NC(=O)C(=O)Nc1cc([N+](=O)[O-])ccc1OC(F)F)c1ccc(Cl)c(Cl)c1 486900836 ZDRPSUOUFVZBDT-CQSZACIVSA-N 476.263 5.099 5 20 JKBD COc1ccc(NC(=O)NCCc2ccc([N+](=O)[O-])cc2)cc1NC(=O)c1ccc(Cl)cc1F 507766461 LDFGZDUPSMIERM-UHFFFAOYSA-N 486.887 5.012 5 20 JKBD COc1ccc(CNCc2ccc(Br)cc2)cc1OCc1ccc([N+](=O)[O-])cc1 507942465 SBVJPQKMSBGYIO-UHFFFAOYSA-N 457.324 5.235 5 20 JKBD COc1cc(C(=O)Nc2ccc(OCc3ccccc3)cc2)c([N+](=O)[O-])cc1OCc1cscn1 509865266 MSMICKZIOZCUFB-UHFFFAOYSA-N 491.525 5.470 5 20 JKBD Cc1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2Sc2ccc(Cl)cc2)c(OCC(=O)N(C)C)c1 511340003 AJNURDIUUJYKAQ-UHFFFAOYSA-N 499.976 5.427 5 20 JKBD O=C(N[C@H](c1ccc(Cl)cc1)c1ccsc1)C1CCN(c2ccccc2[N+](=O)[O-])CC1 512278801 RNSSYJFKUOTWRV-JOCHJYFZSA-N 455.967 5.432 5 20 JKBD O=C(Nc1ccc(Cl)cc1Cl)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 515321825 NMTCHLWGGABJKQ-UHFFFAOYSA-N 462.255 5.776 5 20 JKBD CCc1ccc(CN[C@@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Br)c2ccccc2)s1 515521750 UKAJBNRELIEPLA-HXUWFJFHSA-N 474.380 5.451 5 20 JKBD C[C@H](N[C@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1cccc(NC(=O)Cc2ccccc2F)c1 515523540 OGAWTDDBPUZMKL-JKSUJKDBSA-N 498.942 5.246 5 20 JKBD COc1cc(C(=O)N(Cc2ccc(C)o2)c2ccc(F)cc2)c([N+](=O)[O-])cc1OCc1cscn1 518189992 HYOCIKQWKYQRBF-UHFFFAOYSA-N 497.504 5.526 5 20 JKBD O=C(C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)Nc1ccc(-c2cnc[nH]2)cc1 520615542 CBUVPYDESOXDJT-CPNJWEJPSA-N 481.537 6.164 5 20 JKBD COCCOc1cc([N+](=O)[O-])c(C(=O)Nc2ccc(Sc3ccccc3)c(Cl)c2)cc1OC 522245717 FBIVXHUFELLRIH-UHFFFAOYSA-N 488.949 5.686 5 20 JKBD CCOc1cc(NC(=O)c2cc(-c3ccco3)nc3c2cnn3C(C)C)c([N+](=O)[O-])cc1OCC 589245043 JYQOJEOTFPHSNG-UHFFFAOYSA-N 479.493 5.230 5 20 JKBD Cc1cccc(OC(F)F)c1NC(=O)c1ccc(NCc2ccccc2Cl)c([N+](=O)[O-])c1 608808007 IGFCIYJLVMJZIY-UHFFFAOYSA-N 461.852 6.022 5 20 JKBD O=C(Nc1ccccc1C(=O)N1CCC2(CCCCC2)CC1)c1ccc([N+](=O)[O-])cc1Cl 608821124 NZZDNQFPUXGQOM-UHFFFAOYSA-N 455.942 5.687 5 20 JKBD O=C(CCC(=O)c1ccc2ccc3cccc4ccc1c2c34)Nc1cccnc1N1CCOCC1 727756317 WBYWAUZLAYTTNC-UHFFFAOYSA-N 463.537 5.417 5 20 JKBD O=C(OCc1csc(-c2ccoc2)n1)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 731065929 PMESIHXDDHIWNT-UHFFFAOYSA-N 481.452 5.290 5 20 JKBD CC(C)(C)OC(=O)NCC1CCN(C(=O)c2cc([N+](=O)[O-])ccc2Sc2ccccc2)CC1 748772691 NCKSTAYMYOLUSV-UHFFFAOYSA-N 471.579 5.123 5 20 JKBD Nc1nc(COC(=O)C/C(=C\c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)nc2ccccc12 760455120 RTUMRIDDBCQMKH-GHRIWEEISA-N 497.536 5.404 5 20 JKBD CCc1ccc(N(C(C)=O)c2nc(COC(=O)/C=C\c3ccc([N+](=O)[O-])cc3)cs2)cc1 798128548 ZBCJOHDFALYHOB-JYRVWZFOSA-N 451.504 5.055 5 20 JKBD O=[N+]([O-])c1ccc(/C=C/Sc2nnc(-c3cccnc3)n2-c2ccc(Br)cc2)o1 825276569 IXGBJJCAYQZCAI-PKNBQFBNSA-N 470.308 5.356 5 20 JKBD CCc1cccc(CC)c1NC(=O)[C@H](C)OC(=O)c1cc([N+](=O)[O-])ccc1N1CCC(C)CC1 853804187 KZZQRHFHEPNBIQ-SFHVURJKSA-N 467.566 5.140 5 20 JKBD Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)Oc1ccc(C(=O)Nc2cccc(-c3nccs3)c2)cc1 918644784 KNSMFJQBCGLRFD-UHFFFAOYSA-N 495.538 5.047 5 20 JKBD COc1cc(C2SCCS2)ccc1OC(=O)c1ccc(N[C@@H](C)c2ccccn2)c([N+](=O)[O-])c1 919688372 ZMDHFLASDAOUKG-HNNXBMFYSA-N 497.598 5.869 5 20 JKBD O=C(Nc1cccc(NC(=O)c2cc(Cl)ccc2[N+](=O)[O-])c1)Nc1cccc(C(F)(F)F)c1 919869517 CLKFSFNHQIXUJA-UHFFFAOYSA-N 478.814 6.163 5 20 JKBD O=C(CCc1cccc([N+](=O)[O-])c1)NC1(c2ccc(NC(=O)[C@H]3CCc4ccoc4C3)cc2)CCC1 1786212891 JADPXCGTLSFQEC-NRFANRHFSA-N 487.556 5.060 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)Nc1ccc(C2(NC(=O)c3coc(C(C)C)n3)CCC2)cc1 1790771062 NHWQVEKIRQSPRB-UHFFFAOYSA-N 480.496 5.215 5 20 JKBD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H]1C[C@@H]1c1ccc(F)cc1)c1cc2cc([N+](=O)[O-])ccc2s1 1792918494 RRWLJMACNFYXMD-NJKFVAIMSA-N 493.560 5.004 5 20 JKBD Cc1cccc(C(=O)N2CCCC[C@H]2c2cc(NC(=O)c3cccc(F)c3[N+](=O)[O-])n[nH]2)c1Cl 1821174875 OXWFRWPNXZMURE-SFHVURJKSA-N 485.903 5.039 5 20 JKBD O=C(CCc1cccc([N+](=O)[O-])c1)N1CCC([C@H]2CCCCN2C(=O)Cc2ccccc2Cl)CC1 1826471540 UFJMZLIMFZBRMI-RUZDIDTESA-N 498.023 5.043 5 20 JKBD O=C(c1ccc([N+](=O)[O-])o1)N1CCC([C@@H]2CCCCN2C(=O)c2c(F)cc(Cl)cc2Cl)CC1 1830655562 OXMILORASNKKHF-KRWDZBQOSA-N 498.338 5.181 5 20 JKBD COc1cc(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)[C@H]3CC[C@H](C(C)C)CC3)CC2)ccc1[N+](=O)[O-] 1832697791 QWSULHGTNZECRB-KIFXHHALSA-N 499.652 5.299 5 20 JKBD C[C@@H](Sc1nnc(-c2ccccc2F)n1Cc1ccccc1)C(=O)Nc1ccc([N+](=O)[O-])cc1 9331067 XLMIDQLNHWVVPX-MRXNPFEDSA-N 477.521 5.160 5 20 JKBD C[C@H](OC(=O)CCc1ncc(-c2ccc(Cl)cc2Cl)o1)C(=O)Nc1ccccc1[N+](=O)[O-] 12272327 VFZOVHPPHJCYKS-LBPRGKRZSA-N 478.288 5.060 5 20 JKBD C[C@H](OC(=O)c1csc(-c2ccc(F)cc2)n1)C(=O)Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1 19616681 ONRNFLCHAVPAMQ-LBPRGKRZSA-N 498.517 5.165 5 20 JKBD CCOC(=O)c1c(NC(=O)c2ccc(SC)c([N+](=O)[O-])c2)sc(C(=O)Nc2ccccc2)c1C 22884476 QPXVJRDZUBLFBD-UHFFFAOYSA-N 499.570 5.368 5 20 JKBD COc1cc2c(cc1OC)[C@@H](c1cccs1)N(C(=O)c1cc3cc([N+](=O)[O-])ccc3s1)CC2 24446473 CDVYVDIJPKJOQF-QHCPKHFHSA-N 480.567 5.676 5 20 JKBD O=C(CCCNc1ccc([N+](=O)[O-])cc1)N1CCC(c2nc3cc(Cl)ccc3s2)CC1 26034489 ADYUQPUKAUONNE-UHFFFAOYSA-N 458.971 5.456 5 20 JKBD C[C@H](Nc1ccc(C(=O)N(Cc2ccco2)Cc2cccs2)cc1[N+](=O)[O-])c1ccccn1 72016638 YWZAHHYNVGQDEK-KRWDZBQOSA-N 462.531 5.660 5 20 JKBD Cc1nnc([C@@H](C)OC(=O)c2c3c(nc4ccccc24)/C(=C\c2cccc([N+](=O)[O-])c2)CCC3)o1 109022519 JSPAEXKZMUUDLQ-QLENYVDCSA-N 470.485 5.629 5 20 JKBD CC(C)CC(=O)Nc1cccc(CNC(=O)c2ccc(N[C@@H](C)c3ccccn3)c([N+](=O)[O-])c2)c1 109148383 RQEJSSFXFQUDBX-SFHVURJKSA-N 475.549 5.078 5 20 JKBD O=C(c1csc(-c2cccc([N+](=O)[O-])c2)n1)N1CCc2sccc2[C@@H]1c1cccs1 215709480 FXWDYQXLVJVHRL-LJQANCHMSA-N 453.570 5.629 5 20 JKBD Cc1cc(NC(=O)C2CCN(c3ccc(C(F)(F)F)cc3[N+](=O)[O-])CC2)n(-c2ccc(F)cc2)n1 217358246 WJBXNSDQJBDZRD-UHFFFAOYSA-N 491.445 5.102 5 20 JKBD COc1ccc([C@@H](NCc2nc(-c3cccc([N+](=O)[O-])c3)no2)c2ccccc2)cc1Br 488043007 NVXXMXOPZTVKDQ-QFIPXVFZSA-N 495.333 5.295 5 20 JKBD COc1cc(C(=O)N(Cc2ccco2)CC(F)(F)F)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 489289831 KHQYFYDXEFJRIB-UHFFFAOYSA-N 484.814 5.847 5 20 JKBD O=C(Nc1ccccc1CN1CCSCC1)c1ccc(NCc2ccccc2Cl)c([N+](=O)[O-])c1 489454964 DNGPJZKEBYWMRI-UHFFFAOYSA-N 497.020 5.661 5 20 JKBD CC(C)CCSc1ccc(C(=O)Nc2ccc(Sc3nncn3C)cc2)cc1[N+](=O)[O-] 494945750 AWZVHTBEYCNRKD-UHFFFAOYSA-N 457.581 5.265 5 20 JKBD CC[C@H](C)n1c(S[C@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2C(F)(F)F)nnc1-c1ccccc1 504322769 XQDCZBMQCHYRGJ-UONOGXRCSA-N 493.511 5.962 5 20 JKBD C[C@H]1Cc2cc([N+](=O)[O-])ccc2N1C(=O)c1cc(OCC(F)(F)F)cc(OCC(F)(F)F)c1 504366110 RTIOOFDZUDGXFH-NSHDSACASA-N 478.345 5.068 5 20 JKBD CCCN1CCC(NC(=O)C/C(=C\c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)CC1 512923850 ZVOQAYJMASZQHC-KNTRCKAVSA-N 464.591 5.126 5 20 JKBD COc1ccc(-c2[nH]c3ccccc3c2CCC(=O)Nc2cc([N+](=O)[O-])ccc2OC)c(OC)c1 512971435 GDNXBKUWRBRTJZ-UHFFFAOYSA-N 475.501 5.340 5 20 JKBD COc1ccc([C@H](Cc2ccccc2C)NC(=O)c2ccc([N+](=O)[O-])cc2Cl)cc1OC 520030958 HRYKWUBTIUHDRB-NRFANRHFSA-N 454.910 5.288 5 20 JKBD C[C@H]1CCCN(c2ccc(C(=O)Nc3ccc(C(=O)Nc4ccccc4)cc3)cc2[N+](=O)[O-])C1 520916458 KHCRWPWTXBIHMD-SFHVURJKSA-N 458.518 5.336 5 20 JKBD CCN(CC)CC1CCN(C(=O)c2ccc(Sc3nc4ccccc4s3)c([N+](=O)[O-])c2)CC1 521185233 FZBBPWVMYBTYDA-UHFFFAOYSA-N 484.647 5.550 5 20 JKBD O=C(C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)NC[C@H]1COc2ccccc2O1 603461308 SNEWFTWAEPTVOU-ZPBCLNFZSA-N 487.537 5.091 5 20 JKBD CC(C)(C)c1ccc(C(=O)Nc2ccc(C(=O)Nc3cccnc3)c(Cl)c2)cc1[N+](=O)[O-] 608875426 XOLZNFKAWITBRQ-UHFFFAOYSA-N 452.898 5.445 5 20 JKBD Cc1ccc(NC(=O)c2ccc(Sc3nnc(-c4cccnc4)n3C3CC3)c([N+](=O)[O-])c2)cc1 608972506 QYYUGVMCXBGRJC-UHFFFAOYSA-N 472.530 5.295 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)NCCCN2c3ccccc3Sc3ccccc32)cc1SC 728516171 LVRMGKYUTDSKDU-UHFFFAOYSA-N 481.599 5.748 5 20 JKBD Cc1cc(SC(C)(C)C)ccc1NC(=O)c1ccc(N[C@H](C)c2ccccn2)c([N+](=O)[O-])c1 751252106 MGYLNIJTXRDNIW-QGZVFWFLSA-N 464.591 6.614 5 20 JKBD O=C(O[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1)c1ccc(C(F)(F)F)cn1 844261196 NOWCVVZCGGYDKH-GOSISDBHSA-N 479.798 5.199 5 20 JKBD COC(=O)CCSc1cc(Cl)ccc1NCc1cccc([N+](=O)[O-])c1Br 864032718 JEUGIRLKKRAPLJ-UHFFFAOYSA-N 459.749 5.278 5 20 JKBD O=C(c1ccc(NS(=O)(=O)c2ccc(Cl)c([N+](=O)[O-])c2)cc1)N1CCC(c2ccccc2)CC1 881430644 KSPQPOGJYNXCQR-UHFFFAOYSA-N 499.976 5.069 5 20 JKBD O=C(COc1ccccc1C(=O)Nc1cc([N+](=O)[O-])c(F)cc1F)Nc1cccc(C(F)(F)F)c1 897462723 TVTLSDNUWWAHLQ-UHFFFAOYSA-N 495.360 5.162 5 20 JKBD Cc1ccc(NC(=O)[C@@H](OC(=O)c2nc(-c3cccs3)oc2C)c2ccccc2)c([N+](=O)[O-])c1 915565647 WZHNCXXEAYHHPB-NRFANRHFSA-N 477.498 5.465 5 20 JKBD Cc1ccc(S(=O)(=O)Nc2ccc(NC(=S)Nc3ccc(C(C)C)cc3)cc2)cc1[N+](=O)[O-] 916119997 KBOQBSCSNUAKGP-UHFFFAOYSA-N 484.603 5.636 5 20 JKBD Cc1nc(-c2ncccn2)sc1C(=O)Nc1cc(Cl)c([N+](=O)[O-])cc1OCc1ccccc1 917610926 ZLMZMKFGHJJRQX-UHFFFAOYSA-N 481.921 5.301 5 20 JKBD CC/C=C(\C)C(=O)NC1(c2ccc(NC(=O)Cn3ccc4ccc([N+](=O)[O-])cc43)cc2)CCC1 1786276885 NWLXBKGNOSPPFO-BLLMUTORSA-N 460.534 5.040 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)c3cc4cc([N+](=O)[O-])ccc4s3)CCC2)cc1)C(=O)c1ccco1 1786755271 QUAGBLIEQMUPCT-UHFFFAOYSA-N 489.509 5.033 5 20 JKBD COc1cc(C(=O)NC2(c3ccc(NC(=O)c4ccc(C)s4)cc3)CCC2)cc([N+](=O)[O-])c1OC 1787283066 KTMSBVZPKSLMAP-UHFFFAOYSA-N 495.557 5.043 5 20 JKBD Cc1ncsc1C(=O)Nc1ccc(C2(NC(=O)Cc3ccc(Cl)cc3[N+](=O)[O-])CCC2)cc1 1787420625 RYXOUILNNRTWND-UHFFFAOYSA-N 484.965 5.004 5 20 JKBD CCc1nc(C(=O)Nc2ccc(C3(NC(=O)C4(c5cccc([N+](=O)[O-])c5)CCC4)CCC3)cc2)co1 1789852202 RFJNJGQYMCSBET-UHFFFAOYSA-N 488.544 5.015 5 20 JKBD Cc1occc1C(=O)NC1(c2ccc(NC(=O)c3cc(Br)ccc3[N+](=O)[O-])cc2)CCC1 1790663671 KMVHROYNWXZCPJ-UHFFFAOYSA-N 498.333 5.320 5 20 JKBD Cc1cc(Cl)c(Cl)cc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CCc1cccc([N+](=O)[O-])c1)C2 1800788329 WQLOYCMCLMJCFY-BCDXTJNWSA-N 490.387 5.095 5 20 JKBD Cc1oc(C(C)(C)C)cc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc2cc([N+](=O)[O-])ccc2s1 1801207605 WZVLXLJYEQUMOO-BCDXTJNWSA-N 495.601 5.574 5 20 JKBD CC(C)=CCCC(=O)N1CC[C@@H](CNC(=O)c2cc(Cl)cc([N+](=O)[O-])c2C)[C@H]1c1cccnc1 1811794583 PFBJVJOPHKQMHA-YADARESESA-N 484.984 5.018 5 20 JKBD CC[C@H](C)[C@H](C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2ccc([N+](=O)[O-])o2)n[nH]1)c1ccccc1 1814310235 SYQGYXHVEFMRIR-NVVBAYIOSA-N 479.537 5.047 5 20 JKBD Cc1cscc1C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cc(Cl)cc([N+](=O)[O-])c2C)n[nH]1 1821294975 ZPQAUEPSIQSAOW-SFHVURJKSA-N 487.969 5.269 5 20 JKBD Cc1ccc(CC(=O)N2CCC([C@H]3CCCCN3C(=O)c3cc4ccoc4s3)CC2)cc1[N+](=O)[O-] 1827409904 JBJGGIOFXKOKGH-OAQYLSRUSA-N 495.601 5.187 5 20 JKBD CC(C)(C)c1ccc(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3ccc([N+](=O)[O-])o3)CC2)s1 1827907440 QTTCTKUBHJMLJT-QGZVFWFLSA-N 473.595 5.094 5 20 JKBD O=C(c1cccc2ccoc12)N1CCC([C@H]2CCCCN2C(=O)c2ccc([N+](=O)[O-])cc2F)CC1 1830498685 DAUHKZXAUDFWEA-HSZRJFAPSA-N 479.508 5.027 5 20 JKBD CCCc1ccc(C(=O)N2CCC([C@@H]3CCCCN3C(=O)c3ccc([N+](=O)[O-])c(OC)c3)CC2)cc1 1832695935 QCDISJACVUIZII-DEOSSOPVSA-N 493.604 5.103 5 20 JKBD Cc1cc(C)c(NC(=O)COC(=O)c2ccccc2C(=O)c2ccc(Cl)c([N+](=O)[O-])c2)c(C)c1 11029375 YVGMCALBBRDZMM-UHFFFAOYSA-N 480.904 5.200 5 20 JKBD Cc1ccc([C@H](NC(=O)CSc2nc3cc4ccccc4cc3c(=O)n2C)c2cccs2)cc1 17982005 QGDPRZTVZSSAII-VWLOTQADSA-N 485.634 5.455 5 20 JKBD O=C(Nc1cccnc1)c1ccc(NC(=O)c2ccc(NCc3ccccc3)c([N+](=O)[O-])c2)cc1 24897353 QINDBSFMYCLGEP-UHFFFAOYSA-N 467.485 5.107 5 20 JKBD O=C(OCCCc1nc(-c2cccs2)no1)c1ccccc1C(=O)c1ccc(Cl)c([N+](=O)[O-])c1 26903450 TZINYTPJEPKCGL-UHFFFAOYSA-N 497.916 5.380 5 20 JKBD CC(C)OCc1ccccc1CNC(=O)Cc1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1 30369204 PCSKTHZMOYINGV-UHFFFAOYSA-N 484.556 5.231 5 20 JKBD Cc1csc(Sc2ccc(C(=O)N[C@H](C)c3ccc(NC(=O)C4CC4)cc3)cc2[N+](=O)[O-])n1 31393983 RGQNZFHMPVTSMU-CQSZACIVSA-N 482.587 5.350 5 20 JKBD Cc1ccc(C(=O)N2CCc3ccc([N+](=O)[O-])cc32)cc1NC(=O)c1ccc(Br)cc1 32147882 YYQJUDDIXPPQIT-UHFFFAOYSA-N 480.318 5.121 5 20 JKBD CCn1c(S[C@H](C)C(=O)Nc2ccccc2[N+](=O)[O-])nnc1-c1ccc(C(C)(C)C)cc1 60383429 ULYAKHYSNRUYHT-OAHLLOKOSA-N 453.568 5.290 5 20 JKBD Cc1c(Cl)cc(S(=O)(=O)Oc2ccc3c(=O)c(-c4ccccc4)coc3c2)cc1[N+](=O)[O-] 105535223 JJBLIJBCSKHBMT-UHFFFAOYSA-N 471.874 5.098 5 20 JKBD CC1CCN([C@H](CNC(=O)c2ccc(N[C@@H](C)c3ccccn3)c([N+](=O)[O-])c2)c2cccs2)CC1 108751799 YWQJZKCEUVSKAU-YADARESESA-N 493.633 5.427 5 20 JKBD COc1cc(C(=O)Nc2ccc3c(c2)CCCN3C(C)=O)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 109860812 MVQCNCGBVHABBY-UHFFFAOYSA-N 495.919 5.601 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)Nc2c3ccccc3n3c(C)nc4ccccc4c23)cc1SC 112530016 FICPIJPMATUVRO-UHFFFAOYSA-N 472.526 5.840 5 20 JKBD CS(=O)(=O)c1cc(C(=O)N(Cc2ccc(Cl)cc2)c2ccccc2Cl)cc([N+](=O)[O-])c1 195663999 CJJTYOXPTQFWAP-UHFFFAOYSA-N 479.341 5.152 5 20 JKBD COc1cccc(/C=C(/CC(=O)Nc2ccc(OC)cc2[N+](=O)[O-])c2nc3ccccc3s2)c1 480949689 XJNVLFNSYBOYIJ-ATVHPVEESA-N 475.526 5.791 5 20 JKBD O=C(N[C@@H]1CCN2CCC[C@@H]2C1)c1c2c(nc3ccccc13)/C(=C/c1cccc([N+](=O)[O-])c1)CCC2 485013265 KPEFVESGHQRJSK-QRTWOMCZSA-N 482.584 5.377 5 20 JKBD Cc1ccc(O[C@@H](C)C(=O)N(Cc2ccccc2[N+](=O)[O-])CC(F)(F)F)c(Br)c1 486073177 LZUYNALHMUXEJC-ZDUSSCGKSA-N 475.261 5.024 5 20 JKBD CSc1ccc(C(=O)c2ccccc2C(=O)N2CCC[C@H](CN3CCCCCC3)C2)cc1[N+](=O)[O-] 487870524 HPXFZDVDNPMDET-HXUWFJFHSA-N 495.645 5.276 5 20 JKBD C[C@H](NC(=O)CSc1ccc(C(F)(F)F)cc1[N+](=O)[O-])c1ccc(OC(F)F)cc1 490609266 BEZDWVWSKHTFJW-JTQLQIEISA-N 450.385 5.185 5 20 JKBD O=C(Nc1nnc(Cc2cccc(F)c2)s1)c1ccc(NCc2ccccc2)c([N+](=O)[O-])c1 500928920 QRRFAPNEICEVBG-UHFFFAOYSA-N 463.494 5.041 5 20 JKBD Cn1cc(C(=O)Nc2ccc(Cc3nc4ccccc4s3)cc2)c(-c2ccc([N+](=O)[O-])cc2)n1 505996796 QLYNUGLPXMOTGV-UHFFFAOYSA-N 469.526 5.448 5 20 JKBD COc1cc(CN[C@H](C)c2cnn(-c3ccc(F)cc3)c2C)ccc1OCc1ccc([N+](=O)[O-])cc1 507954205 JIMLMDSNPPDKFM-GOSISDBHSA-N 490.535 5.666 5 20 JKBD CCCN(C(=O)c1ccc(Sc2nncn2C)c([N+](=O)[O-])c1)[C@H](C)c1cc2ccccc2o1 509548060 DTSFWDAOFOVTEF-OAHLLOKOSA-N 465.535 5.234 5 20 JKBD CNC(=O)c1cc(NC(=O)c2ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])c(OC)c2)ccc1Cl 510962289 PSQBEMWINYDJJP-UHFFFAOYSA-N 490.299 5.314 5 20 JKBD Cc1nn(Cc2ccc(C(=O)N(C3CC3)[C@@H](C)c3ccccc3Cl)cc2)c(C)c1[N+](=O)[O-] 512081361 BCAKEZHEBQKPQG-INIZCTEOSA-N 452.942 5.476 5 20 JKBD COc1ccc(NC(=O)c2ccc(NC(=O)c3cc(Cl)cc(Cl)c3)cc2)c([N+](=O)[O-])c1 514887630 GIEZQRZHVBFEFQ-UHFFFAOYSA-N 460.273 5.415 5 20 JKBD COc1ccccc1CN(C(=O)Cc1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1)C1CC1 515442995 AHJSPFPLDYQIHQ-UHFFFAOYSA-N 482.540 5.190 5 20 JKBD Cc1nn(C)c2nc(-c3cccs3)cc(C(=O)Nc3nc(-c4cccc([N+](=O)[O-])c4)cs3)c12 516084062 KHASMSRXWGXRDJ-UHFFFAOYSA-N 476.543 5.289 5 20 JKBD CN(Cc1nc2ccccc2[nH]1)C(=O)C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1 518795207 FRNVBMRZUCSCBC-NBVRZTHBSA-N 483.553 5.670 5 20 JKBD CCCN1CCC(N(C)C(=O)c2ccc(Sc3nc4ccccc4s3)c([N+](=O)[O-])c2)CC1 518812961 IAAFSRFVLPCFHS-UHFFFAOYSA-N 470.620 5.302 5 20 JKBD CC(=O)NC[C@H]1CCCN(C(=O)c2c3c(nc4ccccc24)/C(=C/c2cccc([N+](=O)[O-])c2)CCC3)C1 521418287 KXRSOIFCWZSAJF-ODAUKNCYSA-N 498.583 5.008 5 20 JKBD COc1ccc(NS(=O)(=O)c2ccc(Cl)cc2[N+](=O)[O-])cc1OCc1ccc2ccccc2n1 524380787 YLGZISUJWQPKJP-UHFFFAOYSA-N 499.932 5.185 5 20 JKBD CC[C@H](C)c1ccc([C@@H](NC(=O)C(=O)Nc2cc([N+](=O)[O-])ccc2C)c2cccs2)cc1 603706153 IKZZOWJRVZMMKB-OYHNWAKOSA-N 451.548 5.323 5 20 JKBD Cn1cnnc1Sc1ccc(C(=O)Nc2c(F)cc(F)cc2-c2ccccc2)cc1[N+](=O)[O-] 603940084 UUUJEPLYQANQLD-UHFFFAOYSA-N 467.457 5.072 5 20 JKBD Cc1cc(C(=O)N2CCC[C@@H]2C(=O)Nc2nc(-c3cc4ccccc4o3)cs2)ccc1[N+](=O)[O-] 608802932 MFOAQCAMASUPJO-LJQANCHMSA-N 476.514 5.016 5 20 JKBD Cc1ncc([N+](=O)[O-])cc1C(=O)Nc1ccc(Oc2ccnc3cc(Cl)ccc23)c(F)c1 609066137 JYGBIDUUVOPBKN-UHFFFAOYSA-N 452.829 5.684 5 20 JKBD O=C(c1c2c(nc3ccccc13)/C(=C\c1ccc([N+](=O)[O-])cc1)CCC2)N1CCC[C@H](C2OCCO2)C1 729361635 YJQOLIONYMALSF-ZOECDYFQSA-N 499.567 5.245 5 20 JKBD COc1ccc(CNC(=O)c2sc3cc(Br)ccc3c2Cl)cc1[N+](=O)[O-] 729825215 KAUQUERSLHEOIT-UHFFFAOYSA-N 455.717 5.164 5 20 JKBD O=C(OCc1nnc(-c2ccc([N+](=O)[O-])cc2)o1)c1nc(Cl)c(Cl)c(Cl)c1Cl 782017982 GNEIMRBVGAFCCB-UHFFFAOYSA-N 464.048 5.010 5 20 JKBD COc1cc(CNc2ccc([C@H](O)C(F)(F)F)cc2)c([N+](=O)[O-])cc1OCc1ccccc1 864043179 GYJXNXFHWFXZGY-QFIPXVFZSA-N 462.424 5.390 5 20 JKBD CCc1cccc(C)c1NC(=O)c1ccc(NS(=O)(=O)c2ccc(Cl)c([N+](=O)[O-])c2)cc1 864049767 ZZNOLUDBWVKNIT-UHFFFAOYSA-N 473.938 5.172 5 20 JKBD COc1ccc(Oc2ccc([N+](=O)[O-])cc2C(=O)O[C@@H](C)C(=O)Nc2cc(F)ccc2C)cc1 915250447 UNDCKQNKRWLNHK-HNNXBMFYSA-N 468.437 5.027 5 20 JKBD CC(=O)N(c1nc(COC(=O)c2cc([N+](=O)[O-])ccc2F)cs1)c1c(C)cc(C)cc1C 919251451 QOIVFDSGRLVPAP-UHFFFAOYSA-N 457.483 5.157 5 20 JKBD O=[N+]([O-])c1cccc(/C(O)=C(/C(=S)Nc2ccc3c(c2)CCC3)[n+]2ccc3c(c2)CCCC3)c1 920396174 VVBXQPLNGJYMOA-UHFFFAOYSA-O 472.590 5.573 5 20 JKBD C[C@@H](OC(=O)CCSc1ccc(Br)cc1)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 920581443 GATYLTTUZCULRR-GFCCVEGCSA-N 478.324 5.194 5 20 JKBD Cc1cc2cccc(C(=O)NC3(c4ccc(NC(=O)Cc5cccc([N+](=O)[O-])c5)cc4)CCC3)c2[nH]1 1785792432 YMDSWZOVXHSEGT-UHFFFAOYSA-N 482.540 5.375 5 20 JKBD O=C(NC1(c2ccc(NC(=O)[C@@H]3C[C@H]3C3CC3)cc2)CCC1)c1ccc(Br)c([N+](=O)[O-])c1 1786057677 XDFOGSXORJICEP-RBUKOAKNSA-N 498.377 5.151 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)c3ccc([N+](=O)[O-])cc3F)CCC2)cc1)c1cc(-c2ccco2)no1 1788420519 SPWGZMDJHRQDQK-UHFFFAOYSA-N 490.447 5.043 5 20 JKBD O=C(C1CC2(CCC2)C1)N1CCCC[C@@H]1c1cc(NC(=O)C2(c3cccc([N+](=O)[O-])c3)CCC2)n[nH]1 1820842621 GLKKYDYVUDSTPO-JOCHJYFZSA-N 491.592 5.012 5 20 JKBD O=C(CCc1ccccc1)N1CCC([C@H]2CCCCN2C(=O)Cc2ccc(Cl)cc2[N+](=O)[O-])CC1 1824162381 XEGZXCCLONFDCS-XMMPIXPASA-N 498.023 5.043 5 20 JKBD O=C(c1cc2cc([N+](=O)[O-])ccc2s1)N1CCC([C@H]2CCCCN2C(=O)Cc2ccsc2)CC1 1827166470 HECXDRJTTXQMMJ-OAQYLSRUSA-N 497.642 5.347 5 20 JKBD O=C(c1sccc1F)N1CCC([C@@H]2CCCCN2C(=O)C2(c3cccc([N+](=O)[O-])c3)CCC2)CC1 1830291532 PAXIKBDQANMUIG-QFIPXVFZSA-N 499.608 5.151 5 20 JKBD O=C(Nc1ccc(Cl)c([N+](=O)[O-])c1)[C@@H](Sc1nnc(-c2ccc(F)cc2)o1)c1ccccc1 12677885 JVWRFDFEHFWYDI-IBGZPJMESA-N 484.896 5.909 5 20 JKBD O=C(Nc1cccc(C(F)(F)F)c1)c1cccc(NC(=O)c2cc([N+](=O)[O-])ccc2Cl)c1 14907672 RIQNCBWVQWDTMB-UHFFFAOYSA-N 463.799 5.772 5 20 JKBD CCOC(=O)c1sc(-c2ccc3c(c2)OCCO3)cc1NC(=S)Nc1ccc([N+](=O)[O-])cc1 16704225 REECQUNTQHNVEV-UHFFFAOYSA-N 485.543 5.080 5 20 JKBD Cc1nn(Cc2ccc(C(=O)Nc3cccc(C4SCCS4)c3)cc2)c(C)c1[N+](=O)[O-] 18216652 PJLJFXWHKUYLBS-UHFFFAOYSA-N 454.577 5.187 5 20 JKBD Cc1ccccc1-n1c(-c2cccnc2)nn(CN(C)Cc2cc([N+](=O)[O-])ccc2Cl)c1=S 27532855 NAZLMMSQIRFORG-UHFFFAOYSA-N 480.981 5.425 5 20 JKBD CCN(C(=O)Cc1ccc(NC(=O)[C@H](C)Sc2ccc([N+](=O)[O-])cc2)cc1)c1ccccc1 108042442 LTADSSSUCOYPMH-SFHVURJKSA-N 463.559 5.310 5 20 JKBD CCOC(=O)c1oc2ccccc2c1CNC(=O)c1ccc(N[C@H](C)c2ccccn2)c([N+](=O)[O-])c1 116768707 ZXBGRWCLLCVHPR-MRXNPFEDSA-N 488.500 5.016 5 20 JKBD Cc1nnc(COC(=O)c2c3c(nc4ccccc24)/C(=C\c2ccc([N+](=O)[O-])cc2)CCC3)o1 206744066 JUKHDNBTKBODJF-LGMDPLHJSA-N 456.458 5.068 5 20 JKBD CCCNC(=O)c1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2Oc2ccccc2)cc1Cl 302993234 LQDQBLHOBVUQOW-UHFFFAOYSA-N 453.882 5.433 5 20 JKBD Cc1cccc(NC(=O)Nc2cccc(CNC(=O)Nc3ccc([N+](=O)[O-])cc3Cl)c2)c1 409756716 XVZPTGRGDLJQCD-UHFFFAOYSA-N 453.886 5.522 5 20 JKBD Cc1ncc(NC(=O)c2c3c(nc4ccccc24)/C(=C/c2cccc([N+](=O)[O-])c2)CCC3)cn1 484424717 LNPHCMDAQCQPPM-LDADJPATSA-N 451.486 5.371 5 20 JKBD CCCN(Cc1nc(O)c2ccc(Cl)cc2n1)C(=O)c1csc(-c2cccc([N+](=O)[O-])c2)n1 496476730 XJTCQMUNCDKQHU-UHFFFAOYSA-N 483.937 5.073 5 20 JKBD COc1cc(C(=O)Nc2nc3ccccc3n2C2CCCCC2)c([N+](=O)[O-])cc1OC(F)F 501836322 JJGBMWWGVYEAPE-UHFFFAOYSA-N 460.437 5.312 5 20 JKBD CSc1ccc(C(=O)c2ccccc2C(=O)Nc2nc(-c3ccc[nH]3)cs2)cc1[N+](=O)[O-] 507081034 GWXCQIDQKPCMOX-UHFFFAOYSA-N 464.528 5.252 5 20 JKBD O=C(Cc1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1)Nc1ccc(F)cc1Cl 507251274 GRIMITUFJQJDNY-UHFFFAOYSA-N 450.857 5.421 5 20 JKBD O=C(NCCc1ccc([N+](=O)[O-])cc1)Nc1cccc(NC(=O)c2cccc(C(F)(F)F)c2)c1 509900444 OCMYGXJNYGYDIL-UHFFFAOYSA-N 472.423 5.230 5 20 JKBD O=C(Nc1cc([N+](=O)[O-])ccc1OC(F)F)N1CCC[C@H]1c1cccc(Br)c1 511541790 UKQSABOCDGNBSZ-HNNXBMFYSA-N 456.243 5.328 5 20 JKBD CC[C@@H](C)c1ccc([C@@H](NC(=O)c2cc(OC)c(OC)cc2[N+](=O)[O-])c2cccs2)cc1 512408166 BPTTWKOIYUGLCE-IQMFZBJNSA-N 454.548 5.706 5 20 JKBD Cc1csc(Sc2ccc(C(=O)NCc3ccc(NC(=O)C(C)C)cc3)cc2[N+](=O)[O-])n1 514999198 ODZYCAPIAGBIPB-UHFFFAOYSA-N 470.576 5.035 5 20 JKBD CCOc1cc([N+](=O)[O-])c(C(=O)N[C@H](Cc2ccc(Cl)cc2)c2ccccc2)cc1OC 515868504 GBZMCJOMOLLCSE-HXUWFJFHSA-N 454.910 5.369 5 20 JKBD COc1ccc(CN[C@H]2CCSc3c(F)cccc32)cc1OCc1ccc([N+](=O)[O-])cc1 517538160 NXWMCAAYTJVVAJ-NRFANRHFSA-N 454.523 5.648 5 20 JKBD CC(C)Oc1ccc(NC(=O)c2ccc(N[C@@H](C)c3ccccn3)c([N+](=O)[O-])c2)c(C(F)(F)F)c1 517921919 VFMJIYJFUYCUTA-HNNXBMFYSA-N 488.466 6.221 5 20 JKBD CC(C)C(=O)Nc1ccc(CNCc2ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])cc2)cc1 518766199 JJYVJCPQEXJZMM-UHFFFAOYSA-N 453.926 5.925 5 20 JKBD COc1cc(CNCc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)cc(Br)c1OC 518776911 SQMZSPIHSOIKJW-UHFFFAOYSA-N 463.353 5.393 5 20 JKBD Cc1nn(CCC(=O)N2C[C@@H](c3ccccc3Cl)c3c([nH]c4ccccc34)[C@@H]2C)c(C)c1[N+](=O)[O-] 523226872 JXSCCXVGGSIIOW-JXFKEZNVSA-N 491.979 5.668 5 20 JKBD Cc1nn(C)cc1[C@@H](C)NC(=O)C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1 524341114 LNTPCIKRPISXSH-GYZOOYGHSA-N 461.547 5.055 5 20 JKBD Cc1cccc(-c2nnc(-c3ccc(C(=O)Nc4nc(-c5cccc([N+](=O)[O-])c5)cs4)cc3)o2)c1 602996279 PWCRBYUDRDAFJH-UHFFFAOYSA-N 483.509 5.996 5 20 JKBD COc1cc(C(=O)Nc2cc(-c3ccccc3OC)nn2-c2ccc(C)cc2)c([N+](=O)[O-])cc1OC 603760123 FOFUXZVTCFZFGE-UHFFFAOYSA-N 488.500 5.034 5 20 JKBD COc1ccc(Cl)cc1CN[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1 604044736 AEIDSIAEFJGGFQ-NRFANRHFSA-N 460.317 5.380 5 20 JKBD CCN(C[C@H]1CCOC1)C(=O)c1ccccc1Sc1ccc(C(F)(F)F)cc1[N+](=O)[O-] 604440345 PBEVCSOIQZOZOG-CQSZACIVSA-N 454.470 5.263 5 20 JKBD COc1ccc(C[C@H](N[C@@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2ccccc2)cc1OC 608980568 DOCYHNSLSFHUCN-AOMKIAJQSA-N 483.952 5.166 5 20 JKBD COc1ccc(C[C@@H](N[C@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2ccccc2)cc1OC 608980574 DOCYHNSLSFHUCN-OPAMFIHVSA-N 483.952 5.166 5 20 JKBD O=C(Cn1c2ccccc2c(=O)c2ccccc21)Nc1ccc(NC(=O)c2ccco2)c(Cl)c1 615975730 XRTTWLDZXREYAK-UHFFFAOYSA-N 471.900 5.292 5 20 JKBD CCc1ccc(Cl)c(CC)c1NC(=O)CCCOC(=O)c1cc(F)c(F)cc1[N+](=O)[O-] 725936393 ASVNDVGXDVXISN-UHFFFAOYSA-N 454.857 5.227 5 20 JKBD CC(C)c1cccc(O[C@H](C(=O)OCc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)c2ccccc2)c1 730643640 OFPGROWSRPWFAX-DEOSSOPVSA-N 473.485 5.632 5 20 JKBD C[C@H](Sc1nnc(COc2ccc(Cl)cc2Cl)o1)C(=O)Nc1ccc(F)c([N+](=O)[O-])c1 745941952 NGWTYWNCOGJATH-VIFPVBQESA-N 487.296 5.122 5 20 JKBD C[C@@H](OC(=O)c1ccnc(Oc2ccccc2)c1)C(=O)Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1 749294103 VXHGICRUVJSHOE-OAHLLOKOSA-N 490.497 5.090 5 20 JKBD C[C@H](OC(=O)c1c[nH]c2ccc([N+](=O)[O-])cc12)C(=O)N1c2ccccc2Sc2ccccc21 749315594 BKZYKCNFGDPDTC-AWEZNQCLSA-N 459.483 5.451 5 20 JKBD CC(C)c1ccc(-c2ncc(COC(=O)c3ccc(Sc4nncn4C)c([N+](=O)[O-])c3)s2)cc1 789860419 BNZCNSFDXIYYPL-UHFFFAOYSA-N 495.586 5.478 5 20 JKBD C[C@H](OC(=O)c1cc(-c2ccncc2)nc2ccccc12)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 813320300 RFUAMPUDXQXCHX-HNNXBMFYSA-N 467.441 5.173 5 20 JKBD O=C(COC(=O)c1cc2c(Cl)cccc2s1)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 825219016 OMLCYNRVRLAATC-UHFFFAOYSA-N 458.801 5.277 5 20 JKBD Cc1cc(N2CC3(CCOCC3)[C@@H]2c2cnn(CC(C)C)c2)c([N+](=O)[O-])cc1C(F)(F)F 849479550 XDLYQFIDTTYXLJ-FQEVSTJZSA-N 452.477 5.133 5 20 JKBD O=C(C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)Nc1ccnn1C1CCCC1 881384387 BJZPJUJMJRUWJD-SDXDJHTJSA-N 473.558 6.086 5 20 JKBD O=C(Nc1ccc(Cl)c([N+](=O)[O-])c1)c1cc(S(=O)(=O)Nc2ccccc2F)ccc1Cl 916827856 CBGUCKMZSDIXDU-UHFFFAOYSA-N 484.292 5.094 5 20 JKBD Cc1cccc(F)c1C(=O)NC1(c2ccc(NC(=O)/C=C/c3ccc([N+](=O)[O-])o3)cc2)CCC1 1786208324 ZWOFJZSMALAMRG-ZRDIBKRKSA-N 463.465 5.096 5 20 JKBD Cc1noc(-c2ccccc2)c1C(=O)Nc1ccc(C2(NC(=O)c3ccc([N+](=O)[O-])o3)CCC2)cc1 1788669976 JOHURQADFYEQLL-UHFFFAOYSA-N 486.484 5.213 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)C3(c4cccc(Cl)c4)CC3)CCC2)cc1)c1ccc([N+](=O)[O-])[nH]1 1790186432 SLBYTJLTZDNDIX-UHFFFAOYSA-N 478.936 5.056 5 20 JKBD Cc1oc(C(C)(C)C)cc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cc(Cl)cc([N+](=O)[O-])c1C)C2 1795128287 NHDOELBHEPCEGM-BCDXTJNWSA-N 487.984 5.321 5 20 JKBD Cc1ccc(CC(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2ccccc2Oc2ccccc2)C3)cc1[N+](=O)[O-] 1800138014 MDFAWACYPXEOSN-NUNAXRQHSA-N 499.567 5.190 5 20 JKBD O=C(c1cc2ccc(Cl)cc2[nH]1)N1CCCC2(CCN(C(=O)c3ccc([N+](=O)[O-])cc3F)CC2)C1 1804749632 BTPHEJVYOOPGCJ-UHFFFAOYSA-N 498.942 5.027 5 20 JKBD CC1(C)CCC(CC(=O)NC[C@H]2CCN(C(=O)c3cc(F)cc([N+](=O)[O-])c3)[C@H]2c2cccnc2)CC1 1808902377 KPUXBKMXBCCWLV-NLFFAJNJSA-N 496.583 5.055 5 20 JKBD O=C(c1cccc2ncccc12)N1CCC([C@@H]2CCCCN2C(=O)/C=C/c2ccccc2[N+](=O)[O-])CC1 1832906622 DIRYFCRDGHHUHM-ODUIWNOOSA-N 498.583 5.090 5 20 JKBD Cc1nc(SCC(=O)Nc2ccc([N+](=O)[O-])cc2Br)c2c(C)c(C)sc2n1 9788768 SZFNAFGUVZVDNW-UHFFFAOYSA-N 467.370 5.018 5 20 JKBD CCOc1cc(C(=O)Nc2ccc(OC(F)F)c(Cc3ccccc3)c2)c([N+](=O)[O-])cc1OC 11323426 JDDIFZWAILGBPA-UHFFFAOYSA-N 472.444 5.447 5 20 JKBD O=C(Nc1ccc(OS(=O)(=O)c2ccc(F)c(Cl)c2)cc1)c1cc([N+](=O)[O-])ccc1Cl 14100535 FGZGFBGXANWFQM-UHFFFAOYSA-N 485.276 5.061 5 20 JKBD CS(=O)(=O)c1ccc(Cl)c(NC(=O)c2ccc(NCc3ccccc3Cl)c([N+](=O)[O-])c2)c1 15665962 IDUZFUPKEXZOSY-UHFFFAOYSA-N 494.356 5.170 5 20 JKBD COc1ccc(C(NC(=O)CSc2nc3ccc([N+](=O)[O-])cc3s2)c2ccc(OC)cc2)cc1 17538025 CAFXAYBRJCXUCH-UHFFFAOYSA-N 495.582 5.220 5 20 JKBD COc1cc(C(=O)N2CCN(Cc3cccs3)CC2)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 18147717 XTZRSIXWYIBDTN-UHFFFAOYSA-N 487.965 5.069 5 20 JKBD Cc1c(NC(=O)[C@H](C)Sc2nc3scc(-c4cccs4)c3c(=O)n2C)cccc1[N+](=O)[O-] 23538406 AAJVORQAKYHCIG-LBPRGKRZSA-N 486.600 5.059 5 20 JKBD O=C(Cn1c2ccccc2c(=O)c2ccccc21)NC[C@@H](c1ccccc1)c1c[nH]c2ccccc12 105448484 PZCUEEKNLTUDKS-VWLOTQADSA-N 471.560 5.584 5 20 JKBD CN(Cc1cccc(C(F)(F)F)c1)C1CCN(C(=O)c2ccc(Cl)cc2[N+](=O)[O-])CC1 303018374 LBQQVMIFKBQVIC-UHFFFAOYSA-N 455.864 5.004 5 20 JKBD CC(C)CCSc1ccc(C(=O)N2CCC(c3c[nH]c4ncccc34)CC2)cc1[N+](=O)[O-] 410059738 RXMCSALZQUPJTC-UHFFFAOYSA-N 452.580 5.629 5 20 JKBD O=C1c2ccccc2N[C@@H](c2ccc(-c3ccc([N+](=O)[O-])cc3Cl)o2)N1Cc1cccnc1 489294066 VIZCAGLBSMFDAL-HSZRJFAPSA-N 460.877 5.670 5 20 JKBD C[C@@H]1c2cccn2CCN1C(=O)C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1 502896949 SHDAZOYFAPRCRF-VXNZKSKFSA-N 458.543 5.540 5 20 JKBD COc1ccc(NC(=O)c2ccc(N[C@@H](C)c3ccccn3)c([N+](=O)[O-])c2)cc1OCC(F)(F)F 506177402 ZWWISBMHDRMQAG-AWEZNQCLSA-N 490.438 5.365 5 20 JKBD CCOc1cc([N+](=O)[O-])c(C(=O)Nc2cc(C(C)(C)C)nn2-c2ccc(C)cc2)cc1OC 515096326 DDXDLHWQDMFEPF-UHFFFAOYSA-N 452.511 5.046 5 20 JKBD COCCN(C(=O)[C@@H]1CCC[C@@H](C(F)(F)F)C1)c1nc(-c2ccc([N+](=O)[O-])cc2)cs1 515159544 KYMZAEQAQVUJNF-HUUCEWRRSA-N 457.474 5.066 5 20 JKBD O=C(Nc1c(F)cc(F)cc1-c1ccccc1)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-] 516781122 NAYUHTRQEOQWLT-UHFFFAOYSA-N 452.335 5.733 5 20 JKBD CC(C)c1ccc(Sc2ccc(NC(=O)CNC(=O)c3c(Cl)cccc3[N+](=O)[O-])cc2)cc1 518659246 WJLFICUDCRFKAG-UHFFFAOYSA-N 483.977 5.891 5 20 JKBD C[C@@H](Nc1ccc(C(=O)Nc2cccc(COC3CCCCC3)c2)cc1[N+](=O)[O-])c1ccccn1 520003906 CPPUSHYASHYGDX-LJQANCHMSA-N 474.561 6.265 5 20 JKBD CC[C@@H](C)c1ccc([C@@H](NC(=O)CNC(=O)c2c(Cl)cccc2[N+](=O)[O-])c2cccs2)cc1 520816611 ZSGWUWBYCYTYPP-IQMFZBJNSA-N 485.993 5.459 5 20 JKBD COc1ccccc1-c1cc(NC(=O)c2cc(SC)ccc2[N+](=O)[O-])n(-c2ccccc2)n1 603760146 GYBFJQFTNJWCJE-UHFFFAOYSA-N 460.515 5.430 5 20 JKBD O=C(NC1CCN(Cc2cccc(C(F)(F)F)c2)CC1)c1cc2cc([N+](=O)[O-])ccc2s1 604183318 XETMYCHEKBNSIF-UHFFFAOYSA-N 463.481 5.223 5 20 JKBD CC(C)CN(CCc1ccc(F)cc1)C(=O)c1ccc(N[C@@H](C)c2ccccn2)c([N+](=O)[O-])c1 604301726 PAYOTXOFKVGWSE-IBGZPJMESA-N 464.541 5.643 5 20 JKBD CO[C@H](C)c1cccc(N[C@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Br)c2ccccc2)c1 608889101 IASZWNZSQPFKQC-QRQCRPRQSA-N 484.350 5.857 5 20 JKBD CCN(Cc1ccc(CN(C)C)cc1)C(=O)c1ccc(Sc2nc(C)cs2)c([N+](=O)[O-])c1 608965718 BIYIXIVCFQBUDK-UHFFFAOYSA-N 470.620 5.235 5 20 JKBD C[C@@H](NCc1ccc(Oc2ccc(F)cc2)c([N+](=O)[O-])c1)c1nc2ccccc2n1C(F)F 609006833 ZTKIENMXAVZWAO-CQSZACIVSA-N 456.424 6.122 5 20 JKBD COc1c(Br)cc(Cl)cc1NC(=O)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-] 609096028 SCOQCOIAPYKGAF-UHFFFAOYSA-N 483.624 5.213 5 20 JKBD O=C(Nc1ccc(SC(F)F)cc1)N1CCN(c2ccc([N+](=O)[O-])cc2C(F)(F)F)CC1 727585794 LODQNHYRNMXXJB-UHFFFAOYSA-N 476.427 5.282 5 20 JKBD C[C@@H](Nc1ccc(C(=O)Oc2ccc(-c3noc(C4CC4)n3)cc2)cc1[N+](=O)[O-])c1ccccn1 729220794 LFLQOLHZTNNXOW-OAHLLOKOSA-N 471.473 5.310 5 20 JKBD CSCC[C@@H](NC(=O)c1ccc(Cl)cc1Cl)C(=O)O[C@@H](C)c1cccc([N+](=O)[O-])c1 729357366 JNTYTULFWDXENZ-KPZWWZAWSA-N 471.362 5.058 5 20 JKBD Cc1ccc(NC(=O)[C@H](OC(=O)c2csc(CC(C)C)n2)c2ccccc2)c([N+](=O)[O-])c1 746607085 MZZVONRDBNNPRL-OAQYLSRUSA-N 453.520 5.095 5 20 JKBD O=C(C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)NC[C@H]1COc2ccccc2C1 747585704 HVPPEMTTZLBKRI-IAFWPLRWSA-N 485.565 5.503 5 20 JKBD CCc1cccc2c(C3CCN(C(=O)c4cc([N+](=O)[O-])c(C)c([N+](=O)[O-])c4C)CC3)c[nH]c12 748714773 PLNRWROPQKPLCS-UHFFFAOYSA-N 450.495 5.183 5 20 JKBD O=C(Nc1ccc(Cc2nc3ccccc3s2)cc1)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1 915317642 NZIZHOJFEJRDCY-UHFFFAOYSA-N 473.558 5.149 5 20 JKBD CC(C)c1cccc(C(C)C)c1NC(=S)/C(=C(/O)c1ccc([N+](=O)[O-])cc1)[n+]1cccc(O)c1 917609865 BWVNJTVLOHNWOB-UHFFFAOYSA-O 478.594 6.158 5 20 JKBD CC1CCN(c2ccc([N+](=O)[O-])cc2C(=O)Nc2ccc(C(=O)N3CCCC[C@@H]3C)cc2)CC1 917777882 CSZRLVBHBWUCCJ-IBGZPJMESA-N 464.566 5.098 5 20 JKBD Cc1c(COC(=O)[C@H](C)SCc2nc(O)c3c(-c4ccccc4)csc3n2)cccc1[N+](=O)[O-] 918899094 BGHCQKJGNNDWPM-HNNXBMFYSA-N 495.582 5.646 5 20 JKBD O=C(CCc1cccc([N+](=O)[O-])c1)NC1(c2ccc(NC(=O)c3ccc4c(c3)C(=O)CC4)cc2)CCC1 1790882883 DCNAUMJXSFHYSG-UHFFFAOYSA-N 497.551 5.104 5 20 JKBD C[C@H](C(=O)NC1(c2ccc(NC(=O)c3cc4cc([N+](=O)[O-])ccc4s3)cc2)CCC1)n1cccn1 1791010385 MCAMSUWWLGDRFV-MRXNPFEDSA-N 489.557 5.015 5 20 JKBD C/C(=C\c1cccnc1)C(=O)Nc1ccc(C2(NC(=O)CCc3cccc([N+](=O)[O-])c3)CCC2)cc1 1791851862 DBICOGJMGYBQKE-LVZFUZTISA-N 484.556 5.160 5 20 JKBD C[C@@H](C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cc3cc([N+](=O)[O-])ccc3s1)C2)c1ccc(Cl)cc1 1792820918 IVHKYANORRBMOS-PPRPKMEESA-N 498.004 5.518 5 20 JKBD Cc1oc(C(C)(C)C)cc1C(=O)N1CCCC[C@H]1c1cc(NC(=O)/C=C/c2ccc([N+](=O)[O-])o2)n[nH]1 1814966515 KCVHIERAKCOXQG-RQMBKDMJSA-N 495.536 5.129 5 20 JKBD Cc1oc(C(C)(C)C)cc1C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cc(F)cc([N+](=O)[O-])c2)[nH]n1 1816462783 FGDRDMAGEODIDG-HXUWFJFHSA-N 497.527 5.276 5 20 JKBD O=C(Nc1cc([C@H]2CCCCN2C(=O)/C=C/c2ccccc2[N+](=O)[O-])[nH]n1)c1cccc(F)c1Cl 1821122719 KPTKQOAAYJUNCP-YVNCXZRQSA-N 497.914 5.130 5 20 JKBD O=C(Nc1cc([C@H]2CCCCN2C(=O)c2cccc3ccccc23)[nH]n1)c1cc(F)cc([N+](=O)[O-])c1 1821166523 XSLNHFTWEJMIGQ-HSZRJFAPSA-N 487.491 5.230 5 20 JKBD CCC(C)(C)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cc3cc([N+](=O)[O-])ccc3s2)n[nH]1 1821610071 ARSUGKGZKHLWNS-QGZVFWFLSA-N 469.567 5.275 5 20 JKBD Cc1cccc(C)c1C(=O)N1CCCC[C@H]1c1cc(NC(=O)CSc2ccccc2[N+](=O)[O-])n[nH]1 1822312645 CXRFYDDZUFGTNY-IBGZPJMESA-N 493.589 5.033 5 20 JKBD Cc1c(C(=O)N2CCC([C@H]3CCCCN3C(=O)[C@H]3CCC(F)(F)C3)CC2)cc(Cl)cc1[N+](=O)[O-] 1823695442 IVZHMNUFMJZTNR-FXAWDEMLSA-N 497.970 5.225 5 20 JKBD Cc1cc2cccc(C(=O)N3CCC([C@H]4CCCCN4C(=O)c4ccc([N+](=O)[O-])cc4F)CC3)c2[nH]1 1830496138 HXONGYOADDYWFH-XMMPIXPASA-N 492.551 5.071 5 20 JKBD O=C(CSc1ccccc1[N+](=O)[O-])N1CCC([C@H]2CCCCN2C(=O)C[C@H]2C[C@@H]3CC[C@H]2C3)CC1 1831484120 VQMSSSBBQMDXRB-CWKRKGSWSA-N 499.677 5.133 5 20 JKBD O=C(COC(=O)CCc1ncc(-c2ccc(Cl)cc2Cl)o1)Nc1cc([N+](=O)[O-])ccc1Cl 12271846 HTPAUDBJOVFEBF-UHFFFAOYSA-N 498.706 5.325 5 20 JKBD O=C(Nc1ccc(OC(=O)c2csc(-c3ccc(F)cc3)n2)cc1)c1cccc([N+](=O)[O-])c1 15515697 LMHAYLWUXWPAAW-UHFFFAOYSA-N 463.446 5.329 5 20 JKBD C[C@@H](Sc1nnc(Cc2cccs2)n1C1CC1)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 17273339 KIROLACIDWPRGK-LLVKDONJSA-N 497.524 5.312 5 20 JKBD Cc1cc(SCC(=O)O[C@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)c(C)cc1Br 17483386 JSZKMRNFMGNSBF-CYBMUJFWSA-N 492.351 5.421 5 20 JKBD CC[C@@H]1CCc2sc(-c3nnc(S[C@H](C)c4nnc(-c5ccc([N+](=O)[O-])cc5)o4)n3C)cc2C1 17717211 YGCQYWPHBYMQIP-ZIAGYGMSSA-N 496.618 5.870 5 20 JKBD COc1ccc([N+](=O)[O-])cc1NC(=O)[C@H](C)Sc1nnc(-c2ccc(C(C)(C)C)cc2)o1 22249660 XZPHJNCLTPMQFI-ZDUSSCGKSA-N 456.524 5.070 5 20 JKBD O=C(c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1)N1CCC(c2nc3ccccc3[nH]2)CC1 29267666 WMYAITPWBYKOMK-UHFFFAOYSA-N 476.920 5.937 5 20 JKBD COc1ccc(Oc2ccc([N+](=O)[O-])cc2C(=O)Nc2cc3c(cc2Cl)OCCO3)cc1 32582762 MDGFVZVFXPLJIZ-UHFFFAOYSA-N 456.838 5.073 5 20 JKBD C[C@H](Nc1ccc(C(=O)N(C)Cc2ccc(OC(F)(F)F)cc2)cc1[N+](=O)[O-])c1ccccn1 108781074 KZVZNGCIIHYSDX-HNNXBMFYSA-N 474.439 5.334 5 20 JKBD C[C@@H](NC(=O)c1ccc(N[C@H](C)c2ccccn2)c([N+](=O)[O-])c1)c1cccc(OC(F)F)c1 108832732 PDFKOPHJFYRBGA-HUUCEWRRSA-N 456.449 5.255 5 20 JKBD O=C(NCc1cccnc1N1CCCCC1)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1 109211001 AVJSFKFFFSXPSM-UHFFFAOYSA-N 466.925 5.356 5 20 JKBD Cc1csc(Sc2ccc(C(=O)N(CC(F)(F)F)c3ccccn3)cc2[N+](=O)[O-])n1 409620277 XVGSPFSRUHIVLS-UHFFFAOYSA-N 454.455 5.115 5 20 JKBD Cc1cc(Sc2nnc(-c3ccncc3)n2-c2ccccc2)nc(-c2ccc([N+](=O)[O-])cc2)n1 489280684 ZYFAXSFZBIVNCM-UHFFFAOYSA-N 467.514 5.154 5 20 JKBD CCOc1cc([N+](=O)[O-])c(C(=O)N[C@@H](c2ccc(F)cc2)c2ccccc2Cl)cc1OC 502335170 AKIBNJAGQIAAHX-QFIPXVFZSA-N 458.873 5.314 5 20 JKBD C[C@H]1C[C@@H](C)CN(c2ccc(C(=O)Nc3cc(F)ccc3OC[C@H]3CCCO3)cc2[N+](=O)[O-])C1 502365686 LKZASZPSDANEPV-FUHIMQAGSA-N 471.529 5.026 5 20 JKBD C[C@H](CCc1ccc(Br)cc1)NC(=O)Cn1c2ccccc2c(=O)c2ccccc21 507802352 BWXKWBZLPIEPMJ-QGZVFWFLSA-N 463.375 5.055 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Br)[C@@H](N[C@H]1CCc2cc(F)ccc21)c1ccccc1 513182573 HDVNXOBRTUSOEA-UNMCSNQZSA-N 484.325 5.453 5 20 JKBD Cc1ccc(Sc2ccc(CN[C@H](c3ccc(F)cc3)c3nccn3C)cc2[N+](=O)[O-])cc1 521822041 RNPMKAXTQXTWBE-XMMPIXPASA-N 462.550 5.806 5 20 JKBD O=C(Nc1nc2ccccc2n1Cc1cccc(C(F)(F)F)c1)c1ccc([N+](=O)[O-])cc1F 524120529 MYGNUVNGFSFNGE-UHFFFAOYSA-N 458.371 5.403 5 20 JKBD NC(=O)Nc1cccc(NC(=O)c2ccccc2Sc2ccc(C(F)(F)F)cc2[N+](=O)[O-])c1 599770593 OFWUXYVLZZELJA-UHFFFAOYSA-N 476.436 5.508 5 20 JKBD C[C@H]1CCCN(c2ccc(C(=O)N[C@@H]3C[C@@H](C(F)(F)F)C[C@@H](C(F)(F)F)C3)cc2[N+](=O)[O-])C1 603572876 KNRCABMGMRMOSB-ARLBYUKCSA-N 481.437 5.470 5 20 JKBD O=C(Nc1cccc(NC(=O)c2ccc(Nc3ccccc3)c([N+](=O)[O-])c2)c1)c1ccncc1 603575346 GDEGIXWAGWBLOK-UHFFFAOYSA-N 453.458 5.238 5 20 JKBD O=C(NC[C@H](c1ccc(Cl)cc1Cl)c1c[nH]c2ccccc12)C(=O)Nc1cccc([N+](=O)[O-])c1 603697881 NOIMBHZFTJPAGU-LJQANCHMSA-N 497.338 5.270 5 20 JKBD O=C(Nc1cccc(C(=O)N(Cc2ccccc2[N+](=O)[O-])CC(F)(F)F)c1)c1ccc(F)cc1 603742282 SOMLGQYSJRVEQC-UHFFFAOYSA-N 475.398 5.191 5 20 JKBD C[C@@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccc(C(=O)N2CCCC[C@H]2C)c(Cl)c1 603987179 LQMKWZFNHFBECW-HUUCEWRRSA-N 461.971 5.382 5 20 JKBD C[C@H](NC(=O)N[C@@H](C)c1cccc([N+](=O)[O-])c1)c1ccc(NC(=O)c2ccc(F)cc2)cc1 604104518 OXNRZYIBPZDXJA-HOTGVXAUSA-N 450.470 5.108 5 20 JKBD C[C@H]1CCCCN1C(=O)c1ccc(NC(=O)[C@@H](C)Oc2ccc(Cl)cc2[N+](=O)[O-])cc1Cl 604443647 GQNWDTRMATYBDR-UONOGXRCSA-N 480.348 5.322 5 20 JKBD CC(C)(C)OC(=O)C1CCN(C(=O)c2ccc(NCc3ccccc3Cl)c([N+](=O)[O-])c2)CC1 608989302 JBUNAUXMTJAAKK-UHFFFAOYSA-N 473.957 5.054 5 20 JKBD CCCOc1cc(NC(=O)N2CCC[C@H]2c2ccccc2OC)c([N+](=O)[O-])cc1OCCC 609046551 FLKSGBAOKNTRMY-IBGZPJMESA-N 457.527 5.550 5 20 JKBD O=[N+]([O-])c1cc(CNCc2ccc(CN3CCC(O)CC3)cc2)ccc1Oc1ccccc1Cl 609223714 LCCZYKQXHNLSON-UHFFFAOYSA-N 481.980 5.287 5 20 JKBD Cc1cccc(-c2nnc(S[C@@H](C)C(=O)Nc3ccc([N+](=O)[O-])cc3C(F)(F)F)o2)c1 614785605 BNFOBIMRQLMDSJ-NSHDSACASA-N 452.414 5.091 5 20 JKBD O=[N+]([O-])c1ccc(Sc2nnc(-c3ccncc3)n2-c2ccc(Cl)cc2)c2ccncc12 619669901 PYXZBQHXSOVWHK-UHFFFAOYSA-N 460.906 5.590 5 20 JKBD CCc1cccc[n+]1/C(C(=S)Nc1cc(OC)ccc1OC)=C(/O)c1ccc(C)c([N+](=O)[O-])c1 726569126 BGIQENZPXGYCNT-UHFFFAOYSA-O 480.566 5.094 5 20 JKBD C[C@@H](NC(=S)/C(=C(/O)c1cccc([N+](=O)[O-])c1)[n+]1ccc2c(c1)CCCC2)c1cccs1 726579929 NYXBFRCKIGMZEN-MRXNPFEDSA-O 466.608 5.385 5 20 JKBD O=C(c1ccc(C2SCCCS2)cc1)N1CCN(c2ccc([N+](=O)[O-])cc2C(F)(F)F)CC1 727329025 MIHVQWHYRZJCBD-UHFFFAOYSA-N 497.564 5.445 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)OCc2coc(-c3ccc(Br)cc3)n2)cc1SC 728650203 DORJNJVZMQPFAI-UHFFFAOYSA-N 479.308 5.100 5 20 JKBD COc1ccc(NC(=O)COC(=O)c2sc3cc(Br)ccc3c2Cl)c([N+](=O)[O-])c1 729869738 CFEWEGRVPGGXIF-UHFFFAOYSA-N 499.726 5.030 5 20 JKBD Cc1ccc[n+](/C(C(=S)Nc2cc(Cl)cc(Cl)c2)=C(/O)c2ccc(C)c([N+](=O)[O-])c2)c1 747880204 WJWXCDWHAAVMKN-UHFFFAOYSA-O 475.377 6.129 5 20 JKBD O=C(Nc1ccc(Oc2cccc(Br)c2)nc1)c1cc([N+](=O)[O-])ccc1Br 751127228 XYAYBUOQXVXLOH-UHFFFAOYSA-N 493.111 5.559 5 20 JKBD O=[N+]([O-])c1cc(S(=O)(=O)N(Cc2coc(-c3ccc(F)cc3)n2)c2ccccc2)ccc1Cl 884117473 BWRNVXBKKRDYNK-UHFFFAOYSA-N 487.896 5.438 5 20 JKBD Cc1csc(Sc2ccc(-c3nc(-c4cccc(CN5CCOCC5)c4)no3)cc2[N+](=O)[O-])n1 904496389 XCIQHRPKLVWFLP-UHFFFAOYSA-N 495.586 5.060 5 20 JKBD CC(C)(C)c1nc(COC(=O)c2ccccc2NC(=O)c2ccc([N+](=O)[O-])cc2Cl)cs1 915377673 VIDCYWXXRKYMGU-UHFFFAOYSA-N 473.938 5.612 5 20 JKBD CCCc1ccc([C@H](NC(=O)C(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)c2cccs2)cc1 915741503 YHJKLCGCSKJKFR-FQEVSTJZSA-N 457.939 5.107 5 20 JKBD O=C(O)c1ccc2c(=O)nc(/C(Cl)=C\c3ccc(-c4ccc([N+](=O)[O-])cc4Cl)o3)[nH]c2c1 916127147 GVQNTRBWGUBTSE-CXUHLZMHSA-N 472.240 5.180 5 20 JKBD CC1=C(C(=O)Nc2ccccc2C)[C@H](c2ccc([N+](=O)[O-])cc2)NC(=S)N1c1ccccc1 916162280 NAKHIONEETWNAA-QHCPKHFHSA-N 458.543 5.252 5 20 JKBD C[C@@H](Nc1cccc(COc2ccccc2)c1)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 917941915 XUGHJNUSSIUVKX-OAHLLOKOSA-N 459.424 5.632 5 20 JKBD CC(C)(C)OC(=O)N1CCC(NC(=O)c2cc([N+](=O)[O-])ccc2Sc2ccc(Cl)cc2)CC1 919966358 HIBWUEIPPNZMOI-UHFFFAOYSA-N 491.997 5.529 5 20 JKBD COC(=O)N(C)c1ccc(N[C@@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2ccccc2)cc1 920060339 JAGJRSBLOZZPCX-OAQYLSRUSA-N 468.897 5.243 5 20 JKBD Nc1ccc(C(=O)O[C@H](C(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)c2ccccc2)c(Cl)c1 920542022 WOLVHACNNOOUQB-IBGZPJMESA-N 460.273 5.021 5 20 JKBD Cc1ccc2nc(C(=O)NC3(c4ccc(NC(=O)c5ccc([N+](=O)[O-])o5)cc4)CCC3)ccc2c1 1785748972 SFLFVVXGUWNGOI-UHFFFAOYSA-N 470.485 5.106 5 20 JKBD O=C(CC[C@H]1CNc2ccccc2C1)Nc1ccc(C2(NC(=O)c3ccc([N+](=O)[O-])o3)CCC2)cc1 1788066731 WDWSUMMJBXILOF-GOSISDBHSA-N 488.544 5.000 5 20 JKBD Cc1ocnc1C(=O)Nc1ccc(C2(NC(=O)c3cc4cc([N+](=O)[O-])ccc4s3)CCC2)cc1 1789893810 JWXKGYAQJLSMHV-UHFFFAOYSA-N 476.514 5.167 5 20 JKBD Cc1c(C(=O)Nc2ccc(C3(NC(=O)[C@@H](C)n4ccnc4C)CCC3)cc2)cc(Cl)cc1[N+](=O)[O-] 1790774935 XHRHJHZFXLPCMV-MRXNPFEDSA-N 495.967 5.070 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cccc(Cl)c2)CC1 1829973036 SMGZZWYHNXTEES-QFIPXVFZSA-N 487.959 5.243 5 20 JKBD Cc1cc(F)c(F)c(C(=O)N2CCCC[C@H]2C2CCN(C(=O)/C=C/c3ccccc3[N+](=O)[O-])CC2)c1 1830778352 WTZCWQXMXUIELP-ZUTVHTERSA-N 497.542 5.128 5 20 JKBD CCCCC[C@H](C)C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2ccc([N+](=O)[O-])c(OC)c2)CC1 1831467791 AMRFMQHZEZFIJY-UGKGYDQZSA-N 473.614 5.053 5 20 JKBD C[C@H](CC(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cc(F)cc([N+](=O)[O-])c2)CC1)c1ccccc1 1831509004 GIHJHBLLLVXLET-KBMIEXCESA-N 481.568 5.161 5 20 JKBD C[C@H](OC(=O)c1ccccc1CSc1nc2ccccc2o1)C(=O)Nc1ccccc1[N+](=O)[O-] 9556011 LVLRUDXBGSGVLU-HNNXBMFYSA-N 477.498 5.212 5 20 JKBD C[C@H](OC(=O)C1(c2ccc(F)cc2)CCCC1)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 10799443 SHWZKGUNVXARAB-ZDUSSCGKSA-N 468.403 5.135 5 20 JKBD Cc1ccc(NC(=O)[C@H](OC(=O)CSc2nc3ccccc3o2)c2ccccc2)c([N+](=O)[O-])c1 21138448 YZXVMDIBOYJSDY-JOCHJYFZSA-N 477.498 5.060 5 20 JKBD CC(C)c1sc(NC(=O)c2ccc(Sc3nncn3C)c([N+](=O)[O-])c2)nc1-c1ccccc1 31777833 PWNCMXYNZXZOLW-UHFFFAOYSA-N 480.575 5.374 5 20 JKBD COc1ccc(OC)c(-c2nn(-c3ccccc3)cc2C(=O)Nc2ccc(C)c([N+](=O)[O-])c2)c1 36750843 XDDCNNUREFWSLV-UHFFFAOYSA-N 458.474 5.025 5 20 JKBD CC(C)[C@H](NC(=O)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1)c1nc2ccccc2[nH]1 104723342 IVTXLJQJLOYLKW-NRFANRHFSA-N 489.498 5.220 5 20 JKBD COc1ccc(Oc2ccc([N+](=O)[O-])cc2C(=O)Nc2ccc3nc(NC(C)=O)sc3c2)cc1 108640949 XSZFGQXWVFWPBD-UHFFFAOYSA-N 478.486 5.216 5 20 JKBD O=C(Nc1ccc(NC(=O)c2cc3cc([N+](=O)[O-])ccc3s2)c(C(F)(F)F)c1)c1ccco1 217985416 NPDJNQFOVJZMRZ-UHFFFAOYSA-N 475.404 5.926 5 20 JKBD Cc1csc(Sc2ccc(C(=O)NC[C@@H]3CCCO[C@H]3c3ccccc3)cc2[N+](=O)[O-])n1 409556761 YFYXSOVKWXSHLZ-RXVVDRJESA-N 469.588 5.409 5 20 JKBD CSc1ccc(C(=O)c2ccccc2C(=O)Nc2ccc(C(=O)NC(C)C)cc2C)cc1[N+](=O)[O-] 489957030 MCQHQMMSFPIOCM-UHFFFAOYSA-N 491.569 5.247 5 20 JKBD Cc1ccc([C@H](C)N(C)C(=O)C2CCN(c3ccc(C(F)(F)F)cc3[N+](=O)[O-])CC2)c(C)c1 498572857 BWKSIUFAOUUOJQ-KRWDZBQOSA-N 463.500 5.666 5 20 JKBD Cn1cc(C(=O)Nc2nc(-c3cccc(Br)c3)cs2)c(-c2ccc([N+](=O)[O-])cc2)n1 506244768 DHCUPJCAUAHBTI-UHFFFAOYSA-N 484.335 5.134 5 20 JKBD CC[C@@H](C)NC(=O)c1cccc(CNCc2ccc(Oc3ccccc3Cl)c([N+](=O)[O-])c2)c1 509600892 NJXBYVHUSDMOAU-QGZVFWFLSA-N 467.953 5.859 5 20 JKBD CCOc1ccccc1Oc1ccc(CNC(=O)N(Cc2ccc([N+](=O)[O-])cc2)C(C)C)cn1 509764229 FYYPUCWQOHLFEZ-UHFFFAOYSA-N 464.522 5.301 5 20 JKBD CC1CCN(CCCNC(=O)C/C(=C/c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)CC1 516379016 PVZBEQQAVVHSFX-FXBPSFAMSA-N 478.618 5.373 5 20 JKBD Cc1sc(CNC(=O)[C@H](C)Oc2ccc(Cl)cc2[N+](=O)[O-])nc1-c1ccc(Cl)cc1 520473468 GSHZQXZTUYCHQB-NSHDSACASA-N 466.346 5.417 5 20 JKBD CC(C)COC1CCN(C(=O)c2ccc(Sc3nc4ccccc4s3)c([N+](=O)[O-])c2)CC1 521388093 JCEGCFJWOQTFNY-UHFFFAOYSA-N 471.604 5.633 5 20 JKBD O=C(Nc1ccccc1N1CCCC1)c1ccc(C(=O)Nc2ccccc2N2CCCC2)c([N+](=O)[O-])c1 524353300 WLIHPKZYPSMUAG-UHFFFAOYSA-N 499.571 5.300 5 20 JKBD CCCCc1ccc([C@@H](NC(=O)C(=O)Nc2ccc(C)c([N+](=O)[O-])c2)c2cccs2)cc1 603706148 IDFSHMISJYLUSQ-JOCHJYFZSA-N 451.548 5.152 5 20 JKBD Cc1ccc(C)c(SCc2nc(=O)c3c(C)c(C(=O)NCc4ccccc4[N+](=O)[O-])sc3[nH]2)c1 603919043 PHPXHOLCSNEBMJ-UHFFFAOYSA-N 494.598 5.040 5 20 JKBD COc1cc(C(=O)N(Cc2cccnc2)c2ccc(Cl)cc2)c([N+](=O)[O-])cc1OC(F)F 603963920 FQOBETYCSAQOSS-UHFFFAOYSA-N 463.824 5.100 5 20 JKBD COc1cc(C(=O)N(CCc2ccccc2)c2ccccc2)c([N+](=O)[O-])cc1OCc1cscn1 604463905 FYGKBAHJPFFJJV-UHFFFAOYSA-N 489.553 5.528 5 20 JKBD O=[N+]([O-])c1ccc(-c2nn(-c3ccccc3)cc2CNCc2cccc(OCc3ccccn3)c2)cc1 608836257 VVIVMGFWCHABLY-UHFFFAOYSA-N 491.551 5.711 5 20 JKBD Cc1cc2c[nH]nc2cc1NC(=O)C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1 609174075 ZNIPNTIRTPPALK-GZTJUZNOSA-N 469.526 5.959 5 20 JKBD CC[C@H](NC(=O)N1CCN(Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)CC1)c1nc(C)cs1 609213688 CEIQTSMLFIILBQ-IBGZPJMESA-N 485.635 5.067 5 20 JKBD Cc1c(C(=O)Nc2ccc(N3C[C@H](C)O[C@@H](C)C3)c(C(F)(F)F)c2)cc([N+](=O)[O-])c(C)c1[N+](=O)[O-] 728013614 ZVFYNIKGKQKSCV-RYUDHWBXSA-N 496.442 5.005 5 20 JKBD O=C(Nc1ccc(OCc2cccnc2)cc1)c1cc([N+](=O)[O-])ccc1Sc1ccccc1 728495906 IGCJYSJITMLSGT-UHFFFAOYSA-N 457.511 5.972 5 20 JKBD O=C(OCc1nc2ccccc2c2ccccc12)c1cc(S(=O)(=O)Nc2ccccc2F)c[nH]1 728724088 HNXNFQLJXSGLRQ-UHFFFAOYSA-N 475.501 5.013 5 20 JKBD O=C(Nc1ccccc1CN1CCc2ccccc21)c1cc([N+](=O)[O-])ccc1Br 751093650 PQTBOHFCDABUMR-UHFFFAOYSA-N 452.308 5.172 5 20 JKBD O=C(C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)N1CCc2ccc([N+](=O)[O-])cc21 914605308 LVDSVYANEOQLRS-AQTBWJFISA-N 486.509 5.633 5 20 JKBD CCc1c(C(=O)O[C@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2ccccc2)[nH]c(C)c1C(C)=O 919518767 XEFBHIUNLWDXIQ-QFIPXVFZSA-N 483.908 5.187 5 20 JKBD COc1cc(C(=O)Oc2cc(Cl)ccc2Cl)c([N+](=O)[O-])cc1OCc1cscn1 919977329 LIFMGXDCXCXKEC-UHFFFAOYSA-N 455.275 5.165 5 20 JKBD O=C(OCC[C@@H]1CCCCN1C(=O)c1csc(-c2ccccc2F)n1)c1cccc([N+](=O)[O-])c1 920455394 BNMHKKUWZDMJQB-KRWDZBQOSA-N 483.521 5.099 5 20 JKBD O=C(NC1(c2ccc(NC(=O)c3ccc([N+](=O)[O-])o3)cc2)CCC1)c1cc2ccc(Cl)cc2[nH]1 1785746898 CVPLKPMLYGZANO-UHFFFAOYSA-N 478.892 5.384 5 20 JKBD O=C(Cc1cccc([N+](=O)[O-])c1)Nc1ccc(C2(NC(=O)[C@@]3(F)CCCC=C3F)CCC2)cc1 1785794769 DPTDPCPGQNGWKE-RUZDIDTESA-N 469.488 5.017 5 20 JKBD CN(C)c1ccc([N+](=O)[O-])c(C(=O)Nc2ccc(C3(NC(=O)c4ccc5ccoc5c4)CCC3)cc2)c1 1790056528 MDQYSLWXJVLKJQ-UHFFFAOYSA-N 498.539 5.469 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)Nc1ccc(C2(NC(=O)CCCc3cccnc3)CCC2)cc1 1790772571 STHCRWFSLMWYKT-UHFFFAOYSA-N 490.535 5.208 5 20 JKBD C[C@H](C(=O)Nc1ccc(C2(NC(=O)CSc3ccccc3[N+](=O)[O-])CCC2)cc1)c1ccccn1 1791943498 FTNGIGUTQCCZJT-SFHVURJKSA-N 490.585 5.020 5 20 JKBD O=C(NC1(c2ccc(NC(=O)[C@]3(F)CCCC=C3F)cc2)CCC1)c1ccc([N+](=O)[O-])cc1F 1792379553 KZDLJBKZDABACF-DEOSSOPVSA-N 473.451 5.227 5 20 JKBD CC(C)(C)CCCCCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)/C=C/c1ccccc1[N+](=O)[O-] 1804344519 CGEOGBMVWZHWEU-CSXHJAHVSA-N 455.599 5.243 5 20 JKBD O=C(Nc1cc([C@H]2CCCCN2C(=O)C2(c3cccc([N+](=O)[O-])c3)CCC2)[nH]n1)C1CC2(CCC2)C1 1823052908 IMYBKZDGANMTBU-JOCHJYFZSA-N 491.592 5.012 5 20 JKBD Cc1ccc(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3ccc([N+](=O)[O-])cc3F)CC2)cc1Cl 1823909916 GINXEUCVNZLDNR-HSZRJFAPSA-N 487.959 5.243 5 20 JKBD O=C(/C=C/c1ccccc1[N+](=O)[O-])N1CCC([C@@H]2CCCCN2C(=O)c2cc(Cl)ccc2F)CC1 1823940723 XWWZAIRXTAFRMS-HDFUYHJRSA-N 499.970 5.334 5 20 JKBD Cc1ccccc1OCc1nnc(SCC(=O)Nc2cccc([N+](=O)[O-])c2C)n1-c1ccccc1 9929216 WCQITYPRMZTXMJ-UHFFFAOYSA-N 489.557 5.102 5 20 JKBD O=C(Cn1c2ccccc2c(=O)c2ccccc21)N[C@@H](c1ccccc1)c1ccc(Cl)cc1 11250789 YCBMMURSPHVKAO-MHZLTWQESA-N 452.941 5.714 5 20 JKBD COc1ccc(CCNC(=O)c2ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])cc2)cc1OC 15739069 RANXSNPSMOVWME-UHFFFAOYSA-N 456.882 5.030 5 20 JKBD CSc1ccc([N+](=O)[O-])c(C(=O)Nc2ccc(C)c(S(=O)(=O)Nc3ccccc3Cl)c2)c1 16226814 HYHSJIAKGIIVOD-UHFFFAOYSA-N 491.978 5.332 5 20 JKBD COCCn1c(S[C@H](C)C(=O)Nc2cc([N+](=O)[O-])ccc2Cl)nc2cc(Cl)ccc21 24048516 VYOJDVXBCXIVGH-LLVKDONJSA-N 469.350 5.017 5 20 JKBD CSc1ccc(C(=O)c2ccccc2C(=O)OCc2coc(-c3ccccc3)n2)cc1[N+](=O)[O-] 24165527 ZJFJTTJMLOTBGM-UHFFFAOYSA-N 474.494 5.560 5 20 JKBD O=C(CCCn1c(=O)oc2cc([N+](=O)[O-])ccc21)Nc1nc(-c2cc(Cl)ccc2Cl)cs1 26770008 CRJXXNHAIQMMHS-UHFFFAOYSA-N 493.328 5.352 5 20 JKBD Cc1c(C(=O)OCC(=O)Nc2ccc([N+](=O)[O-])cc2C(F)(F)F)oc2c1ccc1ccccc12 28828082 OVHNQEYOTUEXOZ-UHFFFAOYSA-N 472.375 5.617 5 20 JKBD CCn1c(S[C@H](C)C(=O)N(C)Cc2nc3ccccc3s2)nc2cc3ccccc3cc2c1=O 31747467 ZMBIQYJDGUGNBP-MRXNPFEDSA-N 488.638 5.319 5 20 JKBD CCC[C@@H]1CCc2nc(NC(=O)c3cc(OC)c(OCc4cscn4)cc3[N+](=O)[O-])sc2C1 68813226 IHBSBCXEWIIUEU-CYBMUJFWSA-N 488.591 5.253 5 20 JKBD COc1cc2c(cc1OC)[C@H](c1ccccc1)N(C(=O)c1cc([N+](=O)[O-])ccc1Cl)CC2 104658881 FQSJNITYVUSNOP-QHCPKHFHSA-N 452.894 5.053 5 20 JKBD COc1cc(C(=O)Nc2cc(C)nn2-c2ccc([N+](=O)[O-])cc2)cc(Cl)c1OCC(C)C 105527407 STPCQILIWAVZLH-UHFFFAOYSA-N 458.902 5.038 5 20 JKBD C[C@@H](Nc1ccc(C(=O)NCc2ccc(F)cc2C(F)(F)F)cc1[N+](=O)[O-])c1ccccn1 108777181 KDOQQSALDQJANU-CYBMUJFWSA-N 462.403 5.251 5 20 JKBD CSc1ccc([N+](=O)[O-])c(C(=O)N[C@H](c2ccccc2)c2ccc(Br)cc2)c1 302950636 AKZOSQNWKVRVLE-HXUWFJFHSA-N 457.349 5.599 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Cl)[C@@H](c1ccccc1)N1CCc2c(cnn2-c2ccccc2)C1 502020965 GKNKIUHTNKJMSH-RUZDIDTESA-N 487.947 5.172 5 20 JKBD CCC[C@H](NC(=O)c1ccc(NCc2ccccc2Cl)c([N+](=O)[O-])c1)c1nnc2ccccn12 504699274 UAYILKHWCDXZNT-FQEVSTJZSA-N 478.940 5.174 5 20 JKBD CCN(C(=O)Cc1ccc(NC(=O)N(Cc2ccc([N+](=O)[O-])cc2)C(C)C)cc1)c1ccccc1 509235332 QBKJEFRCULKZSF-UHFFFAOYSA-N 474.561 5.633 5 20 JKBD COc1c(Cl)cccc1NC(=O)C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1 509693754 AZTUCDQFZQCGDZ-DTQAZKPQSA-N 479.945 6.436 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Cl)[C@H](NC1CCN(c2ccccc2)CC1)c1ccccc1 513189611 ZJOXGPCEXOEAGX-XMMPIXPASA-N 464.953 5.187 5 20 JKBD CC(C)N(Cc1cccc(C(F)(F)F)c1)C(=O)Cn1c2ccccc2c(=O)c2ccccc21 514396470 HWHMHRSVXVCHMA-UHFFFAOYSA-N 452.476 5.611 5 20 JKBD Cn1ccnc1[C@H](NCc1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1)c1ccccc1 520208742 HCORQTNIBKWQNZ-AREMUKBSSA-N 464.529 5.060 5 20 JKBD Cc1ccc(NC(=O)c2ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])cc2)cc1C(=O)NC(C)C 520869145 QRXADLVUIDSZPO-UHFFFAOYSA-N 467.909 5.739 5 20 JKBD Cc1cc(C(=O)N2CCC[C@@H]2C(=O)Nc2cc(Cl)c(Cl)cc2Cl)ccc1[N+](=O)[O-] 522482487 PIXPJXYEMAZKSP-QGZVFWFLSA-N 456.713 5.107 5 20 JKBD NC(=O)CC[C@@H]1CCCN(C(=O)c2c3c(nc4ccccc24)/C(=C\c2ccc([N+](=O)[O-])cc2)CCC3)C1 524039556 FNZFFPSXYIFBQO-HOJYTFPLSA-N 498.583 5.138 5 20 JKBD CCOc1cc(NC(=O)N2CCC[C@@H](c3cc4ccccc4[nH]3)C2)c([N+](=O)[O-])cc1OCC 603827177 FKWIFKPJLBSODZ-QGZVFWFLSA-N 452.511 5.285 5 20 JKBD Cc1ccc(NC(=O)c2ccccc2)cc1NC(=O)c1ccc(NCc2ccccc2)c([N+](=O)[O-])c1 603910633 WOPLDZRUWBLSLE-UHFFFAOYSA-N 480.524 6.020 5 20 JKBD COc1ccc(-c2nn(Cc3ccccc3)cc2C(=O)N[C@@H](C)c2cccc([N+](=O)[O-])c2)cc1OC 603966504 BMMNIASMGQPDJA-SFHVURJKSA-N 486.528 5.015 5 20 JKBD O=C(NCCc1cc(F)cc2c1OCOC2)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1 604107417 BBOWSIDWORABQY-UHFFFAOYSA-N 472.856 5.019 5 20 JKBD C[C@@H](NCc1ccc(-c2ccc([N+](=O)[O-])cc2Br)o1)c1ccc2c(c1)OCCO2 608835412 AUNGENKRVNFPGR-CYBMUJFWSA-N 459.296 5.239 5 20 JKBD Cn1cnnc1Sc1ccc(C(=O)Nc2cc(F)ccc2Oc2ccccc2)cc1[N+](=O)[O-] 609022223 BAYIDFAUSYZRLZ-UHFFFAOYSA-N 465.466 5.058 5 20 JKBD C[C@@H](Nc1ccc(C(=O)N2CCCC[C@H]2Cc2ccc(F)cc2)cc1[N+](=O)[O-])c1ccccn1 609187684 UBLIKVTXBZIPKJ-GCJKJVERSA-N 462.525 5.539 5 20 JKBD CC1CCN(c2ccc(C(=O)Nc3ccc(SCc4cccnc4)cc3)cc2[N+](=O)[O-])CC1 619687195 CQUFNUWIJTVSFX-UHFFFAOYSA-N 462.575 5.771 5 20 JKBD Cc1cc[n+](/C(C(=S)Nc2ccc(OC(C)C)cc2)=C(/O)c2cccc([N+](=O)[O-])c2)cc1 726573704 BYRHZOSXADWNKD-UHFFFAOYSA-O 450.540 5.301 5 20 JKBD CC1CCN(c2ccc([N+](=O)[O-])cc2C(=O)N2CCC([C@@H]3C(=O)Nc4cc(Cl)ccc43)CC2)CC1 727413050 LGYPPXGWBJXQLO-DEOSSOPVSA-N 496.995 5.073 5 20 JKBD CCn1c(COC(=O)C2CCN(c3ccc(C(F)(F)F)cc3[N+](=O)[O-])CC2)nc2cc(F)ccc21 727507609 NQRRAHKUGWTUEG-UHFFFAOYSA-N 494.445 5.082 5 20 JKBD Cc1ccc(F)c(NC(=S)/C(=C(/O)c2cccc([N+](=O)[O-])c2)[n+]2ccc3c(c2)CCCC3)c1 744115798 HPYZZLVALAPDRM-UHFFFAOYSA-O 464.542 5.532 5 20 JKBD C[C@H](OC(=O)/C(=C\c1ccc(F)cc1)c1cccs1)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl 772026608 SBPCRUIFQCIRMA-MFVBVHDHSA-N 474.897 5.560 5 20 JKBD CCc1cc[n+](/C(C(=S)Nc2ccc(Cl)cc2)=C(/O)c2ccc(C)c([N+](=O)[O-])c2)cc1 839396100 GNAMTNUWFKOUIG-UHFFFAOYSA-O 454.959 5.730 5 20 JKBD C[C@@H]1C[C@@H](C)CN(c2ccc(-c3nc([C@H]4CCC(=O)N(CC5CCCC5)C4)no3)cc2[N+](=O)[O-])C1 856582797 VWBYWMMDBZCNFB-OPYAIIAOSA-N 481.597 5.023 5 20 JKBD O=C(c1ccc([N+](=O)[O-])cc1Cl)N1CCC(C(O)(c2ccccc2)c2ccccc2)CC1 856854112 ITNVAAOSBZAVEZ-UHFFFAOYSA-N 450.922 5.037 5 20 JKBD CSCc1c(C(=O)N(Cc2nnc(-c3cccc([N+](=O)[O-])c3)o2)C(C)C)oc2ccccc12 864240124 VJYBLILJVHFYME-UHFFFAOYSA-N 466.519 5.305 5 20 JKBD Cc1nc(Cc2ccccc2)sc1C(=O)O[C@@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 915447412 ZIUYTRXDLUNWDV-ZDUSSCGKSA-N 493.463 5.153 5 20 JKBD C[C@H](OC(=O)[C@@H](C)Oc1cccc(Cl)c1Cl)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 915496604 XPWYFKMTAIKYMP-WDEREUQCSA-N 452.250 5.023 5 20 JKBD CCc1cc[n+](/C(C(=S)Nc2cccc(C(C)C)c2)=C(/O)c2ccc(C)c([N+](=O)[O-])c2)cc1 917615892 SZGDMSURUJSDFL-UHFFFAOYSA-O 462.595 6.200 5 20 JKBD CO[C@H](C(=O)NC1(c2ccc(NC(=O)CCc3cccc([N+](=O)[O-])c3)cc2)CCC1)c1ccccc1 1786602394 NWFPLDQFXDZULR-SANMLTNESA-N 487.556 5.049 5 20 JKBD O=C(Cc1ccc([N+](=O)[O-])cc1F)NC1(c2ccc(NC(=O)c3cc4sccc4[nH]3)cc2)CCC1 1789370894 LIVQUWUILKEQRT-UHFFFAOYSA-N 492.532 5.267 5 20 JKBD Cc1ccc(CC(=O)NC2(c3ccc(NC(=O)c4cnc(Cl)s4)cc3)CCC2)cc1[N+](=O)[O-] 1789862421 BSPKAPVFMNBDCM-UHFFFAOYSA-N 484.965 5.004 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)[C@H]3C[C@@H]3c3ccccc3)CCC2)cc1)c1nc2cc([N+](=O)[O-])ccc2[nH]1 1790827811 SGLLGVNSKZVTFM-YADHBBJMSA-N 495.539 5.023 5 20 JKBD C[C@H](Sc1ccccn1)C(=O)Nc1ccc(C2(NC(=O)c3cccc(F)c3[N+](=O)[O-])CCC2)cc1 1791834769 IRXUKPKPTKWNJG-INIZCTEOSA-N 494.548 5.057 5 20 JKBD C[C@@H](Cc1ccccn1)C(=O)NC1(c2ccc(NC(=O)/C=C/c3ccccc3[N+](=O)[O-])cc2)CCC1 1792319179 JGIYJAUQNFNLFY-XIJQHFHMSA-N 484.556 5.016 5 20 JKBD CC(C)(C)CCCCCC(=O)N1CC[C@H](CNC(=O)/C=C/c2ccc([N+](=O)[O-])o2)[C@H]1c1cccnc1 1803263571 CCDXQMFRKNSIRX-AAPLMEDBSA-N 496.608 5.299 5 20 JKBD Cc1c(C(=O)N2CC[C@@H](CNC(=O)CCC3CCCC3)[C@@H]2c2cccnc2)cc(Cl)cc1[N+](=O)[O-] 1806207067 OLZJWPOLUUBFTG-CPJSRVTESA-N 499.011 5.242 5 20 JKBD Cc1ccc(CC(=O)N2CCC([C@H]3CCCCN3C(=O)CCC3CCCC3)CC2)cc1[N+](=O)[O-] 1826269280 DVXMSTSVOYOIEY-XMMPIXPASA-N 469.626 5.036 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)N1CCC([C@H]2CCCCN2C(=O)C[C@H]2C[C@@H]3CC[C@H]2C3)CC1 1831482715 UUCLOTPIQCPQJN-LOCCHRAXSA-N 485.600 5.102 5 20 JKBD CC(C)C1(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)CSc3ccccc3[N+](=O)[O-])CC2)CCC1 1832492222 INUKLBSTNUFPOG-OAQYLSRUSA-N 487.666 5.133 5 20 JKBD COc1ccc(-c2csc(NC(=O)Cn3c4ccccc4c(=O)c4ccccc43)n2)cc1Cl 11250961 RVRVBLZZUDUAKX-UHFFFAOYSA-N 475.957 5.579 5 20 JKBD CC(=O)Oc1ccc(-c2ccc(C(=O)O[C@@H](C)c3nnc(-c4ccc([N+](=O)[O-])cc4)o3)cc2)cc1 17838552 OYURIGDBJKVGPY-HNNXBMFYSA-N 473.441 5.155 5 20 JKBD COc1cc(C(=O)N(C)Cc2ccc3c(c2)OCO3)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 18155747 AXQDRYDFBVSISX-UHFFFAOYSA-N 470.865 5.050 5 20 JKBD Cc1nn(Cc2ccc(C(=O)N[C@H](COc3ccccc3F)c3ccccc3)cc2)c(C)c1[N+](=O)[O-] 69633831 SQIAPNIEKWPUMR-XMMPIXPASA-N 488.519 5.146 5 20 JKBD CCCN(C(=O)CCCn1c(=O)oc2cc([N+](=O)[O-])ccc21)[C@@H](C)c1ccccc1Br 69640117 IOJPUHBKHXDUSX-HNNXBMFYSA-N 490.354 5.045 5 20 JKBD O=C(Nc1cccc(OCc2ccc(F)cc2)c1)c1cc([N+](=O)[O-])ccc1I 108654403 JIZFQHLTWJVRFL-UHFFFAOYSA-N 492.244 5.170 5 20 JKBD Cn1c(NC(=O)C2CCN(c3ccc(C(F)(F)F)cc3[N+](=O)[O-])CC2)nc2cc(Cl)ccc21 109414980 ZWCOHHKWKFJGRW-UHFFFAOYSA-N 481.862 5.009 5 20 JKBD O=c1c2ccc(C(F)(F)F)cc2nc2n1CC/C2=C/c1ccc(-c2ccc([N+](=O)[O-])cc2)o1 207976923 LLPCHMZSSGHVNB-KAMYIIQDSA-N 453.376 5.528 5 20 JKBD O=C(NC1CCN(Cc2ccc(F)cc2)CC1)c1cc([N+](=O)[O-])ccc1Sc1ccccc1 488855237 JDCGUCGCXAQQBL-UHFFFAOYSA-N 465.550 5.280 5 20 JKBD CCC(C)(C)NC(=O)c1ccc(NC(=O)CSc2ccc(C(F)(F)F)cc2[N+](=O)[O-])cc1 489713163 WLXRKBIPYSYZOQ-UHFFFAOYSA-N 469.485 5.263 5 20 JKBD C[C@@H](Nc1ccc(C(=O)N(C)CCCc2cc(-c3ccccc3)no2)cc1[N+](=O)[O-])c1ccccn1 505391898 MBQNUFMRKBNNRB-LJQANCHMSA-N 485.544 5.523 5 20 JKBD CCOc1ccc([C@H](C)NC(=O)c2ccc(N[C@@H](C)c3ccccn3)c([N+](=O)[O-])c2)cc1OC 506244443 AUIRTCVJNMVNLX-IRXDYDNUSA-N 464.522 5.061 5 20 JKBD C[C@@H](Nc1ccc(C(=O)N2CCc3[nH]c4ccc(Cl)cc4c3C2)cc1[N+](=O)[O-])c1ccccn1 507394163 XQOCPCBVQINOFV-OAHLLOKOSA-N 475.936 5.496 5 20 JKBD O=C(CCn1cc([N+](=O)[O-])cn1)NC[C@@H](c1ccccc1)c1c(-c2ccccc2)[nH]c2ccccc12 508806834 SHCCBQOPEJYPAQ-DEOSSOPVSA-N 479.540 5.278 5 20 JKBD COc1ccc([N+](=O)[O-])cc1CNc1ccc(NC(=O)c2ccccc2F)cc1C(F)(F)F 513063954 JQPDKPLERDKEQK-UHFFFAOYSA-N 463.387 5.626 5 20 JKBD COc1ccc(-n2c(SCCOc3ccccc3[N+](=O)[O-])nnc2-c2ccccc2OC)cc1 515423905 FIGZZNCDYDHYEA-UHFFFAOYSA-N 478.530 5.031 5 20 JKBD COc1ccc2[nH]cc(C3=CCN(C(=O)c4ccc(N5CCC[C@H](C)C5)c([N+](=O)[O-])c4)CC3)c2c1 515826308 FTZIUEMXFQZAGB-SFHVURJKSA-N 474.561 5.251 5 20 JKBD COc1cc(C(=O)N2CCC[C@@H](Cc3ccc(C)cc3)C2)c([N+](=O)[O-])cc1OCc1cscn1 519734467 MEOIKRSYGSWXSX-IBGZPJMESA-N 481.574 5.042 5 20 JKBD Cc1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2Sc2ccc(Cl)cc2)cc1NS(C)(=O)=O 520415134 YWOGJDFGQWOANT-UHFFFAOYSA-N 491.978 5.332 5 20 JKBD CCOc1cc([N+](=O)[O-])c(C(=O)Nc2cc(-c3cccc(C)c3)nn2-c2ccccc2)cc1OC 585714930 NIMJQDGWUVFHJN-UHFFFAOYSA-N 472.501 5.416 5 20 JKBD CC(=O)N(c1ccc(Cl)cc1)c1nc(COc2ccc([N+](=O)[O-])cc2Cc2ccccc2)cs1 603948058 UVXDZBUCBXGPPZ-UHFFFAOYSA-N 493.972 6.559 5 20 JKBD CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)Cc1csc(-c2ccc(C(F)(F)F)cc2)n1 604346594 MQOPXAQOQDFBMM-UHFFFAOYSA-N 463.481 5.717 5 20 JKBD Cc1ccc(NC(=O)c2ccc(Sc3nnc(-c4ccncc4)n3C3CC3)c([N+](=O)[O-])c2)cc1 608972380 DOBNUXLTHKLPQF-UHFFFAOYSA-N 472.530 5.295 5 20 JKBD COc1ccc(-c2nnc(SCC(=O)c3cccc([N+](=O)[O-])c3)n2C2CCCCC2)cc1OC 612258313 ZCOFEAGKAWUQRL-UHFFFAOYSA-N 482.562 5.351 5 20 JKBD O=C(OCC[C@@H]1CCCCN1C(=O)C[C@@H](c1ccccc1)C(F)(F)F)c1cccc([N+](=O)[O-])c1 728516710 ZACBZVDRMVWQEV-FPOVZHCZSA-N 478.467 5.259 5 20 JKBD CCc1cc2oc(=O)cc(COC(=O)c3csc(-c4cccc([N+](=O)[O-])c4)n3)c2cc1Cl 747963595 MOXZYCGOLTZGPD-UHFFFAOYSA-N 470.890 5.398 5 20 JKBD O=C(OCc1cc([N+](=O)[O-])cc2c1OCOC2)c1sc(-c2ccco2)nc1-c1ccccc1 900280046 RRHCZUNYSJIEQQ-UHFFFAOYSA-N 464.455 5.202 5 20 JKBD O=C(c1ccc([N+](=O)[O-])s1)N1CCC[C@H]1c1nc(-c2ccc(COc3ccccc3)cc2)no1 904447940 OGHRTDHFHAMTMD-IBGZPJMESA-N 476.514 5.263 5 20 JKBD Cc1cc(C(=O)N2CCC[C@H]2c2nc(-c3cccc(NC(=O)OC(C)(C)C)c3)no2)ccc1[N+](=O)[O-] 904635920 SVHRJAZANZIHKX-FQEVSTJZSA-N 493.520 5.278 5 20 JKBD COc1ccc(NC(=O)Cn2c3ccccc3c(=O)c3ccccc32)cc1NC(=O)OC(C)(C)C 915077318 BKHCCNLJWYQSTR-UHFFFAOYSA-N 473.529 5.149 5 20 JKBD O=[N+]([O-])c1ccc(F)cc1CSc1nnc(COc2ccccc2F)n1-c1ccccc1 915790732 OAMFNFGQLSJFSU-UHFFFAOYSA-N 454.458 5.325 5 20 JKBD O=C(CSc1nnc(-c2ccc(F)cc2)n1Cc1ccco1)Nc1cc(Cl)ccc1[N+](=O)[O-] 916664586 JQJIFHQBOPMXTE-UHFFFAOYSA-N 487.900 5.018 5 20 JKBD CC1=NN(c2ccc(C(=O)O[C@@H](C(=O)Nc3ccc([N+](=O)[O-])cc3Cl)c3ccccc3)cc2)CC1 919143074 XPYGYUOKXNMKDD-HSZRJFAPSA-N 492.919 5.371 5 20 JKBD Cc1ccc(NC(=O)[C@H](OC(=O)c2cc(C3CC3)n(C(C)(C)C)n2)c2ccccc2)c([N+](=O)[O-])c1 919375407 RXUUVPWMLUYOOZ-HSZRJFAPSA-N 476.533 5.269 5 20 JKBD COc1cc(C(=O)Nc2ccccc2SC(F)(F)F)c([N+](=O)[O-])cc1OCc1cscn1 920003930 WHLWAHKUNFCPDE-UHFFFAOYSA-N 485.465 5.503 5 20 JKBD O=C(C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)Nc1cccc(-n2ccnc2O)c1 920082426 CPPBFDHRNSXFKT-JXAWBTAJSA-N 497.536 5.665 5 20 JKBD CCSc1cccnc1C(=O)Nc1ccc(C2(NC(=O)/C=C/c3ccc([N+](=O)[O-])o3)CCC2)cc1 1790207157 IKNOHTIUMAEQTE-ZRDIBKRKSA-N 492.557 5.156 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)c3ccc([N+](=O)[O-])o3)CCC2)cc1)c1ccc(N2CCCCC2)cc1 1790678465 MRMYINTVLKHPEL-UHFFFAOYSA-N 488.544 5.240 5 20 JKBD O=C(Nc1cc([C@@H]2CCCCN2C(=O)[C@@H]2CCC[C@H]3CCCC[C@H]32)[nH]n1)c1cccc(F)c1[N+](=O)[O-] 1821169438 HKFLNQNKKLZKEO-IDVKNYFZSA-N 497.571 5.369 5 20 JKBD CC(C)[C@H]1CC[C@H](C(=O)Nc2cc([C@@H]3CCCCN3C(=O)c3ccc([N+](=O)[O-])cc3F)[nH]n2)CC1 1822105191 ZNMLFQGCMKZGKJ-HOIFWPIMSA-N 485.560 5.225 5 20 JKBD Cc1c(F)cccc1C(=O)N1CCCC[C@H]1C1CCN(C(=O)CSc2ccccc2[N+](=O)[O-])CC1 1823926639 HFOURQIPADPVQQ-QFIPXVFZSA-N 499.608 5.068 5 20 JKBD Cc1cccc2[nH]c(C(=O)N3CCCC[C@@H]3C3CCN(C(=O)c4ccc([N+](=O)[O-])cc4F)CC3)cc12 1828577444 IGFYJLUBYHALRM-RUZDIDTESA-N 492.551 5.071 5 20 JKBD Cc1ccc(CC(=O)N2CCC([C@H]3CCCCN3C(=O)c3ccc4ccoc4c3)CC2)cc1[N+](=O)[O-] 1830912096 MUXZRAYMHOWWCL-XMMPIXPASA-N 489.572 5.125 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)N1CCC([C@H]2CCCCN2C(=O)[C@]2(C)CC=CCC2)CC1 1832407569 ZXHPNVTWTZXUEE-ATIYNZHBSA-N 471.573 5.022 5 20 JKBD O=C(COC(=O)Cn1c2ccccc2c(=O)c2ccccc21)Nc1ccc(Oc2ccccc2)cc1 11276288 CECFUEUSWMJBQM-UHFFFAOYSA-N 478.504 5.129 5 20 JKBD O=C(Nc1ccc(OC(=O)[C@H]2COc3ccc(Cl)cc3C2)cc1)c1cc([N+](=O)[O-])ccc1Cl 15571571 FDEROUUMCLTIDP-CQSZACIVSA-N 487.295 5.311 5 20 JKBD C[C@H](Sc1nnc(Nc2cccc(F)c2)s1)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 22171746 FHPAZZYNUFMVLT-VIFPVBQESA-N 487.460 5.467 5 20 JKBD O=C(NCC1(c2cccc(C(F)(F)F)c2)CCOCC1)c1csc(-c2cccc([N+](=O)[O-])c2)n1 215730297 WIKMXTQSOJEOTB-UHFFFAOYSA-N 491.491 5.215 5 20 JKBD O=C(c1csc(-c2cccc([N+](=O)[O-])c2)n1)N(C[C@H]1CCCO1)c1nc2ccccc2s1 302977574 CJUNOWINGTUMJO-MRXNPFEDSA-N 466.544 5.154 5 20 JKBD COc1ccc([C@@H]2CCCCCN2C(=O)c2ccc(N[C@H](C)c3ccccn3)c([N+](=O)[O-])c2)cc1 303037764 VMUQXJCECNATDR-CLOONOSVSA-N 474.561 5.929 5 20 JKBD CCN(Cc1ccc(C(=O)N(C)C)cc1)C(=O)c1ccc(Sc2ccc(C)cc2)c([N+](=O)[O-])c1 303145120 DMSMMADCERGBNM-UHFFFAOYSA-N 477.586 5.419 5 20 JKBD O=[N+]([O-])c1ccc(-c2ccc(CN[C@H](c3ccccc3)c3ccncc3)o2)c(Br)c1 488457407 JOLBZIADMIHSOE-HSZRJFAPSA-N 464.319 5.892 5 20 JKBD Cc1ccc(Sc2ccc(C(=O)Nc3ccc(CN4CCCC4=O)cc3)cc2[N+](=O)[O-])cc1 500973228 BJJPBRLXHFPNKA-UHFFFAOYSA-N 461.543 5.429 5 20 JKBD COc1cc(C(=O)Nc2ccc(-c3cc4ccccc4o3)cc2)c([N+](=O)[O-])cc1OC(F)F 503946058 MFZSGTGFZARVOU-UHFFFAOYSA-N 454.385 5.870 5 20 JKBD COC(=O)c1cc(C(C)C)ccc1NC(=O)c1ccc(N[C@H](C)c2ccccn2)c([N+](=O)[O-])c1 505164211 LXJVMHPSVNZYMT-MRXNPFEDSA-N 462.506 5.325 5 20 JKBD CSc1ccc([C@@H](CNC(=O)N(C)Cc2ccccc2[N+](=O)[O-])N2CCc3sccc3C2)cc1 505168359 VBXBJCRFWVARLD-HSZRJFAPSA-N 496.658 5.319 5 20 JKBD C[C@H](Nc1ccc(C(=O)N[C@H](C)c2ccc(Br)cc2)cc1[N+](=O)[O-])c1ccccn1 505981065 HUTPWDQKUHRNKX-CABCVRRESA-N 469.339 5.416 5 20 JKBD C[C@@H](Nc1ccc(C(=O)NC(c2ccccc2)c2ccccc2)cc1[N+](=O)[O-])c1ccccn1 506054785 BQRWWCBSPWXQKP-LJQANCHMSA-N 452.514 5.682 5 20 JKBD C[C@@H](Nc1ccc(C(=O)Nc2ccc(Cl)c(C(F)(F)F)c2)cc1[N+](=O)[O-])c1ccccn1 506098689 GPUKOSLIMSLHRI-GFCCVEGCSA-N 464.831 6.087 5 20 JKBD O=C(Nc1cc(Cl)ccc1OC[C@@H]1CCCO1)c1ccc(NCc2ccccc2)c([N+](=O)[O-])c1 509807725 PPKPGTBYEJJHDU-FQEVSTJZSA-N 481.936 5.670 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Cl)[C@H](N[C@H](c1ccccc1)c1ccco1)c1ccccc1 510650317 ZMAMUZBTJKVSIR-DNQXCXABSA-N 461.905 5.900 5 20 JKBD CCC(CC)C(=O)N1CCC(NCc2ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])cc2)CC1 513637737 MRHJTYOGCJNMAB-UHFFFAOYSA-N 459.974 5.557 5 20 JKBD Cc1cccc([N+](=O)[O-])c1NC(=O)CSc1nnc(-c2ccco2)n1[C@@H](C)[C@@H]1C[C@H]2CC[C@H]1C2 515308971 LBESZUOHDVZAGO-XSLAGTTESA-N 481.578 5.483 5 20 JKBD CCOc1ccc([C@H](CNC(=O)c2ccc([N+](=O)[O-])cc2F)c2c[nH]c3ccccc23)cc1OC 515586223 YNINNCURHRDHMC-FQEVSTJZSA-N 477.492 5.184 5 20 JKBD Cn1cc([C@H]2Nc3ccccc3C(=O)N2c2ccc(F)cc2Cl)c(-c2ccc([N+](=O)[O-])cc2)n1 516370340 ODHBMNGDWAGSHK-QHCPKHFHSA-N 477.883 5.559 5 20 JKBD COc1ccc(Oc2ccc([N+](=O)[O-])cc2C(=O)Nc2ccc(C)c(NC(=O)c3ccncc3)c2)cc1 520743770 INABZOQRZGXZFY-UHFFFAOYSA-N 498.495 5.604 5 20 JKBD COc1ccc([C@@H](Cc2ccccc2C)NC(=O)N(C)Cc2ccccc2[N+](=O)[O-])cc1OC 520877122 JWEGPFAMOIKZKL-JOCHJYFZSA-N 463.534 5.046 5 20 JKBD Cc1nc(C)c(-c2csc(NC(=O)CSc3ccc(C(F)(F)F)cc3[N+](=O)[O-])n2)s1 603769862 AOKPLLMQQNVSAV-UHFFFAOYSA-N 474.511 5.541 5 20 JKBD Cc1ccc(C(=O)NCC(F)(F)F)cc1NC(=O)c1cc([N+](=O)[O-])ccc1Sc1ccccc1 603774355 MPHCERLFTCMXLZ-UHFFFAOYSA-N 489.475 5.599 5 20 JKBD CC1CCN(c2ccc(C(=O)Nc3ccc(Sc4nncs4)cc3)cc2[N+](=O)[O-])CC1 604119517 VIQRKBHWGBAFMH-UHFFFAOYSA-N 455.565 5.086 5 20 JKBD COc1ccc([C@H](NC(=O)c2ccc(N[C@H](C)c3ccccn3)c([N+](=O)[O-])c2)c2ccccc2)cc1 604296274 MTLPAQPHLAFMJM-XHCCPWGMSA-N 482.540 5.691 5 20 JKBD CC[C@@H](C)NC(=O)c1ccc(NC(=O)c2ccccc2C(=O)c2ccc(SC)c([N+](=O)[O-])c2)cc1 604312016 BOBWDNWTGMCEHM-MRXNPFEDSA-N 491.569 5.328 5 20 JKBD CCOCc1cccc(NC(=O)C2CCN(c3ccc(C(F)(F)F)cc3[N+](=O)[O-])CC2)c1 608807729 WBMXXMKEVPTKDA-UHFFFAOYSA-N 451.445 5.005 5 20 JKBD COc1ccc(CN[C@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2ccccc2)c(C(F)(F)F)c1 608834647 LTKZYIMAVRLYGF-NRFANRHFSA-N 493.869 5.745 5 20 JKBD COc1ccc(OC)c([C@H](C)NCc2ccc(-c3ccc([N+](=O)[O-])cc3Br)o2)c1 608835433 CSALSJBNJTWUGJ-ZDUSSCGKSA-N 461.312 5.485 5 20 JKBD CCN(C(=O)c1ccc(N2CCCC2)c([N+](=O)[O-])c1)[C@H](c1cccnc1)c1ccc(F)c(C)c1 609155766 UYXJVEPVXYKEEJ-VWLOTQADSA-N 462.525 5.289 5 20 JKBD CC(C)c1noc2nc(-c3ccco3)cc(C(=O)Nc3cc(-c4cccc([N+](=O)[O-])c4)[nH]n3)c12 609201954 BLVSKYLTPLUJNJ-UHFFFAOYSA-N 458.434 5.157 5 20 JKBD O=C(CCN1CCN(c2ccc([N+](=O)[O-])cc2C(F)(F)F)CC1)Nc1c(Cl)cccc1Cl 727438473 YKRIDZSLZZYFHA-UHFFFAOYSA-N 491.297 5.071 5 20 JKBD COc1ccc(-c2nc(C)c(C(=O)N(CC3CC3)c3ccc(Cl)c([N+](=O)[O-])c3)s2)cc1OC 728166042 UUTUVKVBKKZUIP-UHFFFAOYSA-N 487.965 5.754 5 20 JKBD O=C(OCc1nnc(-c2ccco2)o1)c1ccc(Sc2nc3ccccc3s2)c([N+](=O)[O-])c1 745937448 RGSVDSQIRRSZMK-UHFFFAOYSA-N 480.483 5.356 5 20 JKBD CC[C@H](C)Sc1ccc(NC(=O)[C@H]2CC(=O)N(c3ccc(F)c([N+](=O)[O-])c3)C2)c(C(F)(F)F)c1 748656384 GUMKFJXHLQQALU-STQMWFEESA-N 499.486 5.635 5 20 JKBD O=C(Nc1ccccc1)Nc1cccc(NC(=O)c2cc([N+](=O)[O-])ccc2Br)c1 750603342 LDMNDHWBAUAJIE-UHFFFAOYSA-N 455.268 5.254 5 20 JKBD Cc1ccc(C(=O)c2ccccc2C(=O)O[C@@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)cc1C 800441346 NQSMUBIBBPWGHX-INIZCTEOSA-N 480.904 5.280 5 20 JKBD CC(C)c1ccc(-c2nc(C(=O)O[C@H](C)C(=O)Nc3cc([N+](=O)[O-])ccc3Cl)cs2)cc1 900232405 WBWUEVFEHXAKFW-CYBMUJFWSA-N 473.938 5.679 5 20 JKBD O=[N+]([O-])c1ccc(C(F)(F)F)cc1-c1nc(-c2ccc(-n3cnc4ccccc43)nc2)no1 904489233 NRTPRHJLHSOXLH-UHFFFAOYSA-N 452.352 5.065 5 20 JKBD CCC(CC)c1cc[n+](/C(C(=S)N[C@@H]2C[C@H]3CC[C@H]2C3)=C(/O)c2ccc([N+](=O)[O-])cc2)cc1 912843157 JPTOXYWVOGMOSG-JWNTYJGQSA-O 466.627 5.775 5 20 JKBD Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)c1ccccc1SCC(=O)NC1CCCCCCC1 913419046 HSAVFNDDVIJEJO-UHFFFAOYSA-N 469.607 5.785 5 20 JKBD Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)c1ccc(C(=O)Nc2cc([N+](=O)[O-])c(C)cc2C)s1 915827761 HECRRFCQLXNGQW-UHFFFAOYSA-N 468.491 5.303 5 20 JKBD CC(=O)N(c1ccc(Cl)cc1)c1nc(/C=C(\Cl)c2nc3cc([N+](=O)[O-])ccc3[nH]2)cs1 917559517 KVZOKKDMTDDEJU-PXNMLYILSA-N 474.329 6.003 5 20 JKBD O=C(Nc1nc(Cc2ccc(Br)cc2)cs1)c1ccc([N+](=O)[O-])cc1Cl 917714498 SDOVEVTUBOHDPA-UHFFFAOYSA-N 452.717 5.310 5 20 JKBD O=C(Cc1ccc([N+](=O)[O-])cc1F)Nc1ccc(C2(NC(=O)c3cc4ccsc4[nH]3)CCC2)cc1 1791183936 RKAYNDSVTFOQGJ-UHFFFAOYSA-N 492.532 5.267 5 20 JKBD CCc1ncccc1C(=O)NC1(c2ccc(NC(=O)CSc3ccccc3[N+](=O)[O-])cc2)CCC1 1791521467 LDGOSJZTUPWMPT-UHFFFAOYSA-N 490.585 5.092 5 20 JKBD Cc1cc(CCCC(=O)NC2(c3ccc(NC(=O)C4=COCCC4)cc3)CCC2)c([N+](=O)[O-])cc1F 1791637219 MPXWTLZTJPXYNR-UHFFFAOYSA-N 495.551 5.193 5 20 JKBD Cc1ccc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cc4cc([N+](=O)[O-])ccc4s2)C3)c(Cl)c1 1803630467 WMUNDFFCJIMOJG-BJWYYQGGSA-N 483.977 5.337 5 20 JKBD O=C(c1cc2cc([N+](=O)[O-])ccc2s1)N1CCC([C@H]2CCCCN2C(=O)CCc2ccc[nH]2)CC1 1827109877 PNVREGCIDJNJTP-JOCHJYFZSA-N 494.617 5.004 5 20 JKBD Cc1c(C(=O)N2CCC([C@@H]3CCCCN3C(=O)c3ccc(Cl)o3)CC2)cc(Cl)cc1[N+](=O)[O-] 1827984465 FSTJPDDABNTGDZ-SFHVURJKSA-N 494.375 5.350 5 20 JKBD CC(C)(C)CC(=O)N1CCC([C@H]2CCCCN2C(=O)c2ccc(Br)c([N+](=O)[O-])c2)CC1 1830523212 TVNPLTONWNDVAS-LJQANCHMSA-N 494.430 5.027 5 20 JKBD O=C(Cc1cc(F)ccc1[N+](=O)[O-])N1CCC([C@@H]2CCCCN2C(=O)c2ccccc2C2CC2)CC1 1832556829 FCOPLDHTVFACGP-VWLOTQADSA-N 493.579 5.087 5 20 JKBD CCn1c(SCC(=O)Nc2cc([N+](=O)[O-])ccc2F)nnc1-c1ccc(C(C)(C)C)cc1 10177542 RJSJCVVVDISWAD-UHFFFAOYSA-N 457.531 5.041 5 20 JKBD C[C@H](Sc1nnc(-c2ccccc2)n1-c1ccc(F)cc1F)C(=O)Nc1ccccc1[N+](=O)[O-] 10317133 WXNMIQHJSNHSDI-AWEZNQCLSA-N 481.484 5.240 5 20 JKBD CC(=O)N(c1cccc(Cl)c1)c1nc(CSc2nc3ccc([N+](=O)[O-])cc3s2)cs1 10592392 PBITYRQCHXJIDO-UHFFFAOYSA-N 476.992 6.291 5 20 JKBD O=C(OCc1csc(-c2ccccn2)n1)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 11213084 HAFAFFMXKHAZEC-UHFFFAOYSA-N 492.479 5.092 5 20 JKBD O=C(COC(=O)CC(c1ccccc1)c1ccccc1)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 11398947 YZMMBGHRODCGDV-UHFFFAOYSA-N 472.419 5.318 5 20 JKBD C[C@H](OC(=O)c1cc([N+](=O)[O-])ccc1NCc1ccccc1)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 16250742 LKOYJQWDRGXAPY-HNNXBMFYSA-N 489.444 5.083 5 20 JKBD Cc1ccc(CN[C@@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Br)c2ccccc2)cc1F 28623237 HAQBNAOXSBWGMW-OAQYLSRUSA-N 472.314 5.274 5 20 JKBD O=C(COC(=O)Cc1coc2ccc3ccccc3c12)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 28918319 IMSFDVLLNIVPDV-UHFFFAOYSA-N 472.375 5.237 5 20 JKBD CN(CCCCCc1cc(-c2cccc(F)c2)n[nH]1)C(=O)c1cc([N+](=O)[O-])ccc1N1CCCC1 108672754 WKFHBQMQJOINML-UHFFFAOYSA-N 479.556 5.209 5 20 JKBD O=C(Nc1nc(-c2ccc3c(c2)CCO3)cs1)c1csc(-c2ccc([N+](=O)[O-])cc2)n1 215710148 FCRCCWFZSSMKHW-UHFFFAOYSA-N 450.501 5.029 5 20 JKBD Cc1c(NC(=O)c2csc(-c3cccc([N+](=O)[O-])c3)n2)cccc1C(=O)Nc1ccccc1 216260752 BLZJMPBNCZWLSQ-UHFFFAOYSA-N 458.499 5.531 5 20 JKBD Cc1csc(Sc2ccc(C(=O)N3CC=C(c4ccc(F)cc4)CC3)cc2[N+](=O)[O-])n1 302844998 LZLOAQLUUQNDOR-UHFFFAOYSA-N 455.536 5.580 5 20 JKBD COc1cc(C(=O)N[C@@H]2CCCC[C@@H]2Cc2ccccc2)c([N+](=O)[O-])cc1OCc1cscn1 476725642 DQFQTUMFQRHJCI-WIYYLYMNSA-N 481.574 5.170 5 20 JKBD COc1ccc(CSCC(=O)Nc2c(C)cc(Br)cc2Cl)cc1[N+](=O)[O-] 488567024 JTLBOXWBZHBXSF-UHFFFAOYSA-N 459.749 5.200 5 20 JKBD O=C(Nc1ccccc1)Nc1cccc(NC(=O)c2csc(-c3cccc([N+](=O)[O-])c3)n2)c1 496374046 COQPQYQNPCUBEN-UHFFFAOYSA-N 459.487 5.615 5 20 JKBD COc1cc(CN[C@H](c2ccccc2)c2nccs2)c([N+](=O)[O-])cc1OCc1ccccc1 507914456 QFJXSCCZJVQPPE-XMMPIXPASA-N 461.543 5.518 5 20 JKBD CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)NCc1ccccc1-c1ccc(Cn2ccnc2)cc1 509519359 JNQBXCQACIROFL-UHFFFAOYSA-N 483.572 5.627 5 20 JKBD CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)NCC1(c2cccc(C(F)(F)F)c2)CCOCC1 509748413 ARYKKFGXSVCADW-UHFFFAOYSA-N 479.499 5.282 5 20 JKBD O=C(Cn1c2ccccc2c(=O)c2ccccc21)Nc1nc(-c2cccc(Br)c2)cs1 514490695 GBIFBAJITSCVEC-UHFFFAOYSA-N 490.382 5.679 5 20 JKBD C[C@@H]1C[C@@H](C)CN(Cc2ccccc2CN[C@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2C(F)(F)F)C1 515759505 MPYYVOFZFVIHPU-KZNAEPCWSA-N 492.542 5.208 5 20 JKBD C[C@H](Nc1ccc(C(=O)NCCOc2cccc(Cl)c2Cl)cc1[N+](=O)[O-])c1ccccn1 516635084 JHXFRALYSDBPOU-AWEZNQCLSA-N 475.332 5.279 5 20 JKBD Cc1ccc(C(C)C)c(Oc2ccc(CNCc3nccn3CC(F)(F)F)cc2[N+](=O)[O-])c1 517551251 HDLRKWQOYPGIND-UHFFFAOYSA-N 462.472 5.868 5 20 JKBD COc1ccc(-c2nn(-c3ccccc3)cc2CC(=O)Nc2cc([N+](=O)[O-])ccc2OC(F)F)cc1 518907580 VJTVYZPRPBFEQG-UHFFFAOYSA-N 494.454 5.239 5 20 JKBD CNc1ccc(C(=O)Nc2nc(-c3ccc(OC(F)F)cc3OC(F)F)cs2)cc1[N+](=O)[O-] 520315557 MQXKHVJNBWZYTB-UHFFFAOYSA-N 486.403 5.215 5 20 JKBD Cc1cccc(COc2ccc(NC(=O)[C@@H]3CCCN3C(=O)c3ccc([N+](=O)[O-])c(C)c3)c(C)c2)c1 520637859 LJYXWVQVBGVEEN-SANMLTNESA-N 487.556 5.342 5 20 JKBD Cc1nn(Cc2ccc(C(=O)Nc3ccccc3N(C)Cc3ccccc3)cc2)c(C)c1[N+](=O)[O-] 521525695 OKWYPPPAHWRPFU-UHFFFAOYSA-N 469.545 5.345 5 20 JKBD Cc1cc(Sc2ncccn2)ccc1NC(=O)CCNc1ccc(C(F)(F)F)cc1[N+](=O)[O-] 524031376 ABUFIOPEHQTWKN-UHFFFAOYSA-N 477.468 5.304 5 20 JKBD Cc1ccc(-c2csc(NC(=O)C3CCN(c4ccc(C(F)(F)F)cn4)CC3)n2)cc1[N+](=O)[O-] 590648033 FMCMGZRAASIBET-UHFFFAOYSA-N 491.495 5.296 5 20 JKBD CSc1ccc(-c2csc(NC(=O)C3CCN(c4ccccc4[N+](=O)[O-])CC3)n2)cc1 603451585 CYBAXNQPTUVIML-UHFFFAOYSA-N 454.577 5.295 5 20 JKBD C[C@@H](NC(=O)Cc1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1)c1c(F)cccc1F 603510332 OCTMGEXJCFTSAQ-MRXNPFEDSA-N 462.456 5.146 5 20 JKBD O=[N+]([O-])c1ccc(-c2nnc(CN3CCC(CCc4cccc(C(F)(F)F)c4)CC3)o2)cc1 603857717 SMRWFTVPSSWYLY-UHFFFAOYSA-N 460.456 5.508 5 20 JKBD COc1cccc(CC(=O)N2CCc3ccc(NC(=O)c4cc5cc([N+](=O)[O-])ccc5s4)cc32)c1 608944762 BAQVAYYFRFNYBJ-UHFFFAOYSA-N 487.537 5.202 5 20 JKBD CCOc1ccc(OC)cc1NC(=O)Cc1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1 609182599 UPEDCTUOELTZHF-UHFFFAOYSA-N 472.501 5.036 5 20 JKBD Cc1ccc(C(C)C)c(Oc2ccc(CNC3CCN(C(=O)CC(F)(F)F)CC3)cc2[N+](=O)[O-])c1 609223709 JYSQUZICQXCGGG-UHFFFAOYSA-N 493.526 5.852 5 20 JKBD C[C@@H](NC(=O)c1ccccc1Sc1ccc(C(F)(F)F)cc1[N+](=O)[O-])c1nnc2ccccn12 610428529 NJPCCUUVTSHBDK-CYBMUJFWSA-N 487.463 5.299 5 20 JKBD CCc1cccc2c(C(=O)[C@H](OC(=O)CCn3nc(C)c([N+](=O)[O-])c3C)c3ccccc3)c[nH]c12 726646889 FZIPQKYUSATBIE-AREMUKBSSA-N 474.517 5.009 5 20 JKBD O=C(CSCc1nc(O)c2c(-c3ccccc3)csc2n1)Nc1ccc([N+](=O)[O-])c(Cl)c1 727711881 NYPVQXOEPUSQOO-UHFFFAOYSA-N 486.962 5.497 5 20 JKBD COc1ccc(NC(=O)CCC(=O)c2ccc3ccc4cccc5ccc2c3c45)cc1NC(C)=O 727766176 SKQIRNIGOTZEPW-UHFFFAOYSA-N 464.521 6.153 5 20 JKBD O=C(Nc1nc2ccccc2n1Cc1cccc(C(F)(F)F)c1)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1 727998707 FJOMRKQHLGHOBN-UHFFFAOYSA-N 485.378 5.172 5 20 JKBD CC(C)N(Cc1nnc(-c2cccc([N+](=O)[O-])c2)o1)C(=O)[C@@H]1C[C@@H]1c1ccc2ccccc2c1 731163852 BLOMCWVCTVKNJF-DHIUTWEWSA-N 456.502 5.339 5 20 JKBD O=C(Cn1ncc2ccc([N+](=O)[O-])cc21)Nc1cccc(NC(=O)Nc2cccc3c2CCCC3)c1 731337239 YJKZIXNDQQWHFR-UHFFFAOYSA-N 484.516 5.106 5 20 JKBD O=C(Nc1nc2c(s1)C[C@@H](c1ccccc1)CC2)c1cc([N+](=O)[O-])ccc1Br 751110143 ZUTTUDVRXIIARW-ZDUSSCGKSA-N 458.337 5.339 5 20 JKBD O=C(Nc1ccc(Cl)c(C(=O)NC2CCCCC2)c1)c1ccc(Br)c([N+](=O)[O-])c1 917874755 QFVVYTBOVNSYSY-UHFFFAOYSA-N 480.746 5.326 5 20 JKBD CSc1ccc(C(=O)OCC(=O)N2CCC[C@@H]2c2ccc(Cl)c(Cl)c2)cc1[N+](=O)[O-] 918816367 QIDNNGSPHXAFNU-MRXNPFEDSA-N 469.346 5.144 5 20 JKBD C[C@@H](Nc1ccc(C(=O)O[C@H](C)c2nnc(-c3ccccc3)o2)cc1[N+](=O)[O-])c1ccccn1 920545476 RQSGIESUAVCMQO-HZPDHXFCSA-N 459.462 5.131 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)NC1(c2ccc(NC(=O)c3cnn(C(C)(C)C)c3)cc2)CCC1 1787071092 CACMEXPDRLFBEE-UHFFFAOYSA-N 493.539 5.055 5 20 JKBD O=C(NC1(c2ccc(NC(=O)c3cc4c(Cl)cncc4s3)cc2)CCC1)c1ccc([N+](=O)[O-])[nH]1 1788311988 FVKXOUXDVJNWRB-UHFFFAOYSA-N 495.948 5.248 5 20 JKBD C/C(=C\c1ccc(C)o1)C(=O)Nc1ccc(C2(NC(=O)Cc3ccc([N+](=O)[O-])cc3F)CCC2)cc1 1789585104 AQSWAGFPLGTTND-SAPNQHFASA-N 491.519 5.415 5 20 JKBD O=C(C[C@H]1C[C@@H]2CC[C@H]1C2)Nc1ccc(C2(NC(=O)c3ccc([N+](=O)[O-])cc3F)CCC2)cc1 1791323532 IVMPZSGCYXOFGB-FGTMMUONSA-N 465.525 5.308 5 20 JKBD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc(F)c1[N+](=O)[O-])c1sc2ccccc2c1Cl 1800529076 JJPLCWLXOQPWMM-BTTYYORXSA-N 487.940 5.168 5 20 JKBD CCC[C@H]1CC[C@H](C(=O)NC[C@@H]2CCN(C(=O)c3cccc(F)c3[N+](=O)[O-])[C@H]2c2cccnc2)CC1 1812789708 MTTFXTWLGBTDGY-RSKVWTTASA-N 496.583 5.055 5 20 JKBD C[C@@H](C(=O)Nc1cc([C@H]2CCCCN2C(=O)/C=C/c2ccc([N+](=O)[O-])o2)[nH]n1)c1ccc(Cl)cc1 1814656531 XCNOGSGQTKOXHZ-NEWQJLAGSA-N 497.939 5.074 5 20 JKBD Cc1c(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)c3ccc(F)s3)n[nH]2)cc(Cl)cc1[N+](=O)[O-] 1816029413 NIXIOUQFMIPDHF-OAHLLOKOSA-N 491.932 5.100 5 20 JKBD CC(C)c1ccc(C(=O)Nc2cc([C@H]3CCCCN3C(=O)Cc3cc(F)ccc3[N+](=O)[O-])[nH]n2)cc1 1820593760 JSRZBELIFDWNPX-HSZRJFAPSA-N 493.539 5.129 5 20 JKBD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)[nH]n1)C1CC2(CCC2)C1 1823055756 IHXSTBZJPUASBD-IBGZPJMESA-N 493.589 5.419 5 20 JKBD Cc1ccc(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3cccc(F)c3[N+](=O)[O-])CC2)cc1Cl 1823909604 DOFQKWMKBCHFPJ-JOCHJYFZSA-N 487.959 5.243 5 20 JKBD O=C(Cc1cccc([N+](=O)[O-])c1)N1CCC([C@@H]2CCCCN2C(=O)[C@@H]2CCC[C@@H]3CCCC[C@@H]32)CC1 1828455356 AAEQRBVXVGAIRN-IXDWGBGWSA-N 495.664 5.364 5 20 JKBD Cc1ccc(Nc2nnc(S[C@@H](C)C(=O)Nc3ccc([N+](=O)[O-])cc3C(F)(F)F)s2)cc1 10317377 ROGHWONODLYJTM-NSHDSACASA-N 483.497 5.636 5 20 JKBD CC(=O)N(c1nc(COC(=O)c2cc([N+](=O)[O-])ccc2Cl)cs1)c1c(C)cc(C)cc1C 10665555 KXMXOXUITKZSCW-UHFFFAOYSA-N 473.938 5.672 5 20 JKBD Nc1cc(C(=O)O[C@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2ccccc2)ccc1Cl 10874541 JVGFWSFIOBWHJD-IBGZPJMESA-N 460.273 5.021 5 20 JKBD C[C@H](OC(=O)CCc1ncc(-c2ccc(Cl)cc2Cl)o1)C(=O)Nc1cccc([N+](=O)[O-])c1 12271904 BQHHQMJMKJGOHX-LBPRGKRZSA-N 478.288 5.060 5 20 JKBD Cc1ccc(NC(=O)c2cc(Cl)ccc2[N+](=O)[O-])cc1S(=O)(=O)Nc1ccccc1Cl 16066000 GKGREAOMGWDTCI-UHFFFAOYSA-N 480.329 5.263 5 20 JKBD Cc1ccc(-c2cc(C(=O)O[C@@H](C)c3nnc(-c4ccc([N+](=O)[O-])cc4)o3)c3ccccc3n2)o1 17654378 PEEDPODSILMDPV-HNNXBMFYSA-N 470.441 5.679 5 20 JKBD O=C(COC(=O)CCC(=O)c1ccc(-c2ccccc2)cc1)Nc1cc([N+](=O)[O-])ccc1Cl 18958960 MUQMPTRCWHZMPP-UHFFFAOYSA-N 466.877 5.060 5 20 JKBD O=[N+]([O-])c1cccc(-c2noc(CSc3nnc(Nc4cccc(Br)c4)s3)n2)c1 31849060 AFDORWBPEGSEHW-UHFFFAOYSA-N 491.352 5.295 5 20 JKBD C[C@@H](Sc1nnc(-c2cccs2)n1Cc1ccccc1)C(=O)Nc1ccccc1[N+](=O)[O-] 45222531 YQOJNZKMVWDCSY-OAHLLOKOSA-N 465.560 5.082 5 20 JKBD CCOc1ccc([C@H](NC(=O)Cn2c3ccccc3c(=O)c3ccccc32)C(C)C)cc1OCC 58537704 UCANFQXMLQYJFY-MUUNZHRXSA-N 472.585 5.466 5 20 JKBD CC[C@H](C(=O)N1CCC(NC(=O)c2cc([N+](=O)[O-])ccc2Oc2ccccc2)CC1)c1ccccc1 72056931 OTBHFSDNXZFCHE-DEOSSOPVSA-N 487.556 5.302 5 20 JKBD CCOc1cc2c(cc1NC(=O)C1CCN(c3ccc(C(F)(F)F)cc3[N+](=O)[O-])CC1)O[C@H](C)C2 302863389 BLHAKICKSNHTEW-CQSZACIVSA-N 493.482 5.191 5 20 JKBD O=[N+]([O-])c1ccc(-c2noc(CSc3nnc(-c4ccccc4)n3-c3ccccc3)n2)cc1 302924874 BZRYQZAEPHNOAT-UHFFFAOYSA-N 456.487 5.185 5 20 JKBD C[C@@H](Nc1ccc(C(=O)Nc2ccc(-c3cn4c(n3)CCCC4)cc2)cc1[N+](=O)[O-])c1ccccn1 410076015 WFEKHSMQYVSBKP-GOSISDBHSA-N 482.544 5.615 5 20 JKBD O=C(N[C@H]1CCN2CCCC[C@@H]12)c1ccccc1Sc1ccc(C(F)(F)F)cc1[N+](=O)[O-] 481415617 PAPBQUMPMOMLNJ-IRXDYDNUSA-N 465.497 5.121 5 20 JKBD C[C@H](NC(=O)c1cn(C)nc1-c1ccc([N+](=O)[O-])cc1)c1ccc(OCc2ccc(F)cc2)cc1 485570047 PWOWLJBFITYCDZ-KRWDZBQOSA-N 474.492 5.204 5 20 JKBD CN(C)c1ccc(C(=O)c2ccccc2C(=O)Nc2ccc(-c3nccs3)cc2)cc1[N+](=O)[O-] 488722500 FVHPWYYYMNQWMH-UHFFFAOYSA-N 472.526 5.268 5 20 JKBD O=C(COc1ccc(-c2ccccc2)cc1[N+](=O)[O-])Nc1ccc(NC(=O)c2cccs2)cc1 504307732 SWTQPFOILXUDKX-UHFFFAOYSA-N 473.510 5.593 5 20 JKBD COc1ccc(Br)cc1[C@@H]1CCCN1C(=O)[C@@H](C)Sc1ccc([N+](=O)[O-])cc1 504857095 JIDRBNXHXUTNAX-ACJLOTCBSA-N 465.369 5.210 5 20 JKBD COc1ccc(Br)cc1[C@@H]1CCCN1C(=O)[C@H](C)Oc1ccc(Cl)cc1[N+](=O)[O-] 504877106 RTPAOJLKTAWFBA-LRDDRELGSA-N 483.746 5.150 5 20 JKBD O=C(Nc1ncc(Cc2cccc(Br)c2)s1)c1ccc(Cl)cc1[N+](=O)[O-] 505391844 LKKIOVCSSWHKPH-UHFFFAOYSA-N 452.717 5.310 5 20 JKBD CN(CCCCCc1cc(-c2ccccc2)no1)C(=O)c1csc(-c2cccc([N+](=O)[O-])c2)n1 506522422 ILTNIWYUJDNDOW-UHFFFAOYSA-N 476.558 5.858 5 20 JKBD COc1cc(C(=O)N(C)Cc2ccccc2[N+](=O)[O-])ccc1OCc1ccc(Br)cc1 514559589 VIOKNJFKYHTPBO-UHFFFAOYSA-N 485.334 5.217 5 20 JKBD COc1cc(C(=O)Nc2nc(-c3cccnc3)cs2)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 514616927 CXELKONGTIBGMI-UHFFFAOYSA-N 482.905 5.820 5 20 JKBD CN(C(=O)c1ccc(NC(=O)c2ccc([N+](=O)[O-])cc2Cl)cc1Cl)C1CCCCC1 515613413 YWYHARBSPDEPTN-UHFFFAOYSA-N 450.322 5.559 5 20 JKBD COc1ccc(CNCc2nc3cc(Cl)ccc3s2)cc1OCc1ccc([N+](=O)[O-])cc1 517549272 AWMKWHCCDNKABU-UHFFFAOYSA-N 469.950 5.735 5 20 JKBD CN(CCCCCc1cc(-c2cccc(F)c2)no1)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl 519896192 CQRLSFINDRFIAK-UHFFFAOYSA-N 460.893 5.919 5 20 JKBD Cc1sc(NC(=O)c2cc(Cl)ccc2I)nc1-c1cccc([N+](=O)[O-])c1 603997467 JRTHECCVZHGZTG-UHFFFAOYSA-N 499.717 5.537 5 20 JKBD Cc1ccc(CN[C@@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Br)c2ccccc2)c(C)c1 604045914 KBLGCDAEAUKQMY-JOCHJYFZSA-N 468.351 5.444 5 20 JKBD O=C(C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)NCc1cc(-c2ccccc2)no1 604113757 FOJPWCKETAKJMT-XSFVSMFZSA-N 496.548 6.107 5 20 JKBD Cc1ccc(C(=O)C2CCN(C(=O)c3ccc(Sc4nc(C)cs4)c([N+](=O)[O-])c3)CC2)cc1 604187238 CFFVXYVYHGXYFD-UHFFFAOYSA-N 481.599 5.554 5 20 JKBD O=[N+]([O-])c1ccc(-c2nn(-c3ccccc3)cc2CNCc2ccnc(OCC(F)(F)F)c2)cc1 608836324 IXYRWISLZHGREM-UHFFFAOYSA-N 483.450 5.073 5 20 JKBD C[C@H](NCc1ccc(-c2ccc([N+](=O)[O-])cc2Br)o1)c1cccc(N2CCCC2=O)c1 608836412 FQLCIRNBPHKPRU-HNNXBMFYSA-N 484.350 5.595 5 20 JKBD C[C@@H](Nc1ccc(C(=O)Nc2ccc(-c3nc4ccccc4n3C)cc2)cc1[N+](=O)[O-])c1ccccn1 608954676 UFMWUSDNDFLWAN-GOSISDBHSA-N 492.539 5.969 5 20 JKBD COC(=O)c1cc(Oc2ccccc2)ccc1NC(=O)c1cc(SC)c(OC)cc1[N+](=O)[O-] 609126861 RKSPGKKTYBLHGV-UHFFFAOYSA-N 468.487 5.157 5 20 JKBD Cc1ccc(C(=O)Nc2ccc(OC(=O)c3csc(-c4cccc([N+](=O)[O-])c4)n3)cc2)cc1 726960386 JLJSROUYZMAPCX-UHFFFAOYSA-N 459.483 5.498 5 20 JKBD CCNC(=O)c1cccc(CNC(=O)CCC(=O)c2ccc3ccc4cccc5ccc2c3c45)c1 727768548 IMOKSFUVWXUJLD-UHFFFAOYSA-N 462.549 5.613 5 20 JKBD Cc1nc(-c2ccc(F)cc2)sc1C(=O)N(Cc1nnc(-c2cccc([N+](=O)[O-])c2)o1)C(C)C 744001408 GZLKAYQHXBLSOM-UHFFFAOYSA-N 481.509 5.267 5 20 JKBD C[C@H](OC(=O)c1cnc(-c2ccccc2Cl)s1)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 747954302 ZUGLMCRVSBPCES-JTQLQIEISA-N 499.854 5.575 5 20 JKBD O=C(O[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1)c1csc(-c2ccccn2)n1 749411963 OUFJOECNXLUPHF-HXUWFJFHSA-N 494.916 5.304 5 20 JKBD Cc1csc(Sc2ccc(C(=O)Oc3cccc(Oc4ncccn4)c3)cc2[N+](=O)[O-])n1 751193178 BFSWNLFELUUQSG-UHFFFAOYSA-N 466.500 5.312 5 20 JKBD COc1ccc([N+](=O)[O-])cc1NC(=O)[C@@H](C)OC(=O)Cc1c(C)nc2ccccc2c1-c1ccccc1 800367635 JASUCTCKUCZBIL-GOSISDBHSA-N 499.523 5.240 5 20 JKBD O=C1C[C@H](C(=O)N(c2ccccc2)c2nc3ccccc3s2)CN1c1ccc(F)c([N+](=O)[O-])c1 913126110 JAFBBLZJGGSIKA-HNNXBMFYSA-N 476.489 5.061 5 20 JKBD CC(=O)N(c1nc(COC(=O)CCOc2cc(C)ccc2[N+](=O)[O-])cs1)c1ccc(C)cc1C 915439666 FPTRSDQEPIZSCF-UHFFFAOYSA-N 483.546 5.173 5 20 JKBD Cc1ccc(-n2nc(C)c(CC(=O)O[C@@H](C)c3nnc(-c4ccc([N+](=O)[O-])cc4)o3)c2C)cc1Cl 915531664 LSNCDVARURQYIS-INIZCTEOSA-N 495.923 5.256 5 20 JKBD C[C@H](OC(=O)c1cnc(-c2ccccc2)s1)C(=O)Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1 915549708 JLNVINRDJVPZHZ-ZDUSSCGKSA-N 480.527 5.026 5 20 JKBD CC1=C(C(=O)Nc2ccccc2C)[C@@H](c2ccc([N+](=O)[O-])cc2)NC(=S)N1c1ccccc1 916162279 NAKHIONEETWNAA-HSZRJFAPSA-N 458.543 5.252 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Cl)[C@@H](OC(=O)[C@@H]1CCC[C@@H](C(F)(F)F)C1)c1ccccc1 917286055 RWNDVEZRIVSEHX-CLCXKQKWSA-N 484.858 5.840 5 20 JKBD CCOc1cc(NC(=S)Nc2ccc([N+](=O)[O-])cc2)c(OCC)cc1NC(=O)c1ccccc1 918721482 KMHJWGVPUNUQOW-UHFFFAOYSA-N 480.546 5.453 5 20 JKBD COc1cc2c(cc1OC)CN(Cc1ccccc1NC(=O)c1cc(Cl)ccc1[N+](=O)[O-])CC2 921284198 CUUAWNJEURRPGE-UHFFFAOYSA-N 481.936 5.076 5 20 JKBD O=C(Cc1cccc([N+](=O)[O-])c1)Nc1ccc(C2(NC(=O)c3cc(-c4ccccc4)no3)CCC2)cc1 1785793578 IUEVNOAZEBSGRB-UHFFFAOYSA-N 496.523 5.240 5 20 JKBD O=C(Cc1ccc(Cl)cc1[N+](=O)[O-])Nc1ccc(C2(NC(=O)c3ccnc(Cl)c3)CCC2)cc1 1786116606 VZPSHNIVHBFGKO-UHFFFAOYSA-N 499.354 5.287 5 20 JKBD COc1ccc(C(=O)NC2(c3ccc(NC(=O)c4cc(C)c([N+](=O)[O-])cn4)cc3)CCC2)cc1Cl 1788767219 CCKGUMNICVRTTB-UHFFFAOYSA-N 494.935 5.022 5 20 JKBD Cc1ccc2[nH]c(C(=O)NC3(c4ccc(NC(=O)c5cc(O)cc([N+](=O)[O-])c5)cc4)CCC3)cc2c1 1790755970 KEDGRTJBOVRHOS-UHFFFAOYSA-N 484.512 5.152 5 20 JKBD CC1=CC[C@H](C(=O)NC2(c3ccc(NC(=O)c4cc([N+](=O)[O-])ccc4N(C)C)cc3)CCC2)CC1 1790794189 JELDBBNYCJEWJZ-IBGZPJMESA-N 476.577 5.155 5 20 JKBD COc1cc(C(=O)Nc2ccc(C3(NC(=O)C(C)(C)C(C)(F)F)CCC3)cc2)ccc1[N+](=O)[O-] 1792164020 RLUDFUNGHVQGDO-UHFFFAOYSA-N 475.492 5.033 5 20 JKBD Cc1cc(F)c(C(=O)N2CCC([C@@H]3CCCCN3C(=O)CCc3cccc([N+](=O)[O-])c3)CC2)cc1F 1824841862 CJOKHQVLFUMZHA-VWLOTQADSA-N 499.558 5.048 5 20 JKBD COCCN(C(=O)c1sc(-c2ccc(F)cc2)nc1C)c1nc(-c2ccc([N+](=O)[O-])cc2)cs1 17346250 VPJPCTKGQLGMAM-UHFFFAOYSA-N 498.561 5.583 5 20 JKBD C[C@@H](c1ccc(-n2cncn2)cc1)N(C)C(=O)c1cc([N+](=O)[O-])ccc1Sc1ccccc1 25918537 MZHVQXAVWSAKMB-KRWDZBQOSA-N 459.531 5.160 5 20 JKBD O=C(CCSc1nnc(-c2ccc(F)cc2)n1-c1ccccc1)Nc1ccccc1[N+](=O)[O-] 26368886 DKMSAQCXQXPTFY-UHFFFAOYSA-N 463.494 5.103 5 20 JKBD COc1ccc(CSc2nn(CN(C)Cc3cc([N+](=O)[O-])ccc3Cl)c(=S)s2)cc1 27533636 RKLMLMFPIRVNMF-UHFFFAOYSA-N 483.040 5.626 5 20 JKBD O=C(NC[C@@H]1CCCO[C@H]1c1ccccc1)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1 409556260 WBJSVZOOTQKUKR-CYFREDJKSA-N 466.921 5.938 5 20 JKBD Cc1cccc(OC(F)F)c1NC(=O)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 486613280 ADTCWCPUCISAEF-UHFFFAOYSA-N 473.398 5.379 5 20 JKBD O=C(Nc1ccc(NC(=O)N2CCCCCC2)cc1)c1ccc(NCc2ccccc2)c([N+](=O)[O-])c1 498516770 YMJSKROXDQMLPS-UHFFFAOYSA-N 487.560 5.867 5 20 JKBD C[C@H]1Cc2cc([N+](=O)[O-])ccc2N1C(=O)Cc1csc(-c2cccc(Br)c2)n1 504318359 LYCWXJWENFZLKQ-LBPRGKRZSA-N 458.337 5.001 5 20 JKBD CC(C)c1ccc(NC(=O)c2ccc([N+](=O)[O-])cc2I)c(C(C)C)c1 508925229 GTYIBUVENGNRQL-UHFFFAOYSA-N 452.292 5.699 5 20 JKBD Cc1noc([C@@H](C)NC(=O)c2c3c(nc4ccccc24)/C(=C\c2cccc([N+](=O)[O-])c2)CCC3)n1 509111146 HLTHUZHMPBGFBK-QLENYVDCSA-N 469.501 5.202 5 20 JKBD O=C(c1c(Cl)cccc1Cl)N1CCN(C(=O)c2cc3ccccc3c3cccnc23)CC1 517098964 HFRKOHKOYVETAT-UHFFFAOYSA-N 464.352 5.293 5 20 JKBD C[C@H](SCC(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F)c1ccc(OC(F)(F)F)cc1 520472378 OCKCPFZSTFGQLO-JTQLQIEISA-N 468.375 5.945 5 20 JKBD COc1ccc([C@H](Cc2ccccc2C)NC(=O)c2cc(SC)ccc2[N+](=O)[O-])cc1OC 520747069 SWCDIJZPOVJNND-NRFANRHFSA-N 466.559 5.356 5 20 JKBD COc1cc(CNCc2cc(Cl)c3c(c2)OCCCO3)c([N+](=O)[O-])cc1OCc1ccccc1 520953791 XRMKEZXJYFFHOY-UHFFFAOYSA-N 484.936 5.287 5 20 JKBD CC(C)Oc1ccc(NC(=O)Cn2c3ccccc3c(=O)c3ccccc32)c(C(F)(F)F)c1 521526407 OKYHHJRTHZASNV-UHFFFAOYSA-N 454.448 5.599 5 20 JKBD COCCN(C(=O)CCc1cccc(Br)c1)c1nc(-c2ccc([N+](=O)[O-])cc2)cs1 603461287 LEOCTEWKBYXVLE-UHFFFAOYSA-N 490.379 5.093 5 20 JKBD CC(C)C(=O)Nc1cccc(NC(=O)c2ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])cc2)c1 603570575 UGSKCYHBDFGGGN-UHFFFAOYSA-N 453.882 5.887 5 20 JKBD O=C(c1ccc(N2CCCC2)c([N+](=O)[O-])c1)N1CCC(c2nc3cc(Cl)ccc3o2)CC1 603921645 BZDMOCHSDVUISS-UHFFFAOYSA-N 454.914 5.009 5 20 JKBD Cn1c(=O)oc2ccc(NC(=O)c3ccc(Sc4nc5ccccc5s4)c([N+](=O)[O-])c3)cc21 608808403 HLFCFZWFVHNINP-UHFFFAOYSA-N 478.511 5.053 5 20 JKBD C[C@H]1C[C@H](C)CN(c2ccc(C(=O)N3CCC(c4nc(-c5ccccc5)no4)CC3)cc2[N+](=O)[O-])C1 609141891 PCOVCPCGOIALBB-OALUTQOASA-N 489.576 5.147 5 20 JKBD C[C@@H](OC(=O)[C@H](OC1CCCC1)c1ccccc1)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 727017376 PETPAUQWAIIUFO-JLTOFOAXSA-N 480.439 5.184 5 20 JKBD C[C@H](OC(=O)[C@@H]1C[C@H]1c1cccc2ccccc12)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 730872151 CBANBQYAIFJZCR-FASAQXTFSA-N 472.419 5.441 5 20 JKBD Cc1nnc([C@H](C)OC(=O)C/C(=C/c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)o1 744497878 RVEAKSCNQUJMKG-RERGGYADSA-N 450.476 5.131 5 20 JKBD O=C(Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1)c1csc(-c2cccc([N+](=O)[O-])c2)n1 747622885 AFOKWNXEEVQFDL-UHFFFAOYSA-N 453.461 5.002 5 20 JKBD Cc1c(C(=O)Nc2ccc(NC(=O)c3ccc(Cl)cc3)cc2)cc([N+](=O)[O-])c(C)c1[N+](=O)[O-] 748630488 LPWNQLTZMAZVEB-UHFFFAOYSA-N 468.853 5.278 5 20 JKBD COc1ccccc1C1(C(=O)Oc2ccc3c(-c4ccc([N+](=O)[O-])cc4)cc(=O)oc3c2)CC1 749114277 RHYRIHRBRVJBTB-UHFFFAOYSA-N 457.438 5.014 5 20 JKBD Cc1nn(Cc2ccccc2Cl)c(Cl)c1C(=O)Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1 871590343 NMFUPXFHPAIZKC-UHFFFAOYSA-N 488.356 5.831 5 20 JKBD COc1ccc(NC(=O)[C@@H](C)OC(=O)c2sc(-c3ccco3)nc2-c2ccccc2)c([N+](=O)[O-])c1 900284496 OUMDFOAPZHSWAQ-CQSZACIVSA-N 493.497 5.171 5 20 JKBD COC1(c2noc(-c3ccc(Sc4nc5ccccc5s4)c([N+](=O)[O-])c3)n2)CCOCC1 904816168 IAEOEOQOLWDZSS-UHFFFAOYSA-N 470.532 5.058 5 20 JKBD CC(C)c1c(C(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)cnn1-c1ccc(C(F)(F)F)cn1 915139145 PHVURHGCTRKNLQ-UHFFFAOYSA-N 453.808 5.223 5 20 JKBD CC(C)n1ncc2c(C(=O)OCC(=O)Nc3ccc(Cl)cc3[N+](=O)[O-])cc(-c3ccccc3)nc21 916533305 QFDGFFZRGLPBHV-UHFFFAOYSA-N 493.907 5.036 5 20 JKBD CC1=C(C(=O)Nc2cc(C)on2)[C@@H](c2ccc([N+](=O)[O-])cc2)NC(=S)N1c1cccc(C(C)C)c1 918135261 MNEQSCICZZBOQQ-HSZRJFAPSA-N 491.573 5.363 5 20 JKBD C[C@@H]1CN(C(=O)C/C(=C\c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)Cc2ccccc21 922310751 UNGWFYMBXAWEPA-ALDSOSFCSA-N 469.566 6.281 5 20 JKBD COC(=O)/C=C/c1ccc(Sc2nnc(-c3c[nH]c4ccccc34)n2C2CC2)c([N+](=O)[O-])c1 931439222 MTSWQKFBDZMSOH-YRNVUSSQSA-N 461.503 5.007 5 20 JKBD CCn1nc(C)cc1C(=O)Nc1ccc(C2(NC(=O)c3cc(Cl)cc([N+](=O)[O-])c3C)CCC2)cc1 1788425540 ATDJVJVYVSSEGK-UHFFFAOYSA-N 495.967 5.143 5 20 JKBD CCOc1ccccc1C(=O)Nc1ccc(C2(NC(=O)c3ccc([N+](=O)[O-])cc3F)CCC2)cc1 1790240699 CFVBEZTZQGWOPW-UHFFFAOYSA-N 477.492 5.194 5 20 JKBD O=C(C[C@@H]1CCCCO1)NC1(c2ccc(NC(=O)C3(c4cccc([N+](=O)[O-])c4)CCC3)cc2)CCC1 1790475911 KQLZHYVUHMJGSD-DEOSSOPVSA-N 491.588 5.110 5 20 JKBD C[C@@H](Cc1ccco1)C(=O)NC1(c2ccc(NC(=O)CSc3ccccc3[N+](=O)[O-])cc2)CCC1 1791522885 DDSWVSZGUOBYMM-SFHVURJKSA-N 493.585 5.293 5 20 JKBD O=C(CSc1ccccc1[N+](=O)[O-])Nc1ccc(C2(NC(=O)c3ccccc3)CCC2)cc1 1791523907 ZSMPTBOSKDBOEC-UHFFFAOYSA-N 461.543 5.135 5 20 JKBD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(Cl)ccc1F)c1cc2cc([N+](=O)[O-])ccc2s1 1792779011 NTLQBCNNNSYFCQ-MUJYYYPQSA-N 487.940 5.168 5 20 JKBD O=C(/C=C/c1ccc([N+](=O)[O-])o1)Nc1cc([C@H]2CCCCN2C(=O)c2cc3sccc3s2)[nH]n1 1814967210 ARQSYEFGXRVPFS-CSPWOOARSA-N 497.558 5.206 5 20 JKBD CC[C@H](C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cc([N+](=O)[O-])c(O)cc2C)CC1)c1ccccc1 1826314275 AJZLVIFZDGNWEY-UPVQGACJSA-N 493.604 5.036 5 20 JKBD C[C@@H](Sc1nnc(-c2ccccc2Cl)n1C1CCCC1)C(=O)Nc1ccccc1[N+](=O)[O-] 8988905 YJVCFEVMDJWSAZ-CQSZACIVSA-N 471.970 5.741 5 20 JKBD CCOc1cc(C(=O)Nc2ncc(Cc3cc(Cl)ccc3Cl)s2)c([N+](=O)[O-])cc1OC 11521479 CYCSXIZBONKBSB-UHFFFAOYSA-N 482.345 5.609 5 20 JKBD COc1ccc(C[C@@H](N[C@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2ccc(OC)cc2)cc1 19670890 QUTDDTZYLANBID-VOIUYBSRSA-N 483.952 5.166 5 20 JKBD O=C([C@@H]1C[C@@H]1c1cccc(Br)c1)N(Cc1ccccc1[N+](=O)[O-])CC(F)(F)F 195747988 PFVPVTMVMPCTCI-HZPDHXFCSA-N 457.246 5.052 5 20 JKBD C[C@@H](Sc1nnc(-c2ccncc2)n1-c1ccc(Cl)cc1)C(=O)Nc1ccc([N+](=O)[O-])cc1 255936055 DSGQUDFOIONCTN-CQSZACIVSA-N 480.937 5.010 5 20 JKBD O=C(Nc1ccc(C(=O)N2CCc3ccccc32)cc1)c1csc(-c2cccc([N+](=O)[O-])c2)n1 302985298 DWGOMQYIUPQDKI-UHFFFAOYSA-N 470.510 5.174 5 20 JKBD Cc1sc(NC(=O)C2(c3ccccc3Cl)CCOCC2)nc1-c1cccc([N+](=O)[O-])c1 409814185 SPMXJHXQHPUQBR-UHFFFAOYSA-N 457.939 5.367 5 20 JKBD O=C(Nc1ccc(Cl)c(C(=O)NCc2ccccc2F)c1)c1ccc(NC2CC2)c([N+](=O)[O-])c1 484198605 ULIGRIOATLDAQU-UHFFFAOYSA-N 482.899 5.144 5 20 JKBD O=C(C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)NCCc1cn2ccccc2n1 485382365 JYOUDMKRKYIHPK-XDJHFCHBSA-N 483.553 5.142 5 20 JKBD COc1cc(C(=O)Nc2cccc(CO[C@@H]3CCC[C@@H](C)C3)c2)c([N+](=O)[O-])cc1OC(F)F 499196131 SOPMUICPZRNBSA-RHSMWYFYSA-N 464.465 5.552 5 20 JKBD O=C(Nc1nnc(-c2ccccn2)s1)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1 502893738 IGCHRXIGHHEUJX-UHFFFAOYSA-N 453.867 5.206 5 20 JKBD O=C(Nc1cccc(NC(=O)c2ccc(-n3ccnc3)c([N+](=O)[O-])c2)c1)c1cccc(C(F)(F)F)c1 504796231 KMNMLDLLVDWGLQ-UHFFFAOYSA-N 495.417 5.304 5 20 JKBD COc1ccc([C@H](NC(=O)c2ccc(Cn3nc(C)c([N+](=O)[O-])c3C)cc2)c2ccc(F)cc2)cc1 512752948 FYAFWJXFYSCRFN-RUZDIDTESA-N 488.519 5.124 5 20 JKBD CC(C)N(C)CC1CCN(C(=O)c2ccc(NCc3ccccc3Cl)c([N+](=O)[O-])c2)CC1 520420368 VNBCUIYVOMTBMN-UHFFFAOYSA-N 458.990 5.053 5 20 JKBD Cc1csc(Sc2ccc(C(=O)Nc3ccn(Cc4ccccc4)n3)cc2[N+](=O)[O-])n1 520697080 PDSKIHHUGPDQBP-UHFFFAOYSA-N 451.533 5.008 5 20 JKBD C[C@@H](Sc1n[nH]c(/C=C\c2ccccc2)n1)C(=O)Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1 598953242 NXLAKSOWCPXVGM-IWMPZKFUSA-N 478.559 5.126 5 20 JKBD COc1cc(C(=O)Nc2ccccc2-c2nnc(C)o2)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 603660036 UNEYORMIFJRHHW-UHFFFAOYSA-N 480.864 5.660 5 20 JKBD Cc1cc(Oc2ncccn2)ccc1NC(=O)CSc1ccc(C(F)(F)F)cc1[N+](=O)[O-] 604452307 IVFACSAZWUFHSX-UHFFFAOYSA-N 464.425 5.235 5 20 JKBD O=[N+]([O-])c1ccc(-c2ccc(CNCc3ccc(Br)s3)o2)c(Br)c1 608836621 ZDJXTCMXAXQGIH-UHFFFAOYSA-N 472.158 5.731 5 20 JKBD COCCN(Cc1cccnc1)C(=O)c1ccccc1Sc1ccc(C(F)(F)F)cc1[N+](=O)[O-] 609025838 OMQMYDCCDDJJOR-UHFFFAOYSA-N 491.491 5.449 5 20 JKBD Cc1nn(Cc2ccc(C(=O)Nc3ccc(OC(C)C)cc3C(F)(F)F)cc2)c(C)c1[N+](=O)[O-] 609188668 JPGOQDRLCVFWLZ-UHFFFAOYSA-N 476.455 5.515 5 20 JKBD COc1ccc(C)cc1NC(=O)[C@@H](OC(=O)c1c(Cl)cccc1[N+](=O)[O-])c1ccccc1 730644525 LOGKVTIEMBJKOF-NRFANRHFSA-N 454.866 5.102 5 20 JKBD CC(C)c1ncc(Cl)c(C(=O)O[C@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2ccccc2)n1 744675665 LNRJURZQJPRPJC-IBGZPJMESA-N 489.315 5.352 5 20 JKBD O=[N+]([O-])c1cc(C(F)(F)F)ccc1Sc1nnc(-c2ccncc2)n1Cc1ccccc1 799770183 PYBWXNYZYRTYOF-UHFFFAOYSA-N 457.437 5.467 5 20 JKBD COc1cc(-c2nc([C@@H]3CCCN3C(=O)OC(C)(C)C)no2)c([N+](=O)[O-])cc1OCc1ccccc1 904706460 POJGMNYHTGIBMW-SFHVURJKSA-N 496.520 5.304 5 20 JKBD O=C(c1ccc(Br)c([N+](=O)[O-])c1)N(Cc1cc(Br)ccc1F)C1CC1 914485299 QPXFGWAULHVMHV-UHFFFAOYSA-N 472.108 5.064 5 20 JKBD O=C(Nc1cccc(C2SCCS2)c1)N1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 915333714 ZSJFERBEHNLLPF-UHFFFAOYSA-N 498.552 5.446 5 20 JKBD O=C(Nc1ccc(NC(=O)c2cc([N+](=O)[O-])cc([N+](=O)[O-])c2)c(C(F)(F)F)c1)c1ccccc1 915871334 ZIIJTAOMZXZMNX-UHFFFAOYSA-N 474.351 5.026 5 20 JKBD CC1=C(C(=O)Nc2ccccc2C)[C@H](c2ccc(Oc3ccc(F)cc3)c([N+](=O)[O-])c2)NC(=S)N1 916191813 TUELTQNOAHASCR-QHCPKHFHSA-N 492.532 5.266 5 20 JKBD CN(C(=O)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1)C1CCN(C(=O)OC(C)(C)C)CC1 918124547 VWYCLJSBUTWFAC-UHFFFAOYSA-N 489.956 5.512 5 20 JKBD COc1cc(C(=O)N(c2ccc(Nc3ccccc3)cc2)C(C)C)c([N+](=O)[O-])cc1OC(F)F 920224016 WFLZUZAGFQEUNT-UHFFFAOYSA-N 471.460 6.004 5 20 JKBD COc1cc(C(=O)OCc2csc(C3CCCCC3)n2)c([N+](=O)[O-])cc1OCc1cscn1 920652676 MORXLTFPBQHDLO-UHFFFAOYSA-N 489.575 5.500 5 20 JKBD COC(=O)/C=C\c1ccc(Sc2nnc(-c3cccc(C)c3)n2Cc2ccco2)c([N+](=O)[O-])c1 931413679 CTKRWOPGSDPKHW-LUAWRHEFSA-N 476.514 5.140 5 20 JKBD O=C(/C=C/c1ccccc1[N+](=O)[O-])NC1(c2ccc(NC(=O)c3ccnc(C(F)F)c3)cc2)CCC1 1787019743 WLULUBZKQZMIAB-IZZDOVSWSA-N 492.482 5.389 5 20 JKBD Cc1ncccc1C(=O)Nc1ccc(C2(NC(=O)c3cc(Cl)cc([N+](=O)[O-])c3C)CCC2)cc1 1787320379 IUGYHKVHPARYDG-UHFFFAOYSA-N 478.936 5.322 5 20 JKBD O=C(CCc1ccsc1)Nc1ccc(C2(NC(=O)Cc3ccc([N+](=O)[O-])cc3F)CCC2)cc1 1788187345 RQQBEXOJCVVCSN-UHFFFAOYSA-N 481.549 5.105 5 20 JKBD O=C(/C=C/c1ccc([N+](=O)[O-])o1)NC1(c2ccc(NC(=O)c3csc4c3CCCO4)cc2)CCC1 1788398388 XXDOUPWZPSNIRG-CSKARUKUSA-N 493.541 5.035 5 20 JKBD O=C(CCC1CCCC1)NC1(c2ccc(NC(=O)c3nc4cc([N+](=O)[O-])ccc4[nH]3)cc2)CCC1 1790825068 BQGDVAZEWGXYDY-UHFFFAOYSA-N 475.549 5.189 5 20 JKBD O=C(/C=C/c1ccc([N+](=O)[O-])o1)N1CCCC2(CCN(C(=O)c3cc(Cl)sc3Cl)CC2)C1 1805682697 BMXVKJRTWLFHIT-DUXPYHPUSA-N 498.388 5.114 5 20 JKBD CC(C)[C@H](C(=O)N1CCCC[C@H]1c1cc(NC(=O)/C=C/c2ccc([N+](=O)[O-])o2)n[nH]1)c1ccccc1 1814965526 MFQIHTUTYVCFAP-SBNLUSQCSA-N 491.548 5.056 5 20 JKBD C[C@H](C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cc(F)cc([N+](=O)[O-])c2)n[nH]1)c1ccc(Cl)cc1 1821163359 LUZULEJXSFWUBC-QKKBWIMNSA-N 499.930 5.220 5 20 JKBD Cc1c(C(=O)N2CCC([C@@H]3CCCCN3C(=O)c3sccc3F)CC2)cc(Cl)cc1[N+](=O)[O-] 1824731144 XVUTWSUKSCHYMJ-IBGZPJMESA-N 493.988 5.304 5 20 JKBD Cc1ccc(CC(=O)N2CCCC[C@H]2C2CCN(C(=O)C[C@H](C)c3ccccc3)CC2)cc1[N+](=O)[O-] 1830365277 ZXESAABPAOPQBL-NVQXNPDNSA-N 491.632 5.259 5 20 JKBD Cc1cc(O)c([N+](=O)[O-])cc1C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2ccc(C3CC3)cc2)CC1 1830788905 DTBASBCQNOZDRU-DEOSSOPVSA-N 491.588 5.033 5 20 JKBD Cc1c(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3ccc([N+](=O)[O-])o3)CC2)cccc1C(F)(F)F 1832700101 MHLSNHFVLGJWGM-LJQANCHMSA-N 493.482 5.062 5 20 JKBD CCn1c(SCC(=O)Nc2cccc([N+](=O)[O-])c2C)nnc1-c1ccc(Cl)cc1Cl 9848250 DCEQYSWYURXACC-UHFFFAOYSA-N 466.350 5.219 5 20 JKBD CC(=O)Nc1ccc(NC(=O)c2ccc(Sc3ccc(C)cc3)c([N+](=O)[O-])c2)cc1Cl 12734912 KPVBMTUYBRJQAZ-UHFFFAOYSA-N 455.923 5.919 5 20 JKBD COc1ccc([C@H](NC(=O)c2ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])cc2)c2nccn2C)cc1 16473888 PXMZNQAUJXHHIW-QHCPKHFHSA-N 492.919 5.302 5 20 JKBD Cc1cccc([N+](=O)[O-])c1NC(=O)CSc1nnc(-c2ccc(Cl)cc2)n1Cc1ccccc1 20889488 WUYQGOOZORSSQN-UHFFFAOYSA-N 493.976 5.594 5 20 JKBD C[C@H](OC(=O)c1ccc(Br)c([N+](=O)[O-])c1)c1nc(-c2cccc(C(F)(F)F)c2)no1 23437512 QMIYFUVSALZQAD-VIFPVBQESA-N 486.200 5.344 5 20 JKBD COc1ccc(Oc2ccc([N+](=O)[O-])cc2C(=O)N2CC=C(c3c[nH]c4ncccc34)CC2)cc1 32936056 BNQPPVSWKWJPIR-UHFFFAOYSA-N 470.485 5.202 5 20 JKBD CC(C)N(C(=O)c1cc([N+](=O)[O-])ccc1N1CCOCC1)c1ccc(Nc2ccccc2)cc1 108700003 UMQRFTIKHZCRAD-UHFFFAOYSA-N 460.534 5.230 5 20 JKBD O=C(Nc1ccc(Sc2nncs2)cc1)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1 117635745 QJZQQYKUVZCQFM-UHFFFAOYSA-N 484.946 6.296 5 20 JKBD CCOc1ccc(N(C(=O)CCNc2ccccc2[N+](=O)[O-])c2nc3ccccc3s2)cc1 302935442 HVRJZQUFNYGISM-UHFFFAOYSA-N 462.531 5.770 5 20 JKBD COc1cc(CNCc2ccc(Br)cc2)ccc1OCc1ccc([N+](=O)[O-])cc1 303119318 LXECMPSAWHYWCR-UHFFFAOYSA-N 457.324 5.235 5 20 JKBD COc1cc(C(=O)Nc2cc(F)c(F)cc2F)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 303164674 ALEUDSYQHHAPLZ-UHFFFAOYSA-N 452.772 5.719 5 20 JKBD CC(=O)Nc1cccc(Nc2nnc(Sc3cc(C)nc(-c4ccc([N+](=O)[O-])cc4)n3)s2)c1 489186682 URWBSZITZYFGIX-UHFFFAOYSA-N 479.547 5.065 5 20 JKBD COc1cc(C(=O)N2CCC(OC3CCCCC3)CC2)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 495610700 WXAPDDQCICVVMW-UHFFFAOYSA-N 488.968 6.003 5 20 JKBD Cc1ccc(NC(=O)c2csc(-c3ccc([N+](=O)[O-])cc3)n2)cc1S(=O)(=O)Nc1ccccc1 497367357 MZHNDEJXVSFCBF-UHFFFAOYSA-N 494.554 5.080 5 20 JKBD CCCOc1ccccc1Oc1ncccc1CNC(=O)c1cc(SC)ccc1[N+](=O)[O-] 502308942 HMHVHKLSAYLBCH-UHFFFAOYSA-N 453.520 5.223 5 20 JKBD C[C@H]1Cc2cc([N+](=O)[O-])ccc2N1C(=O)Cc1ccc(NC(=O)c2cccc(Br)c2)cc1 504303885 JZIQBQXEYOPTMV-HNNXBMFYSA-N 494.345 5.130 5 20 JKBD Cc1csc(N(C(=O)c2ccc(N[C@@H](C)c3ccccn3)c([N+](=O)[O-])c2)c2ccccc2)n1 506245524 LDJCGHWNGUKFHC-KRWDZBQOSA-N 459.531 5.906 5 20 JKBD Cc1ccc(NC(=O)Nc2ccccc2)cc1NC(=O)N(Cc1ccc([N+](=O)[O-])cc1)C(C)C 509581094 XPNADDIUWNPPKE-UHFFFAOYSA-N 461.522 5.990 5 20 JKBD COc1cc(C(=O)N[C@H]2CCCC[C@H]2c2ccccc2)c([N+](=O)[O-])cc1OCc1cscn1 512748705 JUMXHPFQACACQR-ICSRJNTNSA-N 467.547 5.095 5 20 JKBD CSc1ccc(C(=O)N(C)CCCCCc2cc(-c3cccc(F)c3)no2)cc1[N+](=O)[O-] 521008828 JEFWZIQBEBORHF-UHFFFAOYSA-N 457.527 5.596 5 20 JKBD Cc1cc(C(=O)N2CCC[C@@H]2C(=O)Nc2ccc(N[C@H](C)c3ccccc3)cc2)ccc1[N+](=O)[O-] 523288490 VNFWIUMZDBAUMV-KBMIEXCESA-N 472.545 5.320 5 20 JKBD COc1cc(C(=O)N[C@H](c2ccccc2)c2cc3ccccc3o2)c([N+](=O)[O-])cc1OC(F)F 585691767 XKOPVXFRICWYBY-JOCHJYFZSA-N 468.412 5.470 5 20 JKBD Cc1ccc(C(=O)Nc2cc(OCC(F)(F)F)cc(OCC(F)(F)F)c2)cc1[N+](=O)[O-] 590665388 CNCRZPUZWMZEDN-UHFFFAOYSA-N 452.307 5.038 5 20 JKBD O=C(Nc1nc(Cc2ccccc2)c(-c2ccccc2)s1)c1cc2c(cc1[N+](=O)[O-])OCO2 603743178 WZDFBHIXDMBZTD-UHFFFAOYSA-N 459.483 5.290 5 20 JKBD CCOC(=O)C[C@H](c1ccccc1)C1CCN(C(=O)Nc2cc([N+](=O)[O-])ccc2OC(F)F)CC1 603831065 ZLLGBEQDBMIASD-LJQANCHMSA-N 491.491 5.177 5 20 JKBD O=C(NC1C[C@@H](C(F)(F)F)C[C@H](C(F)(F)F)C1)c1csc(-c2cccc([N+](=O)[O-])c2)n1 604517454 JMDPUALSXLDIEP-QWRGUYRKSA-N 467.391 5.358 5 20 JKBD CN(C[C@@H]1CCCO[C@H]1c1ccccc1)C(=O)c1ccc(NCc2ccccc2)c([N+](=O)[O-])c1 604519003 DHEHJGYLGPBEAY-OZXSUGGESA-N 459.546 5.447 5 20 JKBD COCCN(C(=O)Cn1c2ccccc2c(=O)c2ccccc21)[C@H](C)c1cccc(C(F)(F)F)c1 642070350 XGJHFIVYTXSRII-GOSISDBHSA-N 482.502 5.410 5 20 JKBD CC(C)CC(=O)N1CCN(C(=O)CCCCCNCc2c3ccccc3cc3ccccc23)CC1 727472083 SFOPLTCMDZLSLQ-UHFFFAOYSA-N 473.661 5.360 5 20 JKBD Cc1ccc2c(Cl)c(C(=O)O[C@@H](C)C(=O)Nc3ccc([N+](=O)[O-])cc3C(F)(F)F)sc2c1 729728359 LBADBMOOUUBMHR-JTQLQIEISA-N 486.855 5.974 5 20 JKBD COc1cc(CCNC(=O)c2sc3cc(Br)ccc3c2Cl)c([N+](=O)[O-])cc1OC 729833150 DQXXPFMZWRYEJQ-UHFFFAOYSA-N 499.770 5.215 5 20 JKBD O=C(COC(=O)c1cnc(-c2ccccc2Cl)s1)Nc1ccc(C(F)(F)F)cc1[N+](=O)[O-] 747954238 YRHZQGXUVQAVDL-UHFFFAOYSA-N 485.827 5.186 5 20 JKBD CCOc1ccc(-c2nc(C(=O)O[C@H](C)c3nnc(-c4ccc([N+](=O)[O-])cc4)o3)cs2)cc1 914991962 KCTWZEGEVFHVHM-CYBMUJFWSA-N 466.475 5.085 5 20 JKBD COc1cc(/C=C/C(=O)O[C@H](C)c2ccc([N+](=O)[O-])cc2)ccc1OCc1c(C)noc1C 920155037 GZCYFYCXCHRWGB-GXDWLZFVSA-N 452.463 5.105 5 20 JKBD C[C@@H](NC(=O)c1cc([N+](=O)[O-])ccc1Sc1ccc(Cl)cc1)c1ccc(N2CCOC2=O)cc1 920952768 QJRVCWQASSSREF-OAHLLOKOSA-N 497.960 5.847 5 20 JKBD COc1ccc(C(=O)NC2(c3ccc(NC(=O)c4cc(Cl)cc([N+](=O)[O-])c4C)cc3)CCC2)nc1 1790774766 RAUGCUWJGFNKOF-UHFFFAOYSA-N 494.935 5.022 5 20 JKBD O=C(NC1(c2ccc(NC(=O)c3cc4cc([N+](=O)[O-])ccc4s3)cc2)CCC1)c1ccco1 1791011269 VGJCKAMUZYRARS-UHFFFAOYSA-N 461.499 5.464 5 20 JKBD Cc1ccc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cc(Cl)cc([N+](=O)[O-])c2C)c(Cl)c1 1800713630 XIBYXFXJWYWVFW-BJWYYQGGSA-N 476.360 5.084 5 20 JKBD Cc1cc2[nH]c(C(=O)N[C@@H]3C[C@@H]4CC[C@H](C3)N4C(=O)c3cc4cc([N+](=O)[O-])ccc4s3)cc2s1 1801207368 YEJVQSZPIIJAPA-MUJYYYPQSA-N 494.598 5.226 5 20 JKBD Cc1c(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)c3ccc(Cl)o3)n[nH]2)cc(Cl)cc1[N+](=O)[O-] 1818427556 HTRCQXMRLDJHOO-OAHLLOKOSA-N 492.319 5.146 5 20 JKBD Cc1cccc(C(=O)N2CCCC[C@H]2c2cc(NC(=O)c3ccc([N+](=O)[O-])cc3F)n[nH]2)c1Cl 1821050002 BGTZXGTXRUDXBG-IBGZPJMESA-N 485.903 5.039 5 20 JKBD Cc1c(C(=O)N2CCCC[C@H]2c2cc(NC(=O)c3ccc([N+](=O)[O-])cc3F)n[nH]2)oc2ccccc12 1821054373 KLKRBINLIOVYJT-FQEVSTJZSA-N 491.479 5.131 5 20 JKBD CC(C)c1ccc(CC(=O)N2CCCC[C@@H]2c2cc(NC(=O)c3cc(F)cc([N+](=O)[O-])c3)n[nH]2)cc1 1821168026 GYAJBDRLRUGUFM-HSZRJFAPSA-N 493.539 5.129 5 20 JKBD O=C(c1cccs1)N1CCCC[C@@H]1C1CCN(C(=O)C2(c3cccc([N+](=O)[O-])c3)CCC2)CC1 1825778403 WXOLBLIPUOIDAX-JOCHJYFZSA-N 481.618 5.012 5 20 JKBD O=C(/C=C/c1ccccc1[N+](=O)[O-])N1CCC([C@H]2CCCCN2C(=O)c2cccc3cccnc23)CC1 1828040212 YBBUOYMSUIUNBQ-AKNQKSQZSA-N 498.583 5.090 5 20 JKBD CC1=CC[C@H](C(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3cc(Cl)cc([N+](=O)[O-])c3C)CC2)CC1 1828350909 DAAXACIBSZUNRG-NZQKXSOJSA-N 488.028 5.536 5 20 JKBD Cc1cc(C(=O)N2CCCC[C@H]2C2CCN(C(=O)c3cc4cc([N+](=O)[O-])ccc4s3)CC2)ccn1 1829252027 DXYAQPNGELVMOR-QFIPXVFZSA-N 492.601 5.060 5 20 JKBD Cc1ccc(C(=O)N2CCC([C@H]3CCCCN3C(=O)c3cccc(F)c3[N+](=O)[O-])CC2)c(Cl)c1 1830622441 JBBLVUSPFVRHGC-JOCHJYFZSA-N 487.959 5.243 5 20 JKBD O=C(c1ccccc1C1CC1)N1CCC([C@H]2CCCCN2C(=O)c2cccc(F)c2[N+](=O)[O-])CC1 1830622732 MCXGYPWRKNIGMY-XMMPIXPASA-N 479.552 5.158 5 20 JKBD CNc1ccc(C(=O)N2CCC([C@H]3CCCCN3C(=O)c3cc(Cl)cc([N+](=O)[O-])c3C)CC2)cc1 1830736348 WBWSVPKDOKEHRG-HSZRJFAPSA-N 499.011 5.145 5 20 JKBD O=C(C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)Nc1ccc(NC(=O)C2CC2)cc1 11310647 YOXFFGGMBVQUTN-CYVLTUHYSA-N 498.564 6.122 5 20 JKBD CCN(CC)c1ccc(-c2nnc(SCC(=O)Nc3cc([N+](=O)[O-])ccc3Cl)n2CC)cc1 13877425 PTTSAFILPPYCDH-UHFFFAOYSA-N 489.001 5.104 5 20 JKBD CCc1cccc(CC)c1NC(=O)C1=C(c2ccccc2)NC(=S)N[C@H]1c1ccc([N+](=O)[O-])cc1 14878043 XLNALAPEQUQWPA-VWLOTQADSA-N 486.597 5.288 5 20 JKBD CC(C)[C@@H](Sc1nc2cc3ccccc3cc2c(=O)n1C)C(=O)Nc1ccccc1C(F)(F)F 32328348 IBIFVRIFCSUIIR-OAQYLSRUSA-N 485.531 5.861 5 20 JKBD CC[C@@H](C)Sc1ccc(NC(=O)c2ccn(-c3ccc([N+](=O)[O-])cc3)n2)c(C(F)(F)F)c1 60306299 HZVZJESQMZLVET-CYBMUJFWSA-N 464.469 5.942 5 20 JKBD CCn1c(S[C@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)nc2cc3ccccc3cc2c1=O 115200006 PWMKDMMVFFYTIP-CQSZACIVSA-N 473.514 5.381 5 20 JKBD CN(Cc1ccccc1[N+](=O)[O-])C(=O)c1cc2cc(Br)cc(Br)c2o1 195747880 MBBWVNNCNNXMBF-UHFFFAOYSA-N 468.101 5.138 5 20 JKBD CC(=O)Nc1ccc(-c2csc(NC(=O)c3cc([N+](=O)[O-])ccc3N3CCC(C)CC3)n2)cc1 247921757 HFKQEXFZTDTHPF-UHFFFAOYSA-N 479.562 5.165 5 20 JKBD CCN(CC)C(=O)C1CCN(C(=O)c2ccc(Sc3nc4ccccc4s3)c([N+](=O)[O-])c2)CC1 476175836 XDJIBDFORUNUSD-UHFFFAOYSA-N 498.630 5.076 5 20 JKBD O=C(Nc1ccc(-c2nnco2)cc1)c1ccccc1Sc1ccc(C(F)(F)F)cc1[N+](=O)[O-] 481829807 JKDYQVYATHBTMZ-UHFFFAOYSA-N 486.431 6.067 5 20 JKBD C[C@H](NC(=O)c1ccc(N[C@@H](C)c2ccccn2)c([N+](=O)[O-])c1)c1ccc(Br)cc1 505981066 HUTPWDQKUHRNKX-GJZGRUSLSA-N 469.339 5.416 5 20 JKBD CCOC(=O)c1cc(-c2ccccc2)sc1NC(=O)c1cc(OC)c(OCC)cc1[N+](=O)[O-] 506760181 SSGXZFFFZWDOBM-UHFFFAOYSA-N 470.503 5.160 5 20 JKBD O=C(NCc1cccc(NC(=O)N2CCCC2)c1)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1 509173183 XTMTXNINEMGIMA-UHFFFAOYSA-N 494.935 5.598 5 20 JKBD Cc1ccc(Br)cc1NC(=O)N1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 509859299 CZYLGFMIEUQMMG-UHFFFAOYSA-N 487.276 5.039 5 20 JKBD CC[C@@H](C)[C@H](NC(=O)c1cc(OC)c(OCc2cscn2)cc1[N+](=O)[O-])c1nc2ccccc2[nH]1 512185150 ZRFOFHQYJCOTGT-PEBXRYMYSA-N 495.561 5.032 5 20 JKBD Cc1ccc(CN2C(=O)c3ccccc3N[C@@H]2c2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)cc1 517977055 OMKAJRYOAPKSNQ-VWLOTQADSA-N 453.502 5.070 5 20 JKBD C[C@H](N[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1)c1ccc2c(c1)CCC(=O)N2 518472660 UKTLYDTWQWLYOH-IZHWHUGBSA-N 478.936 5.164 5 20 JKBD CC(=O)Nc1cccc([C@H](C)N(Cc2ccccc2)C(=O)Cn2ccc3cc([N+](=O)[O-])ccc32)c1 521541492 IXUYNPKLYFWLBE-IBGZPJMESA-N 470.529 5.298 5 20 JKBD CC(C)N1CC[C@H](CNC(=O)c2ccccc2Sc2ccc(C(F)(F)F)cc2[N+](=O)[O-])C1 522902178 UVQNBXUGPYKYBB-OAHLLOKOSA-N 467.513 5.225 5 20 JKBD COc1cc([C@@H](C)NC(=O)c2ccc(Cn3nc(C)c([N+](=O)[O-])c3C)cc2)ccc1OC1CCCC1 603764139 HHANXSHZTOWKSB-QGZVFWFLSA-N 492.576 5.277 5 20 JKBD Cc1nn(Cc2ccc(C(=O)N(Cc3ccco3)c3ccc(F)cc3F)cc2)c(C)c1[N+](=O)[O-] 603996362 BKSUYCPVPZEPPI-UHFFFAOYSA-N 466.444 5.175 5 20 JKBD CC(=O)N(C)c1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2Sc2ccc(Cl)cc2)cc1 604478945 MLLBGDNAXNGKQB-UHFFFAOYSA-N 455.923 5.634 5 20 JKBD COc1cccc(OC)c1Oc1ccc(CNCc2ccc(-c3ccccc3[N+](=O)[O-])s2)cn1 608836111 NEVKGXGHXILHFP-UHFFFAOYSA-N 477.542 5.818 5 20 JKBD C[C@@H]1C[C@@H](C)CN(c2ccc(C(=O)N3CCC(c4nc(-c5ccccc5)no4)CC3)cc2[N+](=O)[O-])C1 609141892 PCOVCPCGOIALBB-RTBURBONSA-N 489.576 5.147 5 20 JKBD C[C@H]1CCCN(c2ccc(C(=O)O[C@H](C)C(=O)Nc3ccccc3C(F)(F)F)cc2[N+](=O)[O-])C1 728948769 POSWJEFPUISALV-LSDHHAIUSA-N 479.455 5.034 5 20 JKBD C[C@@H](OC(=O)c1csc(-c2ccc([N+](=O)[O-])cc2)n1)C(=O)Nc1ccccc1Oc1ccccc1 747958318 YKTGLSKJNHEFJV-MRXNPFEDSA-N 489.509 5.695 5 20 JKBD COc1cc([C@@H](C)NC(=O)c2cc([N+](=O)[O-])ccc2Br)ccc1OCCC(C)C 751089898 BWQUIGNTZQMJQC-CQSZACIVSA-N 465.344 5.282 5 20 JKBD CC(C)c1ccc(-c2nc(CC(=O)Nc3cc4c(cc3[N+](=O)[O-])OCCCO4)cs2)cc1 790650833 JZZSZVRRZVCKOR-UHFFFAOYSA-N 453.520 5.184 5 20 JKBD CC(C)Cn1cc([C@H]2N(c3cc(Cl)c(C(F)(F)F)cc3[N+](=O)[O-])CC23CCOCC3)cn1 849477830 BXYOZERVVKLCMD-LJQANCHMSA-N 472.895 5.478 5 20 JKBD CCC(CC)c1cc[n+](/C(C(=S)N[C@@H]2C[C@H]3CC[C@H]2C3)=C(/O)c2cccc([N+](=O)[O-])c2)cc1 912845582 VSYUSFYYLBYHOA-KPDCDPCYSA-O 466.627 5.775 5 20 JKBD Cc1nn(Cc2ccc(C(=O)Nc3cc(NC(=O)OC(C)(C)C)ccc3F)cc2)c(C)c1[N+](=O)[O-] 914769218 DBSXHKZTXMDQCX-UHFFFAOYSA-N 483.500 5.195 5 20 JKBD Cn1c(CSc2nc3ccccc3s2)nnc1SCCCOc1ccc([N+](=O)[O-])cc1 917562983 XZORVOFUQRWGJS-UHFFFAOYSA-N 473.605 5.187 5 20 JKBD Cc1nc(-c2ccccc2)sc1[C@H](C)NC(=O)c1cc([N+](=O)[O-])ccc1I 919771417 FSLMNXOULQASIF-NSHDSACASA-N 493.326 5.122 5 20 JKBD Cc1cc(C)c(NC(=O)[C@H](C)OC(=O)c2ccc(N[C@H](C)c3ccccn3)c([N+](=O)[O-])c2)c(Cl)c1 920548193 QLFPPNXRYSBIQE-SJORKVTESA-N 496.951 5.617 5 20 JKBD Cc1cccc2[nH]c(C(=O)Nc3ccc(C4(NC(=O)c5ccc(O)c([N+](=O)[O-])c5)CCC4)cc3)cc12 1789274128 BVRVYXKVOHMRIL-UHFFFAOYSA-N 484.512 5.152 5 20 JKBD Cc1cccc(C)c1C(=O)Nc1cc([C@@H]2CCCCN2C(=O)CSc2ccccc2[N+](=O)[O-])[nH]n1 1821193478 ZCAUHQBLJZKZDA-IBGZPJMESA-N 493.589 5.033 5 20 JKBD CC1(C)CCC(CC(=O)N2CCC([C@@H]3CCCCN3C(=O)Cc3cccc([N+](=O)[O-])c3)CC2)CC1 1823680146 TXIRLBONUNIICO-VWLOTQADSA-N 483.653 5.364 5 20 JKBD O=C(/C=C/c1ccccc1[N+](=O)[O-])N1CCC([C@@H]2CCCCN2C(=O)c2cc3ccccc3o2)CC1 1828191816 WTPCRZSQNSDYKG-OTOIZHKDSA-N 487.556 5.288 5 20 JKBD C[C@H](Sc1nnc(-c2ccccc2)n1-c1ccc(F)cc1)C(=O)Nc1ccccc1[N+](=O)[O-] 10212686 WMGWMLDVWUJHPK-HNNXBMFYSA-N 463.494 5.101 5 20 JKBD COc1ccc(/C=C/C(=O)O[C@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2ccccc2)cc1OC 10795881 ZYVOSXUBNNAUSJ-JEAXJQIYSA-N 496.903 5.202 5 20 JKBD COc1ccc(NC(=O)[C@H](C)OC(=O)[C@H](Sc2ccccc2)c2ccccc2)c([N+](=O)[O-])c1 15815210 UGEAYTBWKFVOSR-KSFYIVLOSA-N 466.515 5.007 5 20 JKBD Cc1csc(Sc2ccc(C(=O)N3CCC[C@H](C(=O)Nc4ccccc4)C3)cc2[N+](=O)[O-])n1 17822643 SMVVHGNXQWUJHO-KRWDZBQOSA-N 482.587 5.002 5 20 JKBD C[C@H](Sc1nnc(-c2ccc(F)cc2)n1Cc1ccccc1)C(=O)Nc1ccc([N+](=O)[O-])cc1 23599672 YXSHZFBNTZBWHH-INIZCTEOSA-N 477.521 5.160 5 20 JKBD Cn1ccnc1COc1ccc(NC(=O)c2ccc(NCc3ccccc3Cl)c([N+](=O)[O-])c2)cc1 71963933 YFXAQKUXNWTGQI-UHFFFAOYSA-N 491.935 5.425 5 20 JKBD O=C(Nc1ccccc1C(=O)Nc1ccc(-n2ccnc2)c(F)c1)c1ccc([N+](=O)[O-])cc1Cl 108696778 YIJJFNYXPLDYHQ-UHFFFAOYSA-N 479.855 5.078 5 20 JKBD Cc1nccc(-c2cccc(NC(=O)c3ccc(N[C@H](C)c4ccccn4)c([N+](=O)[O-])c3)c2)n1 115711315 LLQBDHQMOHROKT-MRXNPFEDSA-N 454.490 5.181 5 20 JKBD CSCC[C@@H](NC(=O)c1cccc([N+](=O)[O-])c1)C(=O)N1CCC(c2cccc3ccccc23)CC1 476157676 MBJWMYKWNKZIQE-RUZDIDTESA-N 491.613 5.006 5 20 JKBD Cc1ccc(-c2csc(NC(=O)C3CCN(C(=O)c4ccc(Cl)s4)CC3)n2)cc1[N+](=O)[O-] 478065527 WLJAPCNRTOVULY-UHFFFAOYSA-N 490.994 5.233 5 20 JKBD COc1cc(CN(C)C(=O)c2cc([N+](=O)[O-])ccc2NCc2ccccc2)ccc1SC 478547302 XKTMEDALRZWHMU-UHFFFAOYSA-N 451.548 5.210 5 20 JKBD O=C1CCCc2cc(N[C@H](C(=O)Nc3ccc([N+](=O)[O-])cc3Cl)c3ccccc3)ccc2N1 488564608 DTHFIISDLGRBAH-QHCPKHFHSA-N 464.909 5.315 5 20 JKBD CCOC(=O)c1sc(NC(=O)c2cc(SC)ccc2[N+](=O)[O-])c(C(=O)OC(C)(C)C)c1C 498528079 SRIPEKLTTLOMEL-UHFFFAOYSA-N 480.564 5.071 5 20 JKBD Cc1ccc(S(=O)(=O)Nc2ccc(NC(=O)c3[nH]c4ccccc4c3Cl)cc2)cc1[N+](=O)[O-] 500724870 YSSVTMWVAADGAG-UHFFFAOYSA-N 484.921 5.091 5 20 JKBD O=C(Nc1ccc(OC[C@H]2CCCO2)cc1)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 502051612 UEGPZTSIOMZEAG-HXUWFJFHSA-N 493.482 5.027 5 20 JKBD CS(=O)(=O)c1ccc(C(=O)Nc2ccc(Sc3ccccc3)c(Cl)c2)cc1[N+](=O)[O-] 509081792 ODHNUWVRIROWFE-UHFFFAOYSA-N 462.936 5.055 5 20 JKBD COc1ccccc1-n1c(SCc2nc(-c3ccc([N+](=O)[O-])cc3)no2)nnc1-c1cccs1 514458779 QCNHNZCUKATTCK-UHFFFAOYSA-N 492.542 5.255 5 20 JKBD O=C(Nc1ccccc1-c1cccs1)c1ccc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)cc1 515186348 SEMRUZQNJBWRCF-UHFFFAOYSA-N 479.539 5.376 5 20 JKBD O=C(c1ccc(NCc2ccccc2Cl)c([N+](=O)[O-])c1)N1CCC(OCc2ccccc2)CC1 515191403 MUQYSJIUCHIYMN-UHFFFAOYSA-N 479.964 5.682 5 20 JKBD C[C@@H](Sc1nnc(-c2ccccc2)n1[C@H](C)c1ccccc1)C(=O)Nc1ccccc1[N+](=O)[O-] 515488151 VKSSYCHTWOPRLY-QZTJIDSGSA-N 473.558 5.582 5 20 JKBD C[C@H](Nc1ccc(C(=O)N2CCCC[C@@H]2c2nc3ccccc3n2C)cc1[N+](=O)[O-])c1ccccn1 517751472 JOFCSGPLDCZWMZ-MHECFPHRSA-N 484.560 5.417 5 20 JKBD COCCOc1c(Cl)cccc1NC(=O)c1ccc(N2C[C@@H](C)C[C@H](C)C2)c([N+](=O)[O-])c1 520006082 HJWHGFBYYWYIGK-HOTGVXAUSA-N 461.946 5.008 5 20 JKBD CS(=O)(=O)c1ccc(Oc2ccc(NC(=O)c3cc4ccccc4c4cccnc34)cc2)cc1 522534888 JAAMRKYULUCQTQ-UHFFFAOYSA-N 468.534 5.836 5 20 JKBD C[C@H](c1cccc(NC(=O)c2cc([N+](=O)[O-])ccc2Sc2ccccc2)c1)N1CCOCC1 524553433 LYGZTPRRHCILTP-GOSISDBHSA-N 463.559 5.392 5 20 JKBD COc1ccc([N+](=O)[O-])cc1NC(=O)c1ccc(NC(=O)c2cc(Cl)cc(Cl)c2)cc1 603597729 UDPYHAFMLDBFQG-UHFFFAOYSA-N 460.273 5.415 5 20 JKBD Cc1sc2nc(SCc3nc(-c4ccc([N+](=O)[O-])cc4)no3)n(C3CCCC3)c(=O)c2c1C 603680191 IZJVWAYKFFFOAV-UHFFFAOYSA-N 483.575 5.440 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Cl)[C@@H](NC1CCN(Cc2ccc(F)cc2)CC1)c1ccccc1 604044526 UEQPAAMXQGQQSJ-VWLOTQADSA-N 496.970 5.321 5 20 JKBD Cc1nnc(SCc2c(C(=O)OCc3cc(F)ccc3[N+](=O)[O-])oc3ccccc23)s1 742956544 MZVFPULRCNXAIU-UHFFFAOYSA-N 459.480 5.289 5 20 JKBD Cc1ccccc1NC(=O)Cc1nc(COC(=O)c2csc(-c3ccc([N+](=O)[O-])cc3)n2)cs1 747957332 OFYWDMVHCZRIDK-UHFFFAOYSA-N 494.554 5.021 5 20 JKBD Cc1oc(-c2cccs2)nc1CC(=O)Oc1ccc2c(-c3ccc([N+](=O)[O-])cc3)cc(=O)oc2c1 818839094 TWDUWGVYVDIQAK-UHFFFAOYSA-N 488.477 5.541 5 20 JKBD Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)CC[C@H](C)CC(=O)Nc1cc([N+](=O)[O-])c(C)cc1C 864237721 GOEIPJXQJNQKSK-ZDUSSCGKSA-N 456.499 5.120 5 20 JKBD O=C(OCc1coc(-c2ccc(F)cc2)n1)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 899895863 QCRVFTBMKKMSRV-UHFFFAOYSA-N 493.413 5.368 5 20 JKBD Cc1cc(C(=O)N2CCC[C@@H]2c2nc(-c3ccc(C(F)(F)F)s3)no2)ccc1[N+](=O)[O-] 904971306 SKQZYXJGQKOBER-CYBMUJFWSA-N 452.414 5.011 5 20 JKBD CC1=C(C(=O)Nc2ccccc2C)[C@@H](c2ccc(Cl)c([N+](=O)[O-])c2)NC(=S)N1c1ccccc1 916162076 GBFKTVMMLVQMRE-HSZRJFAPSA-N 492.988 5.905 5 20 JKBD C[C@H](Cc1ccccc1Cl)NC(=O)c1ccccc1NC(=O)c1ccc([N+](=O)[O-])cc1Cl 918580351 OHVBYFZCNMGWKZ-CQSZACIVSA-N 472.328 5.515 5 20 JKBD CCN(CC)C(=O)c1ccccc1NC(=O)Cc1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1 919873945 BFVMMRJSUFVLLM-UHFFFAOYSA-N 497.555 5.111 5 20 JKBD O=C(CCc1cccc([N+](=O)[O-])c1)Nc1ccc(C2(NC(=O)c3cccc4cnccc34)CCC2)cc1 1786602358 JVLYMCWUBJTJHO-UHFFFAOYSA-N 494.551 5.524 5 20 JKBD O=C(NC1(c2ccc(NC(=O)c3c(Cl)cccc3Cl)cc2)CCC1)c1ccc([N+](=O)[O-])o1 1790226527 IHTCDMVOSZIUIM-UHFFFAOYSA-N 474.300 5.556 5 20 JKBD Cc1cc(C(=O)NC2(c3ccc(NC(=O)c4cccc(-c5cnco5)c4)cc3)CCC2)ncc1[N+](=O)[O-] 1790710910 SUMPALXLDBEPIA-UHFFFAOYSA-N 497.511 5.015 5 20 JKBD O=C(Cc1ccc([N+](=O)[O-])cc1F)NC1(c2ccc(NC(=O)c3cccc4ccncc34)cc2)CCC1 1790859837 MKIUEXCRPJYSLJ-UHFFFAOYSA-N 498.514 5.273 5 20 JKBD CC1(C)CC(C(=O)Nc2ccc(C3(NC(=O)CSc4ccccc4[N+](=O)[O-])CCC3)cc2)C1 1791650451 BDEUPOHQTWKJLG-UHFFFAOYSA-N 467.591 5.257 5 20 JKBD O=C(/C=C/c1ccc([N+](=O)[O-])o1)Nc1cc([C@H]2CCCCN2C(=O)c2cccc3ccccc23)[nH]n1 1814967576 LPDUKIJXPMLQBE-UFSNDUKISA-N 485.500 5.083 5 20 JKBD Cc1ccc(CC(=O)Nc2cc([C@@H]3CCCCN3C(=O)C[C@@H](C)c3ccccc3)[nH]n2)cc1[N+](=O)[O-] 1820918574 IFFRLZBFKVFXRF-XXBNENTESA-N 489.576 5.055 5 20 JKBD CC(C)[C@@H](C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2ccc([N+](=O)[O-])cc2F)n[nH]1)c1ccccc1 1821049644 UTKBQCFQRQRSTF-LADGPHEKSA-N 493.539 5.203 5 20 JKBD CC/C=C(\C)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cc3cc([N+](=O)[O-])ccc3s2)n[nH]1 1821610590 HALOWYWDPCIHHR-KRPRSCCNSA-N 467.551 5.195 5 20 JKBD Cc1c(C(=O)N2CCCC[C@H]2C2CCN(C(=O)c3cccc(F)c3)CC2)cc(Cl)cc1[N+](=O)[O-] 1830734292 BWIMCRLTAWDLSY-QFIPXVFZSA-N 487.959 5.243 5 20 JKBD CC(C)[C@H](C(=O)N1CC2(CCCN2C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)C1)c1ccccc1 1845738196 JULVIZUWBJDFGB-QHCPKHFHSA-N 477.586 5.066 5 20 JKBD COc1ccc(-c2nc(NC(=O)Cn3c4ccccc4c(=O)c4ccccc43)sc2C)cc1 11248842 UIZFFTVNTWIZLD-UHFFFAOYSA-N 455.539 5.234 5 20 JKBD Cc1ccc(NC(=O)[C@@H](Sc2nnc(NCc3ccccc3)s2)c2ccccc2)c([N+](=O)[O-])c1 11408263 ULVVMWZHLDAJNU-NRFANRHFSA-N 491.598 5.839 5 20 JKBD COc1ccc([C@@H]2CCCN2C(=O)C2CCN(c3ccc(C(F)(F)F)cc3[N+](=O)[O-])CC2)cc1 15598472 WUAQPZRODWGKEP-FQEVSTJZSA-N 477.483 5.202 5 20 JKBD O=C(Nc1ccccc1C(=O)OCc1cc(-c2cccs2)on1)c1ccc([N+](=O)[O-])cc1Cl 15748539 GNZSMEQEJQMRPE-UHFFFAOYSA-N 483.889 5.574 5 20 JKBD O=C(Nc1ccc(NS(=O)(=O)c2ccc(F)c(F)c2)cc1)c1cc2cc([N+](=O)[O-])ccc2s1 15764555 RYFXNPDDORCJEP-UHFFFAOYSA-N 489.481 5.141 5 20 JKBD COc1ccc([N+](=O)[O-])cc1C(=O)OCc1csc(N(C(C)=O)c2cccc(C(F)(F)F)c2)n1 19285088 KNWNRQPGFPNJHN-UHFFFAOYSA-N 495.435 5.120 5 20 JKBD O=C(Nc1cccc(NC(=O)c2cc([N+](=O)[O-])ccc2Sc2ccccc2)c1)c1cccs1 26744990 YFTLFEBTKABTJH-UHFFFAOYSA-N 475.551 6.312 5 20 JKBD Cc1csc(Sc2ccc(C(=O)Nc3cccc(NC(=O)C(C)C)c3)cc2[N+](=O)[O-])n1 31919038 SYXLHGCRBYIMNG-UHFFFAOYSA-N 456.549 5.358 5 20 JKBD Cc1cc(C(=O)N2CCC[C@H]2C(=O)Nc2ccc(OCc3cccc(F)c3)c(F)c2)ccc1[N+](=O)[O-] 97548504 LCMDINMIMJZINQ-QHCPKHFHSA-N 495.482 5.004 5 20 JKBD COc1cc(C(=O)Nc2ccc3c(ccn3CC(C)C)c2)c([N+](=O)[O-])cc1OCc1cscn1 109770490 ZMGXFLVFQAVETM-UHFFFAOYSA-N 480.546 5.502 5 20 JKBD Cc1ccc(NC(=O)c2ccccc2)cc1NC(=O)c1csc(-c2cccc([N+](=O)[O-])c2)n1 215722061 NSKCVIKXTMHYKB-UHFFFAOYSA-N 458.499 5.531 5 20 JKBD CC(=O)NCc1ccc(-c2nc(NC(=O)c3csc(-c4cccc([N+](=O)[O-])c4)n3)sc2C)s1 303058964 UCLYIFZBRSFRIW-UHFFFAOYSA-N 499.599 5.100 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)Nc2nc3ccc(OCC(F)(F)F)cc3s2)cc1SC 482817123 LCQFQTJBVIUOAA-UHFFFAOYSA-N 473.454 5.128 5 20 JKBD COc1ccccc1-c1nc(NC(=O)c2cc([N+](=O)[O-])ccc2Sc2ccc(Cl)cc2)n[nH]1 490148122 JQDBKAFFYDXOHL-UHFFFAOYSA-N 481.921 5.445 5 20 JKBD CSc1ccc(C(=O)N(C)CCCCCc2cc(-c3ccc(F)cc3)n[nH]2)cc1[N+](=O)[O-] 508354737 NFXBQGJEMDZPMN-UHFFFAOYSA-N 456.543 5.331 5 20 JKBD COc1cc(OCC(=O)N(c2nc3ccccc3s2)c2ccc(C)cc2C)ccc1[N+](=O)[O-] 508576047 HERLTDQFRQXFSM-UHFFFAOYSA-N 463.515 5.574 5 20 JKBD O=C(Nc1ccc(OCc2ccccc2F)cc1)c1ccc([N+](=O)[O-])cc1I 512617771 GEKCKSXXTIBXEA-UHFFFAOYSA-N 492.244 5.170 5 20 JKBD CC1CCN(c2ccc(C(=O)Nc3cccc(-c4nnc5n4CCCCC5)c3)cc2[N+](=O)[O-])CC1 514302265 DHXCYBFCMHSPRZ-UHFFFAOYSA-N 474.565 5.068 5 20 JKBD Cc1cc(C)n([C@H](C)C(=O)Nc2ccc(NCc3ccc(C(F)(F)F)cc3[N+](=O)[O-])cc2Cl)n1 600854783 XMNWXQPNYGTHMI-CQSZACIVSA-N 495.889 5.892 5 20 JKBD CCOc1ccc([C@H](C)N[C@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2ccccc2)cc1OC 603598529 JFQHFYOPRFZLFW-FYSMJZIKSA-N 483.952 5.686 5 20 JKBD Cc1cccc(NS(=O)(=O)c2cc(NC(=O)c3cc4cc([N+](=O)[O-])ccc4o3)ccc2C)c1 603781371 OADLACXSFHHIGE-UHFFFAOYSA-N 465.487 5.011 5 20 JKBD Cc1ccc(NS(=O)(=O)c2ccc(N[C@H](C)c3ccc4c(c3)CCC(=O)N4)c([N+](=O)[O-])c2)c(C)c1 603863946 YIEPGMZGJOGHSW-QGZVFWFLSA-N 494.573 5.070 5 20 JKBD COc1cc(C(=O)N2CCc3cc(F)c(F)cc32)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 603896554 FXNQIHHIJNSOLV-UHFFFAOYSA-N 460.820 5.530 5 20 JKBD CCc1nc(CNC(=O)C/C(=C\c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)cs1 609346346 HINKODCIFXAFAJ-LFIBNONCSA-N 464.572 5.471 5 20 JKBD Cc1nc(COc2ccc(NC(=O)c3cc([N+](=O)[O-])ccc3Sc3ccc(Cl)cc3)cc2)no1 609376325 JNGONAJOIIAESL-UHFFFAOYSA-N 496.932 5.922 5 20 JKBD CC(C)c1ccc(Nc2nnc(SCc3nnc(-c4ccc([N+](=O)[O-])cc4)o3)s2)cc1 618900578 ZXVYEWBIGYXCQH-UHFFFAOYSA-N 454.537 5.656 5 20 JKBD COc1ccc(C[C@@H](N[C@@H](C)C(=O)Nc2cc([N+](=O)[O-])ccc2Cl)c2ccccc2)cc1OC 727464514 TYVWSALCLNAARL-HRAATJIYSA-N 483.952 5.166 5 20 JKBD CC(C)(C)OC(=O)Nc1ccc(NC(=O)/C=C/c2ccc([N+](=O)[O-])cc2)c(C(F)(F)F)c1 729656403 APBXBOAPCHULJH-IZZDOVSWSA-N 451.401 5.613 5 20 JKBD Cc1cccc(-c2nnc([C@@H](C)OC(=O)CCNc3ccc(C(F)(F)F)cc3[N+](=O)[O-])o2)c1 750503626 AIVKDMPRCXPFAJ-CYBMUJFWSA-N 464.400 5.078 5 20 JKBD COc1ccc([N+](=O)[O-])cc1NC(=O)c1cc([N+](=O)[O-])ccc1Sc1ccc(Cl)cc1 912763612 BXUFCAPOOHOBBT-UHFFFAOYSA-N 459.867 5.569 5 20 JKBD CC(=O)Nc1ccc(N[C@@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Br)c2ccccc2)cc1C 913095726 XVTRDEOYKCTZEX-JOCHJYFZSA-N 497.349 5.416 5 20 JKBD CC(C)(C)c1nnc(COC(=O)C/C(=C/c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)o1 914797644 BGAVJWMNTUCOSN-VBKFSLOCSA-N 478.530 5.559 5 20 JKBD O=c1nc(/C(Cl)=C/c2ccc(-c3ccc([N+](=O)[O-])cc3)o2)[nH]c2cc(C(F)(F)F)ccc12 916128268 VIQYHXNTMKCFDW-YBEGLDIGSA-N 461.783 5.847 5 20 JKBD O=C(C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)NCc1ccccc1[N+](=O)[O-] 916423529 YITCITFIYAGMJS-QGOAFFKASA-N 474.498 5.360 5 20 JKBD COc1ccc([N+](=O)[O-])c(C(=O)OCC(=O)Nc2c(Cl)c(Cl)cc(Cl)c2Cl)c1 920703590 KGKFECDMRXGZCH-UHFFFAOYSA-N 468.076 5.013 5 20 JKBD O=C(Cc1csc(Cc2ccc(F)cc2)n1)Oc1ccc(NC(=O)c2cccc([N+](=O)[O-])c2)cc1 920875369 WTQPDCMBSVEEQI-UHFFFAOYSA-N 491.500 5.182 5 20 JKBD COc1ccc([C@@H](C)C(=O)Nc2ccc(C3(NC(=O)/C=C/c4ccc([N+](=O)[O-])o4)CCC3)cc2)cc1 1786036726 YIZWWTHSKPIEIJ-QIXNEVBVSA-N 489.528 5.147 5 20 JKBD Cc1noc(C)c1C(=O)Nc1ccc(C2(NC(=O)c3cc(Cl)cc([N+](=O)[O-])c3C)CCC2)cc1 1787331965 MTKQWVPISBNWGN-UHFFFAOYSA-N 482.924 5.223 5 20 JKBD COc1ccc(CC(=O)NC2(c3ccc(NC(=O)c4cccc5cc[nH]c45)cc3)CCC2)c([N+](=O)[O-])c1 1789094076 SSKFGULEVUKUDN-UHFFFAOYSA-N 498.539 5.075 5 20 JKBD Cc1cc2[nH]c(C(=O)Nc3ccc(C4(NC(=O)c5ccc(O)c([N+](=O)[O-])c5)CCC4)cc3)cc2s1 1790879558 VOQQDQBQBICFJT-UHFFFAOYSA-N 490.541 5.213 5 20 JKBD Cc1cc(Cl)cc(C(=O)Nc2ccc(C3(NC(=O)c4ccc([N+](=O)[O-])o4)CCC3)cc2)c1 1792111971 RHEQSFVGEFMVIF-UHFFFAOYSA-N 453.882 5.211 5 20 JKBD CC(C)=CCCC(=O)N1CCCC[C@@H]1c1cc(NC(=O)C2(c3cccc([N+](=O)[O-])c3)CCC2)n[nH]1 1820843884 XJYUTPIEEJEJSU-JOCHJYFZSA-N 479.581 5.178 5 20 JKBD CC1=CC[C@@H](C(=O)N2CCCC[C@@H]2c2cc(NC(=O)c3cc4cc([N+](=O)[O-])ccc4s3)n[nH]2)CC1 1821609773 MNESBUMZGZMUTJ-OXQOHEQNSA-N 493.589 5.585 5 20 JKBD CC1(C(=O)N2CCCC[C@H]2c2cc(NC(=O)c3cc4cc([N+](=O)[O-])ccc4s3)n[nH]2)CCC1 1821610901 JRMJPFFBACXLKW-KRWDZBQOSA-N 467.551 5.029 5 20 JKBD O=C(/C=C/c1cccs1)N1CCC([C@H]2CCCCN2C(=O)CSc2ccccc2[N+](=O)[O-])CC1 1831776716 WUABFCSPNCWSJJ-RQWLHQTBSA-N 499.658 5.082 5 20 JKBD C[C@H]1CC[C@H](C(=O)N2CCCC[C@@H]2C2CCN(C(=O)CSc3ccccc3[N+](=O)[O-])CC2)CC1 1832373571 SVSGWGUAFYABBZ-CEMLEFRQSA-N 487.666 5.133 5 20 JKBD O=C(CCc1ncc(-c2ccccc2)o1)Oc1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2Cl)cc1 9675208 OEMQTWSILQQPCA-UHFFFAOYSA-N 491.887 5.694 5 20 JKBD C[C@H](Sc1nc2ccc([N+](=O)[O-])cc2s1)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 10592828 JPUYXSWUCWUJKR-QMMMGPOBSA-N 472.426 5.251 5 20 JKBD O=C(O[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Br)c1ccccc1)c1ccccc1F 10730602 MTLKCBQMFOGXHW-LJQANCHMSA-N 473.254 5.033 5 20 JKBD Cc1ccc(Sc2ccc(C(=O)N3CCC[C@H](c4nnc5n4CCCCC5)C3)cc2[N+](=O)[O-])cc1 11546694 PJVFJGSJAKCWFS-FQEVSTJZSA-N 491.617 5.392 5 20 JKBD COCCN(C(=O)Cc1csc(-c2cccs2)n1)c1nc(-c2ccc([N+](=O)[O-])cc2)cs1 17346240 QNMVXSLVGQSNDO-UHFFFAOYSA-N 486.600 5.125 5 20 JKBD O=C(C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)OCC(=O)c1ccccc1F 18494035 IBVNTCQQRLAIQL-LGMDPLHJSA-N 476.485 5.700 5 20 JKBD Cc1c(NC(=O)[C@@H](C)Sc2nn(-c3ccc(Cl)cc3)c(=S)s2)cccc1[N+](=O)[O-] 23500224 PSZXGXJMYVCTBB-LLVKDONJSA-N 466.997 5.653 5 20 JKBD C[C@H](NC(=O)CSc1ccc(C(F)(F)F)cc1[N+](=O)[O-])c1ccccc1OC(F)F 26021184 YLVAXARRKKEDIZ-JTQLQIEISA-N 450.385 5.185 5 20 JKBD C[C@H](OC(=O)Cc1csc(-c2ccccc2Cl)n1)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl 26674397 WMTKLYGTYGXKNS-NSHDSACASA-N 480.329 5.138 5 20 JKBD NC(=O)c1cc(NC(=O)c2c3c(nc4ccccc24)/C(=C/c2ccc([N+](=O)[O-])cc2)CCC3)ccc1F 31986295 FPORHCDGMLONCV-SAPNQHFASA-N 496.498 5.510 5 20 JKBD COc1cc(C(=O)Nc2cccc(CN3CCOCC3)c2)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 109000497 IYKVWBDESKUROH-UHFFFAOYSA-N 497.935 5.134 5 20 JKBD C[C@H](Nc1ccc([N+](=O)[O-])c(C(=O)N2CCCC2)c1)c1ccc(OCc2ccc(F)cc2)cc1 487992604 KSDUGRGYFLXQJX-SFHVURJKSA-N 463.509 5.722 5 20 JKBD COc1ccc([N+](=O)[O-])c(C(=O)Nc2nc(-c3ccc(OC(F)F)cc3OC(F)F)cs2)c1 494020089 LCDPTPJKGJCKKQ-UHFFFAOYSA-N 487.387 5.182 5 20 JKBD Cc1ccc2sc(N(Cc3ccccc3)C(=O)c3ccc(-n4cncn4)c([N+](=O)[O-])c3)nc2c1C 496931475 COWUXNKXGVGJEM-UHFFFAOYSA-N 484.541 5.249 5 20 JKBD CCOC(=O)c1sc(NC(=O)c2ccc([N+](=O)[O-])cc2Cl)c(C(=O)OC(C)(C)C)c1C 498522308 KEGFIWFXGPTOCR-UHFFFAOYSA-N 468.915 5.002 5 20 JKBD C[C@H](Nc1ccc(C(=O)N(Cc2ccc([C@@H]3C[C@@H]3C)o2)C2CC2)cc1[N+](=O)[O-])c1ccccn1 506217655 KUVIDYOJANHQFU-XGHQBKJUSA-N 460.534 5.684 5 20 JKBD Cc1cc(C(=O)N2CCC[C@@H](C)C2)ccc1NC(=O)c1ccc(N2CCC[C@H](C)C2)c([N+](=O)[O-])c1 519023872 MHHFIURXNKGTMY-RBUKOAKNSA-N 478.593 5.264 5 20 JKBD CSc1ccc([N+](=O)[O-])c(C(=O)N2CCCC[C@H]2C(=O)Nc2cc(Cl)ccc2Cl)c1 523717373 QHKFQDDLMZOONH-SFHVURJKSA-N 468.362 5.257 5 20 JKBD COc1ccc(CN(Cc2ccc(OC)cc2)C(=O)Cn2c3ccccc3c(=O)c3ccccc32)cc1 590716518 HDGZJBMUCLYBTK-UHFFFAOYSA-N 492.575 5.401 5 20 JKBD CCN(CC(=O)Nc1ccccc1OC)C(=O)c1cc([N+](=O)[O-])ccc1Sc1ccc(Cl)cc1 603470796 MEQJYMKDOJCHLN-UHFFFAOYSA-N 499.976 5.509 5 20 JKBD O=C(Cc1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1)N1CCC[C@@H]1c1ccccc1 603839655 UJWAPZBJMKXYPC-RUZDIDTESA-N 452.514 5.354 5 20 JKBD COc1cc(CNCc2ccc(OC)c([N+](=O)[O-])c2)ccc1OCc1ccc(Br)cc1 604473812 MLRWCABUGPCGRS-UHFFFAOYSA-N 487.350 5.243 5 20 JKBD COc1ccc([C@H]2CCCCCN2C(=O)CSc2nc3cc4ccccc4cc3c(=O)n2C)cc1 613973420 XBTBHEMXXORFNG-RUZDIDTESA-N 487.625 5.331 5 20 JKBD O=C(O[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1)c1oc2ccccc2c1CO 726017847 OSVCPRYQWNXRMY-OAQYLSRUSA-N 480.860 5.024 5 20 JKBD Cc1ccc(C(=O)NC2CC2)cc1NC(=O)CCC(=O)c1ccc2ccc3cccc4ccc1c2c34 727755580 APGHWUUVSSKPSW-UHFFFAOYSA-N 474.560 6.386 5 20 JKBD Cc1ccc([N+](=O)[O-])cc1NC(=O)CNc1ccc(NC(=O)OC(C)(C)C)cc1C(F)(F)F 729675859 TWMADYFZJWXFGO-UHFFFAOYSA-N 468.432 5.320 5 20 JKBD Cc1csc(Sc2ccc(C(=O)O[C@@H](C)c3nnc(-c4ccc(F)cc4)o3)cc2[N+](=O)[O-])n1 746140225 KINUURYYEFIMSS-LBPRGKRZSA-N 486.506 5.618 5 20 JKBD CCOc1cc(NC(=O)c2nc(Cl)c(Cl)c(Cl)c2Cl)c([N+](=O)[O-])cc1OCC 790624561 LLBKEYGHWUNJTE-UHFFFAOYSA-N 469.108 5.653 5 20 JKBD O=C(C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)Nn1cnc2ccccc21 900787753 IBUGYLAWILBEQJ-LGMDPLHJSA-N 455.499 5.255 5 20 JKBD O=C(CCc1ncc(-c2ccc(Cl)cc2Cl)o1)OCc1nc(-c2cccc([N+](=O)[O-])c2)no1 914901096 SVBJOSVVVBIOIG-UHFFFAOYSA-N 489.271 5.283 5 20 JKBD C[C@H](NC(=O)C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)c1cccc([N+](=O)[O-])c1 917700450 HULVEULKONPYBP-HUCUOGIVSA-N 488.525 5.921 5 20 JKBD C[C@H](C(=O)NC1(c2ccc(NC(=O)Cc3ccc(Cl)cc3[N+](=O)[O-])cc2)CCC1)c1ccccn1 1786115645 BYTHQLWVLVIGKT-KRWDZBQOSA-N 492.963 5.124 5 20 JKBD Cc1ccoc1C(=O)Nc1ccc(C2(NC(=O)c3cccc([N+](=O)[O-])c3Br)CCC2)cc1 1788693056 NINFPRBWKFCBKG-UHFFFAOYSA-N 498.333 5.320 5 20 JKBD Cc1ccc(CC(=O)NC2(c3ccc(NC(=O)c4cc(C(C)C)no4)cc3)CCC2)cc1[N+](=O)[O-] 1790162022 CEZZTMYBIOIGEK-UHFFFAOYSA-N 476.533 5.005 5 20 JKBD O=C(Cc1ccc([N+](=O)[O-])cc1F)Nc1ccc(C2(NC(=O)c3cc4ccccc4o3)CCC2)cc1 1791183674 LVFRCXHLUHQPFI-UHFFFAOYSA-N 487.487 5.471 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)c3nc[nH]c3[N+](=O)[O-])CCC2)cc1)c1ccc(-c2ccccc2)cc1 1792166414 RCFDKQPFCHHLBJ-UHFFFAOYSA-N 481.512 5.046 5 20 JKBD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccccc1Oc1ccccc1)c1cc(F)cc([N+](=O)[O-])c1 1799551671 UTMIIPRGSDLVPR-WKCHPHFGSA-N 489.503 5.092 5 20 JKBD C[C@H]1CC[C@H](C(=O)N2CCC([C@@H]3CCCCN3C(=O)Cc3ccc(Cl)cc3[N+](=O)[O-])CC2)CC1 1824157716 BLMVNJCZWASVTM-LEDOBFOHSA-N 490.044 5.237 5 20 JKBD CC1=CC[C@H](C(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3c(F)ccc([N+](=O)[O-])c3C)CC2)CC1 1828351361 FEAKCXDESRQRHW-NZQKXSOJSA-N 471.573 5.022 5 20 JKBD COc1ccc(NC(=O)COC(=O)c2c3c(nc4ccccc24)/C(=C/c2ccco2)CC3)c([N+](=O)[O-])c1 9441328 QGQCWVVGNQUULV-DTQAZKPQSA-N 499.479 5.027 5 20 JKBD Cc1noc(C)c1COc1cc2ccccc2cc1C(=O)N(C)Cc1cc([N+](=O)[O-])ccc1Cl 10904775 LGSCXCFHMXCFNT-UHFFFAOYSA-N 479.920 5.857 5 20 JKBD CCn1c(SCC(=O)Nc2cc3c(cc2Cl)OCCCO3)nc2cc3ccccc3cc2c1=O 11061733 IQPUWOUROMSVHO-UHFFFAOYSA-N 495.988 5.115 5 20 JKBD O=[N+]([O-])c1cccc(-c2noc(CSc3nnc(-c4cccs4)n3Cc3ccccc3)n2)c1 31837889 MFBHAVYQGSCGOO-UHFFFAOYSA-N 476.543 5.305 5 20 JKBD O=C(C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)Nc1ccc2c(c1)CCC(=O)N2 33067051 RPZVSQJBCNUSBI-AQTBWJFISA-N 484.537 5.659 5 20 JKBD Cc1ccc(N2C(=O)CC[C@H](C(=O)Nc3cc([N+](=O)[O-])ccc3F)[C@@H]2c2cccs2)cc1 57564594 XFLDMDULLDKLLJ-HTAPYJJXSA-N 453.495 5.227 5 20 JKBD CC(C)(CNC(=O)Cn1c2ccccc2c(=O)c2ccccc21)c1cccc(C(F)(F)F)c1 72089034 VVGISICFRZAKCS-UHFFFAOYSA-N 452.476 5.268 5 20 JKBD Cc1c(Cl)cccc1-n1c(SCC(=O)c2cccc([N+](=O)[O-])c2)nnc1-c1ccncc1 216804255 XZCFGFHQUWJXDQ-UHFFFAOYSA-N 465.922 5.174 5 20 JKBD O=C(NC[C@@H]1CCCO[C@@H]1c1ccccc1)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 409547885 MKOKZYFHLRHELT-WMZHIEFXSA-N 491.510 5.114 5 20 JKBD C[C@H]1C[C@H](C)CN(c2ccc(C(=O)Nc3cc(Cl)ccc3C(=O)N3CCCC3)cc2[N+](=O)[O-])C1 485311635 HSUVOELNCSBSDP-IRXDYDNUSA-N 484.984 5.219 5 20 JKBD CCc1cc(O)nc(-c2cccc(NC(=O)c3ccc(N4C[C@H](C)C[C@@H](C)C4)c([N+](=O)[O-])c3)c2)n1 485759683 DIXHBFPSHVCVES-IAGOWNOFSA-N 475.549 5.054 5 20 JKBD O=C(NCc1cscn1)c1c2c(nc3ccccc13)/C(=C\c1ccc([N+](=O)[O-])cc1)CCC2 495565783 ZDRZUMDOSPCVPM-ATVHPVEESA-N 456.527 5.406 5 20 JKBD Cc1ccccc1-c1ccc(CN(C(=O)CSc2ccc(C(N)=O)cc2[N+](=O)[O-])C(C)C)s1 498412959 IVAHEPFJVDFPIW-UHFFFAOYSA-N 483.615 5.260 5 20 JKBD O=C(C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)NCc1ccc(F)cc1F 498918995 NGJQHZMFZYBXID-BOPFTXTBSA-N 465.481 5.730 5 20 JKBD COc1cc(C(=O)N(Cc2ccco2)C23CC4CC(CC(C4)C2)C3)c([N+](=O)[O-])cc1OC(F)F 498931424 UHHKCVFJAUQRAJ-UHFFFAOYSA-N 476.476 5.409 5 20 JKBD CN(CCc1ccccc1)C(=O)C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1 502030052 ZCFRKSFXFBLTHT-HEHNFIMWSA-N 457.555 5.836 5 20 JKBD CCSc1ccc([C@@H](C)NC(=O)c2ccc(N[C@@H](C)c3ccccn3)c([N+](=O)[O-])c2)cc1 504711587 JZWKBJZPCAAQFV-SJORKVTESA-N 450.564 5.766 5 20 JKBD O=C(NCc1ccccc1-c1ccc(Cn2ccnc2)cc1)c1cc2cc([N+](=O)[O-])ccc2o1 504775426 MDNHSFHVUVEBSD-UHFFFAOYSA-N 452.470 5.183 5 20 JKBD Cc1cc(NC(=O)c2ccccc2Sc2ccc(C(F)(F)F)cc2[N+](=O)[O-])ccc1C(N)=O 504834724 CXZCDJBIIZGZAH-UHFFFAOYSA-N 475.448 5.424 5 20 JKBD Cn1cnnc1Sc1ccc(C(=O)N2CCC(c3cccc4ccccc34)CC2)cc1[N+](=O)[O-] 509021259 GEQRQSHYZNLSOE-UHFFFAOYSA-N 473.558 5.048 5 20 JKBD Cc1cc([N+](=O)[O-])ccc1C(=O)Nc1ccc(NS(=O)(=O)c2c(Cl)cccc2Cl)cc1 511457600 BGKIQSYHPAEEGM-UHFFFAOYSA-N 480.329 5.263 5 20 JKBD C[C@H]1CN(C(=O)C/C(=C/c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)CC(C)(C)O1 518929461 UWRIXCMIVUBXOQ-JIHKLPAASA-N 451.548 5.161 5 20 JKBD C[C@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)Nc1ccc(N(C)C(=O)c2ccc(Cl)cc2)cc1 521249746 CFWAJMSGZOBTOT-AWEZNQCLSA-N 488.327 5.584 5 20 JKBD CNS(=O)(=O)c1ccc([C@H](C)NCc2ccc(Oc3cc(C)ccc3C(C)C)c([N+](=O)[O-])c2)cc1 521814037 QTAOQVFYOOJNSH-IBGZPJMESA-N 497.617 5.578 5 20 JKBD COc1ccc(CNC(=O)c2ccccc2Sc2ccc(C(F)(F)F)cc2[N+](=O)[O-])cc1OC 597990159 PBIXZIHTPVRJQJ-UHFFFAOYSA-N 492.475 5.712 5 20 JKBD O=C(Nc1ccc(C(=O)N2CCCC2)cc1)c1ccc(NCc2ccccc2Cl)c([N+](=O)[O-])c1 601974728 UTTDGWCWSBGCDH-UHFFFAOYSA-N 478.936 5.349 5 20 JKBD Cc1cc(-c2cc(C(=O)Nc3cc([N+](=O)[O-])ccc3OC(F)F)c3c(C)noc3n2)c(C)s1 603638683 RJIXIKFMRBNWBA-UHFFFAOYSA-N 474.445 5.638 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Br)[C@@H](NCc1cccc(Cl)c1)c1ccccc1 603744416 LOAZLGZJDBYPMX-FQEVSTJZSA-N 474.742 5.480 5 20 JKBD O=C(Nc1ccc(Br)cc1Br)c1cc2cc([N+](=O)[O-])ccc2s1 603819045 RJHCQJYUHZZQFI-UHFFFAOYSA-N 456.115 5.587 5 20 JKBD C[C@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)Nc1ccc(Cl)c(-c2nnc3n2CCCCC3)c1 604446821 WCNLHJYURHZNHD-ZDUSSCGKSA-N 490.347 5.293 5 20 JKBD COc1ccc(-c2csc(NC(=O)c3csc(-c4ccc([N+](=O)[O-])cc4)n3)n2)cc1OC 604516442 NZKDBAOQSLWTGJ-UHFFFAOYSA-N 468.516 5.111 5 20 JKBD O=[N+]([O-])c1ccc(-c2ccc(CNCc3ccnc(Oc4ccccc4)c3)o2)c(Br)c1 608836437 XKZMKOLMNSBGTA-UHFFFAOYSA-N 480.318 6.094 5 20 JKBD Cn1nc(C(F)(F)F)c(-c2ccc(Cl)cc2)c1NC(=O)c1ccc([N+](=O)[O-])cc1Cl 609090432 WPHSNQHVCGIXNQ-UHFFFAOYSA-N 459.211 5.573 5 20 JKBD O=C(Nc1ccccc1C(=O)N1CCCc2sccc2C1)c1ccc([N+](=O)[O-])cc1Cl 609332668 YNYNNWKFJMRNPE-UHFFFAOYSA-N 455.923 5.151 5 20 JKBD O=C(Oc1ccccc1C(=O)NCCCc1ccccc1)c1csc(-c2ccc([N+](=O)[O-])cc2)n1 729918955 PLVRAEIQGWDNLL-UHFFFAOYSA-N 487.537 5.300 5 20 JKBD O=C(CSc1nn(-c2ccc(Cl)cc2)c(=S)s1)Nc1cc(Cl)ccc1[N+](=O)[O-] 819915637 LJKDACNRLFQZNI-UHFFFAOYSA-N 473.388 5.609 5 20 JKBD Cc1cc([N+](=O)[O-])c(F)c(C(=O)Nc2nc(-c3cccc(Br)c3)cs2)c1F 826881741 DNWFKYVUQZKDSI-UHFFFAOYSA-N 454.252 5.320 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Cl)[C@@H](OC(=O)[C@H]1Cc2ccccc2S1)c1ccccc1 841978873 UBZVIOMHHAIRCG-RTWAWAEBSA-N 468.918 5.188 5 20 JKBD CSc1ccc(C(=O)c2ccccc2C(=O)N(C)c2nc3ccccc3s2)cc1[N+](=O)[O-] 844144990 PVCVEKRWIHHDHR-UHFFFAOYSA-N 463.540 5.434 5 20 JKBD COc1ccc(Oc2ccc(Cl)cc2NC(=O)c2cc([N+](=O)[O-])ccc2N2CCOCC2)cc1 912613460 PGHMTYYRNRPMCE-UHFFFAOYSA-N 483.908 5.138 5 20 JKBD COc1cc(/C=C/C(=O)Nc2cc([N+](=O)[O-])c(C)cc2C)ccc1OCc1c(C)noc1C 913416511 HCLQIQRLOWNFGZ-VQHVLOKHSA-N 451.479 5.056 5 20 JKBD Cc1csc(SCc2ccccc2C(=O)OCc2nc(-c3cccc([N+](=O)[O-])c3)no2)n1 914884937 MDKFGNCGGALFDN-UHFFFAOYSA-N 468.516 5.059 5 20 JKBD Cc1noc(C)c1CN(C)C(=O)c1c2c(nc3ccccc13)/C(=C/c1ccc([N+](=O)[O-])cc1)CCC2 915195186 LSJOQNHMGKWTSP-HMMYKYKNSA-N 482.540 5.897 5 20 JKBD CC(C)N(Cc1nnc(-c2cccc([N+](=O)[O-])c2)o1)C(=O)CCCc1ccc(Cl)c(Cl)c1 917590784 FNRQRFZHPOZYBQ-UHFFFAOYSA-N 477.348 5.712 5 20 JKBD O=C(Cn1ccc2ccccc21)O[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1 918770970 IGYFVNNBMLZSBJ-HSZRJFAPSA-N 463.877 5.126 5 20 JKBD C[C@@H](Nc1ccc(C(=O)Oc2cccc(Oc3ccccn3)c2)cc1[N+](=O)[O-])c1ccccn1 920107796 JYDNGDQMYKTNCU-QGZVFWFLSA-N 456.458 5.569 5 20 JKBD COc1cc(C(=O)NC2(c3ccc(NC(=O)/C=C/C4CCCC4)cc3)CCC2)ccc1[N+](=O)[O-] 1790514215 BEMBNAMVOGGLPP-VGOFMYFVSA-N 463.534 5.098 5 20 JKBD O=C(NC1(c2ccc(NC(=O)c3cccc(F)c3Cl)cc2)CCC1)c1ccc([N+](=O)[O-])o1 1790668103 CPKBQOXDENBRJU-UHFFFAOYSA-N 457.845 5.042 5 20 JKBD Cc1ccc(C(=O)NC2(c3ccc(NC(=O)c4cc5cc([N+](=O)[O-])ccc5s4)cc3)CCC2)o1 1791009958 CXGJHIQYHLATNL-UHFFFAOYSA-N 475.526 5.772 5 20 JKBD CC(C)=CCCC(=O)NC1(c2ccc(NC(=O)CSc3ccccc3[N+](=O)[O-])cc2)CCC1 1791522855 ARQHPZAQQXYHCB-UHFFFAOYSA-N 467.591 5.567 5 20 JKBD Cc1c(C(=O)N2CC[C@@H](CNC(=O)[C@H]3CC[C@H](C)CC3)[C@H]2c2cccnc2)cc(Cl)cc1[N+](=O)[O-] 1813550403 YVGVLNMNWOHQMA-LRYGAUQLSA-N 499.011 5.098 5 20 JKBD Cc1cccc(Cl)c1C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2ccc([N+](=O)[O-])cc2F)n[nH]1 1821052463 LJQZTFAJQBENNB-LJQANCHMSA-N 485.903 5.039 5 20 JKBD CC1(C)CCC(CC(=O)N2CCCC[C@@H]2c2cc(NC(=O)Cc3ccc([N+](=O)[O-])cc3F)n[nH]2)CC1 1821843650 CZYBFIQUEMCOAR-JOCHJYFZSA-N 499.587 5.298 5 20 JKBD O=C(CC1CCC1)Nc1cc([C@H]2CCCCN2C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)[nH]n1 1823432221 GDDSCDSANIOBSK-GOSISDBHSA-N 467.551 5.029 5 20 JKBD COc1cc(C(=O)N2CCC([C@@H]3CCCCN3C(=O)c3cccc(Cl)c3C)CC2)ccc1[N+](=O)[O-] 1823918349 HZSRZASGQIOHKL-QFIPXVFZSA-N 499.995 5.112 5 20 JKBD Cc1ccc(CC(=O)N2CCC([C@@H]3CCCCN3C(=O)c3ccc(Cl)cc3)CC2)cc1[N+](=O)[O-] 1830028269 WOWNKNCGODLRDD-QHCPKHFHSA-N 483.996 5.033 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)N1CCCC[C@@H]1C1CCN(C(=O)C2(c3ccccc3)CC2)CC1 1830729314 DNRXMDQNBQQNRF-XMMPIXPASA-N 493.579 5.007 5 20 JKBD Cc1ccc(-c2ccccc2C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)CCc2cccc([N+](=O)[O-])c2)cc1 1847995568 QGTARELEUFXNLO-SVBPBHIXSA-N 483.568 5.018 5 20 JKBD Cc1cccc([N+](=O)[O-])c1NC(=O)CSc1nnc(-c2ccccc2Cl)n1C1CCCC1 8988515 BWXDLDBBGUQVMH-UHFFFAOYSA-N 471.970 5.661 5 20 JKBD C[C@@H](OC(=O)c1ccccc1COc1ccccc1)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl 10851762 ASNQVZVYVUVIQD-OAHLLOKOSA-N 454.866 5.011 5 20 JKBD Cc1cccc(-c2nnc(S[C@H](C)C(=O)Nc3ccc([N+](=O)[O-])cc3Cl)n2Cc2ccco2)c1 22045544 SZDZRJVZSNHIHZ-OAHLLOKOSA-N 497.964 5.576 5 20 JKBD C[C@@H](Sc1nc(C(F)(F)F)nc2ccccc12)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl 22248117 REIBUJNXBMRPIV-SECBINFHSA-N 456.833 5.330 5 20 JKBD CC(C)OC(=O)C[C@H](NC(=O)Cc1csc(-c2ccccc2Cl)n1)c1ccccc1[N+](=O)[O-] 24483612 LCCUMIVLSNVKTH-IBGZPJMESA-N 487.965 5.113 5 20 JKBD O=C(COC(=O)Cc1csc(-c2ccc(C(F)(F)F)cc2)n1)Nc1cc(Cl)ccc1[N+](=O)[O-] 25661729 ZWONKRDIRJHUQJ-UHFFFAOYSA-N 499.854 5.115 5 20 JKBD CC(C)Cn1c(SCC(=O)N(C)c2ccc([N+](=O)[O-])cc2)nnc1-c1ccc(Cl)cc1Cl 105345642 QOTRXMVZSRJKIF-UHFFFAOYSA-N 494.404 5.571 5 20 JKBD O=C(Nc1nc2ccc(OCC(F)(F)F)cc2s1)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-] 107806480 YYILMEADAGCPGI-UHFFFAOYSA-N 495.357 5.339 5 20 JKBD C[C@H](NC(=O)c1cc([N+](=O)[O-])ccc1N1CCCC1)c1ccc(NC(=O)Nc2ccccc2)cc1 108601533 VCOLXDPDGRAHSY-SFHVURJKSA-N 473.533 5.330 5 20 JKBD CCOc1cc(C(=O)N(Cc2ccc(Cl)c(Cl)c2)Cc2ccccn2)c([N+](=O)[O-])cc1OC 499610854 LEDRXILNVALHIX-UHFFFAOYSA-N 490.343 5.547 5 20 JKBD COc1ccc(NC(=O)C2CCN(c3ccc(C(F)(F)F)cc3[N+](=O)[O-])CC2)c(C(F)(F)F)c1 500778700 KMRLGHIHHCSVMG-UHFFFAOYSA-N 491.388 5.496 5 20 JKBD C[C@H](SC(c1ccccc1)c1ccccc1)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 502548512 VPPAFOWDTITQAY-HNNXBMFYSA-N 460.477 6.463 5 20 JKBD CCOc1ccc(-c2nc(NC(=O)c3cn(C)nc3-c3ccc([N+](=O)[O-])cc3)sc2C)cc1 506244923 FUNKUWWCZLVABL-UHFFFAOYSA-N 463.519 5.078 5 20 JKBD COc1ccc(NC(=O)c2cc3cc([N+](=O)[O-])ccc3s2)cc1OCc1cn2ccccc2n1 511883332 DNFDSVAQAKMGDN-UHFFFAOYSA-N 474.498 5.297 5 20 JKBD COCCOc1cc(C)ccc1NC(=O)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1 515685511 GWOYBBILUZQNFG-UHFFFAOYSA-N 456.882 5.626 5 20 JKBD CC1CCN(Cc2ccc(NC(=O)c3ccc(N[C@@H](C)c4ccccn4)c([N+](=O)[O-])c3)cc2)CC1 516596095 JFNZTZUWOFBJNV-FQEVSTJZSA-N 473.577 5.647 5 20 JKBD COc1ccc(CNCc2c(OC)ccc3ccccc23)cc1OCc1ccc([N+](=O)[O-])cc1 518269376 BJDFKATVJPLAGP-UHFFFAOYSA-N 458.514 5.634 5 20 JKBD C[C@@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)Nc1ccc(NC(=O)c2ccoc2)cc1C(F)(F)F 518857845 DZASOJKZULGWOS-LLVKDONJSA-N 497.813 5.518 5 20 JKBD Cc1ccc(NC(=O)c2cccc(C(F)(F)F)c2)cc1NC(=O)Cn1ccc2cc([N+](=O)[O-])ccc21 521564549 DNYXPVLCWVEKKA-UHFFFAOYSA-N 496.445 5.768 5 20 JKBD O=C(Nc1ccccc1OCc1ncc(-c2cccc(Cl)c2)o1)c1csc([N+](=O)[O-])c1 524210408 ZZHOTIBELJUFOY-UHFFFAOYSA-N 455.879 5.796 5 20 JKBD C[C@H]([C@H]1C[C@H]2CC[C@H]1C2)n1c(SCC(=O)Nc2ccccc2[N+](=O)[O-])nnc1-c1ccco1 594533790 CQSOGTKEJIRIIC-LTIDMASMSA-N 467.551 5.174 5 20 JKBD CSc1ccc(C(=O)Nc2ccc(NC(=O)c3ccccc3)cc2C(F)(F)F)cc1[N+](=O)[O-] 603742908 KLMSXQQVVVSFRB-UHFFFAOYSA-N 475.448 5.840 5 20 JKBD COCCOc1cc([N+](=O)[O-])c(C(=O)Nc2cc(Cl)ccc2Sc2ccccc2)cc1OC 619564588 ALIJVJSMYGXZAF-UHFFFAOYSA-N 488.949 5.686 5 20 JKBD CCc1cccc2c1OCC[C@H]2NC(=O)c1ccccc1NC(=O)c1ccc([N+](=O)[O-])cc1Cl 725758945 UQUNASGNBPDEPJ-JOCHJYFZSA-N 479.920 5.317 5 20 JKBD Cc1cc(C(=O)Nc2cccc(NC(=O)c3cccc(C(F)(F)F)c3)c2)c(N)c([N+](=O)[O-])c1 729536485 FRTCXTXOOQSOSZ-UHFFFAOYSA-N 458.396 5.009 5 20 JKBD Cc1noc2nc(-c3ccc(F)cc3)cc(C(=O)O[C@@H](C)C(=O)Nc3ccc([N+](=O)[O-])cc3Cl)c12 813337312 XGXJFRUWKLEWPI-LBPRGKRZSA-N 498.854 5.083 5 20 JKBD CCc1cccc[n+]1/C(C(=S)Nc1ccc(Cl)cc1)=C(/O)c1ccc(C)c([N+](=O)[O-])c1 839395896 CTKBSOOJHNYFMF-UHFFFAOYSA-O 454.959 5.730 5 20 JKBD CCCOc1c(Cl)cc(C(=O)N(Cc2nnc(-c3cccc([N+](=O)[O-])c3)o2)C(C)C)cc1OC 864244611 FWJINDKCUYTYPW-UHFFFAOYSA-N 488.928 5.146 5 20 JKBD O=[N+]([O-])c1ccc(NCCCc2nc(-c3cccc(Cn4cnc5ccccc54)c3)no2)cc1 904492443 URNUVXCTOMYYAS-UHFFFAOYSA-N 454.490 5.088 5 20 JKBD O=C(COC(=O)c1ccccc1SC(F)(F)F)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 914947763 NBMSQJYJWBCAOM-UHFFFAOYSA-N 468.331 5.021 5 20 JKBD C[C@@H](OC(=O)c1cc([N+](=O)[O-])ccc1Oc1ccccc1)C(=O)Nc1c(F)c(F)c(F)c(F)c1F 919191552 GKUAYBAUIGVKOD-SNVBAGLBSA-N 496.344 5.267 5 20 JKBD CC(C)N(Cc1nnc(-c2cccc([N+](=O)[O-])c2)o1)C(=O)C[C@H](C)c1ccc(C(F)(F)F)cc1 920017178 JTNXAHZBKCHOMI-HNNXBMFYSA-N 476.455 5.594 5 20 JKBD O=C(NC1(c2ccc(NC(=O)[C@H]3CCC(F)(F)C3)cc2)CCC1)c1cc2cc([N+](=O)[O-])ccc2s1 1785805121 SFQZOABNWMRUJT-HNNXBMFYSA-N 499.539 5.993 5 20 JKBD C[C@H](C(=O)NC1(c2ccc(NC(=O)c3ccc([N+](=O)[O-])[nH]3)cc2)CCC1)c1ccc(Cl)cc1 1790183604 KLHAIRANWMMLQH-HNNXBMFYSA-N 466.925 5.128 5 20 JKBD CC(C)(C)CCCCCC(=O)Nc1ccc(C2(NC(=O)c3n[nH]cc3[N+](=O)[O-])CCC2)cc1 1791381825 FPYYMOAQWOFXOX-UHFFFAOYSA-N 455.559 5.062 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)N1CCCC[C@@H]1c1cc(NC(=O)C23CCC(CC2)CC3)n[nH]1 1822961623 ZMIAIOJCDRFNHK-RKLYKTOLSA-N 483.544 5.042 5 20 JKBD O=C(c1ccc([N+](=O)[O-])cc1F)N1CCC([C@@H]2CCCCN2C(=O)CCCc2ccccc2F)CC1 1824165917 AFXBCUUDZYVQQY-VWLOTQADSA-N 499.558 5.129 5 20 JKBD CC(C)(C)CC(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cccc([N+](=O)[O-])c2Br)CC1 1826337945 KTPPQEGOOOJVAY-SFHVURJKSA-N 494.430 5.027 5 20 JKBD O=C(/C=C/c1ccccc1[N+](=O)[O-])N1CCC([C@@H]2CCCCN2C(=O)c2cccc(F)c2Cl)CC1 1830575275 QOCOYTUULUVUAU-LEQVUBRHSA-N 499.970 5.334 5 20 JKBD O=C(C1CC2(CCC2)C1)N1CCCC[C@@H]1C1CCN(C(=O)C2(c3cccc([N+](=O)[O-])c3)CCC2)CC1 1832477097 PVNNLBAAJFBFQM-RUZDIDTESA-N 493.648 5.217 5 20 JKBD O=C(c1cccc2cnccc12)N1CCC([C@H]2CCCCN2C(=O)/C=C/c2ccccc2[N+](=O)[O-])CC1 1832906624 DJZWAAUXBVYUDU-TYBKAHOSSA-N 498.583 5.090 5 20 JKBD O=C(c1cc2cc([N+](=O)[O-])ccc2s1)N1CC2(CCCN2C(=O)c2c[nH]c3cc(Cl)ccc23)C1 1843700756 PGEKDIFKFOZBDE-UHFFFAOYSA-N 494.960 5.075 5 20 JKBD Cc1ccc(NC(=O)[C@@H](OC(=O)c2cc(C)nc3c2cnn3C(C)C)c2ccccc2)c([N+](=O)[O-])c1 10205704 BYEDNLSDMSFOTG-QHCPKHFHSA-N 487.516 5.074 5 20 JKBD Cc1cc(-c2cc(C(=O)OCc3cc([N+](=O)[O-])cc4c3OCOC4)c3cnn(C(C)C)c3n2)c(C)o1 10954841 RUJGKGPIYMCINJ-UHFFFAOYSA-N 492.488 5.021 5 20 JKBD O=C(O[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1)c1cc(F)c(F)cc1Cl 11400615 YPHJPBPAVBWYFA-IBGZPJMESA-N 481.238 5.717 5 20 JKBD O=C(O[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1)c1cnn(Cc2ccccc2)c1 12854141 AYFOKPXEVZJDIG-HSZRJFAPSA-N 490.903 5.030 5 20 JKBD Cc1cccc(-c2nnc([C@@H](C)OC(=O)c3ccccc3C(=O)c3ccc(Cl)c([N+](=O)[O-])c3)o2)c1 17528577 MHCPYKDQPCPVLU-OAHLLOKOSA-N 491.887 5.756 5 20 JKBD CC(=O)N(c1cccc(C(F)(F)F)c1)c1nc(COC(=O)c2ccc(C)c([N+](=O)[O-])c2)cs1 23568264 DVUHNPAEIPKIBZ-UHFFFAOYSA-N 479.436 5.420 5 20 JKBD CCn1c(S[C@@H](C)C(=O)Nc2ccccc2Br)nc2cc3ccccc3cc2c1=O 26581002 FXDJNYFJGYLGIN-AWEZNQCLSA-N 482.403 5.451 5 20 JKBD CN(Cc1cc([N+](=O)[O-])ccc1Cl)Cn1nc(COc2ccccc2Cl)n(C2CC2)c1=S 27533241 RIKIMOMGOCGLNU-UHFFFAOYSA-N 494.404 5.632 5 20 JKBD C[C@@H](Nc1ccc(C(=O)N2CCC(c3cccc4ccccc34)CC2)cc1[N+](=O)[O-])c1ccccn1 476143680 IWLSBSMEPXWAQY-HXUWFJFHSA-N 480.568 6.336 5 20 JKBD Cc1ccc(C(=O)Nc2ccccc2)cc1NC(=O)Cn1c2ccccc2c(=O)c2ccccc21 483298654 STIVUWRGRAPFCX-UHFFFAOYSA-N 461.521 5.354 5 20 JKBD C[C@H](NC(=O)CCCNc1ccc([N+](=O)[O-])cc1)c1ccc(NC(=O)c2ccc(F)cc2)cc1 491232679 QNRJDLYKAJGCMZ-KRWDZBQOSA-N 464.497 5.056 5 20 JKBD O=C(Nc1ccc(CC(=O)N2CCc3ccccc32)cc1)c1csc(-c2ccc([N+](=O)[O-])cc2)n1 501686091 FRUWOBSUWLWSEP-UHFFFAOYSA-N 484.537 5.102 5 20 JKBD COc1ccc(Oc2ccc([N+](=O)[O-])cc2C(=O)Nc2ccc(CCC(=O)N3CCCC3)cc2)cc1 510160234 QSIDWNFSOUEFKR-UHFFFAOYSA-N 489.528 5.203 5 20 JKBD COc1cc(C(=O)NCC2(c3ccc(F)cc3)CCCCC2)c([N+](=O)[O-])cc1OCc1cscn1 510173425 ALVLABNNDIVCEK-UHFFFAOYSA-N 499.564 5.410 5 20 JKBD CCN(Cc1ccc(Cl)c(Cl)c1)C(=O)c1cc(OC)c(OCc2cscn2)cc1[N+](=O)[O-] 512622615 NEWRCQYHEKDNGD-UHFFFAOYSA-N 496.372 5.608 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Br)[C@@H](NCc1csc2ccccc12)c1ccccc1 515526570 HAUAGMHEODPMMZ-QFIPXVFZSA-N 496.386 6.042 5 20 JKBD COc1ccc(CNCc2ccc(-c3ccc([N+](=O)[O-])cc3Br)o2)cc1Br 520218565 KEBZMWPSCGNXHY-UHFFFAOYSA-N 496.155 5.678 5 20 JKBD COc1ccc([C@@H](Cc2ccc(F)cc2)N[C@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)cc1 520627534 RKIAXECUYFKXCH-IQMFZBJNSA-N 471.916 5.297 5 20 JKBD COCCN(C(=O)c1oc2ccc(OC)cc2c1C)c1nc(-c2ccc([N+](=O)[O-])cc2)cs1 603461070 KONKRDROAFPFQF-UHFFFAOYSA-N 467.503 5.075 5 20 JKBD O=C(Nc1ccccc1OCc1ncc(-c2cccc(Cl)c2)o1)c1ccc([N+](=O)[O-])cc1F 608851133 SCSDXWZMTBJSHV-UHFFFAOYSA-N 467.840 5.874 5 20 JKBD COc1ccc(CC(=O)Nc2nnc(SCc3c(Cl)cccc3Cl)s2)cc1[N+](=O)[O-] 609009381 RQUMSESFDHDRLO-UHFFFAOYSA-N 485.374 5.235 5 20 JKBD C[C@@H](Nc1ccc(C(=O)N[C@H](CN2CCCCC2)c2ccccc2)cc1[N+](=O)[O-])c1ccccn1 609018436 ZMWKDIAUTINCMD-CJFMBICVSA-N 473.577 5.120 5 20 JKBD COc1ccc(NS(=O)(=O)c2c(Cl)cccc2[N+](=O)[O-])cc1OCc1ccc2ccccc2n1 609069498 MLXHWKRIQGARMQ-UHFFFAOYSA-N 499.932 5.185 5 20 JKBD COc1cc([C@@H]2Nc3ccccc3C(=O)N2CC(F)(F)F)ccc1OCc1ccc([N+](=O)[O-])cc1 726875141 NEVRRXOEMMLDTH-JOCHJYFZSA-N 487.434 5.311 5 20 JKBD C[C@@H](OC(=O)c1csc(-c2ccccc2Cl)n1)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl 727564426 XWVKWFSAMZKZHT-SNVBAGLBSA-N 466.302 5.209 5 20 JKBD C[C@H](OC(=O)c1sccc1-c1ccc(F)cc1)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 744608727 UIMCEXCOSONMHV-NSHDSACASA-N 482.411 5.665 5 20 JKBD Cc1ccc(-c2nc(C)c(C(=O)OCC(=O)Nc3ccc([N+](=O)[O-])cc3Cl)s2)c(C)c1 746596329 QXVANVFDJKSBNR-UHFFFAOYSA-N 459.911 5.092 5 20 JKBD COc1ccc([C@@H](NC(=O)c2cc([N+](=O)[O-])ccc2Br)c2ccc(C)cc2)cc1 751108029 MIZWLMQHOWXWMZ-NRFANRHFSA-N 455.308 5.194 5 20 JKBD CC(C)N(Cc1nnc(-c2cccc([N+](=O)[O-])c2)o1)C(=O)c1ccc(-c2nc3ccccc3s2)o1 864244915 UXJHJDCAHDXABN-UHFFFAOYSA-N 489.513 5.565 5 20 JKBD O=C(Cc1noc(-c2ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])cc2)n1)Nc1ccccc1 904382864 KNPPJODOYAWFNL-UHFFFAOYSA-N 450.838 5.272 5 20 JKBD CSCC[C@@H](NC(=O)c1cccc([N+](=O)[O-])c1)C(=O)O[C@H](C)c1ccc(Cl)cc1Cl 920164959 UITKLJSYLFLKAB-KZULUSFZSA-N 471.362 5.058 5 20 JKBD Cc1cc(C(=O)Oc2ccc(NC(=O)c3cc([N+](=O)[O-])ccc3Cl)cc2)c2c(C(C)C)noc2n1 920838913 NBDHDWQQUBDXII-UHFFFAOYSA-N 494.891 5.688 5 20 JKBD CC(=O)N(c1nc(COC(=O)c2cc(C)cc([N+](=O)[O-])c2)cs1)c1c(C)cc(C)cc1Cl 920901592 WFQOWQNHNJHKQU-UHFFFAOYSA-N 473.938 5.672 5 20 JKBD O=C(COc1cccc2cccnc12)Oc1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2Cl)cc1 923385162 WMLKZTSDRGGAEM-UHFFFAOYSA-N 477.860 5.033 5 20 JKBD O=C(/C=C/c1ccc([N+](=O)[O-])o1)Nc1ccc(C2(NC(=O)c3ccc(-c4cc[nH]n4)cc3)CCC2)cc1 1786207739 LCTLEFKZZTWLRS-ZRDIBKRKSA-N 497.511 5.039 5 20 JKBD Cc1cccc(CC(=O)Nc2ccc(C3(NC(=O)C4(c5cccc([N+](=O)[O-])c5)CCC4)CCC3)cc2)n1 1786212304 JTKIQDJJRIYCPF-UHFFFAOYSA-N 498.583 5.097 5 20 JKBD O=C(CCc1cccc([N+](=O)[O-])c1)Nc1ccc(C2(NC(=O)c3cnc4ccoc4c3)CCC2)cc1 1786600524 XVCOULAMYLNHIG-UHFFFAOYSA-N 484.512 5.117 5 20 JKBD O=C(C[C@@H]1C[C@@H]2CC[C@H]1C2)Nc1ccc(C2(NC(=O)c3cc([N+](=O)[O-])cc4c3OCC4)CCC2)cc1 1791323913 OKRZSJJMJBJUON-HBFSDRIKSA-N 489.572 5.104 5 20 JKBD Cc1ccc(CC(=O)Nc2ccc(C3(NC(=O)c4cc5cc([N+](=O)[O-])ccc5s4)CCC3)cc2)o1 1791949485 VTMDBYHWULVSBG-UHFFFAOYSA-N 489.553 5.701 5 20 JKBD O=C(CCc1cccc([N+](=O)[O-])c1)NC1(c2ccc(NC(=O)[C@]3(F)CCCC=C3F)cc2)CCC1 1792374184 PRKVAQOVMNBMDK-SANMLTNESA-N 483.515 5.407 5 20 JKBD Cc1c(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cccc(C(F)(F)F)c2)C3)cc(Cl)cc1[N+](=O)[O-] 1800711349 JVGWFKOOAPIJAL-BCDXTJNWSA-N 495.885 5.141 5 20 JKBD C/C(=C\c1ccc(C)o1)C(=O)Nc1cc([C@H]2CCCCN2C(=O)/C=C/c2ccccc2[N+](=O)[O-])[nH]n1 1819493064 CJEPEHXBOUIYCK-GDUUISJWSA-N 489.532 5.028 5 20 JKBD O=C(c1cc2ccoc2s1)N1CCC([C@H]2CCCCN2C(=O)c2cc(F)cc([N+](=O)[O-])c2)CC1 1830614017 MMCUYTXHSQGFNU-HXUWFJFHSA-N 485.537 5.089 5 20 JKBD CCn1c(SCC(=O)Nc2ccc([N+](=O)[O-])cc2C)nc2scc(-c3cccs3)c2c1=O 9750707 USUUYLWONJRHBK-UHFFFAOYSA-N 486.600 5.154 5 20 JKBD CCN(c1ccccc1)S(=O)(=O)c1ccc(Oc2c(F)c(F)cc(F)c2F)c([N+](=O)[O-])c1 15128311 DNMXWCFUEHBKSU-UHFFFAOYSA-N 470.400 5.159 5 20 JKBD Cc1c(NC(=O)[C@H](C)Sc2nnc(-c3ccc(F)cc3)c3ccccc23)cccc1[N+](=O)[O-] 21860537 OBDUDYSKHOHOCB-HNNXBMFYSA-N 462.506 5.772 5 20 JKBD C[C@H](Sc1nc2cc3ccccc3cc2c(=O)n1C)C(=O)Nc1cccc(Cl)c1Cl 22253193 XBJFHVAZZNPRCX-LBPRGKRZSA-N 458.370 5.513 5 20 JKBD C[C@@H](c1nnc(-c2cccc(Cl)c2)o1)N1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 24811944 HDOSDEZFCNWEFZ-ZDUSSCGKSA-N 481.862 5.200 5 20 JKBD Cc1nc(CSc2ccc(C(=O)O[C@H](C)C(=O)Nc3cccc([N+](=O)[O-])c3C)cc2)cs1 28895278 XVIHGGGFOUCQSY-CQSZACIVSA-N 471.560 5.144 5 20 JKBD CC(C)CCSc1ccc(C(=O)Nc2ccc(NC(=O)[C@H]3CCCO3)cc2)cc1[N+](=O)[O-] 30506722 XGGCCWCRFMESEG-HXUWFJFHSA-N 457.552 5.103 5 20 JKBD COc1cc(CN(C)C(=O)c2ccc(N[C@@H](C)c3ccccn3)c([N+](=O)[O-])c2)ccc1SC 477817148 LRPOEMJONSADON-INIZCTEOSA-N 466.563 5.166 5 20 JKBD CCN(C(=O)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1)[C@H](C)c1ccc(F)cc1 488695358 KYWANMNHCHDMPX-OAHLLOKOSA-N 467.463 5.579 5 20 JKBD Cc1ccc(S(=O)(=O)Nc2ccc(NC(=O)c3sc4nccc(C)c4c3C)cc2)cc1[N+](=O)[O-] 497485553 XALLWEPWBSZLMS-UHFFFAOYSA-N 496.570 5.183 5 20 JKBD CC(=O)Nc1cccc([C@H](C)NC(=O)c2ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])cc2)c1 498537202 PRZDPJGXMBSAMB-AWEZNQCLSA-N 453.882 5.490 5 20 JKBD Cc1ccccc1[C@@H]1CCN(C(=O)c2ccccc2NC(=O)c2ccc([N+](=O)[O-])cc2Cl)C1 504953049 FRTSYIIPHQZWDZ-QGZVFWFLSA-N 463.921 5.439 5 20 JKBD Cc1nc(-c2cccc(NC(=O)c3ccc(N[C@@H](C)c4ccccn4)c([N+](=O)[O-])c3)c2)cs1 505990956 JENCDZSYGIRNEE-HNNXBMFYSA-N 459.531 5.847 5 20 JKBD COc1ccc(F)cc1-c1csc(NC(=O)c2ccc(N[C@@H](C)c3ccccn3)c([N+](=O)[O-])c2)n1 507354134 RNLMZJZQBWVVTP-AWEZNQCLSA-N 493.520 5.686 5 20 JKBD CN(CCCCCc1cc(-c2ccc(F)cc2)n[nH]1)C(=O)c1cn(C)nc1-c1ccc([N+](=O)[O-])cc1 508359854 PFNLPLFKHIVXKY-UHFFFAOYSA-N 490.539 5.010 5 20 JKBD CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccc(OCc2ccccn2)c(Cl)c1 510001407 FXKUUXTWNQDYPJ-UHFFFAOYSA-N 454.914 5.665 5 20 JKBD COc1cccc([C@H](C)N[C@@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Br)c2ccccc2)c1 511014596 MSERGHPFFUEAOQ-OYHNWAKOSA-N 484.350 5.397 5 20 JKBD C[C@H](Nc1ccc(C(=O)Nc2ccc(OC(F)F)c(Cl)c2)cc1[N+](=O)[O-])c1ccccn1 516161826 NQBUEZWJUDNMRX-LBPRGKRZSA-N 462.840 5.670 5 20 JKBD O=C(c1csc(-c2c(F)cccc2F)n1)N(Cc1ccccc1[N+](=O)[O-])CC(F)(F)F 523183946 ZCRCYKGYEFHRIL-UHFFFAOYSA-N 457.380 5.201 5 20 JKBD C[C@H]1CCCN(c2ccc(C(=O)N3CCC[C@@H]3c3nc4ccccc4s3)cc2[N+](=O)[O-])C1 598675165 UHJJZJBQSAARJL-OXJNMPFZSA-N 450.564 5.418 5 20 JKBD COCCN(C(=O)C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)C1CCCC1 603529047 DTLDGAIXPQAQAT-MNDPQUGUSA-N 465.575 5.553 5 20 JKBD O=C(C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)NCc1ccc(-n2cccn2)cc1 603741963 OWOFHBANBOIHMR-LTGZKZEYSA-N 495.564 5.637 5 20 JKBD COCCN(C(=O)c1oc2c(F)cccc2c1C)c1nc(-c2ccc([N+](=O)[O-])cc2)cs1 603882156 REYUVHZGXYZUOA-UHFFFAOYSA-N 455.467 5.205 5 20 JKBD CCC(C)(C)NC(=O)c1ccc(NC(=O)c2ccc(Cn3nc(C)c([N+](=O)[O-])c3C)cc2)cc1Cl 603987013 GXFFXMPELVFMED-UHFFFAOYSA-N 497.983 5.281 5 20 JKBD O=C(C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1)N(CC1CC1)C1CCCCC1 609021523 IMNGTTVNQNLQGP-UHFFFAOYSA-N 453.505 5.401 5 20 JKBD CCCc1cc[n+](/C(C(=S)Nc2ccc(OC)c(Cl)c2)=C(/O)c2ccc([N+](=O)[O-])cc2)cc1 726962991 XDQROELKURQPEZ-UHFFFAOYSA-O 484.985 5.820 5 20 JKBD CCC(CC)c1cc[n+](/C(C(=S)Nc2ccc(OC)nc2)=C(/O)c2cccc([N+](=O)[O-])c2)cc1 726963712 XYOCKRFUFAMRGX-UHFFFAOYSA-O 479.582 5.513 5 20 JKBD CC(C)Sc1ccc(Cl)cc1NC(=O)c1cc([N+](=O)[O-])ccc1I 729411020 MHCMRTZURWGQMA-UHFFFAOYSA-N 476.723 5.606 5 20 JKBD O=C(Nc1nc(-c2ccc3ccccc3c2)cs1)c1cc([N+](=O)[O-])ccc1Br 751050881 UVTRAUZEASJWLS-UHFFFAOYSA-N 454.305 5.886 5 20 JKBD CC(C)n1ncc2c(C(=O)N(C)Cc3cc([N+](=O)[O-])ccc3Cl)cc(-c3ccccc3)nc21 758854422 RQJBPIGUTASZNN-UHFFFAOYSA-N 463.925 5.513 5 20 JKBD O=C(COC(=O)c1cc([N+](=O)[O-])ccc1Sc1ccccc1)Nc1ccccc1OC(F)F 778960666 NJPRJOVWRXBFEQ-UHFFFAOYSA-N 474.441 5.143 5 20 JKBD CCCOc1cc(NC(=O)c2cc3cc(OC)ccc3nc2C)c([N+](=O)[O-])cc1OCCC 809863012 FPXOPWPNWZPLGD-UHFFFAOYSA-N 453.495 5.290 5 20 JKBD C[C@H](OC(=O)c1cc2ccccc2n1Cc1ccccc1F)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 919377867 UXCWNNANJULXHW-INIZCTEOSA-N 486.459 5.705 5 20 JKBD C[C@H](OC(=O)[C@@H](C)Sc1cc(Cl)ccc1Cl)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 919509303 NSQGLZKVUNZBFV-WDEREUQCSA-N 468.318 5.737 5 20 JKBD COc1cc2c(cc1NC(=O)COC(=O)[C@H](C)Oc1ccc(Cl)cc1[N+](=O)[O-])oc1ccccc12 920778555 TYHLLONEZHJXOG-ZDUSSCGKSA-N 498.875 5.105 5 20 JKBD O=C(Cn1c2ccccc2c(=O)c2ccccc21)N1CCC[C@@H]1Cc1ccc(Br)cc1 920809890 QNZVWNKFBBSEAY-HXUWFJFHSA-N 475.386 5.151 5 20 JKBD O=C(NC1(c2ccc(NC(=O)c3ccc([N+](=O)[O-])[nH]3)cc2)CCC1)c1ccc(C(F)(F)F)cc1 1790187229 IWQWECYUKNSKAZ-UHFFFAOYSA-N 472.423 5.003 5 20 JKBD O=C(NC1(c2ccc(NC(=O)C34CC(C3)C4)cc2)CCC1)c1cc2cc([N+](=O)[O-])ccc2s1 1792036827 WZCZBCAZZBYBCW-UHFFFAOYSA-N 461.543 5.357 5 20 JKBD CCCCC[C@@H](C)C(=O)N1CCCC[C@H]1c1cc(NC(=O)Cn2ccc3ccc([N+](=O)[O-])cc32)n[nH]1 1815074271 AJXQKVVWXWKVNY-GCJKJVERSA-N 494.596 5.181 5 20 JKBD Cc1c(Cl)cccc1C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cccc(F)c2[N+](=O)[O-])n[nH]1 1821167076 CDWUKCZPPITWON-IBGZPJMESA-N 485.903 5.039 5 20 JKBD Cc1c(C(=O)Nc2cc([C@H]3CCCCN3C(=O)C3CCCCC3)[nH]n2)cc(Cl)cc1[N+](=O)[O-] 1821291590 YXJISSPKULWWPX-LJQANCHMSA-N 473.961 5.166 5 20 JKBD O=C(c1ccc([N+](=O)[O-])o1)N1CCC([C@@H]2CCCCN2C(=O)c2c(Cl)cccc2Cl)CC1 1829901166 WCYUVTCXNNKBEM-KRWDZBQOSA-N 480.348 5.042 5 20 JKBD Cc1cc2[nH]c(C(=O)N3CCCC[C@@H]3C3CCN(C(=O)c4ccc([N+](=O)[O-])cc4F)CC3)cc2s1 1830889891 HFZYQPNPQRRHBM-JOCHJYFZSA-N 498.580 5.132 5 20 JKBD CCn1c(S[C@H](C(=O)Nc2ccc(C)cc2[N+](=O)[O-])c2ccccc2)nnc1-c1ccccc1 9484681 OWSSCANHEYOQJV-QFIPXVFZSA-N 473.558 5.654 5 20 JKBD CSc1ccc(C(=O)c2ccccc2C(=O)OCC(=O)Nc2ccc(Cl)cc2C)cc1[N+](=O)[O-] 10154431 NPPRLFOBONLTHF-UHFFFAOYSA-N 498.944 5.305 5 20 JKBD CCOC(=O)Cc1csc(NC(=O)c2cc([N+](=O)[O-])ccc2Sc2ccc(Cl)cc2)n1 11167016 LRYXKKKRBIVGAG-UHFFFAOYSA-N 477.951 5.214 5 20 JKBD CC(=O)Nc1ccc(NC(=O)Cc2cn(-c3ccccc3)nc2-c2ccc([N+](=O)[O-])cc2)cc1Cl 14124914 ZQNDGNBKARQNRC-UHFFFAOYSA-N 489.919 5.241 5 20 JKBD Cc1cc(C)c(NC(=O)C2=C(c3ccccc3)NC(=S)N[C@@H]2c2ccc([N+](=O)[O-])cc2)c(Cl)c1 14878072 YBMPQDCVHKFVFO-HSZRJFAPSA-N 492.988 5.434 5 20 JKBD C[C@@H](Sc1ncnc2sc(-c3ccccc3)cc12)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 16048698 CDIHXRWYSJPKJO-CYBMUJFWSA-N 461.528 6.170 5 20 JKBD CCCN(CC(=O)Nc1ccccc1C)C(=O)c1ccc(NCc2ccccc2)c([N+](=O)[O-])c1 24650820 LXTPBZKUKDHCJZ-UHFFFAOYSA-N 460.534 5.006 5 20 JKBD Cc1nc(-c2ccc(Cl)cc2)sc1C(=O)O[C@H](C)C(=O)Nc1cccc([N+](=O)[O-])c1C 27781306 UEONCBGWSINTEU-CYBMUJFWSA-N 459.911 5.173 5 20 JKBD CC(C)[C@@H](Sc1nc2cc3ccccc3cc2c(=O)n1C)C(=O)Nc1ccccc1Cl 32328352 GWZMZMSWDZSRDA-OAQYLSRUSA-N 451.979 5.496 5 20 JKBD COCCOc1cc([N+](=O)[O-])c(C(=O)Nc2nc(-c3ccccc3)c(C(C)C)s2)cc1OC 106297187 UXBOQKHCTAWTNB-UHFFFAOYSA-N 471.535 5.128 5 20 JKBD Cc1cc([N+](=O)[O-])ccc1NC(=O)CSC1=N/C(=C/c2ccccc2)C(=O)N1c1ccc(F)cc1 207430014 LEBLABULCQRJDU-HYARGMPZSA-N 490.516 5.158 5 20 JKBD O=C(Nc1ccccc1-c1nc2ccccc2s1)c1csc(-c2cccc([N+](=O)[O-])c2)n1 302992048 FYLFEWDNAOZXNR-UHFFFAOYSA-N 458.524 6.247 5 20 JKBD COc1cc([C@H](C)NC(=O)c2ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])cc2)cc(OC)c1OC 482490292 TTWZXDUNFPRJIN-AWEZNQCLSA-N 486.908 5.557 5 20 JKBD COc1ccccc1NS(=O)(=O)c1cc([N+](=O)[O-])ccc1N[C@@H](C)c1ccc(OC(F)F)cc1 492351399 MCPPILWLPWAMJM-AWEZNQCLSA-N 493.488 5.179 5 20 JKBD Cc1cc(C(=O)NCC(C)C)ccc1NC(=O)c1cc([N+](=O)[O-])ccc1NCc1ccccc1 495673602 ZWIWXHOSUKHWIE-UHFFFAOYSA-N 460.534 5.153 5 20 JKBD O=C(CSc1nc(-c2cccs2)nc2ccccc12)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 500287195 XSACDCIPMZGWTB-UHFFFAOYSA-N 490.488 6.016 5 20 JKBD COCCN(C(=O)[C@H]1C[C@H]1c1cccc2ccccc12)c1nc(-c2ccc([N+](=O)[O-])cc2)cs1 503087460 RWNBQZNKSJLJLJ-GOTSBHOMSA-N 473.554 5.655 5 20 JKBD Cc1nn(Cc2ccc(F)cc2)c2sc(C(=O)N3c4ccc([N+](=O)[O-])cc4C[C@@H]3C)cc12 504329878 VWTPBZSUOFCWMG-ZDUSSCGKSA-N 450.495 5.093 5 20 JKBD COc1ccc([C@@H]2CCN(C(=O)C/C(=C\c3ccc([N+](=O)[O-])cc3)c3nc4ccccc4s3)C2)cc1 504947400 DHSWWJMSANVSTJ-BCIXFCFJSA-N 499.592 6.160 5 20 JKBD COc1ccccc1Oc1ccc(N[C@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2C(F)(F)F)cc1F 512545982 YKEOUUYDRZVFGH-CYBMUJFWSA-N 493.413 5.993 5 20 JKBD O=[N+]([O-])c1ccc(-c2nnc(CSc3nnc(-c4ccccc4)n3-c3ccccc3)o2)cc1 513803012 YGLDCESIZJYYQS-UHFFFAOYSA-N 456.487 5.185 5 20 JKBD O=C(C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)N1CCC[C@@H]1c1ccsc1 516071422 HAAKRXNMADCTLG-PZNLSKEWSA-N 475.595 6.560 5 20 JKBD CCOc1cc(CN[C@H](C)c2nc(C)cs2)ccc1OCc1cc([N+](=O)[O-])cc2c1OCOC2 520218532 IEQMZWQWTOSJFD-MRXNPFEDSA-N 485.562 5.055 5 20 JKBD COc1cc(CCNC(=O)c2sc(-c3ccc(C(F)(F)F)cc3)nc2C)c([N+](=O)[O-])cc1OC 591715827 YCYGDQHRQPKRKZ-UHFFFAOYSA-N 495.479 5.035 5 20 JKBD CC1(C)CC(=O)c2sc(NC(=O)c3cc([N+](=O)[O-])ccc3Sc3ccccc3)nc2C1 603771394 DEQOIDRRARINOY-UHFFFAOYSA-N 453.545 5.610 5 20 JKBD Cc1cc(OC(C)C)ccc1NC(=O)N1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 603831424 OIOPAGMABHLICK-UHFFFAOYSA-N 466.460 5.063 5 20 JKBD C[C@H](NC(=O)CSCc1nc(O)c2c(-c3ccccc3)csc2n1)c1cccc([N+](=O)[O-])c1 603965881 PXAOFSZNAPYTLX-AWEZNQCLSA-N 480.571 5.083 5 20 JKBD O=C(C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)Nc1cnc(C2CC2)nc1 609127418 JLJPMVZWFUZMNL-BOPFTXTBSA-N 457.515 5.441 5 20 JKBD COc1ccccc1CCN(C)C(=O)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])c(OC)c1 609182216 LYFRHVJNEIFRRD-UHFFFAOYSA-N 470.909 5.372 5 20 JKBD C[C@H](Nc1ccc(C(=O)NCC2(NC(=O)OC(C)(C)C)CCCCC2)cc1[N+](=O)[O-])c1ccccn1 725723310 HGXDRFJTPKDQFI-SFHVURJKSA-N 497.596 5.120 5 20 JKBD Cc1cc(C(=O)O[C@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)sc1-c1ccc(F)cc1 726656863 QQNXLALZQMEYST-CYBMUJFWSA-N 453.451 5.739 5 20 JKBD CC(C)[C@H](CC(=O)O[C@@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F)c1ccccc1 728640650 XHJJYVLWJKSPBL-YOEHRIQHSA-N 452.429 5.314 5 20 JKBD CC1=C(C(=O)Nc2cccc([N+](=O)[O-])c2)[C@@H](c2ccc3ncccc3c2)NC(=S)N1c1ccccc1 839448663 JEJFIJMWBNAOKQ-RUZDIDTESA-N 495.564 5.492 5 20 JKBD O=C(OCC(=O)N1c2ccccc2Sc2ccccc21)c1cc([N+](=O)[O-])ccc1N1CCCC1 846289836 KOPYGRZCKAEQRB-UHFFFAOYSA-N 475.526 5.181 5 20 JKBD C[C@@H]([C@@H]1C[C@H]2CC[C@H]1C2)n1c(SCC(=O)Nc2cc([N+](=O)[O-])ccc2F)nnc1-c1ccco1 848592684 MNPUJMWHJFCNBM-JKQORVJESA-N 485.541 5.313 5 20 JKBD Cc1cc(C)n(Cc2cccc(-c3noc(-c4ccc(N[C@@H](C)c5ccccn5)c([N+](=O)[O-])c4)n3)c2)n1 904531703 YGOWZCWLMNLGQK-IBGZPJMESA-N 495.543 5.742 5 20 JKBD Cc1ccc(C(=O)Nc2cccc(C(F)(F)F)c2)cc1NC(=O)Cn1ncc2ccc([N+](=O)[O-])cc21 920844467 CQHACQAXQHYUHC-UHFFFAOYSA-N 497.433 5.163 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)c3cc(F)cc([N+](=O)[O-])c3)CCC2)cc1)c1ccc2ncccc2c1 1788907813 MLAOHNNTAXGNEG-UHFFFAOYSA-N 484.487 5.344 5 20 JKBD Cc1ccc(CC(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2ccc(-c3ccccc3)cc2)cc1[N+](=O)[O-] 1803828310 FIZVZFOCTMWWKV-OOSCYNTBSA-N 483.568 5.065 5 20 JKBD O=C(Cc1ccc(Cl)cc1[N+](=O)[O-])N1CCCC2(CCN(C(=O)c3cccc4ccoc34)CC2)C1 1805485430 VVMKKARKOUBBII-UHFFFAOYSA-N 495.963 5.082 5 20 JKBD O=C(CCc1cccc([N+](=O)[O-])c1)Nc1cc([C@@H]2CCCCN2C(=O)c2ccc3occc3c2)[nH]n1 1815537172 POSMQOZAKLXRIK-QFIPXVFZSA-N 487.516 5.003 5 20 JKBD O=C(CCc1cccc([N+](=O)[O-])c1)Nc1cc([C@@H]2CCCCN2C(=O)c2ccc(Cl)c(F)c2)[nH]n1 1815538843 ZKYJBVQBBXAPLR-NRFANRHFSA-N 499.930 5.049 5 20 JKBD Cc1cc(Cl)ccc1C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2ccc([N+](=O)[O-])cc2F)n[nH]1 1821049677 WXCHGFZQHDYHPG-FQEVSTJZSA-N 485.903 5.039 5 20 JKBD O=C(Cc1cccc([N+](=O)[O-])c1)N1CCC([C@H]2CCCCN2C(=O)c2cccc3ccccc23)CC1 1828006714 PSMAOADFVWMDBI-HHHXNRCGSA-N 485.584 5.224 5 20 JKBD Cc1ccc([C@H](C)C(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3cc(F)cc([N+](=O)[O-])c3)CC2)cc1 1831529857 NOGLIGLQSJITGW-UQBPGWFLSA-N 481.568 5.079 5 20 JKBD Cc1ccc([C@@H](C)C(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3ccc([N+](=O)[O-])cc3F)CC2)cc1 1831530272 PRMRJMVMSWSWTL-KBMIEXCESA-N 481.568 5.079 5 20 JKBD CC[C@H](C)[C@@H](C(=O)O[C@@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F)c1ccccc1 9097924 MGTGJSUMDKKQEX-CKFHNAJUSA-N 452.429 5.314 5 20 JKBD O=C(OCC(=O)N1N=C(c2ccc(Cl)cc2)C[C@H]1c1ccco1)c1cc([N+](=O)[O-])ccc1Cl 10667986 UXAIHVBAIXCFMK-IBGZPJMESA-N 488.283 5.029 5 20 JKBD COc1ccccc1NC(=O)c1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2NCc2ccccc2)cc1 15313312 RXDICSHTQIFNKR-UHFFFAOYSA-N 496.523 5.720 5 20 JKBD CCCCc1ccc(-n2nnnc2S[C@@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2C(F)(F)F)cc1 21352806 ZFIAWFKUOIOOCZ-ZDUSSCGKSA-N 494.499 5.051 5 20 JKBD C[C@H](NC(=O)[C@@H](C)OC(=O)Cn1c2ccccc2c(=O)c2ccccc21)c1cccc2ccccc12 28775145 SFKVUEKOKZNWPO-VQTJNVASSA-N 478.548 5.117 5 20 JKBD Cc1ncc2c(n1)CC[C@H](NC(=O)c1ccccc1Sc1ccc(C(F)(F)F)cc1[N+](=O)[O-])C2 30385325 SKGVVPBXBNQPCB-INIZCTEOSA-N 488.491 5.151 5 20 JKBD C[C@H]1CCCN(c2ccc(C(=O)Nc3ccccc3NC(=O)Cc3cccs3)cc2[N+](=O)[O-])C1 409979245 KUVITDLEBHLTIX-KRWDZBQOSA-N 478.574 5.326 5 20 JKBD Cc1cc([C@H]2CCCN2C(=O)C/C(=C\c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)on1 481567817 CIFNCWOFTOERMV-IYYMRFBLSA-N 474.542 5.795 5 20 JKBD O=C(Nc1ccc(OCc2ccccn2)c(Cl)c1)c1csc(-c2ccc([N+](=O)[O-])cc2)n1 495528382 HMEIQCINEFGGBV-UHFFFAOYSA-N 466.906 5.598 5 20 JKBD CSc1ccc(C(=O)Nc2ccc(CC(=O)N3CCCc4ccccc43)cc2)cc1[N+](=O)[O-] 503447184 JSOXMEOVJBFZMQ-UHFFFAOYSA-N 461.543 5.091 5 20 JKBD O=C(c1ccc(NCc2ccccc2)c([N+](=O)[O-])c1)N1CCO[C@H](c2ccccc2Cl)C1 505154314 GNNRLZOKLOQDPX-QHCPKHFHSA-N 451.910 5.074 5 20 JKBD CCCN(C(=O)c1ccc(N[C@@H](C)c2ccccn2)c([N+](=O)[O-])c1)[C@H]1CCc2ccccc2C1 509996276 FSADZWHWGZKNCH-CVDCTZTESA-N 458.562 5.573 5 20 JKBD CC(C)(C)c1ccc(Oc2ccc(CNCc3ccc(N4CCOCC4)nc3)cc2[N+](=O)[O-])cc1 603633468 NBJKQQCYFGZAOR-UHFFFAOYSA-N 476.577 5.206 5 20 JKBD COc1cccc(N2CC[C@@H](CNCc3cn(-c4ccccc4)nc3-c3ccc([N+](=O)[O-])cc3)C2)c1 608837866 SFKNBMJRBZJRLE-NRFANRHFSA-N 483.572 5.072 5 20 JKBD CCN1CCC(N(C)C(=O)C/C(=C\c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)CC1 609231835 BDSQVFOBEJQYQP-KNTRCKAVSA-N 464.591 5.078 5 20 JKBD Cc1ccccc1[C@@H](OC[C@@H](O)Cn1cnc2cc3ccccc3cc2c1=O)c1ccccc1 636935159 SWZDBHTWZJKJEE-CUBQBAPOSA-N 450.538 5.025 5 20 JKBD Cn1ccnc1[C@@H](NC(=O)CCC(=O)c1ccc2ccc3cccc4ccc1c2c34)c1ccc(F)cc1 727753763 RJRBUXGLGVUTRM-PMERELPUSA-N 489.550 6.325 5 20 JKBD COc1ccc([C@@H](NC(=O)c2cc(Cl)ccc2[N+](=O)[O-])c2ccccc2)cc1Br 728497561 BQOGWPBFMBOUIG-FQEVSTJZSA-N 475.726 5.539 5 20 JKBD CSc1ccc([N+](=O)[O-])c(C(=O)NC[C@@H](NC(=O)OC(C)(C)C)c2ccc(C(C)C)cc2)c1 728883379 IMDUDANVJZMUTO-HXUWFJFHSA-N 473.595 5.436 5 20 JKBD O=C(C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)NCc1ccnc(-n2ccnc2)c1 743958849 KTUCALJYUBGDFT-MOSHPQCFSA-N 496.552 5.032 5 20 JKBD C[C@@H](OC(=O)c1ccc2c(c1)-c1ccccc1C2)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 755868805 VLBYWWPUNSCBEC-CYBMUJFWSA-N 470.403 5.369 5 20 JKBD COc1cc(CNc2cccc(N=S(C)(C)=O)c2)ccc1OCc1ccc([N+](=O)[O-])cc1 864015735 UHYNPVFUMSYSMN-UHFFFAOYSA-N 455.536 5.154 5 20 JKBD CC(C)N(Cc1nnc(-c2cccc([N+](=O)[O-])c2)o1)C(=O)c1sc2ccccc2c1Cl 864244592 DKCCFRQRLLJYPZ-UHFFFAOYSA-N 456.911 5.564 5 20 JKBD C[C@@H](OC(=O)c1nc(-c2ccccc2)n2c1CCCCC2)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl 914916819 ZOBBKPXMFVHORH-OAHLLOKOSA-N 482.924 5.022 5 20 JKBD O=C(Nc1cccc(C(F)(F)F)c1)c1cccc(NC(=S)Nc2ccc([N+](=O)[O-])cc2)c1 916115684 UZNKFRGGBAQKJQ-UHFFFAOYSA-N 460.437 5.675 5 20 JKBD O=[N+]([O-])c1ccccc1CN(Cn1nc2sc3ccccc3n2c1=S)CC(F)(F)F 917451715 ZPILXFMBBIWIBS-UHFFFAOYSA-N 453.471 5.010 5 20 JKBD CC(=O)N(c1ccc(Cl)cc1)c1nc(/C=C(/Cl)c2nc3cc([N+](=O)[O-])ccc3[nH]2)cs1 917559516 KVZOKKDMTDDEJU-LZYBPNLTSA-N 474.329 6.003 5 20 JKBD CC(=O)Nc1cccc([C@@H](C)N(Cc2ccccc2)C(=O)CCOc2ccccc2[N+](=O)[O-])c1 917631650 SCWFSMCNTGKZCT-LJQANCHMSA-N 461.518 5.112 5 20 JKBD CC(C)Oc1cccc(CN[C@@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2ccccc2)c1 917937728 BKMFMMIHUVDZPG-HSZRJFAPSA-N 453.926 5.505 5 20 JKBD CCCc1noc2nc(-c3ccco3)cc(C(=O)N(C)Cc3cc([N+](=O)[O-])ccc3Cl)c12 920284797 HEEIGLGMODZHPX-UHFFFAOYSA-N 454.870 5.269 5 20 JKBD Cc1cc(C(=O)Nc2ccc(C3(NC(=O)c4cc5ccoc5s4)CCC3)cc2)ncc1[N+](=O)[O-] 1788766505 XMTXURGFBDRBFS-UHFFFAOYSA-N 476.514 5.167 5 20 JKBD Cc1cc(C(=O)Nc2ccc(C3(NC(=O)Cc4ccc(Cl)cc4[N+](=O)[O-])CCC3)cc2)c(C)n1C 1789973626 ZRDJWBGLMHKONW-UHFFFAOYSA-N 494.979 5.194 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)c3cccc4ccoc34)CCC2)cc1)c1ccc([N+](=O)[O-])c2c1OCO2 1790096554 SFTWSNIZGMAJJV-UHFFFAOYSA-N 499.479 5.131 5 20 JKBD CC1=CC[C@H](C(=O)Nc2cc([C@@H]3CCCCN3C(=O)C3(c4cccc([N+](=O)[O-])c4)CCC3)[nH]n2)CC1 1818807472 BSGNUCLOWSHDKG-CVDCTZTESA-N 491.592 5.178 5 20 JKBD Cc1ccc(C)c(C(=O)Nc2cc([C@H]3CCCCN3C(=O)CSc3ccccc3[N+](=O)[O-])[nH]n2)c1 1823145159 BEOHUUYJDRDJBI-HXUWFJFHSA-N 493.589 5.033 5 20 JKBD CC(C)c1ccc(CC(=O)N2CCC([C@@H]3CCCCN3C(=O)/C=C/c3ccc([N+](=O)[O-])o3)CC2)cc1 1824278251 CECDGOGGQALSGP-DWOOMVRVSA-N 493.604 5.187 5 20 JKBD O=C(Cc1ccc(Cl)cc1)N1CCC([C@H]2CCCCN2C(=O)CCc2cccc([N+](=O)[O-])c2)CC1 1824839132 XZONSBJYZZURIE-RUZDIDTESA-N 498.023 5.043 5 20 JKBD Cc1ccc(CC(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3ccc(C4CC4)cc3)CC2)cc1[N+](=O)[O-] 1830364611 VADAITFPOJIZKE-AREMUKBSSA-N 489.616 5.257 5 20 JKBD O=C(c1cc(F)cc([N+](=O)[O-])c1)N1CCCC[C@H]1C1CCN(C(=O)C2(c3ccccc3)CCC2)CC1 1830615356 CMOYCPQOGMNQSY-VWLOTQADSA-N 493.579 5.089 5 20 JKBD O=[N+]([O-])c1cc2c(c(CSc3nnc(-c4ccccc4Cl)n3Cc3ccccc3)c1)OCOC2 8989090 GTTNUQCZICKEDL-UHFFFAOYSA-N 494.960 5.714 5 20 JKBD CNC(=O)Nc1cccc(NC(=O)C/C(=C/c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)c1 485227835 DJXMQNWCPQZCHF-LGMDPLHJSA-N 487.541 5.525 5 20 JKBD Cc1cc(CNC(=O)CCn2cc([N+](=O)[O-])nc2C)ccc1Oc1ccc(Cl)cc1Cl 488640161 CTVSONMSWQCBGK-UHFFFAOYSA-N 463.321 5.214 5 20 JKBD COCCOc1cc([N+](=O)[O-])c(C(=O)Nc2ccc(Sc3ccc(Cl)cc3)cc2)cc1OC 490110393 BMASAYRMCCZTHS-UHFFFAOYSA-N 488.949 5.686 5 20 JKBD Cc1c(NC(=O)c2cc(OCC(F)(F)F)ccc2[N+](=O)[O-])cccc1C(=O)Nc1ccccc1 498455079 TWHRESSELBCXNW-UHFFFAOYSA-N 473.407 5.349 5 20 JKBD COCCN(C(=O)c1csc(-c2ccccc2)n1)c1nc(-c2ccc([N+](=O)[O-])cc2)cs1 500282979 WIMHBKIBISLKJP-UHFFFAOYSA-N 466.544 5.135 5 20 JKBD O=C(NCCNc1ccc([N+](=O)[O-])cc1)Nc1cccc(NC(=O)c2cccc(C(F)(F)F)c2)c1 509869213 XWVLDRWATHKQCK-UHFFFAOYSA-N 487.438 5.100 5 20 JKBD O=C(N[C@@H](Cc1ccc(O)cc1)c1nc2ccccc2[nH]1)c1cc2cc([N+](=O)[O-])ccc2s1 512074048 GCNSKPOZCLDYJX-FQEVSTJZSA-N 458.499 5.105 5 20 JKBD CCOCCOc1c(Cl)cccc1NC(=O)c1ccc(N2CCC(C)CC2)c([N+](=O)[O-])c1 520141528 VZMBOAODTGHYSD-UHFFFAOYSA-N 461.946 5.152 5 20 JKBD C[C@@H]1CCCN(c2ccc(C(=O)N[C@@H]3C[C@@H](C(F)(F)F)C[C@@H](C(F)(F)F)C3)cc2[N+](=O)[O-])C1 603572878 KNRCABMGMRMOSB-OJLVUWQFSA-N 481.437 5.470 5 20 JKBD CN(C(=O)c1c2c(nc3ccccc13)/C(=C/c1cccc([N+](=O)[O-])c1)CCC2)c1nccs1 603619356 PTVIVIHAPKRVHR-SAPNQHFASA-N 456.527 5.753 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Cl)[C@@H](NCc1cc(Br)ccc1F)c1ccccc1 603632182 OVVWCJSOOLLPLV-FQEVSTJZSA-N 492.732 5.619 5 20 JKBD Cc1csc(Sc2ccc(C(=O)Nc3ccc(C(=O)NCC(C)C)cc3)cc2[N+](=O)[O-])n1 603971290 GXSDKCQGSLAGHS-UHFFFAOYSA-N 470.576 5.149 5 20 JKBD COc1cc(C(=O)N[C@@H](Cc2ccc(Cl)cc2)c2ccccc2)c([N+](=O)[O-])cc1OC(F)F 604118812 KAYUEQUSUNVECF-SFHVURJKSA-N 476.863 5.572 5 20 JKBD C[C@H](NC(=O)NCc1cn(Cc2ccccc2)nc1-c1ccccc1)c1cccc([N+](=O)[O-])c1 604126021 DCJGOIHCMUDGOG-IBGZPJMESA-N 455.518 5.067 5 20 JKBD O=C(C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)NC[C@@H]1Cc2ccccc21 604249161 XFZSZMNJNKCAJC-DTBYZMGXSA-N 455.539 5.591 5 20 JKBD Cc1ccc(C(=O)N2CCC(NC(=O)c3ccc(SCCC(C)C)c([N+](=O)[O-])c3)CC2)cc1 608963322 PLDPIEHZYWUNLE-UHFFFAOYSA-N 469.607 5.076 5 20 JKBD O=C(c1ccc(C(=O)N2CCC[C@@H]2C2CCCC2)cc1[N+](=O)[O-])N1CCC[C@H]1C1CCCC1 609044630 NQKUNXYECOBPEL-PKTZIBPZSA-N 453.583 5.184 5 20 JKBD O=[N+]([O-])c1ccc(-c2nnc(CN(Cc3ccccc3OC(F)(F)F)C3CCCC3)o2)cc1 609203652 NTQASCSUJNFJAS-UHFFFAOYSA-N 462.428 5.488 5 20 JKBD COc1cc(C(=O)N(Cc2c(F)cccc2F)C2CCCC2)c([N+](=O)[O-])cc1OC(F)F 609216029 DKQJNRJZXVTONQ-UHFFFAOYSA-N 456.392 5.068 5 20 JKBD O=C(C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)N1CCCO[C@H](c2ccccc2)C1 609230558 LGXRQLPNOSHXFQ-BDPRQDHOSA-N 499.592 6.125 5 20 JKBD Cc1cc([N+](=O)[O-])ccc1C(=O)O[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1 725986496 AUCKCMDYYVPFMU-HXUWFJFHSA-N 469.837 5.002 5 20 JKBD CC(=O)N(c1ccc(C)c(C)c1)c1nc(CN(C)Cc2cc([N+](=O)[O-])ccc2Cl)cs1 726184980 GFKZSCQBEBIWQD-UHFFFAOYSA-N 458.971 5.638 5 20 JKBD O=C(Nc1nc2c(s1)C(=O)CCC2)c1cc([N+](=O)[O-])ccc1N1CCC(Cc2ccccc2)CC1 727714073 OUEAKXUCTWPRDW-UHFFFAOYSA-N 490.585 5.282 5 20 JKBD CC(C)N(Cc1nnc(-c2cccc([N+](=O)[O-])c2)o1)C(=O)CCSc1nc2ccccc2s1 728083670 NPICCEKGMROTSD-UHFFFAOYSA-N 483.575 5.174 5 20 JKBD CC(=O)N(c1nc(COC(=O)c2ccc([N+](=O)[O-])c(F)c2)cs1)c1c(C)cc(C)cc1C 728154412 IOVLQCRSNUAIQH-UHFFFAOYSA-N 457.483 5.157 5 20 JKBD C[C@@H](NC(C)(C)CNC(=O)c1ccccc1NC(=O)c1ccc([N+](=O)[O-])cc1Cl)c1ccccc1 729250775 VFZSSZPCCJGKKB-QGZVFWFLSA-N 494.979 5.360 5 20 JKBD O=C(COC(=O)c1csc(-c2ccc([N+](=O)[O-])cc2)n1)Nc1c(Cl)cc(Cl)cc1Cl 747956558 UXVGFGRESVFGKT-UHFFFAOYSA-N 486.720 5.474 5 20 JKBD Cc1cc(C(=O)COC(=O)c2csc(-c3cccc([N+](=O)[O-])c3)n2)c(C)n1CCc1cccs1 747962342 MYELYFWCGUGNLQ-UHFFFAOYSA-N 495.582 5.481 5 20 JKBD Cc1c(C(=O)Nc2ccc(F)c(NC(=O)C3CCCCC3)c2)cc([N+](=O)[O-])c(C)c1[N+](=O)[O-] 748620301 ASQOXXIAADJXKA-UHFFFAOYSA-N 458.446 5.030 5 20 JKBD O=C(Nc1cc(Cl)c([N+](=O)[O-])cc1OCc1ccccc1)c1cccc(NC(=O)[C@H]2CCCO2)c1 888564345 UZNHZKMIEWFHHJ-JOCHJYFZSA-N 495.919 5.197 5 20 JKBD O=C(OCc1nnc(C2CC2)o1)c1c2c(nc3ccccc13)/C(=C\c1ccc([N+](=O)[O-])cc1)CCC2 920490650 LVKSTXXGVZTASE-JXAWBTAJSA-N 482.496 5.637 5 20 JKBD CC(=O)N(c1ccc(C(F)(F)F)cc1)c1nc(COC(=O)/C=C\c2ccc([N+](=O)[O-])cc2)cs1 920497979 QOJIXQSFLVYVHD-WCIBSUBMSA-N 491.447 5.511 5 20 JKBD COc1cc(C(=O)NC2(c3ccc(NC(=O)C4CCC(F)(F)CC4)cc3)CCC2)ccc1[N+](=O)[O-] 1786245877 UVPWHPFNWFFOMH-UHFFFAOYSA-N 487.503 5.177 5 20 JKBD O=C(Cc1cc(F)ccc1[N+](=O)[O-])NC1(c2ccc(NC(=O)c3ccc4cc[nH]c4c3)cc2)CCC1 1788914344 DZPOYFKAYMUMHV-UHFFFAOYSA-N 486.503 5.206 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)c3cc4cc([N+](=O)[O-])ccc4s3)CCC2)cc1)c1ccc[nH]1 1789684999 IQBXADSVXUWEDU-UHFFFAOYSA-N 460.515 5.199 5 20 JKBD CCc1nc(C(=O)NC2(c3ccc(NC(=O)c4cc(Cl)cc([N+](=O)[O-])c4C)cc3)CCC2)co1 1790774592 MZVIXMALXNECDZ-UHFFFAOYSA-N 482.924 5.169 5 20 JKBD Cc1cc(CCCC(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2sccc2Cl)C3)c([N+](=O)[O-])cc1F 1793403202 IJCPFABVLOFLOY-BJWYYQGGSA-N 493.988 5.032 5 20 JKBD O=C(Nc1cc([C@@H]2CCCCN2C(=O)[C@@H]2CCC[C@@H]3CCCC[C@H]32)[nH]n1)c1cccc(F)c1[N+](=O)[O-] 1821169436 HKFLNQNKKLZKEO-FBAVSBLXSA-N 497.571 5.369 5 20 JKBD O=C(c1cc2cc([N+](=O)[O-])ccc2s1)N1CCC([C@H]2CCCCN2C(=O)CCC2CCC2)CC1 1824355170 UFRBXPZOZLTRKO-JOCHJYFZSA-N 483.634 5.623 5 20 JKBD O=C(c1c(F)cccc1Cl)N1CCC([C@H]2CCCCN2C(=O)c2cccc(F)c2[N+](=O)[O-])CC1 1830620823 GONBPYRBKJKSLK-HXUWFJFHSA-N 491.922 5.074 5 20 JKBD O=C(Cc1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1)Nc1nc(-c2ccccn2)cs1 9658020 VGXBHACAVWJYNB-UHFFFAOYSA-N 482.525 5.147 5 20 JKBD CC(=O)N(c1nc(COC(=O)c2cc([N+](=O)[O-])ccc2N(C)C)cs1)c1c(C)cc(C)cc1C 10017020 VHANYDLEFATHJU-UHFFFAOYSA-N 482.562 5.084 5 20 JKBD O=C(COC(=O)c1ccccc1Cc1nc2ccccc2s1)Nc1cc([N+](=O)[O-])ccc1Cl 10609943 ILHNXGGSCIXKFL-UHFFFAOYSA-N 481.917 5.244 5 20 JKBD CC(C)OCc1c(C(=O)O[C@@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2C(F)(F)F)oc2ccccc12 11242398 SLOAKABHDTYZEX-ZDUSSCGKSA-N 494.422 5.469 5 20 JKBD Cc1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2Cl)cc1S(=O)(=O)Nc1cccc(Cl)c1 15735886 PVVKMFSTLASPHA-UHFFFAOYSA-N 480.329 5.263 5 20 JKBD Cc1ccc(-n2c(S[C@@H](C)c3nnc(-c4ccc([N+](=O)[O-])cc4)o3)nc3ccccc3c2=O)cc1 17532955 AYNOXPIZYMXZTQ-INIZCTEOSA-N 485.525 5.506 5 20 JKBD Cc1sc(NC(=O)[C@H]2CCCN(C(=O)c3ccc(Cl)cc3)C2)nc1-c1cccc([N+](=O)[O-])c1 195703896 CZSILDWVFRHCLN-KRWDZBQOSA-N 484.965 5.171 5 20 JKBD Cc1cc(C(=O)N2CCC[C@H](C)C2)ccc1NC(=O)c1csc(-c2cccc([N+](=O)[O-])c2)n1 215734459 WGEUIMZWRMULMU-HNNXBMFYSA-N 464.547 5.151 5 20 JKBD C[C@@H](Nc1ccc(C(=O)N2CCC(COc3ccccc3)CC2)cc1[N+](=O)[O-])c1ccccn1 303038476 VQLVEOITPKVQRV-LJQANCHMSA-N 460.534 5.094 5 20 JKBD CC[C@H](C)Sc1ccc(NC(=O)c2cc(SC)c(OC)cc2[N+](=O)[O-])c(C(F)(F)F)c1 483531630 SQMXNEDZYKSDBJ-NSHDSACASA-N 474.526 6.487 5 20 JKBD COc1cc(CCNC(=O)c2oc3ccccc3c2CSc2cccs2)c([N+](=O)[O-])cc1OC 495470947 XCNBZRHQNRPQTC-UHFFFAOYSA-N 498.582 5.685 5 20 JKBD CCOc1ccc(N(C(=O)c2ccc(-n3cncn3)c([N+](=O)[O-])c2)c2nc3ccccc3s2)cc1 496785273 MVWCUKPIHWGUDO-UHFFFAOYSA-N 486.513 5.162 5 20 JKBD Cc1ccccc1-c1ccc(CN(C(=O)C(=O)Nc2cccc([N+](=O)[O-])c2C)C(C)C)s1 499163777 IOQKEYDNMPRGOV-UHFFFAOYSA-N 451.548 5.316 5 20 JKBD Cc1csc(Sc2ccc(C(=O)Nc3cccc(C(=O)N4CCCC4)c3C)cc2[N+](=O)[O-])n1 499583236 BLLLDJABOUGCNV-UHFFFAOYSA-N 482.587 5.308 5 20 JKBD C[C@H]1c2[nH]c3ccccc3c2[C@@H](c2ccccc2Cl)CN1C(=O)CCn1cc([N+](=O)[O-])cn1 508804634 BVAUOUMKTVVEBQ-HNAYVOBHSA-N 463.925 5.051 5 20 JKBD O=C(Nc1ccc2c(c1)Cc1ccccc1-2)c1ccc([N+](=O)[O-])cc1I 508901010 SZWSAKKPCXNNQF-UHFFFAOYSA-N 456.239 5.023 5 20 JKBD C[C@H](Nc1ccc(C(=O)Nc2ccccc2Oc2cccc(F)c2)cc1[N+](=O)[O-])c1ccccn1 509139112 OFTSCIZNEINJEF-KRWDZBQOSA-N 472.476 6.347 5 20 JKBD CC(C)Oc1ccc([N+](=O)[O-])cc1CSc1nnc(-c2ccc(F)cc2)n1C[C@@H]1CCCO1 511111523 VBRFETHSALTWLP-FQEVSTJZSA-N 472.542 5.251 5 20 JKBD COc1cc(C)ccc1Oc1ccc(F)cc1NC(=O)c1cc(OC)c(OC(F)F)cc1[N+](=O)[O-] 513053453 ZCTGLKUPLJNLNX-UHFFFAOYSA-N 492.406 5.706 5 20 JKBD Cc1ccc(C(=O)N2C[C@@H](C)C[C@H](C)C2)cc1NC(=O)Cn1c2ccccc2c(=O)c2ccccc21 515612717 NKFLRWURWSHJTF-PMACEKPBSA-N 481.596 5.220 5 20 JKBD O=C(c1ccc([N+](=O)[O-])o1)N(C[C@H]1CCCO1)c1nc(-c2ccc(Cl)cc2Cl)cs1 603462988 PEAJTXOODYAOLU-GFCCVEGCSA-N 468.318 5.444 5 20 JKBD C[C@H](Nc1ccc(C(=O)N(Cc2ccc3c(c2)OCO3)C2CCCC2)cc1[N+](=O)[O-])c1ccccn1 604295896 HZIOOJHSNGVRLI-SFHVURJKSA-N 488.544 5.477 5 20 JKBD O=C(NC[C@H]1CCCN(C(=O)c2cc([N+](=O)[O-])ccc2Oc2ccccc2)C1)Nc1cccc(F)c1 608867146 YLCAXZCGPZYRRS-GOSISDBHSA-N 492.507 5.200 5 20 JKBD Cc1ccc(NC(=O)c2ccc(N3CCC(C(=O)Nc4ccc(F)cc4)CC3)c([N+](=O)[O-])c2)cc1 608974096 YCRLIWYGYTUZQV-UHFFFAOYSA-N 476.508 5.150 5 20 JKBD CC(C)(C)OC(=O)N1CCC[C@@H]1[C@@H]1CCCCN1C(=O)Nc1ccc([N+](=O)[O-])cc1Cl 725855063 SFRYIPGDGRXGEG-ZWKOTPCHSA-N 452.939 5.034 5 20 JKBD O=C(COC(=O)c1csc(-c2cccc(C(F)(F)F)c2)n1)Nc1cc([N+](=O)[O-])ccc1Cl 725996528 JULAINCYNZLVCK-UHFFFAOYSA-N 485.827 5.186 5 20 JKBD Cc1nn(CCC(=O)C(c2nc3ccccc3s2)c2nc3ccccc3s2)c(C)c1[N+](=O)[O-] 726730315 BSMOVCQYFLZNMZ-UHFFFAOYSA-N 477.571 5.419 5 20 JKBD CC(C)N(Cc1nnc(-c2cccc([N+](=O)[O-])c2)o1)C(=O)c1ccc(F)c(NC(=O)OC(C)(C)C)c1 730450020 IBKWFEZLVPNNCI-UHFFFAOYSA-N 499.499 5.182 5 20 JKBD C[C@H](OC(=O)c1ccccc1OCc1cccs1)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 730617503 IRPBXHPCLWDRAW-ZDUSSCGKSA-N 494.447 5.438 5 20 JKBD O=C(COC(=O)c1c2c(nc3ccccc13)/C(=C/c1ccco1)CC2)c1ccc([N+](=O)[O-])cc1 765736888 BZYUNEWECZUCRI-SAPNQHFASA-N 454.438 5.263 5 20 JKBD CC(=O)N(c1nc(COC(=O)c2ccc([N+](=O)[O-])c(C)c2)cs1)c1c(C)cc(C)cc1C 792241900 SYMQEYRWKRSKDA-UHFFFAOYSA-N 453.520 5.327 5 20 JKBD COc1cc(C(=O)Nc2ccc(F)c(C(=O)O)c2)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 914729716 QEZGSLIQPUTFGE-UHFFFAOYSA-N 460.801 5.139 5 20 JKBD O=C(Nc1ccc(Cl)cc1Cl)[C@H]1CCCCN1C(=O)c1cc(Cl)ccc1[N+](=O)[O-] 915158922 FTJHKFHNPRXVGE-QGZVFWFLSA-N 456.713 5.188 5 20 JKBD O=C(Nc1ccc(Cl)c([N+](=O)[O-])c1)N1CCCN(Cc2ccc(C(F)(F)F)cc2)CC1 915307646 OGONJLPGBDDNAT-UHFFFAOYSA-N 456.852 5.007 5 20 JKBD CC1=C(C(=O)Nc2ccccc2C(F)(F)F)[C@H](c2cc([N+](=O)[O-])ccc2Cl)NC(=S)N1C 916168018 DAGABCVEOLZVOL-KRWDZBQOSA-N 484.887 5.041 5 20 JKBD CC1CCN(c2ccc([N+](=O)[O-])cc2C(=O)N2CCC(C(=O)c3ccc(Cl)cc3)CC2)CC1 918389569 WKXBLAOZJOGURL-UHFFFAOYSA-N 469.969 5.220 5 20 JKBD COC(=O)N(C)c1ccc(NC(=O)c2ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])cc2)cc1 919890362 GCBQLKRVNYAREA-UHFFFAOYSA-N 455.854 5.495 5 20 JKBD CCCCc1ccc(NC(=S)/C(=C(/O)c2ccc(C)c([N+](=O)[O-])c2)[n+]2cc(O)ccc2C)cc1 920486436 GZINEALLVPUMJK-UHFFFAOYSA-O 478.594 5.871 5 20 JKBD Cc1cc(CCCC(=O)Nc2ccc(C3(NC(=O)c4ocnc4C)CCC3)cc2)c([N+](=O)[O-])cc1F 1786274886 OZUVVKPRJYNFFA-UHFFFAOYSA-N 494.523 5.109 5 20 JKBD COc1cc(C(=O)NC2(c3ccc(NC(=O)c4ccc5cnccc5c4)cc3)CCC2)ccc1[N+](=O)[O-] 1789014839 QROAYXZKCKNRLM-UHFFFAOYSA-N 496.523 5.213 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)c3cc4ccsc4[nH]3)CCC2)cc1)c1cc(F)cc([N+](=O)[O-])c1 1790699444 PXEYJEPHHFYBJR-UHFFFAOYSA-N 478.505 5.338 5 20 JKBD Cc1cc(O)c([N+](=O)[O-])cc1C(=O)NC1(c2ccc(NC(=O)C[C@@H]3C[C@@H]4CC[C@H]3C4)cc2)CCC1 1791325627 QMDVQFXPHOTLOS-QYZOEREBSA-N 477.561 5.183 5 20 JKBD COc1cc(C(=O)Nc2ccc(C3(NC(=O)/C=C/c4ccsc4)CCC3)cc2)ccc1[N+](=O)[O-] 1792163674 BOTVOGKUQUWIOJ-XCVCLJGOSA-N 477.542 5.126 5 20 JKBD COc1ccc(CC(=O)NC2(c3ccc(NC(=O)[C@H](C)c4ccccc4)cc3)CCC2)c([N+](=O)[O-])c1 1792312859 CXERVXHANGLTEH-LJQANCHMSA-N 487.556 5.084 5 20 JKBD Cc1ccc2cc(C(=O)N[C@@H]3C[C@@H]4CC[C@H](C3)N4C(=O)Cc3ccc(Cl)cc3[N+](=O)[O-])sc2c1 1793080398 XLJLUKZFOCDXCX-ACDBMABISA-N 498.004 5.266 5 20 JKBD Cc1cc(CCCC(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)C[C@@H](C)c2ccccc2)C3)c([N+](=O)[O-])cc1F 1793405645 VQXQLMUHGVJRQL-LZQXYRQZSA-N 495.595 5.197 5 20 JKBD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc2cc([N+](=O)[O-])ccc2s1)[C@H]1C[C@@H]1c1ccc(F)cc1 1801206215 VSCBEDNTYZLTMU-NJKFVAIMSA-N 493.560 5.004 5 20 JKBD C[C@@H]1CCC[C@@H]1C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)[nH]n1 1818960249 RSHPEONQMVDFBA-LJHODMEESA-N 481.578 5.275 5 20 JKBD O=[N+]([O-])c1cccc(CSc2nnc(CN3CCCCC3)n2-c2ccc(OC(F)F)cc2)c1 12136793 XVQOMBMCHJTBDD-UHFFFAOYSA-N 475.521 5.055 5 20 JKBD O=[N+]([O-])c1cccc(OC[C@H](O)CSc2nnc(-c3ccc(Cl)cc3)n2Cc2ccccc2)c1 15238153 XDAJUIMJBCUFIR-NRFANRHFSA-N 496.976 5.087 5 20 JKBD COc1ccc(NC(=O)[C@@H](C)Sc2nnc(-c3ccc(F)cc3)n2-c2ccccc2)c([N+](=O)[O-])c1 16725097 KVIJSAGVKBLSEL-OAHLLOKOSA-N 493.520 5.110 5 20 JKBD CN(Cc1nccn1C(F)F)C(=O)c1ccccc1Sc1ccc(C(F)(F)F)cc1[N+](=O)[O-] 29183498 DLMFMLWZHRYESI-UHFFFAOYSA-N 486.422 5.629 5 20 JKBD CCN(Cc1cccc(NC(=O)c2cc([N+](=O)[O-])ccc2Oc2ccc(OC)cc2)c1)C(C)=O 31585986 HPWRFVHQHFMUAV-UHFFFAOYSA-N 463.490 5.016 5 20 JKBD Cc1c(NC(=O)CCNc2ccc(C(F)(F)F)cc2[N+](=O)[O-])cccc1C(=O)Nc1ccccc1 72051234 JORHRARXNGYGCW-UHFFFAOYSA-N 486.450 5.615 5 20 JKBD Cc1c(C(=O)N[C@H](c2ccccc2)c2ccc3nc(C(F)(F)F)[nH]c3c2)cccc1[N+](=O)[O-] 105573843 JYPCNYYONKZASI-HXUWFJFHSA-N 454.408 5.318 5 20 JKBD COc1cc(C(=O)Nc2sc(C)c(C)c2C(N)=O)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 110046596 JXPHJKUBZMZBIP-UHFFFAOYSA-N 475.910 5.079 5 20 JKBD CCCN(Cc1nnc(-c2ccccc2Cl)o1)C(=O)c1ccc(C(C)(C)C)c([N+](=O)[O-])c1 489000315 FNDCCXLYOMJASE-UHFFFAOYSA-N 456.930 5.648 5 20 JKBD C[C@H](NC(=O)c1ccc(Sc2nc3ccccc3s2)c([N+](=O)[O-])c1)c1ccc2c(c1)CC(=O)N2 501054865 ONMOMAWOUXEVCI-ZDUSSCGKSA-N 490.566 5.341 5 20 JKBD C[C@@H]1C[C@@H](C)CN(c2ccc(C(=O)Nc3cc(F)ccc3OC[C@H]3CCCO3)cc2[N+](=O)[O-])C1 502365688 LKZASZPSDANEPV-MBOZVWFJSA-N 471.529 5.026 5 20 JKBD CC[C@H](C)n1c(SCc2cc(OC)c(OC(F)F)cc2[N+](=O)[O-])nnc1-c1ccccc1 504323014 YXJRXPJLROEXTD-ZDUSSCGKSA-N 464.494 5.727 5 20 JKBD Cc1ccc(-c2nc(NC(=O)c3cc(OCC(F)(F)F)ccc3[N+](=O)[O-])sc2C)s1 504831072 MVRMAOPVUZPRRZ-UHFFFAOYSA-N 457.455 5.590 5 20 JKBD Cc1ccc(C(=O)Nc2ccccc2)cc1NC(=O)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-] 515161632 LLDXICBBGXGXCW-UHFFFAOYSA-N 473.407 5.349 5 20 JKBD COc1ccc(-c2ccc(CNCc3cccc(NC(=O)c4ccc(C)cc4)c3)o2)c([N+](=O)[O-])c1 518263084 PSZDANUXWYHFNL-UHFFFAOYSA-N 471.513 5.714 5 20 JKBD Cc1nccc(CNC(=O)c2c3c(nc4ccccc24)/C(=C/c2cccc([N+](=O)[O-])c2)CCC3)n1 518326925 MVXGZQAFVWUGQC-XMHGGMMESA-N 465.513 5.048 5 20 JKBD COc1cccc(N2CC[C@@H](CNC(=O)c3cc([N+](=O)[O-])ccc3Sc3ccccc3)C2)c1 522558983 ARWOJKZAXPKYFN-SFHVURJKSA-N 463.559 5.011 5 20 JKBD Cc1ccc(NC(=O)[C@H](Sc2nnc(-c3ccc(F)cc3)n2C)c2ccccc2)c([N+](=O)[O-])c1 591886328 ZCPDODOBUZJHDQ-OAQYLSRUSA-N 477.521 5.310 5 20 JKBD O=C(C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)N1CCC[C@H]1c1ccc(F)cc1 592950230 QZKQKOGPDIURPY-YEZCMDQSSA-N 487.556 6.638 5 20 JKBD COc1ccc(N(Cc2cccs2)C(=O)CSCc2ccc(OC)c([N+](=O)[O-])c2)cc1 603565726 NIMMTUMWIGQHMF-UHFFFAOYSA-N 458.561 5.140 5 20 JKBD COc1ccc(CSCC(=O)N(Cc2ccccc2)[C@H](C)c2cccs2)cc1[N+](=O)[O-] 603569279 FJZDTWVJSUWSIJ-QGZVFWFLSA-N 456.589 5.688 5 20 JKBD CCOc1cc(C(=O)N[C@H](C)c2ccc(Oc3ccccc3)c(F)c2)c([N+](=O)[O-])cc1OC 603991577 MWQJFEGCSSTLPR-OAHLLOKOSA-N 454.454 5.425 5 20 JKBD O=[N+]([O-])c1ccc(-c2nn(-c3ccccc3)cc2CNCc2ccc(Oc3cccnc3)c(F)c2)cc1 608836674 DNMLWDCCLMTYFI-UHFFFAOYSA-N 495.514 6.064 5 20 JKBD COc1ccc(CSCC(=O)Nc2ccc(-c3nc4ccccc4n3C)cc2)cc1[N+](=O)[O-] 608954217 CFIGPLURZHKXSK-UHFFFAOYSA-N 462.531 5.029 5 20 JKBD Cc1ccc(NC(=O)c2ccc(NC3CCN(C(=O)c4ccccc4F)CC3)c([N+](=O)[O-])c2)cc1 608972783 GMUNRZVANDPIOS-UHFFFAOYSA-N 476.508 5.011 5 20 JKBD Cc1c(NC(=O)c2cc(OCC(F)(F)F)ccc2[N+](=O)[O-])cccc1OCC(F)(F)F 609022529 QFIAOWRKVCMEJO-UHFFFAOYSA-N 452.307 5.038 5 20 JKBD C[C@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccc(CC(=O)Nc2ccccc2F)cc1 609065147 AHWVLMNPIHCHIY-HNNXBMFYSA-N 453.495 5.034 5 20 JKBD Cc1ccccc1-c1cc(C(=O)Nc2ccnn2-c2ccc([N+](=O)[O-])cc2)c2cnn(C(C)C)c2n1 609151288 ARJMEESQMBUWSB-UHFFFAOYSA-N 481.516 5.334 5 20 JKBD CCOc1ccc(OCC)c(NC(=S)/C(=C(/O)c2ccc([N+](=O)[O-])cc2)[n+]2cccc(C)c2)c1 726961439 BEDFWCVCFSVTRM-UHFFFAOYSA-O 480.566 5.311 5 20 JKBD C[C@@H](Nc1ccc(C(=O)Nc2ccc(NC(=O)OC(C)(C)C)nc2)cc1[N+](=O)[O-])c1ccccn1 727339857 VVNDFLALJKVXGD-OAHLLOKOSA-N 478.509 5.157 5 20 JKBD C[C@H]1Cc2ccccc2N1Cc1ccoc1C(=O)O[C@H](C)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 728688310 OKABTLUGNBNWDW-JKSUJKDBSA-N 474.473 5.107 5 20 JKBD C[C@H](NC(=O)COC(=O)c1csc(-c2ccc([N+](=O)[O-])cc2)n1)c1ccc(Cl)cc1Cl 747956243 PRMDVMAPLHTYIC-NSHDSACASA-N 480.329 5.059 5 20 JKBD Cc1csc(-c2ccc(NC(=O)c3ccc(OS(=O)(=O)c4cccc([N+](=O)[O-])c4)cc3)cc2)n1 751237417 IMKLFHACIWWHMT-UHFFFAOYSA-N 495.538 5.047 5 20 JKBD Cc1cc(C(=O)Oc2ccc3c(-c4ccc([N+](=O)[O-])cc4)cc(=O)oc3c2)c2cnn(C(C)C)c2n1 786280390 ODHFEVRJFZOPAO-UHFFFAOYSA-N 484.468 5.221 5 20 JKBD Cc1nn(Cc2ccc(C(=O)Nc3ccc(-c4nnc5n4CCCCCC5)cc3)cc2)c(C)c1[N+](=O)[O-] 811388209 GGWUCQLJMVLRBP-UHFFFAOYSA-N 499.575 5.084 5 20 JKBD O=C(Nc1cc(-c2nnc3n2CCCCC3)ccc1Cl)c1ccc(Br)c([N+](=O)[O-])c1 817844091 PJMLWIMPUWAINL-UHFFFAOYSA-N 490.745 5.248 5 20 JKBD CC(C)Cn1cc([C@H]2N(Cc3ccc(-c4ccc([N+](=O)[O-])cc4)o3)CC23CCOCC3)cn1 849479417 QMHPKESCDAQGTH-XMMPIXPASA-N 450.539 5.061 5 20 JKBD COc1cccc([C@H](CNC(=O)/C=C/c2ccc([N+](=O)[O-])cc2)c2c[nH]c3ccccc23)c1OC 912664140 XFLRTVYEORDMQK-UXZSZYKQSA-N 471.513 5.055 5 20 JKBD COc1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2N2CCCCC2)cc1NC(=O)c1cccc(F)c1 916057349 ANSAPDHUUNCEGV-UHFFFAOYSA-N 492.507 5.237 5 20 JKBD CCN(Cc1ccncc1)C(=O)c1cc([N+](=O)[O-])ccc1N1CCC(Cc2ccccc2)CC1 917358317 WSRIYFGJKXYDTB-UHFFFAOYSA-N 458.562 5.111 5 20 JKBD C[C@H](OC(=O)CCCc1ccc(Cl)cc1)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 919387941 WXZQIDPMOICHBK-LBPRGKRZSA-N 458.820 5.160 5 20 JKBD COc1cc(C)ccc1Oc1ccc(F)cc1NC(=O)c1cc([N+](=O)[O-])c(C)c([N+](=O)[O-])c1 920028430 DKEVQPZDUOVXST-UHFFFAOYSA-N 455.398 5.312 5 20 JKBD Cc1ccc(NC(=O)c2cccc(C(F)(F)F)c2)cc1NC(=O)c1cc(Cl)ccc1[N+](=O)[O-] 920844798 GNOHNRYGAIILRO-UHFFFAOYSA-N 477.826 6.080 5 20 JKBD O=C(COc1cccc2ccccc12)Nc1ccc(C2(NC(=O)c3ccc([N+](=O)[O-])o3)CCC2)cc1 1786676055 HFYJDQUWFLYVQC-UHFFFAOYSA-N 485.496 5.168 5 20 JKBD Cc1ccc(C(=O)Nc2ccc(C3(NC(=O)/C=C/c4ccc([N+](=O)[O-])o4)CCC3)cc2)cc1F 1790261282 KOQYMUKLVPHUBJ-PKNBQFBNSA-N 463.465 5.096 5 20 JKBD Cc1ccc(CC(=O)NC2(c3ccc(NC(=O)c4cc(Cl)cc([N+](=O)[O-])c4C)cc3)CCC2)cn1 1790774772 ZWQHDEBBFWUOQR-UHFFFAOYSA-N 492.963 5.250 5 20 JKBD COc1cc(CC(=O)NC2(c3ccc(NC(=O)[C@H]4C[C@H]4c4ccccc4)cc3)CCC2)ccc1[N+](=O)[O-] 1791534340 SFICIJOVOIBVGU-ZEQRLZLVSA-N 499.567 5.084 5 20 JKBD CC[C@H](C)[C@@H](C(=O)N1CCCC2(CCN(C(=O)/C=C/c3ccc([N+](=O)[O-])o3)CC2)C1)c1ccccc1 1809153332 GXFKNYHIGDKNQY-KRQJIXKBSA-N 493.604 5.262 5 20 JKBD Cc1c(C(=O)N2CC[C@@H](CNC(=O)[C@H]3CC[C@H](C)CC3)[C@@H]2c2cccnc2)cc(Cl)cc1[N+](=O)[O-] 1813550402 YVGVLNMNWOHQMA-ILXZRYGISA-N 499.011 5.098 5 20 JKBD Cc1ccc(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)c3cccc(F)c3[N+](=O)[O-])[nH]n2)cc1Cl 1814590789 VBQQHPHYCYKZNZ-IBGZPJMESA-N 485.903 5.039 5 20 JKBD CCCCC[C@@H](C)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)Cn2ccc3ccc([N+](=O)[O-])cc32)[nH]n1 1822003111 YWNJUQOZSMQYBA-GCJKJVERSA-N 494.596 5.181 5 20 JKBD Cc1ccc(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)/C=C/c3ccc([N+](=O)[O-])o3)CC2)cc1Cl 1823904630 LGDCPPZMDQGIPW-FGBWHXJSSA-N 485.968 5.096 5 20 JKBD O=C(c1cc2cc([N+](=O)[O-])ccc2s1)N1CCC([C@@H]2CCCCN2C(=O)c2ccccc2)CC1 1829876271 MOMSCDQYBKMKOQ-QFIPXVFZSA-N 477.586 5.357 5 20 JKBD O=C(c1ccc2ccoc2c1)N1CCC([C@@H]2CCCCN2C(=O)c2cccc(F)c2[N+](=O)[O-])CC1 1830621232 HSLVVPHPAGWMKQ-QFIPXVFZSA-N 479.508 5.027 5 20 JKBD CC[C@H]1CC[C@H](C(=O)N2CCCC[C@H]2C2CCN(C(=O)c3cc(F)cc([N+](=O)[O-])c3)CC2)CC1 1831695523 BFAAYXGMMGCZDA-WXVUKLJWSA-N 473.589 5.184 5 20 JKBD Cc1ccc(-c2nc(CC(=O)O[C@@H](C)C(=O)Nc3ccc([N+](=O)[O-])cc3C(F)(F)F)cs2)cc1 17205607 SJZALGMFRCZZKW-ZDUSSCGKSA-N 493.463 5.158 5 20 JKBD C[C@H](c1ccccc1)n1c(SCC(=O)Nc2ccc([N+](=O)[O-])cc2Cl)nc2ccccc2c1=O 20893058 NVLQKHQYXSGLDN-OAHLLOKOSA-N 494.960 5.298 5 20 JKBD Cc1ccc(C)c(SCc2nc(=O)c3c(C)c(C(=O)Nc4cccc([N+](=O)[O-])c4)sc3[nH]2)c1 29895763 IRASKHFJWXBITE-UHFFFAOYSA-N 480.571 5.363 5 20 JKBD COc1cc(C(=O)Nc2cc(NC(C)=O)ccc2Cl)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 68736898 MPSNDEFUQPKYSC-UHFFFAOYSA-N 490.299 5.913 5 20 JKBD COc1cc(/C=C(/Cl)c2nc3scc(-c4ccc(C)cc4)c3c(=O)[nH]2)cc([N+](=O)[O-])c1O 229928517 JSKDAKMOOVDHLQ-VIZOYTHASA-N 469.906 5.319 5 20 JKBD C[C@@H]1CN(c2ccc(NC(=O)c3cc([N+](=O)[O-])ccc3Sc3ccccc3)cn2)C[C@@H](C)O1 483433530 BKAZUCXRVCFKJJ-IAGOWNOFSA-N 464.547 5.007 5 20 JKBD O=C(Nc1cccc(Cn2cncn2)c1)c1ccc(Sc2nc3ccccc3s2)c([N+](=O)[O-])c1 487557704 MOTODHHSYLSIGX-UHFFFAOYSA-N 488.554 5.248 5 20 JKBD Cc1c(NC(=O)c2ccc(N3C[C@@H](C)C[C@H](C)C3)c([N+](=O)[O-])c2)cccc1C(=O)Nc1ccccc1 498468424 YUQLSEIPNMLBJB-OALUTQOASA-N 486.572 5.890 5 20 JKBD COc1ccc(CC[C@@H]2CCCCN2C(=O)Nc2cc([N+](=O)[O-])ccc2OC(F)F)cc1OC 503268505 MYRUMJYRNUHVRY-INIZCTEOSA-N 479.480 5.233 5 20 JKBD CC(C)N(CC(=O)Nc1ccccc1C(F)(F)F)C(=O)c1cc2cc([N+](=O)[O-])ccc2s1 505243168 VGWMNTOQGYXQKX-UHFFFAOYSA-N 465.453 5.318 5 20 JKBD O=C(CC1CCCCC1)NC1CCC(C(=O)Nc2nc(-c3cccc([N+](=O)[O-])c3)cs2)CC1 508922757 MQNPXRWWAGWYKG-UHFFFAOYSA-N 470.595 5.302 5 20 JKBD CC(=O)Nc1ccc(Cl)cc1NC(=O)c1ccc(NCc2ccccc2Cl)c([N+](=O)[O-])c1 520180177 JNSBZCDQURJEKB-UHFFFAOYSA-N 473.316 5.724 5 20 JKBD CC(C)CC(=O)Nc1cccc(CNC(=O)CSc2ccc(C(F)(F)F)cc2[N+](=O)[O-])c1 520399755 PQYRFGFNWKTZBE-UHFFFAOYSA-N 469.485 5.007 5 20 JKBD CN(Cc1ccccc1[N+](=O)[O-])C(=O)C(=O)Nc1ccc(Oc2ccccc2)cc1C(F)(F)F 520927384 BXLRBOBBIZJHQD-UHFFFAOYSA-N 473.407 5.003 5 20 JKBD CC(=O)N1CCc2c(sc3nc(-c4cc([N+](=O)[O-])ccc4C)cc(-c4ccc(C)cc4)c23)C1 542515570 SPYMLEKVDVILLG-UHFFFAOYSA-N 457.555 6.060 5 20 JKBD CN(C)C(=O)c1cc(NC(=O)c2cc([N+](=O)[O-])ccc2Sc2ccc(Cl)cc2)ccc1Cl 603623756 LPLMIIBBCUWDCB-UHFFFAOYSA-N 490.368 6.007 5 20 JKBD O=C(C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)N1CCCO[C@@H](c2ccccc2)C1 609230559 LGXRQLPNOSHXFQ-CUPKDKKMSA-N 499.592 6.125 5 20 JKBD C[C@H](Nc1ccc(C(=O)NCCCc2cccc(Br)c2)cc1[N+](=O)[O-])c1ccccn1 609410212 BQPOQQWAWFPQRX-INIZCTEOSA-N 483.366 5.288 5 20 JKBD COc1ccc(CC(=O)Nc2ccc(NC(=O)OC(C)(C)C)cc2C(F)(F)F)cc1[N+](=O)[O-] 729654860 FWSVSRKXVOPEIP-UHFFFAOYSA-N 469.416 5.150 5 20 JKBD Cc1cc(C(=O)O[C@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2C(F)(F)F)cc(C)c1OC(F)F 730858644 PEXYQKYPXNOVOA-LLVKDONJSA-N 476.354 5.016 5 20 JKBD CC(C)(C)Cc1nc2cc(NC(=O)c3cc([N+](=O)[O-])ccc3I)ccc2o1 731199787 YDBXJADNHICQTJ-UHFFFAOYSA-N 479.274 5.182 5 20 JKBD C[C@H](OC(=O)c1csc(-c2ccc(Cl)c(Cl)c2)n1)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 744597510 SXMHMLWAQPZBFO-JTQLQIEISA-N 491.312 5.993 5 20 JKBD C[C@@H](c1nn(CN(C)Cc2cc([N+](=O)[O-])ccc2Cl)c(=S)n1-c1ccc(Cl)cc1)N(C)C 813202872 QUERFLWPLRTERL-AWEZNQCLSA-N 495.436 5.330 5 20 JKBD Cc1cc(-c2csc(NC(=O)c3ccccc3[N+](=O)[O-])n2)c(C)n1Cc1ccccc1Cl 857338526 LFXUYVZTCCBHHX-UHFFFAOYSA-N 466.950 6.091 5 20 JKBD Cc1ccc(-c2nc(CC(=O)Oc3ccc(NC(=O)c4cccc([N+](=O)[O-])c4)cc3)cs2)o1 914712134 UQVVFRPXFUPDAZ-UHFFFAOYSA-N 463.471 5.020 5 20 JKBD Cc1ccc(NC(=O)[C@H](OC(=O)Cc2csc(-c3ccc(C)o3)n2)c2ccccc2)c([N+](=O)[O-])c1 914966553 JGLGLPHRLRCLCQ-HSZRJFAPSA-N 491.525 5.394 5 20 JKBD Cc1ccccc1-n1ncc(C(=O)O[C@@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)c1C(F)(F)F 914984377 IKTZXTHIYSMRIF-ZDUSSCGKSA-N 487.394 5.076 5 20 JKBD CCCN(Cc1nnc(-c2ccccc2Cl)o1)C(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1 915307523 GOZWDBBNHBBEPK-UHFFFAOYSA-N 450.282 5.396 5 20 JKBD O=C(Nc1ccc(OC(=O)c2ccc(F)cc2NC(=O)c2ccoc2)cc1)c1cccc([N+](=O)[O-])c1 916953242 MMGLMRGPLHBGML-UHFFFAOYSA-N 489.415 5.051 5 20 JKBD Cn1ccc(COC(=O)c2c3c(nc4ccccc24)/C(=C/c2ccc([N+](=O)[O-])cc2)CCC3)cc1=O 918791474 NWRGKOJDPDIRGV-HMMYKYKNSA-N 481.508 5.076 5 20 JKBD Cc1c([N+](=O)[O-])cc(C(=O)OCC(=O)N2c3ccccc3Sc3ccc(Cl)cc32)cc1[N+](=O)[O-] 919224842 NLETWNMNWVATKF-UHFFFAOYSA-N 499.888 5.451 5 20 JKBD C[C@H](OC(=O)[C@@H](C)SCc1ncc(-c2ccc(Cl)cc2)o1)C(=O)Nc1ccccc1[N+](=O)[O-] 920673915 YALKSVHZNIUHPH-UONOGXRCSA-N 489.937 5.095 5 20 JKBD C[C@@H](C(=O)Nc1ccc(C2(NC(=O)c3cc4cc([N+](=O)[O-])ccc4s3)CCC2)cc1)C1(O)CCC1 1785831778 JPTXDELDLKJTSO-INIZCTEOSA-N 493.585 5.108 5 20 JKBD O=C(NC1(c2ccc(NC(=O)[C@H]3C[C@@H]3C3CC3)cc2)CCC1)c1cc(Br)ccc1[N+](=O)[O-] 1786056014 JQJSTNFAVXVJLV-MOPGFXCFSA-N 498.377 5.151 5 20 JKBD O=C(CCc1cccc([N+](=O)[O-])c1)Nc1ccc(C2(NC(=O)c3cc(Cl)ccn3)CCC2)cc1 1786602191 FQHUGQKAYSNUGU-UHFFFAOYSA-N 478.936 5.024 5 20 JKBD Cc1ccc2oc(C(=O)Nc3ccc(C4(NC(=O)/C=C/c5ccccc5[N+](=O)[O-])CCC4)cc3)cc2n1 1788324874 CXLRWGHOGVGKGM-RIYZIHGNSA-N 496.523 5.506 5 20 JKBD COc1cc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2sc4ccccc4c2Cl)C3)ccc1[N+](=O)[O-] 1803818328 DSCAAWKGEUDCBS-MUJYYYPQSA-N 499.976 5.037 5 20 JKBD O=C(CCc1cccc([N+](=O)[O-])c1)N1CCC([C@@H]2CCCCN2C(=O)c2ccc(Cl)cc2)CC1 1830024313 AZGDXAQNXBPPKR-DEOSSOPVSA-N 483.996 5.114 5 20 JKBD Cc1c(C(=O)N2CCCC[C@H]2C2CCN(C(=O)CCc3ccoc3)CC2)cc(Cl)cc1[N+](=O)[O-] 1830738359 QDBZRUCLCLFARH-QFIPXVFZSA-N 487.984 5.016 5 20 JKBD Cc1c(Cl)cccc1-n1c(S[C@H](C)C(=O)Nc2ccccc2[N+](=O)[O-])nnc1-c1ccncc1 10318177 UISLBVIYBJXLFI-OAHLLOKOSA-N 494.964 5.319 5 20 JKBD C[C@H](OC(=O)c1c(Cl)cccc1Cl)C(=O)Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1 11030125 OUHGNZLACBSINH-JTQLQIEISA-N 466.302 5.209 5 20 JKBD Cc1ccc(NC(=O)[C@H](Sc2nnc(/C=C/c3ccc(C)o3)[nH]2)c2ccccc2)c([N+](=O)[O-])c1 12839563 QOTJJYKMIZKFFZ-UFSNDUKISA-N 475.530 5.565 5 20 JKBD Cc1ccccc1[C@@H](C)NC(=O)[C@@H](C)OC(=O)c1ccccc1C(=O)c1ccc(Cl)c([N+](=O)[O-])c1 22669890 BMZBILYZIOVXIJ-IAGOWNOFSA-N 494.931 5.210 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)N[C@@H](C)c2ccc(NC(=O)Nc3ccccc3)cc2)cc1SC 484694288 GYWBVCAGHFWSSP-HNNXBMFYSA-N 480.546 5.460 5 20 JKBD O=C(N[C@H](COc1ccccc1)c1ccccc1)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-] 502325281 ILEJQJMXPSAWAN-HXUWFJFHSA-N 460.408 5.086 5 20 JKBD O=[N+]([O-])c1ccccc1CSc1nnc(-c2ccc(Cl)cc2Cl)n1Cc1ccco1 502591097 KGJLWYUSTXJPPY-UHFFFAOYSA-N 461.330 6.094 5 20 JKBD C[C@H](NC(=O)c1ccc(N[C@@H](C)c2ccccn2)c([N+](=O)[O-])c1)c1ccc(C(F)(F)F)cc1 506889145 DRGSRSRAVBDCPY-GJZGRUSLSA-N 458.440 5.673 5 20 JKBD COc1cc(C(=O)N[C@@H](c2ccc(Cl)cc2)c2ccsc2)c([N+](=O)[O-])cc1OC(F)F 512750544 WJHLKGWJNHCOHU-SFHVURJKSA-N 468.865 5.439 5 20 JKBD O=C(Nc1ccccc1C(=O)N1CC=C(c2ccc(F)cc2)CC1)c1ccc([N+](=O)[O-])cc1Cl 515005055 ZSOGBGDQCRAOJZ-UHFFFAOYSA-N 479.895 5.569 5 20 JKBD C[C@H](NC(=O)c1ccc(N[C@@H](C)c2ccccn2)c([N+](=O)[O-])c1)c1ccc(OCc2cccnc2)cc1 516594383 ITWPMHIDOZDVJL-PMACEKPBSA-N 497.555 5.628 5 20 JKBD CCCNC(=O)c1cccc(CNCc2ccc(-c3ccc([N+](=O)[O-])cc3Br)o2)c1 517537245 JZMARKNFQYKRPH-UHFFFAOYSA-N 472.339 5.047 5 20 JKBD C[C@@H](NC(=O)c1csc(-c2ccc([N+](=O)[O-])cc2)n1)c1ccc(OCc2cccnc2)cc1 522092993 WGZOIKRRERIJQM-MRXNPFEDSA-N 460.515 5.183 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Cl)N(Cc1ccc(Cl)c(Cl)c1)Cc1ccccn1 522849196 PXOLBZYHWCMQDP-UHFFFAOYSA-N 465.724 6.184 5 20 JKBD O=C(c1csc(-c2cccc([N+](=O)[O-])c2)n1)N1CCC[C@H](c2nc(-c3ccc(Cl)cc3)no2)C1 524157726 QXIMWEHYSWYFOP-INIZCTEOSA-N 495.948 5.442 5 20 JKBD C[C@H]1c2ccsc2CCN1C(=O)C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1 590655421 SMCDTYSDNYUYOF-KXGFGANYSA-N 475.595 6.343 5 20 JKBD CC1CCN(c2ccc(C(=O)N3C[C@H](C(F)(F)F)C[C@@H](C(F)(F)F)C3)cc2[N+](=O)[O-])CC1 604258286 WXQIATFCDYGJDD-HUUCEWRRSA-N 467.410 5.034 5 20 JKBD COc1cc(C(=O)Nc2cc(C)nn2-c2cccc(Cl)c2)c([N+](=O)[O-])cc1OCc1cscn1 604384746 GUCIHJSCXHMUIX-UHFFFAOYSA-N 499.936 5.039 5 20 JKBD Cc1cc(Sc2ncccn2)ccc1NC(=O)c1ccc(NCc2ccccc2)c([N+](=O)[O-])c1 608904213 VQFGPFUOFCUXKH-UHFFFAOYSA-N 471.542 5.709 5 20 JKBD Cc1ccc2nc([C@@H]3CCCN(C(=O)c4ccc(N[C@H](C)c5ccccn5)c([N+](=O)[O-])c4)C3)[nH]c2c1 608986983 PCPKFJSGNCWJTC-UYAOXDASSA-N 484.560 5.367 5 20 JKBD O=C(c1ccc(Sc2nc3ccccc3s2)c([N+](=O)[O-])c1)N1CCC[C@@H](N2CCCC2)C1 609346236 WAWVLEVMJLOSPW-QGZVFWFLSA-N 468.604 5.056 5 20 JKBD CN1CCN(C(=O)C/C(=C\c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)[C@H](c2ccccc2)C1 612591604 DJDCEZKCIUALJJ-MSMNXAATSA-N 498.608 5.651 5 20 JKBD CC(C)N(Cc1nnc(-c2cccc([N+](=O)[O-])c2)o1)C(=O)c1ccc2c(c1)-c1ccccc1C2 746134767 QQQQOUSFPXKHKM-UHFFFAOYSA-N 454.486 5.267 5 20 JKBD O=C(C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)NC[C@H]1COc2ccccc2C1 747585709 HVPPEMTTZLBKRI-IOVUBPJKSA-N 485.565 5.503 5 20 JKBD COc1c([N+](=O)[O-])cc(NCc2ccnc(Oc3ccc(F)cc3)c2)c([N+](=O)[O-])c1Br 749442294 PIMNNHJKZHNHJG-UHFFFAOYSA-N 493.245 5.213 5 20 JKBD CC(C)NC(=O)Nc1ccccc1C(=O)Oc1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2Cl)cc1 756772047 FTAXLWGPAMVUIB-UHFFFAOYSA-N 496.907 5.250 5 20 JKBD C[C@@H](OC(=O)/C(=C\c1ccc(F)cc1)c1cccs1)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl 772120346 AMSZSOOJXJAGDB-GPLLRDDGSA-N 474.897 5.560 5 20 JKBD COc1ccc(Oc2ccc([N+](=O)[O-])cc2C(=O)O[C@@H](C)C(=O)Nc2ccccc2SC)cc1 915443052 XETQTBQMFOWAEM-HNNXBMFYSA-N 482.514 5.302 5 20 JKBD O=C(Nc1ccc(C(=O)Nc2ccc(F)c([N+](=O)[O-])c2)cc1)c1ccc(Br)cc1 916371927 OZDVIEUJATYIST-UHFFFAOYSA-N 458.243 5.001 5 20 JKBD O=C(Nc1ccccc1C(=O)Nc1cccc(-c2nccs2)c1)c1ccc([N+](=O)[O-])cc1Cl 916677031 MDFUTIQBXUWSNZ-UHFFFAOYSA-N 478.917 5.876 5 20 JKBD O=C(Cn1cc(Br)c([N+](=O)[O-])n1)N1c2ccccc2Sc2ccc(Cl)cc21 917569171 SGDKWZFPUXDSNQ-UHFFFAOYSA-N 465.716 5.037 5 20 JKBD C[C@H](OC(=O)c1cc2cc([N+](=O)[O-])ccc2[nH]1)C(=O)N1c2ccccc2Sc2ccccc21 919514681 WEYNBMPTPKCDSA-AWEZNQCLSA-N 459.483 5.451 5 20 JKBD O=C(Cc1ccc([N+](=O)[O-])cc1F)NC1(c2ccc(NC(=O)c3ccnc(C(F)F)c3)cc2)CCC1 1787018508 SOUDFHJMENLWIT-UHFFFAOYSA-N 498.461 5.057 5 20 JKBD Cc1ccc(CC(=O)Nc2ccc(C3(NC(=O)c4ccc(Cl)o4)CCC3)cc2)cc1[N+](=O)[O-] 1790523921 BGKQDLFGHOPUNG-UHFFFAOYSA-N 467.909 5.140 5 20 JKBD Cc1cc(C(=O)NC2(c3ccc(NC(=O)c4cccc5ccoc45)cc3)CCC2)ncc1[N+](=O)[O-] 1790952388 CMNNDANNJVLACZ-UHFFFAOYSA-N 470.485 5.106 5 20 JKBD O=C(/C=C/c1ccccc1[N+](=O)[O-])Nc1ccc(C2(NC(=O)[C@H]3CCC(F)(F)C3)CCC2)cc1 1792315349 FROFPKIVIIIHKD-QKIXSCASSA-N 469.488 5.178 5 20 JKBD O=C(Nc1cc([C@@H]2CCCCN2C(=O)Cc2cccc([N+](=O)[O-])c2)[nH]n1)[C@@H]1CCC[C@@H]2CCCC[C@H]21 1818927380 UTSQDMYCKYTKDY-BQUSRXHISA-N 493.608 5.159 5 20 JKBD Cc1ccc(CC(=O)Nc2cc([C@@H]3CCCCN3C(=O)c3ccccc3C3CC3)[nH]n2)cc1[N+](=O)[O-] 1820921900 XSBNHAKFFKUEDA-QHCPKHFHSA-N 487.560 5.052 5 20 JKBD O=C(c1cc2cc([N+](=O)[O-])ccc2s1)N1CCC([C@@H]2CCCCN2C(=O)CCc2ccc[nH]2)CC1 1827109878 PNVREGCIDJNJTP-QFIPXVFZSA-N 494.617 5.004 5 20 JKBD C[C@H](Sc1nnc(-c2ccccc2F)n1C1CC1)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 17663683 KXZLDHZVPKXXAX-LBPRGKRZSA-N 452.471 5.231 5 20 JKBD Cc1ccc(NC(=O)[C@@H](OC(=O)Cc2c(C)nn(-c3ccccc3)c2C)c2ccccc2)c([N+](=O)[O-])c1 19195521 RJKSOLUTSSQIQM-MHZLTWQESA-N 498.539 5.171 5 20 JKBD COc1ccc([N+](=O)[O-])cc1NC(=O)[C@@H](C)Sc1nnc(-c2ccc(F)cc2)c2ccccc12 20854401 VMSBVQIWLJOFML-CQSZACIVSA-N 478.505 5.472 5 20 JKBD Cn1c(S[C@H](C(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)c2ccccc2)nc2ccsc2c1=O 26100935 IRYXREJLQXHTHU-KRWDZBQOSA-N 486.962 5.029 5 20 JKBD COc1cc(C(=O)N[C@@H](c2ccccc2)c2ccccn2)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 36836116 TYTLOUUKFCALRY-VWLOTQADSA-N 489.915 5.964 5 20 JKBD C[C@@H](Nc1ccc(C(=O)Nc2ccc(NC(=O)c3ccco3)cc2)cc1[N+](=O)[O-])c1ccccn1 108789443 AAFDHFHHPVOHAP-MRXNPFEDSA-N 471.473 5.261 5 20 JKBD C[C@H](Nc1ccc(C(=O)NC2CCN(Cc3ccc(Cl)cc3)CC2)cc1[N+](=O)[O-])c1ccccn1 108791357 WQLCUTXFDKDLMQ-SFHVURJKSA-N 493.995 5.211 5 20 JKBD COc1ccc(Oc2ccc([N+](=O)[O-])cc2C(=O)NCC2(c3ccc(F)cc3)CCOCC2)cc1 108877949 MTXGSIPHSGTIOH-UHFFFAOYSA-N 480.492 5.013 5 20 JKBD O=C(CSc1nc(-c2ccco2)nc2ccccc12)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 247328307 OFASMLDLPVJPNS-UHFFFAOYSA-N 474.420 5.548 5 20 JKBD O=C(Nc1ccc(Br)cc1Br)c1csc(-c2cccc([N+](=O)[O-])c2)n1 302993276 GETWKWVTNNVJRE-UHFFFAOYSA-N 483.141 5.496 5 20 JKBD CN(C(=O)c1ccc(Cl)cc1)c1ccc(NC(=O)C2CCN(c3ccccc3[N+](=O)[O-])CC2)cc1 303009578 MKEVYMLZWUWEKS-UHFFFAOYSA-N 492.963 5.380 5 20 JKBD COc1ccc(NC(=O)N[C@@H](C)c2cccc([N+](=O)[O-])c2)cc1NC(=O)c1ccc(Cl)cc1F 511475315 NPKIBCQLUMLYIX-ZDUSSCGKSA-N 486.887 5.531 5 20 JKBD COc1ccc([C@@H]2CCCN2C(=O)C/C(=C/c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)cc1 515004959 KTIRXZJFIILAKX-UWXJSXIPSA-N 499.592 6.508 5 20 JKBD CCN(C(=O)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1)c1ccc(Br)cn1 522582415 VWMDSHLNDJCRRE-UHFFFAOYSA-N 476.714 5.865 5 20 JKBD O=C(c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1)N(Cc1cccnc1)Cc1ccco1 602221284 SBDPXDYKNQTFBJ-UHFFFAOYSA-N 463.877 5.871 5 20 JKBD COCCN(C(=O)COc1ccccc1-c1ccccc1)c1nc(-c2ccc([N+](=O)[O-])cc2)cs1 603461261 JUMFUOUCCBVVKI-UHFFFAOYSA-N 489.553 5.444 5 20 JKBD O=C(Cn1c2ccccc2c(=O)c2ccccc21)Nc1cccc(C(=O)Nc2cccc(F)c2)c1 614955354 YKMOPVVTTZRSBT-UHFFFAOYSA-N 465.484 5.185 5 20 JKBD Brc1ccc2ccc3c(-c4c5ccccc5cc5ccccc45)ccc4ccc1c2c43 642772100 KUWCGBNNEWUNFH-UHFFFAOYSA-N 457.370 9.320 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Br)[C@@H](Nc1ccc2c(c1)CCCO2)c1ccccc1 725843604 XBLIIZQVYJZHDH-QFIPXVFZSA-N 482.334 5.474 5 20 JKBD COc1cc(Cl)ccc1CNC(=O)c1ccccc1NC(=O)c1ccc([N+](=O)[O-])cc1Cl 730794488 TYZQRTJAXDVCOF-UHFFFAOYSA-N 474.300 5.093 5 20 JKBD Cc1cccc(C(C)C)c1NC(=O)[C@@H](C)OC(=O)c1cc([N+](=O)[O-])ccc1N1CCCCC1 823259935 RQNPEQUTWFKNHE-GOSISDBHSA-N 453.539 5.201 5 20 JKBD CC(C)Sc1ccccc1C(=O)O[C@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 844172375 WJQRVLGUQXQXIH-GFCCVEGCSA-N 456.442 5.298 5 20 JKBD COc1cc(C(=O)Nc2ccnn2C2CCCC2)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 881376015 LVONFEGHBMEPAJ-UHFFFAOYSA-N 456.886 5.613 5 20 JKBD Cc1ccc(-c2nc(C)c(C(=O)O[C@H](C)C(=O)Nc3ccc([N+](=O)[O-])cc3C(F)(F)F)s2)o1 915467462 SCXGHNCFQWXXND-LLVKDONJSA-N 483.424 5.131 5 20 JKBD CCOC(=O)Nc1ccc(NC(=O)c2ccccc2C(=O)c2ccc(SC)c([N+](=O)[O-])c2)cc1 916069878 MGWDTBJDLJKLTE-UHFFFAOYSA-N 479.514 5.368 5 20 JKBD CC(C)N(Cc1nnc(-c2cccc([N+](=O)[O-])c2)o1)C(=O)[C@H](C)Oc1ccc(C(C)(C)C)cc1 916550696 CKFKLSJZUHETAV-KRWDZBQOSA-N 466.538 5.147 5 20 JKBD CC1=C(C(=O)Nc2cccnc2Cl)[C@@H](c2ccc([N+](=O)[O-])cc2)NC(=S)N1c1cccc(C)c1 917378412 JXGQGGXXDWTRFL-OAQYLSRUSA-N 493.976 5.300 5 20 JKBD O=C(Nc1ccccc1C(=O)OCCc1ccc([N+](=O)[O-])cc1)c1ccccc1Br 918990580 BHNYCMJYWQABQU-UHFFFAOYSA-N 469.291 5.009 5 20 JKBD C[C@@H](Nc1ccc(C(=O)O[C@@H](C(=O)N2CCCCC2)c2ccccc2)cc1[N+](=O)[O-])c1ccccn1 920545431 RDNDZQPYXCKNGO-KBMIEXCESA-N 488.544 5.074 5 20 JKBD C[C@@H](CC(=O)O[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Br)c1ccccc1)C1CC1 920721637 GSPLGKCOMJVRSI-RNODOKPDSA-N 461.312 5.017 5 20 JKBD CC(C)CC(=O)Nc1ccc(C2(NC(=O)Cc3cc(Br)ccc3[N+](=O)[O-])CCC2)cc1 1787662824 OWVRRZQEQCBPCF-UHFFFAOYSA-N 488.382 5.080 5 20 JKBD Cc1nc2ccccn2c1C(=O)NC1(c2ccc(NC(=O)/C=C/c3ccccc3[N+](=O)[O-])cc2)CCC1 1792317724 KBQLOJXOOVGHOY-XNTDXEJSSA-N 495.539 5.012 5 20 JKBD CC[C@H]1CC[C@H](C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cc(Cl)cc([N+](=O)[O-])c2C)CC1 1800712997 QLTRFBCDSKRZLB-FWIIZBITSA-N 461.990 5.025 5 20 JKBD C[C@@H](Sc1ccccc1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc2cc([N+](=O)[O-])ccc2s1 1801205871 FCQMJWKIWNZUEN-OQIJWPOYSA-N 495.626 5.242 5 20 JKBD CC(C)[C@@H](C(=O)N1CCCC[C@@H]1c1cc(NC(=O)/C=C/c2ccc([N+](=O)[O-])o2)n[nH]1)c1ccccc1 1814965528 MFQIHTUTYVCFAP-YOVMVTRZSA-N 491.548 5.056 5 20 JKBD Cc1ccc(C(=O)Nc2cc([C@H]3CCCCN3C(=O)CSc3ccccc3[N+](=O)[O-])[nH]n2)c(C)c1 1820481711 YTOGJWKYACLYJZ-HXUWFJFHSA-N 493.589 5.033 5 20 JKBD O=C(/C=C/c1ccccc1[N+](=O)[O-])N1CCC([C@@H]2CCCCN2C(=O)c2cccc3cc[nH]c23)CC1 1828320428 SERRVISZCQWOIO-LCJITAHGSA-N 486.572 5.023 5 20 JKBD O=C(c1cc2cc([N+](=O)[O-])ccc2s1)N1CC2(CCCN2C(=O)c2cc3cccc(F)c3s2)C1 1843702832 RZYDUKFYAUCIOB-UHFFFAOYSA-N 495.557 5.294 5 20 JKBD COc1cccc(NCc2nnc(SCc3ccccc3[N+](=O)[O-])n2C2CCCCC2)c1 10073036 OHTLDPIUVALOJJ-UHFFFAOYSA-N 453.568 5.605 5 20 JKBD O=C(O[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1)c1ccc([N+](=O)[O-])cc1Cl 11028658 KAOPTAYPPRNXQI-IBGZPJMESA-N 490.255 5.347 5 20 JKBD O=C(Cc1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1)Nc1ccc(Cc2ccncc2)cc1 14893563 IRPWAXJVZOOYLX-UHFFFAOYSA-N 489.535 5.615 5 20 JKBD COc1cc(C(=O)Nc2ccccc2Oc2ccccc2Cl)c([N+](=O)[O-])cc1OC(F)F 29583315 JJDLCSCACIGBKK-UHFFFAOYSA-N 464.808 5.903 5 20 JKBD O=C(C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1)N1CCCc2cccc(OC(F)F)c21 72029541 VUGSKJFWQFGNIX-UHFFFAOYSA-N 499.436 5.411 5 20 JKBD C[C@H](OC(=O)c1ccccc1Oc1cccnc1)C(=O)Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1 110831972 DZGXOLYDOTXCJT-HNNXBMFYSA-N 490.497 5.090 5 20 JKBD CSc1ccc([N+](=O)[O-])c(C(=O)Nc2ccc(Cl)cc2C(=O)N2[C@@H](C)CCC[C@H]2C)c1 302996907 YNRNCIFVEJHOOO-OKILXGFUSA-N 461.971 5.626 5 20 JKBD CC(C)Cn1c(SCC(=O)NCc2ccc([N+](=O)[O-])cc2)nnc1-c1ccc(Cl)cc1Cl 490107624 TYKOAXSOLWIDGN-UHFFFAOYSA-N 494.404 5.225 5 20 JKBD CN(CCCCCc1cc(-c2cccc(F)c2)no1)C(=O)c1csc(-c2cccc([N+](=O)[O-])c2)n1 499702689 BGJOTSXKIZLPDY-UHFFFAOYSA-N 494.548 5.997 5 20 JKBD CCn1c(SCC(=O)Nc2cc([N+](=O)[O-])c(C)cc2C)nnc1-c1ccc(Cl)cc1Cl 502617922 LMSXSLXLWLSXOO-UHFFFAOYSA-N 480.377 5.528 5 20 JKBD Cc1nc(COc2ccccc2C(=O)Nc2nc(-c3cccc([N+](=O)[O-])c3)cs2)cs1 502869554 XTUUALDIVVAQKM-UHFFFAOYSA-N 452.517 5.315 5 20 JKBD CC(C)CCSc1ccc(C(=O)N2CCC(C(=O)Nc3cccc(F)c3)CC2)cc1[N+](=O)[O-] 505188442 DAKXADYSKBOTOQ-UHFFFAOYSA-N 473.570 5.363 5 20 JKBD COc1ccc(CNCc2ccc(Oc3ccc(C(C)(C)C)cc3)c([N+](=O)[O-])c2)cc1NC(C)=O 507911558 BVMHSYLUKPSXFH-UHFFFAOYSA-N 477.561 5.941 5 20 JKBD COc1cc(C(=O)NC2(c3ccc(Cl)cc3)CCCC2)c([N+](=O)[O-])cc1OCc1cscn1 509079903 JDABFFGKJWAVAW-UHFFFAOYSA-N 487.965 5.492 5 20 JKBD Cc1cccc(COc2ccc([C@@H](C)Nc3ccc(C(=O)N4CCOCC4)cc3[N+](=O)[O-])cc2)c1 517093053 RXTQSKQEVXAMCW-HXUWFJFHSA-N 475.545 5.128 5 20 JKBD C[C@@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)N(Cc1ccccn1)c1ccc(Br)cc1 518857799 AFFKIZZUOIWHRX-CQSZACIVSA-N 490.741 5.406 5 20 JKBD Cn1ccnc1[C@H](NCc1ccc(-c2ccc([N+](=O)[O-])cc2Br)o1)c1cccc(F)c1 520954160 CSJANMBGSUOJSR-OAQYLSRUSA-N 485.313 5.369 5 20 JKBD COc1ccc(C(=O)N2CCCC2)cc1NC(=O)c1ccc(SCCC(C)C)c([N+](=O)[O-])c1 521103840 XOUJTQZAEUKWSA-UHFFFAOYSA-N 471.579 5.230 5 20 JKBD COCCN(Cc1cccnc1)C(=O)c1cc([N+](=O)[O-])ccc1Sc1ccc(Cl)cc1 524338923 XEZPRIDUPMZATO-UHFFFAOYSA-N 457.939 5.083 5 20 JKBD COCCN(C(=O)[C@H]1C[C@@H]1c1ccccc1Cl)c1nc(-c2ccc([N+](=O)[O-])cc2)cs1 552999543 LLUONMRXEFMGRQ-MSOLQXFVSA-N 457.939 5.155 5 20 JKBD O=C(NC1CC1)c1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2Sc2ccc(Cl)cc2)cc1 589736960 RHBHYKSKTNTUHS-UHFFFAOYSA-N 467.934 5.544 5 20 JKBD CN(C)[C@@H](CNC(=O)c1ccccc1Sc1ccc(C(F)(F)F)cc1[N+](=O)[O-])c1ccco1 599086093 YTUIPYUQPYCDIZ-KRWDZBQOSA-N 479.480 5.391 5 20 JKBD Cc1cccc2sc(C(=O)Nc3ncc(S(=O)(=O)c4ccc([N+](=O)[O-])cc4)s3)c(Cl)c12 602086148 ZTVHXMNDNWEGIQ-UHFFFAOYSA-N 493.975 5.313 5 20 JKBD COc1ccc(NC(=O)c2c[nH]c3ccc([N+](=O)[O-])cc23)cc1NC(=O)c1ccc(Cl)cc1F 604540235 FKEWEWQKMVJLRM-UHFFFAOYSA-N 482.855 5.382 5 20 JKBD CCN(Cc1ccoc1)[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Br)c1ccccc1 608840368 XUFOHZFDYRPRFT-HXUWFJFHSA-N 458.312 5.152 5 20 JKBD Cc1ccc(NC(=O)c2ccc(Sc3nnc(COc4ccc(Cl)cc4)o3)c([N+](=O)[O-])c2)cc1 608972472 NJXVDWOIEXRKRP-UHFFFAOYSA-N 496.932 5.922 5 20 JKBD CC(=O)N(c1ccc(Cl)c(Cl)c1)c1nc(COC(=O)c2ccc([N+](=O)[O-])cc2C)cs1 725988189 RIRCBSDYGYVKTQ-UHFFFAOYSA-N 480.329 5.708 5 20 JKBD Cc1ccc(-c2cc(C(=O)OCc3cc([N+](=O)[O-])cc4c3OCOC4)c3cnn(C(C)C)c3n2)cc1 825882067 GKIREERTBKUVCH-UHFFFAOYSA-N 488.500 5.119 5 20 JKBD Cc1cc(-c2cc(C(=O)Nc3cc([N+](=O)[O-])c(F)cc3F)c3cnn(C(C)C)c3n2)c(C)o1 897593113 AATLVLIBUPDATG-UHFFFAOYSA-N 455.421 5.328 5 20 JKBD CC(=O)Nc1cccc(NC(=O)c2ccccc2NC(=O)c2ccc([N+](=O)[O-])cc2Cl)c1C 903067603 RFLLUILGERCYRX-UHFFFAOYSA-N 466.881 5.020 5 20 JKBD CCc1cc[n+](/C(C(=S)Nc2cccc(NC(C)=O)c2)=C(/O)c2ccc(C)c([N+](=O)[O-])c2)cc1 913141253 JSITXHORLWSNFD-UHFFFAOYSA-O 477.566 5.035 5 20 JKBD O=C(c1cc(-c2ccncc2)nc2ccccc12)N(Cc1ccccc1[N+](=O)[O-])CC(F)(F)F 915864811 AOFRJXGZEPSQTE-UHFFFAOYSA-N 466.419 5.410 5 20 JKBD O=C(Nc1ccccc1SC[C@H]1CC1(Cl)Cl)N1CCN(c2cccc([N+](=O)[O-])c2)CC1 916697885 YAQWTHFKEIWVFE-OAHLLOKOSA-N 481.405 5.235 5 20 JKBD O=C(Nc1cc(Cl)c([N+](=O)[O-])cc1OCc1ccccc1)c1cncc(Br)c1 916827675 QLQMTRNLABGQSE-UHFFFAOYSA-N 462.687 5.237 5 20 JKBD O=C(NC1(c2ccc(NC(=O)c3ccc([N+](=O)[O-])o3)cc2)CCC1)c1ccc(C(F)(F)F)c(F)c1 1785751022 GZOHTPMMPDKILH-UHFFFAOYSA-N 491.397 5.407 5 20 JKBD O=C(CCc1cccc([N+](=O)[O-])c1)Nc1ccc(C2(NC(=O)c3ccnc(Cl)c3)CCC2)cc1 1786601677 LGRRDXHGRHBBMQ-UHFFFAOYSA-N 478.936 5.024 5 20 JKBD Cc1cc(C(=O)NC2(c3ccc(NC(=O)/C=C/c4ccccc4[N+](=O)[O-])cc3)CCC2)c(C)n1C 1792317202 AQNVQVZXOKQOBU-NTEUORMPSA-N 472.545 5.011 5 20 JKBD O=C(c1ccc(-c2ccccc2)c(F)c1)N1CCC2(CCCN(C(=O)c3ccc([N+](=O)[O-])o3)C2)CC1 1804649950 GKCGJUNRSYQQBV-UHFFFAOYSA-N 491.519 5.153 5 20 JKBD O=C(Cc1ccccc1F)N1CCCC2(CCN(C(=O)c3cc4cc([N+](=O)[O-])ccc4s3)CC2)C1 1809217357 BHIPVBJUAILEBW-UHFFFAOYSA-N 495.576 5.036 5 20 JKBD CC(C)[C@@H](C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2ccc([N+](=O)[O-])o2)n[nH]1)c1ccc(Cl)cc1 1814311350 GFUUSNOAHPAHEY-XMSQKQJNSA-N 499.955 5.310 5 20 JKBD CC(C)/C=C/C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)[nH]n1 1823092303 PSCMUZWYVZDWRS-YOCVDRLZSA-N 467.551 5.051 5 20 JKBD Cc1c(C(=O)N2CCC([C@H]3CCCCN3C(=O)Cc3cccs3)CC2)cc(Cl)cc1[N+](=O)[O-] 1827160340 QOMDEFSAYNZSGF-OAQYLSRUSA-N 490.025 5.094 5 20 JKBD Cc1cc(O)c([N+](=O)[O-])cc1C(=O)N1CCC([C@H]2CCCCN2C(=O)CC2CCC(C)(C)CC2)CC1 1830423086 FYVKELIGFFZXEM-HSZRJFAPSA-N 499.652 5.449 5 20 JKBD O=C(c1cccc2ccccc12)N1CCC([C@H]2CCCCN2C(=O)c2ccc(O)c([N+](=O)[O-])c2)CC1 1830490076 ZISGZRIMTCSIRL-XMMPIXPASA-N 487.556 5.001 5 20 JKBD CC(C)CCC(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cc(Br)ccc2[N+](=O)[O-])CC1 1831381739 HKZARHZKOYAWDR-HXUWFJFHSA-N 494.430 5.027 5 20 JKBD Cc1ccc(NC(=O)[C@H](OC(=O)CCc2c[nH]c3ccccc23)c2ccccc2)c([N+](=O)[O-])c1 8649497 GYVFMANWFJWERG-RUZDIDTESA-N 457.486 5.240 5 20 JKBD COc1cc(C(=O)Nc2nc3ccc(Oc4ccccc4)cc3s2)c([N+](=O)[O-])cc1OC(F)F 11916165 GKIMEFLCECEAAP-UHFFFAOYSA-N 487.440 5.859 5 20 JKBD CC(C)c1ccccc1NC(=O)COC(=O)Cc1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1 18961434 GIOBVRFFQUKSDG-UHFFFAOYSA-N 498.539 5.295 5 20 JKBD O=C1c2ccccc2N[C@H](c2ccc(-c3ccc([N+](=O)[O-])cc3Br)o2)N1C1CC1 23986752 UNASXCMBLNQKCY-FQEVSTJZSA-N 454.280 5.346 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Cl)[C@H](Nc1cccc(CN2CCCC2=O)c1)c1ccccc1 28386676 DEGXRFZLPJOYSL-XMMPIXPASA-N 478.936 5.163 5 20 JKBD O=C(CSC1CCCCC1)Nc1c(Br)cc([N+](=O)[O-])cc1Br 71846689 CEKRPISBNMPHDE-UHFFFAOYSA-N 452.168 5.124 5 20 JKBD C[C@H](Nc1ccc(C(=O)Nc2ccc3c(c2)OC2(CCCCC2)O3)cc1[N+](=O)[O-])c1ccccn1 108785374 SUCARCGEDDXJAV-KRWDZBQOSA-N 474.517 5.847 5 20 JKBD Cc1ccc2nc(NC(=O)c3ccccc3NC(=O)c3ccc([N+](=O)[O-])cc3Cl)sc2c1 248342388 YAUYRRYQRSHPOG-UHFFFAOYSA-N 466.906 5.671 5 20 JKBD COCc1c(Br)cccc1NC(=O)c1ccc(N2C[C@@H](C)C[C@@H](C)C2)c([N+](=O)[O-])c1 303142809 RIBMABYCMDJEKN-GASCZTMLSA-N 476.371 5.238 5 20 JKBD CC(C)Oc1ccc(CN[C@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Br)c2ccccc2)cc1 502386160 NPLZQGBHGYMZGR-QHCPKHFHSA-N 498.377 5.614 5 20 JKBD Cc1sc(NC(=O)c2nnn(-c3ccccc3F)c2C(F)(F)F)nc1-c1cccc([N+](=O)[O-])c1 508950197 QDASCHWZIDFXFI-UHFFFAOYSA-N 492.414 5.018 5 20 JKBD CCOc1cc(C(=O)Nc2ccc(Oc3ccc(C)cc3OC)c(F)c2)c([N+](=O)[O-])cc1OC 510258053 RECHHAHIECXHIU-UHFFFAOYSA-N 470.453 5.503 5 20 JKBD CN(Cc1ccccc1[N+](=O)[O-])C(=O)Nc1ccc(C(=O)N(C)C2CCCCC2)c(Cl)c1 511010514 DEWKTLXXSIOQTP-UHFFFAOYSA-N 458.946 5.317 5 20 JKBD C[C@@H](c1nnc(-c2ccccc2)o1)N1CCN(Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)CC1 513783852 GMMKYRZIGKFDAX-SFHVURJKSA-N 475.574 5.252 5 20 JKBD COc1cc(OC)c(OC)cc1CNCc1ccc(Oc2ccccc2Cl)c([N+](=O)[O-])c1 517549332 JIOFEVMXNRVWEN-UHFFFAOYSA-N 458.898 5.356 5 20 JKBD CCN(C[C@@H]1CCCO1)C(=O)C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1 520107395 NMJBWFONLLWBFJ-BXWQOUMASA-N 451.548 5.163 5 20 JKBD COC(=O)c1cc(-c2cccc(C(F)(F)F)c2)ccc1NC(=O)c1cc(OC)ccc1[N+](=O)[O-] 520745393 DYMYASCPCIQNDS-UHFFFAOYSA-N 474.391 5.328 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Cl)[C@@H](NC[C@H]1CCOc2ccccc21)c1ccccc1 521774360 LUHCISREQLSIAS-HXOBKFHXSA-N 451.910 5.084 5 20 JKBD Cc1nc(CSc2ccc(C(=O)Nc3cc4c(cc3[N+](=O)[O-])OCCCO4)cc2)cs1 591600493 SNIITIAEILWGMP-UHFFFAOYSA-N 457.533 5.066 5 20 JKBD C[C@H]1CCC[C@H](C)N1C(=O)c1cc(Cl)ccc1NC(=O)CCOc1ccccc1[N+](=O)[O-] 603959582 DIERMDGDTWLEPP-HOTGVXAUSA-N 459.930 5.059 5 20 JKBD CCN(Cc1ccccc1)C(=O)c1cc(NC(=O)c2ccc([N+](=O)[O-])cc2Cl)ccc1Cl 603989599 LVXYYBAGBXZTCQ-UHFFFAOYSA-N 472.328 5.816 5 20 JKBD COc1cc(C(=O)Nc2ccc(-c3ncon3)cc2)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 608874256 ACXWVBHONYKOPG-UHFFFAOYSA-N 466.837 5.351 5 20 JKBD C[C@H](Sc1nnc(Cc2c(F)cccc2Cl)o1)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 608929574 FGKUTMLIWFYJGQ-JTQLQIEISA-N 461.862 5.264 5 20 JKBD Cc1ccc(Sc2ccc(CN[C@@H](C)c3cccc(NS(C)(=O)=O)c3)cc2[N+](=O)[O-])cc1 725849544 PWYJDOFAQPCGNI-KRWDZBQOSA-N 471.604 5.277 5 20 JKBD O=C(OCc1nnc(-c2ccc(Cl)cc2Cl)o1)c1cc([N+](=O)[O-])ccc1Br 725986412 VWDKPJYJAZLIGB-UHFFFAOYSA-N 473.066 5.071 5 20 JKBD C[C@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)N(CC1CC1)c1ccc(Cl)c([N+](=O)[O-])c1 728167265 WCCSCTFQAWWQJU-NSHDSACASA-N 454.266 5.020 5 20 JKBD O=C(O[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1)[C@H]1CCOc2ccccc21 728355777 DXSWNEXOTQUKAC-PGRDOPGGSA-N 466.877 5.038 5 20 JKBD CN(C(=O)COC(=O)c1sc2cc(Br)ccc2c1Cl)c1ccc([N+](=O)[O-])cc1 729874234 ZEWLPKHWUPAKFG-UHFFFAOYSA-N 483.727 5.045 5 20 JKBD CC[C@H](C)Sc1ccc(NC(=O)Cn2ncc3ccc([N+](=O)[O-])cc32)c(C(F)(F)F)c1 748656445 HGYLUVKBKQMQGD-LBPRGKRZSA-N 452.458 5.493 5 20 JKBD O=C(NCc1cccc(COCc2ccccc2)c1)c1cc([N+](=O)[O-])ccc1Br 751088256 CVUIGMKAEJHMTH-UHFFFAOYSA-N 455.308 5.004 5 20 JKBD Cc1ccccc1NC(=O)Cc1nc(CSc2nc3ccc([N+](=O)[O-])cc3s2)cs1 788007548 ACCOGJGRUXRVNZ-UHFFFAOYSA-N 456.574 5.443 5 20 JKBD O=C(Nc1ccc(Cl)c([N+](=O)[O-])c1)c1ccc(C(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)s1 915827501 BNESSMOLRPUMHT-UHFFFAOYSA-N 481.273 5.376 5 20 JKBD CC(C)c1cccc(NC(=S)/C(=C(/O)c2ccc([N+](=O)[O-])cc2)[n+]2ccc3c(c2)CCCC3)c1 917615420 PBJQARGMDFRXIQ-UHFFFAOYSA-O 474.606 6.208 5 20 JKBD Cc1c(C(=O)O[C@@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)cnn1-c1cccc(C(F)(F)F)c1 918941990 KZIMESFCMHNAAC-ZDUSSCGKSA-N 487.394 5.076 5 20 JKBD O=C(Cc1nc(COC(=O)c2cc([N+](=O)[O-])ccc2Oc2ccccc2)cs1)Nc1ccccc1 920526550 UAYGGRXTIOHKTF-UHFFFAOYSA-N 489.509 5.382 5 20 JKBD Cc1cccc(NC(=O)[C@H](OC(=O)c2ccc(N[C@H](C)c3ccccn3)c([N+](=O)[O-])c2)C(C)C)c1C 920543616 FEAIEMDWBNRNPL-KBMIEXCESA-N 490.560 5.600 5 20 JKBD Cc1ccc2oc(C(=O)NC3(c4ccc(NC(=O)CCc5cccc([N+](=O)[O-])c5)cc4)CCC3)cc2n1 1786600041 HRNZNJYUMWWRER-UHFFFAOYSA-N 498.539 5.425 5 20 JKBD O=C(Cc1ccc([N+](=O)[O-])cc1F)NC1(c2ccc(NC(=O)c3ccc4cc[nH]c4c3)cc2)CCC1 1788914055 WWNWXEMUHQQLLE-UHFFFAOYSA-N 486.503 5.206 5 20 JKBD Cc1nc(C)c(C(=O)Nc2ccc(C3(NC(=O)c4cc5cc([N+](=O)[O-])ccc5s4)CCC3)cc2)o1 1789790713 XOBPSFOAHBFQPN-UHFFFAOYSA-N 490.541 5.476 5 20 JKBD CC(F)(F)C(C)(C)C(=O)NC1(c2ccc(NC(=O)CSc3ccccc3[N+](=O)[O-])cc2)CCC1 1791521509 PBHUTFZYVVTWRA-UHFFFAOYSA-N 491.560 5.502 5 20 JKBD Cc1ccc2cc(C(=O)N[C@@H]3C[C@@H]4CC[C@H](C3)N4C(=O)CCc3cccc([N+](=O)[O-])c3)sc2c1 1793940739 QFWCQJFAPOAQOY-WKCHPHFGSA-N 477.586 5.003 5 20 JKBD Cc1c(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)C[C@H](C)c2ccccc2)C3)cc(Cl)cc1[N+](=O)[O-] 1800712931 MXCHVQYRMLHLTB-KQLYMOGASA-N 469.969 5.002 5 20 JKBD O=C(c1cc2ccccc2o1)N1CCC([C@@H]2CCCCN2C(=O)c2ccc([N+](=O)[O-])cc2F)CC1 1830496225 KKEKBVMQICDNAO-QFIPXVFZSA-N 479.508 5.027 5 20 JKBD Cc1cc(F)c(F)c(C(=O)N2CCC([C@H]3CCCCN3C(=O)/C=C/c3ccccc3[N+](=O)[O-])CC2)c1 1832903408 BLBPHEHVVPAGQU-JJNABOQBSA-N 497.542 5.128 5 20 JKBD O=C(CCc1cccc([N+](=O)[O-])c1)N1CC2(CCCN2C(=O)c2cc(Cl)c(Cl)c(Cl)c2)C1 1846895807 ONOCWBBZDSZNCR-UHFFFAOYSA-N 496.778 5.005 5 20 JKBD O=C(CSc1nnc(-c2ccccc2Cl)n1C1CCCC1)Nc1cc([N+](=O)[O-])ccc1Cl 8989066 SPLWACGCFRYIRN-UHFFFAOYSA-N 492.388 6.006 5 20 JKBD O=c1[nH]c(/C(Cl)=C/c2ccc(O)c([N+](=O)[O-])c2)nc2scc(-c3ccccc3Cl)c12 18064803 RXGJNDCUOMXNGY-AUWJEWJLSA-N 460.298 5.656 5 20 JKBD Cc1nn(-c2ccccc2Cl)c2sc(C(=O)OCc3nnc(-c4ccc([N+](=O)[O-])cc4)o3)cc12 21160836 HGSHLVHJAXTMAC-UHFFFAOYSA-N 495.904 5.364 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Cl)[C@@H](NCc1ccc(OC(F)F)cc1)c1ccccc1 21792448 MAUYUBVWPMREHL-FQEVSTJZSA-N 461.852 5.319 5 20 JKBD Cc1cc(C)c(NC(=O)[C@H](C)Sc2nc3cc4ccccc4cc3c(=O)n2C)c(Cl)c1 26580889 QPGUEAJXJQGFRI-HNNXBMFYSA-N 451.979 5.476 5 20 JKBD CCn1c(SCc2nnc(-c3ccc(Br)s3)o2)nc2cc3ccccc3cc2c1=O 27792410 UFBHLNDWNVELEM-UHFFFAOYSA-N 499.415 5.736 5 20 JKBD COCc1ccc(CNC(=O)C/C(=C/c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)cc1 33191309 DISWYNKAKVHZQF-STZFKDTASA-N 473.554 5.598 5 20 JKBD O=C(CCCc1nc(-c2ccc(Cl)cc2)no1)N(Cc1ccccc1[N+](=O)[O-])CC(F)(F)F 69643605 SDLZDQCKTAYFGJ-UHFFFAOYSA-N 482.846 5.212 5 20 JKBD C[C@H](Sc1ncnc2cc(-c3ccc(F)cc3)sc12)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 69887866 IDCZOTVDOPDCRR-LBPRGKRZSA-N 479.518 6.309 5 20 JKBD O=C(COc1ccc([N+](=O)[O-])cc1C(F)(F)F)N1N=C(c2cccs2)C[C@H]1c1ccco1 72033588 SNFTYXQABXMHDN-HNNXBMFYSA-N 465.409 5.025 5 20 JKBD O=C(CCNc1ccc(C(F)(F)F)cc1[N+](=O)[O-])Nc1ccccc1OCc1cscn1 109988775 UIBCTNKVNZNLGK-UHFFFAOYSA-N 466.441 5.090 5 20 JKBD O=C(CNC(=O)c1c(Cl)cccc1[N+](=O)[O-])Nc1ccc(Oc2ccccc2Cl)cc1 303298784 CFSUHULKTXEWSM-UHFFFAOYSA-N 460.273 5.062 5 20 JKBD O=C(Nc1cc(Cl)ccc1Oc1ccc(Cl)cc1)c1ccc(-n2cncn2)c([N+](=O)[O-])c1 477201947 GHCFWWCPDHIYFE-UHFFFAOYSA-N 470.272 5.527 5 20 JKBD COc1cc(C(=O)NC(C)(c2ccccc2)c2ccccc2)c([N+](=O)[O-])cc1OCc1cscn1 504584456 BPCSICIZHYFISH-UHFFFAOYSA-N 489.553 5.332 5 20 JKBD COc1ccccc1NS(=O)(=O)c1cc([N+](=O)[O-])ccc1N[C@H](c1ccccc1)c1nccs1 505570755 OXSRCNLVKRQYOP-JOCHJYFZSA-N 496.570 5.062 5 20 JKBD C[C@H](Oc1ccc(Cl)cc1Br)C(=O)Nc1cc([N+](=O)[O-])ccc1OC(F)F 515216181 AQXXCBZBANQDIA-QMMMGPOBSA-N 465.634 5.018 5 20 JKBD O=C(Nc1ccc(OCC(F)(F)F)cc1)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 516435033 BECPQJSWMKJDKI-UHFFFAOYSA-N 491.388 5.410 5 20 JKBD O=C(Nc1cccc([N+](=O)[O-])c1)C(=O)N[C@H](Cc1ccc(Cl)cc1Cl)c1ccc(F)cc1 518671619 AYZNVURPPIPNOC-HXUWFJFHSA-N 476.291 5.079 5 20 JKBD Cn1cc(C(=O)Nc2cccc(COCCc3ccccc3)c2)c(-c2ccc([N+](=O)[O-])cc2)n1 518886867 UAFAZUQMRFKBKA-UHFFFAOYSA-N 456.502 5.007 5 20 JKBD Cc1cccc(C(=O)N2CCCC2)c1NC(=O)c1ccc(NCc2ccccc2Cl)c([N+](=O)[O-])c1 603620943 DUPUZQDDSFOTPJ-UHFFFAOYSA-N 492.963 5.657 5 20 JKBD C[C@H](c1ccccc1)n1c(SCc2nc(-c3cccc([N+](=O)[O-])c3)no2)nnc1-c1ccccc1 603917468 SBKGATNDMOSXHB-QGZVFWFLSA-N 484.541 5.805 5 20 JKBD CC(=O)N(c1cccc(C(F)(F)F)c1)c1nc(COc2cccc([N+](=O)[O-])c2C)cs1 603918192 AHNPOKYLXPCRBK-UHFFFAOYSA-N 451.426 5.642 5 20 JKBD C[C@H](NC(=O)NCc1ccccc1-c1ccc(Cn2cccn2)cc1)c1cccc([N+](=O)[O-])c1 608914442 OUZVTIQJADOKHP-IBGZPJMESA-N 455.518 5.067 5 20 JKBD C[C@H](OC(=O)c1csc(-c2ccccc2Cl)n1)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 727562805 GLQPPPAMDDXKCA-NSHDSACASA-N 456.867 5.340 5 20 JKBD CC(C)c1ccc(-c2nc(C(=O)OCC3CCN(c4ncccc4[N+](=O)[O-])CC3)cs2)cc1 729193408 QNZISDBCVKHQBN-UHFFFAOYSA-N 466.563 5.310 5 20 JKBD CC(C)(C)OC(=O)Nc1ccc(NC(=O)c2ccc(NC3CC3)c([N+](=O)[O-])c2)c(C(F)(F)F)c1 729654999 CWDRCIHEOJCWHO-UHFFFAOYSA-N 480.443 5.787 5 20 JKBD Cc1cc(C)c(NC(=S)/C(=C(/O)c2ccc(C)c([N+](=O)[O-])c2)[n+]2cccc(C)c2)c(Cl)c1 747892036 SBZJTNYYYNSUHF-UHFFFAOYSA-O 468.986 6.093 5 20 JKBD C[C@H](OC(=O)[C@@H](C)Sc1ccc([N+](=O)[O-])cc1)C(=O)Nc1c(Cl)cc(Cl)cc1Cl 916522717 JPYILOSFHKPATG-VHSXEESVSA-N 477.753 5.606 5 20 JKBD O=C(Nc1cc([N+](=O)[O-])c(F)cc1F)c1cn(-c2ccccc2)nc1-c1ccc(Cl)cc1 918563940 QOKJLWICOOOMSK-UHFFFAOYSA-N 454.820 5.631 5 20 JKBD Cc1ccc(-n2c(-c3ccncc3)nn(CN(Cc3ccc([N+](=O)[O-])cc3)C(C)C)c2=S)cc1 919950915 XLRLEMLHZQDVTQ-UHFFFAOYSA-N 474.590 5.550 5 20 JKBD Cc1ccc(Cl)cc1NC(=O)[C@@H](C)OC(=O)c1ccc(N[C@H](C)c2ccccn2)c([N+](=O)[O-])c1 920548168 QFMLDDQLDSUFCP-HZPDHXFCSA-N 482.924 5.309 5 20 JKBD C[C@@H](OC(=O)c1csc(-c2ccc(Cl)cc2Cl)n1)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 921223497 KLYCOJCWKUDMLE-SNVBAGLBSA-N 491.312 5.993 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)c3ccc([N+](=O)[O-])[nH]3)CCC2)cc1)c1cccc(-c2ccccc2)n1 1788713547 SHRMAECEQZOZRV-UHFFFAOYSA-N 481.512 5.046 5 20 JKBD CC1=CC[C@H](C(=O)Nc2ccc(C3(NC(=O)Cc4ccc([N+](=O)[O-])cc4F)CCC3)cc2)CC1 1789113908 FDFJXXZSTOVLSE-SFHVURJKSA-N 465.525 5.157 5 20 JKBD CCOc1ccccc1C(=O)Nc1ccc(C2(NC(=O)c3cccc(F)c3[N+](=O)[O-])CCC2)cc1 1790240974 YVEVDEIGVOJBFI-UHFFFAOYSA-N 477.492 5.194 5 20 JKBD Cc1c(C(=O)NC[C@@H]2CCN(C(=O)CCC3CCCC3)[C@H]2c2cccnc2)cc(Cl)cc1[N+](=O)[O-] 1811794273 MMCIBIWZFOJZOX-CPJSRVTESA-N 499.011 5.242 5 20 JKBD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2cc3sccc3s2)[nH]n1)c1ccc([N+](=O)[O-])cc1F 1821054882 XGKSGZTWJWPJBI-INIZCTEOSA-N 499.549 5.353 5 20 JKBD Cc1ccc2cc(C(=O)Nc3cc([C@@H]4CCCCN4C(=O)c4ccc([N+](=O)[O-])o4)[nH]n3)sc2c1 1821525066 MTMWFOSKAPQQDX-INIZCTEOSA-N 479.518 5.054 5 20 JKBD O=C(CCc1ncc(-c2ccc(Cl)cc2Cl)o1)OCc1cc([N+](=O)[O-])cc2c1OCOC2 12272092 ZXGQBASVKZCFTI-UHFFFAOYSA-N 479.272 5.099 5 20 JKBD CCN(CC)C(=O)c1cccc(NC(=O)Cc2cn(-c3ccccc3)nc2-c2ccc([N+](=O)[O-])cc2)c1 14942097 MLIWVNSYVBGKGS-UHFFFAOYSA-N 497.555 5.111 5 20 JKBD CSc1ccc([N+](=O)[O-])c(C(=O)O[C@H](C)C(=O)Nc2ccc(Cl)cc2C(F)(F)F)c1 16197188 TWPLTEKWIXYLQX-SECBINFHSA-N 462.833 5.173 5 20 JKBD COc1ccccc1Nc1nnc(S[C@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)s1 24107433 NZUQKQZLQWUNBB-LLVKDONJSA-N 456.509 5.102 5 20 JKBD O=C(COC(=O)c1cc(C(F)(F)F)cc(C(F)(F)F)c1)Nc1cc([N+](=O)[O-])ccc1Cl 28301889 UTMJECGUECYOPL-UHFFFAOYSA-N 470.709 5.081 5 20 JKBD CCN(CC(=O)Nc1c(F)cccc1F)C(=O)c1ccc(Sc2ccc(C)cc2)c([N+](=O)[O-])c1 31348009 CZGAVQIROIKDNW-UHFFFAOYSA-N 485.512 5.433 5 20 JKBD O=C(Cc1ccccc1[N+](=O)[O-])Nc1ccc(NC(=O)c2ccc(F)cc2)cc1C(F)(F)F 58910491 SJXUVXKXAUZKTR-UHFFFAOYSA-N 461.371 5.186 5 20 JKBD Cc1cc(C(=O)NCC(C)C)ccc1NC(=O)c1ccc(N[C@@H](C)c2ccccn2)c([N+](=O)[O-])c1 60248237 YGFVDOJZYZRVNH-SFHVURJKSA-N 475.549 5.109 5 20 JKBD O=C(c1ccn(-c2ccc([N+](=O)[O-])cc2)n1)N(Cc1ccc(Cl)c(Cl)c1)Cc1ccccn1 109728053 WUXYQXNFQKWPDS-UHFFFAOYSA-N 482.327 5.325 5 20 JKBD COc1ccc(NC(=O)c2cc3ccccc3c3cccnc23)cc1OCc1cn2ccccc2n1 195588236 FUTOTBVXRGWRST-UHFFFAOYSA-N 474.520 5.876 5 20 JKBD COc1ccccc1C[C@H]1CCCN1C(=O)c1ccc(N[C@@H](C)c2ccccn2)c([N+](=O)[O-])c1 302981601 KMYIAKZNPVVQBU-GHTZIAJQSA-N 460.534 5.019 5 20 JKBD C[C@@H](NC(=O)c1cnn(-c2ncc(C(F)(F)F)cc2Cl)c1C(F)F)c1cccc([N+](=O)[O-])c1 409504533 VBPJPNBHKXFTMB-SECBINFHSA-N 489.788 5.276 5 20 JKBD CCS(=O)(=O)Nc1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2Sc2ccccc2)cc1C 490546026 QLDFEYARCDXILD-UHFFFAOYSA-N 471.560 5.068 5 20 JKBD O=C(Cn1c2ccccc2c(=O)c2ccccc21)N[C@H](c1ccc(Cl)cc1)c1cccs1 500785238 FUTXVKVTGYQAJS-RUZDIDTESA-N 458.970 5.775 5 20 JKBD COc1ccc2ccccc2c1CNC(=O)c1ccc(N[C@@H](C)c2ccccn2)c([N+](=O)[O-])c1 506164472 QUWWEBDLDXHBRS-KRWDZBQOSA-N 456.502 5.255 5 20 JKBD CN(CCCCCc1cc(-c2ccccc2)no1)C(=O)Cn1c2ccccc2c(=O)c2ccccc21 506505198 LLTXVBLJVJICAI-UHFFFAOYSA-N 479.580 5.681 5 20 JKBD COc1ccc(NC(=O)CNc2ccc(Oc3ncc(Cl)cc3Cl)cc2)c([N+](=O)[O-])c1 515445093 HTGMGEBFJTYRCI-UHFFFAOYSA-N 463.277 5.148 5 20 JKBD CC(C)OCc1cccc(N[C@@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Br)c2ccccc2)c1 516378665 SSAUXKFPWCXPHT-HSZRJFAPSA-N 498.377 6.074 5 20 JKBD COc1cc(OC)cc([C@@H](NCc2ccc(Oc3ccc(F)cc3)c([N+](=O)[O-])c2)c2nccn2C)c1 520208716 CHKNPLSSXRXOFX-RUZDIDTESA-N 492.507 5.156 5 20 JKBD O=C(C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)N1CC2C[C@H]3CC1C[C@@H](C2)C3 521592869 MZSXKTTUIODRGO-SBKJJDHKSA-N 473.598 6.172 5 20 JKBD COc1cc(C(=O)Nc2cccc(CSc3ccccn3)c2)c([N+](=O)[O-])cc1OC(F)F 522245612 OYNNRAYVIFHVMQ-UHFFFAOYSA-N 461.446 5.144 5 20 JKBD Cc1ccc(-c2csc(NC(=O)c3ccc(CNC(=O)C4CCCC4)cc3)n2)cc1[N+](=O)[O-] 524105524 ILEWIMZALBDCLY-UHFFFAOYSA-N 464.547 5.085 5 20 JKBD COC(=O)C[C@H](NC(=O)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1)c1cccs1 591754486 PRAXKFDNUKUDMF-INIZCTEOSA-N 460.895 5.136 5 20 JKBD CCC(CC)c1nnc(NC(=O)C2CCN(c3ccc(C(F)(F)F)cc3[N+](=O)[O-])CC2)s1 603458743 LHEJVYWVLDFTEC-UHFFFAOYSA-N 471.505 5.224 5 20 JKBD O=C(Nc1cc([N+](=O)[O-])ccc1OC(F)F)c1ccccc1CSc1nc2ccccc2o1 603639203 YDTJLKSAJHNYEY-UHFFFAOYSA-N 471.441 5.882 5 20 JKBD CC1CCN(c2ccc(C(=O)N3CCC(c4nc5cc(Cl)ccc5o4)CC3)cc2[N+](=O)[O-])CC1 603921814 PPBWPOZYAWLMRK-UHFFFAOYSA-N 482.968 5.646 5 20 JKBD Cc1c(NC(=O)c2ccccc2)cccc1N[C@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl 603954821 INNNRLJZKOQBBC-OAHLLOKOSA-N 452.898 5.248 5 20 JKBD COc1cc(C(=O)N(CC(=O)Nc2ccccc2)c2cc(C)cc(C)c2)c([N+](=O)[O-])cc1OC(F)F 609218633 ZDPBVJNHDAQHPG-UHFFFAOYSA-N 499.470 5.107 5 20 JKBD Cc1cccc(COc2ccc(NC(=O)c3cc(OCC(F)(F)F)ccc3[N+](=O)[O-])c(C)c2)c1 609228309 NXJAZXNHBMMGSS-UHFFFAOYSA-N 474.435 5.984 5 20 JKBD CC(=O)Nc1cccc(CN(c2ccc(C)cc2C)S(=O)(=O)c2ccc(Cl)c([N+](=O)[O-])c2)c1 725791290 LNHVWHRAMQSWMW-UHFFFAOYSA-N 487.965 5.219 5 20 JKBD CC(C)(C)OC(=O)N1CCC[C@H]1[C@H]1CCCCN1C(=O)Nc1ccc([N+](=O)[O-])cc1Cl 725855058 SFRYIPGDGRXGEG-MSOLQXFVSA-N 452.939 5.034 5 20 JKBD Cc1ccc[n+](/C(C(=S)N[C@@H](C)c2ccc(Cl)cc2Cl)=C(/O)c2cccc([N+](=O)[O-])c2)c1 726571261 WALMSJGRMMAHLJ-HNNXBMFYSA-O 489.404 6.060 5 20 JKBD CCC(CC)c1cc[n+](/C(C(=S)Nc2ccc(Cl)nc2)=C(/O)c2cccc([N+](=O)[O-])c2)cc1 727159931 PBVQNLJPCMMVQJ-UHFFFAOYSA-O 484.001 6.158 5 20 JKBD O=C(C1CCN(c2nc3ccccc3s2)CC1)N(CC1CC1)c1ccc(Cl)c([N+](=O)[O-])c1 728167392 WWZZPXIKXWMVKM-UHFFFAOYSA-N 470.982 5.518 5 20 JKBD CC(C)(C)OC(=O)N1CCC[C@H]1C1CCN(C(=O)c2ccc(C(C)(C)C)c([N+](=O)[O-])c2)CC1 742507893 QMKJHZWZPWWUAE-FQEVSTJZSA-N 459.587 5.144 5 20 JKBD Cc1csc(Sc2ccc(-c3nc(C4(C(=O)OC(C)(C)C)CCC4)no3)cc2[N+](=O)[O-])n1 904821770 SOROHMVJBOTKIS-UHFFFAOYSA-N 474.564 5.324 5 20 JKBD COc1ccc(N2C(=S)N[C@H](c3cccc([N+](=O)[O-])c3)C(C(=O)Nc3ccc(F)cc3)=C2C)cc1 916169067 ZLNHYRXKGRVTSJ-HSZRJFAPSA-N 492.532 5.091 5 20 JKBD Cc1sc(NC(=O)Cn2c(-c3ccc(F)cc3)c(C)sc2=O)nc1-c1cccc([N+](=O)[O-])c1 917790702 KBXFDEWLEGAQJU-UHFFFAOYSA-N 484.534 5.003 5 20 JKBD O=C(NC1(c2ccc(NC(=O)c3ccc([N+](=O)[O-])o3)cc2)CCC1)c1ccc(C(F)(F)F)cc1 1785750107 QKBRGINZTBNXBS-UHFFFAOYSA-N 473.407 5.268 5 20 JKBD C[C@@H](Sc1ccccc1)C(=O)Nc1ccc(C2(NC(=O)c3ccc([N+](=O)[O-])o3)CCC2)cc1 1786288583 XEVPVEROILNERH-MRXNPFEDSA-N 465.531 5.116 5 20 JKBD O=C(Cc1cc(F)ccc1[N+](=O)[O-])NC1(c2ccc(NC(=O)c3cc4sccn4c3)cc2)CCC1 1788413603 YVRAIDYGKMMGPX-UHFFFAOYSA-N 492.532 5.039 5 20 JKBD Cc1cnc(Cl)c(C(=O)NC2(c3ccc(NC(=O)c4cc([N+](=O)[O-])c(O)cc4C)cc3)CCC2)c1 1790806289 HSOCPPBUZNAVBP-UHFFFAOYSA-N 494.935 5.027 5 20 JKBD C[C@H](C(=O)N1CCCC[C@@H]1c1cc(NC(=O)/C=C/c2ccc([N+](=O)[O-])o2)n[nH]1)c1ccc(Cl)cc1 1814964878 QBLWMZLVSOEGDK-LCGCRYAWSA-N 497.939 5.074 5 20 JKBD C[C@@H](Sc1ccccc1)C(=O)N1CCC([C@@H]2CCCCN2C(=O)/C=C/c2ccc([N+](=O)[O-])o2)CC1 1824277477 ZBBJENQTYWGPRF-XSIWJGCBSA-N 497.617 5.002 5 20 JKBD O=C(/C=C/c1ccccc1[N+](=O)[O-])N1CCC([C@H]2CCCCN2C(=O)c2ccc(C3CC3)cc2)CC1 1830752353 MBTMNEZGVPRCIH-ZUSJUXBOSA-N 487.600 5.419 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)N1CCC([C@@H]2CCCCN2C(=O)[C@H]2CCc3ccccc32)CC1 1831980468 LHAIJQVUQYMEMU-DHLKQENFSA-N 493.579 5.006 5 20 JKBD Cc1nc(CSc2ccc(C(=O)O[C@@H](C)C(=O)Nc3cc([N+](=O)[O-])ccc3Cl)cc2)cs1 11699801 BNTYQJQKXOIYBU-LBPRGKRZSA-N 491.978 5.489 5 20 JKBD COc1cc(C(=O)Nc2nc(-c3ccccn3)cs2)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 14688861 NQCBRQORUXCICS-UHFFFAOYSA-N 482.905 5.820 5 20 JKBD Cc1ccc(C)c(NC(=O)[C@H](C)OC(=O)c2ccccc2C(=O)c2ccc(Cl)c([N+](=O)[O-])c2)c1 15710201 QLEIYEBHEQKZOZ-INIZCTEOSA-N 480.904 5.280 5 20 JKBD COc1ccccc1-n1c(S[C@H](C)C(=O)Nc2ccccc2[N+](=O)[O-])nnc1-c1cccs1 21738311 KBMSDQCBONBCTJ-CQSZACIVSA-N 481.559 5.032 5 20 JKBD CCc1ccc(N(C(C)=O)c2nc(COC(=O)c3cc([N+](=O)[O-])ccc3N3CCCC3)cs2)cc1 22617112 FSIYQIVAGCNRQF-UHFFFAOYSA-N 494.573 5.256 5 20 JKBD O=[N+]([O-])c1cc(S(=O)(=O)N(Cc2coc(-c3cccs3)n2)c2ccccc2)ccc1Cl 22702449 GLSWEHDDKFIBGD-UHFFFAOYSA-N 475.935 5.360 5 20 JKBD CCN(Cc1ccccc1NC(=O)c1ccc(NCc2ccccc2Cl)c([N+](=O)[O-])c1)C(C)=O 27369443 LVPLINYPVDMSBC-UHFFFAOYSA-N 480.952 5.481 5 20 JKBD COc1ccc(N(Cc2cccs2)C(=O)Cn2c3ccccc3c(=O)c3ccccc32)cc1 302988738 VUSYPMDHJHDPNE-UHFFFAOYSA-N 454.551 5.458 5 20 JKBD Cc1csc(Sc2ccc(NC(=O)c3ccn(-c4cccc([N+](=O)[O-])c4)n3)c(C)c2)n1 303123915 NUSIWZIBUSSNRV-UHFFFAOYSA-N 451.533 5.257 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)Nc2ccc(Cl)cc2C(=O)N2[C@@H](C)CCC[C@@H]2C)cc1SC 482823398 ZMOQOHCZSWLMQE-KBPBESRZSA-N 491.997 5.634 5 20 JKBD O=C(Nc1cccc(Cl)c1Oc1cccnc1)c1csc(-c2cccc([N+](=O)[O-])c2)n1 496608345 BYZOKSXMKAYQIE-UHFFFAOYSA-N 452.879 5.811 5 20 JKBD COc1cc(C(=O)N(C)[C@@H](C)c2ccc(C)cc2C)c([N+](=O)[O-])cc1OCc1cscn1 503301570 JJUDCUYUFMAPLF-INIZCTEOSA-N 455.536 5.089 5 20 JKBD COc1ccccc1N1CC[C@@H](CNCc2ccc(Oc3ccc(F)cc3)c([N+](=O)[O-])c2)C1 507920192 FXAVXZNHWPJXMC-IBGZPJMESA-N 451.498 5.151 5 20 JKBD Cc1cc(C(=O)N2CCSCC2)ccc1NC(=O)c1cc([N+](=O)[O-])ccc1Sc1ccccc1 509387071 IUSCUNFEMYVNGD-UHFFFAOYSA-N 493.610 5.496 5 20 JKBD Cc1sc(C(=O)Nc2nnc(SCc3c(Cl)cccc3Cl)s2)cc1[N+](=O)[O-] 515368331 SNBCVWPVHYNRQM-UHFFFAOYSA-N 461.377 5.668 5 20 JKBD O=C(Nc1ccc(Cl)c(C(=O)NC2CC2)c1)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1 515615323 RULLAZVDVJBVKB-UHFFFAOYSA-N 486.311 5.838 5 20 JKBD O=[N+]([O-])c1ccc(-c2ccc(CN[C@H](c3ccccc3)c3nccs3)o2)c(Br)c1 518785242 TYZWQCQWTHRBRS-HXUWFJFHSA-N 470.348 5.953 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Cl)[C@@H](Nc1cccc(OC[C@@H]2CCCO2)c1)c1ccccc1 518994341 BGZGVPYXQSCNPG-URXFXBBRSA-N 481.936 5.598 5 20 JKBD CC(C)(C)Cc1nc2cc(NC(=O)c3cc(OCC(F)(F)F)ccc3[N+](=O)[O-])ccc2o1 520884655 FSQPBNOKYASSLF-UHFFFAOYSA-N 451.401 5.518 5 20 JKBD O=C(c1ccco1)N1CCC(NCc2ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])cc2)CC1 521820278 HKUTZJUBBBBZQT-UHFFFAOYSA-N 455.898 5.028 5 20 JKBD CN(c1ccccc1)c1ccc(CNCc2nnc3c(Cl)cc(C(F)(F)F)cn23)cc1[N+](=O)[O-] 521828243 NHISAJXDXIVJCE-UHFFFAOYSA-N 490.873 5.367 5 20 JKBD CC1CCN(c2ccc(C(=O)Nc3c(N4CCCC4)cccc3N3CCCC3)cc2[N+](=O)[O-])CC1 524343075 NGDWTSVNMCQEKZ-UHFFFAOYSA-N 477.609 5.284 5 20 JKBD Cn1ccnc1[C@@H](NCc1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1)c1ccccc1F 603633441 JBWKRZNJWBWBDX-QHCPKHFHSA-N 466.900 5.792 5 20 JKBD CCOc1cc(C(=O)Nc2sc3c(c2C(=O)OC(C)C)CC[C@@H](C)C3)c([N+](=O)[O-])cc1OC 603761510 KRGSMQGDZBAXMS-CYBMUJFWSA-N 476.551 5.006 5 20 JKBD COc1cc(C(=O)N2CCC[C@@H](OCC(F)(F)F)C2)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 603982058 WCYKRSUIXBYUHF-OAHLLOKOSA-N 488.846 5.233 5 20 JKBD O=C(c1c2c(nc3ccccc13)/C(=C\c1cccc([N+](=O)[O-])c1)CCC2)N1CC[C@@H](N2CCCC2)C1 608905710 IDFWCFOCYKADRC-FLVWFLKISA-N 482.584 5.330 5 20 JKBD CC(C)(C)[C@H](Cn1ccnc1)NC(=O)C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1 729340400 GACAKDFGNKMWSI-QNCNLXEUSA-N 489.601 5.563 5 20 JKBD Cc1ccc([N+](=O)[O-])cc1NC(=O)COC(=O)c1ccccc1C(=O)c1ccc(Cl)c(Cl)c1 729726912 MAYGYDGZUBOBHH-UHFFFAOYSA-N 487.295 5.237 5 20 JKBD C[C@@H](SCc1nc(O)c2c(-c3ccccc3)csc2n1)C(=O)O[C@H](C)c1cccc([N+](=O)[O-])c1 729758369 ITZHXRVSGJYDGH-HUUCEWRRSA-N 495.582 5.898 5 20 JKBD C[C@H](OC(=O)c1csc(-c2cccc([N+](=O)[O-])c2)n1)C(=O)Nc1ccc(Cl)c(C(F)(F)F)c1 747962406 OQHGBKMYVCWNCJ-JTQLQIEISA-N 499.854 5.575 5 20 JKBD C/C(=C/C(=O)O[C@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F)c1ccc(C(F)(F)F)cc1 748392855 PMOVGTNLGYJEEQ-UCQJPZFISA-N 490.356 5.606 5 20 JKBD C[C@@H](OC(=O)c1c[nH]c2ccc([N+](=O)[O-])cc12)C(=O)Nc1c(Cl)cc(Cl)cc1Cl 749318196 UNSHVDAUOSLUSM-MRVPVSSYSA-N 456.669 5.220 5 20 JKBD CCOC(=O)c1c(-c2ccccc2)csc1NC(=O)c1cc(OC)c(OCC)cc1[N+](=O)[O-] 750540474 PCGHXGBQZFXEJO-UHFFFAOYSA-N 470.503 5.160 5 20 JKBD Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)c1cc(S(=O)(=O)N2CCCc3ccccc32)ccc1Cl 913419162 VOTVJJVILFBWOJ-UHFFFAOYSA-N 499.976 5.259 5 20 JKBD COc1cc(C(=O)Nc2cc([N+](=O)[O-])ccc2F)ccc1OCc1ccc(Br)cc1 917612020 VFDCUWNWXYOGIS-UHFFFAOYSA-N 475.270 5.336 5 20 JKBD C[C@H](Nc1ccc(C(=O)O[C@H](C)c2nc(-c3cccs3)no2)cc1[N+](=O)[O-])c1ccccn1 920544728 DZWNYYBRRJRYIM-UONOGXRCSA-N 465.491 5.192 5 20 JKBD C[C@H](SCc1ncc(-c2ccc(Cl)cc2)o1)C(=O)O[C@H](C)C(=O)Nc1ccccc1[N+](=O)[O-] 920673914 YALKSVHZNIUHPH-KGLIPLIRSA-N 489.937 5.095 5 20 JKBD Cc1cc([N+](=O)[O-])ccc1NC(=O)COC(=O)c1csc(-c2ccc(Cl)cc2Cl)n1 921224580 RCBHNSPWOJVMKF-UHFFFAOYSA-N 466.302 5.129 5 20 JKBD COC(=O)/C=C/c1ccc(Sc2nnc(-c3ccccc3C)n2Cc2ccco2)c([N+](=O)[O-])c1 931421763 LDJWOJXELLFUEF-ZRDIBKRKSA-N 476.514 5.140 5 20 JKBD O=C(Cc1ccc2ccccc2c1)Nc1ccc(C2(NC(=O)c3ccc([N+](=O)[O-])[nH]3)CCC2)cc1 1787702036 HRPMJOCDANIZEP-UHFFFAOYSA-N 468.513 5.067 5 20 JKBD O=C(/C=C/c1ccc([N+](=O)[O-])o1)NC1(c2ccc(NC(=O)c3cc4[nH]ccc4s3)cc2)CCC1 1789100924 JWJZGIJYFQMZLU-SOFGYWHQSA-N 476.514 5.192 5 20 JKBD O=C(C[C@@H]1C[C@@H]2CC[C@H]1C2)Nc1ccc(C2(NC(=O)c3cccc(F)c3[N+](=O)[O-])CCC2)cc1 1791324859 BIYLBDOPHSGZEU-SQNIBIBYSA-N 465.525 5.308 5 20 JKBD Cc1ccc(-c2ccccc2C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cc(F)cc([N+](=O)[O-])c2)C3)cc1 1800604633 BOGMPWVALPGBFB-NUNAXRQHSA-N 487.531 5.275 5 20 JKBD Cc1ccc(CC(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)CCCCCC(C)(C)C)cc1[N+](=O)[O-] 1801830697 TWSHXXSRKDFWKI-KOUNCHBCSA-N 457.615 5.081 5 20 JKBD Cc1cc(C(=O)N2CCCC3(CCN(C(=O)CCCc4cc(C)c(F)cc4[N+](=O)[O-])CC3)C2)c(C)o1 1808252297 ZGDVAZUHFXYTFJ-UHFFFAOYSA-N 499.583 5.120 5 20 JKBD CC(C)(C)c1ccc(C(=O)Nc2cc([C@H]3CCCCN3C(=O)/C=C/c3ccc([N+](=O)[O-])o3)[nH]n2)s1 1818341035 DXLOSIGNKVTKKH-VDZSZVPASA-N 497.577 5.289 5 20 JKBD O=C(CSc1ccccc1[N+](=O)[O-])Nc1cc([C@@H]2CCCCN2C(=O)c2cccc(Cl)c2)[nH]n1 1822312752 FSDHNCWCLMOZEF-SFHVURJKSA-N 499.980 5.070 5 20 JKBD Cc1cc(C(=O)N2CCCC[C@H]2C2CCN(C(=O)C3(c4cccc([N+](=O)[O-])c4)CCC3)CC2)c(C)o1 1825879012 SRGPSBAMJCQLRC-VWLOTQADSA-N 493.604 5.160 5 20 JKBD O=C(c1ccoc1Cl)N1CCC([C@H]2CCCCN2C(=O)C2(c3cccc([N+](=O)[O-])c3)CCC2)CC1 1830292961 NRMQZAIRXYXDKQ-JOCHJYFZSA-N 499.995 5.196 5 20 JKBD O=C([C@@H]1CCC[C@@H]2CCCC[C@H]21)N1CCC([C@@H]2CCCCN2C(=O)c2ccc(O)c([N+](=O)[O-])c2)CC1 1830487855 GLOFVZNBGAGGBC-QVGHQYEOSA-N 497.636 5.140 5 20 JKBD Cc1cc(Cl)cc(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3cc(F)cc([N+](=O)[O-])c3)CC2)c1 1832609786 FXCHEMFEGVCFHS-HSZRJFAPSA-N 487.959 5.243 5 20 JKBD O=C(c1cc2cc([N+](=O)[O-])ccc2s1)N1CC2(CCCN2C(=O)[C@@H]2CCC[C@H]3CCCC[C@@H]32)C1 1843941396 WSSZTDHEWUKJFJ-JRGCBEDISA-N 481.618 5.233 5 20 JKBD O=C(O[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1)c1ccccc1Br 11026299 NGCBCTISIBXMTE-LJQANCHMSA-N 489.709 5.548 5 20 JKBD CC(=O)Nc1cccc(NC(=O)[C@@H](C)Sc2nc3ccccc3c3nc4ccccc4n23)c1 21767884 OEWDJXYOSUZUNC-OAHLLOKOSA-N 455.543 5.113 5 20 JKBD Cc1ccc(-n2ccnc2SCC(=O)Nc2ccc([N+](=O)[O-])cc2C(F)(F)F)cc1C 23050496 ACJCCDWSGPFTGL-UHFFFAOYSA-N 450.442 5.147 5 20 JKBD O=C(COC(=O)Cc1csc(-c2ccccc2Cl)n1)Nc1ccc(C(F)(F)F)cc1[N+](=O)[O-] 26674270 OOIKEZNZOGIZLI-UHFFFAOYSA-N 499.854 5.115 5 20 JKBD CCOc1cc([N+](=O)[O-])c(C(=O)Nc2nc(-c3cc(Cl)ccc3Cl)cs2)cc1OC 28246014 SWOOSSUKBQLMNO-UHFFFAOYSA-N 468.318 5.685 5 20 JKBD C[C@@H](Nc1cccc(COc2cccc(F)c2)c1)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 30449402 CFPZDVBDCJATFG-CQSZACIVSA-N 477.414 5.771 5 20 JKBD C[C@@H](N[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1)c1ccc2c(c1)OCO2 30500779 LPVGRRRVCMYFHJ-PEBXRYMYSA-N 453.882 5.008 5 20 JKBD O=C(Nc1cccc(N2C(=O)c3ccccc3C2=O)c1)c1cc([N+](=O)[O-])ccc1NCc1ccccc1 485697169 SKDKUKHGQJUPLG-UHFFFAOYSA-N 492.491 5.260 5 20 JKBD CN(Cc1ccccn1)C(=O)c1c2c(nc3ccccc13)/C(=C/c1cccc([N+](=O)[O-])c1)CCC2 488609087 HOTLZBICNMHBIJ-CAPFRKAQSA-N 464.525 5.687 5 20 JKBD Cc1sc(NC(=O)C2CCN(C(=O)c3ccc(Cl)s3)CC2)nc1-c1cccc([N+](=O)[O-])c1 490746258 OMBOAIOTJLMSRC-UHFFFAOYSA-N 490.994 5.233 5 20 JKBD CC[C@H](C)Sc1ccc(NC(=O)Cn2c3ccccc3c(=O)c3ccccc32)c(C(F)(F)F)c1 499582610 SBPBAVRUSUOEDH-INIZCTEOSA-N 484.543 6.703 5 20 JKBD CCOc1cc2c(cc1[C@@H]1C[C@H]1NC(=O)CSc1ccc(C(F)(F)F)cc1[N+](=O)[O-])O[C@@H](C)C2 504499987 UUWUWDJPUUAVQO-YLQAJVPDSA-N 496.507 5.100 5 20 JKBD CCOC(=O)c1sc(-c2ccccc2)cc1NC(=O)c1cc(OCC)c(OC)cc1[N+](=O)[O-] 512024649 NNWRJENJXNGFTL-UHFFFAOYSA-N 470.503 5.160 5 20 JKBD COc1cccc([C@@H](CNC(=O)c2ccc(Cl)cc2[N+](=O)[O-])c2c[nH]c3ccccc23)c1OC 514981578 ABHMVULJPFGMOE-HXUWFJFHSA-N 479.920 5.309 5 20 JKBD COc1ccc(CNC[C@H]2CCCO[C@@H]2c2ccccc2)cc1OCc1ccc([N+](=O)[O-])cc1 517549453 URVZDNZVOGEURP-YIXXDRMTSA-N 462.546 5.440 5 20 JKBD CCCCN(C(=O)c1ccc(N[C@H](C)c2ccccn2)c([N+](=O)[O-])c1)C1CC(C)(C)NC(C)(C)C1 521453951 PEWMMASQOMHKIK-LJQANCHMSA-N 481.641 5.714 5 20 JKBD CCCn1c(SCc2nc(-c3ccc([N+](=O)[O-])cc3)no2)nnc1-c1ccc(Cl)cc1 603748361 MMTDHKSPEBSOMH-UHFFFAOYSA-N 456.915 5.259 5 20 JKBD Cc1cc(C(=O)N2CCC(C)CC2)ccc1NC(=O)c1cc([N+](=O)[O-])ccc1Sc1ccccc1 603992785 IDQHHYZWXZXLRH-UHFFFAOYSA-N 489.597 6.179 5 20 JKBD Cc1c(NC(=O)c2ccccc2)cccc1NC(=O)c1cc([N+](=O)[O-])ccc1Sc1ccccc1 604001791 ROWNJJWETHZKNH-UHFFFAOYSA-N 483.549 6.559 5 20 JKBD Cc1ccc(Sc2ccc(C(=O)NCc3ccc(CN4CCCC4=O)cc3)cc2[N+](=O)[O-])cc1 604014750 HNEUJULUANNOAK-UHFFFAOYSA-N 475.570 5.107 5 20 JKBD Cn1cnnc1Sc1ccc(C(=O)N[C@@H](c2ccc(C(C)(C)C)cc2)C(F)(F)F)cc1[N+](=O)[O-] 604257527 QRMKSGIBOSPPNY-SFHVURJKSA-N 493.511 5.205 5 20 JKBD CCn1nc(C)c(CNC(=O)C/C(=C\c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)c1C 608948380 OAGVRSQGDJQNGJ-CPNJWEJPSA-N 475.574 5.285 5 20 JKBD COc1ccccc1[C@@H](NCc1ccc(-c2ccc([N+](=O)[O-])cc2Br)o1)c1nccn1C 726607279 NSSJNDFRURAGDD-JOCHJYFZSA-N 497.349 5.239 5 20 JKBD Cc1ccc(NC(=O)[C@@H](OC(=O)Cc2nc(-c3ccsc3)oc2C)c2ccccc2)c([N+](=O)[O-])c1 727023607 SPVUXEVXKPXEHT-QHCPKHFHSA-N 491.525 5.394 5 20 JKBD COc1ccc([C@H](NC(=O)c2cc([N+](=O)[O-])ccc2Cl)c2ccccc2)cc1Br 728497626 CYKINYFCRMLIPY-HXUWFJFHSA-N 475.726 5.539 5 20 JKBD O=C(Nc1sccc1C(=O)NC1CC1)c1ccc(NCc2ccccc2Cl)c([N+](=O)[O-])c1 746782037 NCSSJISYEQKVLC-UHFFFAOYSA-N 470.938 5.066 5 20 JKBD COC(=O)c1c(-c2ccccc2Cl)csc1NC(=O)c1cc(Cl)ccc1[N+](=O)[O-] 747614176 DOUAANMGVGBKJD-UHFFFAOYSA-N 451.287 5.669 5 20 JKBD C[C@@H](OC(=O)c1csc(-c2ccc([N+](=O)[O-])cc2)n1)C(=O)Nc1ccccc1Cc1ccccc1 747957300 NHKADQUAENDKMM-QGZVFWFLSA-N 487.537 5.493 5 20 JKBD O=C(Nc1ccc(N2CCc3sccc3C2)cc1)c1ccc(Br)c([N+](=O)[O-])c1 748654224 ZQMFCVDRGYXRII-UHFFFAOYSA-N 458.337 5.234 5 20 JKBD CCOC(=O)c1c(-c2ccc(C)s2)csc1NC(=O)c1cc(OC)c(OCC)cc1[N+](=O)[O-] 812269775 UTJAVKRFJMFALC-UHFFFAOYSA-N 490.559 5.530 5 20 JKBD C[C@@H](NC(=S)/C(=C(/O)c1ccc([N+](=O)[O-])cc1)[n+]1ccc(C(C)(C)C)cc1)c1ccccc1 917611443 DLTSQZJRDULEPT-GOSISDBHSA-O 462.595 5.742 5 20 JKBD CC(C)[C@H](OC(=O)c1ccc(N[C@@H](C)c2ccccn2)c([N+](=O)[O-])c1)C(=O)Nc1ccccc1Cl 920545329 PXISNOLGCNSMGA-HJPURHCSSA-N 496.951 5.636 5 20 JKBD COc1ccc([N+](=O)[O-])c(C(=O)Nc2ccccc2C(=O)Nc2cccc(C(F)(F)F)c2)c1 920816409 UQARXQKDESCUPM-UHFFFAOYSA-N 459.380 5.127 5 20 JKBD Cc1ccc2oc(C(=O)Nc3ccc(C4(NC(=O)/C=C/c5ccc([N+](=O)[O-])o5)CCC4)cc3)cc2n1 1788321071 LBMQRHBYIFEIHU-DHZHZOJOSA-N 486.484 5.099 5 20 JKBD COc1cc(CC(=O)Nc2ccc(C3(NC(=O)C[C@@H]4C[C@@H]5CC[C@H]4C5)CCC3)cc2)ccc1[N+](=O)[O-] 1790479501 OIYLQUQJFLDEDI-GIVPXCGWSA-N 491.588 5.106 5 20 JKBD COc1cc(CC(=O)Nc2ccc(C3(NC(=O)[C@@H](C)c4ccccc4)CCC3)cc2)ccc1[N+](=O)[O-] 1790480166 CAEGWTYPKMDBRC-IBGZPJMESA-N 487.556 5.084 5 20 JKBD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc2cc([N+](=O)[O-])ccc2s1)[C@H]1C[C@H]1c1ccc(F)cc1 1801206210 VSCBEDNTYZLTMU-AINOVGTFSA-N 493.560 5.004 5 20 JKBD C/C(=C\c1cccs1)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)CCc2cccc([N+](=O)[O-])c2)n[nH]1 1815535745 HRKCIDMPDPEUEJ-JWIKTPOESA-N 493.589 5.108 5 20 JKBD Cc1ccc(CC(=O)N2CCCC[C@H]2C2CCN(C(=O)c3ccccc3Cl)CC2)cc1[N+](=O)[O-] 1830364750 GKNWKCLCOYAAQO-QHCPKHFHSA-N 483.996 5.033 5 20 JKBD COC1(CC(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3cc4cc([N+](=O)[O-])ccc4s3)CC2)CCC1 1832497579 NSEMYHRATDBNAZ-OAQYLSRUSA-N 499.633 5.002 5 20 JKBD O=C(COC(=O)c1c(Cl)ccc(Cl)c1Cl)Nc1ccc(C(F)(F)F)cc1[N+](=O)[O-] 8629045 WQKORXWCBBSKJH-UHFFFAOYSA-N 471.602 5.369 5 20 JKBD COCCn1c(S[C@H](C(=O)Nc2ccc(C)cc2[N+](=O)[O-])c2ccccc2)nc2ccccc21 9073680 JAGDRTSEANMSOG-QHCPKHFHSA-N 476.558 5.371 5 20 JKBD CCn1c2ccccc2c2cc(NC(=O)c3ccc(Sc4nncn4C)c([N+](=O)[O-])c3)ccc21 14907946 DSKGIOUDPHHJPE-UHFFFAOYSA-N 472.530 5.255 5 20 JKBD Cc1nc(Sc2ccc(S(C)(=O)=O)cc2[N+](=O)[O-])c2cc(-c3ccccc3)sc2n1 15131075 BTCLKCOZKMAKRH-UHFFFAOYSA-N 457.558 5.130 5 20 JKBD C[C@H](NC[C@H](c1ccccc1)c1c[nH]c2ccccc12)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 19623577 IKOUMIXYAAIWAZ-OXJNMPFZSA-N 496.489 5.844 5 20 JKBD CC(C)(C)c1ccc(-c2nnc(SCC(=O)Nc3ccccc3[N+](=O)[O-])n2Cc2ccco2)cc1 21752811 FVVMRRSSAGVPLB-UHFFFAOYSA-N 491.573 5.523 5 20 JKBD Cc1csc(Sc2ccc(C(=O)N3CCC([C@@H](O)c4ccccc4)CC3)cc2[N+](=O)[O-])n1 23383461 XDHLOKBWKZJHLG-NRFANRHFSA-N 469.588 5.097 5 20 JKBD C[C@@H](Nc1ccc(C(=O)Nc2ncc(Cc3ccc(F)cc3F)s2)cc1[N+](=O)[O-])c1ccccn1 303001827 NAUYRWLZRWJZBB-CQSZACIVSA-N 495.511 5.741 5 20 JKBD O=C(c1csc(-c2ccc([N+](=O)[O-])cc2)n1)N1CCCC[C@H]1c1nc(-c2ccccc2)no1 303231168 VPEWYBLEDVGTHR-IBGZPJMESA-N 461.503 5.136 5 20 JKBD CC[C@H](C)c1ccc([C@@H](NC(=O)c2cc([N+](=O)[O-])cc(S(C)(=O)=O)c2)c2cccs2)cc1 410095406 QZNPOPGZYDJAIB-OYHNWAKOSA-N 472.588 5.093 5 20 JKBD COc1cc(CN[C@@H](c2ccccc2)c2cccnc2)ccc1OCc1ccc([N+](=O)[O-])cc1 488641177 KRWGZDZVZIYIAO-MHZLTWQESA-N 455.514 5.457 5 20 JKBD CC(=O)Nc1cc(N[C@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2ccccc2)ccc1F 493436213 BZCOBTGLYBKXSK-NRFANRHFSA-N 456.861 5.138 5 20 JKBD CCOc1cc(C(=O)Nc2nc(-c3sccc3Br)cs2)c([N+](=O)[O-])cc1OC 500712728 JJCOXAGONZTFOF-UHFFFAOYSA-N 484.353 5.202 5 20 JKBD O=C(C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)Nc1ccc(-c2ncc[nH]2)cc1 502762719 KJIKTTDWUYCGLO-XDJHFCHBSA-N 481.537 6.164 5 20 JKBD COc1ccc(NC(=O)c2ccc(N[C@@H](C)c3ccccn3)c([N+](=O)[O-])c2)cc1OCc1ccncc1 506230276 BMKWUFIMRAXWFZ-SFHVURJKSA-N 499.527 5.398 5 20 JKBD O=C(Nc1cccc(CNCc2ccc(Oc3ccccc3Cl)c([N+](=O)[O-])c2)c1)C1CCC1 509600968 KHTYYKABSXQUAE-UHFFFAOYSA-N 465.937 6.069 5 20 JKBD CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)c1ccc2c(c1)C(=O)N(c1ccccc1Cl)C2=O 511495149 RFFFDPGWQNSKAI-UHFFFAOYSA-N 477.904 5.100 5 20 JKBD CC(C)OCc1cccc(N[C@@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2ccccc2)c1 516834597 CFCYVBWUONUSET-HSZRJFAPSA-N 453.926 5.965 5 20 JKBD O=C(Nc1cccc(C(F)(F)F)c1)c1cccc(NC(=O)c2ccn(-c3ccc([N+](=O)[O-])cc3)n2)c1 519104326 JJFAZKHGYKHHLO-UHFFFAOYSA-N 495.417 5.304 5 20 JKBD O=[N+]([O-])c1cc(CNc2ccc(N=S3(=O)CCCC3)cc2)ccc1Oc1ccc(F)cc1 600852225 QRSFBJOQSSYRNR-UHFFFAOYSA-N 455.511 6.032 5 20 JKBD CCOC(=O)c1c(NC(=O)Cc2ccccc2[N+](=O)[O-])sc(C(=O)Nc2ccc(C)cc2C)c1C 603466348 MFSZXJBRGQXXIE-UHFFFAOYSA-N 495.557 5.192 5 20 JKBD Cc1ccc(C(=O)N2C[C@@H](C)C[C@@H](C)C2)cc1NC(=O)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-] 603977127 SFIAJSMOXMEBIT-GASCZTMLSA-N 493.482 5.215 5 20 JKBD CSc1nc(-c2ccc(F)cc2)nc(C)c1C(=O)Nc1nc(-c2cccc([N+](=O)[O-])c2)c(C)s1 603997180 AYQNXBAPFNIQCK-UHFFFAOYSA-N 495.561 5.905 5 20 JKBD C[C@H](Nc1ccc(C(=O)Nc2ccc(-c3nc4ccccc4n3C)cc2)cc1[N+](=O)[O-])c1ccccn1 608954677 UFMWUSDNDFLWAN-SFHVURJKSA-N 492.539 5.969 5 20 JKBD Cc1cc(=O)c(C(=O)N(Cc2cccc3ccccc23)C2CCCC2)nn1-c1ccccc1[N+](=O)[O-] 609063671 LZVGZIZTSGOXPO-UHFFFAOYSA-N 482.540 5.187 5 20 JKBD C[C@H](NC(=O)N(C)CCCCCc1cc(-c2ccc(F)cc2)n[nH]1)c1cccc([N+](=O)[O-])c1 609211761 UDLPFBBGMFWBAI-KRWDZBQOSA-N 453.518 5.239 5 20 JKBD Cc1nc(COc2ccc(NC(=O)c3cc([N+](=O)[O-])ccc3Sc3ccccc3)cc2)no1 609376336 KLHLSIQNKNSBQL-UHFFFAOYSA-N 462.487 5.269 5 20 JKBD Fc1ccc(-c2nnc(SCc3nc4ccccc4c4ccccc34)n2C[C@@H]2CCCO2)cc1 620677402 QINPRIKAMYZJKL-FQEVSTJZSA-N 470.573 6.257 5 20 JKBD Cc1ccc(NC(=O)[C@H]2CCc3ccccc3N2C(=O)c2cc([N+](=O)[O-])c(C)c([N+](=O)[O-])c2C)cc1 727056244 NSRRYFWIOPPQAB-JOCHJYFZSA-N 488.500 5.029 5 20 JKBD C[C@H](OC(=O)c1csc(-c2cccc([N+](=O)[O-])c2)n1)C(=O)Nc1ccccc1Oc1ccccc1 747962846 VHFQUBYYXWZSJP-INIZCTEOSA-N 489.509 5.695 5 20 JKBD Cc1c(C(=O)N(C)CCCCCc2cc(-c3ccccc3)no2)cc([N+](=O)[O-])c(C)c1[N+](=O)[O-] 751194303 MKLSATVHYAWTHS-UHFFFAOYSA-N 466.494 5.260 5 20 JKBD COc1cc(-c2nc(-c3ccc(Cn4cnc5ccccc54)cc3)no2)c([N+](=O)[O-])cc1OC(F)F 904475931 LLAGKMCBDPWTFI-UHFFFAOYSA-N 493.426 5.320 5 20 JKBD CCOc1ccc(-c2nc(C(=O)N(Cc3nnc(-c4cccc([N+](=O)[O-])c4)o3)C(C)C)cs2)cc1 914775984 HXYMXZIEWUFHMK-UHFFFAOYSA-N 493.545 5.218 5 20 JKBD CC(C)C(=O)N[C@H](Cc1c[nH]c2ccccc12)C(=O)OCc1nc2ccccc2c2ccccc12 915424655 VCCAECCSJORMMY-AREMUKBSSA-N 465.553 5.296 5 20 JKBD COc1cccc(OC)c1Oc1ccc(CNCc2c3ccccc3cc3ccccc23)cn1 916836303 HLBFRXFVZSRVLA-UHFFFAOYSA-N 450.538 6.487 5 20 JKBD COc1c([N+](=O)[O-])cc(NCc2cccc(NC(=O)C3CCCC3)c2)c([N+](=O)[O-])c1Br 917094484 BXQAYXMOMGGMGJ-UHFFFAOYSA-N 493.314 5.015 5 20 JKBD O=C(O[C@H](C(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1)c1ccccc1)c1ccc(-c2cnco2)cc1 919498802 CICWIBZKMJTDQI-QFIPXVFZSA-N 477.860 5.440 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)c3cc4cc([N+](=O)[O-])ccc4s3)CCC2)cc1)c1cccnc1 1787304942 PUZZTDWTVVEJDH-UHFFFAOYSA-N 472.526 5.266 5 20 JKBD Cc1ccc(C(=O)NC2(c3ccc(NC(=O)C4(c5cccc([N+](=O)[O-])c5)CCC4)cc3)CCC2)cn1 1790476054 XNVMQGWRAGHOTA-UHFFFAOYSA-N 484.556 5.168 5 20 JKBD O=C(CC1CCCC1)N1CCC([C@H]2CCCCN2C(=O)C2(c3cccc([N+](=O)[O-])c3)CCC2)CC1 1830292951 MXHPFWBELHBZFA-RUZDIDTESA-N 481.637 5.217 5 20 JKBD Cc1ccc(C(=O)N2CCC([C@H]3CCCCN3C(=O)c3ccc([N+](=O)[O-])cc3F)CC2)cc1Cl 1830493605 XXLQXUGZKNZIDM-HSZRJFAPSA-N 487.959 5.243 5 20 JKBD Cc1ccc(C(=O)N2CCC([C@H]3CCCCN3C(=O)CSc3ccccc3[N+](=O)[O-])CC2)c(C)c1 1831777070 BMZKUJYRRZDSPT-HSZRJFAPSA-N 495.645 5.237 5 20 JKBD COc1cc([N+](=O)[O-])ccc1NC(=O)CSc1nc(-c2cccs2)c(-c2cccs2)[nH]1 9099381 BRRVUQGPBZCQFT-UHFFFAOYSA-N 472.573 5.514 5 20 JKBD O=C(Cn1c2ccccc2c(=O)c2ccccc21)O[C@H](C(=O)c1c[nH]c2ccccc12)c1ccccc1 11276978 BMMLGFMCVJDEOU-HKBQPEDESA-N 486.527 5.803 5 20 JKBD C[C@H](Sc1nc(/C=C/c2ccccc2)n[nH]1)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 12834953 XNERDVTVJONLLB-PMDBQALLSA-N 463.441 5.021 5 20 JKBD O=C(CCc1cnn(-c2ccccc2)c1)Oc1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2Cl)cc1 15516130 HMZIPFUEMAACSG-UHFFFAOYSA-N 490.903 5.224 5 20 JKBD C[C@H](OC(=O)[C@@H](Sc1ccccc1)c1ccccc1)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 16614936 NEBPSCSJPOTIQS-KKSFZXQISA-N 461.499 5.783 5 20 JKBD COC(=O)c1cc(CN(C)C(=O)c2ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])c(OC)c2)oc1C 27167775 QAOLNRAJYSWESM-UHFFFAOYSA-N 488.880 5.009 5 20 JKBD Cc1c(NC(=O)[C@@H](C)Sc2nnc(Nc3cccc(Br)c3)s2)cccc1[N+](=O)[O-] 28268153 TVFHZJMIMAWWMJ-LLVKDONJSA-N 494.396 5.380 5 20 JKBD Cc1csc(Sc2ccc(C(=O)NCc3cccc(NC(=O)C4CCC4)c3)cc2[N+](=O)[O-])n1 30118978 CRVLSBGFZLJRGL-UHFFFAOYSA-N 482.587 5.180 5 20 JKBD O=C(c1csc([N+](=O)[O-])c1)N(C[C@H]1CCCO1)c1nc(-c2ccc(Cl)cc2Cl)cs1 117233738 NKIVVWSEXKXVKE-CYBMUJFWSA-N 484.386 5.912 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)N[C@H](C)c2ccc(Oc3ccccc3)c(F)c2)cc1SC 483462333 FSUCPMBNNAMLGR-CQSZACIVSA-N 456.495 5.748 5 20 JKBD O=C(C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)N1CCC[C@@H]1c1ccncc1 485475593 NVKWLNQUFAJTRQ-VVMUCNELSA-N 470.554 5.894 5 20 JKBD CN(C(=O)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-])c1ccc(Br)cc1Cl 500758693 MHBQHFWTBMAUIG-UHFFFAOYSA-N 467.625 5.228 5 20 JKBD O=C(c1cc([N+](=O)[O-])ccc1NCc1ccccc1)N1CCC(Oc2ccc(F)cc2F)CC1 501664596 KMIPHAZGYFNXFH-UHFFFAOYSA-N 467.472 5.169 5 20 JKBD C[C@H](Nc1ccc(C(=O)Nc2ccc(-c3nc4c(F)cccc4[nH]3)cc2)cc1[N+](=O)[O-])c1ccccn1 502432732 SYCCEOWHNYVKGO-INIZCTEOSA-N 496.502 6.098 5 20 JKBD Cc1sc(NC(=O)c2ccccc2OCc2cscn2)nc1-c1cccc([N+](=O)[O-])c1 511074372 JQZGZQYQLLCJGZ-UHFFFAOYSA-N 452.517 5.315 5 20 JKBD Cc1ccc(Sc2ccc(CNCc3ccccc3CN3CCCC3=O)cc2[N+](=O)[O-])cc1 513605204 OQEQHIWMJLZGBW-UHFFFAOYSA-N 461.587 5.467 5 20 JKBD Cc1cc(C(=O)N2CCCC[C@@H]2C)ccc1NC(=O)Cn1c2ccccc2c(=O)c2ccccc21 519093646 LMFGTIYJNPHGDO-FQEVSTJZSA-N 467.569 5.116 5 20 JKBD Cc1ccc(CN2CCSCC2)cc1NC(=O)c1cc([N+](=O)[O-])ccc1NCc1ccccc1 522581828 IIDFHPKIRUZAHS-UHFFFAOYSA-N 476.602 5.316 5 20 JKBD Cc1ncsc1CN(C)C(=O)c1c2c(nc3ccccc13)/C(=C/c1cccc([N+](=O)[O-])c1)CCC2 524569250 QSOGIBRLWHACCC-CPNJWEJPSA-N 484.581 6.057 5 20 JKBD CCOc1cc(NC(=O)c2cc(-c3ccc(F)cc3)nc3onc(C)c23)c([N+](=O)[O-])cc1OCC 590851911 VWINHCDVEMACPZ-UHFFFAOYSA-N 480.452 5.295 5 20 JKBD Cc1noc(-c2ccc(C)c(NC(=O)C3CCN(c4ccc(C(F)(F)F)cc4[N+](=O)[O-])CC3)c2)n1 603987522 NLARTRWCLYYENT-UHFFFAOYSA-N 489.454 5.136 5 20 JKBD C[C@@H](Nc1ccc(C(=O)N(C)Cc2ccc(Cl)cc2Cl)cc1[N+](=O)[O-])c1ccccn1 604295567 YLGCVNMKOHVWCT-CQSZACIVSA-N 459.333 5.742 5 20 JKBD CC(C)[C@H](NCc1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1)c1nnc2ccccn12 608789137 XPWFZNZWGDWIIZ-QFIPXVFZSA-N 451.914 5.570 5 20 JKBD COc1cccc(OC)c1Oc1ccc(CNCc2ccc(-c3cccc([N+](=O)[O-])c3)o2)cn1 608836210 YWCVYJQEONJENJ-UHFFFAOYSA-N 461.474 5.349 5 20 JKBD O=C(C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)OCc1cccnc1Cl 729698353 CJJXOPVWXYXVIJ-ATVHPVEESA-N 465.918 5.927 5 20 JKBD C[C@@H](OC(=O)c1cn(C)nc1-c1ccc([N+](=O)[O-])cc1)c1ccccc1NC(=O)c1ccccc1 748019138 JUWLSZTUGLRUHO-QGZVFWFLSA-N 470.485 5.166 5 20 JKBD CC(C)(C)OC(=O)NCc1ccc(-c2noc(CCc3ccc([N+](=O)[O-])cc3Cl)n2)cc1 904720615 QADDEDLHSKFSTI-UHFFFAOYSA-N 458.902 5.108 5 20 JKBD Cc1nc(-c2ccccc2NC(=O)c2ccc(NCc3ccccc3Cl)c([N+](=O)[O-])c2)no1 915867735 UHAYTBCFTTZDGQ-UHFFFAOYSA-N 463.881 5.471 5 20 JKBD O=C(CCOc1ccc(F)cc1Cl)Oc1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2Cl)cc1 916036642 ONDNYAUMMSJWFQ-UHFFFAOYSA-N 493.274 5.668 5 20 JKBD COC(=O)Nc1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2Sc2ccc(Cl)cc2)cc1 916473717 QGYQOZBGPMDMEZ-UHFFFAOYSA-N 457.895 5.830 5 20 JKBD CC(=O)N(c1nc(COC(=O)[C@@H](C)Sc2ccc([N+](=O)[O-])cc2)cs1)c1ccc(C)cc1C 916522849 QZCONZWXOLIWCG-MRXNPFEDSA-N 485.587 5.577 5 20 JKBD O=C(O[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1)[C@H]1CCC[C@@H](C(F)(F)F)C1 917286057 RWNDVEZRIVSEHX-KHYOSLBOSA-N 484.858 5.840 5 20 JKBD O=C(OCc1nc(-c2cccc([N+](=O)[O-])c2)no1)c1cccnc1Oc1ccc(Cl)cc1Cl 920912470 KROFPDYHLSJDAP-UHFFFAOYSA-N 487.255 5.496 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)[C@@H]3CCc4cccc(Cl)c43)CCC2)cc1)c1ccc([N+](=O)[O-])o1 1785751272 WOTXVOYQPOEGMP-GOSISDBHSA-N 479.920 5.319 5 20 JKBD O=C(Cc1cccc([N+](=O)[O-])c1)Nc1ccc(C2(NC(=O)c3cccc4cc[nH]c34)CCC2)cc1 1785791711 MCCIWSDKZSJOOK-UHFFFAOYSA-N 468.513 5.067 5 20 JKBD CC1=CC[C@H](C(=O)Nc2ccc(C3(NC(=O)c4cccc(F)c4[N+](=O)[O-])CCC3)cc2)CC1 1789114769 KANWUXBFNGBMSZ-KRWDZBQOSA-N 451.498 5.228 5 20 JKBD Cc1ccc(CC(=O)NC2(c3ccc(NC(=O)C4(c5cccc([N+](=O)[O-])c5)CCC4)cc3)CCC2)cn1 1790475966 NRIIUMBPHLRTRB-UHFFFAOYSA-N 498.583 5.097 5 20 JKBD COc1ccc(CC(=O)Nc2ccc(C3(NC(=O)[C@@]4(C)CC=CCC4)CCC3)cc2)c([N+](=O)[O-])c1 1790573793 LXIMHHRUWXCVCV-SANMLTNESA-N 477.561 5.026 5 20 JKBD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccccc1Cl)c1cc2cc([N+](=O)[O-])ccc2s1 1799537930 GEDNMZBSRPNJTJ-MUJYYYPQSA-N 469.950 5.029 5 20 JKBD O=C(/C=C/c1ccccc1[N+](=O)[O-])N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(-c2ccccc2)cc1 1803832431 AYAHVAYQLZZSTP-BOXNIABESA-N 481.552 5.227 5 20 JKBD Cc1oc(C(C)(C)C)cc1C(=O)N1CCCC2(CCN(C(=O)Cc3ccc([N+](=O)[O-])cc3F)CC2)C1 1808381281 JUYRXVSVQGFCLK-UHFFFAOYSA-N 499.583 5.020 5 20 JKBD O=C(CC1CCCC1)Nc1cc([C@@H]2CCCCN2C(=O)C2(c3cccc([N+](=O)[O-])c3)CCC2)[nH]n1 1816688759 BCDFZTREXKHAMP-QFIPXVFZSA-N 479.581 5.012 5 20 JKBD Cc1ccc(-c2cc(C(=O)N3CCC([C@H]4CCCCN4C(=O)c4ccc([N+](=O)[O-])o4)CC3)c[nH]2)cc1 1823610245 BZUTVSTVVPUCLR-HSZRJFAPSA-N 490.560 5.038 5 20 JKBD Cc1cscc1C(=O)N1CCC([C@@H]2CCCCN2C(=O)Cc2ccc(Cl)cc2[N+](=O)[O-])CC1 1824162218 ONEPTYDAYFHZRE-NRFANRHFSA-N 490.025 5.094 5 20 JKBD O=C(Nc1cc(Cl)ccc1Oc1ccccc1)c1cc([N+](=O)[O-])ccc1N1CCOCC1 15322988 QAHOXJGPCFFDQB-UHFFFAOYSA-N 453.882 5.129 5 20 JKBD Cc1ccc(NC(=O)CN(C)C(=O)c2ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])cc2)cc1 15916867 ZWOVBMRBLNPYTO-UHFFFAOYSA-N 453.882 5.060 5 20 JKBD O=C(Nc1cccc(-c2nnco2)c1)c1ccc(Sc2nc3ccccc3s2)c([N+](=O)[O-])c1 24743250 QFZDEWJSDSMSOT-UHFFFAOYSA-N 475.511 5.658 5 20 JKBD CSCC[C@H](NC(=O)c1cccc([N+](=O)[O-])c1)C(=O)OCc1sc2ccccc2c1Cl 24977109 FFVFQWSMMOWVIF-INIZCTEOSA-N 478.979 5.058 5 20 JKBD Cc1ccc(C)c(-n2c(SCc3nnc(-c4ccc([N+](=O)[O-])cc4)o3)nc3ccccc3c2=O)c1 25190157 XUOOIWRPYHEKSF-UHFFFAOYSA-N 485.525 5.253 5 20 JKBD C[C@@H](OC(=O)c1ccc(Cl)cc1[N+](=O)[O-])C(=O)Nc1c(Cl)cc(Cl)cc1Cl 28631683 SDHCLPBSRWBDRT-SSDOTTSWSA-N 452.077 5.392 5 20 JKBD CCN(CC(=O)Nc1c(F)cccc1F)C(=O)c1ccc(SCCC(C)C)c([N+](=O)[O-])c1 31348160 DBMOEOUTJFBFHI-UHFFFAOYSA-N 465.522 5.112 5 20 JKBD COc1ccccc1[C@H](NC(=O)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1)c1nccn1C 248124680 HBRSQUQPZMCXNM-QHCPKHFHSA-N 492.919 5.302 5 20 JKBD Brc1ccc2c3c4ccccc4c4ccccc4c3n(-c3ccc(-c4ccccc4)cc3)c2c1 261507487 JBHDXUZBPVLWPM-UHFFFAOYSA-N 498.423 9.520 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Cl)[C@@H](c1ccccc1)N1CC=C(c2ccc(O)cc2)CC1 477027167 JVOAVEBKCSUKKE-XMMPIXPASA-N 463.921 5.423 5 20 JKBD O=C(Nc1cccc(NC(=O)c2cccs2)c1)c1csc(-c2ccc([N+](=O)[O-])cc2)n1 496357665 IJPRGOZUKOYUAR-UHFFFAOYSA-N 450.501 5.284 5 20 JKBD CC[C@@H](C)n1c(S[C@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2C(F)(F)F)nnc1-c1ccccc1 504322770 XQDCZBMQCHYRGJ-ZIAGYGMSSA-N 493.511 5.962 5 20 JKBD COc1cccc([C@@H](C)N2CCN(C(=O)c3ccc(Sc4nc(C)cs4)c([N+](=O)[O-])c3)CC2)c1 505472965 FLGOZEBBJBIJSR-QGZVFWFLSA-N 498.630 5.039 5 20 JKBD Cc1cc(Br)ccc1NC(=O)N1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 603648449 HYDCXSIFVDCGDH-UHFFFAOYSA-N 487.276 5.039 5 20 JKBD CSc1ccc([N+](=O)[O-])c(C(=O)Nc2cc(C(F)(F)F)ccc2-n2nc(C)cc2C)c1 603756465 QPFOPJGGUKFUTM-UHFFFAOYSA-N 450.442 5.390 5 20 JKBD CCC(C)(C)NC(=O)c1ccc(NC(=O)c2ccc(N3CCC[C@@H](C)C3)c([N+](=O)[O-])c2)cc1Cl 603987652 WDUQCCYQZUNEII-MRXNPFEDSA-N 487.000 5.655 5 20 JKBD COc1ccc(CNC(=O)N[C@H](c2ccccc2)c2ccc(Br)cc2F)cc1[N+](=O)[O-] 604078725 CKVUVZMSYVODLX-OAQYLSRUSA-N 488.313 5.094 5 20 JKBD COc1ccc(CNCc2ccc(-n3ccnc3C)c(F)c2)cc1OCc1ccc([N+](=O)[O-])cc1 604434833 ZEMSGIKUYQRBKI-UHFFFAOYSA-N 476.508 5.105 5 20 JKBD C[C@H](SCCOc1ccc([N+](=O)[O-])cc1)c1nc(O)c2c(-c3ccccc3)csc2n1 609387587 VNIIRFKYWAQLFO-AWEZNQCLSA-N 453.545 5.845 5 20 JKBD CN(C)C1CCN(C(=O)c2c3c(nc4ccccc24)/C(=C/c2cccc([N+](=O)[O-])c2)CCC3)CC1 609417102 HPDSXGFIGKTFAK-LVZFUZTISA-N 470.573 5.186 5 20 JKBD C[C@H](NCc1ccc(-c2ccc([N+](=O)[O-])cc2)s1)C(=O)Nc1cccc(N2CCCC2)c1 726606035 QZLRAYVAJLGYMI-KRWDZBQOSA-N 450.564 5.040 5 20 JKBD C[C@@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)N1CCCc2cc(CNC(=O)OC(C)(C)C)ccc21 731022378 GWALNBBUBULOAJ-MRXNPFEDSA-N 471.579 5.080 5 20 JKBD O=C(Nc1cccc(NC(=O)c2cc(F)c(F)cc2[N+](=O)[O-])c1)Nc1cccc2c1CCCC2 731335320 GELXXEKFHVARJJ-UHFFFAOYSA-N 466.444 5.648 5 20 JKBD Cc1c(C(=O)Nc2ccc(Cl)c(-c3nnc4n3CCCCC4)c2)cc([N+](=O)[O-])c(C)c1[N+](=O)[O-] 748625123 MGTAQNNVUWKYAH-UHFFFAOYSA-N 484.900 5.010 5 20 JKBD CC(C)c1ccc(-c2nc(C(=O)OCC(=O)Nc3ccc([N+](=O)[O-])cc3C(F)(F)F)cs2)cc1 900224584 FYVJPFHBGITGNZ-UHFFFAOYSA-N 493.463 5.656 5 20 JKBD Cn1cnnc1Sc1ccc(-c2nc(-c3cccc(Oc4ccccc4)c3)no2)cc1[N+](=O)[O-] 904589172 BAHDAIRDGSIDAG-UHFFFAOYSA-N 472.486 5.384 5 20 JKBD Cc1nc(CSc2ccc(C(=O)OCc3nc(-c4cccc([N+](=O)[O-])c4)no3)cc2)cs1 914900552 JOKSUSYROAXXNU-UHFFFAOYSA-N 468.516 5.059 5 20 JKBD COc1ccc(CN2C(=O)/C(=C/c3ccc(Br)c([N+](=O)[O-])c3)c3ccccc3C2=O)cc1 915852776 XLMKQXPNRIHOLI-UDWIEESQSA-N 493.313 5.089 5 20 JKBD CC(C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)Oc1ccc(-c2ccccc2)cc1[N+](=O)[O-] 920330489 GMELIZJBHRINPP-QHCPKHFHSA-N 471.513 5.032 5 20 JKBD C[C@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)OCc1nc(O)c2c(-c3ccccc3)csc2n1 1525360677 SICABYYYQLMANT-ZDUSSCGKSA-N 467.528 5.196 5 20 JKBD O=C(CCc1cccc([N+](=O)[O-])c1)N1CCCC2(CCN(C(=O)c3cccc4ccccc34)CC2)C1 1806490055 FYLUFDDFYCEJPC-UHFFFAOYSA-N 485.584 5.226 5 20 JKBD CC(C)(C)CCCCCC(=O)NC[C@@H]1CCN(C(=O)c2cc(F)cc([N+](=O)[O-])c2)[C@H]1c1cccnc1 1812808288 GNTCMAYFKFEWDI-CPJSRVTESA-N 498.599 5.445 5 20 JKBD Cc1c(C(=O)N2CCCC[C@H]2c2cc(NC(=O)c3cccc(F)c3[N+](=O)[O-])n[nH]2)oc2ccccc12 1821169451 HXTRFUCCUXFBCE-IBGZPJMESA-N 491.479 5.131 5 20 JKBD CC1=CC[C@@H](C(=O)N2CCCC[C@H]2c2cc(NC(=O)c3cc4cc([N+](=O)[O-])ccc4s3)n[nH]2)CC1 1821609776 MNESBUMZGZMUTJ-UZLBHIALSA-N 493.589 5.585 5 20 JKBD Cc1ccc(C(=O)N2CCC([C@H]3CCCCN3C(=O)c3cc(F)cc([N+](=O)[O-])c3)CC2)cc1Cl 1830612924 MFZRLRVBTZCKKM-HSZRJFAPSA-N 487.959 5.243 5 20 JKBD CC1(C)CCC(CC(=O)N2CCC([C@@H]3CCCCN3C(=O)c3cc(O)cc([N+](=O)[O-])c3)CC2)CC1 1830707793 XHMWEGCTXOHDJN-DEOSSOPVSA-N 485.625 5.140 5 20 JKBD Cc1cccc([N+](=O)[O-])c1NC(=O)CSc1nnc(-c2ccncc2)n1-c1cccc(Cl)c1C 10318053 TYYFGEFRMNWYND-UHFFFAOYSA-N 494.964 5.239 5 20 JKBD O=C(COC(=O)c1cc2cc([N+](=O)[O-])ccc2s1)Nc1ccc(Br)cc1Cl 10565467 UXPVPFHKXYZEGW-UHFFFAOYSA-N 469.700 5.021 5 20 JKBD CC(=O)Nc1cccc([C@@H](C)N(Cc2ccccc2)C(=O)c2ccc([N+](=O)[O-])cc2Cl)c1 11261533 IDGGXPRECIYHKE-MRXNPFEDSA-N 451.910 5.610 5 20 JKBD Cc1ccc(Sc2ccc(C(=O)N3CCC[C@@H](c4nnc5n4CCCCC5)C3)cc2[N+](=O)[O-])cc1 11546697 PJVFJGSJAKCWFS-HXUWFJFHSA-N 491.617 5.392 5 20 JKBD Cn1ccnc1[C@@H](NC(=O)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1)c1cccc(F)c1 23779659 FNSAHWVQIVOLIJ-QFIPXVFZSA-N 480.883 5.433 5 20 JKBD CCCOc1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2I)cc1OCCC 31687617 YTXMOZPEVCJWQV-UHFFFAOYSA-N 484.290 5.029 5 20 JKBD CCn1c(S[C@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2C(F)(F)F)nnc1-c1cccs1 36202491 ZLODNQHYRQRPQY-SNVBAGLBSA-N 471.486 5.073 5 20 JKBD O=C(Nc1ccccc1C(=O)Nc1nnc(-c2ccccc2)s1)c1ccc([N+](=O)[O-])cc1Cl 104887464 APEXQXORVGUMIG-UHFFFAOYSA-N 479.905 5.271 5 20 JKBD O=C(CCc1ncc(-c2ccc(F)cc2F)o1)N(Cc1ccccc1[N+](=O)[O-])CC(F)(F)F 106187702 OFJSQAQRBLNKJL-UHFFFAOYSA-N 469.366 5.052 5 20 JKBD C[C@H](Nc1ccc(C(=O)NCc2ccc(CN3CCC[C@@H](C)C3)cc2)cc1[N+](=O)[O-])c1ccccn1 108782801 UIYLXQASYYWGKS-RTWAWAEBSA-N 487.604 5.325 5 20 JKBD C[C@@H](Sc1ncc(-c2ccccc2)n1CC(F)(F)F)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl 109622981 YRKLTULKRLABJT-GFCCVEGCSA-N 484.887 5.793 5 20 JKBD COc1cc2c(cc1OC)[C@H](c1ccccc1)N(C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)CC2 195580054 WXWZXKJCPVNJLR-QHCPKHFHSA-N 467.909 5.445 5 20 JKBD COCCN(Cc1ccc(F)cc1Cl)C(=O)c1ccc(N[C@@H](C)c2ccccn2)c([N+](=O)[O-])c1 409965017 WQVLMDOMQBTHER-INIZCTEOSA-N 486.931 5.244 5 20 JKBD C[C@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)N(CC(=O)Nc1ccccc1F)Cc1ccccc1F 488115954 FVFCKUOZJXZABM-INIZCTEOSA-N 485.512 5.021 5 20 JKBD CC[C@@H](C)Sc1ccc(NC(=O)c2ccc(Cn3nc(C)c([N+](=O)[O-])c3C)cc2)c(C)c1 498475080 DICKPJYYJMIZFM-MRXNPFEDSA-N 452.580 5.908 5 20 JKBD O=C(Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1)c1cccc(NC(=O)c2cccs2)c1 498713690 XGPCYMBENHJAJJ-UHFFFAOYSA-N 450.501 5.284 5 20 JKBD Cc1cc([N+](=O)[O-])ccc1NC(=O)CSc1nc2ccccc2c(=O)n1Cc1ccccc1Cl 499631666 CSTHDOQNTHABQL-UHFFFAOYSA-N 494.960 5.046 5 20 JKBD Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)c1ccc(CNC(=O)C23CC4CC(CC(C4)C2)C3)cc1 502799901 QWIPOTROWADQHZ-UHFFFAOYSA-N 461.562 5.297 5 20 JKBD CCSc1ccc([C@H](C)NC(=O)c2ccc(N[C@@H](C)c3ccccn3)c([N+](=O)[O-])c2)cc1 504711586 JZWKBJZPCAAQFV-IRXDYDNUSA-N 450.564 5.766 5 20 JKBD O=C(c1ccc(Sc2nc3ccccc3s2)c([N+](=O)[O-])c1)N1CCC(c2ncc[nH]2)CC1 509952461 NQMSOWWZXQCWSH-UHFFFAOYSA-N 465.560 5.099 5 20 JKBD COc1cc([C@H](C)NC(=O)Nc2cc([N+](=O)[O-])ccc2OC(F)F)ccc1OCc1ccncc1 510850086 ODETXODCKGNBKL-AWEZNQCLSA-N 488.447 5.062 5 20 JKBD C[C@H](NC(=O)Nc1ccc(N(C)C(=O)c2ccc(Cl)cc2)cc1)c1cccc([N+](=O)[O-])c1 510999093 MGIOVQTUFQPNBN-HNNXBMFYSA-N 452.898 5.408 5 20 JKBD NC(=O)c1ccc(NC(=O)c2c3c(nc4ccccc24)/C(=C\c2cccc([N+](=O)[O-])c2)CCC3)cc1 514490627 CDTIUSUQLACEIV-CYVLTUHYSA-N 478.508 5.371 5 20 JKBD Cc1ccc(C(C)C)c(Oc2ccc(CNCc3ccc(N4CCN(C)CC4)nc3)cc2[N+](=O)[O-])c1 518268703 QPRZZSSCDOQGRU-UHFFFAOYSA-N 489.620 5.256 5 20 JKBD C[C@@H](NC(=O)C(=O)Nc1ccc(Oc2ccccc2C(F)(F)F)c(F)c1)c1cccc([N+](=O)[O-])c1 519956712 WBKMADBJBCXVLO-CYBMUJFWSA-N 491.397 5.361 5 20 JKBD CCCO[C@@H]1CCCN(C(=O)c2ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])c(OC)c2)CC1 521731018 UZMZFEDKGDMRML-GOSISDBHSA-N 462.930 5.470 5 20 JKBD CC[C@@H](NCc1ccc(OCc2ccc([N+](=O)[O-])cc2)c(OC)c1)c1ccc2c(c1)OCCO2 521818292 FZTIXVHCVWHBLX-JOCHJYFZSA-N 464.518 5.195 5 20 JKBD COc1ccc(Nc2cc3c(cc2[N+](=O)[O-])CCC(=O)N3)cc1OCc1ccc2ccccc2n1 524412195 QPGKRBYDBJKXBG-UHFFFAOYSA-N 470.485 5.359 5 20 JKBD Cc1csc(Sc2ccc(C(=O)Nc3ccc(Sc4nncn4C)cc3)cc2[N+](=O)[O-])n1 590650585 PJMSRLHNSNGCPE-UHFFFAOYSA-N 484.588 5.043 5 20 JKBD CCOc1cc(NC(=O)N2CCC[C@@H]2c2nc3ccccc3s2)c([N+](=O)[O-])cc1OCC 603651441 PPSNLBDASBQUEM-MRXNPFEDSA-N 456.524 5.371 5 20 JKBD O=[N+]([O-])c1cc(CNCc2cccc(OCc3ccccn3)c2)ccc1Oc1ccccc1Cl 608781946 JTXRBBKCWDYKRG-UHFFFAOYSA-N 475.932 6.304 5 20 JKBD Cc1ccccc1NC(=O)[C@@H]1CCc2ccccc2N1C(=O)c1csc(-c2ccc([N+](=O)[O-])cc2)n1 608873081 VFWWRNNTEGVNOI-DEOSSOPVSA-N 498.564 5.627 5 20 JKBD O=C(C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)Nc1ccc2c[nH]nc2c1 609023159 FCQVZYQFSMLYOB-GZTJUZNOSA-N 455.499 5.650 5 20 JKBD CC(=O)N(c1ccc(C)cc1)c1nc(CSc2nc3cc4ccccc4cc3c(=O)n2C)cs1 614509528 HYHLBFOBQAIIMW-UHFFFAOYSA-N 486.622 5.829 5 20 JKBD O=C(Cn1c2ccccc2c(=O)c2ccccc21)N(Cc1cccnc1)c1ccc(Cl)cc1 614688872 ZMGOBAFKEIQFNO-UHFFFAOYSA-N 453.929 5.437 5 20 JKBD Cc1nc(-c2ccsc2)ccc1C(=O)N(Cc1nnc(-c2cccc([N+](=O)[O-])c2)o1)C(C)C 726136760 SMCDIESVHJPXFH-UHFFFAOYSA-N 463.519 5.128 5 20 JKBD O=C(OCC1CCN(c2ccc([N+](=O)[O-])cn2)CC1)c1csc(-c2cccc(C(F)(F)F)c2)n1 726335258 WFYNXEOMCYZKKU-UHFFFAOYSA-N 492.479 5.206 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)OCC(=O)Nc2c(C(C)C)cccc2C(C)C)cc1SC 728651239 QPLILRJHLWALET-UHFFFAOYSA-N 460.552 5.368 5 20 JKBD O=C(Nc1cccc(NC(=O)c2cc([N+](=O)[O-])ccc2Cl)c1)c1cccc(C(F)(F)F)c1 728848912 WSHVYUJDVJXESQ-UHFFFAOYSA-N 463.799 5.772 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])c(Cl)c1)c1cnn(-c2ncc(C(F)(F)F)cc2Cl)c1C(F)F 730969808 OKRWFNPSRUFKQG-UHFFFAOYSA-N 496.179 5.691 5 20 JKBD CC(C)CCSc1ccc(-c2nc([C@H]3CCC(=O)N(CC4CCC4)C3)no2)cc1[N+](=O)[O-] 856563543 AMPZHYZPEHPNCH-SFHVURJKSA-N 458.584 5.289 5 20 JKBD CC(=O)N(c1ccc(F)cc1)c1nc(CSc2nc3ccc([N+](=O)[O-])cc3s2)cs1 917561218 LOLMGSWHYNKQGI-UHFFFAOYSA-N 460.537 5.777 5 20 JKBD O=C(Nc1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2N2CCCC2)cc1)c1ccc(Cl)cc1 919858660 OIFKZCRGSXCORB-UHFFFAOYSA-N 464.909 5.353 5 20 JKBD C[C@H](Nc1ccc(C(=O)OCc2cc(-c3ccc(F)cc3)no2)cc1[N+](=O)[O-])c1ccccn1 920543683 HPKWFZAYESXLHA-HNNXBMFYSA-N 462.437 5.314 5 20 JKBD Cc1cc(C)c(NC(=O)COC(=O)c2ccc(N[C@@H](C)c3ccccn3)c([N+](=O)[O-])c2)c(Cl)c1 920545686 HYJPWZWFDDIEGY-INIZCTEOSA-N 482.924 5.229 5 20 JKBD CCO[C@H](C(=O)O[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1)c1ccccc1 920690136 ZFQBEUCMCNOMIP-VXKWHMMOSA-N 468.893 5.249 5 20 JKBD O=C(Cc1ccc2ncccc2c1)Nc1ccc(C2(NC(=O)c3ccc([N+](=O)[O-])cc3F)CCC2)cc1 1786556966 MPSMRSKJDVACEN-UHFFFAOYSA-N 498.514 5.273 5 20 JKBD Cc1cc(C(=O)Nc2ccc(C3(NC(=O)Cc4ccc(Cl)cc4[N+](=O)[O-])CCC3)cc2)c(C)o1 1787342544 TYBXRSICCCWCEH-UHFFFAOYSA-N 481.936 5.448 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)c3cccc(F)c3[N+](=O)[O-])CCC2)cc1)c1cc(-c2ccco2)no1 1788419977 LZBUEJZFLJSAGN-UHFFFAOYSA-N 490.447 5.043 5 20 JKBD O=C(NC1(c2ccc(NC(=O)c3sccc3Cl)cc2)CCC1)c1nc2cc([N+](=O)[O-])ccc2[nH]1 1789903181 OZYSGAYJXLBMHQ-UHFFFAOYSA-N 495.948 5.248 5 20 JKBD O=C(/C=C/c1ccc([N+](=O)[O-])o1)NC1(c2ccc(NC(=O)c3cc4cc[nH]c4cc3F)cc2)CCC1 1790068827 GBMRLKRGGLHJMD-SOFGYWHQSA-N 488.475 5.269 5 20 JKBD CC(C)=CCCC(=O)NC1(c2ccc(NC(=O)c3cc([N+](=O)[O-])c(O)cc3C)cc2)CCC1 1790809231 HUGQEACKTXRDNX-UHFFFAOYSA-N 451.523 5.103 5 20 JKBD O=C(CCc1cccc([N+](=O)[O-])c1)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1sc2ccccc2c1Cl 1797460150 PYDQPDDDWFQNME-BCDXTJNWSA-N 498.004 5.348 5 20 JKBD CC(C)[C@H](C(=O)N1CCCC2(CCN(C(=O)c3cc(F)cc([N+](=O)[O-])c3)CC2)C1)c1ccccc1 1805623515 PBIIOGIRIGJXPY-DEOSSOPVSA-N 481.568 5.019 5 20 JKBD Cc1c(Cl)cccc1C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cc(F)cc([N+](=O)[O-])c2)[nH]n1 1814599142 DACZOZWAOZZWRY-FQEVSTJZSA-N 485.903 5.039 5 20 JKBD Cc1cc(CCCC(=O)Nc2cc([C@@H]3CCCCN3C(=O)CC(C)(C)C)[nH]n2)c([N+](=O)[O-])cc1F 1815071506 VMICZXJVIJSMLU-FQEVSTJZSA-N 487.576 5.217 5 20 JKBD COc1cc(C(=O)Nc2cc([C@H]3CCCCN3C(=O)c3ccc(C(C)C)cc3)[nH]n2)ccc1[N+](=O)[O-] 1823285260 SOHMCZBEUOYXJW-OAQYLSRUSA-N 491.548 5.070 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)N1CCCC[C@H]1C1CCN(C(=O)C2CCC(F)(F)CC2)CC1 1830729123 AYIUNLLSFCULRV-NRFANRHFSA-N 495.542 5.101 5 20 JKBD O=C(Cc1cc([N+](=O)[O-])ccc1F)N1CCC([C@@H]2CCCCN2C(=O)c2ccc(C3CC3)cc2)CC1 1830746799 LRLWHNBBPGIAGF-SANMLTNESA-N 493.579 5.087 5 20 JKBD CC(C)CC(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)CC1 1831061053 LNRAGTSWFOZZLC-FQEVSTJZSA-N 457.596 5.089 5 20 JKBD Cc1ccc(CC(=O)N2CCC([C@@H]3CCCCN3C(=O)C[C@@H](C)c3ccccc3)CC2)cc1[N+](=O)[O-] 1831506580 JIDPBPUKUXBPIO-GJZUVCINSA-N 491.632 5.259 5 20 JKBD COc1cc(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3c(C)cccc3Cl)CC2)ccc1[N+](=O)[O-] 1832695690 GRYWBRUTMXUEDT-OAQYLSRUSA-N 499.995 5.112 5 20 JKBD COc1cc(CSc2nnc(-c3cccnc3)n2-c2ccccc2C)c([N+](=O)[O-])cc1OC(F)F 10395556 NEZKCCVLOWUVJG-UHFFFAOYSA-N 499.499 5.448 5 20 JKBD COc1cccc(-c2nc(COC(=O)Cn3c4ccccc4c(=O)c4ccccc43)cs2)c1 11277993 NOMFMHWKLMINGV-UHFFFAOYSA-N 456.523 5.030 5 20 JKBD O=[N+]([O-])c1cccc(OC[C@@H](O)CSc2nnc(-c3ccc(Cl)cc3)n2Cc2ccccc2)c1 15238154 XDAJUIMJBCUFIR-OAQYLSRUSA-N 496.976 5.087 5 20 JKBD COc1cc(C(=O)O[C@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)cc(Cl)c1OCC(C)C 17723059 QYVPHORGTZCLPG-CYBMUJFWSA-N 475.885 5.260 5 20 JKBD CCN(Cc1cccc(NC(=O)c2ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])cc2)c1)C(C)=O 27038043 NWOQMRDZDIYXBI-UHFFFAOYSA-N 467.909 5.661 5 20 JKBD Cc1ccc(-c2cc(C(=O)OCc3nnc(-c4ccc([N+](=O)[O-])cc4)o3)c3ccccc3n2)o1 28626736 JWKKIYVHHZOXHG-UHFFFAOYSA-N 456.414 5.118 5 20 JKBD CC(=O)Nc1ccc(Cl)c(NC(=O)c2ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])cc2)c1 59809002 FYGNZBRHDBYOMF-UHFFFAOYSA-N 460.273 5.905 5 20 JKBD COc1ccc(NC(=O)CSc2nnc(-c3ccc(F)cc3)c3ccccc23)c([N+](=O)[O-])c1 104498044 KSLXPTTYJKMCTR-UHFFFAOYSA-N 464.478 5.084 5 20 JKBD Cc1nc(-c2ccc(CCNC(=O)c3ccc(N[C@H](C)c4ccccn4)c([N+](=O)[O-])c3)s2)cs1 108787358 UYRDNHANRWDXDA-OAHLLOKOSA-N 493.614 5.629 5 20 JKBD CCSc1ccc([C@@H](C)NC(=O)c2cc(OC)c(OCc3cscn3)cc2[N+](=O)[O-])cc1 504703787 QBIRVSDERKAMQY-CQSZACIVSA-N 473.576 5.242 5 20 JKBD C[C@@H](c1ccccc1)n1c(Sc2cc3c(cc2[N+](=O)[O-])CCC(=O)N3)nnc1-c1ccccc1 506842425 ZQVLBCHOZLEUBX-INIZCTEOSA-N 471.542 5.499 5 20 JKBD COc1cc(CN[C@@H](C)c2cccc(N3CCCC3=O)c2)ccc1OCc1ccc([N+](=O)[O-])cc1 507904100 OJNHXTXWKXZPJI-IBGZPJMESA-N 475.545 5.160 5 20 JKBD CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)CSc1nnc(-c2ccco2)n1Cc1ccccc1 511506580 OIMZAQTZJDJIAT-UHFFFAOYSA-N 491.573 5.024 5 20 JKBD COc1ccc(Oc2ccc([N+](=O)[O-])cc2C(=O)Nc2ccc(Cl)c(C(=O)N(C)C)c2)cc1 514801828 GSOAXBVELTWBPJ-UHFFFAOYSA-N 469.881 5.003 5 20 JKBD CC(=O)Nc1ccc(NC(=O)COc2ccc(-c3ccccc3)cc2[N+](=O)[O-])c(C(F)(F)F)c1 517911718 RLZXIAWGIHCBHS-UHFFFAOYSA-N 473.407 5.257 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Cl)[C@@H](NCc1cccc(Br)c1)c1ccccc1 520259760 VWHAHJHVRBMDKT-FQEVSTJZSA-N 474.742 5.480 5 20 JKBD COc1ccc([C@@H](Cc2ccccc2C)NC(=O)c2cc(SC)ccc2[N+](=O)[O-])cc1OC 520747070 SWCDIJZPOVJNND-OAQYLSRUSA-N 466.559 5.356 5 20 JKBD CC(C)(C)N1CCCN(C(=O)C/C(=C\c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)CC1 521141529 FYLBDFZOLIYMCM-LVZFUZTISA-N 478.618 5.468 5 20 JKBD CSc1ccc(C(=O)c2ccccc2C(=O)Nc2nc3c(s2)C(=O)CC(C)(C)C3)cc1[N+](=O)[O-] 555481228 HUMATKHFCHQAIU-UHFFFAOYSA-N 495.582 5.412 5 20 JKBD Cc1cc(C)c(NC(=O)c2ccc(Sc3nc4ccccc4s3)c([N+](=O)[O-])c2)c(C)n1 561025251 STLKIMLOXKJJSH-UHFFFAOYSA-N 450.545 5.928 5 20 JKBD Cc1ccc([C@@H]2CCCN2C(=O)C2CCN(c3ccc(C(F)(F)F)cc3[N+](=O)[O-])CC2)cc1 603459855 VHKOUWVXUNVMPP-FQEVSTJZSA-N 461.484 5.502 5 20 JKBD O=[N+]([O-])c1ccc(-c2noc(CSc3nnc(-c4ccncc4)n3-c3ccc(Cl)cc3)n2)cc1 603748247 ITOFPTBYIGLCIR-UHFFFAOYSA-N 491.920 5.233 5 20 JKBD COc1ccc(-c2nc(C)c(C(=O)Nc3nc(-c4cccc([N+](=O)[O-])c4)c(C)s3)s2)cc1 603997222 DWQROQYSYGTDDL-UHFFFAOYSA-N 466.544 5.720 5 20 JKBD COc1ccc([N+](=O)[O-])cc1NC(=O)c1oc2ccccc2c1COc1ccccc1Cl 608802991 VXBCEPAOGOLFCW-UHFFFAOYSA-N 452.850 5.834 5 20 JKBD O=C(c1ccc(NCc2ccccc2Cl)c([N+](=O)[O-])c1)N1CCO[C@@H](c2ccccc2F)C1 608962858 KSODHBOBQUOTPW-HSZRJFAPSA-N 469.900 5.213 5 20 JKBD COc1ccc(CC(=O)Nc2ccc3nc(NC(=O)c4ccc(C)s4)sc3c2)cc1[N+](=O)[O-] 609016897 JUOJGXQEWSMJRE-UHFFFAOYSA-N 482.543 5.017 5 20 JKBD COc1ccc(-c2nsc(NC(=O)c3cc([N+](=O)[O-])ccc3Sc3ccccc3)n2)cc1 609127618 MABUUXASYSLXPJ-UHFFFAOYSA-N 464.528 5.525 5 20 JKBD O=C(O[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1)[C@H]1CCOc2ccccc21 728355772 DXSWNEXOTQUKAC-AVRDEDQJSA-N 466.877 5.038 5 20 JKBD CCc1ccccc1O[C@H](C(=O)OCc1nnc(-c2ccc([N+](=O)[O-])cc2)o1)c1ccccc1 730624278 FKTRFSCPMIWINN-QHCPKHFHSA-N 459.458 5.071 5 20 JKBD CC(=O)N(c1nc(COC(=O)c2c(Cl)cccc2[N+](=O)[O-])cs1)c1c(C)cc(C)cc1C 730644585 OASUMOMBGFSKRL-UHFFFAOYSA-N 473.938 5.672 5 20 JKBD COCCc1ccc(Oc2ccc(NC(=O)c3cc([N+](=O)[O-])cc([N+](=O)[O-])c3C)cc2)cc1 730983979 MWJVWXNXBTZLFR-UHFFFAOYSA-N 451.435 5.045 5 20 JKBD COc1ccc(NC(=O)c2csc(-c3cccc([N+](=O)[O-])c3)n2)cc1NC(=O)OC(C)(C)C 747639298 IXJLXPUBWSUXLL-UHFFFAOYSA-N 470.507 5.326 5 20 JKBD O=C(O[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1)c1c[nH]c2ccc([N+](=O)[O-])cc12 749319119 ZRUSTAQIUQROOM-OAQYLSRUSA-N 494.847 5.175 5 20 JKBD Cc1ccc(-c2cc(C(=O)O[C@@H](C)C(=O)Nc3ccccc3[N+](=O)[O-])c3cnn(C(C)C)c3n2)cc1 825896998 VSYWISKGXAZRSH-KRWDZBQOSA-N 487.516 5.080 5 20 JKBD CC(C)(C)OC(=O)N1CCO[C@H](c2ccc(NCc3ccc(C(F)(F)F)cc3[N+](=O)[O-])cc2)C1 864041473 OZJIESDYMHXSLE-FQEVSTJZSA-N 481.471 5.534 5 20 JKBD CSc1ccccc1NC(=O)c1ccc(NS(=O)(=O)c2ccc(Cl)c([N+](=O)[O-])c2)cc1 867312922 KEBUDPDNSQNISF-UHFFFAOYSA-N 477.951 5.023 5 20 JKBD Cc1oc2nc(S[C@H](C)C(=O)Nc3cccc([N+](=O)[O-])c3)nc(NC(=O)c3ccccc3)c2c1C 878923291 YCIKLBMADRBIAP-OAHLLOKOSA-N 491.529 5.119 5 20 JKBD O=[N+]([O-])c1ccc(F)cc1CSc1nnc(-c2ccccc2)n1Cc1ccc2c(c1)OCO2 915790158 GTEPPAWLQRNNRM-UHFFFAOYSA-N 464.478 5.062 5 20 JKBD O=C(Nc1ccc(OC[C@H](O)c2ccc(OC(F)(F)F)cc2)cc1)c1cc([N+](=O)[O-])ccc1Cl 917002185 AYTKOQBNEFWKNZ-FQEVSTJZSA-N 496.825 5.512 5 20 JKBD CCN(C(=O)Cc1ccc(NC(=O)c2ccc(Br)c([N+](=O)[O-])c2)cc1)c1ccccc1 917770064 VHYSICXMEKZWDT-UHFFFAOYSA-N 482.334 5.205 5 20 JKBD O=C(OCC[C@H]1CCCCN1C(=O)CCCc1c[nH]c2ccccc12)c1cccc([N+](=O)[O-])c1 918637827 MFXNOXUMMXZGOJ-OAQYLSRUSA-N 463.534 5.027 5 20 JKBD O=C(Nc1ccc(N2CCCCC2)c(Cl)c1)c1cc([N+](=O)[O-])ccc1I 919851605 SIWHRLOWGLMIMA-UHFFFAOYSA-N 485.709 5.095 5 20 JKBD O=C(NCC1(c2cccc(C(F)(F)F)c2)CCOCC1)Nc1ccc(Cl)c([N+](=O)[O-])c1 919899473 NPGUKBNDVCTKGH-UHFFFAOYSA-N 457.836 5.137 5 20 JKBD Cc1c(C(=O)Nc2ccc(C3(NC(=O)c4ccc([N+](=O)[O-])[nH]4)CCC3)cc2)oc2ccccc12 1788967659 VTHTXIZRHPYHQO-UHFFFAOYSA-N 458.474 5.039 5 20 JKBD O=C(/C=C/c1ccccc1[N+](=O)[O-])NC1(c2ccc(NC(=O)c3ccc4c(c3)COC4)cc2)CCC1 1789037980 KQWUGJHCXKTPPB-MDWZMJQESA-N 483.524 5.086 5 20 JKBD O=C(NC1(c2ccc(NC(=O)c3cc4cc([N+](=O)[O-])ccc4s3)cc2)CCC1)c1ccc(F)nc1 1791010358 KEYOGIBPFBWQTL-UHFFFAOYSA-N 490.516 5.405 5 20 JKBD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2cccc(F)c2[N+](=O)[O-])[nH]n1)c1cc2sccc2s1 1819029498 RQMQWTOMRUHVNA-HNNXBMFYSA-N 499.549 5.353 5 20 JKBD Cc1cc(Cl)cc(C(=O)N2CCC([C@H]3CCCCN3C(=O)/C=C/c3ccc([N+](=O)[O-])o3)CC2)c1 1824278262 CTTYNRDRABZMAR-YHCZKZFASA-N 485.968 5.096 5 20 JKBD Cc1cc2[nH]c(C(=O)N3CCC([C@H]4CCCCN4C(=O)c4cccc(F)c4[N+](=O)[O-])CC3)cc2s1 1830621714 RMPLXAPUCWDRRD-OAQYLSRUSA-N 498.580 5.132 5 20 JKBD O=C(c1cccc(-c2ccccc2)n1)N1CC2(CCCN2C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)C1 1845738836 GPRYRKKNYIYLOX-UHFFFAOYSA-N 498.564 5.002 5 20 JKBD O=C(Cn1c2ccccc2c(=O)c2ccccc21)O[C@@H](C(=O)c1c[nH]c2ccccc12)c1ccccc1 11276983 BMMLGFMCVJDEOU-WJOKGBTCSA-N 486.527 5.803 5 20 JKBD COc1cc(C(=O)N2CCC(c3nc4cc(Cl)ccc4s3)CC2)c([N+](=O)[O-])cc1OC(F)F 11916107 YJQQHLJAUSWHMG-UHFFFAOYSA-N 497.907 5.488 5 20 JKBD C[C@@H]1CCC[C@@H](C)N1C(=O)COc1ccc(C(=O)Nc2nc(-c3cccc([N+](=O)[O-])c3)cs2)cc1 14376793 RMFCRIMDKLVQCW-IAGOWNOFSA-N 494.573 5.139 5 20 JKBD CCOc1cc([N+](=O)[O-])c(C(=O)Nc2nc(-c3ccc(Br)cc3)cs2)cc1OC 24176360 DCZHPRYQCFDADH-UHFFFAOYSA-N 478.324 5.140 5 20 JKBD COc1cc(C(=O)Nc2nc(-c3cc(Cl)sc3Cl)cs2)c([N+](=O)[O-])cc1OC 26793058 OMCPOSORGYTHJK-UHFFFAOYSA-N 460.320 5.356 5 20 JKBD COc1ccc([N+](=O)[O-])cc1NC(=O)[C@@H](C)Sc1nnc(-c2ccc(F)cc2)n1-c1ccccc1 28797746 FSJMWWAXLNROJH-OAHLLOKOSA-N 493.520 5.110 5 20 JKBD Cc1ccc(-c2nnco2)cc1NC(=O)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1 72010237 ZDCOJHQIQBIKLG-UHFFFAOYSA-N 450.838 5.651 5 20 JKBD C[C@H](Nc1ccc(C(=O)Nc2ccc(N[C@H](C)c3ccccc3)cc2)cc1[N+](=O)[O-])c1ccccn1 302974694 DRFGUQUGAVJXTF-UXHICEINSA-N 481.556 6.588 5 20 JKBD C[C@@H](Nc1ccc(C(=O)Nc2ccccc2NCC(F)(F)F)cc1[N+](=O)[O-])c1ccccn1 303010475 QQAGHQXHNIPJOZ-CQSZACIVSA-N 459.428 5.389 5 20 JKBD C[C@H](Nc1ccc(C(=O)N2CCC(COc3ccccc3)CC2)cc1[N+](=O)[O-])c1ccccn1 303038473 VQLVEOITPKVQRV-IBGZPJMESA-N 460.534 5.094 5 20 JKBD O=C(CSc1ccc(C(F)(F)F)cc1[N+](=O)[O-])Nc1ccc(-n2cccn2)cc1C(F)(F)F 482331168 FLPLBCBKIBWJQU-UHFFFAOYSA-N 490.385 5.549 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)Nc2cccc(COCCc3ccccc3)c2)cc1SC 483344443 AIQPBEZKLOHLGY-UHFFFAOYSA-N 452.532 5.337 5 20 JKBD COc1ccc(CN[C@H](c2ccccc2)c2cccnc2)cc1OCc1ccc([N+](=O)[O-])cc1 488615380 DLARKRKAPACFTG-HHHXNRCGSA-N 455.514 5.457 5 20 JKBD O=C(Nc1cccc(NC(=O)c2cc([N+](=O)[O-])ccc2Sc2ccc(Cl)cc2)c1)c1ccoc1 499620092 WQNPHAGOLMKZFG-UHFFFAOYSA-N 493.928 6.497 5 20 JKBD C[C@H]1Cc2cc([N+](=O)[O-])ccc2N1C(=O)c1cccc(NC(=O)Cc2ccc(Br)cc2)c1 504335319 VMMQCHKIQIHJFS-HNNXBMFYSA-N 494.345 5.130 5 20 JKBD O=C(Nc1cc(N2CCCC2=O)ccc1Cl)c1cc([N+](=O)[O-])ccc1NCc1ccccc1 512472150 RTPFEBRGGRCEHI-UHFFFAOYSA-N 464.909 5.239 5 20 JKBD CCN1CCC(n2nccc2NCc2ccc(-c3ccc([N+](=O)[O-])cc3Br)o2)CC1 518784986 DHLZNTSKNNCPOY-UHFFFAOYSA-N 474.359 5.083 5 20 JKBD CSc1ccc(C(=O)c2ccccc2C(=O)NCc2ncc(-c3ccccc3)o2)cc1[N+](=O)[O-] 519019735 NSAKSVMKPDLNOE-UHFFFAOYSA-N 473.510 5.133 5 20 JKBD C[C@@H](CCc1ccco1)NC(=O)C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1 592465287 VGUPPJXYIOJACP-BYFYWULKSA-N 461.543 5.866 5 20 JKBD Cc1ccc(CN(C)[C@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Br)c2ccccc2)o1 603742704 CQOVICUOKSYYLZ-FQEVSTJZSA-N 458.312 5.071 5 20 JKBD O=[N+]([O-])c1ccc(-c2noc(CSc3nnc(-c4ccccc4)n3-c3ccc(F)cc3F)n2)cc1 603748145 CHLJITGWKWPBAT-UHFFFAOYSA-N 492.467 5.463 5 20 JKBD O=C(c1ccccc1-c1ncc(-c2ccccc2F)o1)N1CCN(c2cccc([N+](=O)[O-])c2)CC1 603902749 DXJICNJFIHVKSD-UHFFFAOYSA-N 472.476 5.018 5 20 JKBD C[C@@H](Nc1ccc(NC(=O)c2ccco2)c(Cl)c1)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 604127257 OYSYGGWKEJXDSQ-LLVKDONJSA-N 496.829 5.551 5 20 JKBD Cc1ccc(C(=O)Nc2cccc(C(F)(F)F)c2)cc1NC(=O)c1cccc(C)c1[N+](=O)[O-] 604449348 CAHOYVHUDCMSQE-UHFFFAOYSA-N 457.408 5.735 5 20 JKBD O=C(Nc1nnc(SCc2c(Cl)cccc2Cl)s1)c1cc([N+](=O)[O-])cc2c1OCCO2 608930843 IPNIHPCXFBTJKJ-UHFFFAOYSA-N 499.357 5.069 5 20 JKBD CCOc1cc(C(=O)Nc2ccc(Oc3cccc(F)c3)c3ccncc23)c([N+](=O)[O-])cc1OC 609104903 FTIOZKBSPLSWFC-UHFFFAOYSA-N 477.448 5.734 5 20 JKBD Cc1ccc(NC(=O)c2c[nH]c3cc([N+](=O)[O-])ccc23)cc1S(=O)(=O)Nc1cccc(Cl)c1 610853440 QPILYTUFRRVGQN-UHFFFAOYSA-N 484.921 5.091 5 20 JKBD CC(C)c1nc(CCNC(=O)c2ccccc2NC(=O)c2ccc([N+](=O)[O-])cc2Cl)cs1 726550762 BQJCRKWAIRCSJY-UHFFFAOYSA-N 472.954 5.053 5 20 JKBD CCc1cccc[n+]1/C(C(=S)NCc1cccc(C(F)(F)F)c1)=C(/O)c1cccc([N+](=O)[O-])c1 726569986 FWFIZPBDGLFJLR-UHFFFAOYSA-O 488.511 5.465 5 20 JKBD Cc1ccc(F)c(C(=O)O[C@@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Br)c2ccccc2)c1 727214032 DXFORDWHXRSCQS-HXUWFJFHSA-N 487.281 5.342 5 20 JKBD O=C(Nc1ccccc1C(=O)Nc1cccc(SC(F)F)c1)c1ccc([N+](=O)[O-])cc1Cl 727412939 UHZOPVQRKFCGPN-UHFFFAOYSA-N 477.876 6.068 5 20 JKBD O=C(Nc1ccc(Sc2nncs2)c(Cl)c1)c1ccc(Br)c([N+](=O)[O-])c1 728185537 LXUUMLLIGIDVBQ-UHFFFAOYSA-N 471.745 5.266 5 20 JKBD CCOc1ccccc1NC(=O)[C@H](OC(=O)c1c(Cl)cccc1[N+](=O)[O-])c1ccccc1 730646522 GBYKRWJVTMSRPW-OAQYLSRUSA-N 454.866 5.184 5 20 JKBD C[C@@H](OC(=O)Cn1ccc2cc([N+](=O)[O-])ccc21)C(=O)Nc1c(Cl)cc(Cl)cc1Cl 744623157 KHSBMEXCHOXEFD-SNVBAGLBSA-N 470.696 5.080 5 20 JKBD CC(C)c1ccc(CN(C(=O)COC(=O)c2csc(-c3ccc([N+](=O)[O-])cc3)n2)C2CC2)cc1 747954948 PJFLBWGOLNOUPG-UHFFFAOYSA-N 479.558 5.190 5 20 JKBD O=C(COC(=O)c1c[nH]c2ccc([N+](=O)[O-])cc12)Nc1c(Cl)c(Cl)cc(Cl)c1Cl 749316046 IFLSDXLHXDTKRN-UHFFFAOYSA-N 477.087 5.485 5 20 JKBD COc1ccc([N+](=O)[O-])cc1CSCC(=O)Nc1cc2oc3ccccc3c2cc1OC 750949272 LBYJZSGRLZUGQG-UHFFFAOYSA-N 452.488 5.383 5 20 JKBD Cc1nnc(Sc2ccc(NC(=O)c3cc([N+](=O)[O-])ccc3Br)c(C)c2)s1 751201019 YLIZZKBYKNABGZ-UHFFFAOYSA-N 465.354 5.229 5 20 JKBD CC(C)(C)OC(=O)COC(=O)C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1 804861065 USQFACFWWHGWQU-FOWTUZBSSA-N 454.504 5.020 5 20 JKBD O=C(c1ccc(CNCc2ccc(Oc3ccccc3Cl)c([N+](=O)[O-])c2)cc1)N1CCCC1 822290875 YSXDSYJQAJENJD-UHFFFAOYSA-N 465.937 5.566 5 20 JKBD Cc1csc(Sc2ccc(C(=O)OCC(=O)Nc3c(Cl)cccc3Cl)cc2[N+](=O)[O-])n1 849119912 AQMMWKKBPKRHTC-UHFFFAOYSA-N 498.369 5.613 5 20 JKBD COc1ccc(N[C@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)cc1NC(=O)OC(C)(C)C 915224266 KHUOHJVNDOYJKW-GFCCVEGCSA-N 464.906 5.043 5 20 JKBD O=C(Nc1ccc(OC(=O)c2sccc2Br)cc1)c1cc([N+](=O)[O-])ccc1Cl 915810942 JUWGKBZWMRVINF-UHFFFAOYSA-N 481.711 5.544 5 20 JKBD C[C@@H](Sc1cc(Cl)ccc1Cl)C(=O)OCC(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 919509470 PUBIWYMAIOZNDA-SECBINFHSA-N 497.278 5.583 5 20 JKBD COc1cc(C(=O)Nc2ccc(N3CCCCC3)c(Cl)c2)c([N+](=O)[O-])cc1OC(F)F 919851329 IYBWNRZNAPXIGR-UHFFFAOYSA-N 455.845 5.101 5 20 JKBD O=C(Nc1ccccc1C(=O)N[C@H]1CCCOc2ccc(F)cc21)c1ccc([N+](=O)[O-])cc1Cl 919859960 LNEODCZVOKMOGC-NRFANRHFSA-N 483.883 5.283 5 20 JKBD O=C(Cc1cccc([N+](=O)[O-])c1)NC1(c2ccc(NC(=O)[C@@H]3[C@@H]4Sc5ccccc5[C@H]43)cc2)CCC1 1789527655 AIXZUHBREBYNOM-KKUQBAQOSA-N 499.592 5.159 5 20 JKBD CC(C)n1ccc(C(=O)Nc2ccc(C3(NC(=O)Cc4ccc(Cl)cc4[N+](=O)[O-])CCC3)cc2)n1 1790164256 DVZJTBUEIDSONU-UHFFFAOYSA-N 495.967 5.016 5 20 JKBD O=C(NC1(c2ccc(NC(=O)c3cccc(F)c3[N+](=O)[O-])cc2)CCC1)c1cc2ccccc2o1 1790700972 HGUNSQJWKCQTFB-UHFFFAOYSA-N 473.460 5.542 5 20 JKBD COc1ccc(Cl)c(C(=O)Nc2ccc(C3(NC(=O)c4cc(O)cc([N+](=O)[O-])c4)CCC3)cc2)c1 1792085597 IJYKLWVOHDVDGE-UHFFFAOYSA-N 495.919 5.024 5 20 JKBD CC1(C)CCC(CC(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)CC1 1801207274 SMXQJPPHNHHLSE-ACDBMABISA-N 483.634 5.668 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2sccc2Cl)[nH]n1 1821287098 LRRONXZPHKIPIG-INIZCTEOSA-N 491.932 5.100 5 20 JKBD O=C(c1cc2cc([N+](=O)[O-])ccc2s1)N1CCC([C@H]2CCCCN2C(=O)c2cccs2)CC1 1825778685 BKGVAMNGTDRRQT-LJQANCHMSA-N 483.615 5.418 5 20 JKBD O=C(c1c[nH]c2cc(Cl)ccc12)N1CC2(CCCN2C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)C1 1845738845 HYFCQCRRNQZWAF-UHFFFAOYSA-N 494.960 5.075 5 20 JKBD COc1ccc(CN(C(=O)Cc2cn(-c3ccccc3)nc2-c2ccc([N+](=O)[O-])cc2)C2CC2)cc1 9888746 XGLVVBYSLQNFJZ-UHFFFAOYSA-N 482.540 5.190 5 20 JKBD CC(C)CCn1c(S[C@@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)nc2ccccc2c1=O 11205882 DRFNETPDMQIFJN-AWEZNQCLSA-N 474.970 5.124 5 20 JKBD O=C(NC[C@H](c1ccco1)N1CCCC1)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1 14047953 XEVVHTKQIZOTQB-HXUWFJFHSA-N 455.898 5.200 5 20 JKBD COc1cc(/C=C/C(=O)O[C@H](C)c2cccc([N+](=O)[O-])c2)ccc1OCc1c(C)noc1C 24084691 RCCZYMVOFNFSDA-PXUDHTSWSA-N 452.463 5.105 5 20 JKBD O=C(c1ccc(NCc2ccccc2Cl)c([N+](=O)[O-])c1)N1CCO[C@H](c2ccccc2)C1 27908844 DEUXNHHQRDTOIF-QHCPKHFHSA-N 451.910 5.074 5 20 JKBD COC(=O)c1ccccc1C(=O)c1ccc(NCc2c(C)nn(Cc3ccccc3)c2C)c([N+](=O)[O-])c1 29397074 CKYRVYXYFFFBQJ-UHFFFAOYSA-N 498.539 5.086 5 20 JKBD Cc1nn(Cc2ccc(C(=O)Nc3c(F)cc(F)cc3-c3ccccc3)cc2)c(C)c1[N+](=O)[O-] 108318356 XOBRGSDVRKKPRY-UHFFFAOYSA-N 462.456 5.654 5 20 JKBD O=C(Nc1ccccc1OCCn1ccnc1)c1ccc(NCc2ccccc2Cl)c([N+](=O)[O-])c1 303014888 RWPIAQOFCGTXMW-UHFFFAOYSA-N 491.935 5.388 5 20 JKBD Cc1nn(Cc2ccc(C(=O)N3CCC[C@H]3c3cccc4ccccc34)cc2)c(C)c1[N+](=O)[O-] 510120730 NWJGAOSHZWOKKD-VWLOTQADSA-N 454.530 5.587 5 20 JKBD COc1cc(C(=O)Nc2cccc(-c3nc(C)c(C)o3)c2)c([N+](=O)[O-])cc1OCc1cscn1 512322453 KVCQLHBHFNCJNB-UHFFFAOYSA-N 480.502 5.163 5 20 JKBD COCCN(C(=O)c1ccc(Oc2cccnc2)cc1)c1nc(-c2ccc([N+](=O)[O-])cc2)cs1 516362548 DKXCHGFZSFGQRM-UHFFFAOYSA-N 476.514 5.199 5 20 JKBD O=C(Nc1cccc(C(=O)N2CCCCC2)c1)c1ccc(NCc2ccccc2)c([N+](=O)[O-])c1 517454092 RXKYMTLGFZAAJX-UHFFFAOYSA-N 458.518 5.085 5 20 JKBD Cc1cc(C(=O)N2CCCC[C@H]2C)ccc1NC(=O)c1ccc(N2CCC(C)CC2)c([N+](=O)[O-])c1 520011673 AMLKTIKDFZDQQG-HXUWFJFHSA-N 478.593 5.406 5 20 JKBD COCCN(C(=O)c1ccc(F)c(C(F)(F)F)c1)c1nc(-c2ccc([N+](=O)[O-])cc2)cs1 520690599 BKRXPWIYJGWPOC-UHFFFAOYSA-N 469.416 5.169 5 20 JKBD COc1cc(C(=O)Nc2ccc(Sc3nc(C)cc(C)n3)cc2)c([N+](=O)[O-])cc1OC(F)F 591356008 CIDDIQNLJWYEPE-UHFFFAOYSA-N 476.461 5.015 5 20 JKBD CCOc1ccc(C(=O)N2CCCCC2)cc1NCc1ccc(C(F)(F)F)cc1[N+](=O)[O-] 600857092 YBGGLEVCXORDLL-UHFFFAOYSA-N 451.445 5.251 5 20 JKBD C[C@@H](c1cccc(Cl)c1)N(C)C(=O)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 603512313 HEQORISUXOFVQH-AWEZNQCLSA-N 469.891 5.703 5 20 JKBD COCCN(C(=O)C1CCN(c2ccccc2[N+](=O)[O-])CC1)[C@H](C)c1cccc(C(F)(F)F)c1 603529895 HNURRBUBTIFGKA-QGZVFWFLSA-N 479.499 5.066 5 20 JKBD CNC(=O)c1ccc(C)c(NC(=O)c2cc([N+](=O)[O-])ccc2Sc2ccc(Cl)cc2)c1 603570355 KRGMPRIDVUVTQK-UHFFFAOYSA-N 455.923 5.320 5 20 JKBD CCOc1cc(NC(=O)c2ccccc2)c(OCC)cc1NC(=O)Nc1ccc([N+](=O)[O-])cc1Cl 604427086 CZNJFVQSGXMJLY-UHFFFAOYSA-N 498.923 5.942 5 20 JKBD C[C@@H](OC(=O)c1csc(-c2cccc(C(F)(F)F)c2)n1)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl 725995785 GBEGKMBWRGPGED-SNVBAGLBSA-N 499.854 5.575 5 20 JKBD Cc1csc(Sc2ccc(C(=O)N3CCC(c4cc5ccccc5[nH]4)CC3)cc2[N+](=O)[O-])n1 744037538 WVMLLFXXRDFECK-UHFFFAOYSA-N 478.599 6.012 5 20 JKBD O=C(OCc1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[C@H](Oc1ccc(Cl)cc1)c1ccccc1 744585882 GKRLVISVQZACSB-OAQYLSRUSA-N 465.849 5.162 5 20 JKBD O=C(OCC(=O)N(Cc1ccccc1)c1ccccc1)c1csc(-c2ccc([N+](=O)[O-])cc2)n1 747958219 VWSJZVAMHNLQAK-UHFFFAOYSA-N 473.510 5.109 5 20 JKBD COc1cc(-c2cc(C(=O)N3CCc4cc([N+](=O)[O-])ccc43)c3ccccc3n2)cc(OC)c1OC 758717711 JZDZOUCRMUDAPX-UHFFFAOYSA-N 485.496 5.039 5 20 JKBD Cc1nc(NS(=O)(=O)c2ccc(Cl)c([N+](=O)[O-])c2)sc1-c1nc2ccccc2n1C(F)F 817997112 TWHKYNASLMKKDU-UHFFFAOYSA-N 499.908 5.226 5 20 JKBD Cc1nn(C)c2sc(C(=O)Nc3cc(Cl)c([N+](=O)[O-])cc3OCc3ccccc3)cc12 822219807 RNIJZOXHYSSQQS-UHFFFAOYSA-N 456.911 5.336 5 20 JKBD CC(C)(C)OC(=O)N1CCOC[C@@H]1c1noc(-c2ccccc2Sc2ccccc2[N+](=O)[O-])n1 904696925 RKSJPUMOVVSZOA-QGZVFWFLSA-N 484.534 5.104 5 20 JKBD COc1cc(-c2nc(-c3ccc(Br)cn3)no2)c([N+](=O)[O-])cc1OCc1ccccc1 904843269 FIKFTADOBLGPSQ-UHFFFAOYSA-N 483.278 5.057 5 20 JKBD O=C(O[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1)c1cc2ccccc2c(Cl)n1 915445738 FIXSZBHKIWMDQV-OAQYLSRUSA-N 496.306 5.987 5 20 JKBD Cc1ccn(-c2ccc(C(=O)Oc3ccc(NC(=O)c4cc([N+](=O)[O-])ccc4Cl)cc3)cc2)n1 915811608 ZPADXPWGVJUJAQ-UHFFFAOYSA-N 476.876 5.214 5 20 JKBD O=c1c2cc([N+](=O)[O-])ccc2nc2n1CC/C2=C\c1ccc(Oc2ccc(F)cc2)c([N+](=O)[O-])c1 916127266 JBDNUVTURJOLFX-RVDMUPIBSA-N 474.404 5.089 5 20 JKBD COc1cc(COC(=O)c2cccc(C)c2NC(=O)c2ccoc2C)c([N+](=O)[O-])cc1OC(F)F 919638085 SJDAUWCMMJDEJY-UHFFFAOYSA-N 490.415 5.024 5 20 JKBD COc1cc(C(=O)Oc2ccc(Cl)cc2Cl)c([N+](=O)[O-])cc1OCc1cscn1 919971651 MPOSRHYHFMOXFX-UHFFFAOYSA-N 455.275 5.165 5 20 JKBD C[C@@H](SCc1ncc(-c2ccc(Cl)cc2)o1)C(=O)OCc1cc(F)ccc1[N+](=O)[O-] 920670325 FIAOCKMEPVWCNS-GFCCVEGCSA-N 450.875 5.407 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)c3cc4ccoc4s3)CCC2)cc1)c1ccc([N+](=O)[O-])o1 1785748791 HLTNVTCQJRCHCN-UHFFFAOYSA-N 451.460 5.057 5 20 JKBD C/C(=C\c1ccc(C)o1)C(=O)Nc1ccc(C2(NC(=O)c3ccc([N+](=O)[O-])cc3F)CCC2)cc1 1789585573 LQXPWYGMHVENAU-JQIJEIRASA-N 477.492 5.487 5 20 JKBD O=C(NC1(c2ccc(NC(=O)C34CCC(CC3)CC4)cc2)CCC1)c1cc(O)cc([N+](=O)[O-])c1 1791981020 SCGGUKCVOVVFMW-UHFFFAOYSA-N 463.534 5.019 5 20 JKBD CC[C@@H](C)[C@@H](C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)/C=C/c1ccccc1[N+](=O)[O-])C2)c1ccccc1 1795575202 UOMNVJARSAUSCR-DMLMBLHWSA-N 475.589 5.076 5 20 JKBD CCC[C@H]1CC[C@H](C(=O)N2CCC3(CCCN(C(=O)Cc4cc([N+](=O)[O-])ccc4F)C3)CC2)CC1 1806657370 VOVLVAIUEXFYLC-MEMLXQNLSA-N 487.616 5.114 5 20 JKBD O=C(Cc1cccc(F)c1)N1CCCC2(CCN(C(=O)c3cc4cc([N+](=O)[O-])ccc4s3)CC2)C1 1809238008 STKHFGVAKOXGTL-UHFFFAOYSA-N 495.576 5.036 5 20 JKBD CC1(C)CCC(CC(=O)Nc2cc([C@H]3CCCCN3C(=O)c3cc(F)cc([N+](=O)[O-])c3)[nH]n2)CC1 1820978865 SOSVKEHBFHOFAW-OAQYLSRUSA-N 485.560 5.369 5 20 JKBD O=C(/C=C/c1ccccc1[N+](=O)[O-])N1CCC([C@H]2CCCCN2C(=O)c2cc(Cl)ccc2F)CC1 1823940724 XWWZAIRXTAFRMS-OXHGWOFKSA-N 499.970 5.334 5 20 JKBD C[C@H](Sc1ccccc1)C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cc(F)cc([N+](=O)[O-])c2)CC1 1824393154 YCCVTUDQXQCJGR-UUOWRZLLSA-N 499.608 5.148 5 20 JKBD Cc1oc(C(C)(C)C)cc1C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cc(F)cc([N+](=O)[O-])c2)CC1 1830615110 RLCKGZSMFAIKDP-HSZRJFAPSA-N 499.583 5.480 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)N1CCCC[C@@H]1C1CCN(C(=O)C2(C(F)(F)F)CCC2)CC1 1830730093 XSJXSCRYOUIVGJ-LJQANCHMSA-N 499.505 5.008 5 20 JKBD Cc1cc(CCCC(=O)N2CCC([C@@H]3CCCCN3C(=O)CC3CCC3)CC2)c([N+](=O)[O-])cc1F 1832830371 FRMUHGYKZXHBHX-DEOSSOPVSA-N 487.616 5.175 5 20 JKBD O=C(c1ccccc1Oc1cccc2ccccc12)N1CC2(CCCN2C(=O)c2ccc([N+](=O)[O-])o2)C1 1840966808 RZHHXATWNOBCDR-UHFFFAOYSA-N 497.507 5.264 5 20 JKBD COc1ccc(C)cc1NC(=O)[C@@H](OC(=O)c1ccc(Cl)c([N+](=O)[O-])c1)c1ccccc1 11025171 LBVAWAHSUPOFBD-NRFANRHFSA-N 454.866 5.102 5 20 JKBD COc1cc(CSc2nnc(-c3ccccc3F)n2C2CC2)c([N+](=O)[O-])cc1OC(F)F 11322669 HINKATGNZBKIEE-UHFFFAOYSA-N 466.441 5.230 5 20 JKBD COc1ccc(C)cc1-c1csc(NC(=O)c2ccc(Cn3nc(C)c([N+](=O)[O-])c3C)cc2)n1 15637749 CXXKTLOALFSVTM-UHFFFAOYSA-N 477.546 5.149 5 20 JKBD CCOc1cc(C(=O)N(C)Cc2cn(-c3ccccc3)nc2-c2ccccc2)c([N+](=O)[O-])cc1OC 23742818 GVULZIQDLRYRAI-UHFFFAOYSA-N 486.528 5.127 5 20 JKBD COc1cc(C(=O)N[C@@H](c2ccccc2)c2nccn2C)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 23774413 UUIYUYCAKKHDMM-QHCPKHFHSA-N 492.919 5.302 5 20 JKBD COc1ccc(NC(=O)c2ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])cc2)cc1NC(C)=O 26061040 DBMQIOKUJVXVLN-UHFFFAOYSA-N 455.854 5.260 5 20 JKBD CCCn1c(SCCC(=O)Nc2ccc([N+](=O)[O-])cc2C)nnc1-c1ccc(Cl)cc1 26224678 YYOQDBRSVYAVTM-UHFFFAOYSA-N 459.959 5.346 5 20 JKBD CN(Cc1ccc(Br)o1)[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1 30213698 FIWHFBJEDKGWTN-LJQANCHMSA-N 478.730 5.416 5 20 JKBD O=C(Nc1nnc(SCc2ccccc2)s1)c1csc(-c2ccc([N+](=O)[O-])cc2)n1 303074277 YPEVGELNDXNQGX-UHFFFAOYSA-N 455.546 5.114 5 20 JKBD CC[C@H](C)[C@H](NC(=O)c1ccc(N[C@H](C)c2ccccn2)c([N+](=O)[O-])c1)c1nc2ccccc2[nH]1 410078165 QGLDFKXGBHXJAG-SRGWNRLKSA-N 472.549 5.556 5 20 JKBD O=C(C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)NCCC(=O)N1CCCCCC1 498530563 WHJITAJRDYFXCD-JZJYNLBNSA-N 492.601 5.044 5 20 JKBD CN(C[C@@H]1OCCc2ccccc21)C(=O)C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1 506266991 ADZFEYCNWPFKOT-JYACYGOOSA-N 499.592 5.908 5 20 JKBD Cc1noc([C@@H]2CCCN(C(=O)C/C(=C/c3ccc([N+](=O)[O-])cc3)c3nc4ccccc4s3)C2)n1 509150551 IICOJDGBDKUFRB-ZJYZBMPFSA-N 489.557 5.233 5 20 JKBD C[C@@H](NC(=O)Nc1ccc(NC(=O)c2ccco2)cc1C(F)(F)F)c1cccc([N+](=O)[O-])c1 509732367 RUMCTOPWJRBSFC-GFCCVEGCSA-N 462.384 5.342 5 20 JKBD CCOc1cc(NC(=O)c2ccccc2)c(OCC)cc1NC(=O)N[C@@H](C)c1cccc([N+](=O)[O-])c1 509781042 JYVGVTMJPQIDQF-KRWDZBQOSA-N 492.532 5.527 5 20 JKBD C[C@H](c1ccco1)N(C(=O)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1)C1CC1 509825042 DIKOZFDCVWNKNM-CQSZACIVSA-N 451.445 5.175 5 20 JKBD Cc1cc(C)n([C@@H](C)C(=O)Nc2ccc(NC(=O)N[C@H](C)c3cccc([N+](=O)[O-])c3)cc2Cl)n1 519501100 HNXILQBFYKVZEC-CVEARBPZSA-N 484.944 5.144 5 20 JKBD CCOc1cc(NC(=O)c2ccccc2-c2ncc(-c3ccccc3F)o2)c([N+](=O)[O-])cc1OCC 520097958 SKCYDNIZVAJXGC-UHFFFAOYSA-N 491.475 6.106 5 20 JKBD CC(C)NC(=O)Nc1ccc(CNCc2ccc(-c3ccc([N+](=O)[O-])cc3Br)o2)cc1 555190890 WDKRVSZDXSOEEB-UHFFFAOYSA-N 487.354 5.437 5 20 JKBD Cn1cnnc1Sc1ccc(C(=O)Nc2ccccc2Sc2ccccc2)cc1[N+](=O)[O-] 590646514 JBSRNHVHURWBLC-UHFFFAOYSA-N 463.544 5.278 5 20 JKBD CC(C)(C)C(=O)N1CCC(NC(=O)c2cc([N+](=O)[O-])ccc2Sc2ccc(Cl)cc2)CC1 603672501 NJTVZSMDRDTVFB-UHFFFAOYSA-N 475.998 5.166 5 20 JKBD O=C(Nc1ccc(-c2cn3ccsc3n2)cc1)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-] 603727248 JOGNDNNJKOVSDS-UHFFFAOYSA-N 462.409 5.164 5 20 JKBD O=[N+]([O-])c1cnc2ccc(Br)cc2c1N1C[C@@H](C(F)(F)F)C[C@H](C(F)(F)F)C1 604270719 NNUWBPDTSSIKNQ-IUCAKERBSA-N 472.183 5.473 5 20 JKBD O=C(c1c2c(nc3ccccc13)/C(=C\c1ccc([N+](=O)[O-])cc1)CCC2)N1CCC[C@H](n2ccnc2)C1 609131169 JJPCPTUNQSPRNI-RVQWUSFHSA-N 493.567 5.694 5 20 JKBD COc1cc([C@H](C)NC(=O)Cn2c3ccccc3c(=O)c3ccccc32)ccc1OCc1ccccc1 614896528 VATKCZKYTXUUNN-NRFANRHFSA-N 492.575 5.620 5 20 JKBD Cc1c(NC(=O)[C@@H](C)OC(=O)Cc2csc(-c3cccc(C(F)(F)F)c3)n2)cccc1[N+](=O)[O-] 725969680 ODFNFISVWSQZEU-CYBMUJFWSA-N 493.463 5.158 5 20 JKBD C[C@H](Nc1ccc(C(=O)OCc2csc(-c3ccoc3)n2)cc1[N+](=O)[O-])c1ccccn1 731073690 JFWURUXYGOGOJC-AWEZNQCLSA-N 450.476 5.236 5 20 JKBD O=C(c1ccc(Cl)cc1)N1CCC[C@@H](C(=O)N(CC2CC2)c2ccc(Cl)c([N+](=O)[O-])c2)C1 745344778 QFFMZRMEOPXEKX-QGZVFWFLSA-N 476.360 5.197 5 20 JKBD Cc1nnc(S[C@H](C(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)c2ccccc2)n1-c1ccccc1 824289047 NYEYVJLJFPKFRL-NRFANRHFSA-N 479.949 5.609 5 20 JKBD C[C@@H](OC(=O)Cn1c2ccccc2c(=O)c2ccccc21)c1nnc(-c2cccc(Cl)c2)o1 841978940 VIZOOFVIIHXDDT-OAHLLOKOSA-N 459.889 5.163 5 20 JKBD O=C(Nc1ccccc1C(=O)OCc1coc(-c2ccc(F)cc2)n1)c1ccc([N+](=O)[O-])cc1Cl 899456551 QSFMKRXEMAXAOK-UHFFFAOYSA-N 495.850 5.652 5 20 JKBD COc1ccc(Oc2ccc([N+](=O)[O-])cc2C(=O)O[C@H](C)C(=O)Nc2cccc(C)c2C)cc1 915249637 MIPUPKXBEVKLCM-QGZVFWFLSA-N 464.474 5.197 5 20 JKBD Cc1ccc(C(=O)Nc2cc([N+](=O)[O-])c(F)cc2F)cc1NC(=O)c1ccc(Br)cc1 915283640 AHYPMYGLDBBQCF-UHFFFAOYSA-N 490.260 5.449 5 20 JKBD C[C@H](Nc1ccc(C(=O)Oc2cccc(NC(=O)c3ccccc3)c2)cc1[N+](=O)[O-])c1ccccn1 920115874 NSUAQPRCJWWLMN-SFHVURJKSA-N 482.496 5.634 5 20 JKBD O=C(Cc1cccc([N+](=O)[O-])c1)Nc1ccc(C2(NC(=O)[C@@H]3[C@H]4Sc5ccccc5[C@H]43)CCC2)cc1 1785793685 UMHHOBRRPMBRQS-GSDHBNRESA-N 499.592 5.159 5 20 JKBD O=C(Cc1ccc(Cl)cc1[N+](=O)[O-])Nc1ccc(C2(NC(=O)c3ccc(Cl)cn3)CCC2)cc1 1786115733 GWERSIHPOYSICN-UHFFFAOYSA-N 499.354 5.287 5 20 JKBD Cc1ccc(C(=O)Nc2ccc(C3(NC(=O)CSc4ccccc4[N+](=O)[O-])CCC3)cc2)o1 1786492975 QMHIWWHNCFFFMC-UHFFFAOYSA-N 465.531 5.036 5 20 JKBD O=C(NC1(c2ccc(NC(=O)[C@@H]3C[C@]3(F)Cl)cc2)CCC1)c1cc2cc([N+](=O)[O-])ccc2s1 1791675830 AXYLZYRJPAOCFG-GAJHUEQPSA-N 487.940 5.482 5 20 JKBD CC(F)(F)C(C)(C)C(=O)NC1(c2ccc(NC(=O)Cc3cc(F)ccc3[N+](=O)[O-])cc2)CCC1 1792308309 LNMOXCIRGAQPTB-UHFFFAOYSA-N 477.483 5.092 5 20 JKBD Cc1oc(C(C)(C)C)cc1C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2ccc([N+](=O)[O-])cc2F)[nH]n1 1816462623 BMXWBJYDOJVENQ-HXUWFJFHSA-N 497.527 5.276 5 20 JKBD CC[C@H](C)CC(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2ccc(Br)c([N+](=O)[O-])c2)CC1 1824346063 ADRUSEMGFSFEGS-OXJNMPFZSA-N 494.430 5.027 5 20 JKBD O=C(CCC1CCC1)N1CCCC[C@H]1C1CCN(C(=O)C2(c3cccc([N+](=O)[O-])c3)CCC2)CC1 1824352478 DTXSPEJOYKJFLG-VWLOTQADSA-N 481.637 5.217 5 20 JKBD CC[C@@H](C(=O)N1CCC([C@H]2CCCCN2C(=O)Cc2cc([N+](=O)[O-])ccc2F)CC1)c1ccccc1 1824946796 QINMEMAAVBYASS-AOYPEHQESA-N 495.595 5.090 5 20 JKBD O=C(c1cc2sccc2s1)N1CCC([C@H]2CCCCN2C(=O)c2ccc(O)c([N+](=O)[O-])c2)CC1 1830489673 UWGDEDRACTVTBO-QGZVFWFLSA-N 499.614 5.124 5 20 JKBD CC[C@H](C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2ccc([N+](=O)[O-])cc2F)CC1)c1ccccc1 1830495820 WXJDKDXWNDTZED-DHLKQENFSA-N 481.568 5.161 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)N1CCCC[C@H]1C1CCN(C(=O)CCc2ccccc2F)CC1 1830728481 DITQHXCHBBTMRD-DEOSSOPVSA-N 499.558 5.048 5 20 JKBD O=C(COC(=O)[C@@H](Sc1ccccc1)c1ccccc1)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 10589803 FFTMRWPQOSBIGK-NRFANRHFSA-N 490.459 5.629 5 20 JKBD O=C(Cc1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1)NCc1csc(-c2ccccc2)n1 10894032 MMCISZNIDSQEDA-UHFFFAOYSA-N 495.564 5.430 5 20 JKBD CCN(CC(=O)Nc1c(Cl)cccc1Cl)C(=O)c1ccc(N2CCC[C@@H](C)C2)c([N+](=O)[O-])c1 12483578 FIKQYFXQIKBPTA-OAHLLOKOSA-N 493.391 5.239 5 20 JKBD O=C(CCc1ncc(-c2ccccc2Cl)o1)Oc1ccc(NC(=O)c2cccc([N+](=O)[O-])c2)cc1 12832674 MNQLSEFLWISYKN-UHFFFAOYSA-N 491.887 5.694 5 20 JKBD O=C(Nc1cccc(S(=O)(=O)Nc2cccc(C(F)(F)F)c2)c1)c1ccc([N+](=O)[O-])cc1Cl 15422416 MORLYZPXPCGRIX-UHFFFAOYSA-N 499.854 5.320 5 20 JKBD Cc1cc(CSc2ccccc2C(=O)O[C@@H](C)C(=O)Nc2cc([N+](=O)[O-])ccc2Cl)on1 16542530 CRBGAXJDFRNCHI-ZDUSSCGKSA-N 475.910 5.021 5 20 JKBD C[C@H](OC(=O)C1CCN(c2ccccc2[N+](=O)[O-])CC1)C(=O)Nc1ccc(Cl)cc1C(F)(F)F 17045074 HLZCZCTYDYBEHA-ZDUSSCGKSA-N 499.873 5.054 5 20 JKBD C[C@@H](Sc1nc2cc3ccccc3cc2c(=O)n1C)C(=O)Nc1ccc(Cl)cc1C(F)(F)F 18591147 WZWQEJFXWGRSMB-GFCCVEGCSA-N 491.922 5.878 5 20 JKBD Cc1c(NC(=O)[C@H](C)OC(=O)c2cccc3c(=O)c(C)c(-c4ccccc4)oc23)cccc1[N+](=O)[O-] 21844378 PSADUJTYDLYESM-KRWDZBQOSA-N 486.480 5.169 5 20 JKBD Cc1ccc(NC(=O)c2ccccc2SCC(=O)NC2CCCCCCC2)cc1[N+](=O)[O-] 24068338 DUHMLXFGIIGTCA-UHFFFAOYSA-N 455.580 5.477 5 20 JKBD CCn1cnnc1-c1cccc(NC(=O)c2cc([N+](=O)[O-])ccc2Sc2ccc(Cl)cc2)c1 25277928 ILSJORBWGZDTJH-UHFFFAOYSA-N 479.949 5.930 5 20 JKBD C[C@@H](Sc1nnc(COc2ccccc2F)n1-c1ccccc1)C(=O)Nc1ccc([N+](=O)[O-])cc1 28174106 OLHXPEXDGXMCDR-MRXNPFEDSA-N 493.520 5.013 5 20 JKBD Cc1ccc([N+](=O)[O-])cc1NC(=O)CSc1nnc(-c2ccccc2F)n1-c1ccc(F)cc1 32517198 LJGPHIGPWXTOMR-UHFFFAOYSA-N 481.484 5.160 5 20 JKBD O=C(CSc1ccc(C(F)(F)F)cc1[N+](=O)[O-])N1CCc2sccc2[C@H]1c1cccs1 105120255 ODDRZJKYEZBTAV-IBGZPJMESA-N 484.546 6.003 5 20 JKBD Cc1nn(Cc2ccc(C(=O)N[C@@H](c3ccccc3)c3ccc(F)cc3)cc2)c(C)c1[N+](=O)[O-] 105873846 PWXTXBKIRVAMOI-DEOSSOPVSA-N 458.493 5.115 5 20 JKBD O=C(c1cc([N+](=O)[O-])ccc1Oc1ccccc1)N1CCC[C@H](c2nc(-c3cccc(F)c3)no2)C1 110013784 LVMDKRBUCICWMU-SFHVURJKSA-N 488.475 5.596 5 20 JKBD CC(C)N1CCC(N(C)C(=O)c2c3c(nc4ccccc24)/C(=C\c2ccc([N+](=O)[O-])cc2)CCC3)CC1 476139571 HHCBLGNLJOVUQE-QOCHGBHMSA-N 498.627 5.965 5 20 JKBD O=C(Nc1ccc2oc(O)nc2c1)c1ccccc1Sc1ccc(C(F)(F)F)cc1[N+](=O)[O-] 482934069 PKCBBFGAGCBYPT-UHFFFAOYSA-N 475.404 5.864 5 20 JKBD Cc1ccc(C(=O)Nc2ccccc2)cc1NC(=O)c1csc(-c2ccc([N+](=O)[O-])cc2)n1 496282895 JXRGGHJXMXIURV-UHFFFAOYSA-N 458.499 5.531 5 20 JKBD O=C(Nc1ccc(S(=O)(=O)c2ccc(F)cc2)cc1)c1cc2cc([N+](=O)[O-])ccc2s1 501201609 SUKNQLCXSMWCKR-UHFFFAOYSA-N 456.476 5.034 5 20 JKBD C[C@@H](c1cccc(C(F)(F)F)c1)N(C(=O)CCCn1c(=O)oc2cc([N+](=O)[O-])ccc21)C1CC1 502864012 YYMLOBDYODNMMG-AWEZNQCLSA-N 477.439 5.054 5 20 JKBD C[C@H]1Cc2cc([N+](=O)[O-])ccc2N1C(=O)C[C@H](NC(=O)c1ccccc1Cl)c1ccccc1 504265359 CNOZNANBFLMBOH-AOMKIAJQSA-N 463.921 5.087 5 20 JKBD C[C@@H]1Cc2cc([N+](=O)[O-])ccc2N1C(=O)c1cccc(NC(=O)c2cccc(Br)c2)c1 504312072 XVYBKSZLCWBRMM-CQSZACIVSA-N 480.318 5.201 5 20 JKBD CCOc1cc2c(cc1[C@@H]1C[C@@H]1NC(=O)CSc1ccc(C(F)(F)F)cc1[N+](=O)[O-])O[C@@H](C)C2 504499985 UUWUWDJPUUAVQO-NUTKFTJISA-N 496.507 5.100 5 20 JKBD Cc1ccn2cc(CNC(=O)C/C(=C\c3ccc([N+](=O)[O-])cc3)c3nc4ccccc4s3)nc2c1 512694400 VHTFXGOADQLQBA-CPNJWEJPSA-N 483.553 5.408 5 20 JKBD COc1ccc([N+](=O)[O-])cc1C(=O)Nc1ccc(NC(=O)c2ccccc2F)cc1C(F)(F)F 514445995 PFRCKXANLQMKPP-UHFFFAOYSA-N 477.370 5.266 5 20 JKBD Cc1ccc(-c2csc(NC(=O)CS[C@H](C)c3nc4ccccc4[nH]3)n2)cc1[N+](=O)[O-] 515164168 ORZXPWXKWOFHRJ-CYBMUJFWSA-N 453.549 5.336 5 20 JKBD COc1ccc(Cl)c(NC(=O)C/C(=C/c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)c1 520414709 LUYPKZNGTOPHFH-VBKFSLOCSA-N 479.945 6.436 5 20 JKBD C[C@@H](Nc1ccc(C(=O)NCc2ccc(-c3nc4ccccc4[nH]3)cc2)cc1[N+](=O)[O-])c1ccccn1 521310530 KSCDRJLZVQQVAI-GOSISDBHSA-N 492.539 5.636 5 20 JKBD CSc1ccc(C(=O)c2ccccc2C(=O)Nc2nc(-c3ccccn3)cs2)cc1[N+](=O)[O-] 603455087 ZYGXKBFDOVFAPP-UHFFFAOYSA-N 476.539 5.319 5 20 JKBD Cc1sc(NC(=O)c2ccccc2SCc2ccco2)nc1-c1cccc([N+](=O)[O-])c1 603997897 XWLGULPERZEYQS-UHFFFAOYSA-N 451.529 6.164 5 20 JKBD COCc1cccc2sc(NC(=O)c3ccccc3C(=O)c3ccc(SC)c([N+](=O)[O-])c3)nc12 609186494 ATNFZWFBLTZIPZ-UHFFFAOYSA-N 493.566 5.556 5 20 JKBD Cc1nc([N+](=O)[O-])cn1CCC(=O)N[C@@H](Cc1ccc(Cl)cc1Cl)c1ccc(F)cc1 609375838 NTLMRDRLZIFAIE-IBGZPJMESA-N 465.312 5.036 5 20 JKBD O=[N+]([O-])c1ccc(-c2ccc(CNC[C@H](O)c3ccc(OC(F)(F)F)cc3)o2)c(Cl)c1 726605231 AGNYMFSPPAWNNO-SFHVURJKSA-N 456.804 5.230 5 20 JKBD COc1ccc(CC(=O)Nc2cc(C(F)(F)F)ccc2NC(=O)OC(C)(C)C)cc1[N+](=O)[O-] 727674603 ZPVJGHRUZOBVOJ-UHFFFAOYSA-N 469.416 5.150 5 20 JKBD CC(C)(C)OC(=O)Nc1ccc(NC(=O)NCCc2ccc([N+](=O)[O-])cc2)c(C(F)(F)F)c1 729574640 WJJBAMURJGZYOH-UHFFFAOYSA-N 468.432 5.325 5 20 JKBD COc1ccccc1C[C@H](C)CC(=O)Oc1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2Cl)cc1 730469007 CRCVPSMGAMMCQB-INIZCTEOSA-N 482.920 5.683 5 20 JKBD O=C(COC(=O)c1csc(-c2ccc(Cl)c(Cl)c2)n1)Nc1ccc(Cl)cc1[N+](=O)[O-] 744605051 PQZZBBYWKULMKN-UHFFFAOYSA-N 486.720 5.474 5 20 JKBD CC(C)(C)OC(=O)N1CCC[C@H]1[C@@H]1CCCN(C(=O)c2ccc(C(C)(C)C)c([N+](=O)[O-])c2)C1 749644111 BETQVMKYYPRKSU-QUCCMNQESA-N 459.587 5.144 5 20 JKBD O=C(OCC1CCN(c2ccc([N+](=O)[O-])cn2)CC1)[C@@H]1CC=CC[C@H]1c1nc2ccccc2s1 750428624 UBAINPPUFYJYOZ-WOJBJXKFSA-N 478.574 5.109 5 20 JKBD CC[C@@H](C)C(=O)N1CCC[C@@H](C(=O)Nc2cc(Cl)c([N+](=O)[O-])cc2OCc2ccccc2)C1 751062264 FJKNICVFNZZGGO-SJLPKXTDSA-N 473.957 5.050 5 20 JKBD O=C(CCc1cccc(Cl)c1)Oc1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2Cl)cc1 790040526 MMNUVWKMWVMUFY-UHFFFAOYSA-N 459.285 5.692 5 20 JKBD O=C(OCc1nnc(-c2ccc([N+](=O)[O-])cc2)o1)c1sc2cc(C(F)(F)F)ccc2c1Cl 914963488 ASFJYTHGASBDPN-UHFFFAOYSA-N 483.811 5.889 5 20 JKBD COc1ccc(Oc2ccc([N+](=O)[O-])cc2C(=O)O[C@@H](C)c2nc(O)c3c(C)c(C)sc3n2)cc1 915441485 DOGWQOIKFBJQKK-ZDUSSCGKSA-N 495.513 5.641 5 20 JKBD O=C(Nc1ccc(Cl)c([N+](=O)[O-])c1)C1CCN(c2ncc(C(F)(F)F)cc2Cl)CC1 916694565 GUZBCKCVUBTUNG-UHFFFAOYSA-N 463.243 5.171 5 20 JKBD C[C@@H](c1ccccc1)n1c(SCC(=O)Nc2cc(Cl)ccc2[N+](=O)[O-])nnc1-c1ccccc1 917254299 KBZUWMDXKRCBKS-INIZCTEOSA-N 493.976 5.847 5 20 JKBD C[C@H](Nc1ccc(C(=O)OCC(=O)Nc2ccc(Cl)c(Cl)c2)cc1[N+](=O)[O-])c1ccccn1 920547070 NVGHIOLSTNOSTF-ZDUSSCGKSA-N 489.315 5.265 5 20 JKBD Cc1ccc(OCc2ccc(C(=O)O[C@H](C)c3nnc(-c4ccc([N+](=O)[O-])cc4)o3)o2)c(C)c1 920586325 MEZZDTWYCDAPOG-MRXNPFEDSA-N 463.446 5.352 5 20 JKBD O=C(NC1(c2ccc(NC(=O)c3cc([N+](=O)[O-])cc4c3OCC4)cc2)CCC1)c1ccc2occc2c1 1790046685 PZSVDHNZNQWYSQ-UHFFFAOYSA-N 497.507 5.337 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)c3ccc([N+](=O)[O-])c4c3OCO4)CCC2)cc1)c1ccc(Cl)cc1 1790295608 AGAVKLBSKLHFSW-UHFFFAOYSA-N 493.903 5.038 5 20 JKBD O=C(CCc1c[nH]c2ccccc12)NC1(c2ccc(NC(=O)c3ccc(O)c([N+](=O)[O-])c3)cc2)CCC1 1790619785 QRXBQGURJLHBQF-UHFFFAOYSA-N 498.539 5.162 5 20 JKBD O=C(NC1(c2ccc(NC(=O)c3cccc(F)c3[N+](=O)[O-])cc2)CCC1)c1ccc(Cl)o1 1790699066 VPUZFLJLLMWMGO-UHFFFAOYSA-N 457.845 5.042 5 20 JKBD COc1cscc1C(=O)NC1(c2ccc(NC(=O)c3c(F)ccc([N+](=O)[O-])c3C)cc2)CCC1 1790771048 NICMNOMYMADCSO-UHFFFAOYSA-N 483.521 5.174 5 20 JKBD CCc1cc(C(=O)NC2(c3ccc(NC(=O)c4cc5cc([N+](=O)[O-])ccc5s4)cc3)CCC2)n[nH]1 1791011262 UVPGPEVJDYKMKR-UHFFFAOYSA-N 489.557 5.157 5 20 JKBD CC[C@@H](C)[C@@H](C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1c(F)ccc([N+](=O)[O-])c1C)c1ccccc1 1800699124 IICJCOZJAGBHCB-OREFEKLXSA-N 481.568 5.124 5 20 JKBD O=C(/C=C/c1ccccc1[N+](=O)[O-])Nc1cc([C@H]2CCCCN2C(=O)c2cccc(F)c2Cl)[nH]n1 1823503775 SPYAZFGEYJPXEN-YVNCXZRQSA-N 497.914 5.130 5 20 JKBD O=C(c1ccc(-c2ccccc2)cc1)N1CCC([C@@H]2CCCCN2C(=O)c2ccc([N+](=O)[O-])o2)CC1 1823616780 UVSJVOGPRDKJMW-DEOSSOPVSA-N 487.556 5.402 5 20 JKBD O=C(c1cccc(F)c1[N+](=O)[O-])N1CCC([C@H]2CCCCN2C(=O)c2ccccc2C2CC2)CC1 1832556162 TYDHQEYBDSQJHK-XMMPIXPASA-N 479.552 5.158 5 20 JKBD O=C(CSc1nnc(-c2ccccc2F)n1Cc1ccccc1)Nc1ccc(Cl)cc1[N+](=O)[O-] 9331429 WZPIBQDGINELBN-UHFFFAOYSA-N 497.939 5.425 5 20 JKBD C[C@@H](OC(=O)c1ccccc1COc1ccccc1)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 10852896 WMUNASOLAURTNB-OAHLLOKOSA-N 488.418 5.377 5 20 JKBD CN(C(=O)CSc1ncnc2scc(-c3ccc(F)cc3)c12)c1ccc([N+](=O)[O-])cc1 11392215 QKMBJFMPHSOGND-UHFFFAOYSA-N 454.508 5.161 5 20 JKBD C[C@H](Oc1ccc2c(-c3ccc([N+](=O)[O-])cc3)cc(=O)oc2c1)C(=O)Nc1cc(F)ccc1F 15370857 IJHXUPLFUPVNRB-ZDUSSCGKSA-N 466.396 5.052 5 20 JKBD COc1ccc(-c2cc(C(=O)O[C@@H](C)c3nnc(-c4ccc([N+](=O)[O-])cc4)o3)c3ccccc3n2)cc1 17529479 AENJGGRVZGADLA-INIZCTEOSA-N 496.479 5.787 5 20 JKBD C[C@H](Sc1nc(-c2ccccc2Br)n[nH]1)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 17669970 GJQQBHVWXNAFBJ-JTQLQIEISA-N 473.312 5.046 5 20 JKBD O=C(Nc1ccccc1C(=O)NCCCCOc1ccc(F)cc1)c1ccc([N+](=O)[O-])cc1Cl 25831126 BKYCZRHMTFFYOF-UHFFFAOYSA-N 485.899 5.229 5 20 JKBD CSc1ccc(C(=O)c2ccccc2C(=O)N(C)Cc2ccc(OC(F)F)cc2)cc1[N+](=O)[O-] 28415001 IXKODRAQYRWDEB-UHFFFAOYSA-N 486.496 5.421 5 20 JKBD O=C(Nc1ccc(Cl)c(C(=O)NC2CCCCC2)c1)c1ccc(N2CCCC2)c([N+](=O)[O-])c1 59827663 UIUFZAVODMKDPR-UHFFFAOYSA-N 470.957 5.163 5 20 JKBD O=C(N[C@@H](c1ccccc1)c1ccco1)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 105010332 AXIPAXSVRZIOGG-QFIPXVFZSA-N 473.451 5.329 5 20 JKBD O=C(COc1ccc(C(=O)Nc2ccc([N+](=O)[O-])cc2F)cc1)Nc1cccc(C(F)(F)F)c1 116710227 GACBJGRIDAZIMW-UHFFFAOYSA-N 477.370 5.023 5 20 JKBD Cc1sc2ncnc(Sc3ccccc3C(=O)NCCNc3ccc([N+](=O)[O-])cc3)c2c1C 252008478 QOEPJHCMHPRMDE-UHFFFAOYSA-N 479.587 5.209 5 20 JKBD Cc1csc(Sc2ccc(C(=O)Nc3ccccc3NC3CCN(C)CC3)cc2[N+](=O)[O-])n1 303200156 LRGYZHLRCWIRGO-UHFFFAOYSA-N 483.619 5.269 5 20 JKBD COc1cc(C(=O)NCc2ccc(-c3nc4ccccc4s3)o2)c([N+](=O)[O-])cc1OC(F)F 478567677 VABMNCKYHWKLHD-UHFFFAOYSA-N 475.429 5.005 5 20 JKBD Cc1ccc(-c2nnco2)cc1NC(=O)c1ccc(Sc2nc3ccccc3s2)c([N+](=O)[O-])c1 483297032 MQPHMHGLAWQOLI-UHFFFAOYSA-N 489.538 5.966 5 20 JKBD O=C(Nc1nc(-c2ccc(OC(F)F)cc2OC(F)F)cs1)c1ccccc1[N+](=O)[O-] 494018096 BZXHTBCHPCRUPF-UHFFFAOYSA-N 457.361 5.173 5 20 JKBD CC(C)c1nc(C(=O)N(Cc2ccccc2[N+](=O)[O-])CC(F)(F)F)nn1-c1ccccc1Cl 498359542 LIGNMBACNRRIRI-UHFFFAOYSA-N 481.862 5.157 5 20 JKBD O=C(N=c1cc[nH]cc1)c1cccc(NC(=O)c2cc([N+](=O)[O-])ccc2Sc2ccccc2)c1 505754497 JLCZRQUQXSYCSP-UHFFFAOYSA-N 470.510 5.068 5 20 JKBD C[C@H](Nc1ccc(C(=O)N[C@@H](c2ccc(Cl)cc2)c2nccn2C)cc1[N+](=O)[O-])c1ccccn1 506084491 ANEOINISEMKLPH-HJPURHCSSA-N 490.951 5.069 5 20 JKBD C[C@H](NC(=O)c1ccc(N[C@H](C)c2ccccn2)c([N+](=O)[O-])c1)c1ccc(OC(F)F)cc1 506847820 SVYPCACXKTWCMQ-LSDHHAIUSA-N 456.449 5.255 5 20 JKBD Cc1nc(-c2ccccc2)sc1[C@H](C)NC(=O)C1CCN(c2ccccc2[N+](=O)[O-])CC1 507535771 PZKOZSKLKCBZAE-INIZCTEOSA-N 450.564 5.121 5 20 JKBD CC(C)(C)c1ccc(C(=O)Nc2ccc(F)c(NS(=O)(=O)c3cccs3)c2)cc1[N+](=O)[O-] 511967279 JSIVUQVYYSTQKF-UHFFFAOYSA-N 477.539 5.146 5 20 JKBD O=C(c1ccc(Sc2nc3ccccc3s2)c([N+](=O)[O-])c1)N(CC(F)(F)F)C1CC1 512858632 YAKNWHWASYQAAB-UHFFFAOYSA-N 453.467 5.523 5 20 JKBD COc1cc(/C=C2\CCn3c2nc2ccc([N+](=O)[O-])cc2c3=O)ccc1OCc1ccc(Cl)cc1 514645854 NDWMZTRJMQCZLP-LDADJPATSA-N 489.915 5.490 5 20 JKBD COc1ccc([C@H](CNC(=O)N[C@H](C)c2cccc([N+](=O)[O-])c2)c2c[nH]c3ccccc23)cc1 515840019 DNAYMKWFKDPTHC-HXOBKFHXSA-N 458.518 5.277 5 20 JKBD CN(C)C1(CNC(=O)C/C(=C\c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)CCCC1 517092458 ZZMZXCSGUIEALR-XDJHFCHBSA-N 464.591 5.126 5 20 JKBD O=C(Cc1ccccc1)Nc1cc(NC(=O)c2ccc(NCc3ccccc3)c([N+](=O)[O-])c2)ccc1F 517420116 CZOILPLWXIDVBH-UHFFFAOYSA-N 498.514 5.780 5 20 JKBD CC(C)CCOC1CCN([C@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2ccccc2)CC1 520787398 GEFADHGFBJTCEJ-QHCPKHFHSA-N 459.974 5.455 5 20 JKBD O=C(C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)NCc1cccc2cccnc12 521740768 GUPYKZHFICTZHZ-QNGOZBTKSA-N 480.549 6.000 5 20 JKBD Cc1cc(Br)ccc1NC(=O)CCNC(=O)c1cc2ccccc2c2cccnc12 523186467 HJWWPBBOEMYSHQ-UHFFFAOYSA-N 462.347 5.218 5 20 JKBD COc1cc(C(=O)N2CC=C(c3ccc(O)cc3)CC2)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 524470594 MCVRVSAUQPDWQC-UHFFFAOYSA-N 480.904 5.684 5 20 JKBD COc1ccc(F)cc1-c1csc(NC(=O)c2cc(OCC(F)(F)F)ccc2[N+](=O)[O-])n1 603758569 PVXRRWJVOLJNMV-UHFFFAOYSA-N 471.388 5.059 5 20 JKBD C[C@H]1C[C@H](C)CN(c2ccc(C(=O)N3CCC(C(=O)c4cc(F)ccc4F)CC3)cc2[N+](=O)[O-])C1 603905533 HUKZIGQIEFMMOQ-IRXDYDNUSA-N 485.531 5.090 5 20 JKBD CC(C)N(Cc1nnc(-c2ccccc2Cl)o1)C(=O)[C@@H](C)Oc1ccc(Cl)cc1[N+](=O)[O-] 604445704 FDDZLIRHLRIKIN-CYBMUJFWSA-N 479.320 5.156 5 20 JKBD Cc1nn(C(F)F)c(C)c1CC(=O)Nc1cc([N+](=O)[O-])ccc1Nc1cccc(C(F)(F)F)c1 604453195 JQFGXIWJLLZEHA-UHFFFAOYSA-N 483.397 5.747 5 20 JKBD CCOc1ccc([C@H](CNC(=O)c2c[nH]c3ccc([N+](=O)[O-])cc23)c2c[nH]c3ccccc23)cc1OC 604545820 PTEPVIXCBCDHDW-NRFANRHFSA-N 498.539 5.527 5 20 JKBD Cc1ccc(C(=O)Nc2nc3ccc(NC(=O)c4cc([N+](=O)[O-])ccc4C)cc3s2)s1 608818064 XTULDNJEBJRIOL-UHFFFAOYSA-N 452.517 5.387 5 20 JKBD C[C@H](Nc1ccc(C(=O)N2CCC(c3nc(-c4ccccc4)no3)CC2)cc1[N+](=O)[O-])c1ccccn1 609141704 GWWNHVDSBSNJCV-SFHVURJKSA-N 498.543 5.233 5 20 JKBD COC1CCN(c2ccc(NC(=O)CCCNc3ccc([N+](=O)[O-])cc3)cc2C(F)(F)F)CC1 728038156 CMAVACXSJRJEDZ-UHFFFAOYSA-N 480.487 5.060 5 20 JKBD CC(=O)N(c1cccc(C(F)(F)F)c1)c1nc(COC(=O)c2cc([N+](=O)[O-])ccc2C)cs1 743000792 YORWCWYRFREKRT-UHFFFAOYSA-N 479.436 5.420 5 20 JKBD Cc1ccc([N+](=O)[O-])cc1NC(=O)COC(=O)c1csc(-c2ccc(Cl)c(Cl)c2)n1 744597568 WYGCNRJZANEVLS-UHFFFAOYSA-N 466.302 5.129 5 20 JKBD Cc1nc2ccccc2c(-c2ccccc2)c1CC(=O)O[C@@H](C)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 746042906 MEPWLQPTVVVICR-SFHVURJKSA-N 494.507 6.015 5 20 JKBD C[C@H](OC(=O)c1cc([N+](=O)[O-])ccc1N1CCCCC1)C(=O)Nc1ccccc1-c1ccccc1 823247775 KCJXCGPWFDBABI-IBGZPJMESA-N 473.529 5.436 5 20 JKBD C[C@@H](CNC(=O)c1ccccc1NC(=O)c1ccc([N+](=O)[O-])cc1Cl)c1ccc(F)cc1 920043468 QMVSLUXXWYVQTL-AWEZNQCLSA-N 455.873 5.173 5 20 JKBD Cc1cc2oc(=O)cc(COC(=O)c3ccc(N[C@H](C)c4ccccn4)c([N+](=O)[O-])c3)c2cc1C 920543705 IAVCUFPFMYSKNW-QGZVFWFLSA-N 473.485 5.243 5 20 JKBD O=C(CCc1cccc([N+](=O)[O-])c1)Nc1ccc(C2(NC(=O)c3ccc(Cl)cn3)CCC2)cc1 1786602796 RZYJKSVEMABHET-UHFFFAOYSA-N 478.936 5.024 5 20 JKBD Cc1cc(C(=O)Nc2ccc(C3(NC(=O)c4cc(Cl)cc([N+](=O)[O-])c4C)CCC3)cc2)cc(O)n1 1788596624 ZPCHUWBFVPGANI-UHFFFAOYSA-N 494.935 5.027 5 20 JKBD Cc1cccc2cc(C(=O)Nc3ccc(C4(NC(=O)c5cc(O)cc([N+](=O)[O-])c5)CCC4)cc3)[nH]c12 1789255350 ZEDUTYZCCSLKAK-UHFFFAOYSA-N 484.512 5.152 5 20 JKBD CC(C)=CCCC(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cc(Cl)cc([N+](=O)[O-])c2C)CC1 1830257731 VGWGBLRVLRFLRV-QFIPXVFZSA-N 476.017 5.536 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cc3ccsc3[nH]2)CC1 1830890221 LQSOCPKHLSNJSB-NRFANRHFSA-N 498.580 5.132 5 20 JKBD C[C@@H](Sc1nnc(-c2ccc(C(C)(C)C)cc2)n1C)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 9463119 AAOJQYWQMKDIFG-CQSZACIVSA-N 464.551 5.591 5 20 JKBD CC[C@@H]1CCc2sc(-c3nnc(SCc4cc([N+](=O)[O-])cc5c4OCOC5)n3C)cc2C1 10440115 RTMLAYOBQQJPHB-CYBMUJFWSA-N 472.592 5.126 5 20 JKBD Cc1c(-c2ccccc2)sc(NC(=O)c2ccc(Cl)c([N+](=O)[O-])c2)c1C(=O)N1CCOCC1 14389699 ZEIGSNSRXMVSLR-UHFFFAOYSA-N 485.949 5.010 5 20 JKBD Cc1nc(-c2ccc(Cl)cc2)sc1C(=O)O[C@H](C)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 16698590 HULNXEYVAWQAFS-GFCCVEGCSA-N 470.894 5.648 5 20 JKBD Cc1ccc(NC(=O)[C@@H](OC(=O)c2csc(-c3cccs3)n2)c2ccccc2)c([N+](=O)[O-])c1 19259262 CFTZTCNWQIGWFF-FQEVSTJZSA-N 479.539 5.625 5 20 JKBD O=C(O)c1ccc2c(=O)n3c(nc2c1)/C(=C/c1ccc(Oc2ccccc2Cl)c([N+](=O)[O-])c1)CC3 20987674 IZKGACPFYKPFQB-RVDMUPIBSA-N 489.871 5.393 5 20 JKBD COc1ccccc1-n1c(S[C@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2)nnc1-c1cccs1 23545694 DMQOMXCLUXNNMF-CQSZACIVSA-N 481.559 5.032 5 20 JKBD C[C@@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccc(Br)cc1Br 24048920 FEFIICKNZWHLHZ-SECBINFHSA-N 460.147 5.239 5 20 JKBD Cc1nn(Cc2ccc(C(=O)N(Cc3cccs3)Cc3cccs3)cc2)c(C)c1[N+](=O)[O-] 24466149 JJXFHAZMXDXBGX-UHFFFAOYSA-N 466.588 5.422 5 20 JKBD CCOCc1ccccc1CN[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1 26996470 COUJAIJEFYUWLB-QHCPKHFHSA-N 453.926 5.254 5 20 JKBD Cc1ccc(NC(=O)COC(=O)c2cc([N+](=O)[O-])ccc2Sc2nc(C)cs2)c(Cl)c1 28832353 VJXQYAUHFOIFCK-UHFFFAOYSA-N 477.951 5.268 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Cl)[C@H](NCc1csc(Br)c1)c1ccccc1 30515484 QGRTWSKJUBSDBY-GOSISDBHSA-N 480.771 5.542 5 20 JKBD Cc1cccc([N+](=O)[O-])c1NC(=O)CSc1nnc(-c2ccccc2)c(-c2ccccc2)n1 36795898 LFKQVIIYNOLTIM-UHFFFAOYSA-N 457.515 5.153 5 20 JKBD Cc1ccc(NC(=O)[C@H](OC(=O)/C=C\c2ccc3ccccc3n2)c2ccccc2)c([N+](=O)[O-])c1 207427920 VOFNZMIERVJRSK-ZUWLDVSESA-N 467.481 5.388 5 20 JKBD C[C@@H](Nc1ccc(C(=O)N2CCC[C@H]2c2ccccc2Cl)cc1[N+](=O)[O-])c1ccccn1 410083524 AWFYVNVXIYFZGX-ZHRRBRCNSA-N 450.926 5.794 5 20 JKBD COc1cc(C(=O)N[C@@H](c2ccccc2)c2cccnc2)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 485508493 FAOYNPDZQQMHDU-VWLOTQADSA-N 489.915 5.964 5 20 JKBD CC[C@H](C)Sc1ccc(NC(=O)c2ccc(Cn3nc(C)c([N+](=O)[O-])c3C)cc2)c(C)c1 498475079 DICKPJYYJMIZFM-INIZCTEOSA-N 452.580 5.908 5 20 JKBD Cc1ccc(Sc2ccc(C(=O)N(C)C3CCN(CCc4ccccn4)CC3)cc2[N+](=O)[O-])cc1 500748850 JOYFGQFZPVPZTC-UHFFFAOYSA-N 490.629 5.229 5 20 JKBD O=[N+]([O-])c1ccc(CN[C@H](c2ccc(F)cc2)c2ccccc2I)cc1 504245487 WDQQXXHHXKQAJZ-HXUWFJFHSA-N 462.262 5.218 5 20 JKBD C[C@H](Nc1ccc(C(=O)Nc2nnc(CC3CCCCC3)s2)cc1[N+](=O)[O-])c1ccccn1 504567164 ZGXIPFNMDQBOAW-HNNXBMFYSA-N 466.567 5.390 5 20 JKBD CCOC(=O)c1c(NC(=O)c2cc(OC)c(OCC)cc2[N+](=O)[O-])sc(-c2ccccc2)c1C 506832722 NUCCDLGWNSVGJB-UHFFFAOYSA-N 484.530 5.468 5 20 JKBD C[C@@H](Cc1ccc(Br)cc1)NC(=O)c1ccc(N[C@@H](C)c2ccccn2)c([N+](=O)[O-])c1 508840928 FXHWYJDLSFYJGM-HOTGVXAUSA-N 483.366 5.286 5 20 JKBD CCOc1cc(Br)c(NC(=O)N(Cc2ccc([N+](=O)[O-])cc2)C(C)C)cc1OCC 509210758 LKOLWTFDIVBXNN-UHFFFAOYSA-N 480.359 5.597 5 20 JKBD CCOc1cc(CN[C@H]2CCCc3occc32)ccc1OCc1cc([N+](=O)[O-])cc2c1OCOC2 509618913 NSXHMRYICXPXNR-QFIPXVFZSA-N 480.517 5.199 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Cl)[C@H](NCC1(c2ccc(F)cc2)CCOCC1)c1ccccc1 513197966 ZWZSAPNEQDOECC-XMMPIXPASA-N 497.954 5.405 5 20 JKBD COc1cccc(CNC(=O)c2ccccc2Sc2ccc(C(F)(F)F)cc2[N+](=O)[O-])c1OC 514749205 LAKAJXQTZLCVSF-UHFFFAOYSA-N 492.475 5.712 5 20 JKBD C[C@H](SCc1nc(O)c2c(-c3ccccc3)csc2n1)C(=O)N[C@H](C)c1cccc([N+](=O)[O-])c1 515681837 YKOKOXVTCIFTJJ-CABCVRRESA-N 494.598 5.471 5 20 JKBD CC[C@@H](NCc1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1)c1nnc2n1CCCCC2 518783637 QGUZFTOINGTOBC-HSZRJFAPSA-N 471.565 5.006 5 20 JKBD CC(C)OCCOCc1cccc(NC(=O)c2ccc(N3CCC[C@@H](C)C3)c([N+](=O)[O-])c2)c1 520099785 QIXATSRUAJCNPC-LJQANCHMSA-N 455.555 5.025 5 20 JKBD COc1ccc(-c2ccc(CN[C@@H](C)c3ccc(OCc4cccnc4)cc3)o2)c([N+](=O)[O-])c1 521815996 HPYUCFIDVCEQFD-SFHVURJKSA-N 459.502 5.688 5 20 JKBD O=C(Nc1ccc(N2CCNC2=O)cc1)c1ccc(Sc2nc3ccccc3s2)c([N+](=O)[O-])c1 589737688 VATBPMPUJMTDJI-UHFFFAOYSA-N 491.554 5.138 5 20 JKBD O=C(c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-])N1CCC[C@@H](c2nc3ccccc3s2)C1 603777283 MWOXAJNLLQKMEP-CYBMUJFWSA-N 465.453 5.165 5 20 JKBD COc1cc(C(=O)Nc2n[nH]c(C(F)(F)F)c2C)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 604498235 RKGKLOUIOCDVLV-UHFFFAOYSA-N 470.791 5.352 5 20 JKBD COC(=O)c1ccc2c(O)nc(/C=C\c3ccc(-c4ccc([N+](=O)[O-])cc4Cl)o3)nc2c1 608800939 CMWUMMVQSRIGKT-UITAMQMPSA-N 451.822 5.114 5 20 JKBD CN(C)CCCOc1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2Sc2ccccc2)cc1 609330952 IZQHBHAFODMZSM-UHFFFAOYSA-N 451.548 5.329 5 20 JKBD CC1CCN(c2ccc(C(=O)Nc3ccccc3CS(=O)(=O)c3ccccc3)cc2[N+](=O)[O-])CC1 609375708 QMHUILSGUAXZLJ-UHFFFAOYSA-N 493.585 5.057 5 20 JKBD CCC(CC)c1cc[n+](/C(C(=S)N[C@H](C)c2cccs2)=C(/O)c2cccc([N+](=O)[O-])c2)cc1 726581599 VXGDAXYAVFTMFA-QGZVFWFLSA-O 482.651 6.409 5 20 JKBD O=C(Nc1cccc(CC[C@H](O)c2ccccc2)c1)C1CCN(c2ccccc2[N+](=O)[O-])CC1 727760388 ITYUXWYGIGCXKF-SANMLTNESA-N 459.546 5.116 5 20 JKBD CCN(Cc1ccc(OCc2cccs2)c(OC)c1)C(=O)c1cc(F)c(F)cc1[N+](=O)[O-] 728805096 PVDJRNOIJRDMBV-UHFFFAOYSA-N 462.474 5.184 5 20 JKBD C[C@H](OC(=O)c1ccccc1C(=O)c1ccc(Cl)c([N+](=O)[O-])c1)c1nnc(-c2ccc(F)cc2)o1 745907330 JYMCAVJCZPZHJJ-ZDUSSCGKSA-N 495.850 5.586 5 20 JKBD COc1cccc(NC(=O)[C@@H](OC(=O)c2csc(-c3ccc([N+](=O)[O-])cc3)n2)c2ccccc2)c1 747956515 UIKNRUVGTQRVAV-QFIPXVFZSA-N 489.509 5.264 5 20 JKBD CC(C)c1ccc(-c2nc(C(=O)OCc3nc(-c4cccc([N+](=O)[O-])c4)no3)cs2)cc1 914802494 VKUZHNCEEUIGAQ-UHFFFAOYSA-N 450.476 5.249 5 20 JKBD CC(C)[C@@H](OC(=O)[C@H](C)Sc1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccccc1C(F)(F)F 915371056 MWFJLRNJWDSPTC-SCLBCKFNSA-N 470.469 5.301 5 20 JKBD COc1ccccc1NC(=O)c1cc2ccccc2cc1OS(=O)(=O)c1c(C)cccc1[N+](=O)[O-] 917863939 XAEVNSPRDPWZCP-UHFFFAOYSA-N 492.509 5.085 5 20 JKBD Cc1cc(C)n(-c2cccc(NC(=O)c3ccccc3NC(=O)c3ccc([N+](=O)[O-])cc3Cl)c2)n1 918131621 MYHRXLZHSGPFTI-UHFFFAOYSA-N 489.919 5.555 5 20 JKBD Cc1nccn1-c1ncccc1NC(=O)C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1 919984571 NVLDACPKRGTEFS-CYVLTUHYSA-N 496.552 5.663 5 20 JKBD COc1ccc(SCC(=O)O[C@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2ccccc2)cc1 921175137 OKKIPAUIVCBGMT-QFIPXVFZSA-N 486.933 5.272 5 20 JKBD CC(C)N(Cc1nnc(-c2cccc([N+](=O)[O-])c2)o1)C(=O)CCc1ccc(C(C)(C)C)cc1 921194863 GHFFIWGTXIAUQD-UHFFFAOYSA-N 450.539 5.312 5 20 JKBD COc1ccc([N+](=O)[O-])cc1NC(=O)[C@H](C)OC(=O)c1csc(-c2ccc(Cl)cc2Cl)n1 921224848 SVASXYVITUIVIR-JTQLQIEISA-N 496.328 5.218 5 20 JKBD C[C@@H]1C[C@@H](C)CN(c2ccc(C(=O)O[C@H](C)c3nnc(-c4ccccc4)o3)cc2[N+](=O)[O-])C1 921249397 FDINDSBFWRDNRB-BRWVUGGUSA-N 450.495 5.045 5 20 JKBD Cc1cc(C(=O)Nc2ccc(C3(NC(=O)Cn4ccc5ccc([N+](=O)[O-])cc54)CCC3)cc2)cnc1C 1787007231 HQYDPGKDLOINCV-UHFFFAOYSA-N 497.555 5.009 5 20 JKBD C[C@H](Sc1cccs1)C(=O)Nc1ccc(C2(NC(=O)c3cc(O)cc([N+](=O)[O-])c3)CCC2)cc1 1789415691 DYVJWXBASMJONU-HNNXBMFYSA-N 497.598 5.290 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)c3cc(O)cc([N+](=O)[O-])c3)CCC2)cc1)c1cccc(-c2cnco2)c1 1790710824 SSOZFOJFCLKSDZ-UHFFFAOYSA-N 498.495 5.017 5 20 JKBD O=C(Cc1ccc([N+](=O)[O-])cc1F)NC1(c2ccc(NC(=O)[C@]3(F)CCCC=C3F)cc2)CCC1 1792377405 CVJCILVVHAJVIY-VWLOTQADSA-N 487.478 5.156 5 20 JKBD Cc1cc(CCCC(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2ccccc2C2CC2)C3)c([N+](=O)[O-])cc1F 1793405262 KMECWHGDDSMYRW-KOUNCHBCSA-N 493.579 5.194 5 20 JKBD CC(C)(C)CCCCCC(=O)N1CCCC[C@H]1c1cc(NC(=O)c2ccc([N+](=O)[O-])o2)n[nH]1 1814311227 BKZRLSFCGJHXQE-KRWDZBQOSA-N 459.547 5.213 5 20 JKBD Cc1c(Cl)cccc1C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cccc(F)c2[N+](=O)[O-])[nH]n1 1814599378 HBXAQDVEMCWYDD-IBGZPJMESA-N 485.903 5.039 5 20 JKBD CC(C)(C)CC(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2ccc(Br)c([N+](=O)[O-])c2)CC1 1826338112 NWICBVQFKLMJFG-LJQANCHMSA-N 494.430 5.027 5 20 JKBD O=C(/C=C/c1ccccc1[N+](=O)[O-])N1CCC([C@H]2CCCCN2C(=O)c2cc3[nH]ccc3s2)CC1 1828336572 HACFSQFLCHISID-MHNQQFQPSA-N 492.601 5.084 5 20 JKBD O=C(c1cc2ccccc2o1)N1CCC([C@@H]2CCCCN2C(=O)c2cccc(F)c2[N+](=O)[O-])CC1 1830622177 SPYNAQSXULYUAY-NRFANRHFSA-N 479.508 5.027 5 20 JKBD Cc1ccc(-c2cc(C(=O)O[C@H](C)C(=O)Nc3ccc([N+](=O)[O-])cc3Cl)c3c(C)noc3n2)cc1 12177195 NXCOLAAVCUBFST-CQSZACIVSA-N 494.891 5.252 5 20 JKBD CCCn1c(S[C@@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)nc2cc(Cl)ccc2c1=O 17723477 BWAFHMLJTNOHFJ-LBPRGKRZSA-N 471.926 5.271 5 20 JKBD COc1cc(C(=O)NC[C@H](c2cccs2)N(C)C)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 17796068 JTWHITLLUNDINO-QGZVFWFLSA-N 475.954 5.143 5 20 JKBD CC(C)(C)c1ccc(C(=O)OCc2nnc(-c3ccc(Br)s3)o2)cc1[N+](=O)[O-] 19193240 BDGQZWRKDDUSLB-UHFFFAOYSA-N 466.313 5.123 5 20 JKBD C[C@H](Sc1nnc(-c2ccncc2)n1-c1ccccc1)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl 20860357 AOFNEAGYAOMWGE-AWEZNQCLSA-N 480.937 5.010 5 20 JKBD C[C@@H](OC(=O)c1ccc(Br)c([N+](=O)[O-])c1)C(=O)Nc1ccccc1Oc1ccccc1 22184109 KRTFTALCQNASHM-CQSZACIVSA-N 485.290 5.334 5 20 JKBD O=C(C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)N1CCc2ccccc2C1 29504125 ITGYOKMNURVCBU-QNGOZBTKSA-N 455.539 5.720 5 20 JKBD O=C(COc1ccc([N+](=O)[O-])cc1C(F)(F)F)N1N=C(c2ccco2)C[C@@H]1c1cccs1 72033598 ROISQFACJSWNMM-OAHLLOKOSA-N 465.409 5.025 5 20 JKBD C[C@@H](Nc1ccc(C(=O)N2CCC[C@@H]2c2nc3ccccc3s2)cc1[N+](=O)[O-])c1ccccn1 108753507 JAHUBARREMWZRF-IIBYNOLFSA-N 473.558 5.750 5 20 JKBD CCCN(CCc1ccccn1)C(=O)c1ccc(NCc2ccccc2Cl)c([N+](=O)[O-])c1 303027768 NGKYROOSVDNXTG-UHFFFAOYSA-N 452.942 5.350 5 20 JKBD Cc1csc(Sc2ccc(C(=O)N3CCCCC[C@H]3c3ccncc3)cc2[N+](=O)[O-])n1 479276828 QYTWKIFRMPMBQC-SFHVURJKSA-N 454.577 5.663 5 20 JKBD COc1cc([C@@H](C)NC(=O)c2ccc(N[C@@H](C)c3ccccn3)c([N+](=O)[O-])c2)ccc1OC(C)C 506249146 RJOYMHOVZMDDND-MSOLQXFVSA-N 478.549 5.450 5 20 JKBD CCOc1ccc(NC(=O)c2cc(OC)c(OCc3cscn3)cc2[N+](=O)[O-])c(C(F)(F)F)c1 513271615 FGRDOUKYCCTRAZ-UHFFFAOYSA-N 497.451 5.309 5 20 JKBD O=C(Nc1cc([N+](=O)[O-])ccc1OC(F)F)N1CCC(c2nc3cc(Cl)ccc3o2)CC1 513989754 OEXUFWYUJDGPJS-UHFFFAOYSA-N 466.828 5.402 5 20 JKBD CCc1ccc(OCc2nnc(Sc3ncccc3[N+](=O)[O-])n2[C@H](C)c2ccccc2)cc1 514652857 KTVRVEGZOBWXED-QGZVFWFLSA-N 461.547 5.483 5 20 JKBD O=[N+]([O-])c1ccc(-c2ccc(CNC[C@@H]3CCN(c4ccccc4)C3)o2)c(Br)c1 517538847 MRPLEEMLFFFGAU-INIZCTEOSA-N 456.340 5.233 5 20 JKBD COc1ccc(CNCc2cn(-c3ccccc3)nc2-c2ccc([N+](=O)[O-])cc2)cc1OC(F)F 521821434 SHIUIELMHIIIRF-UHFFFAOYSA-N 480.471 5.347 5 20 JKBD C[C@@H](Nc1ccc(C(=O)Nc2ccnn2[C@H]2CCCc3ccccc32)cc1[N+](=O)[O-])c1ccccn1 522247199 KJQXEYQHGVKYGZ-KOSHJBKYSA-N 482.544 5.537 5 20 JKBD O=C(Nc1ccc(-c2n[nH]c(C3CC3)n2)cc1)c1ccc(NCc2ccccc2)c([N+](=O)[O-])c1 523858069 BVXDAZJCEALRQU-UHFFFAOYSA-N 454.490 5.122 5 20 JKBD O=C(Nc1ccc(NC(=O)c2cnn(-c3ccc([N+](=O)[O-])cc3)c2)c(C(F)(F)F)c1)c1ccccc1 603743155 VFYADBIPCJSWJO-UHFFFAOYSA-N 495.417 5.304 5 20 JKBD Cc1nc2ccc([N+](=O)[O-])cc2c(-c2ccccc2)c1C(=O)Nc1ccccc1C(F)(F)F 603804298 YZNVSBSFPNLXCZ-UHFFFAOYSA-N 451.404 6.390 5 20 JKBD Cc1cc(C)cc(Oc2ccc(NC(=O)N3CCN(C(=O)c4ccc([N+](=O)[O-])s4)CC3)cc2)c1 604087473 LPAIZKPFFKHPEY-UHFFFAOYSA-N 480.546 5.055 5 20 JKBD CC[C@H](C(=O)N1CCC(NCc2ccc(-c3ccccc3[N+](=O)[O-])s2)CC1)c1ccccc1 608836877 NDTBMNVTTNZRQB-QFIPXVFZSA-N 463.603 5.598 5 20 JKBD C[C@@H](Nc1ccc(C(=O)Nc2cccc(-c3ccc4c(c3)OCCO4)n2)cc1[N+](=O)[O-])c1ccccn1 609382094 JLHBGHRXFQCEGT-QGZVFWFLSA-N 497.511 5.248 5 20 JKBD COc1ccc(C[C@H](NCc2c(Br)cccc2[N+](=O)[O-])c2ccc(OC)cc2)cc1 725841895 QMEBOJRZYVFUCG-QFIPXVFZSA-N 471.351 5.448 5 20 JKBD O=C(CCC(=O)c1ccc2ccc3cccc4ccc1c2c34)NCc1ccnc(-n2cccn2)c1 727755168 QHOCJLWZYYYRCP-UHFFFAOYSA-N 458.521 5.444 5 20 JKBD CN(C[C@@H]1CCN(C(=O)c2cc([N+](=O)[O-])ccc2Sc2ccccc2)C1)C(=O)OC(C)(C)C 729392196 HZMKXIBSZWDOAH-KRWDZBQOSA-N 471.579 5.075 5 20 JKBD Cc1c(NC(=O)[C@@H](C)OC(=O)c2csc(-c3ccc(Cl)c(Cl)c3)n2)cccc1[N+](=O)[O-] 744604400 FLCAIKUFTUEJBA-LLVKDONJSA-N 480.329 5.518 5 20 JKBD O=C(C[C@H](NC(=O)c1ccccc1Cl)c1ccccc1)Nc1cc([N+](=O)[O-])c(F)cc1F 825487634 HNAPSXBEJOGSDH-SFHVURJKSA-N 459.836 5.026 5 20 JKBD O=C(c1ccc([N+](=O)[O-])s1)N1CCC[C@H]1c1nc(-c2ccccc2OCc2ccccc2)no1 904465296 JCPHLFCLGXBEAJ-SFHVURJKSA-N 476.514 5.263 5 20 JKBD O=[N+]([O-])c1cc(-c2nc(-c3cccc(Cn4cnc5ccccc54)c3)no2)ccc1OC(F)F 904492701 OONKMKIBBDPCRG-UHFFFAOYSA-N 463.400 5.311 5 20 JKBD COc1cc(NC(=O)c2ccc(Cn3nc(C)c([N+](=O)[O-])c3C)cc2)ccc1NC(=O)OC(C)(C)C 916431637 IZUVAYDQPDXOKU-UHFFFAOYSA-N 495.536 5.064 5 20 JKBD CCOC(=O)c1c(-c2ccc(C)cc2C)csc1NC(=O)c1cc2c(cc1[N+](=O)[O-])OCO2 917513068 XOJJPETZQDEDKN-UHFFFAOYSA-N 468.487 5.098 5 20 JKBD CC(C)Oc1ccc(N[C@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Br)c2ccccc2)cc1 917935396 FSTHCRNLNHISAQ-QFIPXVFZSA-N 484.350 5.936 5 20 JKBD CCOc1cc(NC(=O)c2ccc3c(c2)C[C@@H](c2ccccc2)OC3=O)c([N+](=O)[O-])cc1OCC 918558501 OHYIJLBWUYPBSV-QFIPXVFZSA-N 476.485 5.099 5 20 JKBD C[C@H](Nc1ccc(C(=O)Oc2ccc(NC(=O)c3ccccc3)cc2)cc1[N+](=O)[O-])c1ccccn1 919678965 IKHZKVPZJVQDBD-SFHVURJKSA-N 482.496 5.634 5 20 JKBD O=C(/C=C/c1ccc([N+](=O)[O-])o1)NC1(c2ccc(NC(=O)Cc3ccc4ncccc4c3)cc2)CCC1 1786556991 PIQYALWKRJXIHA-FMIVXFBMSA-N 496.523 5.126 5 20 JKBD CCn1nc(C(C)C)cc1C(=O)Nc1ccc(C2(NC(=O)c3cccc(F)c3[N+](=O)[O-])CCC2)cc1 1790179687 FUGGGDHBSNZUFO-UHFFFAOYSA-N 493.539 5.135 5 20 JKBD O=C(Cc1ccc2ccccc2c1)NC1(c2ccc(NC(=O)c3ccc([N+](=O)[O-])[nH]3)cc2)CCC1 1790184318 DXWJZHNXDNMDKZ-UHFFFAOYSA-N 468.513 5.067 5 20 JKBD CC[C@@H](C)[C@H](C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)/C=C/c1ccccc1[N+](=O)[O-])C2)c1ccccc1 1795575205 UOMNVJARSAUSCR-QRFUWWTNSA-N 475.589 5.076 5 20 JKBD CC(C)(C)CC(=O)N1CCCC2(CCN(C(=O)c3cc4cc([N+](=O)[O-])ccc4s3)CC2)C1 1809041824 BMOOEHICZAEAIF-UHFFFAOYSA-N 457.596 5.091 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2ccc(Cl)s2)n[nH]1 1816399406 VZGNCJUDXCJXBH-HNNXBMFYSA-N 491.932 5.100 5 20 JKBD O=C(c1cc2ccsc2[nH]1)N1CCC([C@@H]2CCCCN2C(=O)CCc2cccc([N+](=O)[O-])c2)CC1 1824843111 OICYTUMGXZLLHB-QHCPKHFHSA-N 494.617 5.004 5 20 JKBD Cc1cccc(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)Cc3ccc(Cl)cc3[N+](=O)[O-])CC2)c1 1829997703 RCEHZDWHMNBQOV-HSZRJFAPSA-N 483.996 5.033 5 20 JKBD O=C(C1CCC(c2ccc(Cl)cc2)CC1)N1CC2(CCCN2C(=O)c2ccc([N+](=O)[O-])cc2F)C1 1845314035 QUYOWSPVLBWRLP-UHFFFAOYSA-N 499.970 5.178 5 20 JKBD CCOc1cc(/C=C(/C(=O)OCC(=O)Nc2ccc(Cl)cc2[N+](=O)[O-])c2ccccc2)ccc1O 10911203 ZKFYOJNHFXCPFM-XDHOZWIPSA-N 496.903 5.075 5 20 JKBD COc1ccc(C(=O)C2CCN(C(=O)c3ccc(SCCC(C)C)c([N+](=O)[O-])c3)CC2)cc1 12739660 XMWYWXBHZTXYTK-UHFFFAOYSA-N 470.591 5.477 5 20 JKBD COc1cc2c(cc1OC)[C@H](c1ccccc1)N(C(=O)c1ccc([N+](=O)[O-])cc1Cl)CC2 16002268 UQKYHKXSCADEAM-QHCPKHFHSA-N 452.894 5.053 5 20 JKBD O=C(C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)Nc1ccc2c(c1)OCO2 16018648 OCPPXJHWKPBJQK-WJDWOHSUSA-N 459.483 5.503 5 20 JKBD Cc1nc(-c2cccc(Cl)c2)sc1C(=O)OCC(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 17955968 HMODNXGNMPNMAQ-UHFFFAOYSA-N 499.854 5.494 5 20 JKBD C[C@H](OC(=O)c1ccc(NCc2ccccc2)c([N+](=O)[O-])c1)C(=O)Nc1ccccc1Br 23767986 POZVXCNGYNMBBN-HNNXBMFYSA-N 498.333 5.153 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Br)[C@H](NCc1cc(F)cc(F)c1)c1ccccc1 26996356 LECKFSXJAQXUMK-HXUWFJFHSA-N 476.277 5.105 5 20 JKBD Cc1cccc([N+](=O)[O-])c1NC(=O)COC(=O)c1cc2c(C)nn(Cc3ccc(Cl)cc3)c2s1 28797540 IKKQHQHIYNYLPN-UHFFFAOYSA-N 498.948 5.120 5 20 JKBD C[C@@H](Nc1ccc(C(=O)Nc2ncc(Cc3ccccc3)s2)cc1[N+](=O)[O-])c1ccccn1 115701043 CADMUCTWZAMBIZ-MRXNPFEDSA-N 459.531 5.463 5 20 JKBD O=C(NCc1ccncc1)Nc1cccc(NC(=O)c2ccc(Nc3ccccc3)c([N+](=O)[O-])c2)c1 116751883 XLLNPQOONXSNBI-UHFFFAOYSA-N 482.500 5.307 5 20 JKBD Cc1cccc([N+](=O)[O-])c1NC(=O)CSC1=N/C(=C/c2ccccc2)C(=O)N1c1ccc(F)cc1 207430108 SXYCJTZVMPWGCE-XSFVSMFZSA-N 490.516 5.158 5 20 JKBD O=C(c1csc(-c2ccc([N+](=O)[O-])cc2)n1)N(Cc1cccc(Br)c1)C1CC1 303021104 LUJJZOKJUUDFJJ-UHFFFAOYSA-N 458.337 5.286 5 20 JKBD COc1cccc(/C=C(/CC(=O)Nc2cc([N+](=O)[O-])ccc2OC)c2nc3ccccc3s2)c1 480983121 PXDPYTMQBCVTEF-ATVHPVEESA-N 475.526 5.791 5 20 JKBD Cc1csc(Sc2ccc(C(=O)Nc3ccc4c(c3)CCCC(=O)N4)cc2[N+](=O)[O-])n1 483852266 IFFMHPOSXIHGEB-UHFFFAOYSA-N 454.533 5.038 5 20 JKBD C[C@@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccc(Cl)c(C(=O)NCc2ccccc2F)c1 484220738 NYHZSKVGJMCFJV-CQSZACIVSA-N 487.940 5.437 5 20 JKBD CC(C)Cn1nccc1NC(=O)C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1 486425107 HXRFKDGUFSXNLM-AQTBWJFISA-N 461.547 5.626 5 20 JKBD O=C(NCCCOc1ccc(Cl)cc1Cl)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-] 498867016 SKPSPBZYUJCOCR-UHFFFAOYSA-N 467.227 5.042 5 20 JKBD CCOc1cc([N+](=O)[O-])c(C(=O)N(Cc2ccc(Cl)c(Cl)c2)Cc2ccccn2)cc1OC 499621582 SYZKKCMGULXEDG-UHFFFAOYSA-N 490.343 5.547 5 20 JKBD COc1cc2c(cc1OC)[C@H](c1cccs1)N(C(=O)CCCNc1ccc([N+](=O)[O-])cc1)CC2 502868169 RDOYLWNHRCDTEU-RUZDIDTESA-N 481.574 5.040 5 20 JKBD C[C@@H](Nc1ccc(C(=O)NCc2ccc(Oc3ccc(F)cc3)nc2)cc1[N+](=O)[O-])c1ccccn1 507402412 KYNWPQOGZYUTTC-QGZVFWFLSA-N 487.491 5.419 5 20 JKBD Cc1csc(Sc2ccc(NC(=O)CCCn3c(=O)oc4cc([N+](=O)[O-])ccc43)c(C)c2)n1 508470039 RMFDKASXXVPHJH-UHFFFAOYSA-N 484.559 5.146 5 20 JKBD C[C@@H](Nc1ccc(C(=O)N(C2CC2)[C@H](C)c2ccccc2Cl)cc1[N+](=O)[O-])c1ccccn1 512099766 NHZBOCNGVHHGOT-IAGOWNOFSA-N 464.953 6.182 5 20 JKBD COc1cc(C(=O)N2CCC[C@H]2c2ccccn2)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 516619906 IOGBPLSLUXMHPY-SFHVURJKSA-N 453.882 5.421 5 20 JKBD CCCc1ccc([C@H](NC(=O)c2cc(OC)c(OC(F)F)cc2[N+](=O)[O-])c2cccs2)cc1 585690175 UFBAITOVIPHSIL-NRFANRHFSA-N 476.501 5.738 5 20 JKBD COc1cc(C(=O)N(C)Cc2cc(C)c(OCC(F)(F)F)c(C)c2)c([N+](=O)[O-])cc1OC(F)F 604018576 XJJNYWHFOLDTNA-UHFFFAOYSA-N 492.397 5.035 5 20 JKBD CCOc1cccc(N[C@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Br)c2ccccc2)c1 604047939 TWWLCUOZAKAHDT-NRFANRHFSA-N 470.323 5.548 5 20 JKBD CCc1cccc2c(C3CCN(C(=O)c4cc(OC)c(OC(F)F)cc4[N+](=O)[O-])CC3)c[nH]c12 604193260 MMOVOBLUPPHNIB-UHFFFAOYSA-N 473.476 5.268 5 20 JKBD CCCOc1cc(NC(=O)c2cc(Br)ccc2F)c([N+](=O)[O-])cc1OCCC 619206489 XAVANNUZFBCYSJ-UHFFFAOYSA-N 455.280 5.326 5 20 JKBD O=[N+]([O-])c1ccc(/C(O)=C(/C(=S)Nc2ccccc2-c2ccccc2)[n+]2cccc(CO)c2)cc1 725762538 ADESYKSXCYUXGP-UHFFFAOYSA-O 484.557 5.365 5 20 JKBD CC(C)(C)OC(=O)Nc1ccc(NC(=O)c2cnn(-c3ccc([N+](=O)[O-])cc3)c2)c(C(F)(F)F)c1 729655288 PDPDEWWJYSALCE-UHFFFAOYSA-N 491.426 5.399 5 20 JKBD CC(C)N(Cc1nnc(-c2cccc([N+](=O)[O-])c2)o1)C(=O)CC1CCC(c2ccccc2)CC1 730959454 FFMCQNBKPZLZSB-UHFFFAOYSA-N 462.550 5.746 5 20 JKBD Cc1csc(Sc2ccc(NC(=O)N3CCN(c4ccc([N+](=O)[O-])cc4)CC3)c(C)c2)n1 731281392 CTJGYSMCJOKQGR-UHFFFAOYSA-N 469.592 5.173 5 20 JKBD C[C@H](OC(=O)c1cnc(-c2ccccc2Cl)s1)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl 747954909 ONFSBSDPXPXKHF-JTQLQIEISA-N 466.302 5.209 5 20 JKBD O=C(OCC(=O)N1c2ccccc2CCc2ccccc21)c1csc(-c2ccc([N+](=O)[O-])cc2)n1 747958334 YQXOBFHZIUEJCY-UHFFFAOYSA-N 485.521 5.339 5 20 JKBD CCOc1ccccc1NC(=O)[C@H](OC(=O)c1cc([N+](=O)[O-])c(C)c([N+](=O)[O-])c1C)c1ccccc1 748954028 CMNHYGYJWABMKS-HSZRJFAPSA-N 493.472 5.055 5 20 JKBD O=C(Nc1cc(C(F)(F)F)ccc1N1CCCC1)c1cc([N+](=O)[O-])ccc1Br 751063882 ZZXSCWDNHHHQNA-UHFFFAOYSA-N 458.234 5.229 5 20 JKBD COCCNC(=O)c1ccc(Cl)c(NCc2ccc(Oc3ccc(F)cc3)c([N+](=O)[O-])c2)c1 864003450 AMWMSEGYLJEMHR-UHFFFAOYSA-N 473.888 5.168 5 20 JKBD O=C(CCSC(F)(F)F)O[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1 915247714 DSQPAWMGTZHNHB-INIZCTEOSA-N 462.833 5.114 5 20 JKBD COc1ccc(Oc2ccc([N+](=O)[O-])cc2C(=O)O[C@H](C)c2nnc(-c3cccc(C)c3)o2)cc1 915250274 RKNAHRCSUWIJFC-MRXNPFEDSA-N 475.457 5.672 5 20 JKBD CSc1ccc(C(=O)c2ccccc2C(=O)OCc2nnc(-c3cc(C)oc3C)o2)cc1[N+](=O)[O-] 916426373 OREKPROYKWWSHP-UHFFFAOYSA-N 493.497 5.165 5 20 JKBD CC(C)c1ccc(-c2nc(C(=O)OCc3nc(-c4ccc([N+](=O)[O-])cc4)no3)cs2)cc1 918945279 HVWJRRWVKCIATE-UHFFFAOYSA-N 450.476 5.249 5 20 JKBD C[C@H](Nc1ccc(C(=O)OCc2csc(Cc3ccccc3)n2)cc1[N+](=O)[O-])c1ccccn1 920543457 FBGRYZNVXUEYOO-KRWDZBQOSA-N 474.542 5.567 5 20 JKBD CC(C)N(Cc1nnc(-c2cccc([N+](=O)[O-])c2)o1)C(=O)c1cccc(NC(=O)c2cccs2)c1 921194923 PCDADASVLRWRFC-UHFFFAOYSA-N 491.529 5.009 5 20 JKBD COc1cc(C(=O)NC2(c3ccc(NC(=O)c4cc5[nH]ccc5s4)cc3)CCC2)ccc1[N+](=O)[O-] 1789104312 LWGUJDJNEMULIK-UHFFFAOYSA-N 490.541 5.208 5 20 JKBD O=C(/C=C/c1ccc([N+](=O)[O-])o1)NC1(c2ccc(NC(=O)c3cc(-c4ccccc4)no3)cc2)CCC1 1789782163 RIRZVPPASPUAAB-ACCUITESSA-N 498.495 5.304 5 20 JKBD O=C(/C=C/c1ccccc1[N+](=O)[O-])NC1(c2ccc(NC(=O)c3ccoc3Cl)cc2)CCC1 1790207161 JHTXLGIZQOAOAO-IZZDOVSWSA-N 465.893 5.302 5 20 JKBD O=C(Cc1cc(F)ccc1[N+](=O)[O-])NC1(c2ccc(NC(=O)c3cc4ccsc4[nH]3)cc2)CCC1 1790876380 QTRRHIJBXQYRJM-UHFFFAOYSA-N 492.532 5.267 5 20 JKBD CC(C)[C@@H](C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)C1(c3cccc([N+](=O)[O-])c3)CCC1)C2)c1ccccc1 1793208029 CACNGXRIGLYRKO-OUJSJNLKSA-N 489.616 5.095 5 20 JKBD CC[C@H](C)[C@H](C(=O)N1CCCC2(CCN(C(=O)c3cccc(F)c3[N+](=O)[O-])CC2)C1)c1ccccc1 1809162371 MLFIDMXLPPVHKM-RDPSFJRHSA-N 495.595 5.409 5 20 JKBD Cc1c(C(=O)NC[C@H]2CCN(C(=O)[C@H]3CC[C@H](C)CC3)[C@H]2c2cccnc2)cc(Cl)cc1[N+](=O)[O-] 1811796074 CTXIAYLNILNXAQ-HKTKNQGOSA-N 499.011 5.098 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cccc3ccoc23)n[nH]1 1821537578 VXCIAFSSVUHCHV-HXUWFJFHSA-N 491.479 5.131 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)N1CCC([C@@H]2CCCCN2C(=O)[C@@H]2CCCCC2(F)F)CC1 1824647778 GLLBGGNFUQWAKU-RXVVDRJESA-N 495.542 5.101 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)N1CCCC[C@H]1C1CCN(C(=O)[C@@]2(F)CCCC=C2F)CC1 1830731491 WKQANLWKIVFRJB-NBGIEHNGSA-N 493.526 5.021 5 20 JKBD O=C(c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1)N1CCC(OCc2ccccc2)CC1 10409645 KCDBHANIRVBNNA-UHFFFAOYSA-N 466.921 5.862 5 20 JKBD C[C@H](OC(=O)c1ccccc1COc1ccccc1)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 10852887 WMUNASOLAURTNB-HNNXBMFYSA-N 488.418 5.377 5 20 JKBD COc1cc(C(=O)Nc2nc3ccc(SC(F)F)cc3s2)c([N+](=O)[O-])cc1OC(F)F 10958434 NVMPSVSYVCMROR-UHFFFAOYSA-N 477.417 5.382 5 20 JKBD O=C(NCCCc1nc2ccccc2[nH]1)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1 11485912 RXEOKDBWKKWKAD-UHFFFAOYSA-N 450.882 5.279 5 20 JKBD O=C(Nc1ccccc1C(=O)OCc1ccc(-n2cccn2)cc1)c1ccc([N+](=O)[O-])cc1Cl 14677855 OOZQXJNFFZFWAX-UHFFFAOYSA-N 476.876 5.043 5 20 JKBD CC(C)N(Cc1nnc(-c2cccc([N+](=O)[O-])c2)o1)C(=S)Nc1cc(Cl)cc(Cl)c1 15151614 NZKOTAUUVUALTJ-UHFFFAOYSA-N 466.350 5.559 5 20 JKBD COc1cc(C(=O)N2CCN(c3ccccc3OC)CC2)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 15343346 IXLFIMPWSTWIKZ-UHFFFAOYSA-N 497.935 5.020 5 20 JKBD CC(=O)N(c1nc(/C=C\c2nc3cc([N+](=O)[O-])ccc3s2)cs1)c1ccc(F)cc1F 96924492 FPZAKPRTBCBJML-CLTKARDFSA-N 458.471 5.794 5 20 JKBD C[C@H](Nc1ccc(C(=O)N(C)CCCOc2ccc(Cl)cc2)cc1[N+](=O)[O-])c1ccccn1 108850093 SKAPYOSHSKZXSY-KRWDZBQOSA-N 468.941 5.357 5 20 JKBD O=C(/C=C\c1cnc2ccccc2n1)O[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1 207447302 DGAIXJKQJUIYKU-MBHJOXKWSA-N 488.887 5.128 5 20 JKBD Cc1ccccc1-c1nnc(S[C@@H](C)C(=O)Nc2nc(-c3cccc([N+](=O)[O-])c3)cs2)o1 255926749 BWPSJAXDIWHJCK-ZDUSSCGKSA-N 467.532 5.196 5 20 JKBD Cc1nn(Cc2ccc(C(=O)Nc3c(F)cccc3Oc3ccccc3)cc2)c(C)c1[N+](=O)[O-] 410032792 FQXRQBFDJCQWCT-UHFFFAOYSA-N 460.465 5.640 5 20 JKBD CCOc1cc(C(=O)Nc2ccccc2-c2ccc(-c3ccccc3)cc2)c([N+](=O)[O-])cc1OC 410044446 VULWXPOBSXVVBP-UHFFFAOYSA-N 468.509 6.588 5 20 JKBD CCN(CC)c1ccc(-c2nnc(S[C@@H](C)c3nnc(-c4ccc([N+](=O)[O-])cc4)o3)n2C)cc1 501099532 LPZTWUYPDOIUGY-HNNXBMFYSA-N 479.566 5.140 5 20 JKBD COc1cc(CNCc2cc(Br)cs2)c([N+](=O)[O-])cc1OCc1ccccc1 509598980 DGNITLCQNWTEJE-UHFFFAOYSA-N 463.353 5.296 5 20 JKBD COc1cc(NCc2ccc(Oc3ccc(F)cc3)c([N+](=O)[O-])c2)ccc1N1CCCC1=O 512985278 OARDVFHNBZFDLY-UHFFFAOYSA-N 451.454 5.274 5 20 JKBD O=[N+]([O-])c1ccc(-c2ccc(CNCc3ccccc3Cn3cccn3)o2)c(Br)c1 517541973 ALHYQVQDYLNDAJ-UHFFFAOYSA-N 467.323 5.152 5 20 JKBD CCCCN(C)C(=O)C1CCN(C(=O)c2ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])cc2)CC1 517725711 YRRJTBVISQLEEY-UHFFFAOYSA-N 473.957 5.151 5 20 JKBD NC(=O)CC[C@H]1CCCN(C(=O)c2c3c(nc4ccccc24)/C(=C/c2ccc([N+](=O)[O-])cc2)CCC3)C1 524039558 FNZFFPSXYIFBQO-VBIUYMIYSA-N 498.583 5.138 5 20 JKBD O=C(Nc1cc(C(=O)N2CCCCC2)ccc1Cl)c1cc([N+](=O)[O-])ccc1Oc1ccccc1 549711273 QGLYWJLTLIVAHC-UHFFFAOYSA-N 479.920 5.919 5 20 JKBD O=C(CCN1CCCCC1)Nc1ccc(NCc2ccc(C(F)(F)F)cc2[N+](=O)[O-])cc1 600853767 DLVMHYMDKYSGRT-UHFFFAOYSA-N 450.461 5.040 5 20 JKBD Cc1cc(N2CCCC2)ccc1NC(=O)C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1 602093683 NHNPNTZNXHWGOO-HEHNFIMWSA-N 498.608 6.683 5 20 JKBD O=C(C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)N1CCc2[nH]c3ccccc3c2C1 603460907 OVNRVXFELONYLA-CYVLTUHYSA-N 494.576 6.201 5 20 JKBD O=C(C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1)N(Cc1cccc(F)c1)C1CC1 603508306 NQZURGNXJFZUAR-UHFFFAOYSA-N 465.447 5.160 5 20 JKBD O=C(N[C@H](CC(=O)N(Cc1ccccc1[N+](=O)[O-])CC(F)(F)F)c1ccccc1)c1ccccc1 603742221 PYDSVAVGNZYZHR-OAQYLSRUSA-N 485.462 5.047 5 20 JKBD COCc1ccccc1NC(=O)c1ccccc1Sc1ccc(C(F)(F)F)cc1[N+](=O)[O-] 603758459 XLCMMUVQTRXBSB-UHFFFAOYSA-N 462.449 6.164 5 20 JKBD COc1ccc(-c2nn(Cc3ccccc3)cc2C(=O)Nc2ccc(C)c([N+](=O)[O-])c2)cc1OC 603826350 RKEFNZOLIYYTRH-UHFFFAOYSA-N 472.501 5.085 5 20 JKBD COc1cc(C(=O)N(c2cccc(C(F)(F)F)c2)[C@H](C)C2CC2)c([N+](=O)[O-])cc1OC(F)F 603964425 MKLISFNZYTYTSH-LLVKDONJSA-N 474.382 5.669 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Cl)[C@H](NCc1ccc(N2CCCCC2)nc1)c1ccccc1 604045560 UOYDCFZRSMQAQS-XMMPIXPASA-N 479.968 5.103 5 20 JKBD CN(Cc1ccccc1)CC1CCN(C(=O)c2ccc(NCc3ccccc3)c([N+](=O)[O-])c2)CC1 608964140 KAEDUBFAZHYPRG-UHFFFAOYSA-N 472.589 5.191 5 20 JKBD CN(C)CCc1ccc(NC(=O)C/C(=C/c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)cc1 609062874 KWIBFPZTLGUAKI-FXBPSFAMSA-N 486.597 5.878 5 20 JKBD CS(=O)(=O)c1ccc(-c2nc(COc3ccc(-c4ccccc4)cc3[N+](=O)[O-])cs2)cc1 609102578 YLJVSRKCNKKPLT-UHFFFAOYSA-N 466.540 5.368 5 20 JKBD CSc1cccc(N(C)C(=O)c2ccccc2NC(=O)c2ccc([N+](=O)[O-])cc2Cl)c1 726165523 AFWJWHFBHZAPTN-UHFFFAOYSA-N 455.923 5.499 5 20 JKBD Cc1cc(NC(=O)c2cc([N+](=O)[O-])ccc2Br)n(-c2ccccc2C(F)(F)F)n1 728462600 OWTICSFWZMDMCT-UHFFFAOYSA-N 469.217 5.123 5 20 JKBD O=C(Nc1ccccc1C(=O)OCc1csc(-c2ccoc2)n1)c1ccc([N+](=O)[O-])cc1Cl 731067491 WDMHHJWHSKDGAF-UHFFFAOYSA-N 483.889 5.574 5 20 JKBD C[C@@H](OC(=O)c1csc(-c2ccc(Cl)c(Cl)c2)n1)C(=O)Nc1ccc(F)c([N+](=O)[O-])c1 744597235 QDHFRWDPHNKTBL-SECBINFHSA-N 484.292 5.348 5 20 JKBD O=C(CSc1ccc(C(F)(F)F)cc1[N+](=O)[O-])Oc1ccccc1Oc1ccccn1 748686480 HHHNINRAGOZFDW-UHFFFAOYSA-N 450.394 5.499 5 20 JKBD O=C(OCc1cc(-c2ccccc2)no1)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 808818727 BEAJUYOMROHKTR-UHFFFAOYSA-N 475.423 5.228 5 20 JKBD Cc1cc2occ(CC(=O)N(Cc3nnc(-c4cccc([N+](=O)[O-])c4)o3)C(C)C)c2cc1C(C)C 864243076 ZFYKXMCBYOJNTB-UHFFFAOYSA-N 476.533 5.803 5 20 JKBD COc1ccc(Cc2noc(-c3ccc(Sc4nc(C)cs4)c([N+](=O)[O-])c3)n2)cc1OC 904482016 WDHRJCDUQRXCSV-UHFFFAOYSA-N 470.532 5.169 5 20 JKBD C[C@H](OC(=O)c1sc2cccc(Cl)c2c1Cl)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 913326831 GCEYDFASRKIMES-VIFPVBQESA-N 464.286 6.084 5 20 JKBD COc1ccc(Oc2ccc([N+](=O)[O-])cc2C(=O)O[C@H](C)C(=O)Nc2ccc(F)cc2Cl)cc1 915442762 SXQAVRAGVHTYCD-CYBMUJFWSA-N 488.855 5.372 5 20 JKBD C[C@H](OC(=O)c1cc(C2CC2)nc2ccccc12)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 917239653 XDKAMVUVCOKNCK-LBPRGKRZSA-N 473.407 5.223 5 20 JKBD C[C@H](OC(=O)c1cc([N+](=O)[O-])ccc1Oc1ccccc1)C(=O)Nc1ccccc1OC(F)F 917256668 BJTBTZFKMPWXRJ-AWEZNQCLSA-N 472.400 5.173 5 20 JKBD C[C@H](OC(=O)C1CCN(c2ccccc2[N+](=O)[O-])CC1)c1cccc(NC(=O)c2ccccc2)c1 918841769 VSEDFQMPOCGHMC-IBGZPJMESA-N 473.529 5.368 5 20 JKBD Cc1ccc(NC(=O)[C@@H](OC(=O)c2nc(-c3ccccc3)cs2)c2ccccc2)c([N+](=O)[O-])c1 919121104 GRSAVSFNJFWMFU-QFIPXVFZSA-N 473.510 5.564 5 20 JKBD COc1cc(C2SCCS2)ccc1OC(=O)c1ccc(N[C@H](C)c2ccccn2)c([N+](=O)[O-])c1 919688373 ZMDHFLASDAOUKG-OAHLLOKOSA-N 497.598 5.869 5 20 JKBD O=C(NC1(c2ccc(NC(=O)c3cc4cc([N+](=O)[O-])ccc4s3)cc2)CCC1)C(=O)c1ccco1 1791010900 IPFYKSDKIYLRPD-UHFFFAOYSA-N 489.509 5.033 5 20 JKBD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C1(c2cccc([N+](=O)[O-])c2)CCC1)[C@@H]1CCC[C@H]2CCCC[C@@H]21 1800040812 LQNJJDDKZGPMLW-HPWVNZJPSA-N 493.648 5.261 5 20 JKBD C[C@@H](C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2ccc([N+](=O)[O-])cc2F)[nH]n1)c1ccc(Cl)cc1 1814660671 MZWXRAXVKPAUHI-SZNDQCEHSA-N 499.930 5.220 5 20 JKBD O=C(c1ccc([N+](=O)[O-])cc1F)N1CCC([C@H]2CCCCN2C(=O)c2ccc(Cl)cc2F)CC1 1823899259 UACARJZMCKJWCN-JOCHJYFZSA-N 491.922 5.074 5 20 JKBD O=C(CCCc1ccccc1F)N1CCC([C@H]2CCCCN2C(=O)c2cc(F)cc([N+](=O)[O-])c2)CC1 1830613344 ZRKFPILRWUFUME-RUZDIDTESA-N 499.558 5.129 5 20 JKBD C[C@@]1(C(=O)N2CCC([C@@H]3CCCCN3C(=O)c3cc4cc([N+](=O)[O-])ccc4s3)CC2)CC1(F)F 1831062106 PKQMWPGIAUQHEY-MBSDFSHPSA-N 491.560 5.088 5 20 JKBD Cc1ccc([C@H](C)C(=O)N2CCCC[C@H]2C2CCN(C(=O)c3cc(F)cc([N+](=O)[O-])c3)CC2)cc1 1831529855 NOGLIGLQSJITGW-DFBJGRDBSA-N 481.568 5.079 5 20 JKBD Cc1cc(F)ccc1C(=O)N1CCC([C@@H]2CCCCN2C(=O)CSc2ccccc2[N+](=O)[O-])CC1 1831777059 AOYKNYZQOKLLLD-QFIPXVFZSA-N 499.608 5.068 5 20 JKBD COc1cc(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3cccc(C)c3Cl)CC2)ccc1[N+](=O)[O-] 1832697195 HZMWCOIGMZQHCU-OAQYLSRUSA-N 499.995 5.112 5 20 JKBD CSCc1c(C(=O)OCC(=O)Nc2ccc([N+](=O)[O-])cc2C(F)(F)F)oc2ccccc12 9786703 XNAPFOHUFGCWGZ-UHFFFAOYSA-N 468.409 5.018 5 20 JKBD CC(=O)N(c1nc(COC(=O)c2ccc(Cl)c([N+](=O)[O-])c2)cs1)c1ccc(C)cc1C 11025217 DLSGBCKEYZDMRZ-UHFFFAOYSA-N 459.911 5.363 5 20 JKBD CC(=O)N(c1ccc(Cl)c(Cl)c1)c1nc(COC(=O)c2cccc([N+](=O)[O-])c2C)cs1 11397285 RPOSTYYHSFIGGQ-UHFFFAOYSA-N 480.329 5.708 5 20 JKBD O=C1c2ccccc2N[C@@H](c2cn(-c3ccccc3)nc2-c2ccc([N+](=O)[O-])cc2)N1C[C@@H]1CCCO1 15503711 PLCXEUWOIHIJDM-WXVAWEFUSA-N 495.539 5.193 5 20 JKBD CCCCSc1nnc(S[C@@H](C)C(=O)Nc2nc(-c3cccc([N+](=O)[O-])c3)cs2)s1 22489930 OWBSBMMDZDGZRF-NSHDSACASA-N 481.650 5.581 5 20 JKBD O=C(Nc1cccnc1)c1ccc(NC(=O)c2ccc(Nc3ccccc3)c([N+](=O)[O-])c2)cc1 24906490 XEPKFHPJTHKDOM-UHFFFAOYSA-N 453.458 5.238 5 20 JKBD O=C(COC(=O)/C=C/c1cc(C(F)(F)F)ccc1Cl)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 24975285 MACBWQJCCCKXMO-LZCJLJQNSA-N 496.747 5.481 5 20 JKBD COc1cc(C(=O)Nc2cccc([N+](=O)[O-])c2C)ccc1OCc1ccc(Br)s1 31817190 NOUKKZIPIIWNHF-UHFFFAOYSA-N 477.336 5.567 5 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507647407 AOLMQIWJDQLCJJ-CQSZACIVSA-N 455.923 5.620 5 20 JKBD COc1ccc(CNCc2ccc(Oc3cc(C)ccc3C(C)C)c([N+](=O)[O-])c2)cc1NC(C)=O 507914785 QFTIAEUHAKERME-UHFFFAOYSA-N 477.561 6.076 5 20 JKBD COc1cc(C(=O)N(C)c2ccccc2Oc2ccccc2)c([N+](=O)[O-])cc1OCc1cscn1 509130361 VVZLHLBDCKMYBL-UHFFFAOYSA-N 491.525 5.708 5 20 JKBD Cc1nc(-c2ccc(F)cc2)sc1[C@@H](C)Nc1ccc([N+](=O)[O-])c(C(=O)N2CCCC2)c1 511425954 BBBBEMDQJQFTCF-CQSZACIVSA-N 454.527 5.575 5 20 JKBD COc1ccc(NC(=O)c2sc(NC(=O)c3ccc(F)cc3Cl)cc2C)c([N+](=O)[O-])c1 515638748 NOKJUSRXTWEURS-UHFFFAOYSA-N 463.874 5.270 5 20 JKBD O=[N+]([O-])c1ccc(-c2ccc(CN[C@@H]3CCCOc4ccc(F)cc43)o2)c(Br)c1 518771816 FYRHENORJHCKGZ-LJQANCHMSA-N 461.287 5.760 5 20 JKBD CCOc1cc(NC(=O)c2cc(C)cc([N+](=O)[O-])c2)c(OCC)cc1NC(=O)c1ccccc1 518912464 NOHRGUIAMRERBE-UHFFFAOYSA-N 463.490 5.205 5 20 JKBD Cc1cc(Oc2ncccn2)ccc1NC(=O)c1ccc(NCc2ccccc2Cl)c([N+](=O)[O-])c1 520481425 QUUCHMCUQWXEML-UHFFFAOYSA-N 489.919 6.003 5 20 JKBD CC[C@@H](C)N(C(=O)c1ccc(Sc2nc(C)cs2)c([N+](=O)[O-])c1)c1ccc(C(N)=O)cc1 521176042 OZYLNFXLTBVQLF-CQSZACIVSA-N 470.576 5.055 5 20 JKBD COc1ccc(C[C@H](NC(=O)[C@@H](C)Sc2ccc([N+](=O)[O-])cc2)c2ccccc2)cc1OC 524059318 OXQMLNXEETVRIE-VGSWGCGISA-N 466.559 5.193 5 20 JKBD O=C(Nc1c(F)cccc1Cl)N1CCN(Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)CC1 555343149 NJKCPUGGXFSVHC-UHFFFAOYSA-N 474.945 5.466 5 20 JKBD C[C@H](C1CC1)n1nccc1NC(=O)C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1 602140956 RNRCEZARLPZLGB-NISQSXRWSA-N 473.558 5.941 5 20 JKBD Cc1nc2ccccc2n1CCNCc1ccc(-c2ccc([N+](=O)[O-])cc2Br)o1 608835693 LIRWJEGGGYRYAI-UHFFFAOYSA-N 455.312 5.065 5 20 JKBD C[C@@H]1CCCN(c2ccc(C(=O)Nc3ccc(SCc4cccnc4)cc3)cc2[N+](=O)[O-])C1 619687442 SOGUPEVILYJDQJ-GOSISDBHSA-N 462.575 5.771 5 20 JKBD CC(C)(C)c1nc(CC(=O)Oc2ccc(NC(=O)c3cc([N+](=O)[O-])ccc3Cl)cc2)cs1 726752509 OCXSSZCNVIBSIC-UHFFFAOYSA-N 473.938 5.403 5 20 JKBD O=C(CCC(=O)c1ccc2ccc3cccc4ccc1c2c34)NC1CCN(c2ncccn2)CC1 727755606 CTWKYYXAYZJNKO-UHFFFAOYSA-N 462.553 5.122 5 20 JKBD O=C(COC(=O)/C=C\c1cccc(OC2CCCC2)c1)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 727885207 ISQIGEAEZXQVQB-FLIBITNWSA-N 478.423 5.130 5 20 JKBD CC(C)(NC(=O)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1)c1ccc(F)cc1 728500759 OXFLXZBAAKKOEV-UHFFFAOYSA-N 453.436 5.021 5 20 JKBD O=Cc1ccc([N+](=O)[O-])c(Oc2ncnc3scc(-c4ccc(Br)cc4)c23)c1 748308514 SIOJEEPLYYBFQW-UHFFFAOYSA-N 456.277 5.634 5 20 JKBD COc1ccccc1-c1cc(NC(=O)c2cc([N+](=O)[O-])ccc2Br)n(-c2ccccc2)n1 751087901 XPAJTWPOGGNDOE-UHFFFAOYSA-N 493.317 5.471 5 20 JKBD Cc1c(C(=O)Nc2ncc(Cc3cccc(Br)c3)s2)cc([N+](=O)[O-])c(C)c1[N+](=O)[O-] 751149523 IOMCQPKLSAUKBJ-UHFFFAOYSA-N 491.323 5.182 5 20 JKBD O=[N+]([O-])c1ccc(Sc2nnc(-c3ccc(F)cc3)n2Cc2ccccc2)c([N+](=O)[O-])c1 799770516 APLHRTMOXYXCGW-UHFFFAOYSA-N 451.439 5.100 5 20 JKBD CC1=C(C(=O)Nc2ccccc2C(F)(F)F)[C@@H](c2ccc([N+](=O)[O-])o2)NC(=S)N1CC(C)C 812790374 OZUIHGVEDVFIEA-GOSISDBHSA-N 482.484 5.007 5 20 JKBD Cc1cc(C)c(NC(=O)[C@H](C)Oc2ccc3c(-c4ccc([N+](=O)[O-])cc4)cc(=O)oc3c2)c(C)c1 844160311 HUTAOTHUXGZEMI-SFHVURJKSA-N 472.497 5.699 5 20 JKBD Cc1nc(-c2ccc(NC(=O)c3ccccc3C(=O)c3ccc(N(C)C)c([N+](=O)[O-])c3)cc2)co1 915066877 JGISSCZQELLLIE-UHFFFAOYSA-N 470.485 5.108 5 20 JKBD CN1CCN(c2ccccc2NC(=O)c2ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])cc2)CC1 916557204 JDAAASXKLGZVPJ-UHFFFAOYSA-N 466.925 5.045 5 20 JKBD CCc1ccccc1N(C(C)=O)c1nc(COC(=O)c2cc3cccc([N+](=O)[O-])c3[nH]2)cs1 919523326 QSSSMVGRVLWILU-UHFFFAOYSA-N 464.503 5.137 5 20 JKBD O=C(Cc1cccc([N+](=O)[O-])c1)Nc1ccc(C2(NC(=O)c3cccc4cnccc34)CCC2)cc1 1785792094 ROTBGMOUTXRPOE-UHFFFAOYSA-N 480.524 5.133 5 20 JKBD Cc1cc2cccc(C(=O)Nc3ccc(C4(NC(=O)Cc5cccc([N+](=O)[O-])c5)CCC4)cc3)c2[nH]1 1789015930 VRBJKRSGTWDFIU-UHFFFAOYSA-N 482.540 5.375 5 20 JKBD O=C(NC1(c2ccc(NC(=O)c3ccc([N+](=O)[O-])[nH]3)cc2)CCC1)c1ccc(Cl)c(Cl)c1 1790187268 PFHNDHCSDXQNSY-UHFFFAOYSA-N 473.316 5.291 5 20 JKBD COc1cc(C(=O)Nc2ccc(C3(NC(=O)c4cscc4C)CCC3)cc2)cc([N+](=O)[O-])c1OC 1790814840 JFRVSCKNAYSKHR-UHFFFAOYSA-N 495.557 5.043 5 20 JKBD O=C(Cc1ccc([N+](=O)[O-])cc1F)NC1(c2ccc(NC(=O)c3cccc4ccoc34)cc2)CCC1 1790956341 AHUIDAZDYGGOJE-UHFFFAOYSA-N 487.487 5.471 5 20 JKBD CCC[C@H]1CC[C@H](C(=O)N2CC[C@H](CNC(=O)c3ccc([N+](=O)[O-])cc3F)[C@H]2c2cccnc2)CC1 1810747648 WCOJFQSRYICZQY-JJPBMRITSA-N 496.583 5.055 5 20 JKBD C[C@@H](Sc1ccccc1)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)/C=C/c2ccc([N+](=O)[O-])o2)CC1 1824385576 SGOSLSZTZDPRQB-JXAYXJHWSA-N 497.617 5.002 5 20 JKBD Cc1cccc2[nH]c(C(=O)N3CCCC[C@H]3C3CCN(C(=O)c4ccc([N+](=O)[O-])cc4F)CC3)cc12 1828577445 IGFYJLUBYHALRM-VWLOTQADSA-N 492.551 5.071 5 20 JKBD COc1ccc(OC)c([C@H](C)N[C@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2ccccc2)c1 15509387 HFECAMICHKOKOR-WNSKOXEYSA-N 469.925 5.296 5 20 JKBD COc1ccc(OC)c([C@H]2CCCN2C(=O)CSc2ccc(C(F)(F)F)cc2[N+](=O)[O-])c1 15827908 LXUJTDHCPSZKHE-MRXNPFEDSA-N 470.469 5.087 5 20 JKBD COc1ccc(NC(=O)[C@H](C)Sc2nnc(-c3ccc(F)cc3)n2-c2ccccc2)c([N+](=O)[O-])c1 16725099 KVIJSAGVKBLSEL-HNNXBMFYSA-N 493.520 5.110 5 20 JKBD COc1cccc(NC(=O)[C@H](Sc2nc3cc4ccccc4cc3c(=O)n2C)c2ccccc2)c1 22253155 AAEZTJLHNQNSBE-RUZDIDTESA-N 481.577 5.567 5 20 JKBD CCn1c(-c2ccc3c(c2)OCCO3)cnc1S[C@H](C)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 24108410 YDINIPJOJPQHLM-CQSZACIVSA-N 479.518 5.153 5 20 JKBD CC(C)n1ncc2cc(C(=O)Oc3ccc(NC(=O)c4cc([N+](=O)[O-])ccc4Cl)cc3)cnc21 25983560 BHIZVPVTDCMIBU-UHFFFAOYSA-N 479.880 5.045 5 20 JKBD C[C@H](N[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1)c1ccc(C(F)(F)F)cc1 28383911 BEJCDNDFBHYOGO-LHSJRXKWSA-N 477.870 6.298 5 20 JKBD CCOc1cc(NC(=O)c2cc([N+](=O)[O-])c(C)s2)c(OCC)cc1NC(=O)c1ccccc1 29880302 MGJJQUPEMDAHPK-UHFFFAOYSA-N 469.519 5.267 5 20 JKBD COc1cc(C(=O)Nc2ccc(NC(=O)Nc3ccccc3)cc2)c([N+](=O)[O-])cc1OC(F)F 31266219 UUMYZVBZARUWFK-UHFFFAOYSA-N 472.404 5.101 5 20 JKBD CC(=O)Nc1cccc([C@@H](C)NC(=O)c2cc([N+](=O)[O-])ccc2Sc2ccc(Cl)cc2)c1 31304710 OKHSEFANHNFMCQ-CQSZACIVSA-N 469.950 5.849 5 20 JKBD CCN(CC(=O)Nc1c(F)cccc1F)C(=O)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1 31348052 LZHYLZICVZIVOS-UHFFFAOYSA-N 489.862 5.420 5 20 JKBD CCCOc1c(Cl)cc(C(=O)N(Cc2ccccc2[N+](=O)[O-])CC(F)(F)F)cc1OC 106189662 JMSLPGYDUMLJBG-UHFFFAOYSA-N 460.836 5.250 5 20 JKBD Cc1csc(Sc2ccc(C(=O)Nc3cc(C(=O)NC(C)C)ccc3Cl)cc2[N+](=O)[O-])n1 108356805 YOGBJIQHVKQHQS-UHFFFAOYSA-N 490.994 5.555 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)N[C@@H](c2ccc(Br)cc2)C2CCC2)cc1SC 483433043 AWUNJXABDLCZHN-LJQANCHMSA-N 465.369 5.359 5 20 JKBD C[C@H](Nc1ccc(C(=O)N2CCc3sccc3[C@H]2c2cccs2)cc1[N+](=O)[O-])c1ccccn1 506054867 DLTRKQMNJXCSTK-FYSMJZIKSA-N 490.610 6.074 5 20 JKBD COc1ccccc1OCC(=O)Nc1cccc(NC(=O)N(Cc2ccc([N+](=O)[O-])cc2)C(C)C)c1 509210536 KIQHBBRIIVUOKN-UHFFFAOYSA-N 492.532 5.063 5 20 JKBD CC(C)(C)c1ccc(Oc2ccc(CNCc3ccccc3CN3CCCC3=O)cc2[N+](=O)[O-])cc1 513604170 GISPVRZSDZZNHZ-UHFFFAOYSA-N 487.600 6.097 5 20 JKBD COc1cc(C(=O)N[C@H](C)c2ccc(OC3CCCC3)c(OC)c2)c([N+](=O)[O-])cc1OC(F)F 514576030 WNKZSIYTKAWFRQ-CYBMUJFWSA-N 480.464 5.026 5 20 JKBD C[C@H](NC(=O)CCCn1c(=O)oc2cc([N+](=O)[O-])ccc21)c1ccc(Oc2ccccc2)c(F)c1 515626152 QBSJWTPVWKONNU-INIZCTEOSA-N 479.464 5.092 5 20 JKBD CCOc1cc(NC(=O)c2ccc([N+](=O)[O-])cc2F)c(OCC)cc1NC(=O)c1ccccc1 515764460 QRFOENRIAWEPKU-UHFFFAOYSA-N 467.453 5.036 5 20 JKBD CSc1ccc([N+](=O)[O-])c(C(=O)NCCOc2ccc3cc(Br)ccc3c2)c1 516338676 GWHADTNUSNEVPS-UHFFFAOYSA-N 461.337 5.041 5 20 JKBD CC(=O)N(c1cccc(Cl)c1)c1nc(COc2ccc(-c3ccccc3)cc2[N+](=O)[O-])cs1 516343843 WVSVZQHSGMCIEB-UHFFFAOYSA-N 479.945 6.635 5 20 JKBD Cc1ccc(C(=O)C2CCN(C(=O)c3ccc(N[C@H](C)c4ccccn4)c([N+](=O)[O-])c3)CC2)c(C)c1 517551026 HORSKFPAJBYHIE-HXUWFJFHSA-N 486.572 5.515 5 20 JKBD O=C(NCc1cccc(NC(=O)[C@@H]2CCCO2)c1)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1 517932027 IBLORZDGFGOMHC-QHCPKHFHSA-N 495.919 5.088 5 20 JKBD CCOc1cc(C(=O)N[C@@H](c2ccccc2)c2ccc(Br)cc2)c([N+](=O)[O-])cc1OC 519954589 DVYMUYDDMIEBNG-QFIPXVFZSA-N 485.334 5.284 5 20 JKBD CC(=O)NC[C@H]1CCCN(C(=O)c2c3c(nc4ccccc24)/C(=C\c2cccc([N+](=O)[O-])c2)CCC3)C1 521418286 KXRSOIFCWZSAJF-JHRFGPFWSA-N 498.583 5.008 5 20 JKBD C[C@H](N[C@H](C)c1ccc(NC(=O)c2ccc(F)cc2)cc1)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl 604047831 WVOOXLBYAVXPHS-CABCVRRESA-N 484.915 5.317 5 20 JKBD CO[C@H](C)C(=O)Nc1cccc(NC(=O)c2cc([N+](=O)[O-])ccc2Sc2ccc(Cl)cc2)c1 604449166 ZFCIZLDRZDDUTM-CQSZACIVSA-N 485.949 5.625 5 20 JKBD COc1ccc([N+](=O)[O-])cc1CS(=O)(=O)C(c1ccc(Cl)cc1)c1ccc(Cl)cc1 609224456 IARIKXKEEDNYLO-UHFFFAOYSA-N 466.342 5.615 5 20 JKBD CCc1nc(C(=O)N(CC2CC2)c2ccc(Cl)c([N+](=O)[O-])c2)nn1-c1ccccc1Cl 728165652 NPUHWYPSQRGCJV-UHFFFAOYSA-N 460.321 5.102 5 20 JKBD Cc1nn(Cc2ccc(C(=O)N(CC3CC3)c3ccc(Cl)c([N+](=O)[O-])c3)cc2)c(C)c1[N+](=O)[O-] 728166629 JHOIZTCWIWLZRA-UHFFFAOYSA-N 483.912 5.075 5 20 JKBD O=C(C[C@H](c1ccccc1)C(F)(F)F)Oc1ccc(NC(=O)c2cccc([N+](=O)[O-])c2)cc1 728457271 WRCUYEZTBRTHRZ-HXUWFJFHSA-N 458.392 5.489 5 20 JKBD CCOc1cccc(NC(=S)/C(=C(/O)c2cccc([N+](=O)[O-])c2)[n+]2ccc(CC)cc2)c1 743051959 AASVFXXEEAZKTQ-UHFFFAOYSA-O 450.540 5.167 5 20 JKBD Cc1cc(C)c(NC(=O)CCCOC(=O)c2csc(-c3cccc([N+](=O)[O-])c3)n2)c(C)c1 747962285 PXDMXLRDYWBIIP-UHFFFAOYSA-N 453.520 5.219 5 20 JKBD O=C(Nc1nnc(SCc2c(Cl)cccc2Cl)s1)c1cc(F)ccc1[N+](=O)[O-] 751051649 ZTDFQLZOVLOTSW-UHFFFAOYSA-N 459.311 5.437 5 20 JKBD COc1ccc([C@H](Cc2ccc(F)cc2)NC(=O)c2cc([N+](=O)[O-])ccc2Br)cc1 751110160 JVZNUXPFBQSTLX-NRFANRHFSA-N 473.298 5.219 5 20 JKBD C[C@@H](OC(=O)c1cc([N+](=O)[O-])ccc1N1CCCCC1)C(=O)Nc1ccccc1-c1ccccc1 823247785 KCJXCGPWFDBABI-LJQANCHMSA-N 473.529 5.436 5 20 JKBD Cc1ccc(Cl)c(NC(=O)c2ccc(NS(=O)(=O)c3ccc(Cl)c([N+](=O)[O-])c3)cc2)c1 864049696 UKUHQDBSKYENHV-UHFFFAOYSA-N 480.329 5.263 5 20 JKBD CC(=O)Nc1cccc(NC(=S)/C(=C(/O)c2cccc([N+](=O)[O-])c2)[n+]2ccc3c(c2)CCCC3)c1 913141141 FUJISSFFDNIIOQ-UHFFFAOYSA-O 489.577 5.043 5 20 JKBD O=C(OCc1nc(-c2cccc([N+](=O)[O-])c2)no1)/C(=C/c1ccc(F)cc1)c1cccs1 914796858 LMUXWMIGGCOPGD-WOJGMQOQSA-N 451.435 5.129 5 20 JKBD O=C(CCC(=O)c1ccc(F)cc1F)Oc1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2Cl)cc1 916951845 KSXWSXLMQFLXNT-UHFFFAOYSA-N 488.830 5.347 5 20 JKBD O=C(Nc1ccc(N2CCCC2)c(F)c1)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 917784948 TZBJKGWVSQYALV-UHFFFAOYSA-N 480.462 5.208 5 20 JKBD Cc1ccc(Sc2ccc(C(=O)N3CCC[C@@H](CNC(=O)OC(C)(C)C)C3)cc2[N+](=O)[O-])cc1 920469982 UBIMQQFXNRVUJR-SFHVURJKSA-N 485.606 5.431 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)[C@@H]3C[C@@H]3c3ccc(Cl)cc3)CCC2)cc1)c1ccc([N+](=O)[O-])o1 1785750269 AVJGVTIFSRPQSZ-WOJBJXKFSA-N 479.920 5.393 5 20 JKBD Cc1c(C(=O)Nc2ccc(C3(NC(=O)c4cc(O)cc([N+](=O)[O-])c4)CCC3)cc2)oc2ccccc12 1788967552 MPNARMGZRIJIIG-UHFFFAOYSA-N 485.496 5.417 5 20 JKBD Nc1ccccc1/C=C/C(=O)NC1(c2ccc(NC(=O)/C=C/c3ccccc3[N+](=O)[O-])cc2)CCC1 1792315633 JIKWILDUNRICCC-XAXODXSJSA-N 482.540 5.038 5 20 JKBD C[C@@H](CC(=O)N1CCC2(CCCN(C(=O)Cc3ccc(Cl)cc3[N+](=O)[O-])C2)CC1)c1ccccc1 1805484808 JEEWVUYYPQCLHX-FQEVSTJZSA-N 498.023 5.216 5 20 JKBD Cc1cc(CCCC(=O)N2CCCC3(CCN(C(=O)CC4CCCC4)CC3)C2)c([N+](=O)[O-])cc1F 1805821153 IUDMVLAPCVURRI-UHFFFAOYSA-N 487.616 5.177 5 20 JKBD Cc1cc(CCCC(=O)Nc2cc([C@H]3CCCCN3C(=O)[C@H]3CC=CCC3)[nH]n2)c([N+](=O)[O-])cc1F 1815072014 UUFXMJDCQRLGSQ-PGRDOPGGSA-N 497.571 5.137 5 20 JKBD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)[nH]n1)c1ccsc1 1816357583 GKOMTVLAQUPFCS-KRWDZBQOSA-N 481.559 5.214 5 20 JKBD Cc1oc(C(C)(C)C)cc1C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2ccc([N+](=O)[O-])cc2F)[nH]n1 1816462622 BMXWBJYDOJVENQ-FQEVSTJZSA-N 497.527 5.276 5 20 JKBD C[C@@H]1CCC[C@H]1C(=O)N1CCCC[C@H]1C1CCN(C(=O)C2(c3cccc([N+](=O)[O-])c3)CCC2)CC1 1828487432 TXIAARFFYHFVLS-ZPZUNKDASA-N 481.637 5.072 5 20 JKBD Cc1ccc(Nc2nnc(S[C@H](C)C(=O)Nc3ccc([N+](=O)[O-])cc3C(F)(F)F)s2)cc1C 10212296 BZBKUQGTSCCWFK-GFCCVEGCSA-N 497.524 5.945 5 20 JKBD C[C@H](OC(=O)c1ccccc1C(=O)c1ccc(Cl)cc1)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl 10662354 DBOGUPFVOKGPLC-ZDUSSCGKSA-N 487.295 5.317 5 20 JKBD C[C@@H](OC(=O)c1cc([N+](=O)[O-])ccc1Cl)C(=O)Nc1c(Cl)cc(Cl)cc1Cl 10666240 BLOPEBJRQAWATA-SSDOTTSWSA-N 452.077 5.392 5 20 JKBD Cc1ccc(CCC(=O)O[C@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2C(F)(F)F)cc1Cl 10740147 OZYNLSCOJYQYBQ-GFCCVEGCSA-N 458.820 5.078 5 20 JKBD O=C(O[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1)c1ccc(Cl)cc1F 18807523 TUPJJMXRJREYGO-LJQANCHMSA-N 463.248 5.578 5 20 JKBD CCOc1ccc(CCC2CCN(C(=O)c3cc(OC)c(OC(F)F)cc3[N+](=O)[O-])CC2)cc1 22131119 ASYSACMWSPHZTC-UHFFFAOYSA-N 478.492 5.089 5 20 JKBD C[C@@H](OC(=O)c1cccnc1Sc1ccccc1)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 22859408 USYVNWOTYXUMJT-CYBMUJFWSA-N 491.447 5.344 5 20 JKBD CCCn1c(S[C@@H](C)C(=O)Nc2cc([N+](=O)[O-])ccc2Cl)nc2sc3c(c2c1=O)CCC3 23558175 NIJBWUDRXOIKGO-NSHDSACASA-N 493.010 5.038 5 20 JKBD Cc1csc(Sc2ccc([N+](=O)[O-])cc2C(=O)OCC(=O)Nc2c(Cl)cccc2Cl)n1 28832371 CDSPJCQIDAKJAC-UHFFFAOYSA-N 498.369 5.613 5 20 JKBD O=C(Cn1c2ccccc2c(=O)c2ccccc21)Nc1nc(-c2ccccc2OC(F)F)cs1 110602809 PVYZUGZNLWBLQF-UHFFFAOYSA-N 477.492 5.518 5 20 JKBD C[C@H](Nc1ccc(C(=O)Nc2cccc(C(=O)N(C)c3ccccc3)c2)cc1[N+](=O)[O-])c1ccccn1 410053012 RCVRALNIFTVARN-IBGZPJMESA-N 495.539 5.692 5 20 JKBD COCCN(C(=O)C[C@H](c1ccccc1)C(F)(F)F)c1nc(-c2ccc([N+](=O)[O-])cc2)cs1 482290773 CTQFMWXPPLKKHP-GOSISDBHSA-N 479.480 5.434 5 20 JKBD COc1ccc(COc2cccc(F)c2)cc1NC(=O)c1cc(SC)c(OC)cc1[N+](=O)[O-] 483496220 POQJPAQQHJWFRM-UHFFFAOYSA-N 472.494 5.304 5 20 JKBD O=C(Nc1cc(Br)ccc1Br)c1csc(-c2ccc([N+](=O)[O-])cc2)n1 496384788 ZIBCISBWWZTLOE-UHFFFAOYSA-N 483.141 5.496 5 20 JKBD Cn1cc(C(=O)NC[C@@H]2CC3c4ccccc4C2c2ccccc23)c(-c2ccc([N+](=O)[O-])cc2)n1 506075041 XQBYOMSLVSMKTO-UBSBWAOCSA-N 464.525 5.022 5 20 JKBD COCCOc1cc([N+](=O)[O-])c(C(=O)Nc2ccc(Sc3nc(C)cs3)cc2C)cc1OC 508510148 DNHZRLKDOARWNU-UHFFFAOYSA-N 489.575 5.105 5 20 JKBD O=C(Nc1ccccc1SC1CCCC1)c1ccc([N+](=O)[O-])cc1I 508944809 ZTWKBBUKAGSULP-UHFFFAOYSA-N 468.316 5.486 5 20 JKBD CCN(Cc1nc(-c2cccc([N+](=O)[O-])c2)no1)[C@@H]1CCSc2ccc(Br)cc21 509065962 BZNSLYFTYZGULQ-QGZVFWFLSA-N 475.368 5.466 5 20 JKBD COCCN(Cc1ccccn1)C(=O)C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1 512082093 GTPDWFPUJCDLPF-CAPFRKAQSA-N 488.569 5.205 5 20 JKBD Cc1csc(Sc2ccc(C(=O)Nc3cccc(-c4nccn4C)c3)cc2[N+](=O)[O-])n1 516134320 PUSKIAGNLCNDAI-UHFFFAOYSA-N 451.533 5.164 5 20 JKBD CC(C)c1nccn1Cc1cccc(NC(=O)c2ccc(N[C@H](C)c3ccccn3)c([N+](=O)[O-])c2)c1 518433650 RIXPAXWVIIATKM-LJQANCHMSA-N 484.560 5.783 5 20 JKBD CC[C@H](NCc1ccc(-c2ccc([N+](=O)[O-])cc2)s1)c1ccccc1OCC(=O)N1CCCC1 518759750 HEFBXAFZXOHHFL-QHCPKHFHSA-N 479.602 5.565 5 20 JKBD COc1cc([C@@H](C)NCc2cn(-c3ccccc3)nc2-c2ccc([N+](=O)[O-])cc2)cc(OC)c1OC 520949759 PQDJEFNUPNLBPX-GOSISDBHSA-N 488.544 5.324 5 20 JKBD Cc1occc1-c1nnc(SCc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)n1Cc1ccccc1 592732305 DLVPTHDQSCYWLB-UHFFFAOYSA-N 474.502 5.145 5 20 JKBD Cc1nn(Cc2ccc(C(=O)Nc3ccc(Oc4ccc(F)cc4)nc3)cc2)c(C)c1[N+](=O)[O-] 603667037 QGIZCMDJHSPQJF-UHFFFAOYSA-N 461.453 5.035 5 20 JKBD CCOc1ccccc1CN(CCCn1ccnc1)C(=O)c1cc2cc([N+](=O)[O-])ccc2s1 603820544 RARRZTCBFMYWBP-UHFFFAOYSA-N 464.547 5.137 5 20 JKBD O=C(c1cc([N+](=O)[O-])ccc1Sc1ccccc1)N1C[C@@H](C(F)(F)F)C[C@H](C(F)(F)F)C1 604257697 LWBQECJNRSHDTF-STQMWFEESA-N 478.414 5.949 5 20 JKBD COc1cc(C(=O)Nc2ccc(OCc3cccc(C(F)(F)F)c3)cc2)c([N+](=O)[O-])cc1OC 609066935 WAGLDARAMAEXKF-UHFFFAOYSA-N 476.407 5.462 5 20 JKBD CCOc1cc([N+](=O)[O-])c(C(=O)Nc2ccc(N[C@@H](C)c3ccccc3)c(Cl)c2)cc1OC 609072166 KARUYGJAXIMHME-HNNXBMFYSA-N 469.925 6.081 5 20 JKBD Cc1csc(Sc2ccc(C(=O)N3CCCO[C@@H](c4ccccc4)C3)cc2[N+](=O)[O-])n1 609231322 YFMBNOAZGCMKHK-LJQANCHMSA-N 455.561 5.115 5 20 JKBD COc1ccccc1[C@H](Nc1ccc(C(=O)Nc2ccc(C)cc2)cc1[N+](=O)[O-])c1nccn1C 727431764 VOVJLBICXQBIJA-DEOSSOPVSA-N 471.517 5.099 5 20 JKBD C[C@@H]1Oc2ccc(C(=O)C3CCN(c4cc(Cl)c(C(F)(F)F)cc4[N+](=O)[O-])CC3)cc2NC1=O 727432331 HYPKNBYVKAHHOM-NSHDSACASA-N 497.857 5.086 5 20 JKBD O=C(CCC(=O)c1ccc2ccc3cccc4ccc1c2c34)NCc1ccnc(N2CCCC2)c1 727753287 CVDQYCZXVYBKJZ-UHFFFAOYSA-N 461.565 5.859 5 20 JKBD O=C(CCC(=O)c1ccc2ccc3cccc4ccc1c2c34)Nc1ccn(Cc2ccncc2)n1 727769096 ORKVRHWHMNQMNK-UHFFFAOYSA-N 458.521 5.825 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)O[C@H](C(=O)Nc2cc(C)ccc2C)c2ccccc2)cc1SC 728650801 KGNVMKLGNCOUTN-QHCPKHFHSA-N 480.542 5.479 5 20 JKBD O=C(Nc1ccccc1SC[C@@H]1CC1(Cl)Cl)c1cc([N+](=O)[O-])ccc1Br 751093764 QXQUMSLMLFTBCO-JTQLQIEISA-N 476.179 5.896 5 20 JKBD O=C(c1ccc(NCc2c(Br)cccc2[N+](=O)[O-])cc1)N1CCc2ccccc21 864039162 OSUASTXODLNLLT-UHFFFAOYSA-N 452.308 5.172 5 20 JKBD Cc1cc(NC(=O)c2ccc(F)cc2Cl)sc1C(=O)OCC(=O)c1ccc([N+](=O)[O-])cc1 915571371 MEKWHIMDWAKWSY-UHFFFAOYSA-N 476.869 5.049 5 20 JKBD Cc1nc2c(c(C)nn2C)c(C)c1CC(=O)Nc1cc(Cl)c([N+](=O)[O-])cc1OCc1ccccc1 915829541 TZBISSVKEXRPOR-UHFFFAOYSA-N 493.951 5.215 5 20 JKBD O=C(OCC(=O)N1CCC[C@H]1c1ccc(Cl)c(Cl)c1)c1cc([N+](=O)[O-])ccc1Cl 918854896 OYGRVYNJCRSAKQ-KRWDZBQOSA-N 457.697 5.076 5 20 JKBD CC(=O)N(c1ccc(C(F)(F)F)cc1)c1nc(COC(=O)c2cccc([N+](=O)[O-])c2)cs1 920497081 ZFZMDUYIBNWACX-UHFFFAOYSA-N 465.409 5.112 5 20 JKBD C[C@@H](Nc1ccc(C(=O)OCc2ccc(C(=O)Nc3ccccc3)cc2)cc1[N+](=O)[O-])c1ccccn1 920546510 YURAQIHCIGFVGW-LJQANCHMSA-N 496.523 5.772 5 20 JKBD C[C@H](Nc1ccc(C(=O)OCc2nc(-c3ccc(Cl)cc3)no2)cc1[N+](=O)[O-])c1ccccn1 920548762 SFBYHVIXFUUYLG-AWEZNQCLSA-N 479.880 5.223 5 20 JKBD O=C(Cc1cccc([N+](=O)[O-])c1)NC1(c2ccc(NC(=O)c3cccc4cc[nH]c34)cc2)CCC1 1789088533 YKQJJQITZAXNIT-UHFFFAOYSA-N 468.513 5.067 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)c3cc4ccc(Cl)cc4[nH]3)CCC2)cc1)c1ccc([N+](=O)[O-])[nH]1 1790183446 DVGZKFLBQCXFLU-UHFFFAOYSA-N 477.908 5.119 5 20 JKBD Cc1ccc(CC(=O)Nc2ccc(C3(NC(=O)c4coc(C(C)C)n4)CCC3)cc2)cc1[N+](=O)[O-] 1790523813 CNEZKKIKEZMDTR-UHFFFAOYSA-N 476.533 5.005 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)c3cc(F)cc([N+](=O)[O-])c3)CCC2)cc1)c1ccc2ccoc2c1 1790892715 PETBRAQGDWISNT-UHFFFAOYSA-N 473.460 5.542 5 20 JKBD O=C(CSc1ccccc1[N+](=O)[O-])Nc1ccc(C2(NC(=O)Cc3cccc(F)c3)CCC2)cc1 1791522155 HELNZCDPMUXHAJ-UHFFFAOYSA-N 493.560 5.203 5 20 JKBD Cc1cc(O)c([N+](=O)[O-])cc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1sc2ccccc2c1Cl 1797464543 KFQTZHNNHHYHAX-QDMKHBRRSA-N 499.976 5.043 5 20 JKBD Cc1scc(C(=O)N2CCC3(CCCN(C(=O)Cc4ccc(Cl)cc4[N+](=O)[O-])C3)CC2)c1C 1805480348 JTZCCWCQCOPINY-UHFFFAOYSA-N 490.025 5.014 5 20 JKBD CC(C)[C@H](C(=O)N1CCC2(CCCN(C(=O)/C=C/c3ccc([N+](=O)[O-])o3)C2)CC1)c1ccc(F)cc1 1805685225 DPBMLRYKWRYLFW-NRGMSUJUSA-N 497.567 5.011 5 20 JKBD O=C(Nc1cc([C@H]2CCCCN2C(=O)Cc2ccsc2)[nH]n1)c1cc2cc([N+](=O)[O-])ccc2s1 1821609487 GAMDCJJKGWFMIQ-GOSISDBHSA-N 495.586 5.143 5 20 JKBD O=C(Nc1cc([C@H]2CCCCN2C(=O)/C=C/c2ccco2)[nH]n1)c1cc2cc([N+](=O)[O-])ccc2s1 1821612076 QXNSIZPJJYPGGL-QRBZPYHOSA-N 491.529 5.145 5 20 JKBD Cc1cc(Cl)ccc1C(=O)N1CCC([C@@H]2CCCCN2C(=O)Cc2cccc([N+](=O)[O-])c2)CC1 1823677351 WEDIBKHWHBEPSL-DEOSSOPVSA-N 483.996 5.033 5 20 JKBD O=C(CCC1CCCC1)N1CCC([C@@H]2CCCCN2C(=O)CCc2cccc([N+](=O)[O-])c2)CC1 1824838120 CRCHUDWWIMKFAB-VWLOTQADSA-N 469.626 5.118 5 20 JKBD CC[C@H](C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cc(F)cc([N+](=O)[O-])c2)CC1)c1ccccc1 1826316578 KEQKIXWRBPLPQS-LOSJGSFVSA-N 481.568 5.161 5 20 JKBD CC1(C)CCC(CC(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3cccc(F)c3[N+](=O)[O-])CC2)CC1 1830423074 FQBLPFWVVIDIJU-HSZRJFAPSA-N 487.616 5.574 5 20 JKBD O=C(Nc1ccccc1Cl)C(=Cc1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccccc1Cl 20794258 LDRBMTUFWHAVQZ-UHFFFAOYSA-N 456.285 5.562 5 20 JKBD CC(C)OCc1ccccc1CNC(=O)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 31340474 JTHOVIJJANRCQS-UHFFFAOYSA-N 479.499 5.071 5 20 JKBD CCOc1cc([N+](=O)[O-])c(C(=O)Nc2cc(C(F)(F)F)ccc2N2CCCCC2)cc1OC 45452422 BHUNBTVTXICASO-UHFFFAOYSA-N 467.444 5.264 5 20 JKBD Cc1ccccc1[C@H]1CCCN1C(=O)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 108330723 RLYCTFUNPWGOBP-HXUWFJFHSA-N 461.484 5.502 5 20 JKBD Cc1cc(O[C@@H](C)c2ccccc2)ccc1NC(=O)[C@H]1CCCN1C(=O)c1ccc([N+](=O)[O-])c(C)c1 112519491 MISMZSFGPDJTGV-RXFWQSSRSA-N 487.556 5.595 5 20 JKBD COc1cc(C(=O)N(Cc2ccccn2)C(C)C)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 117549735 XHSFRPOAFCLFIH-UHFFFAOYSA-N 455.898 5.495 5 20 JKBD O=C(CNC(=O)c1c(Cl)cccc1[N+](=O)[O-])Nc1ccc(Oc2ccccc2C(F)(F)F)cc1 303350870 FBDDFOMBQAJPBB-UHFFFAOYSA-N 493.825 5.428 5 20 JKBD CS(=O)(=O)c1ccc(C(=O)Nc2ccccc2-c2ccc(-c3ccccc3)cc2)cc1[N+](=O)[O-] 410037419 HBVULHCPBBPIGW-UHFFFAOYSA-N 472.522 5.585 5 20 JKBD O=C(CSc1nnc(-c2ccccc2Cl)n1-c1ccccc1)Nc1ccccc1[N+](=O)[O-] 479816105 XLLBKLGATBHIDQ-UHFFFAOYSA-N 465.922 5.227 5 20 JKBD O=C(c1csc(-c2ccc([N+](=O)[O-])cc2)n1)N1CCc2sccc2[C@H]1c1cccs1 497541630 XASMMTNKNUHLKO-IBGZPJMESA-N 453.570 5.629 5 20 JKBD Cc1csc(Sc2ccc(C(=O)Nc3cccc(NC(=O)c4ccoc4)c3)cc2[N+](=O)[O-])n1 499621734 KQIIGARFKZRRLC-UHFFFAOYSA-N 480.527 5.609 5 20 JKBD CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)Cc1csc(-c2ccc(Cl)cc2Cl)n1 502014687 PCGDDTOSXUIPQK-UHFFFAOYSA-N 464.374 6.005 5 20 JKBD C[C@@H](Nc1ccc(C(=O)N(Cc2cccs2)Cc2cccs2)cc1[N+](=O)[O-])c1ccccn1 503161784 VUGZTNFXKAVKPU-QGZVFWFLSA-N 478.599 6.129 5 20 JKBD Cc1cccc(Oc2ncccc2NC(=O)c2ccc([N+](=O)[O-])cc2I)c1C 508957687 CUUJICLJKDLPIS-UHFFFAOYSA-N 489.269 5.256 5 20 JKBD O=C(N[C@@H]1CCc2c(Cl)cccc21)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 509106550 DCLLTRSVOHJIHP-GOSISDBHSA-N 467.875 5.287 5 20 JKBD C[C@H](Nc1ccc(C(=O)Nc2ccc(-n3nccc3C(F)(F)F)cc2)cc1[N+](=O)[O-])c1ccccn1 509753583 ZITCJBYUIMEEOR-HNNXBMFYSA-N 496.449 5.620 5 20 JKBD Cc1ccc(NC(=O)[C@H](Sc2n[nH]c(/C=C\c3ccc(C)o3)n2)c2ccccc2)c([N+](=O)[O-])c1 514338604 QOTJJYKMIZKFFZ-VZNHHXIYSA-N 475.530 5.565 5 20 JKBD NC(=O)c1cccc(NC(=O)c2c3c(nc4ccccc24)/C(=C\c2ccc([N+](=O)[O-])cc2)CCC3)c1 515180531 RQJLUXPYYRBZGE-SDXDJHTJSA-N 478.508 5.371 5 20 JKBD COc1cc(C(=O)Nc2cc3n[nH]cc3cc2C)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 517863623 CBDXITISDFTNFC-UHFFFAOYSA-N 452.854 5.486 5 20 JKBD O=C(Nc1nnc(Cc2ccccc2F)s1)c1ccc(NCc2ccccc2)c([N+](=O)[O-])c1 518141017 LZJIPIJJTTYEAL-UHFFFAOYSA-N 463.494 5.041 5 20 JKBD O=[N+]([O-])c1ccc(-c2ccc(CNCc3ccc(N4CCCCC4)nc3)o2)c(Br)c1 518266432 YMVGIHHYOBUWDF-UHFFFAOYSA-N 471.355 5.292 5 20 JKBD COc1cc(C(=O)NCc2cccc3cccnc23)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 519493820 ANOBISYKRZODHP-UHFFFAOYSA-N 463.877 5.527 5 20 JKBD Cc1cccc(COc2ccc(NC(=O)c3ccc(Sc4nncn4C)c([N+](=O)[O-])c3)c(C)c2)c1 520636833 FTABSYXHBDLDLE-UHFFFAOYSA-N 489.557 5.323 5 20 JKBD CCN(CC)[C@@H](CNC(=O)C1CCN(c2ccccc2[N+](=O)[O-])CC1)c1ccc(C(F)(F)F)cc1 521297462 WOOUZCWWUVBENM-QHCPKHFHSA-N 492.542 5.029 5 20 JKBD Cc1ccc(-c2nnc(NC(=O)c3ccc(N[C@@H](C)c4ccccn4)c([N+](=O)[O-])c3)s2)c(C)c1 521328017 JGONAEGCDSNJFR-INIZCTEOSA-N 474.546 5.551 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1F)[C@@H]1C[C@H]2CCCC[C@H]2N1C(=O)c1ccc2ccccc2c1 524164152 NSJDMPFDFGVZAQ-QFWMQHCXSA-N 461.493 5.299 5 20 JKBD C[C@H](NC(C)(C)CNC(=O)c1ccc(N[C@H](C)c2ccccn2)c([N+](=O)[O-])c1)c1ccccc1 552344040 UJQZRIGBHYTPQY-RBUKOAKNSA-N 461.566 5.022 5 20 JKBD O=C(Nc1ccc(Br)cc1F)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 603470473 XOQCWSNTNFNZJQ-UHFFFAOYSA-N 490.251 5.370 5 20 JKBD Cc1nc(CSc2ccc(C(=O)Nc3cc([N+](=O)[O-])ccc3OC(F)F)cc2)cs1 603638167 GVHQHRCEMWFZNR-UHFFFAOYSA-N 451.476 5.506 5 20 JKBD COc1ccc(NC(=O)c2ccc(N3C[C@@H](C)C[C@H](C)C3)c([N+](=O)[O-])c2)cc1OCc1ccncc1 603876746 PMWNTAYOZYRMKE-OALUTQOASA-N 490.560 5.312 5 20 JKBD C[C@H](CNC(=O)C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)CN1CCCCC1 604441491 GMZVHHIRKKYNAC-CBAAQYGVSA-N 478.618 5.373 5 20 JKBD COc1ccc(CNCc2ccc(OCc3ccccc3)c(Br)c2)cc1[N+](=O)[O-] 604473831 WGDXZQCGAYUEJZ-UHFFFAOYSA-N 457.324 5.235 5 20 JKBD Cc1cc(CN2CCN(C(=O)CCC(=O)c3ccc4ccc5cccc6ccc3c4c56)CC2)on1 729811410 FVKUCMPKLYEAEY-UHFFFAOYSA-N 465.553 5.188 5 20 JKBD Cc1ccc(N(C(=O)Cn2ncc3ccc([N+](=O)[O-])cc32)c2nc3ccccc3s2)c(C)c1 751107026 HLZPPORUACHPLZ-UHFFFAOYSA-N 457.515 5.536 5 20 JKBD COc1cc(COC(=O)c2nc(Cl)c(Cl)c(Cl)c2Cl)c([N+](=O)[O-])cc1OC(F)F 791093140 DYPZTVHKWJPXBM-UHFFFAOYSA-N 492.045 5.570 5 20 JKBD COc1ccc(Cc2noc(Cc3cn(-c4ccccc4)nc3-c3ccc([N+](=O)[O-])cc3)n2)cc1OC 904481064 MTDGSIROAKQADU-UHFFFAOYSA-N 497.511 5.029 5 20 JKBD Cc1ccc(N2C(=O)/C(=C\c3ccc4c(c3)OCO4)N=C2SCc2csc([N+](=O)[O-])c2)cc1 917416512 YJULEQANNREPQO-QGMBQPNBSA-N 479.539 5.371 5 20 JKBD C[C@@H](N[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Br)c1ccccc1)c1cccc([N+](=O)[O-])c1 917938106 FWTNLFZKNWIAQD-SPLOXXLWSA-N 499.321 5.296 5 20 JKBD COc1cc(/C=C/C(=O)Oc2c(C)cc(C)cc2[N+](=O)[O-])ccc1OCc1c(C)noc1C 918680703 XKPJOHUREFHMMW-VQHVLOKHSA-N 452.463 5.023 5 20 JKBD COc1cc(C(=O)Nc2cccnc2-n2ccnc2C)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 919982570 JYSPIUBIRXYIAL-UHFFFAOYSA-N 479.880 5.191 5 20 JKBD C[C@H](OC(=O)[C@H](C)SCc1ncc(-c2ccc(Cl)cc2)o1)C(=O)Nc1ccccc1[N+](=O)[O-] 920673913 YALKSVHZNIUHPH-KBPBESRZSA-N 489.937 5.095 5 20 JKBD Cc1c(C(=O)NC2(c3ccc(NC(=O)C[C@H]4CCCCO4)cc3)CCC2)cc(Cl)cc1[N+](=O)[O-] 1786646211 DSFGSKDTVPEKQU-HXUWFJFHSA-N 485.968 5.264 5 20 JKBD O=C(CCc1ccccc1Cl)Nc1ccc(C2(NC(=O)c3ccc([N+](=O)[O-])o3)CCC2)cc1 1787803098 ZCHLPPUVIFMPKW-UHFFFAOYSA-N 467.909 5.222 5 20 JKBD CC(C)[C@@H](C(=O)NC1(c2ccc(NC(=O)c3nc[nH]c3[N+](=O)[O-])cc2)CCC1)c1ccc(Cl)cc1 1788613984 HYGHOEHFGYGWRI-HXUWFJFHSA-N 495.967 5.159 5 20 JKBD O=C(Cc1ccc(Cl)cc1[N+](=O)[O-])N1CCCC2(CCN(C(=O)c3ccc4ccoc4c3)CC2)C1 1805485453 YHNFNRJUPDNZNO-UHFFFAOYSA-N 495.963 5.082 5 20 JKBD O=C(Nc1cc([C@H]2CCCCN2C(=O)c2cc3sccc3s2)[nH]n1)c1cccc(F)c1[N+](=O)[O-] 1821169887 KRPRMAOSWGJCBP-OAHLLOKOSA-N 499.549 5.353 5 20 JKBD C[C@@H]1CCC[C@H]1C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cc3cc([N+](=O)[O-])ccc3s2)n[nH]1 1821610224 WJMSMGXJDFCXHO-BJZITVGISA-N 481.578 5.275 5 20 JKBD O=C(Nc1cc([C@H]2CCCCN2C(=O)/C=C/c2ccccc2[N+](=O)[O-])[nH]n1)c1ccccc1C1CC1 1823135033 CLBQLGGZUJXFNT-DKUDOZJNSA-N 485.544 5.215 5 20 JKBD CC[C@@H](C(=O)N1CCC([C@@H]2CCCCN2C(=O)/C=C/c2ccc([N+](=O)[O-])o2)CC1)c1ccccc1 1824274304 DVYBNZUIJLBQHO-SZLQQSRFSA-N 479.577 5.015 5 20 JKBD O=C(CSc1ccccc1[N+](=O)[O-])N1CCC([C@H]2CCCCN2C(=O)/C=C/c2ccsc2)CC1 1825302765 OQYMAIAAOWCOQX-MHNQQFQPSA-N 499.658 5.082 5 20 JKBD O=C(COC(=O)c1nc(Cl)c(Cl)c(Cl)c1Cl)Nc1ccc(Cl)cc1[N+](=O)[O-] 12684178 GYUDRSLZXGNATJ-UHFFFAOYSA-N 473.483 5.052 5 20 JKBD CCn1c(SCC(=O)Nc2c(Cl)cccc2Cl)nc2cc3ccccc3cc2c1=O 22177890 XNWPPEAOKRZZDV-UHFFFAOYSA-N 458.370 5.607 5 20 JKBD CCn1c(SCC(=O)c2cc(C)n([C@H](C)COC)c2C)nc2cc3ccccc3cc2c1=O 22178801 CQAYOPLBYPHHIC-QGZVFWFLSA-N 463.603 5.170 5 20 JKBD CN(C)c1ccc(C(=O)c2ccccc2C(=O)N2CCC[C@@H](c3nc4ccccc4o3)C2)cc1[N+](=O)[O-] 27381892 WOIMLNXESRGWAE-LJQANCHMSA-N 498.539 5.053 5 20 JKBD CCn1c2ccccc2c2cc(NC(=O)CCCn3c(=O)oc4cc([N+](=O)[O-])ccc43)ccc21 29473576 OLOIFJVUOZTXHL-UHFFFAOYSA-N 458.474 5.049 5 20 JKBD O=C(Nc1ccc(CNC(=O)c2cc([N+](=O)[O-])ccc2Oc2ccccc2)cc1)c1ccco1 107782205 WPMRJAAIDATCNY-UHFFFAOYSA-N 457.442 5.162 5 20 JKBD Cc1nn(C)c2nc(-c3cccs3)cc(C(=O)N(Cc3ccccc3[N+](=O)[O-])CC(F)(F)F)c12 107798002 KPAPCEJVGNNPIY-UHFFFAOYSA-N 489.479 5.118 5 20 JKBD Cc1nc([N+](=O)[O-])cn1CC(=O)NC[C@H](c1ccccc1)c1c(-c2ccccc2)[nH]c2ccccc12 116042861 CEEJZIZQBKDDRF-HSZRJFAPSA-N 479.540 5.196 5 20 JKBD Cc1cc(SC2CCCCC2)ccc1NC(=O)CNC(=O)c1c(Cl)cccc1[N+](=O)[O-] 303362768 HSGBDEZIOVGENL-UHFFFAOYSA-N 461.971 5.350 5 20 JKBD O=C(Nc1cccc(NC(=O)c2cc([N+](=O)[O-])ccc2Sc2ccccc2)c1)c1ccncc1 482419859 GHDWJBDNBPEJBM-UHFFFAOYSA-N 470.510 5.646 5 20 JKBD CCN(C(=O)Cc1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1)c1cccc(OC)c1 483355191 WALATSQFOYVUQB-UHFFFAOYSA-N 456.502 5.052 5 20 JKBD Cc1ccsc1CN(C(=O)c1ccc(-n2cncn2)c([N+](=O)[O-])c1)c1ccc(F)c(Cl)c1 497035061 LUAJOJLPSAVPGC-UHFFFAOYSA-N 471.901 5.185 5 20 JKBD O=C(CSc1nnc(COc2ccc(Cl)cc2Cl)o1)Nc1ccc([N+](=O)[O-])cc1Cl 501077453 VIHOJVHSRARHGW-UHFFFAOYSA-N 489.724 5.248 5 20 JKBD O=C(Nc1ccccc1Oc1cccc(F)c1)c1ccc([N+](=O)[O-])cc1I 508755607 RGNPJTGJVFWBPT-UHFFFAOYSA-N 478.217 5.383 5 20 JKBD COc1ccc([C@H](C)N[C@@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2ccccc2)cc1F 511072379 KAGGKAUJEUSJQK-RCDICMHDSA-N 457.889 5.427 5 20 JKBD Cc1ccc(C(=O)Nc2nc3ccc(NC(=O)Cc4ccccc4[N+](=O)[O-])cc3s2)s1 511318865 BEWOXKKUQIDMLL-UHFFFAOYSA-N 452.517 5.008 5 20 JKBD COc1cc(CSc2nnc(-c3ccncc3)n2-c2ccc(C)cc2)c([N+](=O)[O-])cc1OC(F)F 514724086 NSQBKWOTDAHWHV-UHFFFAOYSA-N 499.499 5.448 5 20 JKBD Cc1csc(Sc2ccc(C(=O)Nc3ccc4nc([C@H]5CCCO5)[nH]c4c3)cc2[N+](=O)[O-])n1 517891236 OXHCSVYQXJFCPO-GOSISDBHSA-N 481.559 5.491 5 20 JKBD CCOC(=O)c1sc(-c2cccc([N+](=O)[O-])c2)cc1NC(=O)c1ccccc1C(F)(F)F 603462021 UNQVWZNBNQGOJV-UHFFFAOYSA-N 464.421 5.771 5 20 JKBD CC(C)n1ncc2c(C(=O)Nc3cc([N+](=O)[O-])ccc3OC(F)F)cc(-c3ccco3)nc21 603638188 HLUVOJIZBIVXJP-UHFFFAOYSA-N 457.393 5.034 5 20 JKBD CCN(CC)Cc1cccc(NC(=O)C2CCN(c3ccc(C(F)(F)F)cc3[N+](=O)[O-])CC2)c1 603873148 MREAFMVCBCECCE-UHFFFAOYSA-N 478.515 5.311 5 20 JKBD COc1cccc(NCc2nnc(SCc3csc([N+](=O)[O-])c3)n2C2CCCCC2)c1 603938556 WOIKNEOAGCJDMQ-UHFFFAOYSA-N 459.597 5.666 5 20 JKBD C[C@H]1C[C@@H](C)CN(c2ccc(C(=O)Nc3ccc(Sc4nncs4)cc3)cc2[N+](=O)[O-])C1 604119618 XHMMNUHSNMLTGI-GASCZTMLSA-N 469.592 5.332 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Cl)[C@H](NCC1CCN(Cc2ccccc2)CC1)c1ccccc1 604435231 DELHJKHBKUPCAN-AREMUKBSSA-N 493.007 5.430 5 20 JKBD CCOCc1cccc(NC(=O)c2ccccc2C(=O)c2ccc(SC)c([N+](=O)[O-])c2)c1 608807420 KUYUANBWERREBD-UHFFFAOYSA-N 450.516 5.337 5 20 JKBD COc1ccc(C[C@H](N[C@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)c2ccccc2)cc1OC 608980684 FUHKKUDKTRQANV-VGSWGCGISA-N 474.517 5.297 5 20 JKBD CC(C)N(C)C(=O)c1ccc(Cl)c(NC(=O)c2ccc(Nc3ccccc3)c([N+](=O)[O-])c2)c1 609100465 SMHFLBZKVWBUKE-UHFFFAOYSA-N 466.925 5.725 5 20 JKBD C[C@@H](NCc1ccc(Oc2ccccc2Cl)c([N+](=O)[O-])c1)c1ccc2c(c1)CC(=O)N2C 728302842 YWQHGFJPFRHZQM-OAHLLOKOSA-N 451.910 5.410 5 20 JKBD Cc1cccc(C(=O)OCc2cc([N+](=O)[O-])ccc2OC(C)C)c1NC(=O)c1ccoc1C 729120200 QPKDTFGIUPKJKK-UHFFFAOYSA-N 452.463 5.201 5 20 JKBD COc1ccc(CNCC(=O)Nc2cc(Cl)ccc2Cl)cc1OCc1ccc([N+](=O)[O-])cc1 743636492 ACHAODLKURKLRE-UHFFFAOYSA-N 490.343 5.218 5 20 JKBD CN(Cc1nc2ccccc2s1)C(=O)c1ccccc1NC(=O)c1ccc([N+](=O)[O-])cc1Cl 744322491 WTKXBQWHRPZWAT-UHFFFAOYSA-N 480.933 5.382 5 20 JKBD C[C@H](OC(=O)c1csc(-c2cccc([N+](=O)[O-])c2)n1)C(=O)c1ccc(NC(=O)C(C)(C)C)cc1 747961737 HIEQRWHGQYEJRX-AWEZNQCLSA-N 481.530 5.131 5 20 JKBD C[C@@H](Nc1ccc(-c2nc([C@@H]3CCC(=O)N(CC4CCCC4)C3)no2)cc1[N+](=O)[O-])c1ccccn1 856577522 IARIZVKKLGPONK-YLJYHZDGSA-N 490.564 5.109 5 20 JKBD CC(C)c1ccc(-c2nc(C(=O)O[C@H](C)c3nnc(-c4ccc([N+](=O)[O-])cc4)o3)cs2)cc1 900255559 LBXNMXFHGMXPEW-CQSZACIVSA-N 464.503 5.810 5 20 JKBD Cc1ccccc1-c1cc(C(=O)OCc2nc(-c3cccc([N+](=O)[O-])c3)no2)c2cnn(C(C)C)c2n1 914801113 IOSRHDBIHOKDHW-UHFFFAOYSA-N 498.499 5.303 5 20 JKBD CCc1cccc[n+]1/C(C(=S)Nc1c(C(C)C)cccc1C(C)C)=C(/O)c1cccc([N+](=O)[O-])c1 917610625 NVEWCJQDBQFQLA-UHFFFAOYSA-O 490.649 7.015 5 20 JKBD O=C(Nc1ccccc1SC[C@H]1CC1(Cl)Cl)c1ccc(-n2ccnc2)c([N+](=O)[O-])c1 917750202 PSVWIXWKDXRHMR-CQSZACIVSA-N 463.346 5.319 5 20 JKBD O=C(CN(Cc1ccc(Cl)cc1)C(=O)/C=C\c1ccc([N+](=O)[O-])cc1)Nc1ccccc1F 918625532 ZVPRWLPIBZQRBN-ZROIWOOFSA-N 467.884 5.068 5 20 JKBD COc1cc(C(=O)O[C@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2C(F)(F)F)ccc1OC1CCCC1 919447954 LYGPRENXOHDUDP-CYBMUJFWSA-N 496.438 5.128 5 20 JKBD CC1=C(C(=O)Nc2cccc([N+](=O)[O-])c2)[C@@H](c2ccc(O)c(Cl)c2)NC(=S)N1c1ccccc1 921294340 HGHSHMOFYYMSME-JOCHJYFZSA-N 494.960 5.302 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)[C@H]3C[C@@H]3c3ccc(F)c(F)c3)CCC2)cc1)c1ccc([N+](=O)[O-])o1 1785748798 RUMZMDUKPGMIPW-MSOLQXFVSA-N 481.455 5.017 5 20 JKBD CN(C)c1ccc(C(=O)Nc2ccc(C3(NC(=O)c4ccc([N+](=O)[O-])o4)CCC3)cc2)c2ccccc12 1788990272 IHBWUQPDDRNBDO-UHFFFAOYSA-N 498.539 5.469 5 20 JKBD O=C(/C=C/c1ccccc1[N+](=O)[O-])Nc1ccc(C2(NC(=O)Cc3cccnc3Cl)CCC2)cc1 1792315492 SLJKHUFHEQYMGO-MDWZMJQESA-N 490.947 5.033 5 20 JKBD Cc1c(C(=O)NC[C@H]2CCN(C(=O)CCC3CCCC3)[C@H]2c2cccnc2)cc(Cl)cc1[N+](=O)[O-] 1811794275 MMCIBIWZFOJZOX-NLFFAJNJSA-N 499.011 5.242 5 20 JKBD O=C(CCc1cccc([N+](=O)[O-])c1)Nc1cc([C@H]2CCCCN2C(=O)c2ccc(C3CC3)cc2)[nH]n1 1815538822 YRHHJRXMGMHENQ-XMMPIXPASA-N 487.560 5.134 5 20 JKBD Cc1c(C(=O)N2CCCC[C@H]2c2cc(NC(=O)C3(F)CCCCC3)n[nH]2)cc(Cl)cc1[N+](=O)[O-] 1818881238 AWPIUFQMQCBYCM-SFHVURJKSA-N 491.951 5.258 5 20 JKBD Cc1cc(Cl)ccc1C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cc(F)cc([N+](=O)[O-])c2)n[nH]1 1821163576 SSEHUSUMHUQCTQ-HXUWFJFHSA-N 485.903 5.039 5 20 JKBD CC[C@H](C)[C@H](C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2ccc([N+](=O)[O-])o2)CC1)c1ccccc1 1826419308 REXAOGKRZLYJJQ-SWHJIRTISA-N 481.593 5.251 5 20 JKBD O=C(/C=C/C1CC1)N1CCC([C@@H]2CCCCN2C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)CC1 1831059662 JMRNSXAWUZFOSS-JLXBBBJOSA-N 467.591 5.009 5 20 JKBD O=C(C1CCCCC1)N1CCC([C@@H]2CCCCN2C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)CC1 1831061243 QATRVECRLPVJRQ-QFIPXVFZSA-N 483.634 5.623 5 20 JKBD O=C(c1ccnc2ccccc12)N1CCC([C@H]2CCCCN2C(=O)/C=C/c2ccccc2[N+](=O)[O-])CC1 1832906866 GUEBXZGSNPDRSB-WUZNFDRSSA-N 498.583 5.090 5 20 JKBD Cc1ccc([N+](=O)[O-])cc1NC(=O)CSc1nnc(-c2ccc(Cl)cc2Cl)n1C(C)C 9826359 AKDBMDDDUCTXLG-UHFFFAOYSA-N 480.377 5.780 5 20 JKBD COc1ccc(-c2csc(NC(=O)c3cc(OC)c(OC(F)F)cc3[N+](=O)[O-])n2)cc1Cl 10967884 PGEYYLOQBVTCJE-UHFFFAOYSA-N 485.852 5.243 5 20 JKBD C[C@H](Sc1nc2cc3ccccc3cc2c(=O)n1C)C(=O)Nc1ccc(Cl)cc1C(F)(F)F 18591149 WZWQEJFXWGRSMB-LBPRGKRZSA-N 491.922 5.878 5 20 JKBD Cc1occc1-c1nnc(S[C@H](C)C(=O)Nc2cc([N+](=O)[O-])ccc2Cl)n1-c1ccccc1 22217266 MJCZFRSPIBBZGD-CQSZACIVSA-N 483.937 5.517 5 20 JKBD C[C@@H](OC(=O)c1cc(Cl)ccc1[N+](=O)[O-])C(=O)Nc1c(Cl)cc(Cl)cc1Cl 28670254 KNQNUQYDTUECDH-SSDOTTSWSA-N 452.077 5.392 5 20 JKBD C[C@H]1c2cccn2CCN1C(=O)C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1 30260899 SHDAZOYFAPRCRF-STZPCZCHSA-N 458.543 5.540 5 20 JKBD CCOc1cc(C(=O)Nc2nc(-c3ccc(C(C)(C)C)cc3)cs2)c([N+](=O)[O-])cc1OC 45633395 UEKPRLDIQKSVTP-UHFFFAOYSA-N 455.536 5.675 5 20 JKBD COc1ccc(CSCC(=O)N[C@H](C)c2sc(-c3ccc(F)cc3)nc2C)cc1[N+](=O)[O-] 303304347 ZJXNSPYISZXMLZ-CYBMUJFWSA-N 475.567 5.285 5 20 JKBD Cc1ccc(C(=O)N(C)C)cc1NC(=O)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1 481525970 HWOTZZXXPSXSSC-UHFFFAOYSA-N 453.882 5.303 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)Nc2ccc(F)c(NC(=O)C3CCCCC3)c2)cc1SC 483016481 QJKGHEXOCANIJS-UHFFFAOYSA-N 461.515 5.236 5 20 JKBD O=c1c2cc([N+](=O)[O-])ccc2nc2n1CC/C2=C/c1csc(-c2ccc(C(F)(F)F)cc2)n1 497687821 XKWVIHLSQXRRSP-LCYFTJDESA-N 470.432 5.391 5 20 JKBD C[C@@H](Sc1nnc(-c2ccc(F)cc2)c2ccccc12)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 501187029 OURWGLFUHTYHRC-CQSZACIVSA-N 473.489 6.247 5 20 JKBD COc1cc(C(=O)Nc2ccc(CN3CCCC[C@@H]3C)cc2)c([N+](=O)[O-])cc1OCc1cscn1 503162291 ROHXPRFARVENNX-KRWDZBQOSA-N 496.589 5.266 5 20 JKBD O=C(c1cc([N+](=O)[O-])ccc1Sc1ccc(Cl)cc1)N1CCC(OC2CCCC2)CC1 503352853 LDTVGOQTAVLSEM-UHFFFAOYSA-N 460.983 5.963 5 20 JKBD Cc1nn(Cc2ccc(C(=O)N[C@@H]3CCOc4c(-c5ccccc5)cccc43)cc2)c(C)c1[N+](=O)[O-] 505173498 QRWKDYDEGXAHPI-RUZDIDTESA-N 482.540 5.377 5 20 JKBD Cc1ncc([N+](=O)[O-])cc1C(=O)N(C)Cc1cn(-c2ccccc2)nc1-c1ccc(Cl)cc1 506819770 LOJOBWCJDQXCNQ-UHFFFAOYSA-N 461.909 5.077 5 20 JKBD Cc1cc(C(=O)N(C[C@@H]2CCCO2)c2nc(-c3cccc(C(F)(F)F)c3)cs2)cc([N+](=O)[O-])c1 518907568 STWOCLGPASPWLM-IBGZPJMESA-N 491.491 5.871 5 20 JKBD C[C@H]1CCCN(c2ccc(C(=O)Nc3ccc(NC(=O)c4cccs4)cc3)cc2[N+](=O)[O-])C1 523334363 DDGIDOFGTGYEDA-INIZCTEOSA-N 464.547 5.397 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Cl)[C@@H](NCc1cc2ccccc2s1)c1ccccc1 560865777 JENJZVKGMMEMIX-QFIPXVFZSA-N 451.935 5.933 5 20 JKBD C[C@H]1C[C@H](C)CN(c2ccc(C(=O)Nc3ccc(NC(=O)c4ccco4)cc3)cc2[N+](=O)[O-])C1 591338656 WZYKLYBVNCEDKC-IRXDYDNUSA-N 462.506 5.175 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Br)[C@H](Nc1cccc(OC(F)F)c1)c1ccccc1 604045547 SIHJZLAURCEVND-LJQANCHMSA-N 492.276 5.751 5 20 JKBD CCCN(CC(F)(F)F)C(=O)C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1 604243672 DAZNIMNIAGCGSP-VBKFSLOCSA-N 463.481 5.936 5 20 JKBD COC(=O)c1cc(Oc2ccccc2)ccc1NC(=O)c1cc(OC)c(OC(F)F)cc1[N+](=O)[O-] 604427434 AGOSZRQJHPTNOZ-UHFFFAOYSA-N 488.399 5.036 5 20 JKBD CCCOc1cc(NC(=O)N2CCC[C@@H]2c2cccc3c2OCCO3)c([N+](=O)[O-])cc1OCCC 608993603 FHLWGLNDZZMGLX-LJQANCHMSA-N 485.537 5.313 5 20 JKBD C[C@@H](c1ccc(Cl)cc1)N(C)C(=O)CSc1nc2cc3ccccc3cc2c(=O)n1C 613973436 XFSJZVFYBGMIPR-HNNXBMFYSA-N 451.979 5.052 5 20 JKBD C[C@H](NC(=S)/C(=C(/O)c1cccc([N+](=O)[O-])c1)[n+]1ccc2c(c1)CCCC2)c1cccs1 726579927 NYXBFRCKIGMZEN-INIZCTEOSA-O 466.608 5.385 5 20 JKBD CC(C)(C(=O)OCC(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F)c1cccc(C(F)(F)F)c1 727220347 TXTVLZWQCARUPX-UHFFFAOYSA-N 478.345 5.092 5 20 JKBD C/C(=C/C(=O)O[C@@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F)c1ccccc1Cl 727574281 HPCGVZSSNGPZOM-MMRAYRKESA-N 456.804 5.241 5 20 JKBD Cc1cc(C)c(NC(=O)N2CCN(c3ccc([N+](=O)[O-])cc3C(F)(F)F)CC2)c(Cl)c1 727585304 CPKJCFVMMDGIGL-UHFFFAOYSA-N 456.852 5.238 5 20 JKBD O=C(CCC(=O)c1ccc2ccc3cccc4ccc1c2c34)Nc1cccc(CN2CCCC2=O)c1 727754681 WDSPEEJTBBKDRS-UHFFFAOYSA-N 474.560 6.308 5 20 JKBD O=C(NC1CCN(C(=O)CCC(=O)c2ccc3ccc4cccc5ccc2c3c45)CC1)c1ccsc1 728152215 XFFONLDUOZDBLT-UHFFFAOYSA-N 494.616 6.029 5 20 JKBD Cc1nc(CCC(=O)O[C@H](C)c2cccc([N+](=O)[O-])c2)oc1-c1ccc(Br)cc1 730606452 TZOKXVVTKCYYOA-CQSZACIVSA-N 459.296 5.558 5 20 JKBD CCCOc1cc(NC(=O)N2CCC([C@@H](O)c3ccc(F)cc3)CC2)c([N+](=O)[O-])cc1OCCC 731106504 WNFYMBUSSDNRCO-DEOSSOPVSA-N 489.544 5.289 5 20 JKBD COc1ccc(-c2cc(C(=O)O[C@@H](C)c3nnc(-c4ccc([N+](=O)[O-])cc4)o3)sc2C)cc1 746154393 NZKQARQQNGAFMI-ZDUSSCGKSA-N 465.487 5.608 5 20 JKBD Cc1c(C(=O)Nc2ccc(C(=O)N(C)C3CCCCC3)c(Cl)c2)cc([N+](=O)[O-])c(C)c1[N+](=O)[O-] 748624985 VIIRYHQBYHWEPK-UHFFFAOYSA-N 488.928 5.430 5 20 JKBD CC(C)(C)OC(=O)COC(=O)C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1 804861066 USQFACFWWHGWQU-VBKFSLOCSA-N 454.504 5.020 5 20 JKBD C[C@@H](OC(=O)c1cc(Cl)ccc1[N+](=O)[O-])C(=O)N1c2ccccc2Sc2ccccc21 824291101 ZBSZQCSTDOEHJS-CYBMUJFWSA-N 454.891 5.623 5 20 JKBD C[C@@H](NC(=O)OC(C)(C)C)c1ccc(NCc2c(Br)cccc2[N+](=O)[O-])cc1 864023905 SGKGDLUFDRVWCN-CYBMUJFWSA-N 450.333 5.555 5 20 JKBD O=C(Nc1ccc(N2C(=O)CCCC2=O)cc1)c1cc([N+](=O)[O-])ccc1Sc1ccc(Cl)cc1 915296908 ZAQDTRNKVPBTGV-UHFFFAOYSA-N 495.944 5.695 5 20 JKBD O=C(COc1ccc(C(F)(F)F)cc1)Oc1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2Cl)cc1 916037241 UNVDRHZINIJFRL-UHFFFAOYSA-N 494.809 5.504 5 20 JKBD COc1cccc(CN2CCC(NC(=O)c3ccc(Oc4ccc(Cl)cc4[N+](=O)[O-])cc3)CC2)c1 918653667 QHIHOKKVTNYMLE-UHFFFAOYSA-N 495.963 5.444 5 20 JKBD CC(=O)N(c1ccc(Cl)cc1)c1nc(COC(=O)c2cc([N+](=O)[O-])ccc2Cl)cs1 918854835 JUIRQRCDRJBRME-UHFFFAOYSA-N 466.302 5.400 5 20 JKBD O=C(OCc1nc(-c2ccc([N+](=O)[O-])cc2)no1)c1ccc(Oc2ccc(C(F)(F)F)cn2)cc1 918920722 QELWZLFYNPCIPR-UHFFFAOYSA-N 486.362 5.208 5 20 JKBD Cc1ccc(C(=O)NC2(c3ccc(NC(=O)Cc4ccc(Cl)cc4[N+](=O)[O-])cc3)CCC2)o1 1786115129 WRJFGGSWOBTXGD-UHFFFAOYSA-N 467.909 5.140 5 20 JKBD Cn1ccc(C(=O)NC2(c3ccc(NC(=O)c4cc5cc([N+](=O)[O-])ccc5s4)cc3)CCC2)c1 1791011210 QIQHOSDLPRSAON-UHFFFAOYSA-N 474.542 5.210 5 20 JKBD O=C(Cc1cc(F)ccc1[N+](=O)[O-])Nc1ccc(C2(NC(=O)c3cc4sccn4c3)CCC2)cc1 1792310373 BFABEWAZYFBOMA-UHFFFAOYSA-N 492.532 5.039 5 20 JKBD O=C(/C=C/c1ccccc1[N+](=O)[O-])Nc1cc([C@H]2CCCCN2C(=O)c2sccc2Cl)[nH]n1 1823504444 LYXFOUUPBOVJKF-GFOMBABLSA-N 485.953 5.052 5 20 JKBD O=C(c1ccc([N+](=O)[O-])o1)N1CCC([C@@H]2CCCCN2C(=O)c2cc3cccc(F)c3s2)CC1 1828151735 IDDDFAZMPLSCEY-SFHVURJKSA-N 485.537 5.089 5 20 JKBD O=C(CCc1cccc([N+](=O)[O-])c1)N1CCC([C@@H]2CCCCN2C(=O)c2cc3[nH]ccc3s2)CC1 1828332418 SMLKHTRFZLTAFG-QFIPXVFZSA-N 494.617 5.004 5 20 JKBD Cc1ccc([C@@H](C)C(=O)N2CCCC[C@H]2C2CCN(C(=O)Cc3cc(F)ccc3[N+](=O)[O-])CC2)cc1 1831528265 LZHWVAJMELNJKA-NLFFAJNJSA-N 495.595 5.008 5 20 JKBD O=C(C1CC2(CCC2)C1)N1CCCC[C@H]1C1CCN(C(=O)C2(c3cccc([N+](=O)[O-])c3)CCC2)CC1 1832477100 PVNNLBAAJFBFQM-VWLOTQADSA-N 493.648 5.217 5 20 JKBD Cc1ccc(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)/C=C/c3ccc([N+](=O)[O-])o3)CC2)c(Cl)c1 1832604794 BZRFHWHGLPFYDV-MECCDNJOSA-N 485.968 5.096 5 20 JKBD CC(=O)N(c1nc(COC(=O)/C=C/c2ccc([N+](=O)[O-])cc2)cs1)c1ccc(C)cc1C 10757827 VVVYURVKMAVFHO-YRNVUSSQSA-N 451.504 5.109 5 20 JKBD O=C(O[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Br)c1ccccc1)c1c(F)cccc1F 11125027 ZGCBAZJEVNYTAX-LJQANCHMSA-N 491.244 5.172 5 20 JKBD Cn1cnnc1Sc1ccc(C(=O)Oc2ccc3cc(Br)ccc3c2)cc1[N+](=O)[O-] 15303016 UMKLKMPFJZRHDN-UHFFFAOYSA-N 485.319 5.009 5 20 JKBD Cc1nc(-c2ccc(Cl)cc2)sc1C(=O)O[C@@H](C)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 16698591 HULNXEYVAWQAFS-LBPRGKRZSA-N 470.894 5.648 5 20 JKBD O=C(CSc1nnc(-c2c[nH]c3ccccc23)n1C1CC1)Nc1ccc([N+](=O)[O-])cc1Cl 17881849 WNAKQCJWXXNJJM-UHFFFAOYSA-N 468.926 5.054 5 20 JKBD O=[N+]([O-])c1cc(S(=O)(=O)N2CCCCCC2)ccc1Sc1nnc(-c2ccccc2Cl)o1 20667087 KAORBFKRAPOTSP-UHFFFAOYSA-N 494.982 5.014 5 20 JKBD O=[N+]([O-])c1cccc(CSc2nnc(-c3cccnc3)n2-c2ccc(Br)cc2)c1 21341715 UIXLXMDCQPKFIM-UHFFFAOYSA-N 468.336 5.292 5 20 JKBD Cc1c(NC(=O)[C@H](C)Sc2nnc(-c3ccco3)n2C2CCCCC2)cccc1[N+](=O)[O-] 22282935 LDBSLEZQRNGRBD-HNNXBMFYSA-N 455.540 5.379 5 20 JKBD CC[C@@H](C)c1ccccc1NC(=O)[C@@H](C)OC(=O)c1ccc(Cn2nc(C)c([N+](=O)[O-])c2C)cc1 26160840 ASUXKWUCCMTFIN-VQIMIIECSA-N 478.549 5.154 5 20 JKBD COc1cc(CNC(=O)c2cc3ccccc3c3cccnc23)cc(Br)c1OC 72056167 LRCMBMHASQGQBD-UHFFFAOYSA-N 451.320 5.098 5 20 JKBD O=[N+]([O-])c1ccc(Sc2nnc(-c3ccccc3F)n2Cc2ccccc2)c2ccncc12 105330591 UGNZKUSPNJUVKM-UHFFFAOYSA-N 457.490 5.740 5 20 JKBD CCOc1c(Cl)cc(CNC(=O)c2ccc(N[C@@H](C)c3ccccn3)c([N+](=O)[O-])c2)cc1OC 108832023 UNDJCGOERGNOIP-HNNXBMFYSA-N 484.940 5.154 5 20 JKBD O=C(Cc1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1)N1CC[C@H](c2ccccc2)C1 303033496 XVFWIDXHLNGRAV-QFIPXVFZSA-N 452.514 5.006 5 20 JKBD Cc1cc(N(C)C)ccc1NC(=O)Cc1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1 482640780 ZUQDVVOLBCFWHF-UHFFFAOYSA-N 455.518 5.003 5 20 JKBD CN(CC(F)(F)F)C(=O)c1c2c(nc3ccccc13)/C(=C/c1cccc([N+](=O)[O-])c1)CCC2 485317283 KETRXAZEUHMJJV-FOWTUZBSSA-N 455.436 5.654 5 20 JKBD C[C@H]1C[C@@H](C)CN(C(=O)c2ccccc2NC(=O)c2csc(-c3cccc([N+](=O)[O-])c3)n2)C1 496355242 CSSIUXAKOXANBY-IYBDPMFKSA-N 464.547 5.089 5 20 JKBD Cc1ncc(CN(C)C(=O)c2ccc(Sc3nc4ccccc4s3)c([N+](=O)[O-])c2)s1 502957374 QLISRULOIKSQBG-UHFFFAOYSA-N 456.574 5.393 5 20 JKBD C[C@@H]1Cc2cc([N+](=O)[O-])ccc2N1C(=O)c1ccc(NC(=O)c2cccc(Br)c2)cc1 504393565 HLCUFXYTHPYGFS-CQSZACIVSA-N 480.318 5.201 5 20 JKBD CCN(C(=O)c1ccc(N[C@H](C)c2ccccn2)c([N+](=O)[O-])c1)[C@@H](C)c1cc2ccccc2o1 509700692 ULISVVCACZLUCY-MSOLQXFVSA-N 458.518 6.132 5 20 JKBD C[C@H](Nc1ccc(C(=O)N(C2CC2)[C@@H](C)c2ccccc2Cl)cc1[N+](=O)[O-])c1ccccn1 512099767 NHZBOCNGVHHGOT-IRXDYDNUSA-N 464.953 6.182 5 20 JKBD COCCOc1ccccc1NC(=O)C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1 512146094 GDEQSBFGWAWVRW-MNDPQUGUSA-N 489.553 5.799 5 20 JKBD Cc1ccc(NC(=O)c2ccc(NCc3ccccc3)c([N+](=O)[O-])c2)cc1NC(=O)c1ccncc1 520061769 AUEJCSOUBJHVKH-UHFFFAOYSA-N 481.512 5.415 5 20 JKBD COc1cc(CNCc2ccc(Oc3ccccc3Cl)c([N+](=O)[O-])c2)ccc1OC(F)F 520953546 NPPLVHXHYJWUIX-UHFFFAOYSA-N 464.852 5.940 5 20 JKBD COc1cc(Cl)c(C)cc1NC(=O)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 598916709 JBDVYUGNLHNKAZ-UHFFFAOYSA-N 471.863 5.439 5 20 JKBD Cc1ccc(-n2c(SCCC(=O)Nc3ccc([N+](=O)[O-])cc3C)nnc2-c2ccccn2)c(C)c1 603917976 PSLJIBZLWSAWCZ-UHFFFAOYSA-N 488.573 5.284 5 20 JKBD CC(=O)Nc1ccc(C)c(N[C@@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2ccccc2)c1 604043755 CZINLCCCUYAQSR-JOCHJYFZSA-N 452.898 5.307 5 20 JKBD Cc1nc(CNC(=O)c2ccc(NCc3ccccc3Cl)c([N+](=O)[O-])c2)nc2ccccc12 608809109 REZOMVNBNFQDBH-UHFFFAOYSA-N 461.909 5.042 5 20 JKBD C[C@@H]1CCCN(c2ccc(C(=O)Nc3ccc(C(=O)Nc4cccnc4)c(Cl)c3)cc2[N+](=O)[O-])C1 608874420 FTZXUWZNEFPIRL-MRXNPFEDSA-N 493.951 5.384 5 20 JKBD CN1CCN(C(=O)C/C(=C\c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)[C@@H](c2ccccc2)C1 612591603 DJDCEZKCIUALJJ-CUPKDKKMSA-N 498.608 5.651 5 20 JKBD Cc1nc(NC(=O)Cn2c3ccccc3c(=O)c3ccccc32)sc1Cc1cccc(F)c1 614783096 NWHWGRJVYIGWEP-UHFFFAOYSA-N 457.530 5.288 5 20 JKBD CCOC(=O)Nc1ccc(OC(=O)C2CCN(c3ccc(C(F)(F)F)cc3[N+](=O)[O-])CC2)cc1 730754366 UHTLCXBESLGOJE-UHFFFAOYSA-N 481.427 5.004 5 20 JKBD C[C@@H](Nc1ccc(C(=O)N2CCC[C@@H](Oc3ccc(C4CC4)cn3)C2)cc1[N+](=O)[O-])c1ccccn1 858034284 YHJAGLFPMMBGSZ-XMSQKQJNSA-N 487.560 5.119 5 20 JKBD O=[N+]([O-])c1ccc(I)c(-c2nc(-c3cccnc3Oc3ccccc3)no2)c1 904455014 XCXZYVXXGFTIJX-UHFFFAOYSA-N 486.225 5.104 5 20 JKBD COc1cc(COC(=O)c2cc(C3CC3)nc3onc(C(C)C)c23)c([N+](=O)[O-])cc1OC(F)F 915576482 GTWGORMLLPTVCM-UHFFFAOYSA-N 477.420 5.099 5 20 JKBD O=C(Nc1cc(N2CCCC2=O)ccc1F)c1cc([N+](=O)[O-])ccc1Sc1ccccc1 917797515 XTSKSKSHACBMGB-UHFFFAOYSA-N 451.479 5.264 5 20 JKBD Cc1ccc(NC(=O)[C@H](OC(=O)Cc2nc(-c3ccccc3)oc2C)c2ccccc2)c([N+](=O)[O-])c1 918941371 KOIHMQNMKXGMDD-RUZDIDTESA-N 485.496 5.332 5 20 JKBD O=C(Cc1ccc([N+](=O)[O-])cc1F)NC1(c2ccc(NC(=O)C3CCC(F)(F)CC3)cc2)CCC1 1786245902 IACANQSMBZWRGU-UHFFFAOYSA-N 489.494 5.236 5 20 JKBD CNc1ccc(C(=O)Nc2ccc(C3(NC(=O)Cn4ccc5ccc([N+](=O)[O-])cc54)CCC3)cc2)cc1 1788000258 HIROENSQLNUKMR-UHFFFAOYSA-N 497.555 5.039 5 20 JKBD CC(C)(C)c1cc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cc4cc([N+](=O)[O-])ccc4s2)C3)c[nH]1 1794610361 RJBISCOLSBGVPM-BCDXTJNWSA-N 480.590 5.001 5 20 JKBD Cc1ccc(CCC(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cccc(F)c2[N+](=O)[O-])c2ccccc12 1800532210 BRJQLDUSPUPTSX-WKCHPHFGSA-N 489.547 5.080 5 20 JKBD COc1cccc(Cl)c1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cc3cc([N+](=O)[O-])ccc3s1)C2 1803752149 YJTJPBLALIPFHA-MUJYYYPQSA-N 499.976 5.037 5 20 JKBD O=C(Nc1cc([C@@H]2CCCCN2C(=O)CCc2cccc([N+](=O)[O-])c2)[nH]n1)c1ccc(Cl)c(F)c1 1821039606 OXDLLWSFXIJJJK-NRFANRHFSA-N 499.930 5.049 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cc3ccccc3o2)[nH]n1 1821284042 PZICFOKPIPVZSU-IBGZPJMESA-N 491.479 5.131 5 20 JKBD CC(C)(C)c1cc(C(=O)N2CCC([C@@H]3CCCCN3C(=O)CCc3cccc([N+](=O)[O-])c3)CC2)c[nH]1 1824838659 MYINFQZJZXGEDE-DEOSSOPVSA-N 494.636 5.087 5 20 JKBD CC(C)(C)CC(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)CC1 1826337874 IEFKNWACCQZWHW-FQEVSTJZSA-N 471.623 5.479 5 20 JKBD Cc1c(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)C3CC4(CCC4)C3)CC2)cc(Cl)cc1[N+](=O)[O-] 1830736337 BJINKRMDZCZSTN-JOCHJYFZSA-N 488.028 5.370 5 20 JKBD CCN1C/C(=C\c2ccc(N(C)c3ccccc3)c([N+](=O)[O-])c2)c2nc3ccccc3c(C(=O)O)c2C1 16441017 XVWATTORGBPNNS-HMMYKYKNSA-N 494.551 5.985 5 20 JKBD C[C@H](c1nnc(-c2cccc(Cl)c2)o1)N1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 24811939 HDOSDEZFCNWEFZ-CYBMUJFWSA-N 481.862 5.200 5 20 JKBD CC(=O)N(c1nc(COC(=O)c2ccc(C)c([N+](=O)[O-])c2)cs1)c1c(C)cc(C)cc1Cl 25045574 LULBJLKCQQPRAC-UHFFFAOYSA-N 473.938 5.672 5 20 JKBD COc1ccc(-c2nnc(SCC(=O)Nc3cc([N+](=O)[O-])ccc3C)n2C2CCCCC2)cc1 28789219 JXNOCUZIRUIZIX-UHFFFAOYSA-N 481.578 5.406 5 20 JKBD O=[N+]([O-])c1ccc(-c2noc(CSc3nnc(-c4ccccc4F)n3Cc3ccccc3)n2)cc1 46864926 NORCZXUTWCNWDB-UHFFFAOYSA-N 488.504 5.383 5 20 JKBD C[C@H](NC(=O)C1CCN(c2ccccc2[N+](=O)[O-])CC1)c1ccc(NC(=O)c2ccc(F)cc2)cc1 68737192 ZIJFEJGNQRFPGV-SFHVURJKSA-N 490.535 5.080 5 20 JKBD CC1CCN(c2ccc([N+](=O)[O-])cc2C(=O)NCc2cn(-c3ccccc3)nc2-c2ccncc2)CC1 68797377 ROSFHWRJTKXCFO-UHFFFAOYSA-N 496.571 5.009 5 20 JKBD C[C@@H](Nc1ccc(C(=O)N2CCC[C@H]2Cc2ccccc2Cl)cc1[N+](=O)[O-])c1ccccn1 108892948 BNDOLXCSFGNQBJ-XLIONFOSSA-N 464.953 5.664 5 20 JKBD C[C@H](Sc1nc2sc(-c3ccccc3)cc2c(=O)n1C)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 115197433 UQQZZGPRZNGZIX-ZDUSSCGKSA-N 491.554 5.474 5 20 JKBD O=C(C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1)N1CCC[C@H]1c1cccc(F)c1 117569426 SPMPWRWOXKBJAG-IBGZPJMESA-N 465.447 5.333 5 20 JKBD C[C@H](NC(=O)c1ccccc1SCC(=O)NC12CC3CC(CC(C3)C1)C2)c1cccc([N+](=O)[O-])c1 195697034 SPNODHCCGSGEPW-AWYKWWOESA-N 493.629 5.263 5 20 JKBD O=C(Cn1c2ccccc2c(=O)c2ccccc21)Nc1ccc(OCc2cccc(F)c2)c(F)c1 303231621 YSDQZTWIIMRXON-UHFFFAOYSA-N 470.475 5.651 5 20 JKBD COc1ccc([C@@H](Cc2ccccc2C)NC(=O)c2cc(SC)c(OC)cc2[N+](=O)[O-])cc1OC 483612442 ICYPTNRKSQORFF-HXUWFJFHSA-N 496.585 5.365 5 20 JKBD Cc1cc(Sc2nnc(-c3ccc(Br)cc3)o2)nc(-c2ccc([N+](=O)[O-])cc2)n1 489233439 PONWNZXXXYHBSZ-UHFFFAOYSA-N 470.308 5.324 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Cl)[C@H](c1ccccc1)N1CCC(OC2CCCC2)CC1 503575108 ZJVOMGHSDIYIKB-QHCPKHFHSA-N 457.958 5.352 5 20 JKBD COCCSc1ccc([C@@H](C)Nc2ccc(S(=O)(=O)Nc3ccccc3)cc2[N+](=O)[O-])cc1 505615301 SNAKQGNJBBQOGY-QGZVFWFLSA-N 487.603 5.307 5 20 JKBD CCOC(=O)c1cc(C(=O)Nc2ccc(Cl)cc2C(=O)N2[C@H](C)CCC[C@H]2C)cc([N+](=O)[O-])c1 508305910 MUPSKQBWKVULHC-HUUCEWRRSA-N 487.940 5.080 5 20 JKBD CSCC[C@H](NC(=O)c1ccc([N+](=O)[O-])o1)C(=O)Nc1ccc(Oc2cc(C)cc(C)c2)cc1 508356846 ZGKWVIDGOUOMRZ-FQEVSTJZSA-N 483.546 5.087 5 20 JKBD COc1cc(CNCc2ccc(N3CCC(C)CC3)nc2)c([N+](=O)[O-])cc1OCc1ccccc1 509614591 BVEPKRQKQATUPP-UHFFFAOYSA-N 476.577 5.104 5 20 JKBD CC(=O)Nc1cc(NC(=O)c2ccc(Sc3nc4ccccc4s3)c([N+](=O)[O-])c2)ccc1F 514519275 SWYPQUKMFYOBQV-UHFFFAOYSA-N 482.518 5.706 5 20 JKBD Cc1c(NC(=O)c2ccccc2)cccc1NC(=O)c1ccc(NCc2ccccc2)c([N+](=O)[O-])c1 516131769 AKPSLUCCHXDJTQ-UHFFFAOYSA-N 480.524 6.020 5 20 JKBD O=C(Nc1nc(-c2ccc(OC(F)F)cc2OC(F)F)cs1)c1ccc(Cl)cc1[N+](=O)[O-] 518208545 BYXJAKLVGYKAJE-UHFFFAOYSA-N 491.806 5.827 5 20 JKBD Cc1cc(C(=O)N2CCCC[C@@H]2C)ccc1NC(=O)c1ccc(N2CCC(C)CC2)c([N+](=O)[O-])c1 520011672 AMLKTIKDFZDQQG-FQEVSTJZSA-N 478.593 5.406 5 20 JKBD O=C(Nc1ccccc1Br)C1CCN(C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)CC1 523175374 TYUODSVRMAICIE-UHFFFAOYSA-N 488.363 5.063 5 20 JKBD C[C@H]1c2ccsc2CCN1C(=O)C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1 590655413 SMCDTYSDNYUYOF-IYWFSZBXSA-N 475.595 6.343 5 20 JKBD CC(=O)Nc1cccc([C@@H](C)N(Cc2ccccc2)C(=O)c2ccn(-c3cccc([N+](=O)[O-])c3)n2)c1 603617179 SELNBQYBPMJFFW-LJQANCHMSA-N 483.528 5.143 5 20 JKBD C[C@@H](NC(=O)Cc1ccc(NC(=O)c2cccc(Br)c2)cc1)c1cccc([N+](=O)[O-])c1 603966912 MBKTZMRQYQSUMR-OAHLLOKOSA-N 482.334 5.030 5 20 JKBD Cc1cc(=O)n(-c2ccccc2)c(C)c1C(=O)Nc1nc(-c2cccc([N+](=O)[O-])c2)c(C)s1 603997895 XQHNDLBICNVVAF-UHFFFAOYSA-N 460.515 5.047 5 20 JKBD CN(C)CCn1cc(NC(=O)c2c3c(nc4ccccc24)/C(=C/c2ccc([N+](=O)[O-])cc2)CCC3)cn1 608878896 KQIFNQUGWJOVCB-CAPFRKAQSA-N 496.571 5.030 5 20 JKBD Cc1ccc(C(=O)N2CCC(NCc3ccc(Oc4ccc(Cl)cc4[N+](=O)[O-])cc3)CC2)cc1 608983141 KFXLTDUNMKIRCF-UHFFFAOYSA-N 479.964 5.743 5 20 JKBD C[C@@H](NCc1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1)c1nc2ccccc2n1C(F)F 609006708 RCJAMSWZLAVKAW-CQSZACIVSA-N 472.879 6.636 5 20 JKBD O=C(Nc1ccc(OCc2cccc(C(F)(F)F)c2)cc1)c1cc2c(cc1[N+](=O)[O-])OCCO2 609066592 RDRWNLZYQZKDFS-UHFFFAOYSA-N 474.391 5.216 5 20 JKBD O=C(Cn1c2ccccc2c(=O)c2ccccc21)NCC1(c2cccc(Br)c2)CCC1 617421539 ZZNHMQLOLMLKPE-UHFFFAOYSA-N 475.386 5.155 5 20 JKBD C[C@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccc2c(c1)CCCN2C(=O)OC(C)(C)C 729412269 GHLNNAWDJKTAFQ-HNNXBMFYSA-N 457.552 5.402 5 20 JKBD Cc1cc(-c2cccc(Cl)c2)ccc1NC(=O)CNC(=O)c1c(Cl)cccc1[N+](=O)[O-] 731051912 UPOJRVQJSJSQRQ-UHFFFAOYSA-N 458.301 5.246 5 20 JKBD O=C(/C=C/c1nc2ccccc2s1)O[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1 849189631 CDGACOZRNBUYEW-MDRMPYQZSA-N 493.928 5.794 5 20 JKBD COc1ccc(Oc2ccc([N+](=O)[O-])cc2C(=O)O[C@H](C)C(=O)Nc2c(C)cc(C)cc2C)cc1 915443064 XQSGSVPHMOAXPE-GOSISDBHSA-N 478.501 5.505 5 20 JKBD C[C@@H](Nc1ccc(C(=O)OCc2nc3ccccc3n2C(F)F)cc1[N+](=O)[O-])c1ccccn1 920116456 DTUYAAXKLOQALL-CQSZACIVSA-N 467.432 5.265 5 20 JKBD Cc1cc(CCCC(=O)Nc2ccc(C3(NC(=O)c4cnoc4C)CCC3)cc2)c([N+](=O)[O-])cc1F 1786274921 QMPGSLPQGIUKNB-UHFFFAOYSA-N 494.523 5.109 5 20 JKBD Cc1cc(CCCC(=O)Nc2ccc(C3(NC(=O)C4=COCCC4)CCC3)cc2)c([N+](=O)[O-])cc1F 1786274992 VIMKRZKNSCSTMR-UHFFFAOYSA-N 495.551 5.193 5 20 JKBD CCc1ccnc(C(=O)Nc2ccc(C3(NC(=O)CSc4ccccc4[N+](=O)[O-])CCC3)cc2)c1 1788378738 PZGNZHQPAOPFHZ-UHFFFAOYSA-N 490.585 5.092 5 20 JKBD Cc1cc(C(=O)Nc2ccc(C3(NC(=O)[C@H](C)Sc4cccs4)CCC3)cc2)ncc1[N+](=O)[O-] 1788767074 WVUWSSAMUHNURH-INIZCTEOSA-N 496.614 5.288 5 20 JKBD COc1cc(C(=O)NC2(c3ccc(NC(=O)c4ccnc5ccccc45)cc3)CCC2)ccc1[N+](=O)[O-] 1788890721 HRQUNHJASXCLBJ-UHFFFAOYSA-N 496.523 5.213 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)c3ccc([N+](=O)[O-])cc3F)CCC2)cc1)c1cc2[nH]ccc2s1 1789104838 YTORDLXMGAWVKW-UHFFFAOYSA-N 478.505 5.338 5 20 JKBD CCOc1cccc(C(=O)Nc2ccc(C3(NC(=O)c4cc(F)cc([N+](=O)[O-])c4)CCC3)cc2)c1 1790342713 WECHMEOIKYKZDQ-UHFFFAOYSA-N 477.492 5.194 5 20 JKBD O=C(/C=C/C1CC1)NC1(c2ccc(NC(=O)c3cccc(Br)c3[N+](=O)[O-])cc2)CCC1 1790751521 IJAWEIXEQPVNBG-KPKJPENVSA-N 484.350 5.071 5 20 JKBD COc1cc(Cl)cc(C(=O)Nc2ccc(C3(NC(=O)/C=C/c4ccc([N+](=O)[O-])o4)CCC3)cc2)c1 1792147842 HLBWGBJKTXZAMA-VQHVLOKHSA-N 495.919 5.311 5 20 JKBD O=C(Cc1cc(F)ccc1[N+](=O)[O-])Nc1ccc(C2(NC(=O)c3cc4ccsc4[nH]3)CCC2)cc1 1792309132 CPALCKROQMNGJD-UHFFFAOYSA-N 492.532 5.267 5 20 JKBD Cc1scc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cc4cc([N+](=O)[O-])ccc4s2)C3)c1C 1795333637 VPFLPESBSLOQAO-BJWYYQGGSA-N 469.588 5.053 5 20 JKBD Cc1c(C(=O)Nc2cc([C@H]3CCCCN3C(=O)/C=C/c3ccccc3[N+](=O)[O-])[nH]n2)oc2ccccc12 1818571359 UUYPNVQZVUQAFP-DGXIYAMASA-N 499.527 5.392 5 20 JKBD COc1cc(C(=O)N2CCCC[C@H]2c2cc(NC(=O)CC3CCC(C)(C)CC3)n[nH]2)ccc1[N+](=O)[O-] 1820979558 PZPQQWOLBZGVHA-FQEVSTJZSA-N 497.596 5.239 5 20 JKBD Cc1cc(Cl)cc(C(=O)Nc2cc([C@H]3CCCCN3C(=O)c3cccc(F)c3[N+](=O)[O-])[nH]n2)c1 1823191674 FZLOYRAPDOEZCG-LJQANCHMSA-N 485.903 5.039 5 20 JKBD CC1(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3cc4cc([N+](=O)[O-])ccc4s3)CC2)CCC1 1823709696 NLOFOGPRUMVNGR-HXUWFJFHSA-N 469.607 5.233 5 20 JKBD Cc1oc(C(C)(C)C)cc1C(=O)N1CCCC[C@@H]1C1CCN(C(=O)/C=C/c2ccc([N+](=O)[O-])o2)CC1 1825947057 FPAVBFIAXXXXPR-DQACCSDVSA-N 497.592 5.333 5 20 JKBD O=C(/C=C/c1ccccc1)N1CCC([C@H]2CCCCN2C(=O)CSc2ccccc2[N+](=O)[O-])CC1 1831776056 ILBPCODMYKKPRN-YAOQVBECSA-N 493.629 5.020 5 20 JKBD Cc1cc([N+](=O)[O-])ccc1NC(=O)CSc1nnc(-c2ccccc2Cl)n1C1CCCC1 8988509 UKDWAQAYFVLUDZ-UHFFFAOYSA-N 471.970 5.661 5 20 JKBD CSc1ccc(NC(=O)COC(=O)c2cc([N+](=O)[O-])ccc2Sc2nc(C)cs2)cc1 11953739 PHVPIWMFAIAJCM-UHFFFAOYSA-N 475.573 5.028 5 20 JKBD COc1cc(C(=O)Nc2nc3ccc(Oc4ccccc4)cc3s2)c([N+](=O)[O-])cc1OC 14377321 ZTWFFPZDEMYXLY-UHFFFAOYSA-N 451.460 5.266 5 20 JKBD O=C(CSc1ccc(C(F)(F)F)cc1[N+](=O)[O-])N1CCC[C@@H]1c1nc2ccccc2s1 15566890 GIOIKYQOBZDKFF-CQSZACIVSA-N 467.494 5.679 5 20 JKBD C[C@H](OC(=O)c1cn(-c2ccccc2)nc1-c1cccs1)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 17530772 CKCDIBGVXPTFCG-HNNXBMFYSA-N 487.497 5.477 5 20 JKBD C[C@H](OC(=O)c1ccc(Nc2ccccc2)c([N+](=O)[O-])c1)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 17892051 NXXFXEZLNDWHRG-AWEZNQCLSA-N 475.417 5.215 5 20 JKBD Cc1nc(-c2cccc(NC(=O)c3ccc(NS(=O)(=O)c4cccc([N+](=O)[O-])c4)cc3)c2)cs1 18824759 JPGIZEWXIBSQES-UHFFFAOYSA-N 494.554 5.080 5 20 JKBD C[C@H](OC(=O)CCC(=O)c1ccc(-c2ccccc2)cc1)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 18959419 QLDNJMXMZWCERQ-KRWDZBQOSA-N 471.469 5.579 5 20 JKBD C[C@@H](OC(=O)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1)c1nc2ccccc2c(=O)[nH]1 23634561 JXCLOUQALNMIRQ-CYBMUJFWSA-N 465.849 5.195 5 20 JKBD Cc1ccc(N[C@@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Br)c2ccccc2)cc1F 25425420 SJVDLQZOSVLFSA-HXUWFJFHSA-N 458.287 5.597 5 20 JKBD CCc1cc(N2CCC[C@@H](c3nnc4ccc(C(F)(F)F)cn34)C2)nc(-c2ccc([N+](=O)[O-])cc2)n1 68754495 SYNWEAAOPIQALK-MRXNPFEDSA-N 497.481 5.060 5 20 JKBD Cc1cc(CSc2ccccc2C(=O)Nc2nc(-c3cccc([N+](=O)[O-])c3)cs2)on1 105147160 ZMZRFVBRECRIAY-UHFFFAOYSA-N 452.517 5.559 5 20 JKBD O=C(/C=C\c1ccc2ccccc2n1)O[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1 207428109 MJOAWYMIZUHBKZ-WCKUGHEZSA-N 487.899 5.733 5 20 JKBD Cc1ccc(Cn2c(SCc3nnc(-c4ccc([N+](=O)[O-])cc4)o3)nc3ccccc3c2=O)cc1 248063013 DGAMDZMDSABZCA-UHFFFAOYSA-N 485.525 5.004 5 20 JKBD Cc1cc(C)c2sc(N(Cc3ccccc3)C(=O)c3ccc(S(C)(=O)=O)c([N+](=O)[O-])c3)nc2c1 255938303 DHRUXAGDCREVKX-UHFFFAOYSA-N 495.582 5.072 5 20 JKBD CCOc1ccc(OCC)c(NC(=O)c2ccc(N[C@@H](C)c3ccccn3)c([N+](=O)[O-])c2)c1 506010191 QICBERASQDNXKW-INIZCTEOSA-N 450.495 5.213 5 20 JKBD O=[N+]([O-])c1cc(S(=O)(=O)N2CCCCCC2)ccc1SCc1coc(-c2ccccc2)n1 506332022 PPPOTNWHBSKLCF-UHFFFAOYSA-N 473.576 5.107 5 20 JKBD CCOc1cc([N+](=O)[O-])c(C(=O)Nc2ccc(Cl)cc2C(=O)N2[C@@H](C)CCC[C@@H]2C)cc1OC 508288230 MJSLYXBKJSZSAF-GJZGRUSLSA-N 489.956 5.311 5 20 JKBD COCCOc1cccc(N[C@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2ccccc2)c1 511020639 YWIXPSOKEFGYEG-QFIPXVFZSA-N 455.898 5.065 5 20 JKBD C[C@H](C(=O)Nc1cccc(NC(=O)c2cc([N+](=O)[O-])ccc2Sc2ccccc2)c1)n1cccn1 512396797 UPSAHRBXQQUZQY-QGZVFWFLSA-N 487.541 5.395 5 20 JKBD O=C(c1c2c(nc3ccccc13)/C(=C/c1cccc([N+](=O)[O-])c1)CCC2)N1CCCSCC1 512522516 VKPRMTAQUBFGQN-KNTRCKAVSA-N 459.571 5.599 5 20 JKBD Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)Nc1ccc(NC(=O)Nc2ccccc2Cl)cc1 517560400 NQEAATPNSDCITQ-UHFFFAOYSA-N 460.899 5.001 5 20 JKBD C[C@H](Nc1ccc(C(=O)Nc2c(F)cc(F)cc2-c2ccccc2)cc1[N+](=O)[O-])c1ccccn1 517908860 URJQUCOBYFBEPN-INIZCTEOSA-N 474.467 6.360 5 20 JKBD CSc1ccc([N+](=O)[O-])c(C(=O)Nc2cc(C(=O)Nc3cccc(C(F)(F)F)c3)ccc2C)c1 519953850 ZULPMXWFPIAONM-UHFFFAOYSA-N 489.475 6.149 5 20 JKBD O=C1CCCN1C[C@@H](NCc1ccc(-c2ccc([N+](=O)[O-])cc2)s1)c1cccc(C(F)(F)F)c1 520948968 LUSIGJNEJKRKGB-OAQYLSRUSA-N 489.519 5.795 5 20 JKBD O=[N+]([O-])c1ccc(-c2ccc(CN[C@H]3CCSc4c(F)cccc43)o2)c(Br)c1 520951174 TUOAFJAZVLRCPA-SFHVURJKSA-N 463.328 6.083 5 20 JKBD O=C(CC(F)(F)F)N1CCC(NCc2ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])cc2)CC1 520960074 FXTRVOYWZLQHNX-UHFFFAOYSA-N 471.863 5.074 5 20 JKBD O=C(c1ccc(NCc2ccccc2Cl)c([N+](=O)[O-])c1)N(Cc1ccncc1)C[C@H]1CCCO1 521272165 YMQGDCGWKUPOOV-OAQYLSRUSA-N 480.952 5.077 5 20 JKBD CCOC(=O)c1sc(-c2ccc(F)cc2)cc1NC(=O)c1cc(SC)c(OC)cc1[N+](=O)[O-] 560325223 RYWLGUQYAPPLLM-UHFFFAOYSA-N 490.534 5.622 5 20 JKBD O=C(Nc1ccccc1)c1ccc(Cl)c(NC(=O)c2cc(OCC(F)(F)F)ccc2[N+](=O)[O-])c1 603738279 CRQJXFXJKYCVTE-UHFFFAOYSA-N 493.825 5.694 5 20 JKBD COc1ccc(Oc2ccc([N+](=O)[O-])cc2C(=O)N(C)C[C@@H]2CCCO[C@@H]2c2ccccc2)cc1 604519598 HBNRRPXZYMYFHV-RXFWQSSRSA-N 476.529 5.636 5 20 JKBD CN(CCc1cccc2ccccc12)C(=O)c1ccccc1NC(=O)c1ccc([N+](=O)[O-])cc1Cl 725721339 BLRKWJIYBVZDCL-UHFFFAOYSA-N 487.943 5.968 5 20 JKBD O=C(CCc1cc(Br)cs1)Oc1ccc(NC(=O)c2cccc([N+](=O)[O-])c2)cc1 730469578 NLJQLKAYMNICER-UHFFFAOYSA-N 475.320 5.209 5 20 JKBD O=C(COC(=O)c1nc(-c2ccccc2)oc1-c1ccccc1)Nc1cc(Cl)ccc1[N+](=O)[O-] 731377218 PMWSAPCGGUTYRA-UHFFFAOYSA-N 477.860 5.366 5 20 JKBD O=C(Nc1cc(Cl)c([N+](=O)[O-])cc1OCc1ccccc1)c1cnc(-c2ccccc2)nc1 743607371 CMHCXCYLKUADKU-UHFFFAOYSA-N 460.877 5.537 5 20 JKBD CCN(Cc1ccc(OC)cc1OC)C(=O)c1ccccc1NC(=O)c1ccc([N+](=O)[O-])cc1Cl 745843607 INGZXNNHVYEGAX-UHFFFAOYSA-N 497.935 5.180 5 20 JKBD Cc1c(C(=O)Nc2ccccc2Oc2ncc(Cl)cc2Cl)cc([N+](=O)[O-])c(C)c1[N+](=O)[O-] 748621982 VGLUDGUKBZFVFX-UHFFFAOYSA-N 477.260 5.866 5 20 JKBD CC[C@@H](C)Sc1ccc(NC(=O)c2cc([N+](=O)[O-])c(C)c([N+](=O)[O-])c2)c(C(F)(F)F)c1 748658181 RGIHZCKFJWMTGL-SNVBAGLBSA-N 457.430 5.973 5 20 JKBD O=C(Nc1cccc(COc2ccccc2)c1)c1ccc([N+](=O)[O-])cc1I 751098995 UHPPUEMNVIJKLB-UHFFFAOYSA-N 474.254 5.031 5 20 JKBD O=C(Nc1cc(Cl)ccc1Cl)[C@@H]1CCCCN1C(=O)c1ccc(Cl)c([N+](=O)[O-])c1 751246579 NSDNDGVNLTZFNS-INIZCTEOSA-N 456.713 5.188 5 20 JKBD CC(=O)N(c1cccc(Cl)c1)c1nc(COC(=O)c2cc(Cl)ccc2[N+](=O)[O-])cs1 754673448 XGFREMKRTGNNHT-UHFFFAOYSA-N 466.302 5.400 5 20 JKBD CC1=C(C(=O)Nc2ccccc2C)[C@H](c2ccc(-c3ccccc3[N+](=O)[O-])s2)NC(=S)N1 812920076 SMTGEWVTGKTTBM-NRFANRHFSA-N 464.572 5.063 5 20 JKBD O=C(COC(=O)c1cc([N+](=O)[O-])ccc1N1CCCCC1)Nc1ccccc1-c1ccccc1 823215054 GBXUZZDFEJYNDB-UHFFFAOYSA-N 459.502 5.048 5 20 JKBD C[C@@H](NC(=O)c1cc([N+](=O)[O-])ccc1N1CCCCC1)c1cccc(NC(=O)c2ccccc2)c1 918613464 RGBZQHLDRYIYHU-LJQANCHMSA-N 472.545 5.328 5 20 JKBD O=C(COC(=O)c1ccc([N+](=O)[O-])cc1F)Nc1c(Cl)c(Cl)cc(Cl)c1Cl 919569411 ZZWNRJVKPOWCCN-UHFFFAOYSA-N 456.040 5.143 5 20 JKBD O=C(Oc1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2Cl)cc1)c1ccn(-c2cccc(F)c2)n1 920275092 CUPMSNLHEMOWKQ-UHFFFAOYSA-N 480.839 5.045 5 20 JKBD Cc1nc(-c2ccc(Cl)s2)sc1C(=O)O[C@@H](C)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl 921106265 NDJMLOVOUGDQMR-VIFPVBQESA-N 486.358 5.579 5 20 JKBD Cc1nscc1C(=O)NC1(c2ccc(NC(=O)Cc3ccc(Cl)cc3[N+](=O)[O-])cc2)CCC1 1786114905 MHAUIORYTPSUBG-UHFFFAOYSA-N 484.965 5.004 5 20 JKBD O=C(CSc1ccccc1[N+](=O)[O-])NC1(c2ccc(NC(=O)c3ccc(Cl)cn3)cc2)CCC1 1789733817 NAVLKFKFUDZLBE-UHFFFAOYSA-N 496.976 5.183 5 20 JKBD CC(C)=CCCC(=O)NC1(c2ccc(NC(=O)Cc3cc(F)ccc3[N+](=O)[O-])cc2)CCC1 1792310267 WUWLCYIBEWHESS-UHFFFAOYSA-N 453.514 5.157 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(Cl)c(Cl)cc1F 1803876025 AAMVYPVHGUNTPU-CLLJXQQHSA-N 498.313 5.054 5 20 JKBD Cc1c(C(=O)Nc2cc([C@H]3CCCCN3C(=O)[C@H]3CCC(F)(F)C3)[nH]n2)cc(Cl)cc1[N+](=O)[O-] 1821290290 TZFLRNFIHVJGRV-SUMWQHHRSA-N 495.914 5.021 5 20 JKBD Cc1cc(Cl)cc(C(=O)Nc2cc([C@H]3CCCCN3C(=O)c3ccc([N+](=O)[O-])cc3F)[nH]n2)c1 1823192519 ZUZDTBKVAMLOSX-HXUWFJFHSA-N 485.903 5.039 5 20 JKBD CC/C=C(\C)C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cc(Cl)cc([N+](=O)[O-])c2C)CC1 1830738924 YDDRBUYNPGDZDI-GSWGVQEBSA-N 461.990 5.146 5 20 JKBD CCOc1ccc(-c2nc(NC(=O)c3cc(OC)c(OC(F)F)cc3[N+](=O)[O-])sc2C)cc1 10960125 ZSHDBSYDCRKZSV-UHFFFAOYSA-N 479.461 5.288 5 20 JKBD Cc1nn(-c2ccc(F)cc2)c2sc(C(=O)O[C@@H](C)c3nnc(-c4ccc([N+](=O)[O-])cc4)o3)cc12 17530782 ZYSUTQYPSQQFMY-ZDUSSCGKSA-N 493.476 5.411 5 20 JKBD C[C@@H](Sc1nnc(Nc2ccc(OC(F)(F)F)cc2)s1)C(=O)Nc1ccccc1[N+](=O)[O-] 22181162 DAYCUKDVHXULFM-SNVBAGLBSA-N 485.469 5.208 5 20 JKBD Cc1ccc(NC(=O)c2cc3cc([N+](=O)[O-])ccc3s2)cc1S(=O)(=O)Nc1ccccc1F 22744020 XBZVLHFEYUCUHW-UHFFFAOYSA-N 485.518 5.310 5 20 JKBD C[C@@H](c1ccccc1)N(C)C(=O)C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1 25617889 SEYJWGSKVAMJFC-RWZYYMRUSA-N 457.555 6.355 5 20 JKBD COc1ccc2cc(C(=O)Oc3ccc(NC(=O)c4cc([N+](=O)[O-])ccc4Cl)cc3)c(C)nc2c1 27151805 XZJBMNNPRPRWHK-UHFFFAOYSA-N 491.887 5.585 5 20 JKBD Cc1cccc([N+](=O)[O-])c1NC(=O)CSc1nnc(-c2cccnc2)n1-c1ccccc1C(C)C 36795905 BMJGLTGIVXVZTK-UHFFFAOYSA-N 488.573 5.400 5 20 JKBD O=C(Nc1ccccc1C(=O)N1CCC(Cc2cccc(F)c2)CC1)c1ccc([N+](=O)[O-])cc1Cl 108638807 MVGQHWUTQJAFEP-UHFFFAOYSA-N 495.938 5.735 5 20 JKBD C[C@H](Nc1ccc(C(=O)N(C)Cc2ccc(Cl)c(Cl)c2)cc1[N+](=O)[O-])c1ccccn1 303058576 ZTEOXZUZVSMJJU-AWEZNQCLSA-N 459.333 5.742 5 20 JKBD O=C(NC[C@H]1CCCO[C@H]1c1ccccc1)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1 409556267 WBJSVZOOTQKUKR-DVECYGJZSA-N 466.921 5.938 5 20 JKBD CCOc1cc(NC(=O)NCc2ccc(Oc3cccnc3)c(F)c2)c([N+](=O)[O-])cc1OCC 409661903 YDCLTKKKHHUNFD-UHFFFAOYSA-N 470.457 5.040 5 20 JKBD COc1cc(C(=O)N[C@@H](c2ccccc2)c2ccc3c(c2)CCCO3)c([N+](=O)[O-])cc1OC(F)F 410048876 MILDKJXVTUSEIN-QHCPKHFHSA-N 484.455 5.049 5 20 JKBD O=C(c1ccc(NCc2ccccc2)c([N+](=O)[O-])c1)N1CCC(c2c[nH]c3ncccc23)CC1 410053416 GLBQOJNFWDFQOM-UHFFFAOYSA-N 455.518 5.103 5 20 JKBD O=C(Cn1c2ccccc2c(=O)c2ccccc21)N(Cc1ccc2c(c1)OCO2)C1CCCCC1 476834924 CMVDTDCITQNHAF-UHFFFAOYSA-N 468.553 5.245 5 20 JKBD COc1ccc(NC(=O)c2ccc(N3C[C@H](C)C[C@@H](C)C3)c([N+](=O)[O-])c2)c(C(F)(F)F)c1 488512754 IMCNDBGXKACJCG-ZIAGYGMSSA-N 451.445 5.357 5 20 JKBD Cc1noc(C)c1NC(=O)c1c2c(nc3ccccc13)/C(=C\c1ccc([N+](=O)[O-])cc1)CCC2 499450738 DZMTXPNPQLORSJ-JXAWBTAJSA-N 454.486 5.877 5 20 JKBD COc1ccc(CNC2CCN(Cc3ccccc3C)CC2)cc1OCc1ccc([N+](=O)[O-])cc1 512819930 FIRRRXAEZQGHGH-UHFFFAOYSA-N 475.589 5.245 5 20 JKBD COc1cc(C(=O)N(Cc2ccncc2)C[C@@H]2CCCO2)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 518694065 GGBXWZGZHJMHPA-FQEVSTJZSA-N 497.935 5.266 5 20 JKBD C[C@@H]1CCC[C@@H](C)N1C(=O)c1cc(Cl)ccc1NC(=O)c1ccn(-c2ccc([N+](=O)[O-])cc2)n1 520020612 YEARBJYWFHKSDD-HZPDHXFCSA-N 481.940 5.089 5 20 JKBD O=C(CN(Cc1ccco1)C(=O)c1ccc([N+](=O)[O-])s1)Nc1ccc(Cl)c(C(F)(F)F)c1 600670617 VKOIANVDISALMB-UHFFFAOYSA-N 487.843 5.203 5 20 JKBD COc1cc(C(=O)Nc2cc(-c3ccccc3)nn2-c2ccccc2C)c([N+](=O)[O-])cc1OC 603760255 IBHIEFFCSSCUBC-UHFFFAOYSA-N 458.474 5.025 5 20 JKBD O=C(Cc1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1)N[C@@H](CC(F)(F)F)c1ccccc1 604009183 DKLPKXSSHYRUIZ-QHCPKHFHSA-N 494.473 5.800 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)N[C@@H]2c3cc(Br)ccc3SC[C@H]2C)cc1SC 609218984 BAQRKUBPBVEPCW-MGNBDDOMSA-N 483.409 5.301 5 20 JKBD C[C@H](Sc1ncnc2sc3c(c12)CCCC3)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 619835577 NNJYMIIYFPMBTP-JTQLQIEISA-N 482.509 5.616 5 20 JKBD C[C@H](NCc1ccc(-c2ccccc2[N+](=O)[O-])s1)C(=O)Nc1cccc(N2CCCC2)c1 726605967 NJEDEWOVGAXPAE-KRWDZBQOSA-N 450.564 5.040 5 20 JKBD C[C@@H](Nc1ccc(C(=O)N2CCC[C@H]2c2ccccc2C(F)(F)F)cc1[N+](=O)[O-])c1ccccn1 728033406 LMNOBMDGOYQAHP-ZHRRBRCNSA-N 484.478 6.159 5 20 JKBD C[C@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccccc1C(=O)Nc1ccc(Cl)cn1 745407157 MNEXRVSYTLBJLJ-ZDUSSCGKSA-N 456.911 5.015 5 20 JKBD Cc1c(C(=O)O[C@H](C)C(=O)Nc2c(Cl)cc(Cl)cc2Cl)cc([N+](=O)[O-])c(C)c1[N+](=O)[O-] 748949467 HKNOCWBWPAQTOX-SECBINFHSA-N 490.683 5.264 5 20 JKBD Cc1sc(NC(=O)c2cc([N+](=O)[O-])ccc2Br)nc1-c1cccc(Cl)c1 751053446 CDEDQIRRHDJTIJ-UHFFFAOYSA-N 452.717 5.695 5 20 JKBD Cc1cc(NC(=O)c2ccccc2Cl)sc1C(=O)O[C@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1 915579031 PFWBYEYYYDPDKT-CYBMUJFWSA-N 487.921 5.054 5 20 JKBD COc1ccc(-c2[nH]c3ccccc3c2CCC(=O)Oc2cc([N+](=O)[O-])ccc2OC)c(OC)c1 920017896 NEOIKITVUWOBQO-UHFFFAOYSA-N 476.485 5.307 5 20 JKBD C[C@H](OC(=O)c1ccc(N[C@H](C)c2ccccn2)c([N+](=O)[O-])c1)C(=O)c1cccc(Cl)c1 920547572 OQNAWZXPKISCIE-CABCVRRESA-N 453.882 5.245 5 20 JKBD Cc1c(Cl)cccc1NC(=O)[C@@H](C)OC(=O)c1ccc(N[C@H](C)c2ccccn2)c([N+](=O)[O-])c1 920549427 XUQULNZBAZFIBS-HZPDHXFCSA-N 482.924 5.309 5 20 JKBD Cc1cccc(C(=O)Nc2ccc(C3(NC(=O)/C=C/c4ccc([N+](=O)[O-])o4)CCC3)cc2)c1F 1785943745 ZXVRTRXZNXAXIU-ZRDIBKRKSA-N 463.465 5.096 5 20 JKBD CC(C)c1cc(C(=O)Nc2ccc(C3(NC(=O)CCc4cccc([N+](=O)[O-])c4)CCC3)cc2)no1 1787544381 HBEQFSDTJDJYFN-UHFFFAOYSA-N 476.533 5.087 5 20 JKBD O=C(CSc1ccccc1[N+](=O)[O-])Nc1ccc(C2(NC(=O)c3cccs3)CCC2)cc1 1791521272 HCSQGIYJYWGTFB-UHFFFAOYSA-N 467.572 5.196 5 20 JKBD Cc1ccc(C(=O)N2CCCC[C@H]2C2CCN(C(=O)Cc3ccc(Cl)cc3[N+](=O)[O-])CC2)s1 1825785107 DWZFYCDYWTYPCD-FQEVSTJZSA-N 490.025 5.094 5 20 JKBD Cc1c(C(=O)N2CCCC[C@H]2C2CCN(C(=O)Cc3cccc([N+](=O)[O-])c3)CC2)oc2ccccc12 1828123733 JVDJGINWENOHAP-DEOSSOPVSA-N 489.572 5.125 5 20 JKBD CSc1ccc(C(=O)Nc2nnc(SCc3ccc(Cl)cc3)s2)cc1[N+](=O)[O-] 16008544 LGBBKVCCYMHFOX-UHFFFAOYSA-N 452.970 5.366 5 20 JKBD COc1cccc([C@@H](CNC(=O)c2ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])c(OC)c2)N(C)C)c1 18016938 ADCHCSFCAPWULN-OAQYLSRUSA-N 499.951 5.090 5 20 JKBD Cc1ccc(NC(=O)CSc2nnc(-c3ccc(Cl)cc3)n2Cc2ccco2)cc1[N+](=O)[O-] 21622975 JQPGOYULGJHBGN-UHFFFAOYSA-N 483.937 5.187 5 20 JKBD Cn1cnnc1Sc1ccc(C(=O)N[C@H](c2ccccc2)c2cc3ccccc3o2)cc1[N+](=O)[O-] 24877146 WFELDYBMYNBLPT-HSZRJFAPSA-N 485.525 5.140 5 20 JKBD CSc1ccc(C(=O)c2ccccc2C(=O)NCc2coc(-c3cccs3)n2)cc1[N+](=O)[O-] 26671327 DHKWPCVCEJYHOP-UHFFFAOYSA-N 479.539 5.194 5 20 JKBD O=C(c1ccc(NCc2ccccc2)c([N+](=O)[O-])c1)N1CCC[C@H](c2nc3ccccc3o2)C1 27374570 JULINFVOGITOKK-FQEVSTJZSA-N 456.502 5.368 5 20 JKBD Cc1c(C(=O)N[C@H](CC(=O)OC(C)C)c2ccccc2[N+](=O)[O-])sc2nc(C(F)(F)F)ccc12 29779470 GZYHHEKQCKNUSN-OAHLLOKOSA-N 495.479 5.345 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Cl)[C@H](N[C@@H]1CCSc2c(F)cccc21)c1ccccc1 30504648 DXVIFLBEBOIDEU-TZIWHRDSSA-N 471.941 5.894 5 20 JKBD CCOc1ccc(NC(=O)Cc2cn(-c3ccccc3)nc2-c2ccc([N+](=O)[O-])cc2)c(C)c1 195704785 YHRPYXMWYVILBB-UHFFFAOYSA-N 456.502 5.336 5 20 JKBD COc1cccc([C@H]2CCCN2C(=O)Cc2cn(-c3ccccc3)nc2-c2ccc([N+](=O)[O-])cc2)c1 248260164 VRONWNUQQFCYNC-AREMUKBSSA-N 482.540 5.362 5 20 JKBD COc1ccc([N+](=O)[O-])cc1NC(=O)c1ccccc1Sc1ncnc2sc(C)c(C)c12 480870546 BUYKQSHVFMWIOG-UHFFFAOYSA-N 466.544 5.628 5 20 JKBD COc1ccc([C@@H](CNC(=O)c2cc(SC)c(OC)cc2[N+](=O)[O-])c2c[nH]c3ccccc23)cc1 484933397 JKTJYVXICSKDDV-HXUWFJFHSA-N 491.569 5.377 5 20 JKBD CCOc1cc(Br)c(NC(=O)c2csc(-c3cccc([N+](=O)[O-])c3)n2)cc1OCC 496607793 AQXRRFMFJDCXII-UHFFFAOYSA-N 492.351 5.531 5 20 JKBD CCOc1cc(Br)c(CC(=O)N(Cc2ccc([N+](=O)[O-])cc2)C(C)C)cc1OCC 502011593 YVCXLTOZBYYMKG-UHFFFAOYSA-N 479.371 5.134 5 20 JKBD CCOc1cc(NC(=O)c2ccc(C)c(NC(=O)c3ccccc3)c2)c([N+](=O)[O-])cc1OCC 506621266 PLQUMHRZNQKMQD-UHFFFAOYSA-N 463.490 5.205 5 20 JKBD CSCC[C@H](NC(=O)c1ccc([N+](=O)[O-])o1)C(=O)Nc1ccc(Oc2ccccc2Cl)cc1 508279318 KAQZMJLPJAEGDV-KRWDZBQOSA-N 489.937 5.124 5 20 JKBD O=[N+]([O-])c1cc(CNCc2cccnc2OCC(F)(F)F)ccc1Oc1ccccc1Cl 509623305 YHVVFUQSPQXCGV-UHFFFAOYSA-N 467.831 5.666 5 20 JKBD O=C(Nc1cccc(NC(=O)c2ccc(Cl)cc2[N+](=O)[O-])c1)Nc1cccc(C(F)(F)F)c1 510287277 LHGZXCUGLUSYGB-UHFFFAOYSA-N 478.814 6.163 5 20 JKBD COc1cc(C(=O)N(C)[C@H](C)c2nc3ccccc3s2)c([N+](=O)[O-])cc1OCc1cscn1 512301906 WEULWHOUODCLAA-CYBMUJFWSA-N 484.559 5.082 5 20 JKBD CN(C(=O)c1ccc(NS(=O)(=O)c2ccc(Cl)cc2[N+](=O)[O-])cc1Cl)C1CCCCC1 515632086 IUQYHKBCTYPQSG-UHFFFAOYSA-N 486.377 5.107 5 20 JKBD CCSc1nnc(NC(=O)C/C(=C\c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)s1 516538356 JSRTVKARWJEFTQ-SDNWHVSQSA-N 483.600 5.737 5 20 JKBD Cc1ccc(C(=O)N2CCC(NCc3cn(-c4ccccc4)nc3-c3ccc([N+](=O)[O-])cc3)CC2)cc1 520963693 YWHMMGVOIXBUNH-UHFFFAOYSA-N 495.583 5.150 5 20 JKBD O=C(NC[C@@H](c1ccccc1Cl)c1c[nH]c2ccccc12)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl 603697360 IDHVOHDNROEFSB-KRWDZBQOSA-N 497.338 5.270 5 20 JKBD Cc1cc(NC(=O)c2ccc(F)cc2Cl)sc1C(=O)N[C@@H](C)c1cccc([N+](=O)[O-])c1 603966606 AZOVEHBGPNCHGU-LBPRGKRZSA-N 461.902 5.501 5 20 JKBD Cc1csc(Sc2ccc(C(=O)N3C[C@H](C(F)(F)F)C[C@@H](C(F)(F)F)C3)cc2[N+](=O)[O-])n1 604257546 GWRYKJJFZKKSEG-VXGBXAGGSA-N 499.458 5.714 5 20 JKBD COc1ccc([C@@H](Cc2ccccc2C)N[C@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2C)cc1OC 604474113 PMHSZHAWRKQWNN-AUSIDOKSSA-N 477.561 5.129 5 20 JKBD COc1cc(C(=O)Nc2ccccc2OCc2ncc(-c3cccc(Cl)c3)o2)ccc1[N+](=O)[O-] 608850334 HIWXABZOWCHZKG-UHFFFAOYSA-N 479.876 5.743 5 20 JKBD Cc1csc(Sc2ccc(C(=O)N3C[C@H](c4ccccc4)OC[C@H]3C)cc2[N+](=O)[O-])n1 608966178 GTRCWVVBCYBYIA-DNVCBOLYSA-N 455.561 5.113 5 20 JKBD O=C(Cn1cc(-c2ccc([N+](=O)[O-])cc2)cn1)N1N=C(c2cc3ccccc3o2)C[C@@H]1c1ccco1 609150769 NXBPMXGWFCVPAQ-JOCHJYFZSA-N 481.468 5.175 5 20 JKBD Cn1cc(C(=O)N[C@H]2CCCc3nc(-c4ccc(F)cc4)sc32)c(-c2ccc([N+](=O)[O-])cc2)n1 609187206 DPHHDAMQDFNQRC-IBGZPJMESA-N 477.521 5.065 5 20 JKBD O=[N+]([O-])c1cc(S(=O)(=O)N2CCCCCC2)ccc1Sc1nnc(-c2cccc(Cl)c2)o1 619715642 HAXARFRGFLFILJ-UHFFFAOYSA-N 494.982 5.014 5 20 JKBD C[C@H](OC(=O)c1csc(-c2cccc([N+](=O)[O-])c2)n1)C(=O)NC(c1ccccc1)c1ccccc1 747961863 LDCRLAJWUGIDHB-KRWDZBQOSA-N 487.537 5.169 5 20 JKBD O=c1c2ccccc2[nH]c2ccc(-c3nc(-c4ccc(-n5cnc6ccccc65)nc4)no3)cc12 904487628 KDYGCQFXUNUXFO-UHFFFAOYSA-N 456.465 5.132 5 20 JKBD Cc1csc(Sc2ccc(C(=O)Nc3ccc(N(C)C4CCN(C)CC4)cc3)cc2[N+](=O)[O-])n1 917794589 NIWDHZWZGMIAAL-UHFFFAOYSA-N 497.646 5.294 5 20 JKBD CC(C)[C@@H](CN(Cc1ccc(Cl)c(Cl)c1)C(=S)Nc1ccc([N+](=O)[O-])cc1)N(C)C 920313754 ICUBKLWNSQLWPP-HXUWFJFHSA-N 469.438 5.687 5 20 JKBD C[C@@H](NC(=O)c1cccc(Cl)c1Cl)C(=O)Oc1ccc(-c2ccccc2)cc1[N+](=O)[O-] 920329636 MNSSQGPMJJCCFX-CYBMUJFWSA-N 459.285 5.293 5 20 JKBD COc1ccc(Cl)cc1NC(=O)[C@@H](C)OC(=O)c1ccc(N[C@@H](C)c2ccccn2)c([N+](=O)[O-])c1 920543946 BCPQOBCTNTXVHT-LSDHHAIUSA-N 498.923 5.009 5 20 JKBD C[C@H](OC(=O)c1ccc(N[C@H](C)c2ccccn2)c([N+](=O)[O-])c1)C(=O)Nc1ccc2ccccc2c1 920546479 YLNVQIRIWRMGFE-MSOLQXFVSA-N 484.512 5.500 5 20 JKBD O=C(NC1(c2ccc(NC(=O)c3ccc([N+](=O)[O-])o3)cc2)CCC1)c1cc(F)cc(Cl)c1 1785751461 DWZJNKHVWVGMKK-UHFFFAOYSA-N 457.845 5.042 5 20 JKBD O=C(Cc1ccc(Cl)cc1[N+](=O)[O-])Nc1ccc(C2(NC(=O)CCc3ccco3)CCC2)cc1 1786114666 ISHOFWHZHGZKJO-UHFFFAOYSA-N 481.936 5.151 5 20 JKBD O=C(/C=C/c1ccc([N+](=O)[O-])o1)Nc1ccc(C2(NC(=O)c3cc(-c4ccccc4)[nH]n3)CCC2)cc1 1786207917 TVNKRSHHCNXZFL-ACCUITESSA-N 497.511 5.039 5 20 JKBD Cc1cnc(C(=O)Nc2ccc(C3(NC(=O)Cc4ccc(Cl)cc4[N+](=O)[O-])CCC3)cc2)s1 1787213637 KFWZOQGTJHSVPJ-UHFFFAOYSA-N 484.965 5.004 5 20 JKBD O=C(NC1(c2ccc(NC(=O)c3sccc3Cl)cc2)CCC1)c1ccc([N+](=O)[O-])c2c1OCO2 1789900276 ZYWANAFSRDOIPC-UHFFFAOYSA-N 499.932 5.100 5 20 JKBD O=C(Cc1ccc(Cl)s1)NC1(c2ccc(NC(=O)c3cc(O)cc([N+](=O)[O-])c3)cc2)CCC1 1790754847 GUFVUEXJEFJAHU-UHFFFAOYSA-N 485.949 5.006 5 20 JKBD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc([N+](=O)[O-])cc1F)c1ccc(-c2ccc(Cl)cc2)o1 1800349707 HZBUOQSOAZNCNB-BCDXTJNWSA-N 497.910 5.213 5 20 JKBD O=C([C@@H]1CCC[C@@H]2CCCC[C@@H]21)N1CCC([C@@H]2CCCCN2C(=O)c2ccc([N+](=O)[O-])o2)CC1 1823614501 LUXNLZISMZENPO-UVUJQTEASA-N 471.598 5.028 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)N1CCC([C@H]2CCCCN2C(=O)c2ccc3cc[nH]c3c2)CC1 1828044569 UAIKTZRKEFSONL-XMMPIXPASA-N 492.551 5.071 5 20 JKBD O=C(/C=C/c1ccccc1[N+](=O)[O-])N1CCC([C@H]2CCCCN2C(=O)c2ccc3cnccc3c2)CC1 1828205553 KTMBZVRQXWFHCA-QJASNXPTSA-N 498.583 5.090 5 20 JKBD O=C(c1cccc(F)c1[N+](=O)[O-])N1CCC([C@H]2CCCCN2C(=O)c2ccc(C3CC3)cc2)CC1 1830750456 VSUATGBKIKHGTN-XMMPIXPASA-N 479.552 5.158 5 20 JKBD O=C(c1ccccc1Cl)N1CCC([C@@H]2CCCCN2C(=O)/C=C/c2ccccc2[N+](=O)[O-])CC1 1832903914 IDXVRIFJGFRDJZ-OTOIZHKDSA-N 481.980 5.195 5 20 JKBD C[C@@H](Sc1nc2ccccc2c(=O)n1Cc1ccccc1Cl)C(=O)Nc1ccccc1[N+](=O)[O-] 9456499 IEJPYPFVZXWXAX-OAHLLOKOSA-N 494.960 5.126 5 20 JKBD O=[N+]([O-])c1ccccc1CSc1nnc(CN2CCCCC2)n1-c1ccccc1C(F)(F)F 12136677 RUHRWBMDUSAWSR-UHFFFAOYSA-N 477.512 5.473 5 20 JKBD CCN(CC(=O)Nc1c(Cl)cccc1Cl)C(=O)c1ccc(N2CCC[C@H](C)C2)c([N+](=O)[O-])c1 12483570 FIKQYFXQIKBPTA-HNNXBMFYSA-N 493.391 5.239 5 20 JKBD COc1cc(CSc2nc3cc(Cl)ccc3c(=O)n2C(C)C)c([N+](=O)[O-])cc1OC(F)F 12724140 XVJGDVDWHPBLNG-UHFFFAOYSA-N 485.896 5.441 5 20 JKBD CC(C)c1ccccc1-n1c(SCc2cc([N+](=O)[O-])cc3c2OCOC3)nnc1-c1cccnc1 16049059 MEKZEJIJGLFWGU-UHFFFAOYSA-N 489.557 5.520 5 20 JKBD CN(CC(=O)Nc1ccc(Cl)c(C(F)(F)F)c1)C(=O)c1cc2cc([N+](=O)[O-])ccc2s1 17974385 XYMXPUXLDCXSLD-UHFFFAOYSA-N 471.844 5.192 5 20 JKBD O=C(Nc1cccc(/C=C(\Cl)c2nc3cc([N+](=O)[O-])ccc3[nH]2)c1)c1ccccc1Cl 18064338 CFKMMAUIGIDNHQ-WQRHYEAKSA-N 453.285 6.114 5 20 JKBD O=C(CSc1ccc2c(c1)CCC2)Nc1c(Br)cc([N+](=O)[O-])cc1Br 21515315 FWMLJZNQAWTVFB-UHFFFAOYSA-N 486.185 5.339 5 20 JKBD O=C(CSc1nnc(Nc2cccc(F)c2)s1)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 22170981 PGJXYHHYAOMWFL-UHFFFAOYSA-N 473.433 5.079 5 20 JKBD Cc1occc1-c1nnc(S[C@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2C)n1Cc1ccccc1 23607454 FRNHJKXDKFFJTC-QGZVFWFLSA-N 477.546 5.231 5 20 JKBD O=C(Cc1ccc(OC(F)F)cc1)O[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1 26117135 VSMGWTYPZBXNED-OAQYLSRUSA-N 490.846 5.315 5 20 JKBD CCOc1ncccc1NC(=O)C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1 27583598 LGKSXNYLMOCGBJ-VKAVYKQESA-N 460.515 5.568 5 20 JKBD O=C(COC(=O)c1cc(C(F)(F)F)cc(C(F)(F)F)c1)Nc1ccc([N+](=O)[O-])cc1Cl 28301896 IEIDUXAFUOMZSK-UHFFFAOYSA-N 470.709 5.081 5 20 JKBD COc1cc(C(=O)Nc2ccc(NC(=O)NC(C)C)cc2)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 31021530 WATXFRSABVESKI-UHFFFAOYSA-N 498.923 5.831 5 20 JKBD COc1ccc(Oc2ccc([N+](=O)[O-])cc2C(=O)N[C@@H](C)c2ccc(NC(=O)C3CC3)cc2)cc1 33019194 JDIYOKGZCHPBKB-INIZCTEOSA-N 475.501 5.235 5 20 JKBD Cc1occc1C(=O)Nc1cc(NC(=O)CCNc2ccc(C(F)(F)F)cc2[N+](=O)[O-])ccc1F 46790368 YHTNWWXXKGFABH-UHFFFAOYSA-N 494.401 5.347 5 20 JKBD CCOc1cc([N+](=O)[O-])c(C(=O)NC[C@H](c2ccc(OC)cc2)c2c[nH]c3ccccc23)cc1OC 105002319 KTXQWIBOZQBXLG-OAQYLSRUSA-N 489.528 5.054 5 20 JKBD C[C@H](Nc1ccc(C(=O)N(C2CC2)[C@@H]2CCCc3ccccc32)cc1[N+](=O)[O-])c1ccccn1 110573772 ZTHLMJJKJGDXDF-AVRWGWEMSA-N 456.546 5.845 5 20 JKBD C[C@@H](N[C@H](Cc1ccccc1)c1ccccc1)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 248235148 DGGDGEGTEDPXMH-OPAMFIHVSA-N 457.452 5.514 5 20 JKBD CSc1ccc(C(=O)c2ccccc2C(=O)NC[C@@H]2CCCO[C@H]2c2ccccc2)cc1[N+](=O)[O-] 409547490 JNWGLMFBYRUTCO-FNZWTVRRSA-N 490.581 5.445 5 20 JKBD COc1ccc(OC(F)F)c(NC(=O)C2CCN(c3ccc(C(F)(F)F)cc3[N+](=O)[O-])CC2)c1 482239446 FJFVEWKJWXIRFY-UHFFFAOYSA-N 489.397 5.079 5 20 JKBD C[C@H]1CCCN(c2ccc(C(=O)Nc3cc(C(=O)Nc4ccccc4)ccc3Cl)cc2[N+](=O)[O-])C1 483414622 ODUXBKYYYBWJKC-KRWDZBQOSA-N 492.963 5.989 5 20 JKBD Cc1ccc([N+](=O)[O-])c(Oc2nc(CN3CCOCC3)nc3scc(-c4ccccc4)c23)c1 484253687 LSAJHVLOEQFVGX-UHFFFAOYSA-N 462.531 5.199 5 20 JKBD COc1cc(C(=O)Nc2ccc(F)cc2-c2ccc(F)cc2)c([N+](=O)[O-])cc1OC(F)F 485811474 CDNBZYWBRTWEAU-UHFFFAOYSA-N 450.344 5.402 5 20 JKBD COc1ccc([C@H](NCc2nc(-c3cccc([N+](=O)[O-])c3)no2)c2ccccc2)cc1Br 488043003 NVXXMXOPZTVKDQ-JOCHJYFZSA-N 495.333 5.295 5 20 JKBD O=C(c1csc(-c2cccc([N+](=O)[O-])c2)n1)N(Cc1cccnc1)c1ccc(Br)cc1 496611511 MGOZUOWZMUOIDJ-UHFFFAOYSA-N 495.358 5.723 5 20 JKBD COc1ccc(CSCC(=O)N(C)[C@@H]2CCSc3ccc(Br)cc32)cc1[N+](=O)[O-] 504552910 MLGPVBUGMJKOTD-MRXNPFEDSA-N 497.436 5.295 5 20 JKBD C[C@@H](Nc1ccc(C(=O)Nc2nc(CN3CCCCCC3)cs2)cc1[N+](=O)[O-])c1ccccn1 507267339 XTIIOMWLMBXKSM-QGZVFWFLSA-N 480.594 5.248 5 20 JKBD CCOc1cc(C(=O)Nc2ccc(Sc3nc(C)cs3)cc2C)c([N+](=O)[O-])cc1OC 508512803 MGLRAFBFFGLZCU-UHFFFAOYSA-N 459.549 5.479 5 20 JKBD COc1ccc(CSCC(=O)Nc2ccc(NC(=O)c3ccc(Cl)cc3)cc2)cc1[N+](=O)[O-] 509827515 PJAKZPPIMZPVDT-UHFFFAOYSA-N 485.949 5.381 5 20 JKBD CCc1nc(CN2CCN(C(=O)c3ccc(Oc4ccc(Cl)cc4[N+](=O)[O-])cc3)CC2)cs1 510228720 MMEYSYRJACDARM-UHFFFAOYSA-N 486.981 5.017 5 20 JKBD COc1cc(C(=O)N(Cc2ccc(Cl)cc2)C2CC2)c([N+](=O)[O-])cc1OCc1cscn1 512433804 PIQVDMNIZNFTOO-UHFFFAOYSA-N 473.938 5.097 5 20 JKBD O=C(C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)N1CCC[C@H]1c1ccsc1 516071420 HAAKRXNMADCTLG-DJAVKIJBSA-N 475.595 6.560 5 20 JKBD Cc1ccc(NC(=O)c2cccc(C(F)(F)F)c2)cc1NC(=O)c1ccc(C)c([N+](=O)[O-])c1 518889484 PDYNTHVJUPNYLN-UHFFFAOYSA-N 457.408 5.735 5 20 JKBD C[C@@H](NC(=O)C(=O)Nc1ccc(Oc2ccccc2)cc1C(F)(F)F)c1cccc([N+](=O)[O-])c1 520081980 HDQCPNFUZBTPLM-CQSZACIVSA-N 473.407 5.222 5 20 JKBD O=C(Cc1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1)Nc1ccccc1NCC(F)(F)F 521033440 YFRLSHMOIPDOGH-UHFFFAOYSA-N 495.461 5.603 5 20 JKBD CSc1cccc(N(C)C(=O)c2ccccc2NS(=O)(=O)c2cc(C)c(C)c([N+](=O)[O-])c2)c1 522363470 IYQQKUQGJRWCEI-UHFFFAOYSA-N 485.587 5.011 5 20 JKBD O=C(c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1)N1CCO[C@H](c2ccccc2F)C1 524052720 UMBKMLJHSJDBRD-QFIPXVFZSA-N 456.857 5.393 5 20 JKBD O=C(C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)Nc1ccccc1OC(F)F 550219999 CPUOXTQHJYKEKF-DTQAZKPQSA-N 481.480 6.375 5 20 JKBD CCCOc1cc(NC(=O)N2CCC[C@@H]2c2ccc(OC)cc2)c([N+](=O)[O-])cc1OCCC 603652872 JPKQEPOHGCBCLV-HXUWFJFHSA-N 457.527 5.550 5 20 JKBD Cc1occc1C(=O)Nc1cc(Nc2ccc(C(=O)c3ccccc3)cc2[N+](=O)[O-])ccc1F 603858086 GLDFQEVLDJCRRQ-UHFFFAOYSA-N 459.433 5.862 5 20 JKBD O=C(NC[C@H]1CCN(c2ccc(F)c(F)c2)C1)c1cc([N+](=O)[O-])ccc1Sc1ccccc1 604459115 NVKSXXDLYFADNT-MRXNPFEDSA-N 469.513 5.281 5 20 JKBD O=C(CNCc1ccc(Oc2ccccc2Cl)c([N+](=O)[O-])c1)Nc1ccc(F)c(F)c1F 604478454 WGXOCTDYHDTFOS-UHFFFAOYSA-N 465.815 5.186 5 20 JKBD CCN(Cc1cnn(C)c1)C(=O)c1c2c(nc3ccccc13)/C(=C/c1ccc([N+](=O)[O-])cc1)CCC2 604481894 FIOFVBPZKJCNOP-RCCKNPSSSA-N 481.556 5.416 5 20 JKBD O=[N+]([O-])c1ccc(S(=O)(=O)Nc2nc3nc(-c4ccccc4)cc(C(F)(F)F)c3s2)s1 608929361 XFRBZNAEFXCUTP-UHFFFAOYSA-N 486.478 5.148 5 20 JKBD Cc1csc(Sc2ccc(C(=O)Nc3cccc([C@@H](C)N4CCOCC4)c3)cc2[N+](=O)[O-])n1 609182745 FBUXQZCTHYWWMP-MRXNPFEDSA-N 484.603 5.156 5 20 JKBD COCc1cccc2sc(NC(=O)c3ccc(Sc4nc(C)cs4)c([N+](=O)[O-])c3)nc12 609186385 KVLABMJDMLHYDQ-UHFFFAOYSA-N 472.573 5.519 5 20 JKBD CSc1ccc2cc(COC(=O)[C@@H]3CCCN3C(=O)c3ccc([N+](=O)[O-])c(C)c3)c(Cl)nc2c1 726676458 RSMAGDLBIFPUGV-NRFANRHFSA-N 499.976 5.175 5 20 JKBD O=C(CCC(=O)c1ccc2ccc3cccc4ccc1c2c34)N[C@H]1CCCN(c2ncccn2)C1 727755002 LHMYFUAWIIWODL-QFIPXVFZSA-N 462.553 5.122 5 20 JKBD O=C(c1ccc(-n2ccc(C(F)(F)F)n2)cc1)N(CC1CC1)c1ccc(Cl)c([N+](=O)[O-])c1 728167282 WNIYJNGZKOTCJI-UHFFFAOYSA-N 464.831 5.510 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)Nc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(C(F)(F)F)c2)cc1SC 728475442 PANXGYUOGFFNOL-CHWSQXEVSA-N 499.511 5.210 5 20 JKBD COc1ccc([N+](=O)[O-])cc1COC(=O)c1oc2ccccc2c1CSc1nnc(C)s1 742955749 MRGVSCUKLHCBRN-UHFFFAOYSA-N 471.516 5.159 5 20 JKBD Cc1cccc(NC(=O)Nc2cccc(CNC(=O)c3cc([N+](=O)[O-])c(C)c([N+](=O)[O-])c3C)c2)c1 748622824 HZSXZBGCMBXVFO-UHFFFAOYSA-N 477.477 5.002 5 20 JKBD CC(C)Oc1ccc(-c2nc(C(=O)O[C@@H](C)c3nnc(-c4ccc([N+](=O)[O-])cc4)o3)cs2)cc1 749312178 DDSRZXADKXISJL-AWEZNQCLSA-N 480.502 5.474 5 20 JKBD CSc1ccc(C(=O)c2ccccc2C(=O)O[C@H](C)C(=O)Nc2ccccc2C)cc1[N+](=O)[O-] 777426743 ICWSRHONLQVGEB-MRXNPFEDSA-N 478.526 5.040 5 20 JKBD Cc1cccc(C(C)C)c1NC(=O)[C@H](C)OC(=O)c1ccc(N2CCC[C@H](C)C2)c([N+](=O)[O-])c1 783460927 KNFIOKSFENEFTJ-HKUYNNGSSA-N 467.566 5.447 5 20 JKBD O=C(CNC(=O)c1ccccc1Sc1ccc(C(F)(F)F)cc1[N+](=O)[O-])OCc1ccccc1 783509835 NFOFRAKSJDFESF-UHFFFAOYSA-N 490.459 5.238 5 20 JKBD CC(=O)N(c1nc(COC(=O)/C=C\c2ccc([N+](=O)[O-])cc2)cs1)c1ccc(C)cc1C 798128368 VVVYURVKMAVFHO-XFFZJAGNSA-N 451.504 5.109 5 20 JKBD Cc1ccc2sc(-c3ccc(N(C(=O)c4ccc([N+](=O)[O-])n4C)C4=NCCCS4)cc3)nc2c1 826861409 URKRSJWFSVAFBC-UHFFFAOYSA-N 491.598 5.658 5 20 JKBD Cc1ccnc2sc(C(=O)O[C@@H](C)C(=O)Nc3nc(-c4cccc([N+](=O)[O-])c4)cs3)c(C)c12 914917766 CWTWPQWQYCKBCN-ZDUSSCGKSA-N 482.543 5.129 5 20 JKBD O=C(Oc1ccc2c(-c3ccc([N+](=O)[O-])cc3)cc(=O)oc2c1)[C@H]1CCC[C@H](C(F)(F)F)C1 916035254 IBXORKZHYRAJGX-GJZGRUSLSA-N 461.392 5.642 5 20 JKBD CN(c1ccccc1)c1ccc(/C=C(/Cl)c2nc(=O)c3ccc(C(=O)O)cc3[nH]2)cc1[N+](=O)[O-] 916127127 FJIFUCJMGGYCGV-WOJGMQOQSA-N 476.876 5.034 5 20 JKBD COCCOc1ccc(N[C@@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2ccccc2)cc1F 920060734 SPXMKRHFVULRNW-JOCHJYFZSA-N 473.888 5.204 5 20 JKBD Cc1ccc(-c2noc([C@H](C)OC(=O)c3ccc(N[C@@H](C)c4ccccn4)c([N+](=O)[O-])c3)n2)cc1F 920549180 WFKRQRHKWBEVAZ-HOTGVXAUSA-N 491.479 5.578 5 20 JKBD O=C(/C=C/c1ccc([N+](=O)[O-])o1)NC1(c2ccc(NC(=O)C3(c4ccccc4)CC3)cc2)CCC1 1785860640 UPLPQEPOLFDNGG-ACCUITESSA-N 471.513 5.067 5 20 JKBD O=C(/C=C/c1ccc([N+](=O)[O-])o1)Nc1ccc(C2(NC(=O)c3ccc(Cl)s3)CCC2)cc1 1786206158 ASIXCRNPJAFHAO-UXBLZVDNSA-N 471.922 5.364 5 20 JKBD Cc1csc(C(=O)Nc2ccc(C3(NC(=O)/C=C/c4ccc([N+](=O)[O-])o4)CCC3)cc2)c1 1786485846 MCZHUUJIYQQPFA-VQHVLOKHSA-N 451.504 5.019 5 20 JKBD O=C(/C=C/c1ccc([N+](=O)[O-])o1)NC1(c2ccc(NC(=O)[C@H]3C[C@H]3c3ccccc3)cc2)CCC1 1791526500 BOTYZKLYXHWGLC-FAKVZGHMSA-N 471.513 5.139 5 20 JKBD C[C@H](C(=O)N1CCCC2(CCN(C(=O)/C=C/c3ccccc3[N+](=O)[O-])CC2)C1)c1ccc(Cl)cc1 1805194089 CEZBSHUPNTZARW-JTPHSUOKSA-N 496.007 5.296 5 20 JKBD CC[C@H](C(=O)N1CCCC2(CCN(C(=O)/C=C/c3ccccc3[N+](=O)[O-])CC2)C1)c1ccccc1 1809012253 DANIDUNWCPLXOU-XXFRDUSWSA-N 475.589 5.033 5 20 JKBD Cc1c(Cl)ccc(C(=O)N2CCC([C@@H]3CCCCN3C(=O)c3ccc([N+](=O)[O-])o3)CC2)c1Cl 1823616752 UMXQZCJCXXLPCD-SFHVURJKSA-N 494.375 5.350 5 20 JKBD O=C(/C=C/c1ccccc1[N+](=O)[O-])N1CCC([C@@H]2CCCCN2C(=O)c2cccc3cnccc23)CC1 1828656910 ODVYGYFVLQLUCH-GIPLCNRYSA-N 498.583 5.090 5 20 JKBD Cc1c(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)[C@H]3CCC[C@H]3C)CC2)cc(Cl)cc1[N+](=O)[O-] 1830736104 QQGOQACHPOYIBG-QGCDCVKKSA-N 476.017 5.226 5 20 JKBD C[C@]1(C(=O)N2CCCC[C@H]2C2CCN(C(=O)CSc3ccccc3[N+](=O)[O-])CC2)CC=CCC1 1832410665 JVMBLUOMNJBARE-LVXARBLLSA-N 485.650 5.053 5 20 JKBD CC(C)Cn1c(SCC(=O)Nc2cc(Cl)ccc2[N+](=O)[O-])nnc1-c1ccccc1F 8651080 YIJSYGVMRGJOOY-UHFFFAOYSA-N 463.922 5.033 5 20 JKBD COc1ccc(OCc2nnc(SCc3ccccc3[N+](=O)[O-])n2-c2ccccc2F)cc1 11022129 FYIRYLQYDXSHHM-UHFFFAOYSA-N 466.494 5.195 5 20 JKBD Cc1ccc(NC(=O)[C@H](Sc2nnc(NCC(C)C)s2)c2ccccc2)c([N+](=O)[O-])c1 18663722 NGSDOVUEAKBHCX-GOSISDBHSA-N 457.581 5.295 5 20 JKBD CC(=O)NCCCc1ccc(-c2csc(NC(=O)c3ccc(C(C)(C)C)c([N+](=O)[O-])c3)n2)cc1 25738859 VXMYUOTWCWAXKY-UHFFFAOYSA-N 480.590 5.337 5 20 JKBD CS(=O)(=O)Nc1cccc(NC(=O)c2cc([N+](=O)[O-])ccc2Sc2ccc(Cl)cc2)c1 29161205 UMLCOCZIZFCGSK-UHFFFAOYSA-N 477.951 5.023 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Cl)[C@@H](NCc1csc(Br)c1)c1ccccc1 30515480 QGRTWSKJUBSDBY-SFHVURJKSA-N 480.771 5.542 5 20 JKBD Cc1nc(-c2cccc(NC(=O)c3ccc(N[C@H](C)c4ccccn4)c([N+](=O)[O-])c3)c2)oc1C 108854009 BEHIZGHTXGXGAQ-MRXNPFEDSA-N 457.490 5.687 5 20 JKBD Cc1ccc(NC(=O)c2ccc(N[C@@H](C)c3ccccn3)c([N+](=O)[O-])c2)c(OC[C@@H]2CCCO2)c1 108891225 VQDMKPRJCPVBLQ-ICSRJNTNSA-N 476.533 5.281 5 20 JKBD Cc1sc(NC(=O)CCc2ncc(-c3ccccc3F)o2)nc1-c1cccc([N+](=O)[O-])c1 195704203 QHDDCCKRFFEVET-UHFFFAOYSA-N 452.467 5.392 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Cl)N1CCCN(Cc2ccc(C(F)(F)F)cc2)CC1 302928211 FDLOGPYRZHUXDY-UHFFFAOYSA-N 456.852 5.007 5 20 JKBD CCOc1ccc(N(C(=O)CCn2nc(C)c([N+](=O)[O-])c2C)c2nc3ccccc3s2)cc1 303117563 HQHGUYZJSGQQHS-UHFFFAOYSA-N 465.535 5.172 5 20 JKBD COc1cccc(/C=C(\CC(=O)N2CCc3ccc([N+](=O)[O-])cc32)c2nc3ccccc3s2)c1 477611866 CJTHZNILKREHCC-CPNJWEJPSA-N 471.538 5.733 5 20 JKBD C[C@H](c1ccc(C(F)(F)F)cc1)N(C)C(=O)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-] 480124201 LRRXDUBVDZPDOY-LLVKDONJSA-N 450.335 5.388 5 20 JKBD CC[C@H](C)Sc1ccc(NC(=O)c2ccc(-n3cncn3)c([N+](=O)[O-])c2)c(C(F)(F)F)c1 499535906 ZNMKGNGVHVRYRV-LBPRGKRZSA-N 465.457 5.337 5 20 JKBD COc1ccc([C@@H](NC(=O)C2CCN(c3ccc(C(F)(F)F)cc3[N+](=O)[O-])CC2)C(C)C)cc1 503050376 KDTSRMHYYZYAMR-QFIPXVFZSA-N 479.499 5.352 5 20 JKBD O=C(C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)N1CCC(OC2CCCC2)CC1 503364983 DCLCHMBUIGDXSZ-LVZFUZTISA-N 491.613 6.085 5 20 JKBD Cc1ccc([N+](=O)[O-])cc1NC(=O)c1ccc(C)c(S(=O)(=O)Nc2cc(Cl)ccc2F)c1 508355126 QWYUYPHQCKBREN-UHFFFAOYSA-N 477.901 5.057 5 20 JKBD O=[N+]([O-])c1ccc(Sc2nnc(-c3cccnc3)n2-c2ccc(Br)cc2)cc1 514653500 VKSPLQLWTYLYSP-UHFFFAOYSA-N 454.309 5.151 5 20 JKBD O=C(NCc1cccc(NC(=O)[C@H]2CCCO2)c1)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1 517932026 IBLORZDGFGOMHC-HSZRJFAPSA-N 495.919 5.088 5 20 JKBD C[C@@H](NCc1ccc(-c2ccc([N+](=O)[O-])cc2)s1)c1cc(F)ccc1N1CCN(C)CC1 518275107 BUPTWKPRDYQYHK-QGZVFWFLSA-N 454.571 5.065 5 20 JKBD Cc1csc(Sc2ccc(C(=O)Nc3ccc(C(=O)NC(C)C)c(C)c3)cc2[N+](=O)[O-])n1 518695786 JXWYZBMQEPDPHH-UHFFFAOYSA-N 470.576 5.210 5 20 JKBD COc1ccc(N(C)C(=O)c2ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])c(OC)c2)cc1OC 520018347 SQPVEWGEEURMOP-UHFFFAOYSA-N 472.881 5.343 5 20 JKBD O=C(Nc1ncn(Cc2ccccc2)n1)c1cc([N+](=O)[O-])ccc1Sc1ccc(Cl)cc1 520410288 ZCMXLIBCMZYWOL-UHFFFAOYSA-N 465.922 5.292 5 20 JKBD CCc1nc(CN(C)C(=O)C/C(=C\c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)cs1 520471402 HXRCULSZJMOODD-SFQUDFHCSA-N 478.599 5.813 5 20 JKBD Cc1ccc(NC(=O)c2ccc(N3CCC[C@@H](C)C3)c([N+](=O)[O-])c2)cc1NC(=O)c1ccncc1 520745399 FOVSHTAGTUDUSG-QGZVFWFLSA-N 473.533 5.039 5 20 JKBD CC(=O)N1CCc2c(sc3nc4c(c(-c5ccc(C)cc5)c23)COc2c-4cc(F)cc2[N+](=O)[O-])C1 558387620 OFQCJISRHLABHH-UHFFFAOYSA-N 489.528 5.783 5 20 JKBD C[C@@H]1C[C@@H](C)CN(c2ccc(C(=O)Nc3ccc(NC(=O)c4ccco4)cc3)cc2[N+](=O)[O-])C1 591338655 WZYKLYBVNCEDKC-IAGOWNOFSA-N 462.506 5.175 5 20 JKBD O=[N+]([O-])c1ccccc1CN(Cc1ccccc1)S(=O)(=O)c1ccccc1C(F)(F)F 595285177 NHKIHHRZBPWEST-UHFFFAOYSA-N 450.438 5.005 5 20 JKBD CC(=O)Nc1cccc(NC(=O)C/C(=C\c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)c1 602605636 YMPDEHBYYNYWDG-QGOAFFKASA-N 472.526 5.732 5 20 JKBD O=C(NC1C[C@@H](C(F)(F)F)C[C@H](C(F)(F)F)C1)c1cc([N+](=O)[O-])ccc1Sc1ccccc1 603573181 VKGPHASGUYXXPH-STQMWFEESA-N 492.441 6.385 5 20 JKBD Cn1c(SCc2nc(O)c3ccc(C(F)(F)F)cc3n2)nc2cc3ccccc3cc2c1=O 615599975 INRGSYLBXUIEIG-UHFFFAOYSA-N 468.460 5.047 5 20 JKBD O=C(CCC(=O)c1ccc2ccc3cccc4ccc1c2c34)Nc1cccc(N2CCNC2=O)c1 727756185 SMVSNRFAPKROGV-UHFFFAOYSA-N 461.521 5.715 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)OCC(=O)Nc2cc(Cl)c(Cl)cc2Cl)cc1SC 728651860 YYSDLTYWMFWPED-UHFFFAOYSA-N 479.725 5.081 5 20 JKBD O=C(Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1)c1ccccc1OCc1cn2ccccc2n1 746090927 WNPUZKJUMQJLGX-UHFFFAOYSA-N 471.498 5.197 5 20 JKBD COc1cccc(Cc2cnc(NC(=O)c3csc(-c4ccc([N+](=O)[O-])cc4)n3)s2)c1 747633697 NVEYUOJCBCDOCI-UHFFFAOYSA-N 452.517 5.027 5 20 JKBD O=C1/C(=C/c2ccc(-c3cccc([N+](=O)[O-])c3)o2)NC(=S)N1c1ccccc1C(F)(F)F 747970846 UNMXHQLYQHCCQQ-WJDWOHSUSA-N 459.405 5.136 5 20 JKBD O=C(C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)Nc1ccn(Cc2ccccn2)n1 748676717 QEKIEBKSZRHVAF-CYVLTUHYSA-N 496.552 5.414 5 20 JKBD C[C@H](OC(=O)[C@@H](C)Sc1ccc([N+](=O)[O-])cc1)c1nc(-c2cccc(C(F)(F)F)c2)no1 924160182 FFVJUOLANFIQSM-NWDGAFQWSA-N 467.425 5.449 5 20 JKBD COc1ccc(/C=C(\C)C(=O)NC2(c3ccc(NC(=O)c4ccc([N+](=O)[O-])o4)cc3)CCC2)cc1 1785751217 TVOHSIDDKAYPKC-WUKNDPDISA-N 475.501 5.048 5 20 JKBD O=C(NC1(c2ccc(NC(=O)[C@H]3CCCCC3(F)F)cc2)CCC1)c1ccc([N+](=O)[O-])cc1F 1786464737 GQPJXDTVASZWFD-LJQANCHMSA-N 475.467 5.307 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)c3ccc([N+](=O)[O-])o3)CCC2)cc1)c1ccc(C(F)(F)F)c(F)c1 1790648771 QPZFKWDGQQAFTO-UHFFFAOYSA-N 491.397 5.407 5 20 JKBD O=C(CSC1CCCC1)NC1(c2ccc(NC(=O)c3cc(F)cc([N+](=O)[O-])c3)cc2)CCC1 1790695762 NVJGMJPLUWVDEA-UHFFFAOYSA-N 471.554 5.157 5 20 JKBD Cc1c(C(=O)N2CC[C@@H](CNC(=O)/C=C/C3CCCC3)[C@@H]2c2cccnc2)cc(Cl)cc1[N+](=O)[O-] 1808492210 CHBBAIMXAHYZBT-JJHGBTGXSA-N 496.995 5.018 5 20 JKBD Cc1c(Cl)ccc(C(=O)N2CCC([C@H]3CCCCN3C(=O)c3ccc([N+](=O)[O-])o3)CC2)c1Cl 1823616748 UMXQZCJCXXLPCD-GOSISDBHSA-N 494.375 5.350 5 20 JKBD CCCCC[C@@H](C)C(=O)N1CCC([C@H]2CCCCN2C(=O)Cc2ccc([N+](=O)[O-])cc2F)CC1 1831294848 RZASYPQCPWWKHA-NTKDMRAZSA-N 475.605 5.113 5 20 JKBD Cc1cc(Cl)cc(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)Cc3cccc([N+](=O)[O-])c3)CC2)c1 1832608491 XACKQMFVVSJSBX-XMMPIXPASA-N 483.996 5.033 5 20 JKBD CCCCc1ccc(-c2ccc(C(=O)N3CC[C@H]4[C@@H]3CCN4C(=O)c3ccc([N+](=O)[O-])o3)cc2)cc1 1847171437 SOLRAAZYUQXWQR-ZEQRLZLVSA-N 487.556 5.327 5 20 JKBD O=C(CSc1nnc(COc2ccccc2Cl)n1C1CC1)Nc1ccc([N+](=O)[O-])cc1Cl 9413146 KLGLZKHOWMOFGX-UHFFFAOYSA-N 494.360 5.138 5 20 JKBD C[C@@H](OC(=O)c1cc2c(s1)-c1ccccc1OC2)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl 9815376 APAGNSYKFCQYFU-LLVKDONJSA-N 458.879 5.053 5 20 JKBD CC(=O)Nc1ccc(NC(=O)c2ccc(Sc3nc(C)cs3)c([N+](=O)[O-])c2)cc1Cl 12735262 WGWIDYBUAVSUMD-UHFFFAOYSA-N 462.940 5.375 5 20 JKBD O=C(Oc1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2Cl)cc1)c1csc(-c2ccccc2)n1 15516099 RJMGWFNYFFQULH-UHFFFAOYSA-N 479.901 5.843 5 20 JKBD C[C@H](NC[C@@H](c1ccccc1)c1c[nH]c2ccccc12)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 19623566 IKOUMIXYAAIWAZ-JXFKEZNVSA-N 496.489 5.844 5 20 JKBD O=C(NCc1ccccc1)c1nnc(/C(Cl)=C/c2ccc(-c3cccc([N+](=O)[O-])c3)o2)s1 22016588 OHZCKRUFEAILNC-PDGQHHTCSA-N 466.906 5.373 5 20 JKBD Cc1ccc(NC(=O)[C@H](C)OC(=O)c2ccc(Sc3nc(C)cs3)c([N+](=O)[O-])c2)c(F)c1 23968917 NNFAYXIKOLEBCE-ZDUSSCGKSA-N 475.523 5.142 5 20 JKBD Cc1ccc(-c2nnc3n2CCCCC3)cc1NC(=O)c1ccc(N2CCC[C@@H](C)C2)c([N+](=O)[O-])c1 25847784 TUCHQSSOMBHQSH-GOSISDBHSA-N 488.592 5.377 5 20 JKBD Cn1c(S[C@@H](C(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)c2ccccc2)nc2sccc2c1=O 28607536 UMWLFMWRGQAZMD-QGZVFWFLSA-N 486.962 5.029 5 20 JKBD O=C(C1CCN(c2ccccc2[N+](=O)[O-])CC1)N(Cc1ccccn1)c1ccc(Cl)cc1 59784952 RHYNXSOZZFJODT-UHFFFAOYSA-N 450.926 5.093 5 20 JKBD COc1ccc([C@H](C)N(C)C(=O)C/C(=C/c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)cc1 483220128 KAKYASQYGZSEDZ-RWZYYMRUSA-N 487.581 6.363 5 20 JKBD CCn1cc(NC(=O)c2ccccc2Sc2ccc(C(F)(F)F)cc2[N+](=O)[O-])ccc1=O 486973988 GQQZDQYEJKIUEA-UHFFFAOYSA-N 463.437 5.199 5 20 JKBD COc1ccc(-c2ccc([C@H]3Nc4ccccc4C(=O)N3Cc3cccnc3)o2)c([N+](=O)[O-])c1 489286778 KUGIAVXNNZXJQR-DEOSSOPVSA-N 456.458 5.025 5 20 JKBD CC(=O)c1sc(NC(=O)c2csc(-c3ccc([N+](=O)[O-])cc3)n2)nc1-c1ccccc1 496317032 ZNCBSEWDIXDRBG-UHFFFAOYSA-N 450.501 5.297 5 20 JKBD C[C@@H](c1cccc(C(F)(F)F)c1)N(C(=O)C1CCN(c2ccccc2[N+](=O)[O-])CC1)C1CC1 502888793 UHPAOERLQKUBRP-INIZCTEOSA-N 461.484 5.582 5 20 JKBD C[C@@H](Nc1ccc(C(=O)NC2(c3ccc(Cl)cc3)CCOCC2)cc1[N+](=O)[O-])c1ccccn1 505132668 DIPGLGRGZHPJHH-QGZVFWFLSA-N 480.952 5.252 5 20 JKBD C[C@@H](Nc1ccc(C(=O)N2CCO[C@@H](c3ccccc3Cl)C2)cc1[N+](=O)[O-])c1ccccn1 505137115 QCZWHOHCMLTQID-WAIKUNEKSA-N 466.925 5.030 5 20 JKBD CN(C)c1ccc(NC(=O)CCNc2ccc(C(F)(F)F)cc2[N+](=O)[O-])c(C(F)(F)F)c1 509183020 IYILQIPLOXEQDY-UHFFFAOYSA-N 464.366 5.139 5 20 JKBD O=C(C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)N1CCCN(c2ccccc2)CC1 516527742 YYIUXOFXHMGPMX-QOCHGBHMSA-N 498.608 5.874 5 20 JKBD CO[C@@H](C)c1cccc(NC(=O)c2ccc(C(=O)Nc3cccc([C@H](C)OC)c3)c([N+](=O)[O-])c2)c1 524357907 VXECLCJVVADZEM-IRXDYDNUSA-N 477.517 5.514 5 20 JKBD Cc1sc2ncnc(Sc3ccccc3C(=O)NCc3cccc([N+](=O)[O-])c3)c2c1C 569757281 YLOQCBIWMJWSCY-UHFFFAOYSA-N 450.545 5.298 5 20 JKBD O=C(Nc1nc(-c2ccncc2)cs1)c1ccc(NCc2ccccc2Cl)c([N+](=O)[O-])c1 603454747 NRIMCPWZWAYAPG-UHFFFAOYSA-N 465.922 5.631 5 20 JKBD C[C@@H]1CCCN(c2ccc(C(=O)NCc3cccc(COCc4ccco4)c3)cc2[N+](=O)[O-])C1 603882376 AYSJWRHEHXGHNK-LJQANCHMSA-N 463.534 5.071 5 20 JKBD O=C(Nc1nc2cc(C(F)(F)F)ccc2n1Cc1ccco1)c1c[nH]c2ccc([N+](=O)[O-])cc12 604540820 NKCNYACIOCVWHR-UHFFFAOYSA-N 469.379 5.338 5 20 JKBD CCOc1cc(C(=O)Nc2ccc(-c3nc4c(Cl)cccc4[nH]3)cc2)c([N+](=O)[O-])cc1OC 608947982 MMUNPEPYITVQHZ-UHFFFAOYSA-N 466.881 5.451 5 20 JKBD O=C(Cc1csc(-c2cccc(C(F)(F)F)c2)n1)OCc1nc(-c2cccc([N+](=O)[O-])c2)no1 725969770 PJAVMRMUHZGYFJ-UHFFFAOYSA-N 490.419 5.073 5 20 JKBD O=C(c1c2c(nc3ccccc13)/C(=C\c1cccc([N+](=O)[O-])c1)CCC2)N1CCC[C@@H](C2OCCO2)C1 729361306 VIHGXWNGFUHPCD-OYQOIYBLSA-N 499.567 5.245 5 20 JKBD O=C(NCCOC(=O)c1nc(-c2ccccc2)oc1-c1ccccc1)c1ccc([N+](=O)[O-])cc1Cl 731411881 IOQOEFXFDHQHNX-UHFFFAOYSA-N 491.887 5.157 5 20 JKBD O=C(COC(=O)c1csc(-c2ccc([N+](=O)[O-])cc2)n1)Nc1cccc(Oc2ccccc2)c1 747957231 LVMPTQRGWXKDTL-UHFFFAOYSA-N 475.482 5.306 5 20 JKBD C[C@@H](OC(=O)c1cc([N+](=O)[O-])ccc1N1CCCCC1)C(=O)Nc1ccc(Cl)cc1Cl 823195196 RNERXCVZGSAEQR-CYBMUJFWSA-N 466.321 5.076 5 20 JKBD O=C(c1ccc([N+](=O)[O-])s1)N1CCC[C@@H]1c1nc(-c2ccc(Oc3ccc(F)cc3)nc2)no1 904504768 IXJXPMXTLMAWKB-MRXNPFEDSA-N 481.465 5.010 5 20 JKBD CN(Cc1c(Cl)cccc1Cl)C(=O)c1ccccc1NC(=O)c1ccc([N+](=O)[O-])cc1Cl 914497059 SWKYLPOKPICSOU-UHFFFAOYSA-N 492.746 6.080 5 20 JKBD O=C(OCc1nc2ccccc2c2ccccc12)[C@H]1CCCN(C(=O)Nc2ccccc2F)C1 915564890 GICCXPIXUOXCKS-SFHVURJKSA-N 457.505 5.514 5 20 JKBD COCc1c(C(=O)Nc2cc(Cl)c([N+](=O)[O-])cc2OCc2ccccc2)oc2ccccc12 916827792 YQWXRIVKLQAWFK-UHFFFAOYSA-N 466.877 5.972 5 20 JKBD COc1cccc(OC)c1Oc1ccc(CNc2c([N+](=O)[O-])cc(C(F)(F)F)cc2[N+](=O)[O-])cn1 917089432 HDKLSZFBOUNGQL-UHFFFAOYSA-N 494.382 5.338 5 20 JKBD O=C(OCC(=O)N1CCC[C@@H]1c1ccc(Cl)c(Cl)c1)c1ccc(Cl)c([N+](=O)[O-])c1 918849192 AQFCVOKNACVIDO-MRXNPFEDSA-N 457.697 5.076 5 20 JKBD C[C@@H](Oc1ccc(Cl)c(Cl)c1)C(=O)O[C@H](C)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 919442760 FKXNJLGBXGMARI-GHMZBOCLSA-N 452.250 5.023 5 20 JKBD COc1cc(C(=O)Nc2ccccc2SC(F)F)c([N+](=O)[O-])cc1OCc1cscn1 919983322 YFCUEZVUQJSLMB-UHFFFAOYSA-N 467.475 5.206 5 20 JKBD C[C@H](OC(=O)c1ccc(N[C@@H](C)c2ccccn2)c([N+](=O)[O-])c1)C(=O)Nc1ccc(F)cc1Cl 920544566 CVHQYVLLXYFGNK-KBPBESRZSA-N 486.887 5.139 5 20 JKBD COc1ccc2c(-c3ccccc3)c(C(=O)OCC(=O)Nc3c(C)cccc3[N+](=O)[O-])oc2c1 920644167 UWEHCARJUZIGDX-UHFFFAOYSA-N 460.442 5.121 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)c3ccccc3C(F)(F)F)CCC2)cc1)c1ccc([N+](=O)[O-])o1 1785749691 IIHYJXSSUSZQLG-UHFFFAOYSA-N 473.407 5.268 5 20 JKBD O=C(/C=C/c1ccc([N+](=O)[O-])o1)Nc1ccc(C2(NC(=O)c3ccc4c(c3)CCCC4=O)CCC2)cc1 1786207400 INZMAUNDVYSUFK-JLHYYAGUSA-N 499.523 5.168 5 20 JKBD O=C(Cn1ccc2ccc([N+](=O)[O-])cc21)Nc1ccc(C2(NC(=O)c3ccc(F)cc3)CCC2)cc1 1786277589 OPKXEWIUAQGFCX-UHFFFAOYSA-N 486.503 5.137 5 20 JKBD O=C(CSC1CCCC1)Nc1ccc(C2(NC(=O)c3cc(F)cc([N+](=O)[O-])c3)CCC2)cc1 1786348155 AGTBONRZBYXXDO-UHFFFAOYSA-N 471.554 5.157 5 20 JKBD Cc1ccc(S/C=C/C(=O)Nc2ccc(C3(NC(=O)c4ccc([N+](=O)[O-])[nH]4)CCC3)cc2)cc1 1789488978 FSMCXTSITNNYLM-DTQAZKPQSA-N 476.558 5.285 5 20 JKBD Cc1nc(C(=O)Nc2ccc(C3(NC(=O)CSc4ccccc4[N+](=O)[O-])CCC3)cc2)sc1C 1789984968 VSYGMUKONCUGIN-UHFFFAOYSA-N 496.614 5.208 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)[C@@H]3C[C@H]3c3ccc(Cl)cc3)CCC2)cc1)c1ccc([N+](=O)[O-])[nH]1 1790185750 DVPSCAFMVBDRSI-VQTJNVASSA-N 478.936 5.128 5 20 JKBD Cc1ccc(C(=O)NC2(c3ccc(NC(=O)/C=C/c4ccccc4[N+](=O)[O-])cc3)CCC2)c(C)n1 1792317256 HPQZCXGIQFKUND-OQLLNIDSSA-N 470.529 5.068 5 20 JKBD Cc1c(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2ccccc2C(F)(F)F)cc(Cl)cc1[N+](=O)[O-] 1799587363 CYNPYCYFKJATOW-MUJYYYPQSA-N 495.885 5.141 5 20 JKBD C[C@@H](C(=O)N1CCCC[C@H]1c1cc(NC(=O)Cc2ccc(Cl)cc2[N+](=O)[O-])n[nH]1)c1ccccc1 1814846351 OHWQKCKRQXVCBO-IERDGZPVSA-N 495.967 5.010 5 20 JKBD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2cc3sccc3s2)[nH]n1)c1cc(F)cc([N+](=O)[O-])c1 1821166190 NLWXHYPBZRFGQW-INIZCTEOSA-N 499.549 5.353 5 20 JKBD Cc1ccc(C(=O)N2CCCC[C@H]2C2CCN(C(=O)c3cc(Cl)cc([N+](=O)[O-])c3C)CC2)o1 1824684570 CIEWPTJFLTWCCZ-FQEVSTJZSA-N 473.957 5.005 5 20 JKBD O=C(c1cccc(F)c1[N+](=O)[O-])N1CCC([C@H]2CCCCN2C(=O)c2cccc(F)c2Cl)CC1 1830572763 WVNJRUPZSXEXPW-HXUWFJFHSA-N 491.922 5.074 5 20 JKBD C[C@@H](C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)CC1)n1cccc1 1832112696 AFZCHYXALQBWAF-AVRDEDQJSA-N 494.617 5.106 5 20 JKBD Cc1cc([N+](=O)[O-])ccc1NC(=O)COC(=O)c1ccccc1CSc1nc2ccccc2o1 9555926 IZYLNHRACWOWQW-UHFFFAOYSA-N 477.498 5.132 5 20 JKBD O=C(COC(=O)COc1ccc2oc3ccccc3c2c1)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 9785828 CPOQDFNMIFXHIP-UHFFFAOYSA-N 488.374 5.074 5 20 JKBD C[C@H](OC(=O)CCSc1ccccc1Cl)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 10404757 WZMOMMWOHJAJJB-NSHDSACASA-N 476.860 5.320 5 20 JKBD COc1cc(NC(=O)CNc2cc([N+](=O)[O-])ccc2Nc2ccccc2)c(OC)cc1Cl 11617845 VRRSCJFDLOOKKY-UHFFFAOYSA-N 456.886 5.060 5 20 JKBD O=C(Nc1ccccc1C(=O)OCc1csc(-c2ccccn2)n1)c1ccc([N+](=O)[O-])cc1Cl 12475209 LKHZLOZEJNWSCZ-UHFFFAOYSA-N 494.916 5.376 5 20 JKBD Cc1cc(C)c(CNC(=O)c2c3c(nc4ccccc24)/C(=C/c2ccc([N+](=O)[O-])cc2)CCC3)c(=O)[nH]1 12826199 VWZIQPSMQALZEI-HMMYKYKNSA-N 494.551 5.255 5 20 JKBD C[C@H](OC(=O)C[C@@H](NC(=O)c1ccccc1Cl)c1ccccc1)c1cccc([N+](=O)[O-])c1 21673029 VNHFYVGDABZFNR-KSFYIVLOSA-N 452.894 5.414 5 20 JKBD CCOC(=O)c1cc(C(=O)N(Cc2ccccc2)[C@H](C)c2cccc(NC(C)=O)c2)cc([N+](=O)[O-])c1 23193151 XZOQLKHKTFZNAB-GOSISDBHSA-N 489.528 5.134 5 20 JKBD CCn1c(S[C@H](C)C(=O)Nc2nc(-c3cccc([N+](=O)[O-])c3)cs2)nnc1-c1cccs1 36654478 USTDFVKSEKPBBM-GFCCVEGCSA-N 486.604 5.178 5 20 JKBD Cc1ccc(NC(=O)[C@H](Sc2nnc(C)n2CCc2cccs2)c2ccccc2)c([N+](=O)[O-])c1 303145685 FFLKWEWFQQYYJU-JOCHJYFZSA-N 493.614 5.579 5 20 JKBD COc1ccccc1C[C@H]1CCCN1C(=O)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 478892039 CPAZQQSZSUBPIW-HXUWFJFHSA-N 491.510 5.072 5 20 JKBD CCCN(CC(=O)Nc1cc(Cl)ccc1Cl)C(=O)c1cc(SC)c(OC)cc1[N+](=O)[O-] 482334589 PZTKFWSOSXAZTL-UHFFFAOYSA-N 486.377 5.123 5 20 JKBD CCCn1c2ccccc2c2nnc(SCC(=O)Nc3ccc([N+](=O)[O-])cc3C(F)(F)F)nc21 495484782 OEFJNPMLLCTBDN-UHFFFAOYSA-N 490.467 5.047 5 20 JKBD COc1cc(CN(C(=O)c2csc(-c3cccc([N+](=O)[O-])c3)n2)C2CC2)ccc1OC(F)F 498344893 QFCOMNLBBHIHIM-UHFFFAOYSA-N 475.473 5.133 5 20 JKBD COc1ccc(Br)cc1[C@@H]1CCCN1C(=O)[C@H](C)Sc1ccc([N+](=O)[O-])cc1 504857098 JIDRBNXHXUTNAX-UGSOOPFHSA-N 465.369 5.210 5 20 JKBD Cc1nnc(Sc2ccc(NC(=O)CCNc3ccc(C(F)(F)F)cc3[N+](=O)[O-])c(C)c2)s1 505945142 SGJYTVJHEKXFFF-UHFFFAOYSA-N 497.524 5.674 5 20 JKBD Cc1csc(N(CC(F)(F)F)C(=O)C2CCN(c3ccc(C(F)(F)F)cc3[N+](=O)[O-])CC2)n1 511703156 NMZAOQGNMKCRTG-UHFFFAOYSA-N 496.433 5.190 5 20 JKBD Cc1ccc([N+](=O)[O-])cc1NC(=O)CNc1ccc(Cl)cc1C(=O)N1[C@@H](C)CCC[C@@H]1C 515662799 JTLYBFOWCDYWHL-HOTGVXAUSA-N 458.946 5.010 5 20 JKBD Cc1noc(C)c1CNC(=O)c1c2c(nc3ccccc13)/C(=C\c1ccc([N+](=O)[O-])cc1)CCC2 516779546 UZHOTNQWMOPAMS-RGEXLXHISA-N 468.513 5.555 5 20 JKBD CC(=O)Nc1ccc(-c2csc(NC(=O)c3ccc(NCc4ccccc4)c([N+](=O)[O-])c3)n2)cc1 599531683 JOMHRKMIZIFXHO-UHFFFAOYSA-N 487.541 5.541 5 20 JKBD CCOc1cc(NC(=O)c2ccc(C)c(NC(=O)c3ccccc3F)c2)c([N+](=O)[O-])cc1OCC 603638995 LCWSGVFZLCKHFQ-UHFFFAOYSA-N 481.480 5.344 5 20 JKBD O=C(c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1)N1CCC[C@H](OCC(F)(F)F)C1 603981477 FVZQZCSFOWHEIN-INIZCTEOSA-N 458.820 5.224 5 20 JKBD C[C@H](c1cccs1)N(C)C(=O)c1ccc(C(=O)N(C)[C@H](C)c2cccs2)c([N+](=O)[O-])c1 609044974 XLOVENPDRXIFEK-HUUCEWRRSA-N 457.577 5.384 5 20 JKBD O=C(CCc1nc2cc(Cl)ccc2s1)N(Cc1ccccc1[N+](=O)[O-])CC(F)(F)F 609326752 AJZZBMCFJFCOED-UHFFFAOYSA-N 457.861 5.382 5 20 JKBD CCc1cc[n+](/C(C(=S)Nc2ccccc2-c2ccccc2)=C(/O)c2ccc(C)c([N+](=O)[O-])c2)cc1 725763744 LUUXLOWFFNKGKG-UHFFFAOYSA-O 496.612 6.743 5 20 JKBD Cc1c(Br)cccc1NC(=O)N1CCN(c2ccc([N+](=O)[O-])cc2C(F)(F)F)CC1 727594899 DMXHOMICJKRIEN-UHFFFAOYSA-N 487.276 5.039 5 20 JKBD C[C@H](OC(=O)[C@H]1C[C@@H]1c1ccc(Cl)c(Cl)c1)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 727927050 LNANLQQIKOTEEE-BIMULSAOSA-N 491.249 5.594 5 20 JKBD O=C(Cc1csc(-c2ccc3c(c2)OCO3)n1)N(CC1CC1)c1ccc(Cl)c([N+](=O)[O-])c1 728164954 DMOGQYFXRHCNKW-UHFFFAOYSA-N 471.922 5.086 5 20 JKBD Cc1c(C(C)(C)C)nn(-c2ccccc2)c1NC(=O)c1ccc(Br)c([N+](=O)[O-])c1 730504424 KENRSDJREHVTCV-UHFFFAOYSA-N 457.328 5.401 5 20 JKBD CCc1ccc(N(C(C)=O)c2nc(COC(=O)c3c(Cl)cccc3[N+](=O)[O-])cs2)cc1 730643095 HRTZZJLPAQDNGX-UHFFFAOYSA-N 459.911 5.309 5 20 JKBD O=C(Cc1csc(-c2ccccn2)n1)Oc1ccc2c(-c3ccc([N+](=O)[O-])cc3)cc(=O)oc2c1 743918814 ALCRSWICUNFGQO-UHFFFAOYSA-N 485.477 5.035 5 20 JKBD CC(C)c1ccc(CN(C(=O)COC(=O)c2csc(-c3cccc([N+](=O)[O-])c3)n2)C2CC2)cc1 747955812 MQVBWAIBVCFVIX-UHFFFAOYSA-N 479.558 5.190 5 20 JKBD Cc1c(C(=O)N2CCCC[C@H]2C(=O)Nc2cc(Cl)ccc2Cl)cc([N+](=O)[O-])c(C)c1[N+](=O)[O-] 748838465 TWNXILDOHOWHJE-KRWDZBQOSA-N 495.319 5.060 5 20 JKBD Cc1cc(Cc2cnc(NC(=O)c3cc(F)ccc3[N+](=O)[O-])s2)ccc1Br 751087071 OUXOHIOFMPHNCX-UHFFFAOYSA-N 450.289 5.104 5 20 JKBD O=C(Nc1ccccc1C(=O)Nc1nc2ccccc2s1)c1ccc([N+](=O)[O-])cc1Cl 912450844 JTTKDCUBGXBMPI-UHFFFAOYSA-N 452.879 5.363 5 20 JKBD Cc1ccc(NC(=O)[C@H](OC(=O)c2cc(C)n(Cc3ccccn3)c2C)c2ccccc2)c([N+](=O)[O-])c1 914613453 HCZKSSHDSKRJKR-AREMUKBSSA-N 498.539 5.302 5 20 JKBD O=C(CCC(=O)N1CCc2sccc2C1)Nc1cc(Cl)c([N+](=O)[O-])cc1OCc1ccccc1 917610058 KCKQZHBXXYDOEW-UHFFFAOYSA-N 499.976 5.192 5 20 JKBD O=C(Nc1ccc(OC(=O)c2cccn2Cc2cccs2)cc1)c1cc([N+](=O)[O-])ccc1Cl 918214730 XXOILAVCDUMUOJ-UHFFFAOYSA-N 481.917 5.631 5 20 JKBD O=C(OCc1nc(-c2cccc([N+](=O)[O-])c2)no1)c1c(Cl)cc(C(F)(F)F)cc1Cl 919298000 VARBHQLMAOWIHT-UHFFFAOYSA-N 462.167 5.327 5 20 JKBD Cc1ccc(CCC(=O)Nc2ccc(C3(NC(=O)c4c(F)ccc([N+](=O)[O-])c4C)CCC3)cc2)nc1 1786868418 YFNDQPPQBYFPQZ-UHFFFAOYSA-N 490.535 5.126 5 20 JKBD O=C(NC1(c2ccc(NC(=O)c3sc4ccccc4c3Cl)cc2)CCC1)c1nc[nH]c1[N+](=O)[O-] 1788990249 GNVZMQASZXHHNH-UHFFFAOYSA-N 495.948 5.248 5 20 JKBD Cc1ncc(/C=C/C(=O)NC2(c3ccc(NC(=O)c4c(F)ccc([N+](=O)[O-])c4C)cc3)CCC2)s1 1790772316 IQVPGXCOFYRRQX-DHZHZOJOSA-N 494.548 5.268 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)Nc1ccc(C2(NC(=O)[C@@H]3CCC(F)(F)C3)CCC2)cc1 1790774835 NUZHGJVLXQJPBI-OAHLLOKOSA-N 475.467 5.225 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)c3cccc(F)c3[N+](=O)[O-])CCC2)cc1)c1ccc2ccoc2c1 1790892274 AZEUBRJWSOZNLX-UHFFFAOYSA-N 473.460 5.542 5 20 JKBD O=C(CCCc1cccnc1)Nc1ccc(C2(NC(=O)CCc3cccc([N+](=O)[O-])c3)CCC2)cc1 1791948779 IELLOEVVBYHUIL-UHFFFAOYSA-N 486.572 5.079 5 20 JKBD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc([N+](=O)[O-])cc1F)c1cccc2c1oc1ccccc12 1800352529 OCPQKQXKAOZRTD-BJWYYQGGSA-N 487.487 5.199 5 20 JKBD Cc1c(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)oc2ccccc12 1801207023 PPQMVMJQZHEXJX-BCDXTJNWSA-N 489.553 5.430 5 20 JKBD CC(C)(C)CCCCCC(=O)N1CC[C@H](CNC(=O)c2cc(F)cc([N+](=O)[O-])c2)[C@H]1c1cccnc1 1811306928 JDEZEEOKYWTOED-CJFMBICVSA-N 498.599 5.445 5 20 JKBD O=C(CCc1cccc([N+](=O)[O-])c1)Nc1cc([C@H]2CCCCN2C(=O)c2ccc3occc3c2)[nH]n1 1815537166 POSMQOZAKLXRIK-JOCHJYFZSA-N 487.516 5.003 5 20 JKBD O=C(/C=C/c1ccc([N+](=O)[O-])o1)N1CCC([C@H]2CCCCN2C(=O)c2csc3c2CCCC3)CC1 1828565601 NGPRFRNIPJVMQX-DQACCSDVSA-N 497.617 5.075 5 20 JKBD Cc1cc(Cl)ccc1C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2ccc([N+](=O)[O-])cc2F)CC1 1830493557 WNXFKQXPDHXBQP-QHCPKHFHSA-N 487.959 5.243 5 20 JKBD Cc1ccc([C@H](C)C(=O)N2CCC([C@H]3CCCCN3C(=O)c3cc(F)cc([N+](=O)[O-])c3)CC2)cc1 1830615431 FASARTVUVSYMDJ-UQBPGWFLSA-N 481.568 5.079 5 20 JKBD COc1cc(C(=O)N2CCC([C@@H]3CCCCN3C(=O)C[C@@H](C)c3ccccc3)CC2)ccc1[N+](=O)[O-] 1831510268 LDNBPGZAWXFGQR-YKSBVNFPSA-N 493.604 5.031 5 20 JKBD CC(C)n1ncc2c(C(=O)Nc3nc(-c4cccc([N+](=O)[O-])c4)cs3)cc(-c3ccco3)nc21 10679995 QHUIUYZJOYHZQC-UHFFFAOYSA-N 474.502 5.556 5 20 JKBD CC[C@@H](C)c1ccccc1NC(=O)[C@@H](C)OC(=O)Cn1c2ccccc2c(=O)c2ccccc21 10722837 NOTAMPOOXPBJGA-RTBURBONSA-N 456.542 5.239 5 20 JKBD C[C@@H](OC(=O)C1c2ccccc2Oc2ccccc21)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 10798394 FLNGYCLHJHNHTM-CYBMUJFWSA-N 486.402 5.422 5 20 JKBD Cc1ccc(-c2cc(C(=O)O[C@H](C)C(=O)Nc3cc([N+](=O)[O-])ccc3Cl)c3c(C)noc3n2)cc1 12177517 MUYNXLHHGPKWIJ-CQSZACIVSA-N 494.891 5.252 5 20 JKBD CCCc1nnc(NC(=O)C/C(=C/c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)s1 18840831 JYXQBNGRSBJKHG-QINSGFPZSA-N 465.560 5.578 5 20 JKBD CCn1cnnc1-c1cccc(NC(=O)c2ccc(NCc3ccccc3Cl)c([N+](=O)[O-])c2)c1 25281300 MDDPGXVJXCVIRY-UHFFFAOYSA-N 476.924 5.391 5 20 JKBD CCc1ccc(-c2csc(NC(=O)c3cc(OC)c(OC(F)F)cc3[N+](=O)[O-])n2)s1 29580050 IOLLWSXIZGBGOI-UHFFFAOYSA-N 455.464 5.205 5 20 JKBD CC(=O)NCc1ccc(-c2nc(NC(=O)c3cc4cc([N+](=O)[O-])ccc4s3)sc2C)s1 30157000 JDZBAFITXXRTAV-UHFFFAOYSA-N 472.573 5.191 5 20 JKBD O=C(c1ccc(NCc2ccccc2Cl)c([N+](=O)[O-])c1)N1CCC[C@@H](c2nc3ccccc3o2)C1 31129094 AWNGPCVLHCXCLH-LJQANCHMSA-N 490.947 6.021 5 20 JKBD COC(=O)c1cc(C(=O)Nc2sc3c(c2-c2nc4ccccc4[nH]2)CCCC3)cc([N+](=O)[O-])c1 69298162 GMUSZVVIBJDQFS-UHFFFAOYSA-N 476.514 5.117 5 20 JKBD Cc1cc(Sc2ncccn2)ccc1NC(=O)Cn1c2ccccc2c(=O)c2ccccc21 110048069 QBVDEFKDNSBYMT-UHFFFAOYSA-N 452.539 5.043 5 20 JKBD O=C(NCc1ccc(CN2CCCC2=O)cc1)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1 195533371 QCQHVSLFJDNKKO-UHFFFAOYSA-N 479.920 5.093 5 20 JKBD O=[N+]([O-])c1ccc(-c2nn(-c3ccccc3)cc2CN[C@@H](c2ccccc2)c2ccco2)cc1 215865167 CTIDHTHUUYVNEK-MHZLTWQESA-N 450.498 5.920 5 20 JKBD COc1ccc(OC)c([C@H](C)NCc2cn(-c3ccccc3)nc2-c2ccc([N+](=O)[O-])cc2)c1 215866227 DHARDVFJMDMOAM-SFHVURJKSA-N 458.518 5.316 5 20 JKBD Cc1cc(O[C@H](C)c2ccccc2)ccc1NC(=O)c1nn(-c2ccccc2[N+](=O)[O-])c(C)cc1=O 303236080 ZLDZSDHFTZYGNI-LJQANCHMSA-N 484.512 5.150 5 20 JKBD C[C@@H](Nc1ccc(C(=O)Nc2ncc(Cc3ccc(F)cc3)s2)cc1[N+](=O)[O-])c1ccccn1 410016150 QSFNWKCQLAPYAQ-OAHLLOKOSA-N 477.521 5.602 5 20 JKBD Cc1ccc(C(=O)NC2CC2)cc1NC(=O)c1ccc(NCc2ccccc2Cl)c([N+](=O)[O-])c1 483669300 GSYPUBUYLKXEQH-UHFFFAOYSA-N 478.936 5.313 5 20 JKBD O=C(c1cc(F)ccc1F)C1CCN(C(=O)c2cc([N+](=O)[O-])ccc2Sc2ccccc2)CC1 483695863 CQOKHHFFWZZXOM-UHFFFAOYSA-N 482.508 5.759 5 20 JKBD COc1ccc(CSCC(=O)N2CCC[C@@H]2c2ccc(Cl)c(Cl)c2)cc1[N+](=O)[O-] 487920862 VOKAKDHGAMKBHZ-QGZVFWFLSA-N 455.363 5.507 5 20 JKBD CC(=O)Nc1cccc2c1CCCN2C(=O)c1ccc(Sc2ccc(C)cc2)c([N+](=O)[O-])c1 491279354 QDJMXTUAAVDROD-UHFFFAOYSA-N 461.543 5.606 5 20 JKBD O=C(Nc1ccc(Cl)c(-c2nnc3n2CCCCC3)c1)c1csc(-c2ccc([N+](=O)[O-])cc2)n1 496384194 YFUGXFNOLFMROS-UHFFFAOYSA-N 494.964 5.609 5 20 JKBD Cc1cc(N2CCSCC2)ccc1NC(=O)CSc1ccc(C(F)(F)F)cc1[N+](=O)[O-] 497317979 DEIZDQQFNKRBII-UHFFFAOYSA-N 471.526 5.206 5 20 JKBD O=C(CSc1ccc(C(F)(F)F)cc1[N+](=O)[O-])NCc1ccc(Oc2cccc(F)c2)nc1 501747330 ZQPCVYCVOVKTNA-UHFFFAOYSA-N 481.427 5.349 5 20 JKBD O=C(Nc1cccc(COC2CCCCC2)c1)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-] 502317296 HGLNIHZAMWGLDR-UHFFFAOYSA-N 452.429 5.638 5 20 JKBD C[C@@H]1Cc2cc([N+](=O)[O-])ccc2N1C(=O)C[C@H](NC(=O)c1ccccc1Cl)c1ccccc1 504265362 CNOZNANBFLMBOH-ZHRRBRCNSA-N 463.921 5.087 5 20 JKBD Cn1cc(C(=O)N2CCC(c3nc4cc(Cl)ccc4s3)CC2)c(-c2ccc([N+](=O)[O-])cc2)n1 506074069 ZXFGXHKKEWNCKQ-UHFFFAOYSA-N 481.965 5.278 5 20 JKBD O=C(NCCc1coc(-c2ccc(F)cc2)n1)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1 507159724 YDLHIWXTXSPUEX-UHFFFAOYSA-N 481.867 5.807 5 20 JKBD O=C(CSc1nnc(-c2cccnc2)n1-c1ccc(Cl)c(Cl)c1)c1ccc([N+](=O)[O-])cc1 513970614 UATMPLPSRJLKDX-UHFFFAOYSA-N 486.340 5.519 5 20 JKBD O=C(Cc1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1)Nc1cc2c(cc1Cl)OCCO2 515061538 BCWMKPNTYYBSPM-UHFFFAOYSA-N 490.903 5.053 5 20 JKBD O=C(Nc1ccccc1NCc1ccc([N+](=O)[O-])cc1)c1ccccc1I 519169648 WCZNSQBEFUKQKP-UHFFFAOYSA-N 473.270 5.064 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Br)[C@H](Nc1ccc2ncsc2c1)c1ccccc1 520029378 URSBCMIUZXNJAG-HXUWFJFHSA-N 483.347 5.759 5 20 JKBD O=C(c1cc([N+](=O)[O-])ccc1Sc1ccc(Cl)cc1)N1CCC(N2CCCCC2)CC1 521181362 PBKMPCLROYHMJC-UHFFFAOYSA-N 459.999 5.490 5 20 JKBD Cc1sc(NC(=O)c2cn(C)nc2-c2ccccc2Cl)nc1-c1cccc([N+](=O)[O-])c1 521762212 DFKALBJCUUSEIC-UHFFFAOYSA-N 453.911 5.333 5 20 JKBD O=C(Nc1ccc(Br)cn1)c1cccc(NC(=O)c2cc3cc([N+](=O)[O-])ccc3o2)c1 523676930 FPXLIUNQMOOGHS-UHFFFAOYSA-N 481.262 5.003 5 20 JKBD CCOc1cc(NC(=O)c2ccccc2OCc2cn3cccc(C)c3n2)c([N+](=O)[O-])cc1OCC 591351475 XWBNTLSLRGRNHU-UHFFFAOYSA-N 490.516 5.180 5 20 JKBD O=[N+]([O-])c1cc(S(=O)(=O)Nc2ccccc2)ccc1N1CCC[C@@H]1c1nc2ccccc2s1 603473299 XDSQPXWGRPRBJK-HXUWFJFHSA-N 480.571 5.347 5 20 JKBD CN(Cc1cccc2ccccc12)C(=O)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 603508932 YKFHHMSEAIRQLC-UHFFFAOYSA-N 471.479 5.642 5 20 JKBD Cn1ccnc1[C@H](NCc1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1)c1ccccc1F 603633440 JBWKRZNJWBWBDX-HSZRJFAPSA-N 466.900 5.792 5 20 JKBD Cc1nc(-c2ccc(NC(=O)N[C@H](CC(=O)OC(C)C)c3ccccc3[N+](=O)[O-])cc2)cs1 603652243 XEKAVUNAEQNJAN-LJQANCHMSA-N 468.535 5.231 5 20 JKBD COCCN(C(=O)c1ccc(Oc2ccccc2)nc1)c1nc(-c2ccc([N+](=O)[O-])cc2)cs1 603750547 SAFPABYSLWCXSE-UHFFFAOYSA-N 476.514 5.199 5 20 JKBD Cc1ccc2c(C3=CCN(C(=O)c4cc(OCC(F)(F)F)ccc4[N+](=O)[O-])CC3)c[nH]c2c1 604104003 ZSTYAPWOBNTWIU-UHFFFAOYSA-N 459.424 5.255 5 20 JKBD C[C@H](NCc1ccc(-c2ccc([N+](=O)[O-])cc2Br)o1)c1nc2ccccc2n1C(F)F 609006721 SPOHOLDKEKWXPV-LBPRGKRZSA-N 491.292 6.213 5 20 JKBD CC(C)[C@H](C)N1Cc2cccc(N[C@H](C)C(=O)Nc3ccc([N+](=O)[O-])cc3C(F)(F)F)c2C1 609041237 GTYXNXLUMLFLIJ-CABCVRRESA-N 464.488 5.413 5 20 JKBD C[C@@H](SCCOc1ccc([N+](=O)[O-])cc1)c1nc(O)c2c(-c3ccccc3)csc2n1 609387588 VNIIRFKYWAQLFO-CQSZACIVSA-N 453.545 5.845 5 20 JKBD C[C@@H](Sc1nc2cc3ccccc3cc2c(=O)n1C)C(=O)N[C@H](C)c1cc2ccccc2o1 622146057 HPVHJTXOJNRAQQ-HZPDHXFCSA-N 457.555 5.191 5 20 JKBD CC(C)CCSc1ccc(C(=O)N2CCCN(C(=O)Oc3ccccc3)CC2)cc1[N+](=O)[O-] 725756950 HRCOVDNRQQCSHY-UHFFFAOYSA-N 471.579 5.080 5 20 JKBD Cc1nc(-c2ccsc2)ccc1C(=O)O[C@@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 726233351 KSOPRWLKUIMBGT-LBPRGKRZSA-N 479.436 5.230 5 20 JKBD Cc1cc(S(N)(=O)=O)cc(NC(=O)CCC(=O)c2ccc3ccc4cccc5ccc2c3c45)c1C 728151567 LVPOCSBHYIBXMN-UHFFFAOYSA-N 484.577 5.450 5 20 JKBD CC(C)(C)OC(=O)Nc1ccc(NC(=O)c2cc3cc([N+](=O)[O-])ccc3s2)c(C(F)(F)F)c1 729655281 KSRDOQZIYLSIRT-UHFFFAOYSA-N 481.452 6.428 5 20 JKBD O=C(O[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1)c1csc(-c2ccoc2)n1 731090301 CCLSYEXUYPTNIM-IBGZPJMESA-N 483.889 5.502 5 20 JKBD C[C@H](OC(=O)c1csc(-c2cccc([N+](=O)[O-])c2)n1)C(=O)N(c1nccs1)C1CCCCC1 747960710 AHFBJIIPRBGDAT-AWEZNQCLSA-N 486.575 5.086 5 20 JKBD CSc1ccc([N+](=O)[O-])c(C(=O)OCC(=O)N2c3ccccc3Sc3ccc(Cl)cc32)c1 761198686 SQVNPTYINKRYJM-UHFFFAOYSA-N 486.958 5.956 5 20 JKBD C[C@@H](OC(=O)CCOc1ccc(Cl)cc1Cl)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 919490128 DOYRISRNGSUQOD-LLVKDONJSA-N 452.250 5.025 5 20 JKBD Cc1nc(-c2cccc(NC(=O)C3CCN(c4ccc(C(F)(F)F)cc4[N+](=O)[O-])CC3)c2)[nH]c1C 920269587 IQQXAXGDCJGBLQ-UHFFFAOYSA-N 487.482 5.476 5 20 JKBD O=C(Cn1ccc2ccc([N+](=O)[O-])cc21)Nc1ccc(C2(NC(=O)c3cccc(F)c3)CCC2)cc1 1786277563 NSBOCUCLAKJYIA-UHFFFAOYSA-N 486.503 5.137 5 20 JKBD CCc1ncccc1C(=O)Nc1ccc(C2(NC(=O)/C=C/c3ccccc3[N+](=O)[O-])CCC2)cc1 1787095748 AWKJZJJANXWGPS-XNTDXEJSSA-N 470.529 5.013 5 20 JKBD COc1cc(C(=O)NC2(c3ccc(NC(=O)c4cccc(Cl)c4)cc3)CCC2)c([N+](=O)[O-])cc1O 1790264877 AUXHYVIUHQDFNL-UHFFFAOYSA-N 495.919 5.024 5 20 JKBD O=C(CSc1ccccc1[N+](=O)[O-])Nc1ccc(C2(NC(=O)COC3CCCCC3)CCC2)cc1 1791521600 CJZHMMRXJQNGQR-UHFFFAOYSA-N 497.617 5.170 5 20 JKBD O=C(NC1(c2ccc(NC(=O)[C@@H]3CCCS3)cc2)CCC1)c1cc2cc([N+](=O)[O-])ccc2s1 1792012575 FOAZQOSOHCWQKZ-FQEVSTJZSA-N 481.599 5.453 5 20 JKBD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc2cc([N+](=O)[O-])ccc2s1)c1ccc(Cl)cc1F 1801206585 VZRAMPDXWDYZMU-MUJYYYPQSA-N 487.940 5.168 5 20 JKBD CC[C@H](C(=O)N1CCCC2(CCN(C(=O)Cc3ccc(Cl)cc3[N+](=O)[O-])CC2)C1)c1ccccc1 1809006075 JAVOOVZSECLYDL-QHCPKHFHSA-N 498.023 5.216 5 20 JKBD Cc1c(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)[C@H](C)Cc3ccco3)n[nH]2)cc(Cl)cc1[N+](=O)[O-] 1822846929 MBKVIPIEWZKFLK-JLTOFOAXSA-N 499.955 5.057 5 20 JKBD O=C(c1cc2cc([N+](=O)[O-])ccc2s1)N1CCC([C@@H]2CCCCN2C(=O)C2=CCCS2)CC1 1824566299 FHOAYRPXRCLGQU-IBGZPJMESA-N 485.631 5.064 5 20 JKBD CC(F)(F)C(C)(C)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)Cc2ccc(Cl)cc2[N+](=O)[O-])CC1 1824628862 MPHQYRUZPJSAGS-LJQANCHMSA-N 499.986 5.092 5 20 JKBD O=C(c1ccc(F)s1)N1CCCC[C@@H]1C1CCN(C(=O)C2(c3cccc([N+](=O)[O-])c3)CCC2)CC1 1825351593 XMMLGAVHUKZMHV-OAQYLSRUSA-N 499.608 5.151 5 20 JKBD Cc1c(C(=O)N2CCC([C@@H]3CCCCN3C(=O)Cc3cccs3)CC2)cc(Cl)cc1[N+](=O)[O-] 1827160339 QOMDEFSAYNZSGF-NRFANRHFSA-N 490.025 5.094 5 20 JKBD CCC[C@H]1CC[C@H](C(=O)N2CCCC[C@H]2C2CCN(C(=O)c3ccc(O)c([N+](=O)[O-])c3)CC2)CC1 1831562579 UKJXHVTXKNARDK-RRPUWOKSSA-N 485.625 5.140 5 20 JKBD O=C(c1c(F)cccc1Cl)N1CCC([C@@H]2CCCCN2C(=O)/C=C/c2ccccc2[N+](=O)[O-])CC1 1832905583 YFRGDSBZWQFFHM-LEQVUBRHSA-N 499.970 5.334 5 20 JKBD O=C(Cn1c2ccccc2c(=O)c2ccccc21)O[C@H](C(=O)Nc1ccccc1)c1ccccc1 10723442 YXXVVCLZYBISIN-NDEPHWFRSA-N 462.505 5.078 5 20 JKBD C[C@H](OC(=O)c1c(Cl)cccc1Cl)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 11112407 WHQNUDAWRUYNGI-QMMMGPOBSA-N 451.184 5.104 5 20 JKBD O=C(COC(=O)c1ccccc1-c1ncc(-c2ccccc2)o1)Nc1ccc([N+](=O)[O-])cc1Cl 19164830 UQXKDUQJAGVHHB-UHFFFAOYSA-N 477.860 5.366 5 20 JKBD CCOc1cc(C(=O)O[C@H](C(=O)Nc2cc(C)ccc2C)c2ccccc2)c([N+](=O)[O-])cc1OC 19473004 QNKKVLMBOREGRL-DEOSSOPVSA-N 478.501 5.156 5 20 JKBD CN(Cc1cn(-c2ccccc2)nc1-c1ccc(Cl)cc1)C(=O)Cc1ccccc1[N+](=O)[O-] 23228914 JSKCIDMYZDYOAC-UHFFFAOYSA-N 460.921 5.302 5 20 JKBD Cc1ccc(NC(=O)[C@@H](OC(=O)c2cc3cnn(C(C)C)c3nc2C)c2ccccc2)c([N+](=O)[O-])c1 26255754 WACDLFXEHOIGCS-QHCPKHFHSA-N 487.516 5.074 5 20 JKBD O=C(CSc1nc2sc3c(c2c(=O)n1C1CCCC1)CCCC3)Nc1ccccc1[N+](=O)[O-] 28450860 CFGIOUXYIZZOQG-UHFFFAOYSA-N 484.603 5.091 5 20 JKBD CCOc1cc(C(=O)NC[C@H](c2ccc(OC)cc2)c2c[nH]c3ccccc23)c([N+](=O)[O-])cc1OC 36772497 WYJSURZLISSUFT-OAQYLSRUSA-N 489.528 5.054 5 20 JKBD CC[C@@H](C(=O)N1CCC(NC(=O)c2cc([N+](=O)[O-])ccc2Oc2ccccc2)CC1)c1ccccc1 72056932 OTBHFSDNXZFCHE-XMMPIXPASA-N 487.556 5.302 5 20 JKBD C[C@@H](Nc1ccc(C(=O)N2CCCc3cc(Br)ccc32)cc1[N+](=O)[O-])c1ccccn1 108886304 GACRGWNXHBQJBG-OAHLLOKOSA-N 481.350 5.518 5 20 JKBD CC(C)[C@H](NC(=O)c1ccc(NCc2ccccc2Cl)c([N+](=O)[O-])c1)c1nc(C2CC2)no1 110700627 OCCCRRUGURBKES-FQEVSTJZSA-N 469.929 5.248 5 20 JKBD C[C@H](Nc1ccc(C(=O)Nc2ccc3nc(N(C)C)ccc3c2)cc1[N+](=O)[O-])c1ccccn1 195742650 BBEDMGQLAWKRME-INIZCTEOSA-N 456.506 5.029 5 20 JKBD O=C(Nc1ccc(-c2nc3ccccc3s2)cn1)C1CCN(c2ccccc2[N+](=O)[O-])CC1 216527201 LQADUPHCFGFECB-UHFFFAOYSA-N 459.531 5.122 5 20 JKBD C[C@H](Nc1ccc(C(=O)N[C@H](C)c2nc(-c3ccccc3)cs2)cc1[N+](=O)[O-])c1ccccn1 410288336 KTZIVODFDIHUBG-DLBZAZTESA-N 473.558 5.777 5 20 JKBD CC(C)Cc1ccc(C(=O)C2CCN(C(=O)CCCNc3ccc([N+](=O)[O-])cc3)CC2)cc1 479879400 AZLQIEWEKPAUFE-UHFFFAOYSA-N 451.567 5.107 5 20 JKBD O=C(c1csc(-c2ccc([N+](=O)[O-])cc2)n1)N(Cc1cccnc1)c1ccc(Cl)cc1 496269415 ZQSMPHFFAYPJMF-UHFFFAOYSA-N 450.907 5.614 5 20 JKBD Cc1occc1-c1nnc(S[C@@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)n1-c1ccccc1 501212033 YURWNKJSQRKJPR-HNNXBMFYSA-N 474.502 5.647 5 20 JKBD COc1cc(C(=O)N[C@H](c2ccc(F)cc2)c2ccccc2Cl)c([N+](=O)[O-])cc1OC(F)F 502350954 DFELMVLRSBICOC-HXUWFJFHSA-N 480.826 5.517 5 20 JKBD CC1CCC(NS(=O)(=O)c2ccc(N[C@@H](c3ccccc3)c3nccs3)c([N+](=O)[O-])c2)CC1 505559155 IDVGGROVEAZTST-QRFVXNFXSA-N 486.619 5.110 5 20 JKBD O=C(C1CCN(c2ccccc2[N+](=O)[O-])CC1)N1CCC(c2nc3cc(Cl)ccc3o2)CC1 515577026 BPSICQZZBJQWDS-UHFFFAOYSA-N 468.941 5.012 5 20 JKBD COc1cc(C(=O)Nc2cc(C(C)(C)C)nn2-c2cccc(Cl)c2)c([N+](=O)[O-])cc1OC 517378453 KPHGXAZWNBUANT-UHFFFAOYSA-N 458.902 5.001 5 20 JKBD CN(Cc1ccccc1F)C(=O)C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1 518299637 UKKVWVVSFATLKZ-XMHGGMMESA-N 461.518 5.933 5 20 JKBD O=C(Nc1cc(-c2cccc([N+](=O)[O-])c2)[nH]n1)c1cnn(-c2ccc(Cl)cc2)c1C(F)(F)F 520570396 GUIXTMBDCACPQR-UHFFFAOYSA-N 476.802 5.095 5 20 JKBD O=C(c1ccc(C(=O)N2CCC[C@H]2c2ccccc2)c([N+](=O)[O-])c1)N1CCC[C@H]1c1ccccc1 524353865 OUVWKRJSVPVGHL-DQEYMECFSA-N 469.541 5.549 5 20 JKBD O=[N+]([O-])c1ccc(-c2ccc(CNCc3ccnc(N4CCN(c5ccc(F)cc5)CC4)c3)o2)cc1 549178851 OBHBYLWGCPLKKZ-UHFFFAOYSA-N 487.535 5.005 5 20 JKBD O=[N+]([O-])c1ccc(-c2nn(-c3ccccc3)cc2CNCc2nc3cc(Cl)ccc3s2)cc1 558931696 JNMGVSJWPQXTSZ-UHFFFAOYSA-N 475.961 6.000 5 20 JKBD COC(=O)c1cc(NC(=O)c2ccc(NCc3ccccc3Cl)c([N+](=O)[O-])c2)c(F)cc1F 603230473 QEWRSEPXOXSGHG-UHFFFAOYSA-N 475.835 5.177 5 20 JKBD Cn1cnnc1Sc1ccc(C(=O)Nc2ccc(-c3cc4ccccc4o3)cc2)cc1[N+](=O)[O-] 603301825 HTNHJQOFDREZLO-UHFFFAOYSA-N 471.498 5.540 5 20 JKBD O=C(c1cc(F)ccc1F)C1CCN(c2c([N+](=O)[O-])cnc3ccc(Br)cc23)CC1 603862426 SJDDPGUQXLDGJT-UHFFFAOYSA-N 476.277 5.283 5 20 JKBD C[C@@H]1CCCN(c2ccc(C(=O)Nc3ccc(C(=O)N4CCCC[C@H]4C)cc3)cc2[N+](=O)[O-])C1 603993314 QVVXMQXLQKILQH-RTBURBONSA-N 464.566 5.098 5 20 JKBD O=C(NC[C@@H]1CCCN(C(=O)c2cc([N+](=O)[O-])ccc2Oc2ccccc2)C1)Nc1cccc(F)c1 608867182 YLCAXZCGPZYRRS-SFHVURJKSA-N 492.507 5.200 5 20 JKBD COc1ccccc1-n1c(Sc2ccc(C(C)=O)cc2[N+](=O)[O-])nnc1-c1cccs1 619670048 AFMJBOAOHONWGB-UHFFFAOYSA-N 452.517 5.266 5 20 JKBD O=C(Nc1ccc(Oc2ccc(F)cc2)c2ccncc12)c1cc([N+](=O)[O-])ccc1N1CCOCC1 727798323 CAWGHPOFYXMIFL-UHFFFAOYSA-N 488.475 5.163 5 20 JKBD O=C(OCc1cc([N+](=O)[O-])cc2c1OCOC2)c1ccccc1C(=O)c1ccc(Cl)c(Cl)c1 729726787 JQCFEJDLGDIXRE-UHFFFAOYSA-N 488.279 5.356 5 20 JKBD O=C(Nc1ccc(OC(=O)c2ccc(Cl)nc2Cl)cc1)c1cc([N+](=O)[O-])ccc1Cl 747625969 XOZKQJPFJGZMOQ-UHFFFAOYSA-N 466.664 5.422 5 20 JKBD C[C@H](OC(=O)c1csc(-c2cccc([N+](=O)[O-])c2)n1)c1nc(-c2cccc(C(F)(F)F)c2)no1 747961633 HAMVARWIWYWOQG-NSHDSACASA-N 490.419 5.705 5 20 JKBD Cc1c(C(=O)N2CCCC[C@H]2C(=O)Nc2ccc(Cl)cc2Cl)cc([N+](=O)[O-])c(C)c1[N+](=O)[O-] 748617708 CCMOSBUJCSJTIX-KRWDZBQOSA-N 495.319 5.060 5 20 JKBD O=C(O)/C=C/c1ccc(NC(=O)C/C(=C\c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)cc1 914730738 IEMGNWLYTKIIJF-UHGDPLQBSA-N 485.521 5.872 5 20 JKBD CCC(=O)Nc1cccc(C(=O)O[C@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2ccccc2)c1 917310747 FGQJLLNDBRYEBX-QFIPXVFZSA-N 481.892 5.134 5 20 JKBD O=C(Nc1cc([N+](=O)[O-])c(F)cc1F)c1nc(-c2ccccc2)n(-c2cccc(C(F)(F)F)c2)n1 918564095 VMIJHSDEOKGXNO-UHFFFAOYSA-N 489.360 5.392 5 20 JKBD CCO[C@@H](C(=O)Oc1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2Cl)cc1)c1ccccc1 920216122 JRQGEPFVVDGEDY-OAQYLSRUSA-N 454.866 5.184 5 20 JKBD C[C@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)Nc1cc(NC(=O)OC(C)(C)C)ccc1F 920819495 PZUFKSVBTUFMGC-NSHDSACASA-N 453.854 5.140 5 20 JKBD COc1cc(C(=O)NC2(c3ccc(NC(=O)c4cc5ccccc5o4)cc3)CCC2)ccc1[N+](=O)[O-] 1789005456 BIJGXLHPTGKXKQ-UHFFFAOYSA-N 485.496 5.411 5 20 JKBD C[C@H](Sc1ccccn1)C(=O)NC1(c2ccc(NC(=O)c3ccc([N+](=O)[O-])cc3F)cc2)CCC1 1790625189 VVXOMVHTJJWYIN-INIZCTEOSA-N 494.548 5.057 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)Nc1ccc(C2(NC(=O)c3ccc4c(c3)COC4)CCC2)cc1 1790771185 UHJJYOPKGAGIKT-UHFFFAOYSA-N 489.503 5.134 5 20 JKBD O=C(Cc1ccc([N+](=O)[O-])cc1F)Nc1ccc(C2(NC(=O)CCc3ccsc3)CCC2)cc1 1791184195 QXJQCPGJIVRTRP-UHFFFAOYSA-N 481.549 5.105 5 20 JKBD COc1cc(C(=O)Nc2ccc(C3(NC(=O)/C(C)=C/c4ccc(C)o4)CCC3)cc2)ccc1[N+](=O)[O-] 1792165882 SYQPVXIECKIGCO-BMRADRMJSA-N 489.528 5.356 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2ccc3occc3c2)[nH]n1 1821283523 LAXBIKXBPIQHDS-FQEVSTJZSA-N 491.479 5.131 5 20 JKBD O=C(Nc1cc([C@H]2CCCCN2C(=O)CCc2cccc([N+](=O)[O-])c2)[nH]n1)c1cccc2ccoc12 1821534283 IVNQYZFANCNCHZ-JOCHJYFZSA-N 487.516 5.003 5 20 JKBD CC[C@H](C(=O)N1CCC([C@H]2CCCCN2C(=O)Cc2cc([N+](=O)[O-])ccc2F)CC1)c1ccccc1 1824946798 QINMEMAAVBYASS-AZGAKELHSA-N 495.595 5.090 5 20 JKBD CN(C)c1ccc([N+](=O)[O-])cc1C(=O)N1CCC([C@H]2CCCCN2C(=O)/C=C/C2CCCCC2)CC1 1830355507 IYPMGAVAYYDCHO-IGQYLQMFSA-N 496.652 5.031 5 20 JKBD CC1(C)CC(C(=O)N2CCCC[C@H]2C2CCN(C(=O)C3(c4cccc([N+](=O)[O-])c4)CCC3)CC2)C1 1831930815 AIORCNOEHWOKOG-DEOSSOPVSA-N 481.637 5.072 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)N1CCC([C@H]2CCCCN2C(=O)[C@@H](C)c2cccs2)CC1 1832144933 DRCJBOFFCXHPIU-LAUBAEHRSA-N 487.597 5.141 5 20 JKBD O=C(c1cc2cc([N+](=O)[O-])ccc2s1)N1CC2(CCCN2C(=O)c2ccc3occ(Cl)c3c2)C1 1844748730 BDIISIBXLSUAJT-UHFFFAOYSA-N 495.944 5.340 5 20 JKBD Cc1ccc([N+](=O)[O-])cc1NC(=O)COC(=O)c1c2c(nc3ccccc13)/C(=C/c1ccco1)CC2 8620696 LEJJLXPOGGCFAV-GHRIWEEISA-N 483.480 5.327 5 20 JKBD CCOc1ccc(NC(=O)CSc2nnc(-c3ccco3)n2C2CCCCC2)c([N+](=O)[O-])c1 10015308 HJYAESBFMUSGAW-UHFFFAOYSA-N 471.539 5.081 5 20 JKBD CCOc1ccc(Oc2ccccc2NC(=O)c2cc(OC)c(OC(F)F)cc2[N+](=O)[O-])cc1 10963054 FQNIXOIRYGFYJC-UHFFFAOYSA-N 474.416 5.648 5 20 JKBD COc1ccc(C)cc1NC(=O)[C@H](OC(=O)c1ccc([N+](=O)[O-])cc1Cl)c1ccccc1 11028650 IHQZFKUTTOVCLG-OAQYLSRUSA-N 454.866 5.102 5 20 JKBD CCOc1ccc(NC(=O)[C@H](C)OC(=O)c2ccccc2C(=O)c2ccc(Cl)c([N+](=O)[O-])c2)cc1 15710218 DVGIVWWCIAZTGY-HNNXBMFYSA-N 496.903 5.062 5 20 JKBD COc1ccc(N2C(=O)CC[C@H](C(=O)Nc3cccc([N+](=O)[O-])c3C)[C@@H]2c2ccccc2OC)cc1 19164865 KFIKAKLUTHHCCR-LVXARBLLSA-N 489.528 5.043 5 20 JKBD COc1cc(C2SCCS2)ccc1OC(=O)c1ccc(Cn2nc(C)c([N+](=O)[O-])c2C)cc1 20009108 CNLYISBCXJEHOT-UHFFFAOYSA-N 485.587 5.163 5 20 JKBD CCCn1c(S[C@@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2C)nnc1-c1ccc(Cl)cc1 21669555 RJMUTBZRIWINHA-AWEZNQCLSA-N 459.959 5.344 5 20 JKBD CCn1c(SCC(=O)OCc2cc([N+](=O)[O-])ccc2OC)nnc1-c1ccc(Cl)cc1Cl 24163099 AYMMXTQSHCXWDF-UHFFFAOYSA-N 497.360 5.024 5 20 JKBD Cc1csc(SCc2c(C(=O)NCCNc3ccccc3[N+](=O)[O-])oc3ccccc23)n1 24320763 RPZIHVMCHWMPSL-UHFFFAOYSA-N 468.560 5.240 5 20 JKBD CCn1c(S[C@@H](C)c2nc(=O)c3c(C)c(C)sc3[nH]2)nc2cc3ccccc3cc2c1=O 24891846 BHZJICPEPUKZIO-AWEZNQCLSA-N 462.600 5.338 5 20 JKBD O=C(CSc1nnc(-c2cccs2)n1Cc1ccccc1)Nc1ccc([N+](=O)[O-])cc1Cl 36184232 OYONXZVRGMENJB-UHFFFAOYSA-N 485.978 5.347 5 20 JKBD CC(=O)Nc1ccc(Cl)c(NC(=O)Cc2cn(-c3ccccc3)nc2-c2ccc([N+](=O)[O-])cc2)c1 108420858 ZBOHZPJULIAQFU-UHFFFAOYSA-N 489.919 5.241 5 20 JKBD C[C@H](Nc1ccc(C(=O)Nc2ccc(NC(=O)c3ccco3)cc2)cc1[N+](=O)[O-])c1ccccn1 108789442 AAFDHFHHPVOHAP-INIZCTEOSA-N 471.473 5.261 5 20 JKBD Cc1ccc(-c2csc(NC(=O)c3cnn(-c4ccccc4F)c3C(F)(F)F)n2)cc1[N+](=O)[O-] 219452270 JXNFKVOJEWIJMS-UHFFFAOYSA-N 491.426 5.623 5 20 JKBD CCOC(=O)c1sc(N(Cc2ccccc2)C(=O)c2cc3cc([N+](=O)[O-])ccc3o2)nc1C 477236979 VDBIVJWMXLIIFP-UHFFFAOYSA-N 465.487 5.130 5 20 JKBD COc1ccc([C@H](C)N(C)C(=O)C/C(=C\c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)cc1 483220132 KAKYASQYGZSEDZ-SAGAUJLNSA-N 487.581 6.363 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)N2c3ccccc3CC[C@H]2C(=O)Nc2ccc(C)cc2)cc1SC 483699841 LMUGIWLXFCIHBF-NRFANRHFSA-N 491.569 5.234 5 20 JKBD C[C@@H](NCc1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1)c1ccc2c(c1)NC(=O)CO2 504131629 SZKQJBWAPHSLGZ-CQSZACIVSA-N 453.882 5.222 5 20 JKBD O=C(c1ccoc1)N1CCC(NCc2ccc(Oc3ccccc3Cl)c([N+](=O)[O-])c2)CC1 509605027 WZTYLDRYRGJSOM-UHFFFAOYSA-N 455.898 5.028 5 20 JKBD C[C@H](N[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1)c1ccc2c(c1)CCC(=O)N2 518472662 UKTLYDTWQWLYOH-OWJWWREXSA-N 478.936 5.164 5 20 JKBD O=C(Nc1nc(-c2ccc(OC(F)F)cc2OC(F)F)cs1)c1cccc([N+](=O)[O-])c1 519938632 MINONUBGGVGXRK-UHFFFAOYSA-N 457.361 5.173 5 20 JKBD CC(C)c1noc(CCCNC(=O)C/C(=C\c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)n1 522036913 VVWKWYYVXJPDCH-NBVRZTHBSA-N 491.573 5.391 5 20 JKBD CC(C)(C)c1ccc(C(=O)N2CCC[C@H](c3nc(-c4ccc(Cl)cc4)no3)C2)cc1[N+](=O)[O-] 522577200 BCMVGDPJSDAJDA-KRWDZBQOSA-N 468.941 5.616 5 20 JKBD O=C(N[C@@H](c1cccs1)C1CC1)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 589327581 XGCRXWZDUDKFKO-LJQANCHMSA-N 453.486 5.159 5 20 JKBD Cc1nn(Cc2ccc(C(=O)N(c3cccc(C(F)(F)F)c3)[C@@H](C)C3CC3)cc2)c(C)c1[N+](=O)[O-] 603964329 FFEYGQVOSQAATQ-INIZCTEOSA-N 486.494 5.921 5 20 JKBD CCc1nc2cc(N[C@H](C(=O)Nc3ccc([N+](=O)[O-])cc3Br)c3ccccc3)ccc2o1 604048224 XUORHSPEXZVWFZ-QFIPXVFZSA-N 495.333 5.853 5 20 JKBD C[C@@H](NC(=O)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1)c1ccc2nc(O)[nH]c2c1 604243893 NAKADAXJQQLLRQ-GFCCVEGCSA-N 452.854 5.113 5 20 JKBD CN(C(=O)c1ccc(C(=O)N(C)[C@H]2CCc3ccccc32)c([N+](=O)[O-])c1)[C@H]1CCc2ccccc21 609043774 RIBFGLVRKIRKSW-DQEYMECFSA-N 469.541 5.114 5 20 JKBD O=c1c2cc([N+](=O)[O-])ccc2nc2n1CC/C2=C/c1ccc(-c2cccc(Br)c2)o1 609335190 BKUXEJUHOFMWCT-KAMYIIQDSA-N 464.275 5.272 5 20 JKBD O=C(OCc1nnc(-c2c(Cl)cccc2Cl)o1)c1csc(-c2cccc([N+](=O)[O-])c2)n1 726640651 LHAPGQSRPFTFGH-UHFFFAOYSA-N 477.285 5.432 5 20 JKBD Cc1cccc(C(C)C)c1NC(=O)N1CCN(c2ccc([N+](=O)[O-])cc2C(F)(F)F)CC1 727585325 DESNXZHUCNPEDL-UHFFFAOYSA-N 450.461 5.400 5 20 JKBD CC(=O)N(c1ccc(C(F)(F)F)cc1)c1nc(COC(=O)c2cc(C)cc([N+](=O)[O-])c2N)cs1 727899145 ONQUGRZHJMCKJN-UHFFFAOYSA-N 494.451 5.002 5 20 JKBD CCOc1cc([N+](=O)[O-])c(C(=O)O[C@@H](C)c2ccccc2NC(=O)c2ccccc2)cc1OC 748016663 YERNPXSJKRLCFY-INIZCTEOSA-N 464.474 5.172 5 20 JKBD Cc1c(C(=O)Nc2ccc(NC(=O)c3ccoc3)cc2C(F)(F)F)cc([N+](=O)[O-])c(C)c1[N+](=O)[O-] 748621762 ZBTAYCNBXUCPIQ-UHFFFAOYSA-N 492.366 5.236 5 20 JKBD CC(C)(C)OC(=O)N1CCC[C@H]1[C@@H]1CCCCN1C(=O)c1csc(-c2ccc([N+](=O)[O-])cc2)n1 751409117 GVPMYSHAXZHLOZ-PMACEKPBSA-N 486.594 5.113 5 20 JKBD O=C(COC(=O)c1sc2cccc(Cl)c2c1Cl)Nc1cc2c(cc1[N+](=O)[O-])OCCCO2 913330829 FVPZXYHIYOVNET-UHFFFAOYSA-N 497.312 5.073 5 20 JKBD Cc1ccnc2sc(C(=O)O[C@H](C)C(=O)Nc3nc(-c4cccc([N+](=O)[O-])c4)cs3)c(C)c12 914917764 CWTWPQWQYCKBCN-CYBMUJFWSA-N 482.543 5.129 5 20 JKBD O=[N+]([O-])c1ccc(NC2CCC(Nc3ccc([N+](=O)[O-])c4cnccc34)CC2)c2ccncc12 915211971 NXQLETNONHIHFA-UHFFFAOYSA-N 458.478 5.435 5 20 JKBD COC(=O)/C=C\c1ccc(N[C@@H](C)c2cccc(NC(=O)Cc3ccccc3F)c2)c([N+](=O)[O-])c1 917075309 FATNIQQDEKGZKU-MOJYJUKOSA-N 477.492 5.274 5 20 JKBD O=c1c2ccccc2c(-c2ccc(F)cc2)nn1CN(Cc1ccccc1[N+](=O)[O-])CC(F)(F)F 917614986 CLXOOZAPDRQSOB-UHFFFAOYSA-N 486.425 5.133 5 20 JKBD COc1cc(C(=O)N(C)Cc2ccn(-c3ccccc3)n2)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 917767061 OQFUTSLOOGBXPO-UHFFFAOYSA-N 492.919 5.507 5 20 JKBD COc1cccc(CN2CCC(NC(=O)c3cc([N+](=O)[O-])ccc3Sc3ccccc3)CC2)c1 918654057 XIOPEORCQXJDIQ-UHFFFAOYSA-N 477.586 5.149 5 20 JKBD COc1cc(C(=O)Nc2ccc(N3CCCCCC3)cc2)c([N+](=O)[O-])cc1OCc1cscn1 919964961 PPMRZBUZTNYLND-UHFFFAOYSA-N 482.562 5.272 5 20 JKBD CS(=O)(=O)c1cc(C(=O)Oc2ccc(-c3nc4ccccc4s3)cc2Cl)cc([N+](=O)[O-])c1 920276895 GSVXUMNWFBNVCV-UHFFFAOYSA-N 488.930 5.148 5 20 JKBD Cc1cc2cccc(C(=O)NC3(c4ccc(NC(=O)c5ccc([N+](=O)[O-])o5)cc4)CCC3)c2[nH]1 1785748987 UYXKINAGQGKQFJ-UHFFFAOYSA-N 458.474 5.039 5 20 JKBD O=C(/C=C/c1ccc([N+](=O)[O-])o1)Nc1ccc(C2(NC(=O)[C@H]3C[C@@H]3c3ccccc3)CCC2)cc1 1786208077 IZZVGPNHOXJWBY-XWDPTAOESA-N 471.513 5.139 5 20 JKBD CC1=CC[C@H](C(=O)NC2(c3ccc(NC(=O)Cc4ccc([N+](=O)[O-])cc4F)cc3)CCC2)CC1 1791183390 CRZOUBAOIMYZIX-SFHVURJKSA-N 465.525 5.157 5 20 JKBD O=C(Cc1ccc([N+](=O)[O-])cc1F)Nc1ccc(C2(NC(=O)c3cccc4ccoc34)CCC2)cc1 1791183535 FNJSZLBOFQJSHD-UHFFFAOYSA-N 487.487 5.471 5 20 JKBD O=C(Cc1ccc([N+](=O)[O-])cc1F)Nc1ccc(C2(NC(=O)c3cc4[nH]ccc4s3)CCC2)cc1 1791183556 GGCCHXOQJPGBQB-UHFFFAOYSA-N 492.532 5.267 5 20 JKBD Cc1cccc(Cl)c1C(=O)N1CCC([C@@H]2CCCCN2C(=O)/C=C/c2ccc([N+](=O)[O-])o2)CC1 1824276484 TXHZDDHEAQRZLF-DJGBTNNQSA-N 485.968 5.096 5 20 JKBD Cc1oc(C(C)(C)C)cc1C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2ccc(O)c([N+](=O)[O-])c2)CC1 1825951471 RHLLKJIDCZPSJG-NRFANRHFSA-N 497.592 5.046 5 20 JKBD O=C(c1cc(F)cc([N+](=O)[O-])c1)N1CCC([C@@H]2CCCCN2C(=O)c2cc(F)ccc2Cl)CC1 1830579038 QDWLVAPJRKTOPP-QFIPXVFZSA-N 491.922 5.074 5 20 JKBD CC1(C(=O)N2CCC([C@H]3CCCCN3C(=O)CSc3ccccc3[N+](=O)[O-])CC2)CCCCC1 1831777650 VSMYNQHZXNOPDZ-OAQYLSRUSA-N 487.666 5.277 5 20 JKBD O=C([C@H]1CCc2cccc(Cl)c21)N1CC2(CCCN2C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)C1 1845739601 RDNNWOVSNBEHKD-SFHVURJKSA-N 495.988 5.010 5 20 JKBD CCOc1ccccc1Nc1nnc(S[C@@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)s1 17541348 CBVHDPOXIUGQLN-LBPRGKRZSA-N 470.536 5.492 5 20 JKBD COc1ccc(NC(=O)CSc2ncnc3cc(-c4ccc(F)cc4)sc23)c([N+](=O)[O-])c1 23550591 MJDSXHAICMIJEG-UHFFFAOYSA-N 470.507 5.145 5 20 JKBD COC(=O)c1ccc(OCc2csc(N(C(C)=O)c3c(C)cc(C)cc3Cl)n2)c([N+](=O)[O-])c1 26270819 BMBCLZSFXKYLPS-UHFFFAOYSA-N 489.937 5.372 5 20 JKBD CC[C@H](NC(=O)c1ccc(N[C@@H](C)c2ccccn2)c([N+](=O)[O-])c1)c1ccccc1OC(F)F 108779489 BCHYMMUUFLXCLZ-YJBOKZPZSA-N 470.476 5.645 5 20 JKBD C[C@H](Nc1ccc(C(=O)Nc2ccc(-n3cnc4ccccc43)cc2)cc1[N+](=O)[O-])c1ccccn1 108785469 OCOOCIBFMOZLNW-SFHVURJKSA-N 478.512 5.754 5 20 JKBD Cc1nc(-c2ccc(F)cc2)sc1C(=O)Nc1nc(-c2cccc([N+](=O)[O-])c2)c(C)s1 195704011 CBUAAGUCBZZISU-UHFFFAOYSA-N 454.508 5.850 5 20 JKBD CN(CCCCCc1cc(-c2cccc(F)c2)n[nH]1)C(=O)c1cn(C)nc1-c1ccc([N+](=O)[O-])cc1 410071989 JXNSFPJTQSXXBV-UHFFFAOYSA-N 490.539 5.010 5 20 JKBD COc1cc(C(=O)Nc2ccc3c(c2)CCC(=O)N3)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 482558249 UKIIHQYPMJBZTD-UHFFFAOYSA-N 467.865 5.186 5 20 JKBD O=C(Nc1ccc(F)cc1-c1ccc(F)cc1)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-] 485661995 VUOTXWXCFYMUBP-UHFFFAOYSA-N 452.335 5.733 5 20 JKBD O=C(Nc1ccc(Oc2ncc(Cl)cc2Cl)cc1)c1cnn(-c2ccc([N+](=O)[O-])cc2)c1 485712610 YKUMGVLBTRGKDH-UHFFFAOYSA-N 470.272 5.527 5 20 JKBD COc1ccc(NC(=O)c2cc3cc(Br)cc(Br)c3o2)c([N+](=O)[O-])c1 494067249 WORIFFCJMFFMQG-UHFFFAOYSA-N 470.073 5.127 5 20 JKBD CC(C)N(Cc1nnc(-c2ccccc2Cl)o1)C(=O)c1csc(-c2ccc([N+](=O)[O-])cc2)n1 496365033 TWEYCZUWWCLZPG-UHFFFAOYSA-N 483.937 5.473 5 20 JKBD COc1cc(C(=O)Nc2cc(F)c(F)cc2NC(C)=O)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 506543022 UEYSYQFYHKVBST-UHFFFAOYSA-N 491.834 5.538 5 20 JKBD CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)NCc1cc(Br)ccc1OC(F)F 509732895 DFWAUTABWWUPTA-UHFFFAOYSA-N 472.286 5.079 5 20 JKBD CSc1ccc(C(=O)c2ccccc2C(=O)Nc2cccc(-c3noc(C)n3)c2)cc1[N+](=O)[O-] 520411319 DALAUIVFDHMZEO-UHFFFAOYSA-N 474.498 5.158 5 20 JKBD O=C(Nc1cc(Cl)ccc1Cl)[C@@H]1CCCCN1C(=O)c1ccc(NC2CC2)c([N+](=O)[O-])c1 523063182 ZHQMUKBMESJWEI-IBGZPJMESA-N 477.348 5.109 5 20 JKBD Cc1noc2nc(-c3ccccc3)cc(C(=O)N(Cc3ccccc3[N+](=O)[O-])CC(F)(F)F)c12 603614310 CUVSCBOZQMRSSU-UHFFFAOYSA-N 470.407 5.311 5 20 JKBD Cc1ccc(C(=O)Nc2cc([N+](=O)[O-])c(C)cc2C)cc1NC(=O)c1ccc(Br)cc1 603637465 LTJZKQOTRRJOQC-UHFFFAOYSA-N 482.334 5.787 5 20 JKBD O=C(Nc1cc([N+](=O)[O-])ccc1OC(F)F)c1ccc(SCc2cn3ccccc3n2)cc1 603638766 UGHQUAJRARNBIA-UHFFFAOYSA-N 470.457 5.389 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Br)[C@H](NCc1ccc(Cl)o1)c1ccccc1 603926150 MBHIOHPHZUTQDC-GOSISDBHSA-N 464.703 5.073 5 20 JKBD O=C(Nc1cc([N+](=O)[O-])ccc1OC(F)F)N1CCc2[nH]c3c(Br)cccc3c2C1 604363026 YMYGZVMLBLRKJR-UHFFFAOYSA-N 481.253 5.030 5 20 JKBD COCCc1ccc(Oc2ccc(NC(=O)c3cnn(-c4ccc([N+](=O)[O-])cc4)c3)cc2)cc1 609375828 MPWGNXOFKBLGKA-UHFFFAOYSA-N 458.474 5.014 5 20 JKBD O=[N+]([O-])c1cccc(/C(O)=C(/C(=S)NC23CC4CC(CC(C4)C2)C3)[n+]2ccc3c(c2)CCCC3)c1 725761542 KATRNMSTHVCDQL-UHFFFAOYSA-O 490.649 5.531 5 20 JKBD O=[N+]([O-])c1cccc(/C(O)=C(/C(=S)Nc2ccccc2-c2ccccc2)[n+]2cccc(CO)c2)c1 725763238 IFYJBOKRBQGFBW-UHFFFAOYSA-O 484.557 5.365 5 20 JKBD Cn1c(Cl)cnc1CNC(=O)c1ccccc1Sc1ccc(C(F)(F)F)cc1[N+](=O)[O-] 726542869 QZWKRHXHJXGKED-UHFFFAOYSA-N 470.860 5.082 5 20 JKBD C[C@H]1Cc2cc([N+](=O)[O-])ccc2N1C(=O)CCCCCCC(=O)N1c2ccc([N+](=O)[O-])cc2C[C@@H]1C 728810967 YJTPDIHCXQZCQA-ROUUACIJSA-N 494.548 5.099 5 20 JKBD O=C(Oc1ccc(-c2noc([C@@H]3CCCO3)n2)cc1)c1cc([N+](=O)[O-])ccc1Oc1ccccc1 729112367 OVJRFXVWUMHHEG-QFIPXVFZSA-N 473.441 5.508 5 20 JKBD Cc1ccc(F)c(NC(=S)/C(=C(/O)c2cccc([N+](=O)[O-])c2)[n+]2ccc(C(C)(C)C)cc2)c1 744116827 QZMMWDRKRDZTMY-UHFFFAOYSA-O 466.558 5.951 5 20 JKBD Cc1cc(C)c(NC(=S)/C(=C(/O)c2ccc(C)c([N+](=O)[O-])c2)[n+]2ccccc2)c(Cl)c1 747892074 SHANHPLRYLUUQW-UHFFFAOYSA-O 454.959 5.784 5 20 JKBD CSc1ccc(C(=O)O[C@H](C)C(=O)N2c3ccccc3Sc3ccccc32)cc1[N+](=O)[O-] 853689529 KSCFCXZYADXTQR-CQSZACIVSA-N 466.540 5.692 5 20 JKBD O=C(O[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1)c1cc2ccsc2[nH]1 914891334 IAPCZLHJXYIZER-GOSISDBHSA-N 455.879 5.328 5 20 JKBD Cc1c(NC(=O)c2ccccc2)cccc1N[C@H](C)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl 917640547 FDYXNBGUJNMTPX-OAHLLOKOSA-N 452.898 5.248 5 20 JKBD Cc1cccc([N+](=O)[O-])c1S(=O)(=O)Oc1ccc2c(=O)c(-c3ccccc3Cl)c(C)oc2c1 917868489 WAGFIBSGIZDGFB-UHFFFAOYSA-N 485.901 5.406 5 20 JKBD C[C@H](Nc1ccc(C(=O)OCc2cccc(C(=O)Nc3ccccc3)c2)cc1[N+](=O)[O-])c1ccccn1 920544300 LRHGFOMYNBEYPE-IBGZPJMESA-N 496.523 5.772 5 20 JKBD O=C(COC(=O)c1cccnc1Oc1ccc(Cl)cc1Cl)Nc1ccc(F)c([N+](=O)[O-])c1 920912775 RBWTVYMYPXXMMV-UHFFFAOYSA-N 480.235 5.024 5 20 JKBD CC(C)c1cc(C(=O)NC2(c3ccc(NC(=O)CCc4cccc([N+](=O)[O-])c4)cc3)CCC2)no1 1786602600 WXLJXLCAXFONEW-UHFFFAOYSA-N 476.533 5.087 5 20 JKBD Cc1cc(CCCC(=O)NC2(c3ccc(NC(=O)c4ccncc4)cc3)CCC2)c([N+](=O)[O-])cc1F 1787306977 VJYBZIBOPQUWEH-UHFFFAOYSA-N 490.535 5.208 5 20 JKBD O=C(Cc1ccc([N+](=O)[O-])cc1F)NC1(c2ccc(NC(=O)c3cc4[nH]ccc4s3)cc2)CCC1 1789104813 XDYIOHHTKWPYGM-UHFFFAOYSA-N 492.532 5.267 5 20 JKBD Cc1c(C(=O)Nc2ccc(C3(NC(=O)[C@@H]4C[C@@]4(F)Cl)CCC3)cc2)cc(Cl)cc1[N+](=O)[O-] 1790774754 QSYPQSXLMJKBQU-JTSKRJEESA-N 480.323 5.229 5 20 JKBD C[C@@H](Sc1ccccn1)C(=O)Nc1ccc(C2(NC(=O)c3ccc([N+](=O)[O-])cc3F)CCC2)cc1 1791835482 WDJKSWASLNKZTR-MRXNPFEDSA-N 494.548 5.057 5 20 JKBD O=C(CCc1cccc([N+](=O)[O-])c1)Nc1cc([C@@H]2CCCCN2C(=O)c2cc3ccccc3o2)[nH]n1 1815537278 UPGMWESOFNNWHC-NRFANRHFSA-N 487.516 5.003 5 20 JKBD Cc1cscc1C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)[nH]n1 1818242195 JOQMVQXAVHTNBY-GOSISDBHSA-N 495.586 5.522 5 20 JKBD CC(C)(C)CC(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cccc(Br)c2[N+](=O)[O-])CC1 1826338891 ZJKRZPNEVRTYRZ-IBGZPJMESA-N 494.430 5.027 5 20 JKBD CCCCC[C@H](C)C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cc([N+](=O)[O-])ccc2N(C)C)CC1 1831465387 HYPAYUYUQKFBPT-RDPSFJRHSA-N 486.657 5.111 5 20 JKBD COc1cc(OC)c(NC(=O)CSc2ccc(C(F)(F)F)cc2[N+](=O)[O-])cc1Cl 15949104 KPECKKQFVSDUQX-UHFFFAOYSA-N 450.822 5.015 5 20 JKBD COc1ccc(N2C(=O)CC[C@@H](C(=O)Nc3cccc([N+](=O)[O-])c3C)[C@H]2c2ccccc2OC)cc1 19164871 KFIKAKLUTHHCCR-QFQXNSOFSA-N 489.528 5.043 5 20 JKBD C[C@H](Sc1nnc(Nc2cccc(F)c2)s1)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl 22171140 YJGXDUVCHKLEES-VIFPVBQESA-N 453.908 5.102 5 20 JKBD COc1cc(-c2noc(CSc3nc4cc5ccccc5cc4c(=O)n3C)n2)ccc1OC(F)F 22254554 NJENOFAJVSNTHO-UHFFFAOYSA-N 496.495 5.039 5 20 JKBD O=C(Oc1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2Cl)cc1)c1cc(Cl)c(Cl)[nH]1 23662258 KXCFUGTVXGTAKE-UHFFFAOYSA-N 454.653 5.355 5 20 JKBD CCOc1ccc(-c2nc(COC(=O)C3CCN(c4ccccc4[N+](=O)[O-])CC3)cs2)cc1OC 24792945 LZSAIFZEXTUQBE-UHFFFAOYSA-N 497.573 5.085 5 20 JKBD CSc1ccc([N+](=O)[O-])c(C(=O)O[C@@H](C)C(=O)Nc2ccccc2Cc2ccccc2)c1 28400844 GFUKDUCZOVUGOF-INIZCTEOSA-N 450.516 5.092 5 20 JKBD CCN(CC)[C@H](CNC(=O)Cn1c2ccccc2c(=O)c2ccccc21)c1ccccc1Cl 32317711 RUFJHAJLPIZUGL-RUZDIDTESA-N 461.993 5.007 5 20 JKBD CC(C)N(Cc1ccc(Cl)c(Cl)c1)C(=O)c1ccc(Sc2nncn2C)c([N+](=O)[O-])c1 68734230 FIXONLSSZMWCKP-UHFFFAOYSA-N 480.377 5.232 5 20 JKBD Cc1cc(O[C@H](C)c2ccccc2)ccc1NC(=O)[C@@H]1CCCN1C(=O)c1ccc([N+](=O)[O-])c(C)c1 112519499 MISMZSFGPDJTGV-IBVKSMDESA-N 487.556 5.595 5 20 JKBD O=C(Nc1ccc(Cl)cc1Cl)[C@@H]1CCCCN1C(=O)c1cc2cc([N+](=O)[O-])ccc2s1 195562363 YULQBSJZTPIEMX-KRWDZBQOSA-N 478.357 5.750 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)N[C@@H](C)c2sc(-c3ccc(F)cc3)nc2C)cc1SC 303284350 VJWXVDBEYNCHOR-NSHDSACASA-N 461.540 5.387 5 20 JKBD COc1ccc2[nH]cc(C3=CCN(C(=O)c4ccc(N[C@H](C)c5ccccn5)c([N+](=O)[O-])c4)CC3)c2c1 507067570 MSLYVKRLVHDOJH-GOSISDBHSA-N 497.555 5.582 5 20 JKBD O=C(Nc1cc([N+](=O)[O-])ccc1OC(F)F)[C@@H]1C[C@@H]2CCCC[C@@H]2N1C(=O)c1ccc(Cl)cc1 508927859 OVLUKKDLHMXAPU-JVPBZIDWSA-N 493.894 5.262 5 20 JKBD O=C(Cc1ccc([N+](=O)[O-])cc1)Nc1cccc(NC(=O)Nc2cccc(C(F)(F)F)c2)c1 510300068 SPEXRXLJCICPQE-UHFFFAOYSA-N 458.396 5.439 5 20 JKBD CN(Cc1ccccc1[N+](=O)[O-])C(=O)Nc1ccc(N(C)C(=O)c2ccc(Cl)cc2)cc1 511008416 DOFGYZUYVPOLFX-UHFFFAOYSA-N 452.898 5.189 5 20 JKBD CC(C)(C)c1cc(NC(=O)c2ccc(NCc3ccccc3)c([N+](=O)[O-])c2)n(-c2ccccn2)n1 519120852 VWTBRKLHCULQSJ-UHFFFAOYSA-N 470.533 5.337 5 20 JKBD O=C(Nc1ccc(CN2C(=O)Cc3ccc(Cl)cc32)cc1)c1c[nH]c2cc([N+](=O)[O-])ccc12 521741317 AZPSOTOSBHREFQ-UHFFFAOYSA-N 460.877 5.071 5 20 JKBD O=C(Nc1ncc(Cc2ccccc2Cl)s1)c1ccc([N+](=O)[O-])cc1I 523066599 DPXXDSJTQPMSKO-UHFFFAOYSA-N 499.717 5.152 5 20 JKBD Cc1nc(-c2ccccc2)sc1[C@@H](C)Nc1cnn(-c2ccc([N+](=O)[O-])cc2)c(=O)c1Cl 523295380 KVRPOJVBAYBEOP-CYBMUJFWSA-N 467.938 5.399 5 20 JKBD O=C(Nc1cc([N+](=O)[O-])ccc1Nc1cccc(C(F)(F)F)c1)c1cc(-c2cccnc2)on1 603730877 HEDLSCJNQKEXRY-UHFFFAOYSA-N 469.379 5.660 5 20 JKBD O=C(NCc1ccccc1[N+](=O)[O-])N[C@@H](c1ccccc1)c1ccc(Br)cc1F 604076764 RQOSOXJIRRLXOA-FQEVSTJZSA-N 458.287 5.085 5 20 JKBD COC(=O)c1ccc2c(c1)CCN2C(=O)C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1 604233415 TWGYWIDMAGJLGX-ZHZULCJRSA-N 499.548 5.511 5 20 JKBD CCN(C[C@H]1CCOC1)C(=O)C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1 604440391 TWRHSCAWARESCH-ZJYZBMPFSA-N 451.548 5.020 5 20 JKBD NC(=O)c1cc(-c2csc(NC(=O)CCC(=O)c3ccc4ccc5cccc6ccc3c4c56)n2)c[nH]1 727765611 APQHMUKPZZYVPL-UHFFFAOYSA-N 492.560 5.736 5 20 JKBD C[C@H]1CN(c2ccc(NC(=O)c3cc([N+](=O)[O-])ccc3Cl)cc2C(F)(F)F)C[C@@H](C)O1 728010151 FHMZKFHKJRXGEW-TXEJJXNPSA-N 457.836 5.133 5 20 JKBD C[C@H](NCc1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1)c1ccc2c(c1)CC(=O)N2C 728301199 LEEHOYBOBQBVHW-HNNXBMFYSA-N 451.910 5.410 5 20 JKBD O=C(NC1CC1)c1cc([N+](=O)[O-])ccc1NCc1ccccc1-c1ccc(Cn2ccnc2)cc1 728909077 NDEQOOZALKAUKU-UHFFFAOYSA-N 467.529 5.011 5 20 JKBD Cc1c(C(=O)O[C@@H](C)c2cccc(NC(=O)c3ccccc3)c2)cc([N+](=O)[O-])c(C)c1[N+](=O)[O-] 748943303 GFLKQAZNXJAFDZ-INIZCTEOSA-N 463.446 5.290 5 20 JKBD COc1ccc(OC)c(-c2csc(NC(=O)c3cc([N+](=O)[O-])ccc3N3CCC(C)CC3)n2)c1 900998166 PKNVWIBKIUSSLA-UHFFFAOYSA-N 482.562 5.224 5 20 JKBD CCOc1ccc(NS(=O)(=O)c2ccc(Cl)c(C(=O)Nc3cccc([N+](=O)[O-])c3C)c2)cc1 913412982 CLBXQUHDMBLFHW-UHFFFAOYSA-N 489.937 5.008 5 20 JKBD C[C@H](OC(=O)CCOc1ccc(Cl)c(Cl)c1)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 914962475 PVIGBLKGPUAQGX-NSHDSACASA-N 452.250 5.025 5 20 JKBD COc1cc(C(=O)Nc2ccc(N(C)C3CCCCC3)c(F)c2)c([N+](=O)[O-])cc1OC(F)F 916436794 HVTQHPKDMPFPFQ-UHFFFAOYSA-N 467.444 5.365 5 20 JKBD Cn1ccc(COC(=O)c2c3c(nc4ccccc24)/C(=C\c2ccc([N+](=O)[O-])cc2)CCC3)cc1=O 918791473 NWRGKOJDPDIRGV-HKWRFOASSA-N 481.508 5.076 5 20 JKBD CC(=O)N(c1nc(COC(=O)c2cc([N+](=O)[O-])c(C)c([N+](=O)[O-])c2)cs1)c1c(C)cc(C)cc1C 919224574 IGNPIGBZUBSHJT-UHFFFAOYSA-N 498.517 5.235 5 20 JKBD Cc1ccc(CC(=O)O[C@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Br)c2ccccc2)s1 920665733 HQGSJTNZFKKJDI-FQEVSTJZSA-N 489.347 5.193 5 20 JKBD COc1ccc(C(OC(=O)Cn2c3ccccc3c(=O)c3ccccc32)c2ccc(OC)cc2)cc1 920799833 WFRRRIHVNYAUDB-UHFFFAOYSA-N 479.532 5.505 5 20 JKBD CCc1noc(C)c1C(=O)NC1(c2ccc(NC(=O)Cc3ccc(Cl)cc3[N+](=O)[O-])cc2)CCC1 1786115711 GFKOMRBDKXOBQT-UHFFFAOYSA-N 496.951 5.097 5 20 JKBD Cc1cscc1C(=O)NC1(c2ccc(NC(=O)/C=C/c3ccc([N+](=O)[O-])o3)cc2)CCC1 1786204375 AGRZMKOREXJZAR-VQHVLOKHSA-N 451.504 5.019 5 20 JKBD O=C(/C=C/c1ccc([N+](=O)[O-])o1)Nc1ccc(C2(NC(=O)c3cccc4cnccc34)CCC2)cc1 1786207556 ZDWNXEPNEPMACN-PKNBQFBNSA-N 482.496 5.197 5 20 JKBD O=C(/C=C/c1ccco1)Nc1ccc(C2(NC(=O)CSc3ccccc3[N+](=O)[O-])CCC2)cc1 1786916039 GXWRJEWCISZIFS-OUKQBFOZSA-N 477.542 5.127 5 20 JKBD O=C(NC1(c2ccc(NC(=O)c3c[nH]c4cccc(Cl)c34)cc2)CCC1)c1ccc([N+](=O)[O-])o1 1789393199 XOLJRJJKUJLVHP-UHFFFAOYSA-N 478.892 5.384 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cc(Cl)c(Cl)cc1F)C2 1800701213 IPQIMVMGJJUMMF-CLLJXQQHSA-N 498.313 5.054 5 20 JKBD Cc1cc(C(=O)N2CCC3(CCCN(C(=O)CCCc4cc(C)c(F)cc4[N+](=O)[O-])C3)CC2)c(C)o1 1805820713 DLIXJLXFCBHSPO-UHFFFAOYSA-N 499.583 5.120 5 20 JKBD Cc1oc(C(C)(C)C)cc1C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cc(O)cc([N+](=O)[O-])c2)CC1 1830703990 FOKQYOCMSZLEJB-HSZRJFAPSA-N 497.592 5.046 5 20 JKBD C[C@@H](OC(=O)c1cc2cc([N+](=O)[O-])ccc2s1)C(=O)N(c1nccs1)C1CCCCC1 11182199 ICIUYUSEOJHBNO-CYBMUJFWSA-N 459.549 5.177 5 20 JKBD Cc1ccc(NC(=O)[C@H](OC(=O)CCc2ncc(-c3ccccc3)o2)c2ccccc2)c([N+](=O)[O-])c1 11942424 ZGIBUMNWDXHVBI-AREMUKBSSA-N 485.496 5.414 5 20 JKBD O=C(COC(=O)c1ccc(Oc2ccc(C(F)(F)F)cn2)cc1)Nc1cc([N+](=O)[O-])ccc1Cl 16168949 NDKAGCPMSLYAOO-UHFFFAOYSA-N 495.797 5.250 5 20 JKBD C[C@@H](OC(=O)c1ccc(Oc2ccc(C(F)(F)F)cn2)cc1)C(=O)Nc1ccc(F)c([N+](=O)[O-])c1 16169154 OVEBSKBRJDWLRJ-GFCCVEGCSA-N 493.369 5.124 5 20 JKBD Cc1cc([N+](=O)[O-])ccc1NC(=O)CSc1nnc(-c2ccc(Cl)cc2)n1Cc1ccccc1 23599751 AXFVAGXYIOQQDM-UHFFFAOYSA-N 493.976 5.594 5 20 JKBD CSc1ccc([N+](=O)[O-])c(C(=O)NCc2ccccc2-c2ccc(CN3CCCC3)cc2)c1 26404962 GRMGMNGJAOPAQL-UHFFFAOYSA-N 461.587 5.510 5 20 JKBD O=C(c1cc2ccccc2c2cccnc12)N1CCN(Cc2csc(-c3ccccc3)n2)CC1 58916431 NLVKVOUEEZUSNV-UHFFFAOYSA-N 464.594 5.470 5 20 JKBD C[C@@H](Nc1ccc(C(=O)N(C)Cc2ccccc2C(F)(F)F)cc1[N+](=O)[O-])c1ccccn1 108768091 DOWYEANRYINFNO-OAHLLOKOSA-N 458.440 5.454 5 20 JKBD Cc1nc(-c2ccc(NC(=O)C3CCN(c4ccc(C(F)(F)F)cc4[N+](=O)[O-])CC3)cc2)oc1C 117494957 OGEOGDCOZXBPGS-UHFFFAOYSA-N 488.466 5.741 5 20 JKBD Cc1sc(NC(=O)c2cc([N+](=O)[O-])cc([N+](=O)[O-])c2C)nc1-c1ccc(Br)cc1 247996446 PUNCDYASXKIZGG-UHFFFAOYSA-N 477.296 5.258 5 20 JKBD O=C(Nc1ccc(Cl)c(C(=O)NCc2ccccc2F)c1)c1cc2cccc([N+](=O)[O-])c2[nH]1 484189669 DTKVBPDYKAQUJU-UHFFFAOYSA-N 466.856 5.051 5 20 JKBD Cc1nn(-c2ccccc2)c(C)c1NC(=O)[C@H](C)Sc1nc2cc3ccccc3cc2c(=O)n1C 498078987 CPZLYPISCZARGR-SFHVURJKSA-N 483.597 5.009 5 20 JKBD COc1ccc(C(=O)N2CCCCCC2)cc1NC(=O)c1ccc(C(C)(C)C)c([N+](=O)[O-])c1 501747868 PYHLJZUYMFYRMR-UHFFFAOYSA-N 453.539 5.169 5 20 JKBD C[C@H](Nc1ccc(C(=O)N[C@@H]2CCSc3c(F)cccc32)cc1[N+](=O)[O-])c1ccccn1 506087628 SBNAEPPYDIEXJJ-IFXJQAMLSA-N 452.511 5.269 5 20 JKBD COc1ccc(-n2c(SCc3cc([N+](=O)[O-])ccc3OC(C)C)nnc2-c2ccncc2)cc1 511107277 ODWWVSXGZKQFNT-UHFFFAOYSA-N 477.546 5.326 5 20 JKBD Cc1ccc(Sc2ccc(C(=O)Nc3ccc(NC4CCOCC4)cc3)cc2[N+](=O)[O-])cc1 513075794 OMLHLHUCUYJZGW-UHFFFAOYSA-N 463.559 5.898 5 20 JKBD O=C(N[C@@H](c1ccccc1)C(F)(F)F)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 518279631 IRQUNSAZZYKDBB-SFHVURJKSA-N 475.389 5.250 5 20 JKBD C[C@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)Nc1ccc(NC(=O)c2ccco2)cc1C(F)(F)F 518881027 RYQYLVZBYXQVKA-NSHDSACASA-N 497.813 5.518 5 20 JKBD COc1cc(CNCc2ccc(-c3csc(C)n3)cc2)c([N+](=O)[O-])cc1OCc1ccccc1 520962593 JLFKPXOKNBDPFT-UHFFFAOYSA-N 475.570 5.904 5 20 JKBD CCN1CCC(n2nccc2NCc2ccc(Sc3ccc(C)cc3)c([N+](=O)[O-])c2)CC1 520965118 YUQWZHXLPIIFTG-UHFFFAOYSA-N 451.596 5.520 5 20 JKBD Cc1ccc(-c2nc(CCNC(=O)c3ccc(N[C@H](C)c4ccccn4)c([N+](=O)[O-])c3)co2)cc1 522578339 HFNDWVYSZHJLFZ-GOSISDBHSA-N 471.517 5.099 5 20 JKBD COc1ccc(COc2cccc(F)c2)cc1N[C@@H](C)C(=O)Nc1cccc([N+](=O)[O-])c1C 558108243 BDCGLEGWAWPBAI-INIZCTEOSA-N 453.470 5.069 5 20 JKBD NC(=O)c1cccc(Oc2ccc(NC(=O)c3cc([N+](=O)[O-])ccc3Sc3ccccc3)cn2)c1 608808049 LUQCBDAAYORRKV-UHFFFAOYSA-N 486.509 5.285 5 20 JKBD COCc1cccc2sc(NC(=O)C3CCN(c4ccc(C(F)(F)F)cc4[N+](=O)[O-])CC3)nc12 609186341 IDYHPGQFOASEOH-UHFFFAOYSA-N 494.495 5.225 5 20 JKBD O=C(Cn1ccc2cc([N+](=O)[O-])ccc21)N[C@H]1CCCc2nc(-c3ccc(F)cc3)sc21 609187522 OTGVDBHEGPXDEH-SFHVURJKSA-N 450.495 5.006 5 20 JKBD C[C@@H](NC(=S)/C(=C(/O)c1cccc([N+](=O)[O-])c1)[n+]1ccccc1)c1ccc(Cl)cc1Cl 726570335 MIWIENFEDXQLSJ-CQSZACIVSA-O 475.377 5.751 5 20 JKBD CC(C)(C)OC(=O)Nc1cc(C(=O)N(CC2CC2)c2ccc(Cl)c([N+](=O)[O-])c2)ccc1F 730488621 NURDHCZLJCODKY-UHFFFAOYSA-N 463.893 5.791 5 20 JKBD O=C(Cc1csc(NC(=O)c2ccccc2)n1)OCc1nc2ccccc2c2ccccc12 742324872 AKPUIUQSCADQOA-UHFFFAOYSA-N 453.523 5.383 5 20 JKBD O=C(COC(=O)c1csc(-c2ccc([N+](=O)[O-])cc2)n1)Nc1cc(Cl)c(Cl)cc1Cl 747956631 IHYHKPWQJHDNFN-UHFFFAOYSA-N 486.720 5.474 5 20 JKBD C[C@H](NC(=O)COC(=O)c1csc(-c2cccc([N+](=O)[O-])c2)n1)c1ccc(Cl)cc1Cl 747964197 TVWLEGIYBUDRCN-NSHDSACASA-N 480.329 5.059 5 20 JKBD C[C@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)O[C@@H](C)c1ccccc1NC(=O)c1ccccc1 748019695 CDXQJJQAQVGQMO-IRXDYDNUSA-N 450.516 5.632 5 20 JKBD O=[N+]([O-])c1cccc(/C(O)=C(/C(=S)NCc2cccs2)[n+]2ccc(Cc3ccccc3)cc2)c1 839413234 VBEIBTRXOYQOKC-UHFFFAOYSA-O 488.614 5.536 5 20 JKBD CCOc1cc(/C=C(/C(=O)O[C@@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2C)c2ccccc2)ccc1O 852996724 CZDZCLBSNQJOQG-CQHJRZBDSA-N 490.512 5.119 5 20 JKBD Cc1sc2ncnc(Sc3ccccc3C(=O)Nc3cc([N+](=O)[O-])c(F)cc3F)c2c1C 897467580 FYJYBYQUMLUIPI-UHFFFAOYSA-N 472.498 5.898 5 20 JKBD CC(C)N(Cc1nnc(-c2cccc([N+](=O)[O-])c2)o1)C(=O)c1ccc2c(c1)Cc1ccccc1-2 915135745 VIPBRDAECMQVQJ-UHFFFAOYSA-N 454.486 5.267 5 20 JKBD O=C(Oc1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2Cl)cc1)c1cccc(CN2CCCC2)c1 920082004 IKSZSEFLFNERIG-UHFFFAOYSA-N 479.920 5.316 5 20 JKBD O=C(Nc1cc(Cl)c([N+](=O)[O-])cc1OCc1ccccc1)c1cccn(Cc2ccccc2)c1=O 920818719 PTNXGBSKQLOCSV-UHFFFAOYSA-N 489.915 5.290 5 20 JKBD O=C(NC1(c2ccc(NC(=O)c3cc4ccccc4o3)cc2)CCC1)c1cc(O)cc([N+](=O)[O-])c1 1789004403 FMFGKEQLWBQYNA-UHFFFAOYSA-N 471.469 5.108 5 20 JKBD COc1ccc(CC(=O)Nc2ccc(C3(NC(=O)CCC=C(C)C)CCC3)cc2)c([N+](=O)[O-])c1 1790571562 AOROFDFLIOBVQB-UHFFFAOYSA-N 465.550 5.026 5 20 JKBD CN(C)c1ccc([N+](=O)[O-])cc1C(=O)Nc1ccc(C2(NC(=O)CCc3ccsc3)CCC2)cc1 1790794353 NIZMRKGZNHMOAT-UHFFFAOYSA-N 492.601 5.103 5 20 JKBD CSc1ccc(CC(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cc4cc([N+](=O)[O-])ccc4s2)C3)cc1 1802653319 GTMDVOFEGOTTGT-REPLKXPHSA-N 495.626 5.026 5 20 JKBD Cc1cc(CCCC(=O)N2CCCC[C@H]2c2cc(NC(=O)CC(C)(C)C)n[nH]2)c([N+](=O)[O-])cc1F 1816753968 BFIDVFJQKGJLMG-FQEVSTJZSA-N 487.576 5.217 5 20 JKBD O=C(Nc1cc([C@H]2CCCCN2C(=O)c2ccsc2)[nH]n1)c1cc2cc([N+](=O)[O-])ccc2s1 1821610539 CPRXBIDCVYOGNZ-QGZVFWFLSA-N 481.559 5.214 5 20 JKBD O=C(/C=C/c1ccccc1[N+](=O)[O-])Nc1cc([C@@H]2CCCCN2C(=O)/C=C/C2CCCCC2)[nH]n1 1823504050 ZJNBIZXSUQBQMX-FMLZQHPSSA-N 477.565 5.160 5 20 JKBD CC(C)(C)CC(=O)N1CCC([C@H]2CCCCN2C(=O)C2(c3cccc([N+](=O)[O-])c3)CCC2)CC1 1830293380 ZRUFZUQXJKJXID-HSZRJFAPSA-N 469.626 5.072 5 20 JKBD Cc1ccc(CC(=O)N2CCCC[C@H]2C2CCN(C(=O)C[C@@H](C)c3ccccc3)CC2)cc1[N+](=O)[O-] 1830365272 ZXESAABPAOPQBL-GJZUVCINSA-N 491.632 5.259 5 20 JKBD CC1(C)CCC(CC(=O)N2CCCC[C@@H]2C2CCN(C(=O)Cc3cccc([N+](=O)[O-])c3)CC2)CC1 1830421937 QBBNPRNCZTXJFM-RUZDIDTESA-N 483.653 5.364 5 20 JKBD C[C@H](CC(=O)N1CCCC[C@@H]1C1CCN(C(=O)CCc2cccc([N+](=O)[O-])c2)CC1)c1ccccc1 1831503050 HSJVKPYKURTFFK-AJTFRIOCSA-N 491.632 5.341 5 20 JKBD CCc1ccccc1N(C(C)=O)c1nc(COC(=O)c2ccc([N+](=O)[O-])cc2Cl)cs1 11028701 SYDGGRSOFKOKKC-UHFFFAOYSA-N 459.911 5.309 5 20 JKBD COc1ccc(Cc2nnc(S[C@@H](C(=O)Nc3ccc(C)cc3[N+](=O)[O-])c3ccccc3)o2)cc1 11648367 RDFBLZMLHFBHDI-HSZRJFAPSA-N 490.541 5.358 5 20 JKBD C[C@H](OC(=O)CCc1ncc(-c2ccc(Cl)cc2)o1)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl 12257962 QXBSNAFCXYGVIU-LBPRGKRZSA-N 478.288 5.060 5 20 JKBD CC(=O)c1sc(NC(=O)Cn2c3ccccc3c(=O)c3ccccc32)nc1-c1ccccc1 14228168 GCGXGKCNAVVIRI-UHFFFAOYSA-N 453.523 5.120 5 20 JKBD CC(=O)Nc1ccc(C2=N/C(=C\c3ccc(Oc4ccc(Cl)cc4[N+](=O)[O-])cc3)C(=O)O2)cc1 15189591 OTKVQQPOWJJAAO-NDENLUEZSA-N 477.860 5.343 5 20 JKBD C[C@H](Sc1nnc(Nc2cccc(Br)c2)s1)C(=O)Nc1ccccc1[N+](=O)[O-] 16543284 LLHGCNJURGDOLA-JTQLQIEISA-N 480.369 5.072 5 20 JKBD Cc1csc(Sc2ccc(C(=O)O[C@H](C)C(=O)Nc3ccccc3C)cc2[N+](=O)[O-])n1 23973450 JSGATSIDBZFELI-CQSZACIVSA-N 457.533 5.003 5 20 JKBD CCn1c(SCC(=O)N2N=C(c3ccco3)C[C@@H]2c2ccco2)nc2cc3ccccc3cc2c1=O 24891942 ZRRQYSUVVSKZNS-JOCHJYFZSA-N 498.564 5.226 5 20 JKBD C[C@@H]1Oc2ccc(NC(=O)c3ccc(Oc4ccc(Cl)cc4[N+](=O)[O-])cc3)cc2NC1=O 27019428 MKFWQIIISIYZDN-LBPRGKRZSA-N 453.838 5.012 5 20 JKBD NC(=O)c1cc(NC(=O)c2c3c(nc4ccccc24)/C(=C/c2cccc([N+](=O)[O-])c2)CCC3)ccc1F 33064992 WFSDLGUSTYOUJX-GHRIWEEISA-N 496.498 5.510 5 20 JKBD Cc1cc([N+](=O)[O-])ccc1NC(=O)CNc1ccc(NC(=O)c2ccc(F)cc2)cc1C(F)(F)F 71982537 QKBOQHLDRFKSCR-UHFFFAOYSA-N 490.413 5.364 5 20 JKBD CC[C@H](C)Sc1ccc(NC(=O)CCCn2c(=O)oc3cc([N+](=O)[O-])ccc32)c(C(F)(F)F)c1 109734584 PMCPJACTJYUKOA-ZDUSSCGKSA-N 497.495 5.831 5 20 JKBD Cc1cc(C)cc(C(=O)N2CCC[C@H](C(=O)Nc3nc(-c4cccc([N+](=O)[O-])c4)c(C)s3)C2)c1 195704384 KDDAPRCAVXZCRK-IBGZPJMESA-N 478.574 5.134 5 20 JKBD C[C@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)NC1CCN(Cc2ccc(Cl)c(Cl)c2)CC1 303377365 UYTARVQLTLLODK-AWEZNQCLSA-N 468.406 5.163 5 20 JKBD O=C(C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)N1CCC[C@H]1c1ccncc1 485475588 NVKWLNQUFAJTRQ-UEAVEIDSSA-N 470.554 5.894 5 20 JKBD CSc1ccc([N+](=O)[O-])c(C(=O)N(C)[C@H]2CCSc3ccc(Br)cc32)c1 504602359 WRUMQZWPAGZWQA-HNNXBMFYSA-N 453.383 5.388 5 20 JKBD COc1ccc([C@H]2CCN(C(=O)C/C(=C\c3ccc([N+](=O)[O-])cc3)c3nc4ccccc4s3)C2)cc1 504947401 DHSWWJMSANVSTJ-IFRHDIGASA-N 499.592 6.160 5 20 JKBD C[C@H](Nc1ccc(C(=O)N[C@@H]2CCOc3c(Cl)cccc32)cc1[N+](=O)[O-])c1ccccn1 507891232 IBENDUNMIBYROM-IFXJQAMLSA-N 452.898 5.070 5 20 JKBD Cc1cc(C(=O)N2CCSCC2)ccc1NC(=O)c1cc([N+](=O)[O-])ccc1Oc1ccccc1 508539404 VYAPXRPFHXOGBS-UHFFFAOYSA-N 477.542 5.137 5 20 JKBD COc1cc2c(cc1OC)[C@H](c1ccccc1)N(C(=O)Nc1cc([N+](=O)[O-])ccc1OC(F)F)CC2 510825505 NYWQVUOVWYODEI-QHCPKHFHSA-N 499.470 5.393 5 20 JKBD C[C@@H](Sc1nnc(-c2ccccc2)n1[C@H](C)c1ccccc1)C(=O)Nc1ccc([N+](=O)[O-])cc1 515488825 YBXWLMNGFJZVAM-QZTJIDSGSA-N 473.558 5.582 5 20 JKBD Cc1cccc([N+](=O)[O-])c1NC(=O)CSc1nnc(-c2ccccc2)n1[C@@H](C)c1ccccc1 515572836 HYPZXMKVBJYWRU-SFHVURJKSA-N 473.558 5.502 5 20 JKBD O=C(Nc1cccc(CNCc2ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])cc2)c1)c1ccncc1 517536371 AFJFGDCNBKNRKO-UHFFFAOYSA-N 488.931 5.978 5 20 JKBD O=C(Nc1ccc(Oc2ccccc2C(F)(F)F)c(F)c1)c1cc2c(cc1[N+](=O)[O-])OCCO2 518886788 LBRGKEPZLBTJJJ-UHFFFAOYSA-N 478.354 5.569 5 20 JKBD Cc1ccc2nc([C@H]3CCCN3C(=O)c3cc([N+](=O)[O-])ccc3NCc3ccccc3)[nH]c2c1 519937142 GVVQPUWPYVJFEO-XMMPIXPASA-N 455.518 5.369 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)N[C@@H]2CCCc3nc(-c4ccc(F)cc4)sc32)cc1SC 520538622 IFKMYMBBGZROGA-OAHLLOKOSA-N 473.551 5.395 5 20 JKBD O=C(C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)Nc1ccc(-c2cnc[nH]2)cc1 520615543 CBUVPYDESOXDJT-UYRXBGFRSA-N 481.537 6.164 5 20 JKBD CCS(=O)(=O)c1ccccc1NC(=O)c1ccc(Sc2nc3ccccc3s2)c([N+](=O)[O-])c1 603572334 VGJGQSFDUCGBMI-UHFFFAOYSA-N 499.595 5.402 5 20 JKBD O=C(c1c2c(nc3ccccc13)/C(=C/c1ccc([N+](=O)[O-])cc1)CCC2)N1CCC[C@@H](n2ccnc2)C1 609131171 JJPCPTUNQSPRNI-ZGZCKBCJSA-N 493.567 5.694 5 20 JKBD Cc1ccc(NC(=O)c2ccc(N[C@@H](C)c3ccc(N4CCOC4=O)cc3)c([N+](=O)[O-])c2)cc1 727431485 QNCFKALZQZOCJF-KRWDZBQOSA-N 460.490 5.285 5 20 JKBD Cc1nn(-c2ccccc2)c2ncc(C(=O)N(CC3CC3)c3ccc(Cl)c([N+](=O)[O-])c3)cc12 728165971 TUBLAKQZRLLKST-UHFFFAOYSA-N 461.909 5.347 5 20 JKBD C[C@@H]1Cc2cc([N+](=O)[O-])ccc2N1C(=O)CCCCCCC(=O)N1c2ccc([N+](=O)[O-])cc2C[C@H]1C 728810965 YJTPDIHCXQZCQA-QZTJIDSGSA-N 494.548 5.099 5 20 JKBD C[C@H](Nc1nc2ccc([N+](=O)[O-])cc2s1)c1cccc(NC(=O)Cc2ccccc2F)c1 731206301 FYFGCRMWRMREDK-AWEZNQCLSA-N 450.495 5.698 5 20 JKBD O=C(O[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1)c1cnn(-c2ccccc2F)c1 746901703 NASUTRQAOCTLJS-JOCHJYFZSA-N 494.866 5.110 5 20 JKBD CCOC(=O)/C=C\c1ccc(NC(=O)c2ccccc2NC(=O)c2ccc([N+](=O)[O-])cc2Cl)cc1 759309043 RAMAPVRWDAOODO-ZROIWOOFSA-N 493.903 5.329 5 20 JKBD Cc1nc(C(C)C)sc1C(=O)O[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1 915505629 QOLYFMUJPARWKU-GOSISDBHSA-N 473.938 5.673 5 20 JKBD COc1ccc(N2C(=S)N[C@@H](c3ccsc3)C(C(=O)Nc3ccc([N+](=O)[O-])cc3)=C2C)cc1 916167653 DVQDQRFWIKLUHV-NRFANRHFSA-N 480.571 5.013 5 20 JKBD COc1ccc(COC(=O)c2cc(-c3cc(C)oc3C)nc3c2cnn3C(C)C)cc1[N+](=O)[O-] 918928505 QEPNWALBGDAXHB-UHFFFAOYSA-N 464.478 5.163 5 20 JKBD COc1cc(C(=O)OCc2nc3ccccc3c(C)c2Cl)c([N+](=O)[O-])cc1OCc1cscn1 920650829 AUIWQNVOIDXYDK-UHFFFAOYSA-N 499.932 5.506 5 20 JKBD O=C(/C=C/c1ccoc1)NC1(c2ccc(NC(=O)CSc3ccccc3[N+](=O)[O-])cc2)CCC1 1791521565 XPLHIQUQZSUZET-IZZDOVSWSA-N 477.542 5.127 5 20 JKBD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc(F)c1[N+](=O)[O-])c1cccc2c1oc1ccccc12 1800530208 DAVUHZOBJCUFLB-BJWYYQGGSA-N 487.487 5.199 5 20 JKBD CC(C)=CCCC(=O)N1CC[C@@H](CNC(=O)c2cc3cc([N+](=O)[O-])ccc3s2)[C@H]1c1cccnc1 1812303823 ORHPPBGOGJBNHS-UQBPGWFLSA-N 492.601 5.271 5 20 JKBD CC[C@H](C(=O)N1CCCC[C@@H]1c1cc(NC(=O)CCc2cccc([N+](=O)[O-])c2)n[nH]1)c1ccccc1 1815537170 DPVXLNBCCJNDNV-LADGPHEKSA-N 489.576 5.137 5 20 JKBD Cc1c(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)c3cccc(F)c3[N+](=O)[O-])[nH]n2)oc2ccccc12 1818569747 JFZBGBACDVLRTP-IBGZPJMESA-N 491.479 5.131 5 20 JKBD Cc1ccc(S/C=C/C(=O)N2CCC([C@@H]3CCCCN3C(=O)c3ccc([N+](=O)[O-])o3)CC2)cc1 1823614319 JUTWTGZOYMWRNZ-ZDJZVTAXSA-N 483.590 5.036 5 20 JKBD CC1=CC[C@@H](C(=O)N2CCC([C@H]3CCCCN3C(=O)CSc3ccccc3[N+](=O)[O-])CC2)CC1 1831776112 JDNKQHSFONKPNU-FGZHOGPDSA-N 485.650 5.053 5 20 JKBD Cc1c(C(=O)N2CCC([C@@H]3CCCCN3C(=O)C3CC(C)(C)C3)CC2)cc(Cl)cc1[N+](=O)[O-] 1831930934 IGGVPWMRSISKIY-NRFANRHFSA-N 476.017 5.226 5 20 JKBD C[C@H](C(=O)N1CCCC[C@H]1C1CCN(C(=O)Cc2ccc(Cl)cc2[N+](=O)[O-])CC1)c1ccccc1 1832889285 LCIHZCXVBGTPME-CYFREDJKSA-N 498.023 5.214 5 20 JKBD Cc1ccc(-c2nnc(S[C@H](C(=O)Nc3ccc(C)cc3[N+](=O)[O-])c3ccccc3)n2C)cc1 10263759 KHGPWXCYVPOBSG-QFIPXVFZSA-N 473.558 5.479 5 20 JKBD C[C@H](OC(=O)C1c2ccccc2Oc2ccccc21)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 10798387 FLNGYCLHJHNHTM-ZDUSSCGKSA-N 486.402 5.422 5 20 JKBD C[C@@H](c1nc2ccccc2s1)N(C)C(=O)CCNc1ccc(C(F)(F)F)cc1[N+](=O)[O-] 16498881 NGKRGMDYHGOSQR-LBPRGKRZSA-N 452.458 5.245 5 20 JKBD Cc1sc2nc(S[C@H](C)C(=O)Nc3ccccc3[N+](=O)[O-])n(C3CCCC3)c(=O)c2c1C 22101826 NCWWLSFYIOPSNV-CQSZACIVSA-N 472.592 5.217 5 20 JKBD Cc1c(C(=O)Nc2ncc(Cc3cccc(Cl)c3Cl)s2)cc([N+](=O)[O-])cc1[N+](=O)[O-] 26366512 AJXQEYMOUPDTOB-UHFFFAOYSA-N 467.290 5.418 5 20 JKBD O=C(CSc1ccc(C(F)(F)F)cc1[N+](=O)[O-])Nc1ccccc1OC[C@H]1CCCCO1 108912984 OEPCGPUSJNNUCS-OAHLLOKOSA-N 470.469 5.292 5 20 JKBD O=C(Nc1cccc(Cl)c1SC(F)F)c1cc([N+](=O)[O-])ccc1I 110218499 DGTZGTSCZIEEJG-UHFFFAOYSA-N 484.649 5.420 5 20 JKBD Cc1sc(NC(=O)C2CCN(c3nc4ccccc4o3)CC2)nc1-c1cccc([N+](=O)[O-])c1 195704138 RLNRSWXMXHZNND-UHFFFAOYSA-N 463.519 5.023 5 20 JKBD CCOCc1cccc(NC(=O)Cc2cn(-c3ccccc3)nc2-c2ccc([N+](=O)[O-])cc2)c1 303164546 QBIHWJUEMFQUPB-UHFFFAOYSA-N 456.502 5.165 5 20 JKBD Cc1cc(C)c(NC(=O)CNCc2cn(-c3ccccc3)nc2-c2ccc([N+](=O)[O-])cc2)c(C)c1 409521720 PGMSKSVMVHTFSM-UHFFFAOYSA-N 469.545 5.101 5 20 JKBD O=C(N[C@@H]1CCN2CCC[C@H]2C1)c1c2c(nc3ccccc13)/C(=C/c1cccc([N+](=O)[O-])c1)CCC2 485013273 KPEFVESGHQRJSK-WIVRNPGZSA-N 482.584 5.377 5 20 JKBD CCN(C(=O)c1cnn(-c2ccc([N+](=O)[O-])cc2)c1)[C@@H]1CCSc2ccc(Br)cc21 504551359 BJHOHHHWPPOLJY-LJQANCHMSA-N 487.379 5.242 5 20 JKBD C[C@H](Nc1ccc(C(=O)N(C)Cc2cc(Br)ccc2F)cc1[N+](=O)[O-])c1ccccn1 506178072 JGQYYWLOQGMXOU-AWEZNQCLSA-N 487.329 5.337 5 20 JKBD CCN(C(=O)N[C@H](C)c1cccc([N+](=O)[O-])c1)[C@H]1CCSc2ccc(Br)cc21 507330871 RSOKWGHMRNHBES-ACJLOTCBSA-N 464.385 5.687 5 20 JKBD CC1CCN(c2ccc(C(=O)N3CCC[C@@H](c4nc(-c5ccc(F)cc5)no4)C3)cc2[N+](=O)[O-])CC1 522584316 PEWFTALDNZPQRP-HXUWFJFHSA-N 493.539 5.040 5 20 JKBD CN(C)C(=O)c1ccc(CNC(=O)c2cc([N+](=O)[O-])ccc2Sc2ccc(Cl)cc2)cc1 600312600 JUHIETLXHHXFLX-UHFFFAOYSA-N 469.950 5.031 5 20 JKBD C[C@H](NC(=O)C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)c1ccc2c(c1)OCO2 600859468 SYCYDGYXCXMCGQ-QUYZQLMHSA-N 487.537 5.741 5 20 JKBD CC[C@@H](C)c1ccc([C@@H](NC(=O)C(=O)Nc2ccc(C)c([N+](=O)[O-])c2)c2cccs2)cc1 603706222 OZQOPAMPKGFPHS-IVZQSRNASA-N 451.548 5.323 5 20 JKBD Cc1nc(C)c(-c2csc(NC(=O)c3ccc(NCc4ccccc4)c([N+](=O)[O-])c3)n2)s1 603904376 FJKRNNBNCCUSCS-UHFFFAOYSA-N 465.560 5.656 5 20 JKBD C[C@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)N[C@@H](C)c1ccc(NC(=O)Nc2ccccc2)cc1 604446127 DVIMBDKVJDYGIF-HOTGVXAUSA-N 482.924 5.537 5 20 JKBD O=C(c1cc([N+](=O)[O-])ccc1Sc1ccccc1)N1CCC(c2nc(-c3ccccn3)no2)CC1 608809195 MWQDVWGXGRJNCR-UHFFFAOYSA-N 487.541 5.211 5 20 JKBD O=C(c1ccc(NCc2ccccc2Cl)c([N+](=O)[O-])c1)N1CC[C@@H](Nc2ccccc2)C1 609113751 XZCQBLDHHPYNGX-HXUWFJFHSA-N 450.926 5.187 5 20 JKBD COC(=O)Nc1cccc(C(=O)Nc2cc(Cl)c([N+](=O)[O-])cc2OCc2ccccc2)c1 728460739 RROUDHGJVBOJQV-UHFFFAOYSA-N 455.854 5.258 5 20 JKBD O=C(Nc1ccccc1COCc1ccccc1)c1ccc(I)c([N+](=O)[O-])c1 730476608 BHEBENKDYCWFQK-UHFFFAOYSA-N 488.281 5.169 5 20 JKBD Cc1cccc([N+](=O)[O-])c1NC(=O)COC(=O)c1nc(-c2ccccc2)oc1-c1ccccc1 731376742 BWPOEYFVAYKHLP-UHFFFAOYSA-N 457.442 5.021 5 20 JKBD Cc1cccc(-c2nnc([C@H](C)OC(=O)c3cc([N+](=O)[O-])ccc3N3CCC(C)CC3)o2)c1 746145848 SNQWDJGCKMWJON-KRWDZBQOSA-N 450.495 5.108 5 20 JKBD CCc1cc2oc(=O)cc(COC(=O)c3csc(-c4ccc([N+](=O)[O-])cc4)n3)c2cc1Cl 747956575 WIAAIOKLGXUAOF-UHFFFAOYSA-N 470.890 5.398 5 20 JKBD CC(C)[C@H](OC(=O)c1csc(-c2cccc([N+](=O)[O-])c2)n1)C(=O)Nc1cccc2ncccc12 747960751 BGBDTQSXAGUDCZ-NRFANRHFSA-N 476.514 5.087 5 20 JKBD C[C@H](Sc1ncc(-c2ccccc2)n1C[C@H]1CCCO1)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 828604404 OXNBHJIRAXFENA-OXJNMPFZSA-N 477.546 5.541 5 20 JKBD Cc1ccc(Sc2ccc(-c3nc(CC(=O)NC4CCCCC4)no3)cc2[N+](=O)[O-])cc1 904246377 PHEOOAVHAYXHHZ-UHFFFAOYSA-N 452.536 5.096 5 20 JKBD O=C1[C@@H](c2ccccc2)N(Cc2ccccc2)C(=O)N1Cc1c(Br)cccc1[N+](=O)[O-] 915668723 NNWNODOQQCFJIR-OAQYLSRUSA-N 480.318 5.063 5 20 JKBD O=[N+]([O-])c1ccc(-c2ccc(/C=C(/c3nc4ccccc4[nH]3)S(=O)(=O)c3ccccc3)o2)cc1 915852474 ZBMQNAAECRPKGH-JLPGSUDCSA-N 471.494 5.703 5 20 JKBD CC1CCN(c2ccc([N+](=O)[O-])cc2C(=O)N2C[C@@H](C(F)(F)F)C[C@@H](C(F)(F)F)C2)CC1 918673541 YUYQMHNFXPCOTG-OKILXGFUSA-N 467.410 5.034 5 20 JKBD Cc1cccc(C(C)C)c1NC(=O)[C@@H](C)OC(=O)c1cc([N+](=O)[O-])ccc1Oc1ccccc1 919192907 QIDHUFALYUOBLO-GOSISDBHSA-N 462.502 6.003 5 20 JKBD CSCC[C@@H](NC(=O)c1cccc(C)c1)C(=O)Oc1ccc(-c2ccccc2)cc1[N+](=O)[O-] 920330365 ASKLDKWBXHUUPL-OAQYLSRUSA-N 464.543 5.027 5 20 JKBD COc1cscc1C(=O)NC1(c2ccc(NC(=O)Cc3ccc(Cl)cc3[N+](=O)[O-])cc2)CCC1 1786116623 XMRSCIIAISGVNT-UHFFFAOYSA-N 499.976 5.309 5 20 JKBD Cc1cccc2[nH]c(C(=O)NC3(c4ccc(NC(=O)/C=C/c5ccc([N+](=O)[O-])o5)cc4)CCC3)cc12 1786207451 OCQXAJLCQAIOHB-ZRDIBKRKSA-N 484.512 5.439 5 20 JKBD O=C(/C=C/c1ccsc1)Nc1ccc(C2(NC(=O)c3cc([N+](=O)[O-])cc4c3OCC4)CCC2)cc1 1786944420 GDCSTLMRSNJVID-FARCUNLSSA-N 489.553 5.052 5 20 JKBD Cc1ccc(CC(=O)NC2(c3ccc(NC(=O)[C@@H](C)Nc4ccccc4)cc3)CCC2)cc1[N+](=O)[O-] 1789467790 SIPGORTZBGTVPL-HXUWFJFHSA-N 486.572 5.080 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)C3CCC3)CCC2)cc1)c1cc(F)cc([N+](=O)[O-])c1Br 1790795704 WXBQLIJYSYFQSN-UHFFFAOYSA-N 490.329 5.044 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)c3ccc([N+](=O)[O-])[nH]3)CCC2)cc1)c1cnc2cccc(Cl)c2c1 1790978747 KHTOFOQMANYLLI-UHFFFAOYSA-N 489.919 5.186 5 20 JKBD COc1cc(Cl)cc(C(=O)Nc2ccc(C3(NC(=O)c4cc(C)c([N+](=O)[O-])cn4)CCC3)cc2)c1 1792149318 DRWLUIIEQNJEFX-UHFFFAOYSA-N 494.935 5.022 5 20 JKBD CC(C)(C)CCCCCC(=O)N1CC[C@@H](CNC(=O)c2ccc([N+](=O)[O-])cc2F)[C@H]1c1cccnc1 1810745934 JEOUGPCMKVXYPP-NBGIEHNGSA-N 498.599 5.445 5 20 JKBD CC(C)(C)CCCCCC(=O)N1CC[C@@H](CNC(=O)c2cc(F)cc([N+](=O)[O-])c2)[C@@H]1c1cccnc1 1811306930 JDEZEEOKYWTOED-CPJSRVTESA-N 498.599 5.445 5 20 JKBD Cc1csc(CCC(=O)N2CCCC[C@@H]2c2cc(NC(=O)/C=C/c3ccccc3[N+](=O)[O-])n[nH]2)c1 1823500428 DOGLCPKQFWEFJS-XBFAEUMISA-N 493.589 5.026 5 20 JKBD CC[C@@H](C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2ccc([N+](=O)[O-])cc2F)CC1)c1ccccc1 1826316481 HRQWTTJHODLRHJ-RCZVLFRGSA-N 481.568 5.161 5 20 JKBD O=C(c1ccc([N+](=O)[O-])o1)N1CCC([C@@H]2CCCCN2C(=O)c2cc(Cl)sc2Cl)CC1 1829451040 KGRXQMDMMZOXDP-AWEZNQCLSA-N 486.377 5.103 5 20 JKBD Cc1ccc(CC(=O)N2CCCC[C@@H]2C2CCN(C(=O)C[C@H](C)c3ccccc3)CC2)cc1[N+](=O)[O-] 1830365267 ZXESAABPAOPQBL-BKMJKUGQSA-N 491.632 5.259 5 20 JKBD O=C(c1ccccc1F)N1CCC([C@H]2CCCCN2C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)CC1 1831061802 ZIKOHPRVJNOKTI-JOCHJYFZSA-N 495.576 5.496 5 20 JKBD C[C@@H](CC(=O)N1CCCC[C@H]1C1CCN(C(=O)Cc2cc([N+](=O)[O-])ccc2F)CC1)c1ccccc1 1831504355 RLDSPPSQPAOSQN-FNZWTVRRSA-N 495.595 5.090 5 20 JKBD CCC[C@H]1CC[C@H](C(=O)N2CCCC[C@H]2C2CCN(C(=O)c3ccc([N+](=O)[O-])c(OC)c3)CC2)CC1 1831562558 UWCIHUHDPWAXSY-SSPYTLHUSA-N 499.652 5.443 5 20 JKBD CC(C)C1(C(=O)N2CCC([C@H]3CCCCN3C(=O)CSc3ccccc3[N+](=O)[O-])CC2)CCC1 1831777159 GMGNCLHGPMQGCL-OAQYLSRUSA-N 487.666 5.133 5 20 JKBD Cc1ccc(NC(=O)[C@H](Sc2nnc(-c3ccccc3Cl)n2C)c2ccccc2)c([N+](=O)[O-])c1 9809161 PMDXIZOVXKPRAM-OAQYLSRUSA-N 493.976 5.824 5 20 JKBD CCN(CC)S(=O)(=O)c1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2Sc2ccccc2)cc1 14830326 FQLGFBDGWHJQDB-UHFFFAOYSA-N 485.587 5.029 5 20 JKBD Cc1ccc(S(=O)(=O)Nc2ccc(C(=O)Nc3ccc(Cl)cc3Cl)cc2)cc1[N+](=O)[O-] 15431963 SJZCFMZRLDSIHQ-UHFFFAOYSA-N 480.329 5.263 5 20 JKBD C[C@@H](Sc1nc2cc3ccccc3cc2c(=O)n1C)C(=O)Nc1cccc(Cl)c1Cl 22253189 XBJFHVAZZNPRCX-GFCCVEGCSA-N 458.370 5.513 5 20 JKBD CCN(CC)c1ccc(-c2nnc(S[C@H](C)C(=O)Nc3ccc([N+](=O)[O-])cc3Cl)n2C)cc1 22434062 LYTXATKDSNLYME-CQSZACIVSA-N 489.001 5.009 5 20 JKBD C[C@H](OC(=O)c1ccc(Br)c([N+](=O)[O-])c1)C(=O)Nc1ccccc1-c1ccccc1 22833657 WIEZOZNBHMPZBM-AWEZNQCLSA-N 469.291 5.208 5 20 JKBD O=C(COC(=O)CSc1ccccc1[N+](=O)[O-])Nc1c(Cl)c(Cl)cc(Cl)c1Cl 25126741 TZSFOKLXEUVUIN-UHFFFAOYSA-N 484.144 5.482 5 20 JKBD O=C(Nc1ccc(-c2cnc(C3CC3)o2)cc1)c1ccc(NCc2ccccc2)c([N+](=O)[O-])c1 25930767 MHUNFZAOEHBZIW-UHFFFAOYSA-N 454.486 5.992 5 20 JKBD COc1cc(C(=O)NCC(c2ccccc2)c2ccccc2)c([N+](=O)[O-])cc1OCc1cscn1 72024563 VTNYRVGOYBHQQT-UHFFFAOYSA-N 489.553 5.201 5 20 JKBD c1cc(-c2ccc3ccc4cccc5ccc2c3c45)cc(-c2ccc3ccc4cccc5ccc2c3c45)c1 219852698 GHDZTXRYFQBMKP-UHFFFAOYSA-N 478.594 10.815 5 20 JKBD O=C1CCCN1C[C@H](NCc1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1)c1ccccc1 302923992 BCPMHUQTWDIZOH-QFIPXVFZSA-N 465.937 5.494 5 20 JKBD COC(=O)COc1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2Sc2ccc(Cl)cc2)cc1 482647427 HOQOGZLWDAFYRL-UHFFFAOYSA-N 472.906 5.204 5 20 JKBD C[C@H](Nc1ccc(C(=O)N[C@@H](c2ccccc2)c2cccnc2)cc1[N+](=O)[O-])c1ccccn1 485499113 DBJXRTMZFANFSX-BVZFJXPGSA-N 453.502 5.077 5 20 JKBD Cc1ccc(-c2csc(NC(=O)CSCc3cc(-c4cccs4)on3)n2)cc1[N+](=O)[O-] 488839537 PHQISZSSUIKIFE-UHFFFAOYSA-N 472.573 5.615 5 20 JKBD Cc1csc(Sc2ccc(C(=O)Nc3ccc(C(=O)NC(C)C)cc3C)cc2[N+](=O)[O-])n1 489957875 NZJPGQFHKNZUQG-UHFFFAOYSA-N 470.576 5.210 5 20 JKBD O=C(Nc1ccc(-n2cccn2)cc1C(F)(F)F)c1csc(-c2ccc([N+](=O)[O-])cc2)n1 496301463 CRUHNWNFHNUQEF-UHFFFAOYSA-N 459.409 5.175 5 20 JKBD O=C(Nc1cc(C(F)(F)F)cnc1O)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1 499539102 SYUIMJCSYQBJPB-UHFFFAOYSA-N 453.760 5.412 5 20 JKBD COc1cccc([C@@H](CNC(=O)Nc2cccc([N+](=O)[O-])c2C)c2c[nH]c3ccccc23)c1OC 503677965 WUXZBKQCTRNBMJ-HXUWFJFHSA-N 474.517 5.355 5 20 JKBD C[C@H](Nc1ccc(C(=O)NCc2ccc(OCC(F)(F)F)cc2)cc1[N+](=O)[O-])c1ccccn1 507155166 MYZUFXITPYQRQH-HNNXBMFYSA-N 474.439 5.034 5 20 JKBD C[C@@H](NC(=O)c1cn(C)nc1-c1ccc([N+](=O)[O-])cc1)c1ccc(NC(=O)Nc2ccccc2)cc1 508856369 AEMTYXFEEAACRE-QGZVFWFLSA-N 484.516 5.130 5 20 JKBD Cc1ccc(NC(=O)[C@@H](Sc2nnc(C[C@H](C)c3ccccc3)o2)c2ccccc2)c([N+](=O)[O-])c1 515309931 ZPBMXKAMDFTTID-UUOWRZLLSA-N 488.569 6.105 5 20 JKBD COc1ccc(NC(=O)c2nc(-c3cccs3)n(-c3cccc(C(F)(F)F)c3)n2)c([N+](=O)[O-])c1 518167106 HVLXQDIOOHLSTH-UHFFFAOYSA-N 489.435 5.184 5 20 JKBD Cc1ncsc1CN(C)C(=O)C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1 520892896 OVWFRGMABXOUHN-GZTJUZNOSA-N 464.572 5.559 5 20 JKBD C[C@@H]1CCC[C@@H](OCc2cccc(N[C@H](C)C(=O)Nc3ccc([N+](=O)[O-])cc3C(F)(F)F)c2)C1 582351543 BMRBJOQYDXFOIK-JXXFODFXSA-N 479.499 6.148 5 20 JKBD O=C(C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)N1CCN(Cc2ccco2)CC1 592585718 AKVSVAMFTJGWGQ-CAPFRKAQSA-N 488.569 5.073 5 20 JKBD Cc1c(NC(=O)c2cccc(NC(=O)c3cccc(Br)c3)c2)cccc1[N+](=O)[O-] 603751666 ZMAFSLSSOOAKMH-UHFFFAOYSA-N 454.280 5.170 5 20 JKBD C[C@H](NC(=O)N[C@H](C)c1cccc([N+](=O)[O-])c1)c1ccc(NC(=O)c2ccc(F)cc2)cc1 604104520 OXNRZYIBPZDXJA-JKSUJKDBSA-N 450.470 5.108 5 20 JKBD CCc1cccc2c(C3CCN(C(=O)C4CCN(c5ccccc5[N+](=O)[O-])CC4)CC3)c[nH]c12 604193236 IZANWRWTBBSYMW-UHFFFAOYSA-N 460.578 5.261 5 20 JKBD CC(C)CCSc1ccc(C(=O)N2CCC(CC(=O)NC3CCCC3)CC2)cc1[N+](=O)[O-] 604396700 OLDKGKXTJCBPPW-UHFFFAOYSA-N 461.628 5.034 5 20 JKBD COc1ccc(Oc2ccc([N+](=O)[O-])cc2C(=O)N(C)C[C@H]2CCCO[C@H]2c2ccccc2)cc1 604519597 HBNRRPXZYMYFHV-IBVKSMDESA-N 476.529 5.636 5 20 JKBD C[C@H](NCc1ccccc1-c1ccc(Cn2cccn2)cc1)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl 608910239 KEADGJPCYJYZOW-SFHVURJKSA-N 489.963 5.277 5 20 JKBD Cc1nc(-c2ccccc2)sc1CN[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1 608981465 SCBBBLOOARWSBN-QHCPKHFHSA-N 492.988 6.150 5 20 JKBD O=C(Nc1nc(-c2ccccc2OC(F)F)cs1)c1csc(-c2ccc([N+](=O)[O-])cc2)n1 609021439 AJBXQZNISXQRTL-UHFFFAOYSA-N 474.470 5.696 5 20 JKBD Cc1csc(Sc2ccc(C(=O)Nc3nnc(Cc4ccccc4F)s3)cc2[N+](=O)[O-])n1 609375924 SICPUSJCXGCYKN-UHFFFAOYSA-N 487.563 5.345 5 20 JKBD COc1cc(C(=O)N[C@@H](c2ccc3c(c2)CCCC3)c2cccs2)c([N+](=O)[O-])cc1OC 612668045 JZOHNHQUAKNBBU-QHCPKHFHSA-N 452.532 5.072 5 20 JKBD O=C(CCC(=O)c1ccc2ccc3cccc4ccc1c2c34)Nc1cccc(N2CCOC2=O)c1 727755347 UGDISSGWCYXPIG-UHFFFAOYSA-N 462.505 6.142 5 20 JKBD C[C@@H](OC(=O)CC(c1ccccc1)c1ccccc1)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 765949111 CIMJZHUXYJYZOR-MRXNPFEDSA-N 486.446 5.706 5 20 JKBD CC(C)N(Cc1nnc(-c2cccc([N+](=O)[O-])c2)o1)C(=O)[C@@H](C)Oc1ccc(C(C)(C)C)cc1 916550697 CKFKLSJZUHETAV-QGZVFWFLSA-N 466.538 5.147 5 20 JKBD C[C@H](OC(=O)c1cc2cc([N+](=O)[O-])ccc2o1)C(=O)N1c2ccccc2Sc2ccccc21 919212521 TVQPZSBGIISHCT-AWEZNQCLSA-N 460.467 5.716 5 20 JKBD COc1ccc([C@@H]2C[C@@H]2C(=O)Nc2ccc(C3(NC(=O)Cc4cccc([N+](=O)[O-])c4)CCC3)cc2)cc1 1786328809 UOZSTLNFUGKBKS-UIOOFZCWSA-N 499.567 5.084 5 20 JKBD Cc1cccc(C(=O)Nc2ccc(C3(NC(=O)C4(c5cccc([N+](=O)[O-])c5)CCC4)CCC3)cc2)n1 1787323959 LFNHPGLFPXEQLR-UHFFFAOYSA-N 484.556 5.168 5 20 JKBD Cc1nnsc1C(=O)Nc1ccc(C2(NC(=O)c3cc4cc([N+](=O)[O-])ccc4s3)CCC2)cc1 1788760290 QXYFHPVKXURLMH-UHFFFAOYSA-N 493.570 5.031 5 20 JKBD O=C(NC1(c2ccc(NC(=O)C3CC4(CCC4)C3)cc2)CCC1)c1ccc([N+](=O)[O-])cc1F 1792039822 HHPODYXOKSHLNY-UHFFFAOYSA-N 451.498 5.062 5 20 JKBD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2cc(F)cc([N+](=O)[O-])c2)[nH]n1)c1cc2sccc2s1 1819029378 OCNJMFKWXINWSE-INIZCTEOSA-N 499.549 5.353 5 20 JKBD CC(C)(C)CCCCCC(=O)Nc1cc([C@@H]2CCCCN2C(=O)/C=C/c2ccc([N+](=O)[O-])o2)[nH]n1 1822114062 LDJZLJUEXFUGNH-RPAADVPWSA-N 485.585 5.613 5 20 JKBD COc1ccc(NC(=O)[C@H](C)Sc2nnc(-c3ccco3)n2C2CCCCC2)c([N+](=O)[O-])c1 16864223 KGKCYSIXSYVAQD-AWEZNQCLSA-N 471.539 5.079 5 20 JKBD C[C@@H](OC(=O)c1csc(-c2cccs2)n1)C(=O)Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1 19260117 MQKNZZGBTCXHGW-LLVKDONJSA-N 486.556 5.087 5 20 JKBD COc1cc(NC(=O)c2ccc(SCCC(C)C)c([N+](=O)[O-])c2)ccc1NC(=O)c1cccnc1 26237324 VTAHABRFNNDXIA-UHFFFAOYSA-N 494.573 5.641 5 20 JKBD O=C(CSc1ccccc1C(=O)Nc1ccc(F)c([N+](=O)[O-])c1)NC1CCCCCCC1 32517603 PMFNTZRMNJRAPL-UHFFFAOYSA-N 459.543 5.307 5 20 JKBD COCCOc1cc([N+](=O)[O-])c(C(=O)Nc2ccccc2Sc2ccccc2)cc1OC 58520850 QHVACQIILJIJQU-UHFFFAOYSA-N 454.504 5.032 5 20 JKBD C[C@@H](Nc1ccc(C(=O)Nc2ccccc2OC[C@@H]2CCCCO2)cc1[N+](=O)[O-])c1ccccn1 108910902 QOERSVPRKXZRAV-QUCCMNQESA-N 476.533 5.363 5 20 JKBD COc1ccc([N+](=O)[O-])cc1NC(=O)[C@@H](C)Sc1ncc(-c2ccccc2)n1CC(F)(F)F 109621952 XBDGZFKZQKTRSO-CYBMUJFWSA-N 480.468 5.149 5 20 JKBD C[C@@H](Sc1ncc(-c2ccccc2)n1CC(F)(F)F)C(=O)Nc1ccc(F)c([N+](=O)[O-])c1 109622843 VZCUVIPONOFFIC-GFCCVEGCSA-N 468.432 5.279 5 20 JKBD CN(C(=O)c1ccc(Cl)cc1)c1ccc(NC(=O)c2cc3cc([N+](=O)[O-])ccc3s2)cc1 195645398 NJJBKYWXPZRYQR-UHFFFAOYSA-N 465.918 5.992 5 20 JKBD Cc1sc(NC(=O)c2cnc3c(cnn3Cc3ccccc3)c2)nc1-c1cccc([N+](=O)[O-])c1 195704157 MHNHAYPNGRVHHL-UHFFFAOYSA-N 470.514 5.072 5 20 JKBD CSCC[C@@H](NC(=O)c1cccc([N+](=O)[O-])c1)C(=O)NCc1ccccc1-c1ccc(Cl)cc1 303157139 OEFKUNDAKLJTTR-HSZRJFAPSA-N 498.004 5.083 5 20 JKBD CCOc1cc(CN[C@@H]2CCCc3ccccc32)ccc1OCc1cc([N+](=O)[O-])cc2c1OCOC2 409479030 JGOPABBBOHKOMT-RUZDIDTESA-N 490.556 5.606 5 20 JKBD Cc1ccc(SCc2cccc(C(=O)N3CCN(C(=O)c4ccc([N+](=O)[O-])s4)CC3)c2)c(C)c1 478596063 YBPHJFSPUFHHMU-UHFFFAOYSA-N 495.626 5.164 5 20 JKBD COc1ccc([C@@H]2CCN(C(=O)c3ccc(Oc4ccc(Cl)cc4[N+](=O)[O-])cc3)C2)cc1 504939173 MOUKFYRPFHKTNK-GOSISDBHSA-N 452.894 5.679 5 20 JKBD C[C@@H](Nc1ccc(C(=O)N[C@H]2CCOc3c(Cl)cccc32)cc1[N+](=O)[O-])c1ccccn1 507891234 IBENDUNMIBYROM-KUHUBIRLSA-N 452.898 5.070 5 20 JKBD Cn1ccnc1[C@H](NCc1ccc(Oc2ccccc2Cl)c([N+](=O)[O-])c1)c1cccc(F)c1 509598594 BYAPMKLLLODOAO-HSZRJFAPSA-N 466.900 5.792 5 20 JKBD COc1cc([N+](=O)[O-])ccc1NC(=O)CN[C@H](c1ccc(C)cc1)c1ccc(F)cc1Cl 520831396 HSRXARAZSMKNLY-HSZRJFAPSA-N 457.889 5.022 5 20 JKBD COc1ccc(CNCc2cn(Cc3ccccc3Cl)nc2-c2ccccc2)cc1[N+](=O)[O-] 521828766 YQPCMHLUBHWFRH-UHFFFAOYSA-N 462.937 5.458 5 20 JKBD O=[N+]([O-])c1ccccc1-c1ccc(CNCc2nnc3c(Cl)cc(C(F)(F)F)cn23)s1 608835788 QSVSSMQCVOYNKG-UHFFFAOYSA-N 467.860 5.328 5 20 JKBD COc1cc(CN2CCO[C@H](c3ccc(Cl)c(Cl)c3)C2)c([N+](=O)[O-])cc1OC(F)F 608975983 GTPJUBWQDSXADX-SFHVURJKSA-N 463.264 5.085 5 20 JKBD CCn1c(SCC(=O)c2ccc(NC(C)=O)c(SC)c2)nc2cc3ccccc3cc2c1=O 613972944 MTXLAJIVPVFVRU-UHFFFAOYSA-N 477.611 5.225 5 20 JKBD O=C(Nc1nc(C2CC2)c(Cc2cccc(C(F)(F)F)c2)s1)c1cc(F)ccc1[N+](=O)[O-] 726153988 ZJCDMZTUQAXSQY-UHFFFAOYSA-N 465.428 5.930 5 20 JKBD O=C(C[C@@H](NC(=O)c1ccccc1Cl)c1ccccc1)Nc1ccc([N+](=O)[O-])c(Cl)c1 727711932 QQDSIUSVGWDCND-LJQANCHMSA-N 458.301 5.402 5 20 JKBD COc1ccccc1[C@H](C)CC(=O)O[C@@H](C(=O)Nc1ccc(C)cc1[N+](=O)[O-])c1ccccc1 728658692 NIIPQLFALCDASE-IQGLISFBSA-N 462.502 5.329 5 20 JKBD Cc1cccc(C(C)C)c1NC(=O)[C@H](C)OC(=O)CNc1ccc(C(F)(F)F)cc1[N+](=O)[O-] 772382558 SNXGBROXGMQFOT-AWEZNQCLSA-N 467.444 5.028 5 20 JKBD O=C(N[C@H](c1ccccc1)c1ccc2nc(C(F)(F)F)[nH]c2c1)c1cc(Cl)ccc1[N+](=O)[O-] 844144640 NLGJFCXQSHOOPG-LJQANCHMSA-N 474.826 5.663 5 20 JKBD CC(C)N(Cc1nnc(-c2cccc([N+](=O)[O-])c2)o1)C(=O)c1ccc2[nH]c3c(c2c1)CCCC3 864243043 YHKWYESGQBRDPF-UHFFFAOYSA-N 459.506 5.056 5 20 JKBD COc1ccc(N[C@@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)cc1NC(=O)OC(C)(C)C 915224268 KHUOHJVNDOYJKW-LBPRGKRZSA-N 464.906 5.043 5 20 JKBD NC(=O)c1ccc(CSc2ncccc2C(=O)OCc2nc3ccccc3c3ccccc23)cc1 915461227 LOHLDPWUZRIDMZ-UHFFFAOYSA-N 479.561 5.531 5 20 JKBD Cc1onc(-c2c(Cl)cccc2Cl)c1C(=O)OCc1nc(-c2ccc([N+](=O)[O-])cc2)no1 919065388 FRIUMDQNNFCFQS-UHFFFAOYSA-N 475.244 5.272 5 20 JKBD Cc1ccc2[nH]c(C(=O)Nc3ccc(C4(NC(=O)/C=C/c5ccc([N+](=O)[O-])o5)CCC4)cc3)cc2c1 1788964675 AJFFAOIMGQFGMU-DHZHZOJOSA-N 484.512 5.439 5 20 JKBD O=C(Cc1cc([N+](=O)[O-])ccc1F)NC1(c2ccc(NC(=O)c3ccc4occc4c3)cc2)CCC1 1789048882 MQQBTZVDAPMBQZ-UHFFFAOYSA-N 487.487 5.471 5 20 JKBD COc1cc(CC(=O)NC2(c3ccc(NC(=O)[C@H]4CC=C(C)CC4)cc3)CCC2)ccc1[N+](=O)[O-] 1789115196 PIAHHVAJTURPRB-FQEVSTJZSA-N 477.561 5.026 5 20 JKBD COc1ccc(CC(=O)Nc2ccc(C3(NC(=O)[C@@H]4CC=C(C)CC4)CCC3)cc2)c([N+](=O)[O-])c1 1790571462 WHIOUQYMVKDLLX-LJQANCHMSA-N 477.561 5.026 5 20 JKBD Cc1cc(O)c([N+](=O)[O-])cc1C(=O)Nc1ccc(C2(NC(=O)[C@H]3CCCCC3(F)F)CCC2)cc1 1790806192 BHMGZZWZLGXEHO-LJQANCHMSA-N 487.503 5.182 5 20 JKBD O=C(CC[C@H]1CCOC1)Nc1ccc(C2(NC(=O)c3cc4cc([N+](=O)[O-])ccc4s3)CCC2)cc1 1792025878 IHXQLOMVWXSOHO-KRWDZBQOSA-N 493.585 5.374 5 20 JKBD Cc1cc(CCCC(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2ccc3occc3c2)c([N+](=O)[O-])cc1F 1797562674 JUWSLEMJSGUILK-KOUNCHBCSA-N 493.535 5.063 5 20 JKBD CC[C@H]1CC[C@H](C(=O)N2CCC([C@@H]3CCCCN3C(=O)c3cccc(F)c3[N+](=O)[O-])CC2)CC1 1830622144 GEGTVQMVRRCSIW-LEDOBFOHSA-N 473.589 5.184 5 20 JKBD C[C@H](CC(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cccc(F)c2[N+](=O)[O-])CC1)c1ccccc1 1831508732 DZIVXPKMXUKPST-DVECYGJZSA-N 481.568 5.161 5 20 JKBD Cc1ccc(NC(=O)[C@H](Sc2nnc(-c3ccc(Cl)cc3)n2N)c2ccccc2)c([N+](=O)[O-])c1 8659204 BTECGAGDQPSINT-HXUWFJFHSA-N 494.964 5.001 5 20 JKBD O=C(Nc1ccccc1)C1CCN(C(=O)c2cc([N+](=O)[O-])ccc2Sc2ccc(Cl)cc2)CC1 15182308 VEILSXIZUZHPRO-UHFFFAOYSA-N 495.988 5.890 5 20 JKBD C[C@@H](OC(=O)c1csc(-c2ccc(Cl)cc2)n1)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl 16457611 MKIUUBMMABANAL-SNVBAGLBSA-N 466.302 5.209 5 20 JKBD C[C@@H](OC(=O)c1cc2cc([N+](=O)[O-])ccc2s1)C(=O)Nc1ccc(Cl)cc1C(F)(F)F 16800356 YVUWZFQHDNEIQP-SECBINFHSA-N 472.828 5.666 5 20 JKBD Cc1occc1-c1nnc(S[C@H](C)C(=O)Nc2cc([N+](=O)[O-])ccc2Cl)n1Cc1ccccc1 21449461 PRWAKIZLWHEVNQ-OAHLLOKOSA-N 497.964 5.576 5 20 JKBD Cc1c(NC(=O)[C@@H](C)Sc2nnc(-c3ccccc3Cl)n2C2CCCC2)cccc1[N+](=O)[O-] 21722693 LNIPDSPOIDQAPR-OAHLLOKOSA-N 485.997 6.050 5 20 JKBD CCN(CC)c1ccc(-c2nnc(S[C@@H](C)C(=O)Nc3cccc([N+](=O)[O-])c3C)n2CC)cc1 25367684 YFOGXRRJNIXJDQ-KRWDZBQOSA-N 482.610 5.147 5 20 JKBD CSc1ccc(C(=O)c2ccccc2C(=O)N(C)Cc2ccc(F)cc2F)cc1[N+](=O)[O-] 27131466 AYWBUZYTBDIOJU-UHFFFAOYSA-N 456.470 5.098 5 20 JKBD Cc1ccccc1-n1c(-c2ccncc2)nn(CN(C)Cc2cc([N+](=O)[O-])ccc2Cl)c1=S 27532867 NBTHNKVEIKDBQG-UHFFFAOYSA-N 480.981 5.425 5 20 JKBD COc1ccc(N[C@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2C(F)(F)F)cc1Cc1ccccc1 28888978 DBSMQEBUOUOLOQ-OAHLLOKOSA-N 473.451 5.652 5 20 JKBD Cc1c(NC(=O)c2ccc(N3CCCC3)c([N+](=O)[O-])c2)cccc1C(=O)N1CCc2sccc2C1 45915691 VNXQFHGBOGHFOA-UHFFFAOYSA-N 490.585 5.016 5 20 JKBD C[C@@H](NC(=O)c1ccc(N[C@H](C)c2ccccn2)c([N+](=O)[O-])c1)c1ccc(NC(=O)C2CC2)cc1 108783611 FKWFLVHJJLUTRN-IAGOWNOFSA-N 473.533 5.002 5 20 JKBD COc1ccccc1-c1cc(NC(=O)c2cc(SC)ccc2[N+](=O)[O-])n(-c2ccc(C)cc2)n1 195624943 HXZJRUMEOHBTJZ-UHFFFAOYSA-N 474.542 5.739 5 20 JKBD CCOc1ccc(-c2nc(CC(=O)Nc3nc(-c4cccc([N+](=O)[O-])c4)c(C)s3)cs2)cc1 195704266 CXKMQXWKGNEUSQ-UHFFFAOYSA-N 480.571 5.730 5 20 JKBD COc1cc(F)c(NC(=O)c2ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])c(OC)c2)cc1OC 410026841 GEZVAEBTQFFFSZ-UHFFFAOYSA-N 476.844 5.458 5 20 JKBD Cc1sc(NC(=O)c2nnn(-c3ccc(F)cc3)c2C(F)(F)F)nc1-c1cccc([N+](=O)[O-])c1 498391641 YPZIYTMZXRPYKA-UHFFFAOYSA-N 492.414 5.018 5 20 JKBD Cc1nn(Cc2ccc(C(=O)N(Cc3ccc(F)cc3F)C3CCCC3)cc2)c(C)c1[N+](=O)[O-] 500566502 VVKRQADRSWVVPG-UHFFFAOYSA-N 468.504 5.320 5 20 JKBD COc1ccc(C(=O)N2CCCCCC2)cc1NC(=O)c1cc2cc([N+](=O)[O-])ccc2s1 501691747 UHDXWOJBHFNIFM-UHFFFAOYSA-N 453.520 5.087 5 20 JKBD O=C(NCc1ccc(NC(=O)c2ccc([N+](=O)[O-])cc2Cl)cc1)c1ccc(C(F)(F)F)cc1 502580710 IWISVIMWEIFLLR-UHFFFAOYSA-N 477.826 5.449 5 20 JKBD Cc1cc([N+](=O)[O-])ccc1C(=O)N(CC(=O)Nc1ccc(Cl)cc1C(F)(F)F)C(C)C 504775039 JHXKNDLFKFZGIR-UHFFFAOYSA-N 457.836 5.065 5 20 JKBD Cc1cccc(NS(=O)(=O)c2ccc(C(=O)N(Cc3ccc([N+](=O)[O-])cc3)C(C)C)cc2)c1C 509710931 JALYDMVRBYAKCW-UHFFFAOYSA-N 481.574 5.063 5 20 JKBD CCc1ccc2nc(NC(=O)c3cc(OC)c(OCc4cscn4)cc3[N+](=O)[O-])sc2c1 511657216 QKROIYZMRNEBLH-UHFFFAOYSA-N 470.532 5.063 5 20 JKBD O=C(C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)Nc1ccc2c(c1)OCC(=O)N2 517469973 SQVUAYJSVRQSFG-WJDWOHSUSA-N 486.509 5.105 5 20 JKBD COc1cc(C(=O)Nc2ccc(OCc3cccc(C)c3)cc2C)c([N+](=O)[O-])cc1OC(F)F 517936794 HVXXVGHYZCHAED-UHFFFAOYSA-N 472.444 5.653 5 20 JKBD CCC(=O)Nc1ccc(N[C@@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2ccccc2)cc1 520741891 DRQCJYHOIMUCRE-JOCHJYFZSA-N 452.898 5.389 5 20 JKBD CC(C)(C)Cc1nc2cc(NC(=O)c3ccc([N+](=O)[O-])cc3I)ccc2o1 521769378 YZMWREDBBVFTTF-UHFFFAOYSA-N 479.274 5.182 5 20 JKBD CC(C)N(C)Cc1ccccc1CNCc1ccc(-c2ccc([N+](=O)[O-])cc2Br)o1 521815973 HBNXEFFBEQWMGM-UHFFFAOYSA-N 472.383 5.747 5 20 JKBD Cc1cccn2c(=O)cc(CNc3cc([N+](=O)[O-])ccc3Nc3cccc(C(F)(F)F)c3)nc12 589420091 FNXIAVVVVOREQM-UHFFFAOYSA-N 469.423 5.286 5 20 JKBD C[C@H](c1cc2ccccc2o1)N(C)C(=O)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 603459664 JUMSMQBYWBMJMK-OAHLLOKOSA-N 475.467 5.796 5 20 JKBD Cc1ccc(S(=O)(=O)Nc2ccc(NC(=O)c3oc4ccc(F)cc4c3C)cc2)cc1[N+](=O)[O-] 609453785 BKEVHXBVDQZDLN-UHFFFAOYSA-N 483.477 5.150 5 20 JKBD O=C(Nc1ccc(Cl)c([N+](=O)[O-])c1)N1CCC[C@@H](c2nc(-c3ccc(Cl)cc3)no2)C1 726694034 XJYUEDWOWNBUKK-CYBMUJFWSA-N 462.293 5.363 5 20 JKBD COc1ccc([N+](=O)[O-])c(C(=O)Nc2nc3ccccc3n2Cc2cccc(C(F)(F)F)c2)c1 727999547 QMOBGJUIQRRILN-UHFFFAOYSA-N 470.407 5.273 5 20 JKBD CC(=O)N[C@H](CC(=O)OCc1nc2ccccc2c2ccccc12)c1ccc(Br)cc1 742467131 PRGUPCJNMKFHKN-HSZRJFAPSA-N 477.358 5.461 5 20 JKBD O=C(N[C@H](Cn1cnc2ccccc21)c1ccc(F)cc1)c1cc([N+](=O)[O-])ccc1Br 751089689 PEIIXZBMDDURPR-HXUWFJFHSA-N 483.297 5.017 5 20 JKBD O=C(COC(=O)c1ccc(-c2nc3ccccc3s2)o1)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 774030444 ZVBMSUSHSBWPST-UHFFFAOYSA-N 491.403 5.279 5 20 JKBD Cc1csc(Sc2ccc(C(=O)OCC(=O)Nc3ccc(F)cc3Cl)cc2[N+](=O)[O-])n1 849119975 GUYBJOGEDVAYOC-UHFFFAOYSA-N 481.914 5.099 5 20 JKBD CC(C)Cn1cc([C@@H]2N(C(=O)c3cc([N+](=O)[O-])ccc3Oc3ccccc3)CC23CCOCC3)cn1 849532006 NJOXGBMRJMWLLS-VWLOTQADSA-N 490.560 5.234 5 20 JKBD O=C(c1cc(Cl)ccc1[N+](=O)[O-])N1CCC(C(O)(c2ccccc2)c2ccccc2)CC1 856854119 FYFADSRJDBTXFI-UHFFFAOYSA-N 450.922 5.037 5 20 JKBD Cc1cc([C@@H]2CCCN2C(=O)C/C(=C\c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)no1 912930892 IPYIKDCIRWXTRU-RRXSNJIPSA-N 474.542 5.795 5 20 JKBD CC(C)[C@H](OC(=O)c1cc2cc([N+](=O)[O-])ccc2s1)C(=O)Nc1ccccc1C(F)(F)F 915379607 CEAPHLDXFSYUAA-SFHVURJKSA-N 466.437 5.648 5 20 JKBD CCN(CC)Cc1cccc(CNC(=O)c2ccccc2NC(=O)c2ccc([N+](=O)[O-])cc2Cl)c1 915902883 OQVBBFLLOZAOAL-UHFFFAOYSA-N 494.979 5.272 5 20 JKBD CCCOc1ccc([C@H](C)Nc2cc([N+](=O)[O-])c(OC)c(Br)c2[N+](=O)[O-])cc1OC 917077650 OHNRGBWSCNVLQA-NSHDSACASA-N 484.303 5.245 5 20 JKBD Cc1c([N+](=O)[O-])cc(C(=O)Nc2ccc(C(=O)N(C)C3CCCCC3)c(Cl)c2)cc1[N+](=O)[O-] 917755352 WKMQKZARAIFMBY-UHFFFAOYSA-N 474.901 5.122 5 20 JKBD CCN(Cc1ccccc1)C(=O)c1cc(NC(=O)c2cc([N+](=O)[O-])cc([N+](=O)[O-])c2C)ccc1Cl 917767137 QTTLDIVTTJUVQY-UHFFFAOYSA-N 496.907 5.379 5 20 JKBD Cc1ccc(C(=O)O[C@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2ccccc2)c(Cl)n1 919252573 ZBAYXJXLVVKKSW-SFHVURJKSA-N 460.273 5.142 5 20 JKBD CSc1nc2ccc(NC(=O)c3ccc(N[C@H](C)c4ccccn4)c([N+](=O)[O-])c3)cc2s1 919679890 OFMSCQXPRMFRHR-CYBMUJFWSA-N 465.560 5.747 5 20 JKBD O=C(Nc1ccc(OC(=O)c2cc(F)cc3nc(S)[nH]c23)cc1)c1cc([N+](=O)[O-])ccc1Cl 919695029 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CC(C)(C)c1ncccc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc2cc([N+](=O)[O-])ccc2s1 1801207173 VMJKVVMYNPNBQZ-BCDXTJNWSA-N 492.601 5.068 5 20 JKBD CC(C)[C@H](C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2ccc([N+](=O)[O-])[nH]2)n[nH]1)c1ccc(Cl)cc1 1820362065 AAZZCDZGTWODEC-KNQAVFIVSA-N 498.971 5.045 5 20 JKBD O=C(/C=C/C1CCCCC1)Nc1cc([C@@H]2CCCCN2C(=O)CCc2cccc([N+](=O)[O-])c2)[nH]n1 1820905090 JPHZMXJPAUQQFW-KHMHUBCMSA-N 479.581 5.079 5 20 JKBD Cc1cccc(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)c3cc(F)cc([N+](=O)[O-])c3)n[nH]2)c1Cl 1821168114 ISBWLEFCICMYPE-LJQANCHMSA-N 485.903 5.039 5 20 JKBD C[C@H](CC(=O)Nc1cc([C@H]2CCCCN2C(=O)CCc2cccc([N+](=O)[O-])c2)[nH]n1)c1ccccc1 1822040954 HKLVLBKOLCDJNT-NTKDMRAZSA-N 489.576 5.137 5 20 JKBD O=C(/C=C/c1ccccc1[N+](=O)[O-])Nc1cc([C@@H]2CCCCN2C(=O)c2cccc(F)c2Cl)[nH]n1 1823503771 SPYAZFGEYJPXEN-SGWGQVFISA-N 497.914 5.130 5 20 JKBD O=C(c1ccc2occ(Cl)c2c1)N1CCC([C@@H]2CCCCN2C(=O)c2ccc([N+](=O)[O-])o2)CC1 1823614096 RJXLLDFBLSWUGT-IBGZPJMESA-N 485.924 5.135 5 20 JKBD C[C@@H](C(=O)N1CCC([C@@H]2CCCCN2C(=O)CCc2cccc([N+](=O)[O-])c2)CC1)c1cccs1 1824842971 LNXZIGGAQJWQMI-XXBNENTESA-N 483.634 5.012 5 20 JKBD COc1ccc([N+](=O)[O-])cc1NC(=O)[C@@H](C)Sc1nnc(-c2cccs2)n1-c1ccccc1 3468569 PXLGJDXELULFPL-CQSZACIVSA-N 481.559 5.032 5 20 JKBD CC(C)Cn1c(SCC(=O)Nc2cc([N+](=O)[O-])ccc2Cl)nnc1-c1ccccc1F 8651388 VMDHRHJJGASNFX-UHFFFAOYSA-N 463.922 5.033 5 20 JKBD CCCn1c(S[C@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)nc2cc(Cl)ccc2c1=O 9398682 ATZPOYHLQWLUME-LLVKDONJSA-N 481.361 5.141 5 20 JKBD O=C(OCc1cc(-c2cccs2)on1)c1ccccc1C(=O)c1ccc(Cl)c([N+](=O)[O-])c1 14754859 COLPHWMQVFZOEQ-UHFFFAOYSA-N 468.874 5.553 5 20 JKBD COc1ccc(OC)c(NC(=O)c2ccccc2Sc2ccc(C(F)(F)F)cc2[N+](=O)[O-])c1 15083224 TYEGWBOYSFBLGM-UHFFFAOYSA-N 478.448 6.034 5 20 JKBD Cc1ccc(-c2nnc([C@@H](C)OC(=O)c3ccc(NCc4ccccc4)c([N+](=O)[O-])c3)o2)cc1 17656726 PMROXFXWBDJTAE-QGZVFWFLSA-N 458.474 5.483 5 20 JKBD C[C@@H](OC(=O)Cc1coc2ccc3ccccc3c12)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 21451828 VOCJSWFXWZVZKY-CYBMUJFWSA-N 486.402 5.626 5 20 JKBD O=C(Nc1ccc(Cl)cc1)c1nnc(/C(Cl)=C/c2ccc(Cl)c([N+](=O)[O-])c2)s1 21841691 PRASBLDOKDLNQH-QPEQYQDCSA-N 455.710 5.742 5 20 JKBD COc1cccc([C@@H](NC(=O)c2ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])cc2)c2nccn2C)c1 24018067 VFCAFZUYNJOQSE-HSZRJFAPSA-N 492.919 5.302 5 20 JKBD COc1cc2c(cc1OC)[C@H](c1cccs1)N(C(=O)c1ccc(Cl)cc1[N+](=O)[O-])CC2 24445065 MBMSDOVUXOUUOP-OAQYLSRUSA-N 458.923 5.115 5 20 JKBD Cc1ccc(NC(=O)C(C)C)cc1NC(=O)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1 46789739 UTNHLPNYVJCQIG-UHFFFAOYSA-N 467.909 6.196 5 20 JKBD C[C@@H](OC(=O)/C(=C\c1ccc(F)cc1)c1cccs1)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 96887694 GPCCBBMZMYXYAT-RMENWYJGSA-N 465.462 5.690 5 20 JKBD COc1cccc([C@@H](CNC(=O)CSc2ccc([N+](=O)[O-])cc2)c2c[nH]c3ccccc23)c1OC 104722523 KZMRVNPXJXQFNJ-JOCHJYFZSA-N 491.569 5.134 5 20 JKBD CSc1ccc(C(=O)c2ccccc2C(=O)Nc2ccc(-c3nc(C)c(C)o3)cc2)cc1[N+](=O)[O-] 115720368 VFNHGBYGNCCFPS-UHFFFAOYSA-N 487.537 6.072 5 20 JKBD C[C@H](Nc1ccc(C(=O)Nc2nc(-c3c(F)cccc3F)cs2)cc1[N+](=O)[O-])c1ccccn1 303036152 VCIAJWATKCYKAG-ZDUSSCGKSA-N 481.484 5.817 5 20 JKBD C[C@@H](NC(C)(C)CNC(=O)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1)c1ccccc1 303176842 CGUWCAROOYMPDY-QGZVFWFLSA-N 492.542 5.076 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)Nc2ncc(Cc3cccc(Cl)c3Cl)s2)cc1SC 303178537 JXXFHYILTAAQCF-UHFFFAOYSA-N 484.386 5.932 5 20 JKBD COc1cc(C(=O)N[C@H](c2ccccc2)c2cccc(Cl)c2)c([N+](=O)[O-])cc1OC(F)F 501432007 CHVPFRAHVSHRRX-HXUWFJFHSA-N 462.836 5.378 5 20 JKBD CCOc1ccc(C(=O)Nc2ncc(Cc3cccc(Br)c3)s2)cc1[N+](=O)[O-] 505452469 ANZFQDSZOPAMDO-UHFFFAOYSA-N 462.325 5.056 5 20 JKBD CCOc1ccc([C@@H](CNC(=O)c2ccc([N+](=O)[O-])c(OC)c2)c2c[nH]c3ccccc23)cc1OC 511133908 ANMMSGZXVBZYBT-HXUWFJFHSA-N 489.528 5.054 5 20 JKBD O=C(Nc1ccc(N[C@@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2ccccc2)cc1)NC1CC1 514981376 SHZAIJLGEYOQGS-JOCHJYFZSA-N 479.924 5.324 5 20 JKBD Cc1ccc(C(=O)N2C[C@H](C)C[C@@H](C)C2)cc1NC(=O)Cn1c2ccccc2c(=O)c2ccccc21 515612718 NKFLRWURWSHJTF-WOJBJXKFSA-N 481.596 5.220 5 20 JKBD CCOc1ccc(NC(=O)c2cc3ccccc3c3cccnc23)cc1S(=O)(=O)N1CCCCC1 515836354 KZDLCIVMSQYQMQ-UHFFFAOYSA-N 489.597 5.214 5 20 JKBD Cc1nc(-c2cccc(NC(=O)C3CCN(c4ccc(C(F)(F)F)cc4[N+](=O)[O-])CC3)c2)oc1C 517666724 HDQRHGQNMPTWSP-UHFFFAOYSA-N 488.466 5.741 5 20 JKBD O=C(c1oc2ccccc2c1CSc1ccc(F)cc1)N1CCN(c2ccc([N+](=O)[O-])nc2)CC1 519102666 ONJVBGRIZSFQJI-UHFFFAOYSA-N 492.532 5.130 5 20 JKBD COc1cc([C@H](C)NCc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)ccc1OCc1ccncc1 520211551 YEUILIXFBVCUDI-SFHVURJKSA-N 475.570 6.157 5 20 JKBD O=[N+]([O-])c1ccc(-c2ccc(CNC[C@H]3CCCO[C@H]3c3ccccc3)o2)c(Br)c1 521830315 RXKKMFZMBYJMPW-HXOBKFHXSA-N 471.351 5.875 5 20 JKBD CC(C)N(Cc1nnc(-c2ccccc2Cl)o1)C(=O)c1ccc(N2CCC[C@@H](C)C2)c([N+](=O)[O-])c1 600864538 LFGSRRAOXURYRP-QGZVFWFLSA-N 497.983 5.585 5 20 JKBD O=C(Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1)c1cn(Cc2ccccc2)nc1-c1cccnc1 601908562 GHUXXZMTNOBCPA-UHFFFAOYSA-N 482.525 5.277 5 20 JKBD O=C(Nc1ccc(NC(=O)c2csc([N+](=O)[O-])c2)c(C(F)(F)F)c1)c1ccc(F)cc1 603757143 PSFMWVQVIDGOJY-UHFFFAOYSA-N 453.373 5.319 5 20 JKBD COc1ccc(NC(=O)c2ccc(C(=O)Nc3ccc(OC)c(Cl)c3)c([N+](=O)[O-])c2)cc1Cl 603834151 HWISHMQQUZVQKH-UHFFFAOYSA-N 490.299 5.423 5 20 JKBD C[C@@H](NC(=O)c1ccccc1OCC(=O)Nc1cccc(C(F)(F)F)c1)c1cccc([N+](=O)[O-])c1 603966530 FHDIZEXRKYHAKC-OAHLLOKOSA-N 487.434 5.122 5 20 JKBD O=C(CCc1ccc(Br)cc1F)N(Cc1ccccc1[N+](=O)[O-])CC(F)(F)F 604486356 ZMINHURGAWXSCT-UHFFFAOYSA-N 463.225 5.020 5 20 JKBD CC(=O)Nc1cccc([C@H](C)NCc2ccc(-c3ccc([N+](=O)[O-])cc3Br)o2)c1 608835855 QKINMFLDCBNKDV-ZDUSSCGKSA-N 458.312 5.427 5 20 JKBD COc1cc(CCNC(=O)Nc2ccc(OCc3cccc(F)c3)cc2C)c([N+](=O)[O-])cc1OC 609079505 FDCHULXBXNQJLO-UHFFFAOYSA-N 483.496 5.003 5 20 JKBD C[C@@H](Nc1ccc2oc(CC(C)(C)C)nc2c1)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 609419377 PIDFUVDECAMXIL-GFCCVEGCSA-N 464.444 5.783 5 20 JKBD Cc1c(C(=O)Nc2cc(C(F)(F)F)ccc2NC(=O)OC(C)(C)C)cc([N+](=O)[O-])c(C)c1[N+](=O)[O-] 727790640 NVXVBBOJIQBIBP-UHFFFAOYSA-N 498.414 5.738 5 20 JKBD CC(C)(C)OC(=O)N1CCCc2cc(NC(=O)c3ccc(N4CCCC4)c([N+](=O)[O-])c3)ccc21 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O=C(Nc1ccc(C2(NC(=O)c3cc4cc([N+](=O)[O-])ccc4s3)CCC2)cc1)c1coc(Cl)n1 1787107872 YUPVSQLWEZSKSU-UHFFFAOYSA-N 496.932 5.512 5 20 JKBD Cc1cccc2[nH]c(C(=O)Nc3ccc(C4(NC(=O)/C=C/c5ccc([N+](=O)[O-])o5)CCC4)cc3)cc12 1789269203 HPAGYDQXXDNQJS-ZRDIBKRKSA-N 484.512 5.439 5 20 JKBD COc1cc(C(=O)Nc2ccc(C3(NC(=O)CCC=C(C)C)CCC3)cc2)cc([N+](=O)[O-])c1OC 1790815413 WQIDWVWDVWODJK-UHFFFAOYSA-N 481.549 5.106 5 20 JKBD CC[C@H](C)[C@@H](C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2ccc([N+](=O)[O-])o2)[nH]n1)c1ccccc1 1816848410 VAOJCPPYCNXFRU-XKDCRVNJSA-N 479.537 5.047 5 20 JKBD Cc1ccc2[nH]c(C(=O)N3CCCC[C@H]3C3CCN(C(=O)c4cc(F)cc([N+](=O)[O-])c4)CC3)cc2c1 1828123336 PAIHURBHJCQQJR-VWLOTQADSA-N 492.551 5.071 5 20 JKBD O=C(c1cc2ccoc2s1)N1CCC([C@@H]2CCCCN2C(=O)c2cccc(F)c2[N+](=O)[O-])CC1 1830619102 JCQRKHHXCLVBDI-IBGZPJMESA-N 485.537 5.089 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2ccc3occc3c2)CC1 1830734051 UOPRUJBREPXSFF-HSZRJFAPSA-N 493.535 5.336 5 20 JKBD Cc1nc(-c2ccc(Cl)cc2)sc1C(=O)OCC(=O)Nc1ccc([N+](=O)[O-])cc1Cl 10696715 QITCZFGGQKRGCF-UHFFFAOYSA-N 466.302 5.129 5 20 JKBD CS(=O)(=O)Nc1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2Sc2ccc(Cl)cc2)cc1 11362152 VRDSXCQEOFGAGP-UHFFFAOYSA-N 477.951 5.023 5 20 JKBD Cc1occc1-c1nnc(S[C@@H](C)C(=O)Nc2cc([N+](=O)[O-])ccc2Cl)n1Cc1ccccc1 21449463 PRWAKIZLWHEVNQ-HNNXBMFYSA-N 497.964 5.576 5 20 JKBD Cc1ccc(OCc2nc(CC(=O)Nc3nc(-c4ccc(C)c([N+](=O)[O-])c4)cs3)cs2)cc1 302922604 VNXXOPHCCNMMQU-UHFFFAOYSA-N 480.571 5.552 5 20 JKBD COc1cc(C(=O)Nc2ccc(Oc3ccccc3)cn2)c([N+](=O)[O-])cc1OCc1cscn1 487420184 WGDIOAKOSQSKDR-UHFFFAOYSA-N 478.486 5.079 5 20 JKBD Cc1nc([N+](=O)[O-])cn1CCC(=O)N1C[C@@H](c2ccccc2Cl)c2c([nH]c3ccccc23)[C@@H]1C 488805047 LIVKCNZVUGYVDR-KXBFYZLASA-N 477.952 5.360 5 20 JKBD Cc1csc(Sc2ccc(C(=O)NC[C@H]3CCCN(Cc4cccs4)C3)cc2[N+](=O)[O-])n1 492759048 WAEDMTJBXLCDKP-MRXNPFEDSA-N 488.660 5.214 5 20 JKBD C[C@@H](c1ccccc1)N(C(=O)c1ccc(Sc2nncn2C)c([N+](=O)[O-])c1)c1ccccc1 498005574 HBRLCZYUNFQERZ-KRWDZBQOSA-N 459.531 5.283 5 20 JKBD C[C@H](c1c(F)cccc1F)N(C)C(=O)Cc1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1 498512668 UFXCTJFONBUPNZ-QGZVFWFLSA-N 476.483 5.488 5 20 JKBD COCc1ccccc1CNC(=O)C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1 499955373 GDNNWFVDQHBJHK-KGENOOAVSA-N 473.554 5.598 5 20 JKBD O=C(C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)Nc1cnn(Cc2ccncc2)c1 503828702 NLEREINFYORRLT-DEDYPNTBSA-N 496.552 5.414 5 20 JKBD C[C@H](SCc1ncc(-c2ccc(Cl)cc2)o1)C(=O)N1c2ccc([N+](=O)[O-])cc2C[C@@H]1C 504375721 AXOWVUYCMHICJQ-KBPBESRZSA-N 457.939 5.503 5 20 JKBD C[C@@H](CCc1ccc(Br)cc1)NC(=O)Cn1c2ccccc2c(=O)c2ccccc21 507802351 BWXKWBZLPIEPMJ-KRWDZBQOSA-N 463.375 5.055 5 20 JKBD COc1cc(C(=O)Nc2ccc3[nH]c(-c4ccco4)nc3c2)c([N+](=O)[O-])cc1OCc1cscn1 509940276 BNUYSZRYBOPJGN-UHFFFAOYSA-N 491.485 5.028 5 20 JKBD Cc1cc(Br)ccc1N(C)C(=O)c1ccc(N[C@H](C)c2ccccn2)c([N+](=O)[O-])c1 510059135 PQBATWYRGQKOCF-OAHLLOKOSA-N 469.339 5.510 5 20 JKBD Cc1ccc(Sc2ccc(CN[C@@H](C)c3ccc(S(=O)(=O)N(C)C)cc3)cc2[N+](=O)[O-])cc1 513627133 LFQPRYHNGKMVGW-SFHVURJKSA-N 485.631 5.156 5 20 JKBD COc1cc(C(=O)NCC2(c3ccccc3)CCCCC2)c([N+](=O)[O-])cc1OCc1cscn1 516231451 YYWJQPQAABMCQD-UHFFFAOYSA-N 481.574 5.271 5 20 JKBD COc1cc(Br)c(NC(=O)c2ccc(Nc3ccccc3)c([N+](=O)[O-])c2)cc1OC 517671259 FGLKCOHVEZDILK-UHFFFAOYSA-N 472.295 5.370 5 20 JKBD COc1ccc(COc2cccc(F)c2)cc1NC(=O)[C@@H](C)Oc1ccc(Cl)cc1[N+](=O)[O-] 520954582 PDXHKHACBLROGP-CQSZACIVSA-N 474.872 5.381 5 20 JKBD CNc1ccc(C(=O)Nc2ccc(OC)c(OCc3ccc4ccccc4n3)c2)cc1[N+](=O)[O-] 524126626 CEOZEDQIJJAQMO-UHFFFAOYSA-N 458.474 5.025 5 20 JKBD Cc1cc([N+](=O)[O-])ccc1NC(=O)CCSc1nnc(COc2ccc(Cl)cc2Cl)o1 592996511 UUSPTTOYGUKZDO-UHFFFAOYSA-N 483.333 5.293 5 20 JKBD CCCCN(C)C(=O)C1CCN(C(=O)c2cc([N+](=O)[O-])ccc2Sc2ccc(Cl)cc2)CC1 604180692 MDVFIDBFQKWLCA-UHFFFAOYSA-N 490.025 5.510 5 20 JKBD O=C(Nc1ccccn1)c1cccc(NC(=O)c2cc([N+](=O)[O-])ccc2NCc2ccccc2)c1 608847914 MWXQKLVDFMLMOR-UHFFFAOYSA-N 467.485 5.107 5 20 JKBD CCCOc1cc(NC(=O)c2nnn(-c3ccc(F)c(Cl)c3)c2C)c([N+](=O)[O-])cc1OCCC 609407609 RYQBLKUDSNLCJT-UHFFFAOYSA-N 491.907 5.106 5 20 JKBD Cc1cccc(-c2nnc(S[C@@H](C(=O)Nc3ccc(C)cc3[N+](=O)[O-])c3ccccc3)o2)c1 614785647 GYCIMZOACYTBFQ-OAQYLSRUSA-N 460.515 5.734 5 20 JKBD COc1cc(NC(=O)CCC(=O)c2ccc3ccc4cccc5ccc2c3c45)cc(OC)c1OC 727753403 QJHZYYURPADTOU-UHFFFAOYSA-N 467.521 6.211 5 20 JKBD CC(=O)N(c1cccc(C(F)(F)F)c1)c1nc(COC(=O)c2cc(C)cc([N+](=O)[O-])c2N)cs1 727900071 IBZNOFIVAQQRAN-UHFFFAOYSA-N 494.451 5.002 5 20 JKBD CCc1ccccc1NC(=S)/C(=C(/O)c1cccc([N+](=O)[O-])c1)[n+]1ccc(C(CC)CC)cc1 731122517 KKCLCCJTJYMSMD-UHFFFAOYSA-O 476.622 6.672 5 20 JKBD O=C(Nc1ccc(OC(=O)[C@@H]2CCC[C@H](C(F)(F)F)C2)cc1)c1cc([N+](=O)[O-])ccc1Cl 916035720 GIZJVMPZEFMUKM-OLZOCXBDSA-N 470.831 5.775 5 20 JKBD CC(=O)N(c1ccc(Cl)cc1)c1nc(/C=C2/C(=O)Nc3cc(Cl)c([N+](=O)[O-])cc32)cs1 917560034 FZOAZANVIOFOEJ-GIDUJCDVSA-N 475.313 5.535 5 20 JKBD CC(=O)N(c1ccc(F)cc1)c1nc(/C=C(/Cl)c2nc3cc([N+](=O)[O-])ccc3[nH]2)cs1 917560152 SAHAAUZBOGTSMB-LZYBPNLTSA-N 457.874 5.488 5 20 JKBD Cc1cc(C)c(C(=O)CCCC(=O)O[C@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)c(C)c1 919454682 VMUWXISYZUUYEY-QGZVFWFLSA-N 451.479 5.227 5 20 JKBD CC(C)c1cccc(C(C)C)c1NC(=O)COC(=O)[C@@H](C)Oc1ccc(Cl)cc1[N+](=O)[O-] 920776980 FYFBPUZBHRTKTF-OAHLLOKOSA-N 462.930 5.444 5 20 JKBD O=C(/C=C/c1ccc([N+](=O)[O-])o1)Nc1ccc(C2(NC(=O)[C@H]3C[C@@H]3c3ccc(F)cc3)CCC2)cc1 1786205611 LABNZMHQONSDFZ-VGJPLKPLSA-N 489.503 5.278 5 20 JKBD Cc1cc(C(=O)Nc2ccc(C3(NC(=O)C45CCC(CC4)CC5)CCC3)cc2)ncc1[N+](=O)[O-] 1788767459 PMJHKUIMZUNEKQ-UHFFFAOYSA-N 462.550 5.016 5 20 JKBD COC1(CC(=O)NC2(c3ccc(NC(=O)c4cc(Cl)cc([N+](=O)[O-])c4C)cc3)CCC2)CCC1 1790773726 GESZGJBELZDDSO-UHFFFAOYSA-N 485.968 5.264 5 20 JKBD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CCCCCCCCc1ccccc1)c1ccc([N+](=O)[O-])o1 1804257352 QDMKEBOHUQOIGA-NUNAXRQHSA-N 481.593 5.413 5 20 JKBD Cc1ccc(C(=O)N2CCC([C@H]3CCCCN3C(=O)/C=C/c3ccc([N+](=O)[O-])o3)CC2)c(Cl)c1 1824279692 ZHZZKXFMEJODGJ-MECCDNJOSA-N 485.968 5.096 5 20 JKBD O=C(/C=C/C1CCCCC1)N1CCC([C@H]2CCCCN2C(=O)Cc2cc([N+](=O)[O-])ccc2F)CC1 1824949496 NVPYKACBQUDLSD-QXJBOHEXSA-N 485.600 5.033 5 20 JKBD CC[C@H](C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cccc(F)c2[N+](=O)[O-])CC1)c1ccccc1 1826316432 GGEIKNFUDCLSAI-XUZZJYLKSA-N 481.568 5.161 5 20 JKBD O=C(/C=C/c1ccc([N+](=O)[O-])o1)N1CCC([C@H]2CCCCN2C(=O)c2cccc3ccccc23)CC1 1828008054 XAHVESBENNXANN-CVJKAFSHSA-N 487.556 5.288 5 20 JKBD Cc1c(C(=O)N2CCC([C@@H]3CCCCN3C(=O)[C@@H]3CCC[C@@H]3C)CC2)cc(Cl)cc1[N+](=O)[O-] 1828486399 OGPQRAMDSUKUSY-AQKFKSFVSA-N 476.017 5.226 5 20 JKBD O=C(c1ccc([N+](=O)[O-])o1)N1CCC([C@H]2CCCCN2C(=O)c2ccc3occ(Cl)c3c2)CC1 1829698290 JCHWFNMWLVQZLN-LJQANCHMSA-N 485.924 5.135 5 20 JKBD CCCCn1c(S[C@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)nnc1-c1ccc(OC)cc1 9482336 GIGJAFIDQULQRM-CQSZACIVSA-N 489.985 5.435 5 20 JKBD C[C@H](OC(=O)c1nc(Cl)c(Cl)c(Cl)c1Cl)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl 12682699 HOFCYNXRPUBIAA-YFKPBYRVSA-N 487.510 5.441 5 20 JKBD C[C@H](OC(=O)c1csc(-c2ccc(Cl)cc2)n1)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 16457787 BAAXRHSFBHIRTI-JTQLQIEISA-N 499.854 5.575 5 20 JKBD COc1ccc(N2C(=O)CC[C@H](C(=O)Nc3cccc([N+](=O)[O-])c3C)[C@H]2c2ccccc2OC)cc1 19164867 KFIKAKLUTHHCCR-HFZDXXHNSA-N 489.528 5.043 5 20 JKBD C[C@H](c1nc2ccccc2s1)N1CCN(C(=O)c2ccc(C(C)(C)C)c([N+](=O)[O-])c2)CC1 29928468 UOZAKRHMIGTFOI-MRXNPFEDSA-N 452.580 5.021 5 20 JKBD COc1cc([N+](=O)[O-])ccc1NC(=O)COC(=O)c1c2c(nc3ccccc13)/C(=C\c1ccco1)CC2 104349659 XULCHQKTCZNISK-SSZFMOIBSA-N 499.479 5.027 5 20 JKBD CCOc1c(Cl)cc(CNC(=O)c2ccc(N[C@H](C)c3ccccn3)c([N+](=O)[O-])c2)cc1OC 108832026 UNDJCGOERGNOIP-OAHLLOKOSA-N 484.940 5.154 5 20 JKBD O=C(Nc1cc(-c2nnc3n2CCCCC3)ccc1F)c1cc2ccccc2c2cccnc12 110836184 HKYVFTICXICDTM-UHFFFAOYSA-N 451.505 5.764 5 20 JKBD COc1ccc(CSCC(=O)NC(c2ccc(F)cc2)c2ccc(F)cc2)cc1[N+](=O)[O-] 195631044 SXXTZGPVFQHAEE-UHFFFAOYSA-N 458.486 5.021 5 20 JKBD CN(Cc1cn(Cc2ccccc2Cl)nc1-c1ccccc1)C(=O)NCc1ccccc1[N+](=O)[O-] 410138799 HWAGBXSPFDDGJZ-UHFFFAOYSA-N 489.963 5.502 5 20 JKBD COc1ccc(-c2csc(NC(=O)c3ccc(N4CCCC4)c([N+](=O)[O-])c3)n2)cc1Cl 499217006 FLNWNMOFPIFSGA-UHFFFAOYSA-N 458.927 5.233 5 20 JKBD O=C(COc1ccccc1[N+](=O)[O-])Nc1cccc(NC(=O)Nc2cccc(C(F)(F)F)c2)c1 510300326 TXUQFGBTRYZQLJ-UHFFFAOYSA-N 474.395 5.275 5 20 JKBD COc1cc2c(cc1OC)[C@H](c1cccs1)N(C(=O)c1cc3cc([N+](=O)[O-])ccc3o1)CC2 513831446 RMABPGKHZWTGCK-HSZRJFAPSA-N 464.499 5.208 5 20 JKBD C[C@@H]1CN(C(=O)C/C(=C\c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)C[C@H](c2ccccc2)O1 516754653 SOJKROKOLQGXMO-XLXQETLTSA-N 499.592 6.124 5 20 JKBD CSc1ccc(C(=O)c2ccccc2C(=O)Nc2cccc(-c3cnco3)c2)cc1[N+](=O)[O-] 517444519 DYOMPXSLHFKSNQ-UHFFFAOYSA-N 459.483 5.455 5 20 JKBD CCOc1cc(C(=O)Nc2ccc(Oc3ccccc3)cc2C(F)(F)F)c([N+](=O)[O-])cc1OC 520011088 PIWRLDWVKVLXJP-UHFFFAOYSA-N 476.407 6.066 5 20 JKBD CN1C(=O)CCc2cc(NC(=O)c3ccc(Oc4ccc(Cl)cc4[N+](=O)[O-])cc3)ccc21 520546755 YDOBEYLXDLKVCF-UHFFFAOYSA-N 451.866 5.202 5 20 JKBD O=C(Nc1cc(Cl)ccc1Cl)[C@H]1CCCCN1C(=O)c1ccc(N2CCCC2)c([N+](=O)[O-])c1 522270159 HUAHXFDNVMROCG-HXUWFJFHSA-N 491.375 5.135 5 20 JKBD CN(C(=O)c1c2c(nc3ccccc13)/C(=C/c1ccc([N+](=O)[O-])cc1)CCC2)c1nccs1 603619410 YEJZUVHHXTYJRA-BMRADRMJSA-N 456.527 5.753 5 20 JKBD C[C@H]1C[C@@H]1c1ccc(CNC(=O)Cc2cn(-c3ccccc3)nc2-c2ccc([N+](=O)[O-])cc2)o1 603971444 LCKJUUMOHMMGFQ-SBUREZEXSA-N 456.502 5.023 5 20 JKBD C[C@@H](Nc1ccc(C(=O)NC2(c3ccc4c(c3)OCCO4)CCCC2)cc1[N+](=O)[O-])c1ccccn1 604567589 UHGYTQHWAZPIDK-GOSISDBHSA-N 488.544 5.133 5 20 JKBD CC(C)Oc1ccc(F)cc1NC(=O)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 608946272 WQTCLWWUYUCWSW-UHFFFAOYSA-N 469.435 5.395 5 20 JKBD CN1CCN(C[C@@H](NCc2ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])cc2)c2ccccc2)CC1 609042217 OWDQPYDWZLVXNX-XMMPIXPASA-N 480.996 5.119 5 20 JKBD COc1ccc(-n2c(SCC(=O)Nc3c(C)cccc3[N+](=O)[O-])nnc2-c2cccc(C)c2)cc1 619619011 XFHGATSTQKVENI-UHFFFAOYSA-N 489.557 5.199 5 20 JKBD CC(C)c1ncc(Cl)c(C(=O)O[C@H](C(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)c2ccccc2)n1 744676971 WCIRTHNRIBDEEJ-IBGZPJMESA-N 489.315 5.352 5 20 JKBD O=C(Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1)c1csc(-c2ccc([N+](=O)[O-])cc2)n1 747624172 ZTIJRXNIVSZAJM-UHFFFAOYSA-N 453.461 5.002 5 20 JKBD Cc1cccn2c(NC(=O)c3cc([N+](=O)[O-])ccc3Br)c(-c3ccccc3)nc12 751063989 ODEQHPYPVQJAME-UHFFFAOYSA-N 451.280 5.233 5 20 JKBD CSc1ccc(C(=O)O[C@@H](C)C(=O)N2c3ccccc3Sc3ccccc32)cc1[N+](=O)[O-] 853689528 KSCFCXZYADXTQR-AWEZNQCLSA-N 466.540 5.692 5 20 JKBD C[C@H](OC(=O)CCc1ccc(Cl)cc1Cl)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 912870440 XXQGAHQKPOBNOP-JTQLQIEISA-N 479.238 5.423 5 20 JKBD O=C(Nc1cc(Cl)c([N+](=O)[O-])cc1OCc1ccccc1)c1nc(N2CCCC2)ncc1Cl 916040261 XFUBUNRYUDXBPO-UHFFFAOYSA-N 488.331 5.123 5 20 JKBD Cc1ccc(N2C(=O)CC[C@H](C(=O)N[C@H](C)c3cccc([N+](=O)[O-])c3)[C@H]2c2cccs2)cc1 917699619 DETJJXNQUJENPK-GQOCTPOGSA-N 463.559 5.326 5 20 JKBD C[C@@H](Nc1ccc(C(=O)N2CCC[C@@H]2COc2ccc(Cl)cc2)cc1[N+](=O)[O-])c1ccccn1 919711738 YOJFZDKAWRNOQX-YLJYHZDGSA-N 480.952 5.500 5 20 JKBD O=C(NC1(c2ccc(NC(=O)[C@@H]3CCC[C@@H]4CCCC[C@@H]43)cc2)CCC1)c1ccc([N+](=O)[O-])[nH]1 1789192140 UHVIFQWTBZCBJN-DZFGPLHGSA-N 464.566 5.277 5 20 JKBD CCn1nc(C)cc1C(=O)NC1(c2ccc(NC(=O)c3cc(Cl)cc([N+](=O)[O-])c3C)cc2)CCC1 1790774763 ZMNPPQCCKBIMQM-UHFFFAOYSA-N 495.967 5.143 5 20 JKBD O=C(CSc1ccccc1[N+](=O)[O-])Nc1ccc(C2(NC(=O)c3cccnc3Cl)CCC2)cc1 1791521943 UDNAYJWQQVLHMS-UHFFFAOYSA-N 496.976 5.183 5 20 JKBD C/C(=C\c1cccnc1)C(=O)Nc1ccc(C2(NC(=O)c3c(F)ccc([N+](=O)[O-])c3C)CCC2)cc1 1791852583 FOFLLQHKUGRUFX-BMRADRMJSA-N 488.519 5.289 5 20 JKBD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc2cc([N+](=O)[O-])ccc2s1)c1cc2sccc2s1 1801206960 GGQFIKOYTRSCPG-QDMKHBRRSA-N 497.623 5.651 5 20 JKBD Cc1ccc(CC(=O)N2CCC3(CCCN(C(=O)Cc4ccc5ccccc5c4)C3)CC2)cc1[N+](=O)[O-] 1809125417 AYKKPODHHZNSHK-UHFFFAOYSA-N 499.611 5.073 5 20 JKBD Cc1c(C(=O)N2CCCC[C@H]2c2cc(NC(=O)c3cc(F)cc([N+](=O)[O-])c3)n[nH]2)oc2ccccc12 1821165537 DLNMEBHIUYRRKX-FQEVSTJZSA-N 491.479 5.131 5 20 JKBD O=C(c1cc2sccc2[nH]1)N1CCC([C@@H]2CCCCN2C(=O)CCc2cccc([N+](=O)[O-])c2)CC1 1824841130 AZQNDHGTZYNSGG-QHCPKHFHSA-N 494.617 5.004 5 20 JKBD O=C(/C=C/c1ccccc1[N+](=O)[O-])N1CCC([C@@H]2CCCCN2C(=O)CCC2CCCC2)CC1 1826272108 VUPQKECFMLMBQL-RQOTYCFOSA-N 467.610 5.198 5 20 JKBD O=C(c1ccc([N+](=O)[O-])cc1F)N1CCC([C@H]2CCCCN2C(=O)c2cccc3ccccc23)CC1 1828010043 WEFSMMISIKJTQR-AREMUKBSSA-N 489.547 5.434 5 20 JKBD C[C@@H]1CCC[C@@H]1C(=O)N1CCCC[C@@H]1C1CCN(C(=O)C2(c3cccc([N+](=O)[O-])c3)CCC2)CC1 1828487413 TXIAARFFYHFVLS-DCEDVJGZSA-N 481.637 5.072 5 20 JKBD COc1cc(C(=O)N2CCCC[C@H]2C2CCN(C(=O)CC3CCC(C)(C)CC3)CC2)ccc1[N+](=O)[O-] 1832695772 MAVMMPUACCZIPW-QHCPKHFHSA-N 499.652 5.443 5 20 JKBD O=C(c1c(F)cccc1Cl)N1CCC([C@H]2CCCCN2C(=O)/C=C/c2ccccc2[N+](=O)[O-])CC1 1832905584 YFRGDSBZWQFFHM-VDZCTEQFSA-N 499.970 5.334 5 20 JKBD O=C(Nc1ccc(OC(=O)c2csc(-c3cccs3)n2)cc1)c1cccc([N+](=O)[O-])c1 15515699 GESLPBGWNAVKDO-UHFFFAOYSA-N 451.485 5.251 5 20 JKBD COCc1c(C(=O)O[C@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2ccccc2)oc2ccccc12 21122612 JIAKHXXQHZUHCM-QFIPXVFZSA-N 494.887 5.678 5 20 JKBD Cc1ccccc1NC(=O)Cc1nc(CSc2nc3cc4ccccc4cc3c(=O)n2C)cs1 22254003 TTZGTRDCHDJFEG-UHFFFAOYSA-N 486.622 5.325 5 20 JKBD CC[C@@H](C)Cc1c(C)sc2[nH]c(SCc3nnc(-c4ccc([N+](=O)[O-])cc4)o3)nc(=O)c12 23007041 LPVOHUXSVCLZNZ-LLVKDONJSA-N 471.564 5.132 5 20 JKBD O=C(NCc1nc(-c2ccncc2)cs1)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1 110536965 QPYUVVVJBQZJFH-UHFFFAOYSA-N 466.906 5.489 5 20 JKBD O=C(c1cccc2ccccc12)N1CCC[C@@H](C(=O)N(Cc2ccccc2[N+](=O)[O-])CC(F)(F)F)C1 195611981 DFEVCTJSEJSOGM-HXUWFJFHSA-N 499.489 5.191 5 20 JKBD C[C@@H](N[C@@H](Cc1cccc(F)c1)c1cccc(F)c1)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 303015497 SAXRWUNAZBZJFB-PEBXRYMYSA-N 493.432 5.792 5 20 JKBD O=C(CCCc1cccs1)Nc1cccc(C(=O)Nc2cc3c(cc2[N+](=O)[O-])OCCCO3)c1 478100393 BEQVIXLUQOPPFH-UHFFFAOYSA-N 481.530 5.031 5 20 JKBD O=C(Nc1ccc(Oc2ccc(F)cc2)nc1)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-] 481744998 XCRHMOMJUONFMC-UHFFFAOYSA-N 451.332 5.115 5 20 JKBD CN(Cc1ccccc1[N+](=O)[O-])C(=O)c1ccccc1Sc1ccc(Br)cn1 484364109 QSCPVSXFBHSMJP-UHFFFAOYSA-N 458.337 5.176 5 20 JKBD Cc1nc(SCc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)n([C@H](C)[C@H]2C[C@H]3CC[C@H]2C3)c1C 485044192 HRTHWVDJHMCQIG-NDUPCHFUSA-N 453.568 5.748 5 20 JKBD CCOC(=O)c1sc(-c2cccc([N+](=O)[O-])c2)cc1NC(=O)Cc1csc(-c2ccccn2)n1 500297349 AEXLTJYSSTUAEK-UHFFFAOYSA-N 494.554 5.200 5 20 JKBD Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)c1cnn(-c2ncc(Cl)cc2Cl)c1C(F)(F)F 503070890 DZJSZRXOHZUNCZ-UHFFFAOYSA-N 474.226 5.370 5 20 JKBD Cc1sc(NC(=O)c2cc(OCC(F)(F)F)ccc2[N+](=O)[O-])nc1-c1c(F)cc(F)cc1F 504751720 XKFLPFNUSXVGED-UHFFFAOYSA-N 491.369 5.637 5 20 JKBD Cn1cc(C(=O)Nc2nc(-c3cccc4ccccc34)cs2)c(-c2ccc([N+](=O)[O-])cc2)n1 506244996 HQWPPJOJXNFMRV-UHFFFAOYSA-N 455.499 5.524 5 20 JKBD COc1c(Cl)cccc1NC(=O)Cc1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1 509699116 QDIBSNXETGWPHC-UHFFFAOYSA-N 462.893 5.291 5 20 JKBD Cc1cc(Sc2ccccc2)ccc1NC(=O)c1nn(-c2ccccc2[N+](=O)[O-])c(C)cc1=O 512852263 TXUWUPJOZJADMI-UHFFFAOYSA-N 472.526 5.161 5 20 JKBD C[C@@H](c1ccccc1)n1c(S[C@H](C)C(=O)Nc2ccccc2[N+](=O)[O-])nnc1-c1ccccc1 515488153 VKSSYCHTWOPRLY-ZWKOTPCHSA-N 473.558 5.582 5 20 JKBD Cc1csc(Sc2ccc(C(=O)Nc3ccc(OCc4nccn4C)cc3)cc2[N+](=O)[O-])n1 515581821 UEFNYPZUOBIYSY-UHFFFAOYSA-N 481.559 5.076 5 20 JKBD C[C@@H]1C[C@@H](C)CN(c2ccc(C(=O)N3CCC(C(=O)c4ccc(Cl)cc4)CC3)cc2[N+](=O)[O-])C1 515988697 FXGIREMBIBZGBQ-QZTJIDSGSA-N 483.996 5.466 5 20 JKBD C[C@H](c1cccnc1)N(C)C(=O)C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1 520103172 QIKPCTAWPSPLTN-HDAKKWKLSA-N 458.543 5.750 5 20 JKBD CCN(C(=O)[C@@H](C)Sc1ccc([N+](=O)[O-])cc1)[C@H](c1cccnc1)c1ccc(F)c(F)c1 520502822 WRGAVIUPZFEBQU-QRQCRPRQSA-N 457.502 5.387 5 20 JKBD O=C(C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)Nc1ncn(Cc2ccccc2)n1 521803294 XPXMGMVCNSNLKX-ZHZULCJRSA-N 496.552 5.414 5 20 JKBD CNC(=O)c1cccc(NC(=O)c2ccccc2Sc2ccc(C(F)(F)F)cc2[N+](=O)[O-])c1C 603624396 ITOAOUCVRVZEMZ-UHFFFAOYSA-N 489.475 5.685 5 20 JKBD O=C(c1cc2cc([N+](=O)[O-])ccc2o1)N1CCC[C@@H](c2nc(-c3ccc(Cl)cc3)no2)C1 608817308 AQOBLHVUFPOPPA-CQSZACIVSA-N 452.854 5.064 5 20 JKBD COc1ccc(NC(=O)C/C(=C/c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)c(C)c1 608898722 YXORNQQWMIBSGW-JXAWBTAJSA-N 459.527 6.091 5 20 JKBD CN(C(=O)c1ccc(C(=O)N(C)[C@@H]2CCc3ccccc32)c([N+](=O)[O-])c1)[C@@H]1CCc2ccccc21 609043775 RIBFGLVRKIRKSW-JWQCQUIFSA-N 469.541 5.114 5 20 JKBD CCCCCOc1ccc([C@@H](C)NC(=O)Cn2c3ccccc3c(=O)c3ccccc32)cc1OC 611958748 IMJXYCGKGCVIKO-HXUWFJFHSA-N 472.585 5.610 5 20 JKBD CC[C@H]1c2ccsc2CCN1C(=O)CSc1nc2cc3ccccc3cc2c(=O)n1CC 670314803 NRKWUQPCAWVXBI-NRFANRHFSA-N 463.628 5.259 5 20 JKBD Cc1cc([N+](=O)[O-])ccc1C(=O)O[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1 725986480 AUCKCMDYYVPFMU-FQEVSTJZSA-N 469.837 5.002 5 20 JKBD Cc1ccc(Br)cc1NC(=O)CNCc1ccc(-c2ccc([N+](=O)[O-])cc2)s1 726605771 IQQMRUUJVBWRIE-UHFFFAOYSA-N 460.353 5.123 5 20 JKBD C[C@@H](NCc1ccc(-c2ccc([N+](=O)[O-])cc2Br)o1)c1ccc(N2CCOC2=O)cc1 726606206 DGCWCMJWRMGAGA-CQSZACIVSA-N 486.322 5.425 5 20 JKBD COc1cc(C(=O)N[C@H](C)c2ccc3c(c2)CC(=O)N3C)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 728252850 KUIMZNDYONQBRN-CQSZACIVSA-N 495.919 5.059 5 20 JKBD CCN(C)C(=O)c1cccc(C(=O)Nc2cc(Cl)c([N+](=O)[O-])cc2OCc2ccccc2)c1 729169747 BBSYHMMEZLPOQW-UHFFFAOYSA-N 467.909 5.171 5 20 JKBD Cc1ccc(-c2nnc([C@@H](C)OC(=O)c3ccc(N4CCC(C)CC4)c([N+](=O)[O-])c3)o2)cc1 745929877 JSKSBVVVYXJGBV-QGZVFWFLSA-N 450.495 5.108 5 20 JKBD C[C@H]1CN(c2ccc(NC(=O)c3ccc(NCc4ccccc4)c([N+](=O)[O-])c3)cc2)C[C@@H](C)O1 747435437 YDPKVJMVZNIFBS-KDURUIRLSA-N 460.534 5.073 5 20 JKBD O=C(COC(=O)c1csc(-c2cccc([N+](=O)[O-])c2)n1)N[C@@H](c1ccc(F)cc1)C1CCCC1 747955446 IFONHZRRFRUVQL-JOCHJYFZSA-N 483.521 5.062 5 20 JKBD O=C(COC(=O)/C(=C/c1ccc(F)cc1)c1cccs1)Nc1cc(Cl)ccc1[N+](=O)[O-] 772042602 LIMBSHUWRAZYBJ-MHWRWJLKSA-N 460.870 5.171 5 20 JKBD O=C(Cc1noc(-c2ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])cc2)n1)NC1CCCCC1 904246105 MTCSMDMJBWQFKX-UHFFFAOYSA-N 456.886 5.082 5 20 JKBD O=C(c1ccc([N+](=O)[O-])s1)N1CCC[C@H]1c1nc(-c2cccc(Oc3ccccc3)c2)no1 904586785 FNQOFIDUAFOHME-SFHVURJKSA-N 462.487 5.476 5 20 JKBD Cn1cc(-c2nc(-c3cccc(NC(=O)OC(C)(C)C)c3)no2)c(-c2ccc([N+](=O)[O-])cc2)n1 904634032 JILUOTACIUYHGF-UHFFFAOYSA-N 462.466 5.059 5 20 JKBD O=C(C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)OCc1nnc(C2CC2)o1 920408031 VHZCDQXDRLCNFT-WJDWOHSUSA-N 462.487 5.139 5 20 JKBD C[C@@H]1CC[C@H](C(=O)Nc2ccc(C3(NC(=O)c4cc5cc([N+](=O)[O-])ccc5s4)CCC3)cc2)O1 1789158799 UBVNKPKSFWSSHC-FOIQADDNSA-N 479.558 5.125 5 20 JKBD CN(C)c1ccc([N+](=O)[O-])c(C(=O)Nc2ccc(C3(NC(=O)C(C)(C)C(C)(F)F)CCC3)cc2)c1 1790055065 VIZQNQXJHKNGBS-UHFFFAOYSA-N 488.535 5.090 5 20 JKBD Cc1ccc(CC(=O)Nc2ccc(C3(NC(=O)c4ccnc(C(F)F)c4)CCC3)cc2)cc1[N+](=O)[O-] 1790524631 LOOGWPXWKZGZRP-UHFFFAOYSA-N 494.498 5.226 5 20 JKBD O=C(Cc1cc(F)ccc1[N+](=O)[O-])Nc1ccc(C2(NC(=O)c3cccc4ccncc34)CCC2)cc1 1792309795 MBWWIPMENISOGL-UHFFFAOYSA-N 498.514 5.273 5 20 JKBD O=C(Cc1cccc([N+](=O)[O-])c1)Nc1cc([C@@H]2CCCCN2C(=O)[C@@H]2CCC[C@@H]3CCCC[C@@H]32)[nH]n1 1814375052 IOGHMYUSPISFBN-KZDDHRSZSA-N 493.608 5.159 5 20 JKBD Cc1cc(CCCC(=O)N2CCCC[C@@H]2C2CCN(C(=O)[C@@H]3C[C@@H]3C3CC3)CC2)c([N+](=O)[O-])cc1F 1824370368 VVVWFSUECPKPIA-VDKIKQQVSA-N 499.627 5.031 5 20 JKBD CC(C)C1(C(=O)N2CCCC[C@H]2C2CCN(C(=O)/C=C/c3ccccc3[N+](=O)[O-])CC2)CCC1 1832495008 YATWXBFBWCNGPK-RGPPVUSESA-N 467.610 5.054 5 20 JKBD CC(C)Cn1c(SCC(=O)Nc2ccc([N+](=O)[O-])cc2C(F)(F)F)nnc1-c1ccccc1F 8651379 ORACKFFMTJDIGK-UHFFFAOYSA-N 497.474 5.398 5 20 JKBD Cc1ccc(-n2c(SCC(=O)N(C)c3ccc([N+](=O)[O-])cc3)nnc2-c2ccccc2F)cc1 9804245 VUIUEORMWBHIGH-UHFFFAOYSA-N 477.521 5.045 5 20 JKBD COCCN(C(=O)c1cc2ccccc2cc1OC)c1nc(-c2ccc([N+](=O)[O-])cc2)cs1 14790585 AYSZOLDZXXXGSN-UHFFFAOYSA-N 463.515 5.173 5 20 JKBD CN(C)[C@H](CNC(=O)C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)c1ccsc1 25816044 HQMKIXVDGIDQQX-DUBROFONSA-N 492.626 5.616 5 20 JKBD COc1cc(CC(=O)O[C@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2ccccc2)ccc1C 26246872 YRUBWAPHZVKANL-QHCPKHFHSA-N 468.893 5.031 5 20 JKBD CCn1c(S[C@H](C)C(=O)N2CCC[C@@H]2c2cccs2)nc2cc3ccccc3cc2c1=O 26581197 MWBXMNIXHILNMZ-IIBYNOLFSA-N 463.628 5.475 5 20 JKBD O=C(Cc1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1)N[C@@H](c1ccccc1)c1ccccn1 29715278 OUKIQQFRLKTNJG-LJAQVGFWSA-N 489.535 5.291 5 20 JKBD CCn1ncc2ccc(NC(=O)N3CCN(Cc4ccc(-c5ccccc5[N+](=O)[O-])s4)CC3)cc21 477440539 DFVXVYRTIWDOKA-UHFFFAOYSA-N 490.589 5.043 5 20 JKBD Cc1nc2ccccc2c(-c2ccccc2)c1CC(=O)Nc1n[nH]c(-c2cccc([N+](=O)[O-])c2)n1 490396729 HSFNQXBVOCEDGH-UHFFFAOYSA-N 464.485 5.085 5 20 JKBD CC[C@@H](C)Sc1ccc(NC(=O)c2cc(OC)c(OCc3cscn3)cc2[N+](=O)[O-])c(C)c1 498454790 SKRGPUCLXYRPDN-OAHLLOKOSA-N 487.603 6.090 5 20 JKBD Cc1c(NC(=O)c2ccccc2)cccc1NC(=O)c1csc(-c2ccc([N+](=O)[O-])cc2)n1 498714493 ACKWOMIFYVKCJO-UHFFFAOYSA-N 458.499 5.531 5 20 JKBD Cc1nnc(NC(=O)c2c3c(nc4ccccc24)/C(=C\c2cccc([N+](=O)[O-])c2)CCC3)s1 509141885 UPBAHXWMKSMHGC-VBKFSLOCSA-N 457.515 5.432 5 20 JKBD COc1cc(C(=O)N2CCC[C@H]2c2nc3ccccc3s2)c([N+](=O)[O-])cc1OCc1cscn1 512600110 PFUGWIJYWOIPFQ-KRWDZBQOSA-N 496.570 5.226 5 20 JKBD C[C@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)C(c1nc2ccccc2s1)c1nc2ccccc2s1 513648551 RKMLYVUJPCSGTE-AWEZNQCLSA-N 491.619 6.696 5 20 JKBD O=C(C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1)N(Cc1cscn1)c1ccccc1 521276273 UGIIINZUKQDMRF-UHFFFAOYSA-N 490.507 5.520 5 20 JKBD NC(=O)CC[C@@H]1CCCN(C(=O)c2c3c(nc4ccccc24)/C(=C/c2cccc([N+](=O)[O-])c2)CCC3)C1 524039820 UNRCSJSNPKIGJW-XSLGSPGOSA-N 498.583 5.138 5 20 JKBD O=C(Nc1ccc(NC(=O)C2CC2)cc1C(F)(F)F)c1ccc(NCc2ccccc2)c([N+](=O)[O-])c1 590874151 XJBFXADXOKCADK-UHFFFAOYSA-N 498.461 5.827 5 20 JKBD Cc1c(NC(=O)c2cnn(-c3cccc(C(F)(F)F)c3)c2C(F)(F)F)cccc1[N+](=O)[O-] 603440968 MAQZSHXWOKDEGF-UHFFFAOYSA-N 458.318 5.379 5 20 JKBD O=C(c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-])N(Cc1nnc(-c2ccc(Cl)cc2)o1)C1CC1 603730675 YGIMXEWXVPADDG-UHFFFAOYSA-N 496.829 5.044 5 20 JKBD C[C@H](CNC(=O)c1ccccc1Sc1ccc(C(F)(F)F)cc1[N+](=O)[O-])CN1CCCC1 603971234 RTNUTMTVKNQGON-OAHLLOKOSA-N 467.513 5.227 5 20 JKBD O=C(Nc1nc2c(s1)COCC2)c1c2c(nc3ccccc13)/C(=C\c1ccc([N+](=O)[O-])cc1)CCC2 609022675 XQDJWAXGQNEMQZ-VKAVYKQESA-N 498.564 5.801 5 20 JKBD C[C@H](c1nc2ccccc2s1)N1CCN(C(=O)c2cc3ccccc3c3cccnc23)CC1 643126367 XXZAUJFGNOJRFW-GOSISDBHSA-N 452.583 5.517 5 20 JKBD CC(C)(C)OC(=O)Nc1ccc(F)c(NC(=O)c2ccc(NCc3ccccc3)c([N+](=O)[O-])c2)c1 727389570 LKRHUIMTKPEBPA-UHFFFAOYSA-N 480.496 5.945 5 20 JKBD Cc1ccc(Sc2ccc(C(=O)N3CCC(N(C)C(=O)OC(C)(C)C)CC3)cc2[N+](=O)[O-])cc1 730561555 KJCZDRSUKJHCGD-UHFFFAOYSA-N 485.606 5.526 5 20 JKBD O=C(OC[C@@H]1CCCN1C(=O)c1ccccc1[N+](=O)[O-])/C(=C/c1ccc(F)cc1)c1cccs1 730704149 NTCXHQAUMZHPHR-QTKYHAHDSA-N 480.517 5.184 5 20 JKBD O=C(OCC1CCN(c2ccc([N+](=O)[O-])cn2)CC1)[C@H]1CC=CC[C@@H]1c1nc2ccccc2s1 750428618 UBAINPPUFYJYOZ-PMACEKPBSA-N 478.574 5.109 5 20 JKBD Cc1ncc([N+](=O)[O-])cc1C(=O)Nc1cc([N+](=O)[O-])ccc1Nc1cccc(C(F)(F)F)c1 750718060 ZPJOBXNGIVGRMT-UHFFFAOYSA-N 461.356 5.221 5 20 JKBD C[C@@H](Nc1ccc(-c2nc(-c3ccc(C(F)(F)F)s3)no2)cc1[N+](=O)[O-])c1ccccn1 904970855 MAHMYMBHZCEAKC-LLVKDONJSA-N 461.425 5.960 5 20 JKBD COc1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2Cl)cc1NC(=O)c1ccc(Cl)cc1F 917787901 SHMHJMFPXAQAQZ-UHFFFAOYSA-N 478.263 5.554 5 20 JKBD C[C@@H](Nc1ccc(C(=O)OCc2ncc(-c3ccc(Cl)cc3)o2)cc1[N+](=O)[O-])c1ccccn1 920545178 GMDSZXVCUXWADC-OAHLLOKOSA-N 478.892 5.828 5 20 JKBD COc1ccc([C@@H](Cc2ccc(F)cc2)N[C@@H](C)C(=O)Nc2cc([N+](=O)[O-])ccc2Cl)cc1 921065403 ACYKWAYAKYVXPQ-OYHNWAKOSA-N 471.916 5.297 5 20 JKBD Cc1cc(C(=O)N2CC[C@@H](CNC(=O)CCCCCC(C)(C)C)[C@@H]2c2cccnc2)ncc1[N+](=O)[O-] 1812807179 MWDSCWLLLGUMTF-OFVILXPXSA-N 495.624 5.009 5 20 JKBD O=C(NC1CCN(C2CC2)CC1)c1c2c(nc3ccccc13)/C(=C/c1cccc([N+](=O)[O-])c1)CCC2 9962174 KYTSIXAXYXBCTK-LVZFUZTISA-N 482.584 5.377 5 20 JKBD CC(=O)N(c1nc(COC(=O)c2ccc(Cl)cc2[N+](=O)[O-])cs1)c1ccc(C)cc1C 10748639 HTTVFEWCKRGGIF-UHFFFAOYSA-N 459.911 5.363 5 20 JKBD CC(C)(C)c1ccc(SCC(=O)OCC(=O)Nc2ccc([N+](=O)[O-])cc2C(F)(F)F)cc1 12960594 QCKQSAVFQBAKFB-UHFFFAOYSA-N 470.469 5.185 5 20 JKBD Cc1cccc(-c2nnc(S[C@H](C(=O)Nc3ccc(C)cc3[N+](=O)[O-])c3ccccc3)n2C)c1 22010642 YRPOUNMLVJNEAQ-QFIPXVFZSA-N 473.558 5.479 5 20 JKBD Cc1c(C(=O)COC(=O)c2ccccc2NC(=O)c2ccc([N+](=O)[O-])cc2Cl)oc2ccccc12 23951225 OYFDFCMXARYMAM-UHFFFAOYSA-N 492.871 5.595 5 20 JKBD C[C@H](Sc1nnc(COc2ccccc2F)n1-c1ccccc1)C(=O)Nc1ccc([N+](=O)[O-])cc1 28174110 OLHXPEXDGXMCDR-INIZCTEOSA-N 493.520 5.013 5 20 JKBD COc1cc(C(=O)N(Cc2cccnc2)Cc2ccco2)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 71835468 NNUPPXKAHKEVJO-UHFFFAOYSA-N 493.903 5.880 5 20 JKBD COc1cc(C(=O)N[C@H](C)c2nc(-c3ccccc3)cs2)c([N+](=O)[O-])cc1OCc1cscn1 410303212 MCGBCGMSGDPVJU-CQSZACIVSA-N 496.570 5.253 5 20 JKBD CC1(C)C[C@H]2C[C@@](C)(CN2C(=O)C2CCN(c3ccc(C(F)(F)F)cc3[N+](=O)[O-])CC2)C1 483460972 BNMNNYGANSVDQF-HTAPYJJXSA-N 453.505 5.257 5 20 JKBD Cc1ccc(NC(=O)Nc2ccccc2)cc1NC(=O)c1csc(-c2cccc([N+](=O)[O-])c2)n1 496394720 MXISZCNBKKEOEP-UHFFFAOYSA-N 473.514 5.923 5 20 JKBD CSc1ccc([N+](=O)[O-])c(C(=O)N(CC(=O)Nc2ccc(Cl)cc2C(F)(F)F)C(C)C)c1 504760496 SLBQCGYOQJEWAU-UHFFFAOYSA-N 489.903 5.478 5 20 JKBD C[C@@H](Nc1ccc(C(=O)Nc2ccc(C(=O)Nc3cccnc3)cc2)cc1[N+](=O)[O-])c1ccccn1 506194367 RLRXPJIYSULICI-QGZVFWFLSA-N 482.500 5.063 5 20 JKBD CCOc1ccc(Oc2cc(CNC(=O)Nc3cc([N+](=O)[O-])ccc3OC(F)F)ccn2)cc1 511541468 SUMWYQUPQGEITL-UHFFFAOYSA-N 474.420 5.104 5 20 JKBD CC(C)n1c(SCC(=O)N2CCc3ccc([N+](=O)[O-])cc32)nnc1-c1ccc(Cl)cc1Cl 514524986 NOIFZXYRAUWHHB-UHFFFAOYSA-N 492.388 5.422 5 20 JKBD COc1ccc(CNC(=O)c2ccccc2Sc2ncnc3sc(C)c(C)c23)cc1[N+](=O)[O-] 515731726 PJYSFTIIIVMUIX-UHFFFAOYSA-N 480.571 5.306 5 20 JKBD COCCN(C(=O)C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)C1CCCC1 603529043 DTLDGAIXPQAQAT-KNTRCKAVSA-N 465.575 5.553 5 20 JKBD CCCC(=O)NC1CCN(C(=O)C/C(=C/c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)CC1 603744090 LSPLWLUVLITQPS-MNDPQUGUSA-N 492.601 5.043 5 20 JKBD O=[N+]([O-])c1ccc(-c2noc(CN[C@H](c3ccccc3)c3ccc(Br)cc3F)n2)cc1 604009779 YMCSXCKBEOFCLT-OAQYLSRUSA-N 483.297 5.426 5 20 JKBD CCOc1cccc(CN[C@@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Br)c2ccccc2)c1 604045530 PXQIDTKTJVAPLA-JOCHJYFZSA-N 484.350 5.226 5 20 JKBD Cc1ccc(S(=O)(=O)Nc2ccc(NC(=O)Nc3ccccc3C(F)(F)F)cc2)cc1[N+](=O)[O-] 604532639 HZPWDYQOEROHRH-UHFFFAOYSA-N 494.451 5.367 5 20 JKBD C[C@H]1C[C@H](C)CN(c2ccc(C(=O)Nc3c(-c4ccccc4)ncn3C3CC3)cc2[N+](=O)[O-])C1 604544160 QMJFYSGIKRNQRB-ROUUACIJSA-N 459.550 5.528 5 20 JKBD O=[N+]([O-])c1ccc(-c2ccc(CNCc3ccc(OCC4CC4)nc3)o2)c(Br)c1 608836809 HRFHVKJMGIAANO-UHFFFAOYSA-N 458.312 5.091 5 20 JKBD CCCS(=O)(=O)c1ccccc1S[C@H](C)C(=O)Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1 609323955 NNGZVETXUZGGRG-CQSZACIVSA-N 491.616 5.021 5 20 JKBD O=C(C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)N1CCCc2sccc2C1 609332267 OEXUGLABMNOTIJ-XMHGGMMESA-N 475.595 6.172 5 20 JKBD O=C(O[C@H](C(=O)Nc1ccc(F)cc1)c1ccccc1)c1cc([N+](=O)[O-])ccc1Br 725984209 FWMIUWARCGVBAC-IBGZPJMESA-N 473.254 5.033 5 20 JKBD C[C@H](OC(=O)c1cc([N+](=O)[O-])ccc1Br)C(=O)Nc1ccc(Cl)cc1C(F)(F)F 725984992 GMBQMBCGCPOOSB-QMMMGPOBSA-N 495.635 5.214 5 20 JKBD CCc1cccc[n+]1/C(C(=S)Nc1ccc(OC(C)C)cc1)=C(/O)c1cccc([N+](=O)[O-])c1 726573686 BBTIZNXRGHXOLG-UHFFFAOYSA-O 464.567 5.555 5 20 JKBD COCCSc1ccc([C@@H](C)Nc2cc([N+](=O)[O-])c(OC)c(Br)c2[N+](=O)[O-])cc1 728909510 ONVLJFLJZUKPSG-LLVKDONJSA-N 486.344 5.186 5 20 JKBD Cc1ccc(S(=O)(=O)Nc2ccc(NC(=O)c3sccc3SC(F)F)cc2)cc1[N+](=O)[O-] 730517643 YPZCVOYTNJCTOF-UHFFFAOYSA-N 499.542 5.333 5 20 JKBD CC(C)N(Cc1ccc(-c2cccc(F)c2)s1)Cn1nc(-c2cccc([N+](=O)[O-])c2)ccc1=O 747073548 DEZKXAKOQFPLCO-UHFFFAOYSA-N 478.549 5.554 5 20 JKBD CC(C)Oc1ccc(-c2nc(C(=O)O[C@@H](C)C(=O)Nc3cc([N+](=O)[O-])ccc3Cl)cs2)cc1 749318834 WFHAUTKUFWMJKW-ZDUSSCGKSA-N 489.937 5.343 5 20 JKBD CC(C)(C)OC(=O)N1CCC[C@@H]1[C@H]1CCCCN1C(=O)c1csc(-c2ccc([N+](=O)[O-])cc2)n1 751409127 GVPMYSHAXZHLOZ-WOJBJXKFSA-N 486.594 5.113 5 20 JKBD C[C@H](OC(=O)Cc1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1)C(=O)c1ccc(F)cc1F 760450250 KOFQYQKNTJSCTC-INIZCTEOSA-N 491.450 5.083 5 20 JKBD COCCN(C(=O)c1ccc(C)c(-n2cccc2)c1)c1nc(-c2ccc([N+](=O)[O-])cc2)cs1 821921043 OVXGETZTTWQBCQ-UHFFFAOYSA-N 462.531 5.111 5 20 JKBD CC(C)Cn1cc([C@H]2N(C(=O)c3cc4ccccc4c4cccnc34)CC23CCOCC3)cn1 849532766 VHAYTTFLMHEALN-AREMUKBSSA-N 454.574 5.234 5 20 JKBD CN(Cc1ccccc1[N+](=O)[O-])Cn1nc(-c2ccccc2Cl)n(C2CCCC2)c1=S 914783470 DHHHSENZFFAPPR-UHFFFAOYSA-N 457.987 5.847 5 20 JKBD Cc1cc(C)c2cc(C(=O)Oc3ccc(NC(=O)c4cc([N+](=O)[O-])ccc4Cl)cc3)sc2n1 916833938 BCECVXXOTHVRIC-UHFFFAOYSA-N 481.917 5.946 5 20 JKBD COc1cc(C(=O)Nc2ccc(N(C)Cc3ccccc3)cc2)c([N+](=O)[O-])cc1OC(F)F 917818566 NWVUCBAALZMZBQ-UHFFFAOYSA-N 457.433 5.094 5 20 JKBD C[C@@H](SCc1nc(O)c2c(-c3ccccc3)csc2n1)C(=O)OCCc1ccc([N+](=O)[O-])cc1 918899184 DHHKIRCORBJKPU-OAHLLOKOSA-N 495.582 5.380 5 20 JKBD C[C@H](OC(=O)C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)c1nc(C2CC2)no1 919013581 ZVSDPHDDOJSDED-VMOJBDSFSA-N 476.514 5.700 5 20 JKBD Cc1cc(NC(=O)c2ccc(F)cc2Cl)sc1C(=O)OCCOc1ccccc1[N+](=O)[O-] 919155918 CEWXIFUPOCQOKQ-UHFFFAOYSA-N 478.885 5.245 5 20 JKBD Cc1cc(C)c(NC(=O)COC(=O)c2cc([N+](=O)[O-])ccc2Oc2ccccc2)c(Cl)c1 919191862 GQIABCKFBDZRCI-UHFFFAOYSA-N 454.866 5.453 5 20 JKBD C[C@H](OC(=O)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-])C(=O)Nc1ccc(Cl)cc1Cl 919195392 GCNQIXCRYWONNI-VIFPVBQESA-N 481.210 5.027 5 20 JKBD O=C(OCc1nnc(-c2ccc([N+](=O)[O-])cc2)o1)c1cccc(OCc2cccc(Cl)c2)c1 919803354 LEZJZJQHBXMWTG-UHFFFAOYSA-N 465.849 5.234 5 20 JKBD Cc1ncc(COC(=O)C/C(=C\c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)s1 920347969 KNWOINPTUXAUDB-MHWRWJLKSA-N 451.529 5.644 5 20 JKBD COc1ccc(Cl)c(C(=O)NC2(c3ccc(NC(=O)c4cc(C)c([N+](=O)[O-])cn4)cc3)CCC2)c1 1788767280 JAKLKZWDYSBURB-UHFFFAOYSA-N 494.935 5.022 5 20 JKBD Cc1nscc1C(=O)NC1(c2ccc(NC(=O)C3(c4cccc([N+](=O)[O-])c4)CCC3)cc2)CCC1 1790475964 NQOGNKXAYTXGCH-UHFFFAOYSA-N 490.585 5.229 5 20 JKBD O=C(CSc1ccccc1[N+](=O)[O-])Nc1ccc(C2(NC(=O)CCc3ccoc3)CCC2)cc1 1791523402 QMCHEBDJMMHPMW-UHFFFAOYSA-N 479.558 5.047 5 20 JKBD CC(C)(C)CCCCCC(=O)N1CC[C@@H](CNC(=O)c2ccc(O)c([N+](=O)[O-])c2)[C@H]1c1cccnc1 1810718872 ZNEYNSXFAROJLT-SQJMNOBHSA-N 496.608 5.012 5 20 JKBD Cc1ccc(-c2ccccc2C(=O)N2CCCC[C@@H]2c2cc(NC(=O)c3ccc([N+](=O)[O-])o3)n[nH]2)cc1 1814312054 VNRUWBBUMOWZLM-JOCHJYFZSA-N 499.527 5.506 5 20 JKBD Cc1cc(Cl)ccc1C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2ccc([N+](=O)[O-])cc2F)[nH]n1 1814593565 SEUUJZJDZGHERC-HXUWFJFHSA-N 485.903 5.039 5 20 JKBD Cc1c(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)C(C)(C)C(C)(F)F)[nH]n2)cc(Cl)cc1[N+](=O)[O-] 1821289739 JKCQAERWFWYRLR-INIZCTEOSA-N 497.930 5.267 5 20 JKBD Cc1c(C(=O)N2CCC([C@H]3CCCCN3C(=O)c3cc(F)cc([N+](=O)[O-])c3)CC2)oc2ccccc12 1830617352 MYJPSKVRZRALJG-HSZRJFAPSA-N 493.535 5.336 5 20 JKBD O=C(c1ccc([N+](=O)[O-])[nH]1)N1CCC([C@H]2CCCCN2C(=O)c2ccc(-c3ccccc3)cc2)CC1 1832699565 GJTFLCZFVYQTSQ-RUZDIDTESA-N 486.572 5.137 5 20 JKBD O=C(Cn1c2ccccc2c(=O)c2ccccc21)O[C@@H](C(=O)Nc1ccccc1)c1ccccc1 10723443 YXXVVCLZYBISIN-MUUNZHRXSA-N 462.505 5.078 5 20 JKBD C[C@@H](Sc1nnc(-c2ccncc2)n1-c1ccc(Cl)cc1)C(=O)Nc1cccc([N+](=O)[O-])c1 11410368 LELBEQKAOLKHCX-CQSZACIVSA-N 480.937 5.010 5 20 JKBD Cn1ccnc1[C@@H](NC(=O)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1)c1ccc(F)cc1 14406763 IXJNMHXPNVOFKJ-QFIPXVFZSA-N 480.883 5.433 5 20 JKBD C[C@@H](OC(=O)c1cc(-c2ccccc2)nc2ccccc12)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 17483246 OPWHWCKZCQTVIL-MRXNPFEDSA-N 466.453 5.778 5 20 JKBD CCOc1ccccc1NC(=O)[C@@H](Sc1nc2cc3ccccc3cc2c(=O)n1C)c1ccccc1 24969770 OUHIUBCFEMLRIT-SANMLTNESA-N 495.604 5.958 5 20 JKBD Cc1c(NC(=O)[C@@H](C)Sc2ncc(-c3ccccc3)n2C[C@@H]2CCCO2)cccc1[N+](=O)[O-] 28752004 MMTIRXRNOJFRJR-MJGOQNOKSA-N 466.563 5.065 5 20 JKBD Cc1ccc(Cc2cnc(NC(=O)Cn3c4ccccc4c(=O)c4ccccc43)s2)cc1F 105991294 GAMYGARLLVXDMZ-UHFFFAOYSA-N 457.530 5.288 5 20 JKBD C[C@@H](Nc1ccc(C(=O)Nc2nc(-c3cccc(F)c3)cs2)cc1[N+](=O)[O-])c1ccccn1 108829981 DRHALRSHXBGRQE-CQSZACIVSA-N 463.494 5.678 5 20 JKBD O=C(Nc1nc(-c2ccc(I)cc2)cs1)c1ccc(Cl)cc1[N+](=O)[O-] 216185476 RCPHHJBOWFZBBN-UHFFFAOYSA-N 485.690 5.229 5 20 JKBD O=C(Cn1c2ccccc2c(=O)c2ccccc21)Nc1ccc(Sc2nncs2)c(Cl)c1 303236798 ZWPZVOIHHDHCKX-UHFFFAOYSA-N 478.986 5.450 5 20 JKBD Cn1cc(C(=O)Nc2ncc(Cc3cccc(C(F)(F)F)c3)s2)c(-c2ccc([N+](=O)[O-])cc2)n1 410086507 FACYLGCPWGAFIX-UHFFFAOYSA-N 487.463 5.314 5 20 JKBD CC1CCN(c2ccc(C(=O)Nc3ccc(OC(F)F)cc3OC(F)F)cc2[N+](=O)[O-])CC1 478939692 ZKUFJBFFYXCLBJ-UHFFFAOYSA-N 471.407 5.286 5 20 JKBD CCc1cc(O)nc(-c2cccc(NC(=O)c3ccc(N4C[C@@H](C)C[C@@H](C)C4)c([N+](=O)[O-])c3)c2)n1 485759678 DIXHBFPSHVCVES-CALCHBBNSA-N 475.549 5.054 5 20 JKBD COCCN(C(=O)[C@@H]1C[C@@H]1c1cccc(Cl)c1)c1nc(-c2ccc([N+](=O)[O-])cc2)cs1 494100610 PDKYZUAKTXJYDA-RTBURBONSA-N 457.939 5.155 5 20 JKBD CC[C@H](C)Sc1ccc(NC(=O)c2cc(C(=O)OC)cc([N+](=O)[O-])c2)c(C(F)(F)F)c1 499535447 WCEDNBPGIKLXEV-NSHDSACASA-N 456.442 5.543 5 20 JKBD O=C(CSc1ccc(C(F)(F)F)cc1[N+](=O)[O-])Nc1cccc(NC(=O)c2ccoc2)c1 499644896 AASFUAXEHNMFLF-UHFFFAOYSA-N 465.409 5.190 5 20 JKBD C[C@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)N(C)[C@H]1CCSc2ccc(Br)cc21 504567167 ZILOENQWSBAVBM-SJCJKPOMSA-N 467.410 5.533 5 20 JKBD CCN(C(=O)c1cc([N+](=O)[O-])ccc1OC)[C@@H]1CCSc2ccc(Br)cc21 504609088 YIGDXAGOZIFFCK-MRXNPFEDSA-N 451.342 5.065 5 20 JKBD Cc1ccc(CN(Cc2ccco2)C(=O)c2ccc([N+](=O)[O-])cc2I)s1 508580499 SFHIYGAWTYYZPL-UHFFFAOYSA-N 482.299 5.005 5 20 JKBD COc1cc(C(=O)N(Cc2ccco2)C[C@@H]2CCCO2)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 511603334 AKEUKCACWPXRKG-IBGZPJMESA-N 486.908 5.464 5 20 JKBD O=C(Nc1ccccc1OCCc1ccccc1)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-] 514424947 UDEFPGIVWQGFRP-UHFFFAOYSA-N 460.408 5.410 5 20 JKBD Cc1ccc(Sc2ccc(CN[C@@H](CN3CCN(C)CC3)c3ccccc3)cc2[N+](=O)[O-])cc1 518783766 WNCURVREFXEKFM-VWLOTQADSA-N 476.646 5.133 5 20 JKBD C[C@H](NCc1ccc(-c2ccc([N+](=O)[O-])cc2Br)o1)c1ccc(NC(=O)C2CC2)cc1 521816118 KOKCZGQHSZLSQN-AWEZNQCLSA-N 484.350 5.817 5 20 JKBD COc1ccc(C[C@@H](NC(=O)[C@@H](C)Sc2ccc([N+](=O)[O-])cc2)c2ccccc2)cc1OC 524059317 OXQMLNXEETVRIE-VGOFRKELSA-N 466.559 5.193 5 20 JKBD COc1ccc(CN(C)C)cc1NC(=O)c1ccc(Sc2ccc(C)cc2)c([N+](=O)[O-])c1 603589834 HRSUUNVELWWWCK-UHFFFAOYSA-N 451.548 5.377 5 20 JKBD CCCC(=O)NC1CCN(C(=O)C/C(=C\c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)CC1 603744089 LSPLWLUVLITQPS-KNTRCKAVSA-N 492.601 5.043 5 20 JKBD CCS(=O)(=O)c1ccc2oc(/C=C\c3ccc(-c4ccc([N+](=O)[O-])cc4Cl)o3)nc2c1 603784802 QVMNEKQKEQLDND-YHYXMXQVSA-N 458.879 5.613 5 20 JKBD CCOc1cc(C(=O)Nc2ccc(OCc3ccccc3Cl)cc2)c([N+](=O)[O-])cc1OC 604185367 DJBCGDBYZUHODQ-UHFFFAOYSA-N 456.882 5.487 5 20 JKBD COc1cc(C(=O)N2CCO[C@@H](c3ccccc3F)C2)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 608963599 UNAXQLWTICLSRU-HSZRJFAPSA-N 486.883 5.402 5 20 JKBD C[C@H](NCc1ccc(Oc2ccc(F)cc2)c([N+](=O)[O-])c1)c1nc2ccccc2n1C(F)F 609006831 ZTKIENMXAVZWAO-AWEZNQCLSA-N 456.424 6.122 5 20 JKBD CC(C)[C@@H](C)N1Cc2cccc(N[C@H](C)C(=O)Nc3ccc([N+](=O)[O-])cc3C(F)(F)F)c2C1 609041240 GTYXNXLUMLFLIJ-HUUCEWRRSA-N 464.488 5.413 5 20 JKBD O=C(Cn1c2ccccc2c(=O)c2ccccc21)Nc1ccnn1Cc1cccc2ccccc12 611873753 QYWPTGYFLIRRIE-UHFFFAOYSA-N 458.521 5.191 5 20 JKBD CCc1cc[n+](/C(C(=S)Nc2ccc3c(c2)OCCCO3)=C(/O)c2ccc(C)c([N+](=O)[O-])c2)cc1 727417530 HBLQMMREBGAGAX-UHFFFAOYSA-O 492.577 5.238 5 20 JKBD CN(C)C(=O)Sc1cccc(NC(=O)C2CCN(c3ccc(C(F)(F)F)cc3[N+](=O)[O-])CC2)c1 729242556 JXZFVFZYGLQTHR-UHFFFAOYSA-N 496.511 5.242 5 20 JKBD CCCOc1nc2ccccc2cc1/C=C\C(=O)O[C@H](C)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 746114865 XZJFTGMWHGLPNF-IVOILVROSA-N 474.473 5.299 5 20 JKBD CC(C)(C)OC(=O)N1CCC[C@H]1[C@H]1CCCN(C(=O)c2cc3ccccc3c3cccnc23)C1 749648343 NUIMNSAHGZSMCN-RDPSFJRHSA-N 459.590 5.640 5 20 JKBD C[C@H](OC(=O)c1cc2c3ccccc3n(C)c2s1)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 762213293 JOIFJBCFIXSLLC-NSHDSACASA-N 491.447 5.504 5 20 JKBD Cc1csc(Sc2ccc(C(=O)OCC(=O)Nc3ncc(Cl)cc3Cl)cc2[N+](=O)[O-])n1 849119926 BXDZPGXROXOZQJ-UHFFFAOYSA-N 499.357 5.008 5 20 JKBD COc1cc(NCc2ccc(Cl)cc2[N+](=O)[O-])c(C(=O)N2[C@H](C)CCC[C@H]2C)cc1OC 864003280 HSOIEPMUDCZOHE-HUUCEWRRSA-N 461.946 5.281 5 20 JKBD CSc1ccc(C(=O)c2ccccc2C(=O)Nc2ccc(-c3coc(C)n3)cc2)cc1[N+](=O)[O-] 913134974 YWOKPRMVRRHBNZ-UHFFFAOYSA-N 473.510 5.763 5 20 JKBD COC(=O)Nc1ccc(NC(=O)c2ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])c(OC)c2)cc1 916473720 QMSHIBPHNWTZRA-UHFFFAOYSA-N 471.853 5.480 5 20 JKBD CC1=C(C(=O)Nc2ccccc2)[C@H](c2cc([N+](=O)[O-])c(F)cc2F)NC(=S)N1c1ccccc1 916724177 XLKRNHWAERGINL-QFIPXVFZSA-N 480.496 5.222 5 20 JKBD CC(C)N(Cc1nnc(-c2cccc([N+](=O)[O-])c2)o1)C(=O)CSCc1ccc(Cl)cc1Cl 919982171 NKTZBKPLTLJISU-UHFFFAOYSA-N 495.388 5.622 5 20 JKBD O=C(CC[C@@H]1CNc2ccccc2C1)NC1(c2ccc(NC(=O)c3ccc([N+](=O)[O-])o3)cc2)CCC1 1785748549 QJMNRPRWLPBSPI-SFHVURJKSA-N 488.544 5.000 5 20 JKBD Cc1cc(C(=O)NC2(c3ccc(NC(=O)Cc4ccc(C)c([N+](=O)[O-])c4)cc3)CCC2)c(C)o1 1790526383 SUNFCTORARPKKG-UHFFFAOYSA-N 461.518 5.103 5 20 JKBD Cc1ccc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)cc1Cl 1801206441 FLBDXMUSRMRADV-BCDXTJNWSA-N 483.977 5.337 5 20 JKBD CC(C)c1ccc(CC(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)C2(c4cccc([N+](=O)[O-])c4)CCC2)C3)cc1 1801856148 GUGCZGAJPWFAGX-QEIWAGNOSA-N 489.616 5.021 5 20 JKBD Cc1ccc(CCC(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cccc(F)c2[N+](=O)[O-])C3)c2ccccc12 1804621431 LPDAUGTZKOCLNV-WKCHPHFGSA-N 489.547 5.080 5 20 JKBD O=C(Nc1cc([C@H]2CCCCN2C(=O)CSc2ccccc2[N+](=O)[O-])[nH]n1)c1cccc(Cl)c1 1820502582 KMBWEGIJIHDIDD-GOSISDBHSA-N 499.980 5.070 5 20 JKBD CC(C)c1ccc(C(=O)N2CCCC[C@H]2c2cc(NC(=O)Cc3ccc([N+](=O)[O-])cc3F)n[nH]2)cc1 1821843126 ZXBXICQRICWZBI-QHCPKHFHSA-N 493.539 5.129 5 20 JKBD O=C(c1ccc(Cl)cc1F)N1CCC([C@H]2CCCCN2C(=O)c2cc(F)cc([N+](=O)[O-])c2)CC1 1830612685 IAJPVCPKHUQQFU-JOCHJYFZSA-N 491.922 5.074 5 20 JKBD CC[C@H](C(=O)N1CCC([C@@H]2CCCCN2C(=O)Cc2cc(F)ccc2[N+](=O)[O-])CC1)c1ccccc1 1832887808 YMGPAMHVIJHQSG-DQEYMECFSA-N 495.595 5.090 5 20 JKBD O=[N+]([O-])c1ccc(CSc2nnc(CN3CCCCC3)n2-c2ccc(OC(F)F)cc2)cc1 9946466 KNVGFQONBAGVIX-UHFFFAOYSA-N 475.521 5.055 5 20 JKBD Cc1csc(Sc2ccc(C(=O)Nc3c(C)nn(-c4ccccc4)c3C)cc2[N+](=O)[O-])n1 10539733 YYBNDLWGXGFUEW-UHFFFAOYSA-N 465.560 5.566 5 20 JKBD CCc1ccccc1N(C(C)=O)c1nc(COC(=O)c2cc([N+](=O)[O-])ccc2Cl)cs1 10665524 RXVBLFWAZIPIOK-UHFFFAOYSA-N 459.911 5.309 5 20 JKBD CCCCc1ccc(NC(=S)N(Cc2nnc(-c3cccc([N+](=O)[O-])c3)o2)C(C)C)cc1 18142936 KNCAYJKDGZFQJN-UHFFFAOYSA-N 453.568 5.595 5 20 JKBD COc1ccc([N+](=O)[O-])cc1NC(=O)[C@H](C)Sc1nn(-c2ccc(Cl)cc2)c(=S)s1 23589467 UQGZIRNHIUQRRQ-JTQLQIEISA-N 482.996 5.353 5 20 JKBD Cc1cc(C)nc(Sc2ccc(NC(=O)Cn3c4ccccc4c(=O)c4ccccc43)cc2)n1 45766229 XWOPNSMGFOECKT-UHFFFAOYSA-N 466.566 5.351 5 20 JKBD Cc1ccc(C(=O)NCC(F)(F)F)cc1NC(=O)c1ccc(Nc2ccccc2)c([N+](=O)[O-])c1 71938651 YHXSBFKEYGSAOX-UHFFFAOYSA-N 472.423 5.191 5 20 JKBD COc1ccc(NC(=O)c2ccc(N3CCC[C@@H](C)C3)c([N+](=O)[O-])c2)cc1OCc1ccncc1 116945882 BNPYHRIJGBRRRL-GOSISDBHSA-N 476.533 5.066 5 20 JKBD Cc1cc(NC(=O)c2c3c(nc4ccccc24)/C(=C/c2cccc([N+](=O)[O-])c2)CCC3)n(C)n1 409713144 VMULQYGJLLKNDE-NBVRZTHBSA-N 453.502 5.314 5 20 JKBD NC(=O)c1cc(NC(=O)C/C(=C\c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)ccc1Cl 491552181 HPCNLHCKQOKFKE-RVDMUPIBSA-N 492.944 5.526 5 20 JKBD COc1cc(C(=O)N2CCCC[C@H](N3CCCC3)C2)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 502878105 YHHJGEZILLAYOR-IBGZPJMESA-N 473.957 5.140 5 20 JKBD CC[C@@H](C)n1c(S[C@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)nnc1-c1ccccc1 504288557 IMITZXDIGILYRC-ZIAGYGMSSA-N 459.959 5.597 5 20 JKBD COc1ccc([N+](=O)[O-])cc1C(=O)Nc1cccc(NC(=O)c2cccc(C(F)(F)F)c2)c1 504775737 ODMBBMYONSJVMZ-UHFFFAOYSA-N 459.380 5.127 5 20 JKBD O=C(Nc1ccccc1C(=O)N1CCC(Cc2ccc(F)cc2)CC1)c1ccc([N+](=O)[O-])cc1Cl 504856755 HPLOWRLSSSNGJK-UHFFFAOYSA-N 495.938 5.735 5 20 JKBD C[C@@H](Nc1ccc(C(=O)N[C@H]2CCSc3ccc(Cl)cc32)cc1[N+](=O)[O-])c1ccccn1 506069122 BBAGMVZIQBLQHV-KUHUBIRLSA-N 468.966 5.783 5 20 JKBD COc1cc(C(=O)N[C@H](C)c2ccccc2Oc2ccccc2)c([N+](=O)[O-])cc1OC(F)F 506183050 JGWIXCKDQIMMHU-CQSZACIVSA-N 458.417 5.488 5 20 JKBD COc1cc([C@H](C)NC(=O)N(Cc2ccc([N+](=O)[O-])cc2)C(C)C)ccc1OCc1ccncc1 509784289 VPGMYRNYBGBTGR-IBGZPJMESA-N 478.549 5.259 5 20 JKBD COc1ccc(CNCc2ccc(Sc3ccc(C)cc3)c([N+](=O)[O-])c2)c(OC)c1OC 513062860 VHLOENHDFPMHCJ-UHFFFAOYSA-N 454.548 5.370 5 20 JKBD C[C@@H]1CCCCN1CCCCNC(=O)C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1 516397504 KELNGFZJRDTICL-FCKILEINSA-N 492.645 5.906 5 20 JKBD O=C(Nc1cccc([N+](=O)[O-])c1)C(=O)N(Cc1ccc(-c2ccccc2C(F)(F)F)o1)C1CC1 516738658 DABWXPPCADNJCW-UHFFFAOYSA-N 473.407 5.003 5 20 JKBD Cc1nn(Cc2ccc(C(=O)Nc3cccc(COC4CCCCC4)c3)cc2)c(C)c1[N+](=O)[O-] 520661529 FEQKERDOTQWRRR-UHFFFAOYSA-N 462.550 5.558 5 20 JKBD C[C@@H](Nc1ccc(C(=O)Nc2ccc(OCC(F)(F)C(F)F)nc2)cc1[N+](=O)[O-])c1ccccn1 521497789 QEMDUEAXDPMDSC-CYBMUJFWSA-N 493.417 5.089 5 20 JKBD CCOc1ccc(N(C(=O)Cn2ccc3cc([N+](=O)[O-])ccc32)c2nc3ccccc3s2)cc1 521544607 OEKRKEFXPMGKSJ-UHFFFAOYSA-N 472.526 5.923 5 20 JKBD Cc1ccc(C(=O)Nc2nc(-c3ccc(OC(F)F)cc3OC(F)F)cs2)cc1[N+](=O)[O-] 522048887 DKYVOEQVNMHEFH-UHFFFAOYSA-N 471.388 5.482 5 20 JKBD CC(C)Cn1ccnc1NC(=O)C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1 522578587 QBVPQFMAPNIXFK-QGOAFFKASA-N 461.547 5.626 5 20 JKBD O=C(COc1ccc(F)cc1[N+](=O)[O-])Nc1cccc(C(=O)Nc2cccc(C(F)(F)F)c2)c1 524161841 XWKHRNISUCZNOX-UHFFFAOYSA-N 477.370 5.023 5 20 JKBD Cc1nc(COc2ccc(F)cc2)sc1C(=O)Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1 591587767 AZOCRFAZKCINQU-UHFFFAOYSA-N 470.507 5.454 5 20 JKBD Cc1c(C(=O)N(C[C@H]2CCCO2)c2nc(-c3cccc(C(F)(F)F)c3)cs2)cccc1[N+](=O)[O-] 592949768 FXGMSPRUXONOJI-QGZVFWFLSA-N 491.491 5.871 5 20 JKBD COc1ccc(OC)c(-c2csc(NC(=O)c3ccc(N4CCC[C@@H](C)C4)c([N+](=O)[O-])c3)n2)c1 603461171 BAVJSWKWJBIEBN-OAHLLOKOSA-N 482.562 5.224 5 20 JKBD CC[C@H](C)C(=O)Nc1cccc(CNCc2cn(-c3ccccc3)nc2-c2ccc([N+](=O)[O-])cc2)c1 608836687 FPOWPEVMNRCHLP-FQEVSTJZSA-N 483.572 5.722 5 20 JKBD C[C@@H]1CCCN(c2ccc(C(=O)Nc3cc(C(=O)N4CCCCC4)ccc3Cl)cc2[N+](=O)[O-])C1 608873359 VBMSYKHETOIYRC-QGZVFWFLSA-N 484.984 5.363 5 20 JKBD Cc1ccc(NC(=O)c2ccc(Oc3ccc(C(=O)Nc4cccnc4)cc3)c([N+](=O)[O-])c2)cc1 608974684 YFLQROCEAXEFDC-UHFFFAOYSA-N 468.469 5.595 5 20 JKBD Cc1nn(Cc2ccc(C(=O)Nc3nc(-c4ccccc4OC(F)F)cs3)cc2)c(C)c1[N+](=O)[O-] 609021756 PTYHSYGSFXZDEH-UHFFFAOYSA-N 499.499 5.434 5 20 JKBD Cc1nc(-c2ccc(F)cc2)sc1[C@H](C)NC(=O)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-] 609186663 YORWGLCXDWCYNG-NSHDSACASA-N 483.443 5.598 5 20 JKBD Cc1ccc(Sc2ccc(C(=O)N3CCC(n4c(O)nc5ccccc54)CC3)cc2[N+](=O)[O-])cc1 610252072 RUYXJMDQSPWOKM-UHFFFAOYSA-N 488.569 5.587 5 20 JKBD O=[N+]([O-])c1cccc(/C(O)=C(/C(=S)NCCc2ccc(Cl)cc2Cl)[n+]2ccccc2)c1 726572547 AIDOHILKUCXCDE-UHFFFAOYSA-O 475.377 5.233 5 20 JKBD Cc1ccc(NC(=O)[C@@H](OC(=O)c2csc(C(C)(C)C)n2)c2ccccc2)c([N+](=O)[O-])c1 726685684 CUELIZOGPQWTMS-IBGZPJMESA-N 453.520 5.194 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)Oc2cccc(C(=O)Nc3ccc(C)cc3)c2)cc1SC 728474962 IGWYVRWOTFLOJI-UHFFFAOYSA-N 452.488 5.105 5 20 JKBD COc1ccc(CSCC(=O)Nc2ccc(N3CCc4sccc4C3)cc2)cc1[N+](=O)[O-] 748649872 KGWJNZHQPNWJGK-UHFFFAOYSA-N 469.588 5.100 5 20 JKBD COc1cc(C(=O)N2CCC([C@H](O)c3ccccc3)CC2)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 817877738 DBCCRAZDJDGIMK-RUZDIDTESA-N 496.947 5.635 5 20 JKBD COc1ccc([N+](=O)[O-])cc1COC(=O)Cc1csc(-c2ccc(C(F)(F)F)cc2)n1 824923712 SOCGWFKYXWNYJI-UHFFFAOYSA-N 452.410 5.032 5 20 JKBD Cc1nn(-c2ccccc2)c(C)c1NC(=O)[C@H](C)Sc1nc2ccc([N+](=O)[O-])cc2s1 827004972 BLWOUBOABPSRRO-AWEZNQCLSA-N 453.549 5.126 5 20 JKBD CCOc1cc(/C=C(\C(=O)O[C@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2C)c2ccccc2)ccc1O 852996723 CZDZCLBSNQJOQG-AFDUHFSSSA-N 490.512 5.119 5 20 JKBD CC(C)c1ccc(-c2nc(C(=O)OCC(=O)Nc3cc(Cl)ccc3[N+](=O)[O-])cs2)cc1 900226653 MRZIEJJPYNETGZ-UHFFFAOYSA-N 459.911 5.291 5 20 JKBD C[C@@H](OC(=O)CCOc1ccc(Cl)c(Cl)c1)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 914963159 WDCGSRCWCAXDBB-SNVBAGLBSA-N 495.237 5.260 5 20 JKBD COc1cc(C(=O)Nc2cc(Cl)c([N+](=O)[O-])cc2OCc2ccccc2)c([N+](=O)[O-])cc1OC 916827453 JIMKBTHEQMJEPM-UHFFFAOYSA-N 487.852 5.005 5 20 JKBD C[C@@H](OC(=O)c1cc2cc([N+](=O)[O-])ccc2o1)C(=O)Nc1c(Cl)cc(Cl)cc1Cl 919212580 DJNWEWQNUPOGON-MRVPVSSYSA-N 457.653 5.485 5 20 JKBD C[C@H](OC(=O)c1[nH]c2ccc(Br)cc2c1Cl)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 919337892 PCFPENXOXOQLTI-VIFPVBQESA-N 491.685 5.460 5 20 JKBD O=C(OCc1csc([N+](=O)[O-])c1)c1cccnc1Oc1ccc(F)cc1Br 919417063 JFAJHNJGLCQUCC-UHFFFAOYSA-N 453.245 5.102 5 20 JKBD CC(=O)N[C@@H](CC(=O)Oc1ccc(-c2ccccc2)cc1[N+](=O)[O-])c1ccc(Br)cc1 920330737 MUTLMPSFBLBBHL-FQEVSTJZSA-N 483.318 5.197 5 20 JKBD O=C(OCc1nnc(-c2ccc(Cl)cc2Cl)o1)c1ccc(Br)c([N+](=O)[O-])c1 920491644 OIVZLRVQCRDERI-UHFFFAOYSA-N 473.066 5.071 5 20 JKBD O=C(CCCC(F)(F)F)Nc1ccc(C2(NC(=O)c3cc(F)cc([N+](=O)[O-])c3)CCC2)cc1 1786621366 JZRFNKMSSSDQGI-UHFFFAOYSA-N 467.419 5.214 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)[C@@H]3C[C@H]3C3CC3)CCC2)cc1)c1cccc(Br)c1[N+](=O)[O-] 1790751405 BVNCYNYDVHCBTL-RBUKOAKNSA-N 498.377 5.151 5 20 JKBD O=C(NC1(c2ccc(NC(=O)c3cccc4ccoc34)cc2)CCC1)c1cc([N+](=O)[O-])cc2c1OCC2 1790957175 QNQUYIZPDONLSV-UHFFFAOYSA-N 497.507 5.337 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)[C@@H]3C[C@]3(F)Cl)CCC2)cc1)c1cc2cc([N+](=O)[O-])ccc2s1 1791009839 AIFBNUYIXWZQOV-GAJHUEQPSA-N 487.940 5.482 5 20 JKBD COc1cc(C(=O)NC2(c3ccc(NC(=O)C45CCC(CC4)CC5)cc3)CCC2)c([N+](=O)[O-])cc1O 1791980748 KDAFLQURYBZGIS-UHFFFAOYSA-N 493.560 5.027 5 20 JKBD CC(C)C1(C(=O)Nc2ccc(C3(NC(=O)/C=C/c4ccc([N+](=O)[O-])o4)CCC3)cc2)CCC1 1792047064 PGOYCGJNLSMLMT-PKNBQFBNSA-N 451.523 5.161 5 20 JKBD O=C(Cc1cccc([N+](=O)[O-])c1)Nc1cc([C@@H]2CCCCN2C(=O)[C@@H]2CCC[C@H]3CCCC[C@@H]32)[nH]n1 1814375055 IOGHMYUSPISFBN-SPHCQZIESA-N 493.608 5.159 5 20 JKBD Cc1ccc(C(=O)N2CCC([C@@H]3CCCCN3C(=O)/C=C/c3ccc([N+](=O)[O-])o3)CC2)c(Cl)c1 1824279732 ZHZZKXFMEJODGJ-OUZREKFBSA-N 485.968 5.096 5 20 JKBD CNc1ccc(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3cc(Cl)cc([N+](=O)[O-])c3C)CC2)cc1 1826853364 MDFCNGJXRIBKQV-HSZRJFAPSA-N 499.011 5.145 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)N1CCCC[C@H]1C1CCN(C(=O)[C@H](C)c2cccs2)CC1 1830728496 DLGWHVQHJROYNH-UTKZUKDTSA-N 487.597 5.141 5 20 JKBD Cc1cccc([N+](=O)[O-])c1NC(=O)CSc1nc2ccccc2c(=O)n1-c1ccc(F)c(Cl)c1 8759574 IUDNTJKNKBAEOP-UHFFFAOYSA-N 498.923 5.126 5 20 JKBD Cc1ccc(NC(=O)[C@H](OC(=O)c2cc([N+](=O)[O-])ccc2Cl)c2ccccc2)c([N+](=O)[O-])c1 10665277 KWKMXQXDYZPSPN-HXUWFJFHSA-N 469.837 5.002 5 20 JKBD O=C(COC(=O)Cn1c2ccccc2c(=O)c2ccccc21)Nc1ccc(-c2ccccc2)cc1 11276579 RIQNTOCNZFJTMH-UHFFFAOYSA-N 462.505 5.004 5 20 JKBD CC[C@H](C)c1ccc([C@@H](NC(=O)c2ccc(S(C)(=O)=O)c([N+](=O)[O-])c2)c2cccs2)cc1 14316084 DYLABGJUFCWIRI-OYHNWAKOSA-N 472.588 5.093 5 20 JKBD Cc1occc1-c1nnc(S[C@@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)n1Cc1ccccc1 21684833 ROTZXAQFYZEIKU-HNNXBMFYSA-N 497.964 5.576 5 20 JKBD Cc1sc2nc(SCc3nnc(-c4ccc([N+](=O)[O-])cc4)o3)n(C3CCCC3)c(=O)c2c1C 22206527 GIGLIQHZZLUKBB-UHFFFAOYSA-N 483.575 5.440 5 20 JKBD O=C(CSc1ccc([N+](=O)[O-])cc1)N[C@@H](c1ccccc1)c1ccc2nc(C(F)(F)F)[nH]c2c1 23359713 WSHXBDWHEUEYAX-NRFANRHFSA-N 486.475 5.488 5 20 JKBD CCn1c(SCc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)nnc1-c1ccc(C(C)(C)C)cc1 29833751 ONDRAORFYVAEIM-UHFFFAOYSA-N 464.551 5.513 5 20 JKBD O=C(C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)Nc1cccc(Cn2cccn2)c1 32469652 ALJIJQUPNXILNS-QNGOZBTKSA-N 495.564 6.019 5 20 JKBD O=[N+]([O-])c1ccc(OCCCSc2nnc(-c3c[nH]c4ccccc34)n2C[C@H]2CCCO2)cc1 71971068 GCPIVXAHJNIJKC-LJQANCHMSA-N 479.562 5.075 5 20 JKBD COc1ccc(CSCC(=O)Nc2cccnc2Oc2cccc(C)c2C)cc1[N+](=O)[O-] 117562944 WDKOVFPMQNUOKD-UHFFFAOYSA-N 453.520 5.279 5 20 JKBD O=C(Nc1ccccc1)c1nnc(/C(Cl)=C\c2ccc(-c3ccccc3[N+](=O)[O-])o2)s1 210161678 UGQPLWOQYSSVLF-FOWTUZBSSA-N 452.879 5.696 5 20 JKBD O=C(Nc1ccc(Cl)cc1Cl)[C@@H]1CCCCN1C(=O)c1ccc(Cl)cc1[N+](=O)[O-] 302923709 APVDDKUYUQSBNY-INIZCTEOSA-N 456.713 5.188 5 20 JKBD C[C@H](Sc1nc2cc3ccccc3cc2c(=O)n1C)C(=O)c1ccc(NC(=O)C(C)(C)C)cc1 495350302 BRJCIBVAASZKEC-INIZCTEOSA-N 473.598 5.435 5 20 JKBD Cc1nn(-c2ccccc2)c(C)c1NC(=O)[C@@H](C)Sc1nc2cc3ccccc3cc2c(=O)n1C 498078986 CPZLYPISCZARGR-GOSISDBHSA-N 483.597 5.009 5 20 JKBD Cn1ccnc1Sc1ccccc1NC(=O)c1ccc(NCc2ccccc2)c([N+](=O)[O-])c1 509862944 IFUOAVJUDJQENC-UHFFFAOYSA-N 459.531 5.344 5 20 JKBD COc1cccc(-c2nnc(SCc3cc([N+](=O)[O-])ccc3OC(C)C)n2Cc2ccco2)c1 511067872 XGNCANUPECAPRX-UHFFFAOYSA-N 480.546 5.583 5 20 JKBD O=C(Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1)[C@@H]1CCCN1C(=O)c1ccc(Cl)c(Cl)c1 514487905 ZVWCNIGMKJHHHF-SFHVURJKSA-N 491.356 5.268 5 20 JKBD Cc1ccc(C(N)=O)cc1NC(=O)c1c2c(nc3ccccc13)/C(=C\c1cccc([N+](=O)[O-])c1)CCC2 521810169 RVIILHJTHQNEEB-RGEXLXHISA-N 492.535 5.680 5 20 JKBD O=C(N[C@H](c1ccc(Br)cc1)C1CCC1)C1CCN(c2ccccc2[N+](=O)[O-])CC1 604016855 IZGDNYWSDQTBDG-QFIPXVFZSA-N 472.383 5.231 5 20 JKBD O=C(NC[C@@H](c1ccccc1)c1c[nH]c2ccccc12)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-] 604078191 SLQSIARXUPJRKA-FQEVSTJZSA-N 483.446 5.579 5 20 JKBD C[C@@H]1CN(C(=O)c2c3c(nc4ccccc24)/C(=C\c2ccc([N+](=O)[O-])cc2)CCC3)CCCO1 608946515 QLUBEKASFGPBAC-HWLQVLAGSA-N 457.530 5.271 5 20 JKBD CSc1ccc([N+](=O)[O-])c(C(=O)N[C@@H]2c3cc(Br)ccc3SC[C@H]2C)c1 609219123 GSMFGUHUHBHDFG-QGHHPUGFSA-N 453.383 5.292 5 20 JKBD COc1ccc(OC)c(NC(=S)/C(=C(/O)c2cccc([N+](=O)[O-])c2)[n+]2ccc3c(c2)CCCC3)c1 726570420 NSEAHHUKWPHHGD-UHFFFAOYSA-O 492.577 5.102 5 20 JKBD O=C(Nc1ccc(N2CCOCC2)c(F)c1)c1ccc(NCc2ccccc2Cl)c([N+](=O)[O-])c1 727998096 NKZAEDPJPMUVDM-UHFFFAOYSA-N 484.915 5.088 5 20 JKBD COc1ccc([N+](=O)[O-])cc1NC(=O)[C@H](C)OC(=O)c1sc(-c2ccco2)nc1-c1ccccc1 900279384 SQBIZELHWDAMCZ-AWEZNQCLSA-N 493.497 5.171 5 20 JKBD CC(C)[C@H](OC(=O)c1ccc(N2CCCC2)c([N+](=O)[O-])c1)C(=O)Nc1ccccc1C(F)(F)F 915370902 ZSWBTMRSQDFDFA-FQEVSTJZSA-N 479.455 5.034 5 20 JKBD CC(=O)Nc1ccc(C)c(NC(=O)c2cc([N+](=O)[O-])ccc2N2CCC(Cc3ccccc3)CC2)c1 918611801 CMBZMAQZCNXLBK-UHFFFAOYSA-N 486.572 5.573 5 20 JKBD CCn1c(SCC(=O)OCc2csc([N+](=O)[O-])c2)nnc1-c1ccc(Cl)cc1Cl 918799400 WODNHGBBZMJHSN-UHFFFAOYSA-N 473.363 5.077 5 20 JKBD C[C@H](Nc1ccc(C(=O)Nc2nc(-c3cccc([N+](=O)[O-])c3)cs2)cc1[N+](=O)[O-])c1ccccn1 919679636 ADLDTGDFAWXLJB-AWEZNQCLSA-N 490.501 5.447 5 20 JKBD Cc1ccc(Cl)cc1NC(=O)[C@H](C)OC(=O)c1ccc(N[C@@H](C)c2ccccn2)c([N+](=O)[O-])c1 920548166 QFMLDDQLDSUFCP-HOTGVXAUSA-N 482.924 5.309 5 20 JKBD O=[N+]([O-])c1ccc2nc(/C(Cl)=C/c3cc(Br)c4c(c3)OCCCO4)[nH]c2c1 921265472 GSUNKULEGWWABI-QPEQYQDCSA-N 450.676 5.132 5 20 JKBD Cc1ccc(CCC(=O)NC2(c3ccc(NC(=O)c4c(F)ccc([N+](=O)[O-])c4C)cc3)CCC2)nc1 1790771140 RQRFARWGZOJHIY-UHFFFAOYSA-N 490.535 5.126 5 20 JKBD CN(C)c1ccc([N+](=O)[O-])cc1C(=O)Nc1ccc(C2(NC(=O)c3cc4ccccc4o3)CCC2)cc1 1790794485 XBXJVCPFHASAKH-UHFFFAOYSA-N 498.539 5.469 5 20 JKBD Cc1c(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2c(F)ccc(Cl)c2F)C3)cc(Cl)cc1[N+](=O)[O-] 1800712992 BOZUZNMCZLUCSK-BTTYYORXSA-N 498.313 5.054 5 20 JKBD COc1c(Cl)cccc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc2cc([N+](=O)[O-])ccc2s1 1801208823 QFZSTKRNAAOBJX-MUJYYYPQSA-N 499.976 5.037 5 20 JKBD Cc1ccc(F)cc1C(=O)N1CCCC2(CCN(C(=O)c3cc(Cl)cc([N+](=O)[O-])c3C)CC2)C1 1805061564 BLIACINSQRWISW-UHFFFAOYSA-N 487.959 5.163 5 20 JKBD Cc1cc(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)c3cc(Cl)cc([N+](=O)[O-])c3C)n[nH]2)c(C)o1 1821291076 NQVFSNPEZCIFDR-LJQANCHMSA-N 485.928 5.109 5 20 JKBD C[C@@H]1CCC[C@@H]1C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cc3cc([N+](=O)[O-])ccc3s2)n[nH]1 1821610228 WJMSMGXJDFCXHO-LJHODMEESA-N 481.578 5.275 5 20 JKBD O=C(CC1CCCC1)N[C@@H]1CCc2nc(NC(=O)c3cc4cc([N+](=O)[O-])ccc4s3)sc2C1 1824424501 BKVQUSLRBLOFRA-OAHLLOKOSA-N 484.603 5.072 5 20 JKBD Cc1ccc(-c2cc(C(=O)N3CCCC[C@H]3C3CCN(C(=O)c4ccc([N+](=O)[O-])o4)CC3)c[nH]2)cc1 1825423215 WXTGXYZGYXSLOK-QHCPKHFHSA-N 490.560 5.038 5 20 JKBD Cc1nscc1C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)CC1 1825661153 PWEKTJDOXIKCTO-HXUWFJFHSA-N 498.630 5.122 5 20 JKBD Cc1oc(C(C)(C)C)cc1C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cc(F)cc([N+](=O)[O-])c2)CC1 1825951768 ZWYVLDKTSRLBLY-HSZRJFAPSA-N 499.583 5.480 5 20 JKBD CN(C)c1ccc([N+](=O)[O-])c(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)/C=C/C3CCCCC3)CC2)c1 1829649451 FMIJLYOXMSYTDS-IGQYLQMFSA-N 496.652 5.031 5 20 JKBD O=C(/C=C/c1ccccc1[N+](=O)[O-])N1CCC([C@@H]2CCCCN2C(=O)c2c(F)cccc2Cl)CC1 1829901219 XAKODAZGVRWVIK-LEQVUBRHSA-N 499.970 5.334 5 20 JKBD Cc1c(C(=O)N2CCC([C@@H]3CCCCN3C(=O)CCC(C)C)CC2)cc(Cl)cc1[N+](=O)[O-] 1831382191 RBSAHSDFDGYASQ-NRFANRHFSA-N 464.006 5.226 5 20 JKBD C[C@@H](OC(=O)CSc1ccc([N+](=O)[O-])cc1)c1nc(-c2cccc(C(F)(F)F)c2)no1 11647785 KYGRUGNSSZRCQT-LLVKDONJSA-N 453.398 5.060 5 20 JKBD O=C(Cn1c2ccccc2c(=O)c2ccccc21)N1CCc2sccc2[C@H]1c1cccs1 14809685 VTNXQJCOILHSCZ-VWLOTQADSA-N 456.592 5.452 5 20 JKBD Cc1ccc(NC(=O)c2cccc([N+](=O)[O-])c2)cc1S(=O)(=O)Nc1ccc(SC(F)F)cc1 15705243 XYHIGLSNMJFYIH-UHFFFAOYSA-N 493.513 5.271 5 20 JKBD CSc1ccc([N+](=O)[O-])c(C(=O)OCC(=O)Nc2c(Cl)c(Cl)cc(Cl)c2Cl)c1 16196235 IZBTVXWXPLHSNC-UHFFFAOYSA-N 484.144 5.726 5 20 JKBD Cc1nc(-c2ccccc2)sc1C(=O)O[C@@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 17828520 RLXRCPFXTNVTFR-LBPRGKRZSA-N 479.436 5.230 5 20 JKBD O=C(OCc1nnc(-c2ccc(Cl)cc2)o1)c1ccc(NCc2ccccc2)c([N+](=O)[O-])c1 20991221 QFQGUCQYOIQFOH-UHFFFAOYSA-N 464.865 5.267 5 20 JKBD O=C(Cn1c2ccccc2c(=O)c2ccccc21)N(Cc1cccs1)c1ccc2c(c1)OCCO2 22101611 XMCRXKYHMCQNCH-UHFFFAOYSA-N 482.561 5.221 5 20 JKBD Cc1ncc(-c2ccc(NC(=O)C3CCN(c4ccc(C(F)(F)F)cc4[N+](=O)[O-])CC3)cc2)o1 29858936 PABQYPCHEXIAEG-UHFFFAOYSA-N 474.439 5.432 5 20 JKBD C[C@@H](Sc1nc(C2CC2)n(-c2ccccc2)n1)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 36202624 NEMILPNZBYWTGQ-GFCCVEGCSA-N 477.468 5.191 5 20 JKBD Cc1cc(NC(=O)C2CCN(c3ccc(C(F)(F)F)cc3[N+](=O)[O-])CC2)n(Cc2ccccc2)n1 69559031 BLUSNBPQVOWAGW-UHFFFAOYSA-N 487.482 5.022 5 20 JKBD C[C@H](Nc1ccc(C(=O)Nc2cc(C(C)(C)C)nn2C(C)(C)C)cc1[N+](=O)[O-])c1ccccn1 110565145 SEFHEOWMAXVXJA-INIZCTEOSA-N 464.570 5.664 5 20 JKBD COc1cc(C(=O)N[C@@H](c2ccc(C(C)C)cc2)c2cccs2)c([N+](=O)[O-])cc1OC(F)F 115378820 MCHSBWLUCLEUKT-NRFANRHFSA-N 476.501 5.909 5 20 JKBD Cc1c(NC(=O)c2ccccc2)cccc1NC(=O)c1ccc(N2CCC(C)CC2)c([N+](=O)[O-])c1 409460248 CIYRGOAKIRCUQP-UHFFFAOYSA-N 472.545 5.644 5 20 JKBD COc1cc(C(=O)NC[C@@H]2CCCO[C@H]2c2ccccc2)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 409572635 CMHOTTCLUVZBHH-DFBJGRDBSA-N 496.947 5.947 5 20 JKBD O=C(Cn1c2ccccc2c(=O)c2ccccc21)N[C@H](Cc1cccc(F)c1)c1cccc(F)c1 489909409 QBJIWNBVHFVAEL-RUZDIDTESA-N 468.503 5.533 5 20 JKBD COc1ccc(NC(=O)c2oc3ccccc3c2CSc2nnc(C)s2)c([N+](=O)[O-])c1 499290341 BCLAKLMBBOLXAU-UHFFFAOYSA-N 456.505 5.054 5 20 JKBD O=C(c1ccc(Cl)cc1)C1CCN(C(=O)c2csc(-c3ccc([N+](=O)[O-])cc3)n2)CC1 502244398 JOCDJJVSZDAKOY-UHFFFAOYSA-N 455.923 5.107 5 20 JKBD CSc1cc2c(cc1NC(=O)c1ccc(Sc3nc(C)cs3)c([N+](=O)[O-])c1)OCCO2 505876805 HEIUAPKKXGMQIV-UHFFFAOYSA-N 475.573 5.256 5 20 JKBD C[C@@H](NC(=O)c1ccc(N[C@H](C)c2ccccn2)c([N+](=O)[O-])c1)c1cccc(OCc2ccccn2)c1 509518261 FKENHMHFBHFJLB-WOJBJXKFSA-N 497.555 5.628 5 20 JKBD Cc1cccc([N+](=O)[O-])c1NC(=O)CSc1nnc(-c2ccccc2)n1[C@H](C)c1ccccc1 515572835 HYPZXMKVBJYWRU-GOSISDBHSA-N 473.558 5.502 5 20 JKBD CC(C)N(C(=O)c1ccc(N2C[C@@H](C)C[C@H](C)C2)c([N+](=O)[O-])c1)c1ccc(Br)cn1 515624505 FWHXOLMFEDKVRD-HOTGVXAUSA-N 475.387 5.290 5 20 JKBD COc1cc(CNCc2ccc(-c3ccccc3[N+](=O)[O-])s2)ccc1OCC(F)(F)F 518768481 VRGXAXRFOGGPOA-UHFFFAOYSA-N 452.454 5.563 5 20 JKBD CC(C)N1CCC[C@@H](CNC(=O)c2ccccc2Sc2ccc(C(F)(F)F)cc2[N+](=O)[O-])C1 520151206 FLRFOXNCJMFNRI-INIZCTEOSA-N 481.540 5.615 5 20 JKBD C[C@H](Nc1ccc(C(=O)NCc2ccc(OC3CCCCC3)nc2)cc1[N+](=O)[O-])c1ccccn1 522221308 UBCWTKVXRQMZPT-SFHVURJKSA-N 475.549 5.199 5 20 JKBD Cc1csc(Sc2ccc(C(=O)N(Cc3nc(O)c4ccccc4n3)C(C)C)cc2[N+](=O)[O-])n1 603224076 ZCZANGVKBBSDQR-UHFFFAOYSA-N 495.586 5.211 5 20 JKBD COCCN(C(=O)CCCc1c[nH]c2ccccc12)c1nc(-c2ccc([N+](=O)[O-])cc2)cs1 603461246 JGHCAFLWICTUCU-UHFFFAOYSA-N 464.547 5.202 5 20 JKBD CS(=O)(=O)c1ccc(C(=O)Nc2cc(Cl)ccc2Sc2ccccc2)cc1[N+](=O)[O-] 603461331 UXIUIYZXCGEYNH-UHFFFAOYSA-N 462.936 5.055 5 20 JKBD C[C@H](Nc1ccc(C(=O)Nc2cc(C3CC3)nn2-c2ccccc2)cc1[N+](=O)[O-])c1ccccn1 608963012 FQRNPJYVCFITOH-KRWDZBQOSA-N 468.517 5.478 5 20 JKBD COc1ccc(NC(C)=O)c(NC(=O)CCC(=O)c2ccc3ccc4cccc5ccc2c3c45)c1 727755668 AHKFMVQYUMYWNN-UHFFFAOYSA-N 464.521 6.153 5 20 JKBD Cc1cc(OCc2cccc(Cl)c2)ccc1NC(=O)c1cc([N+](=O)[O-])ccc1N1CCOCC1 727999208 JQQNWWPOUBAVTJ-UHFFFAOYSA-N 481.936 5.225 5 20 JKBD O=C1CCCc2cc(NC(=O)c3ccccc3NC(=O)c3ccc([N+](=O)[O-])cc3Cl)ccc2N1 728551321 GCJBFQJOQILTDW-UHFFFAOYSA-N 478.892 5.028 5 20 JKBD COc1ccc(CC[C@H](C)NC(=O)c2ccccc2NC(=O)c2ccc([N+](=O)[O-])cc2Cl)cc1 742411156 OKFBDCUABQGEQR-INIZCTEOSA-N 481.936 5.260 5 20 JKBD C[C@@H](OC(=O)CSc1cccc2cccc(Cl)c12)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 745902618 MLKJVEQCLAQCDJ-CYBMUJFWSA-N 469.906 5.848 5 20 JKBD Cc1c([N+](=O)[O-])cc(C(=O)Nc2nc(-c3cc(Cl)sc3Cl)cs2)cc1[N+](=O)[O-] 747627424 HIYWWRORRZNSMI-UHFFFAOYSA-N 459.292 5.556 5 20 JKBD CC[C@H](C)c1ccccc1NC(=O)[C@@H](C)OC(=O)c1csc(-c2cccc([N+](=O)[O-])c2)n1 747961092 FYONJXNQRXPWAZ-LSDHHAIUSA-N 453.520 5.416 5 20 JKBD COc1cc(C(=O)Nc2ccccc2C(=O)Nc2cccc(C(F)(F)F)c2)ccc1[N+](=O)[O-] 751108930 ULWVYWQIQGSAFX-UHFFFAOYSA-N 459.380 5.127 5 20 JKBD O=C(O[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Br)c1ccccc1)c1cc(F)cc(F)c1 848942895 DAGYIKPHIPQYNE-LJQANCHMSA-N 491.244 5.172 5 20 JKBD O=C(Nc1nc(-c2cc(Cl)ccc2Cl)cs1)c1cc([N+](=O)[O-])ccc1N1CCOCC1 863919845 DAMAVJGGPJJRHT-UHFFFAOYSA-N 479.345 5.114 5 20 JKBD CC(C)N(Cc1nnc(-c2cccc([N+](=O)[O-])c2)o1)C(=O)CCc1ccc(-c2ccccc2)o1 864244647 HOAGZLABXSICAS-UHFFFAOYSA-N 460.490 5.275 5 20 JKBD Cc1sc(-c2ccco2)nc1C(=O)Oc1ccc2c(-c3ccc([N+](=O)[O-])cc3)cc(=O)oc2c1 913123801 VGTKCUYAHOARPA-UHFFFAOYSA-N 474.450 5.612 5 20 JKBD Cc1c(NC(=O)C/C(=C\c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)cccc1[N+](=O)[O-] 916701930 DBKWVCOWIPAEQV-GHRIWEEISA-N 474.498 5.991 5 20 JKBD CN(Cc1cccc(NC(=O)Cn2c3ccccc3c(=O)c3ccccc32)c1)C(=O)OC(C)(C)C 917112378 BSNIOPNAHMZYOD-UHFFFAOYSA-N 471.557 5.160 5 20 JKBD COc1ccc(NC(=O)c2cc(-c3ccncc3)nc3ccc(Br)cc23)c([N+](=O)[O-])c1 919985311 HXXQTVIORURAAE-UHFFFAOYSA-N 479.290 5.228 5 20 JKBD CC(=O)Nc1cc(NC(=O)c2ccc(Sc3ccc(C)cc3)c([N+](=O)[O-])c2)c(F)cc1F 921155859 ALSILZQOXUVFBK-UHFFFAOYSA-N 457.458 5.543 5 20 JKBD COc1ccc(-n2c(C)nnc2SCC(=O)OCc2nc3ccccc3c3ccccc23)cc1 921279440 WEADTGQPSFYUBU-UHFFFAOYSA-N 470.554 5.121 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)NC1(c2ccc(NC(=O)c3ccc4ncoc4c3)cc2)CCC1 1789078604 MGWZAWVOFWPMPV-UHFFFAOYSA-N 488.475 5.245 5 20 JKBD O=C(NC1(c2ccc(NC(=O)c3cc(-c4ccccc4)no3)cc2)CCC1)c1cc(O)cc([N+](=O)[O-])c1 1789781783 ASMCUTYCUHEQHW-UHFFFAOYSA-N 498.495 5.017 5 20 JKBD COc1cc(CC(=O)NC2(c3ccc(NC(=O)[C@H](C)c4cccs4)cc3)CCC2)ccc1[N+](=O)[O-] 1791816528 SNWMUZHKIYXVAP-QGZVFWFLSA-N 493.585 5.145 5 20 JKBD CC(F)(F)C(C)(C)C(=O)N1CCCC2(CCN(C(=O)c3cc4cc([N+](=O)[O-])ccc4s3)CC2)C1 1806183722 XHLYYMANLMBXLY-UHFFFAOYSA-N 493.576 5.336 5 20 JKBD CC[C@H](C(=O)N1CCCC2(CCN(C(=O)c3c(F)ccc([N+](=O)[O-])c3C)CC2)C1)c1ccccc1 1809015969 IKICWRMCAMVIOJ-NRFANRHFSA-N 481.568 5.081 5 20 JKBD CC(C)c1ccc(C(=O)N2CC[C@H](CNC(=O)/C=C/c3ccccc3[N+](=O)[O-])[C@H]2c2cccnc2)cc1 1814194140 LNNSALBZMVBJOX-XRVJWVRBSA-N 498.583 5.146 5 20 JKBD Cc1nc(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3cc4cc([N+](=O)[O-])ccc4s3)CC2)cs1 1826130016 XQHNLQFWYZFSBJ-HXUWFJFHSA-N 498.630 5.122 5 20 JKBD CCCOc1ccc(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3ccc([N+](=O)[O-])cc3F)CC2)cc1 1830102267 CRNCSGBZQSQPNG-RUZDIDTESA-N 497.567 5.070 5 20 JKBD CC1(C)CC(C(=O)N2CCCC[C@H]2C2CCN(C(=O)c3cc4cc([N+](=O)[O-])ccc4s3)CC2)C1 1831933128 WHTGODYQVHRZSZ-NRFANRHFSA-N 483.634 5.479 5 20 JKBD O=C(CSc1ccccc1[N+](=O)[O-])N1CCC([C@@H]2CCCCN2C(=O)C23CCC(CC2)CC3)CC1 1832391736 JSBWSZZPCZPIFP-VITNCHFBSA-N 499.677 5.277 5 20 JKBD C[C@@H](C(=O)N1CCCC12CN(C(=O)c1cc3cc([N+](=O)[O-])ccc3s1)C2)c1ccc(Cl)cc1 1841199336 UDOFWZIGTMBMOQ-OAHLLOKOSA-N 483.977 5.084 5 20 JKBD COc1cc([N+](=O)[O-])ccc1NC(=O)COC(=O)CCc1c(-c2ccc(F)cc2)[nH]c2ccccc12 10693160 HAWDUYJZJIUSRZ-UHFFFAOYSA-N 491.475 5.005 5 20 JKBD COc1ccc(Br)cc1-c1nc(COC(=O)/C=C/c2ccc([N+](=O)[O-])cc2)cs1 10897709 VNCSMLWOFORXQS-RUDMXATFSA-N 475.320 5.246 5 20 JKBD COc1ccc(N2C(=O)/C(=C\c3cccs3)N=C2SCc2cccc([N+](=O)[O-])c2)cc1Cl 13163747 XYZNVCOCKXNHMP-XDHOZWIPSA-N 485.974 5.995 5 20 JKBD C[C@H](Oc1ccc2c(-c3ccc([N+](=O)[O-])cc3)cc(=O)oc2c1)C(=O)Nc1ccc(F)cc1F 15370853 APWPKGUAWZERMR-ZDUSSCGKSA-N 466.396 5.052 5 20 JKBD C[C@@H](OC(=O)CSc1ccc2ccccc2c1)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 21347572 UBVDHTLLJZEZFH-CYBMUJFWSA-N 478.448 5.429 5 20 JKBD CCOC(=O)c1c(NC(=O)c2cc(SC)ccc2[N+](=O)[O-])sc(C(=O)Nc2ccccc2)c1C 24470444 VFIBOEWFYJRRRJ-UHFFFAOYSA-N 499.570 5.368 5 20 JKBD O=C(O[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1)c1ccc(NC(=O)C2CC2)cc1 24973495 SYNZKLFERZGNOP-JOCHJYFZSA-N 493.903 5.134 5 20 JKBD C[C@H](Sc1nccn1-c1ccc(Cl)cc1)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 26679300 YGMJUKVGPHWPCE-NSHDSACASA-N 470.860 5.572 5 20 JKBD COc1cc(-c2nnc(S/C=C\c3ccc([N+](=O)[O-])o3)n2C2CCCCC2)cc(OC)c1OC 96936392 BRHVDQXSWJJLGA-QXMHVHEDSA-N 486.550 5.740 5 20 JKBD CC(C)N(C(=O)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1)c1ccc(F)cc1 303080722 DBNUAXDVDVXLSA-UHFFFAOYSA-N 453.436 5.411 5 20 JKBD O=C(Cc1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1)NCCCc1c[nH]c2ccccc12 303321486 UIDFHTQJLPSQRZ-UHFFFAOYSA-N 479.540 5.220 5 20 JKBD Cc1csc(Sc2ccc(C(=O)Nc3ccccc3OCC(F)(F)F)cc2[N+](=O)[O-])n1 477385563 MZGIRHYNAZGZLC-UHFFFAOYSA-N 469.466 5.704 5 20 JKBD Cn1cnnc1Sc1ccc(C(=O)Nc2ccc(F)cc2-c2ccc(F)cc2)cc1[N+](=O)[O-] 485761193 IOOCUWZJVUGVRC-UHFFFAOYSA-N 467.457 5.072 5 20 JKBD Cc1nc([N+](=O)[O-])cn1CCC(=O)NC[C@H](c1ccccc1)c1c(-c2ccccc2)[nH]c2ccccc12 488387625 UYHSLCBBXBLVKV-XMMPIXPASA-N 493.567 5.586 5 20 JKBD CCOc1cc([N+](=O)[O-])c(C(=O)Nc2ccc(S[C@H](C)CC)cc2C(F)(F)F)cc1OC 499594062 FQCMPMOMTBHNMY-GFCCVEGCSA-N 472.485 6.164 5 20 JKBD COc1ccc(CSCC(=O)N(Cc2cccs2)c2ccc(F)cc2F)cc1[N+](=O)[O-] 511063269 MXQOFSZJBJYNNT-UHFFFAOYSA-N 464.515 5.410 5 20 JKBD O=C(c1cc2cccc([N+](=O)[O-])c2[nH]1)C(c1nc2ccccc2s1)c1nc2ccccc2s1 513648362 PNEIJKZNUXIJRH-UHFFFAOYSA-N 470.535 6.310 5 20 JKBD O=C(c1ccc(-n2ccnc2)c([N+](=O)[O-])c1)N(CCc1ccccc1)c1nc2ccccc2s1 515216333 UTMBATDUQYLADZ-UHFFFAOYSA-N 469.526 5.280 5 20 JKBD CSc1ccc(C(=O)c2ccccc2C(=O)N2C[C@H](C)O[C@H](c3ccccc3)C2)cc1[N+](=O)[O-] 516322347 JDHWXNLPXWLFEW-SBUREZEXSA-N 476.554 5.150 5 20 JKBD Cc1csc(Sc2ccc(C(=O)N3CCC(OC4CCC(C)CC4)CC3)cc2[N+](=O)[O-])n1 518117303 IINNJRYHLMGINO-UHFFFAOYSA-N 475.636 5.711 5 20 JKBD COc1cc(C(=O)Nc2ccc(Oc3ccccc3C(F)(F)F)cc2)c([N+](=O)[O-])cc1OC 519978381 BNAWZAHBZOFOCB-UHFFFAOYSA-N 462.380 5.675 5 20 JKBD Cc1nc(CN(c2cccc(C(F)(F)F)c2)S(=O)(=O)c2ccc(C)c([N+](=O)[O-])c2)cs1 521007239 LGRPYGNAXANWNC-UHFFFAOYSA-N 471.482 5.082 5 20 JKBD CC(C)(C)[C@H](NC(=O)C(=O)Nc1cc([N+](=O)[O-])ccc1OC(F)F)c1cccc(C(F)(F)F)c1 524048282 FVYRMSXFOZSCHQ-MRXNPFEDSA-N 489.397 5.057 5 20 JKBD CC(C)c1c(C(=O)Nc2cc([N+](=O)[O-])ccc2OC(F)F)cnn1-c1cccc(Cl)c1 603638828 VUYDYFONQHQIRQ-UHFFFAOYSA-N 450.829 5.411 5 20 JKBD NC(=O)c1ccc(NC(=O)c2c3c(nc4ccccc24)/C(=C\c2cccc([N+](=O)[O-])c2)CCC3)cc1F 608850403 IRAAXKGFYGQYCV-LGMDPLHJSA-N 496.498 5.510 5 20 JKBD COc1cccc([C@H](Nc2ccc(C(=O)Nc3ccc(C)cc3)cc2[N+](=O)[O-])c2nccn2C)c1 608971771 QHTQSVQPTABXEZ-DEOSSOPVSA-N 471.517 5.099 5 20 JKBD O=C(Nc1ccccc1C(=O)N1CCC(CN2CCCCCC2)CC1)c1ccc([N+](=O)[O-])cc1Cl 609024239 HNURZRUAYAQSBC-UHFFFAOYSA-N 499.011 5.229 5 20 JKBD O=C(CSc1nc2ccccc2c2nc3ccccc3n12)N1CCC(OCc2ccccc2)CC1 613813780 VUTHSZOSQWLLCV-UHFFFAOYSA-N 482.609 5.336 5 20 JKBD COCCOc1cc([N+](=O)[O-])c(C(=O)Nc2nc(-c3cccc4ccccc34)cs2)cc1OC 619564485 RQRAKKRGSQWRQF-UHFFFAOYSA-N 479.514 5.158 5 20 JKBD Cc1nn(-c2ccc(C(=O)N(Cc3nnc(-c4cccc([N+](=O)[O-])c4)o3)C(C)C)cc2)c(C)c1Cl 864244649 HPHBGZKCNNCSLE-UHFFFAOYSA-N 494.939 5.152 5 20 JKBD CC(C)c1c(C(=O)O[C@@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)cnn1-c1ccc(Cl)cc1 913378807 NBNIJDQYMAMASR-AWEZNQCLSA-N 481.896 5.525 5 20 JKBD CCCOc1ccc(C(=O)NC2(c3ccc(NC(=O)c4ccc([N+](=O)[O-])o4)cc3)CCC2)cc1 1785750083 PHHGRGZUSMYAFQ-UHFFFAOYSA-N 463.490 5.038 5 20 JKBD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2cccc(F)c2[N+](=O)[O-])[nH]n1)[C@@H]1CCC[C@H]2CCCC[C@H]21 1818931178 JSMCLWKYQSXSSV-IDVKNYFZSA-N 497.571 5.369 5 20 JKBD O=C(c1ccc([N+](=O)[O-])o1)N1CCC([C@@H]2CCCCN2C(=O)c2ccc3occ(Cl)c3c2)CC1 1829698288 JCHWFNMWLVQZLN-IBGZPJMESA-N 485.924 5.135 5 20 JKBD Cc1cc(C(=O)N2CCC([C@H]3CCCCN3C(=O)CC3CCC(C)(C)CC3)CC2)ncc1[N+](=O)[O-] 1830421479 LDWQPDFJDPEOGM-HSZRJFAPSA-N 484.641 5.138 5 20 JKBD O=C(c1cc(F)ccc1Cl)N1CCC([C@@H]2CCCCN2C(=O)c2cccc(F)c2[N+](=O)[O-])CC1 1830621903 SQMRCDAIRPPHCQ-NRFANRHFSA-N 491.922 5.074 5 20 JKBD COc1cc(C(=O)N2CCCC[C@H]2C2CCN(C(=O)c3cc(C)cc(Cl)c3)CC2)ccc1[N+](=O)[O-] 1832697547 PTLDQBNNKARMFM-QFIPXVFZSA-N 499.995 5.112 5 20 JKBD C[C@@H](C(=O)N1CC2(CCCN2C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)C1)c1ccc(Cl)cc1 1845738180 IPQTXIMCANGOFN-OAHLLOKOSA-N 483.977 5.084 5 20 JKBD CCCCn1c(SCC(=O)Nc2ccc(Cl)cc2[N+](=O)[O-])nnc1-c1ccc(OC)cc1 9483456 HSQYGXWURYVUNC-UHFFFAOYSA-N 475.958 5.046 5 20 JKBD CNc1ccc(C(=O)OCC(=O)Nc2c(Cl)c(Cl)cc(Cl)c2Cl)cc1[N+](=O)[O-] 9924162 OXECWQDAVVOGMC-UHFFFAOYSA-N 467.092 5.046 5 20 JKBD C[C@H](Sc1nc(C2CC2)nn1-c1ccccc1)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 10202022 VFDBEKLNKAXLRO-LBPRGKRZSA-N 477.468 5.191 5 20 JKBD Cn1c(S[C@@H](C(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)c2ccccc2)nnc1-c1cccs1 10709422 ODMCPUSWWSJYBJ-GOSISDBHSA-N 485.978 5.577 5 20 JKBD COc1cc(OC)c(NC(=O)Cc2cn(-c3ccccc3)nc2-c2ccc([N+](=O)[O-])cc2)cc1Cl 11603960 FGULGVXVOUZDHQ-UHFFFAOYSA-N 492.919 5.299 5 20 JKBD Cc1cccc(-c2nc(CC(=O)O[C@H](C)C(=O)Nc3ccc([N+](=O)[O-])cc3C(F)(F)F)cs2)c1 17229828 QOOXYZPMVRTISY-CYBMUJFWSA-N 493.463 5.158 5 20 JKBD Cc1ccc(-n2c(S[C@H](C)c3nnc(-c4ccc([N+](=O)[O-])cc4)o3)nc3ccccc3c2=O)cc1C 17532841 CBUJLQJDISMXTB-QGZVFWFLSA-N 499.552 5.814 5 20 JKBD COc1ccc(CN(C)C(=O)c2ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])c(OC)c2)cc1 18096030 IMJOKVZDEHRSIG-UHFFFAOYSA-N 456.882 5.330 5 20 JKBD O=C(Nc1ccc(Cl)c(-c2nnc3n2CCCCC3)c1)c1ccc(NC2CC2)c([N+](=O)[O-])c1 105746353 OPYGWZCGHSVPHH-UHFFFAOYSA-N 466.929 5.060 5 20 JKBD CC1CCN(c2ccc([N+](=O)[O-])cc2C(=O)N(C)CCCc2cc(-c3cccc(F)c3)n[nH]2)CC1 108570136 XWNROWIZZXSYCP-UHFFFAOYSA-N 479.556 5.065 5 20 JKBD C[C@H]1CN(C(=O)c2ccccc2NC(=O)c2ccc([N+](=O)[O-])cc2Cl)C[C@H](c2ccccc2)O1 109046427 BYOYAVBTKNTFHZ-QMHKHESXSA-N 479.920 5.103 5 20 JKBD CN(CC(F)(F)F)C(=O)c1c2c(nc3ccccc13)/C(=C\c1cccc([N+](=O)[O-])c1)CCC2 485317284 KETRXAZEUHMJJV-VBKFSLOCSA-N 455.436 5.654 5 20 JKBD O=C(Nc1ccccn1)c1cccc(NC(=O)c2cc([N+](=O)[O-])ccc2Oc2ccccc2)c1 505829322 DOVKDEUUQGSPBC-UHFFFAOYSA-N 454.442 5.287 5 20 JKBD C[C@H](Nc1ccc(C(=O)N[C@H](C(=O)Nc2ccccc2)c2ccccc2)cc1[N+](=O)[O-])c1ccccn1 508854894 IBRDRLJSWUQKBW-SIBVEZHUSA-N 495.539 5.273 5 20 JKBD COc1cc([C@@H](C)NC(=O)CSc2ccc(C(F)(F)F)cc2[N+](=O)[O-])ccc1OC(C)C 509326231 WVEQHYSYDMIUBQ-CYBMUJFWSA-N 472.485 5.379 5 20 JKBD COc1cc(C)ccc1Oc1ccc(F)cc1NC(=O)C1CCN(c2ccccc2[N+](=O)[O-])CC1 512831051 ASRAOVSHPDMSLP-UHFFFAOYSA-N 479.508 5.698 5 20 JKBD Cc1cccc(-c2nnc(SCc3nc(-c4ccc([N+](=O)[O-])cc4)no3)n2Cc2ccco2)c1 514458854 WBORRERZSPXEJB-UHFFFAOYSA-N 474.502 5.145 5 20 JKBD COc1cc([C@@H](C)N[C@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2ccccc2)cc(OC)c1OC 515516942 LHHPXQMOSDISJT-CMJOXMDJSA-N 499.951 5.305 5 20 JKBD CCCC(=O)Nc1cccc(CN[C@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2ccccc2)c1 515524537 IPSPNYYKLCLTRH-DEOSSOPVSA-N 480.952 5.456 5 20 JKBD COc1ccc2c(c1)CCN2C(=O)C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1 521844503 QGSNCGUXNAPBEX-XMHGGMMESA-N 471.538 5.733 5 20 JKBD O=C(c1csc(-c2cccc([N+](=O)[O-])c2)n1)N1CCO[C@H](c2ccc(Cl)c(Cl)c2)C1 524053747 QXCUQPRHUMIDFX-SFHVURJKSA-N 464.330 5.239 5 20 JKBD O=C(C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)NCc1cc(-c2ccccc2)on1 555296787 UPAAOJVQCXEBDY-ZHZULCJRSA-N 496.548 6.107 5 20 JKBD CCC(C)(C)NC(=O)c1ccc(NC(=O)c2cc(OCC(F)(F)F)ccc2[N+](=O)[O-])cc1Cl 603986546 FLMKVSPLVRBLLA-UHFFFAOYSA-N 487.862 5.360 5 20 JKBD CSc1ccc(C(=O)c2ccccc2C(=O)Nc2nnc(-c3ccsc3)s2)cc1[N+](=O)[O-] 604120681 ZTUAZKWFBPXTEB-UHFFFAOYSA-N 482.568 5.380 5 20 JKBD Cc1nc(-c2ccc(F)cc2)sc1[C@@H](C)NC(=O)[C@@H](C)Oc1ccc(Cl)cc1[N+](=O)[O-] 609186358 JIFLOZPKTBOAPU-DGCLKSJQSA-N 463.918 5.464 5 20 JKBD CCOc1ccc(-n2c(Sc3ccc([N+](=O)[O-])c4cnccc34)nnc2-c2ccncc2)cc1 619709062 WFDJREBVDHZQTN-UHFFFAOYSA-N 470.514 5.336 5 20 JKBD Cc1c(C(=O)N(C)CCCCCc2cc(-c3cccc(F)c3)no2)cc([N+](=O)[O-])cc1[N+](=O)[O-] 745822135 FSOMRYNRNKYEPY-UHFFFAOYSA-N 470.457 5.091 5 20 JKBD C[C@@H](OC(=O)c1cn(C)nc1-c1ccc([N+](=O)[O-])cc1)c1ccc(NC(=O)c2ccccc2)cc1 748016257 ILIRJMPBYXYYTN-QGZVFWFLSA-N 470.485 5.166 5 20 JKBD Cc1csc(SCc2ccc(C(=O)OCC3CCN(c4ccc([N+](=O)[O-])cn4)CC3)cc2)n1 750426351 CCKZGHSUZWFTMH-UHFFFAOYSA-N 484.603 5.120 5 20 JKBD C[C@@H]1CCC[C@@H](C)N1C(=O)c1cc(Cl)ccc1NC(=O)c1cc([N+](=O)[O-])ccc1Br 751080938 MZOPVSQYYDZNGR-CHWSQXEVSA-N 494.773 5.666 5 20 JKBD CC1CCN(c2ccc(C(=O)Nc3nc(COc4ccccc4)cs3)cc2[N+](=O)[O-])CC1 884002640 RWGCHLKGHXOVLW-UHFFFAOYSA-N 452.536 5.119 5 20 JKBD CC(C)c1ccc(-c2nc(C(=O)OCC(=O)Nc3cc([N+](=O)[O-])ccc3Cl)cs2)cc1 900225172 OZCPBOWQQLXTSR-UHFFFAOYSA-N 459.911 5.291 5 20 JKBD O=C(Nc1ccc(N2CCOC2=O)cc1)c1ccc(NCc2ccccc2Cl)c([N+](=O)[O-])c1 918386002 FRDDJDMGEANVNG-UHFFFAOYSA-N 466.881 5.069 5 20 JKBD COc1ccc(COC(=O)Cc2csc(-c3ccc(C(F)(F)F)cc3)n2)cc1[N+](=O)[O-] 919050416 GRXHHGKVTLHPAL-UHFFFAOYSA-N 452.410 5.032 5 20 JKBD Cc1cccc(C(C)C)c1NC(=O)[C@@H](C)OC(=O)c1ccc(N[C@@H](C)c2ccccn2)c([N+](=O)[O-])c1 920544881 MYLADRKKTAHFFN-RBUKOAKNSA-N 490.560 5.779 5 20 JKBD O=C(N[C@H](c1ccccc1)c1ccc2nc(C(F)(F)F)[nH]c2c1)c1cc([N+](=O)[O-])ccc1F 921161439 RTUWNUOBULUMNC-LJQANCHMSA-N 458.371 5.148 5 20 JKBD O=C(Cn1ccc2ccc([N+](=O)[O-])cc21)Nc1ccc(C2(NC(=O)[C@H]3CC=CCC3)CCC2)cc1 1786277789 UWTZLZIUYZGNOS-FQEVSTJZSA-N 472.545 5.040 5 20 JKBD O=C(Cc1ccc2ncccc2c1)Nc1ccc(C2(NC(=O)c3cc(F)cc([N+](=O)[O-])c3)CCC2)cc1 1786556850 ISEXWCNAZJIWAP-UHFFFAOYSA-N 498.514 5.273 5 20 JKBD Cc1cc[nH]c1C(=O)Nc1ccc(C2(NC(=O)c3ccc(Br)c([N+](=O)[O-])c3)CCC2)cc1 1787102847 CJMDJLCQJVBJRW-UHFFFAOYSA-N 497.349 5.055 5 20 JKBD Cc1cccc(-c2cnccc2C(=O)Nc2ccc(C3(NC(=O)c4ccc([N+](=O)[O-])o4)CCC3)cc2)c1 1788358540 HYBWHPYMOXHXCB-UHFFFAOYSA-N 496.523 5.620 5 20 JKBD CC(C)[C@H](C(=O)NC1(c2ccc(NC(=O)c3ccc([N+](=O)[O-])[nH]3)cc2)CCC1)c1ccccc1 1790183435 DCOSECJSNQAGHR-QHCPKHFHSA-N 460.534 5.110 5 20 JKBD CCCCCc1ncc(C(=O)Nc2ccc(C3(NC(=O)c4ccc([N+](=O)[O-])o4)CCC3)cc2)s1 1791075521 WVDZYHCAGKWGIG-UHFFFAOYSA-N 482.562 5.439 5 20 JKBD CC(C)[C@@H](C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cc(F)cc([N+](=O)[O-])c2)[nH]n1)c1ccccc1 1814931317 HNDPQUYUVMIITJ-LADGPHEKSA-N 493.539 5.203 5 20 JKBD O=C(c1ccccc1F)N1CCCC[C@@H]1C1CCN(C(=O)C2(c3cccc([N+](=O)[O-])c3)CCC2)CC1 1829879924 XIDNODZFCBPEJC-RUZDIDTESA-N 493.579 5.089 5 20 JKBD Cc1ccc([C@H](C)C(=O)N2CCC([C@H]3CCCCN3C(=O)c3cccc(F)c3[N+](=O)[O-])CC2)cc1 1830623635 XGJLPVOYPGWXJW-YADARESESA-N 481.568 5.079 5 20 JKBD O=C(C[C@H]1C[C@@H]2CC[C@H]1C2)N1CCC([C@H]2CCCCN2C(=O)CSc2ccccc2[N+](=O)[O-])CC1 1831777286 NVISAYVQKJJKDY-CWKRKGSWSA-N 499.677 5.133 5 20 JKBD C[C@H](C(=O)N1CCCC[C@@H]1C1CCN(C(=O)CCc2cccc([N+](=O)[O-])c2)CC1)c1cccs1 1832137702 BZNPQJPDHJCSSY-WMZHIEFXSA-N 483.634 5.012 5 20 JKBD Cc1nn(Cc2ccc(C(=O)N[C@@H](c3ccc(F)cc3)c3cccs3)cc2)c(C)c1[N+](=O)[O-] 9900447 AFZLZDXIHDPTDW-QFIPXVFZSA-N 464.522 5.176 5 20 JKBD CC(C)c1ccc(-c2noc(COC(=O)Cn3c4ccccc4c(=O)c4ccccc43)n2)cc1 10723083 NZMBWKCSCMXFTF-UHFFFAOYSA-N 453.498 5.072 5 20 JKBD CCc1ccc(N(C(C)=O)c2nc(COC(=O)c3ccc(Cl)cc3[N+](=O)[O-])cs2)cc1 10748613 CIKVYBDVFCHGAF-UHFFFAOYSA-N 459.911 5.309 5 20 JKBD O=C(CSc1nc(C(F)(F)F)nc2ccccc12)Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1 22248335 DFICKWQAAIXJMB-UHFFFAOYSA-N 491.476 5.411 5 20 JKBD C[C@@H](Sc1nc2cc3ccccc3cc2c(=O)n1C)C(=O)Nc1ccc(Cl)cc1Cl 22253175 FLGUHFSZDCVPTF-GFCCVEGCSA-N 458.370 5.513 5 20 JKBD O=C(COCc1nc2ccccc2s1)Oc1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2Cl)cc1 29473407 DGQGTYJAROJFSK-UHFFFAOYSA-N 497.916 5.232 5 20 JKBD C[C@H](Sc1nc2cc3ccccc3cc2c(=O)n1C)c1nc(=O)c2c(-c3ccco3)csc2[nH]1 29590333 GXFRDQBGHTVNEE-ZDUSSCGKSA-N 486.578 5.498 5 20 JKBD CCC[C@H]1CCc2nc(NC(=O)c3cc(OC)c(OCc4cscn4)cc3[N+](=O)[O-])sc2C1 68813229 IHBSBCXEWIIUEU-ZDUSSCGKSA-N 488.591 5.253 5 20 JKBD C[C@@H](Nc1ccc(C(=O)N2CCn3cccc3[C@@H]2c2ccccc2)cc1[N+](=O)[O-])c1ccccn1 108940256 RXOWPBYOBAZRCN-BCHFMIIMSA-N 467.529 5.210 5 20 JKBD CC(=O)c1sc(NC(=O)c2csc(-c3cccc([N+](=O)[O-])c3)n2)nc1-c1ccccc1 496311871 NPEACEIEGIZIOM-UHFFFAOYSA-N 450.501 5.297 5 20 JKBD O=C(c1ccc(NCc2ccccc2)c([N+](=O)[O-])c1)N(Cc1cccs1)C[C@@H]1CCCO1 500485139 KTTTXWDZFHCIOP-FQEVSTJZSA-N 451.548 5.090 5 20 JKBD Cn1cnnc1Sc1ccc(C(=O)N2CCC[C@@H]2c2ccc(C(C)(C)C)cc2)cc1[N+](=O)[O-] 502729272 XIIKOMHEBVDTQR-LJQANCHMSA-N 465.579 5.149 5 20 JKBD O=C(Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1)c1cnn(-c2ncccc2Cl)c1C(F)F 503131846 OQQUSLNRMSSSBI-UHFFFAOYSA-N 476.852 5.142 5 20 JKBD CCCOc1ccc(CN[C@@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Br)c2ccccc2)cc1 515758169 DYWLFOZASQNBSA-HSZRJFAPSA-N 498.377 5.616 5 20 JKBD CN(C)C[C@H]1CCCCN1C(=O)C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1 517861745 LHQXEMGGDNYUPN-OHUBLEDJSA-N 464.591 5.078 5 20 JKBD COCCOc1c(Cl)cccc1NC(=O)c1cc([N+](=O)[O-])ccc1NCc1ccccc1 520012089 XGTBRFZYDHZFGA-UHFFFAOYSA-N 455.898 5.138 5 20 JKBD Cc1cc(C(=O)Nc2ccccc2OCc2ncc(-c3cccc(Cl)c3)o2)cc([N+](=O)[O-])c1 524006500 JZBAILJQZJNRMD-UHFFFAOYSA-N 463.877 6.043 5 20 JKBD CCOC(=O)C[C@@H](c1ccccc1)C1CCN(C(=O)Cn2c3ccccc3c(=O)c3ccccc32)CC1 603932851 XSCNSKWSQXLADC-SANMLTNESA-N 496.607 5.130 5 20 JKBD CC(=O)N(c1ccc(F)cc1)c1nc(/C=C\c2nc3cc([N+](=O)[O-])ccc3n2-c2ccccc2)cs1 603945825 QMUJLPZNHFGMNP-ZROIWOOFSA-N 499.527 6.384 5 20 JKBD COc1cccc(C[C@H]2CCCN2C(=O)C2CCN(c3ccc(C(F)(F)F)cc3[N+](=O)[O-])CC2)c1 604010214 SOJZIABEOOIATA-HXUWFJFHSA-N 491.510 5.072 5 20 JKBD C[C@H](Nc1ccc(NC(=O)c2cc3c(cc2[N+](=O)[O-])OCCO3)cc1Cl)c1ccccc1 609072149 JTCCJHMVDNCUMM-AWEZNQCLSA-N 453.882 5.445 5 20 JKBD COc1ccccc1[C@@H](NC(=O)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-])c1ccccc1 609374191 ITOXOPTVAVSDGQ-NRFANRHFSA-N 460.408 5.064 5 20 JKBD C[C@H](Nc1ccc(C(=O)N2CCCC[C@@H]2[C@H](C)NC(=O)OC(C)(C)C)cc1[N+](=O)[O-])c1ccccn1 727376859 DKRBVNXAQDUACI-NPPFBWRTSA-N 497.596 5.071 5 20 JKBD O=C(CSc1nnc(-c2cccs2)n1C1CC1)Oc1ccc(-c2ccccc2)cc1[N+](=O)[O-] 728768379 DFWOXLYHUDTCNV-UHFFFAOYSA-N 478.555 5.614 5 20 JKBD CC(C)(C)OC(=O)Nc1ccc(NC(=O)c2ccn(-c3cccc([N+](=O)[O-])c3)n2)c(C(F)(F)F)c1 729655085 LCZVNALWKWEAFS-UHFFFAOYSA-N 491.426 5.399 5 20 JKBD CC1=C(C(=O)Nc2ccccc2C)[C@@H](c2ccc(Cl)c([N+](=O)[O-])c2)NC(=O)N1Cc1cccs1 732041931 XGJCQNZAMIZOJP-JOCHJYFZSA-N 496.976 5.797 5 20 JKBD C[C@H](OC(=O)c1csc(-c2ccc([N+](=O)[O-])cc2)n1)c1cccc(NC(=O)c2ccccc2)c1 747954936 OUGYIQJPTBXGQR-INIZCTEOSA-N 473.510 5.889 5 20 JKBD C[C@H](SCc1nc(O)c2c(-c3ccccc3)csc2n1)C(=O)O[C@@H](C)c1ccccc1[N+](=O)[O-] 749053891 HOKKDLZPNFJARV-GJZGRUSLSA-N 495.582 5.898 5 20 JKBD Cc1ccc(-c2nc(CC(=O)Oc3ccc(NC(=O)c4cc([N+](=O)[O-])ccc4Cl)cc3)cs2)o1 914711832 OXMGVGMWCLUFOB-UHFFFAOYSA-N 497.916 5.674 5 20 JKBD Cc1ccc(NS(=O)(=O)c2ccc(C)c(NC(=S)Nc3ccc([N+](=O)[O-])cc3)c2)c(C)c1 916115903 KRZOTOJLRNFTBI-UHFFFAOYSA-N 470.576 5.130 5 20 JKBD O=C(Nc1nc2ccccc2n1C1CCCCC1)c1cc([N+](=O)[O-])ccc1I 916467948 DQAZLIBDYHRCEZ-UHFFFAOYSA-N 490.301 5.307 5 20 JKBD CC(C)COC1CCN(C(=O)c2cc([N+](=O)[O-])ccc2N2CCC(Cc3ccccc3)CC2)CC1 917833326 HVLQEMGPLUSMOR-UHFFFAOYSA-N 479.621 5.331 5 20 JKBD O=C(OCc1nc(-c2ccc([N+](=O)[O-])cc2)no1)c1nc(Cl)c(Cl)c(Cl)c1Cl 918806243 FAXOQTUHZVQNET-UHFFFAOYSA-N 464.048 5.010 5 20 JKBD C[C@H](C(=O)NC1(c2ccc(NC(=O)c3ccc([N+](=O)[O-])o3)cc2)CCC1)c1ccc(Cl)cc1 1785748767 PWBMBWDQLVUCFJ-HNNXBMFYSA-N 467.909 5.393 5 20 JKBD O=C(Cc1cc(F)ccc1[N+](=O)[O-])NC1(c2ccc(NC(=O)c3cc4ccccc4o3)cc2)CCC1 1789007248 BPQIGBNJNLWECW-UHFFFAOYSA-N 487.487 5.471 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)C3(c4cccc([N+](=O)[O-])c4)CCC3)CCC2)cc1)[C@@H]1CCCS1 1792014006 KSGHZMLXAHCXNL-QFIPXVFZSA-N 479.602 5.046 5 20 JKBD Cc1c(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3ccc([N+](=O)[O-])cc3F)CC2)oc2ccccc12 1828128612 WVQRKICPPSDXSE-HSZRJFAPSA-N 493.535 5.336 5 20 JKBD O=C([C@@H]1CC=CCC1)N1CCC([C@@H]2CCCCN2C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)CC1 1831059991 MFCRTKVQUJRRLQ-KNQAVFIVSA-N 481.618 5.399 5 20 JKBD CC(C)c1nnc(S[C@@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2C(F)(F)F)n1Cc1ccco1 10932623 LBVSSJFAASLJON-LBPRGKRZSA-N 483.472 5.089 5 20 JKBD COc1ccc(NC(=O)[C@H](OC(=O)Cn2c3ccccc3c(=O)c3ccccc32)c2ccccc2)cc1 11278948 FRYVZRVYFLDOKJ-GDLZYMKVSA-N 492.531 5.087 5 20 JKBD Cc1cc(C)c(NC(=O)C2CCN(c3ccc(C(F)(F)F)cc3[N+](=O)[O-])CC2)c(Cl)c1 14669243 GGUCHCVFPSABOP-UHFFFAOYSA-N 455.864 5.739 5 20 JKBD COCCN(C(=O)c1cccc(C(F)(F)F)c1)c1nc(-c2ccc([N+](=O)[O-])cc2)cs1 14790539 GAXRRPRLZDZITN-UHFFFAOYSA-N 451.426 5.030 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Cl)[C@@H](NCc1ccc(OCC(F)(F)F)cc1)c1ccccc1 23630538 RKOYSKFFIUYJRV-NRFANRHFSA-N 493.869 5.659 5 20 JKBD O=C1c2ccccc2N[C@H](c2cn(-c3ccccc3)nc2-c2ccc([N+](=O)[O-])cc2)N1C1CC1 24099184 USBZQDVFWPNSBY-VWLOTQADSA-N 451.486 5.176 5 20 JKBD CCOCc1ccccc1CN[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Br)c1ccccc1 26996499 RCEJVXAFNXHOJQ-HSZRJFAPSA-N 498.377 5.363 5 20 JKBD COc1cc(C(=O)N2CCC(c3c[nH]c4ccccc34)CC2)c([N+](=O)[O-])cc1OCc1cscn1 108904820 CVGJSOXDTKJKPW-UHFFFAOYSA-N 492.557 5.140 5 20 JKBD COc1cc(F)c(NC(=O)C/C(=C\c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)cc1OC 410025120 HULBVRBLEXEDBQ-LFIBNONCSA-N 493.516 5.930 5 20 JKBD C[C@@H](Nc1ccc(C(=O)N2CCC[C@@H]2c2ccccc2Cl)cc1[N+](=O)[O-])c1ccccn1 410083523 AWFYVNVXIYFZGX-OPAMFIHVSA-N 450.926 5.794 5 20 JKBD C[C@@H](NC(=O)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-])c1nc(-c2ccccc2)cs1 410289181 SZDULKFABMBAMO-GFCCVEGCSA-N 451.426 5.150 5 20 JKBD COc1ccc(NC(=O)[C@@H](C)Sc2ccc([N+](=O)[O-])cc2)cc1NC(=O)c1cccc(F)c1 482467932 TYYIVSPLUIUTJO-CQSZACIVSA-N 469.494 5.114 5 20 JKBD COc1ccc(Oc2ccc([N+](=O)[O-])cc2C(=O)Nc2ccc(Cl)c(C(=O)NC3CC3)c2)cc1 488459669 OJOLFIKKGPTZMT-UHFFFAOYSA-N 481.892 5.194 5 20 JKBD COc1ccc2ccccc2c1CN[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1 493476830 DVWVTBVRZMDQOP-RUZDIDTESA-N 475.932 5.880 5 20 JKBD COCc1cccc(NC(=O)C/C(=C\c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)c1 499984710 WQPBDMGFDYVGNE-CPNJWEJPSA-N 459.527 5.920 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1)c1cnn(-c2ncc(C(F)(F)F)cc2Cl)c1C(F)(F)F 503090816 REYUWSWOMBZGFJ-UHFFFAOYSA-N 479.724 5.119 5 20 JKBD C[C@@H](Nc1ccc(C(=O)Nc2ccccc2NC(=O)c2ccccc2)cc1[N+](=O)[O-])c1ccccn1 506246539 PXAIALZKXOTGMF-GOSISDBHSA-N 481.512 5.668 5 20 JKBD C[C@H]1CCCN(Cc2csc(NC(=O)c3ccc(N[C@@H](C)c4ccccn4)c([N+](=O)[O-])c3)n2)C1 507161848 SVIHHYUEJSWJDO-IRXDYDNUSA-N 480.594 5.104 5 20 JKBD O=C(Cn1c2ccccc2c(=O)c2ccccc21)NCC1(c2ccc(Cl)cc2Cl)CCOCC1 508798054 YJNWUJOSSJBZQO-UHFFFAOYSA-N 495.406 5.326 5 20 JKBD COc1cc(C(=O)Nc2ccc(-c3csc(C)n3)cc2)c([N+](=O)[O-])cc1OCc1cscn1 509862699 GDJRQJSZQGMBKB-UHFFFAOYSA-N 482.543 5.323 5 20 JKBD COc1ccc(NC(=O)N(C)Cc2ccccc2[N+](=O)[O-])cc1NC(=O)c1ccc(Cl)cc1F 511437579 JNSHVKLEFNMGMX-UHFFFAOYSA-N 486.887 5.312 5 20 JKBD COc1cc(CNC2CCN(Cc3ccccc3C)CC2)ccc1OCc1ccc([N+](=O)[O-])cc1 512819980 FSAIQRYIMUVSKU-UHFFFAOYSA-N 475.589 5.245 5 20 JKBD CSc1ccc(C(=O)c2ccccc2C(=O)Nc2cc3c(cc2Cl)OCCO3)cc1[N+](=O)[O-] 515201813 ZTNWBAAKDVMNIT-UHFFFAOYSA-N 484.917 5.225 5 20 JKBD COc1cc(C(=O)NCCc2c(C)cc(C(C)(C)C)cc2C)c([N+](=O)[O-])cc1OCc1cscn1 517718698 ACUDZWSPYDPBOI-UHFFFAOYSA-N 497.617 5.526 5 20 JKBD COc1cc(C(=O)C(c2nc3ccccc3s2)c2nc3ccccc3s2)ccc1[N+](=O)[O-] 523974852 YZZMZDNKGFLLFH-UHFFFAOYSA-N 461.524 5.838 5 20 JKBD Cc1c(C(=O)Nc2cc(OCC(F)(F)F)cc(OCC(F)(F)F)c2)cccc1[N+](=O)[O-] 585732261 MDRDHKGSQMMNFM-UHFFFAOYSA-N 452.307 5.038 5 20 JKBD Cc1nn(C)c(C)c1CCC(=O)Nc1cc([N+](=O)[O-])ccc1Nc1cccc(C(F)(F)F)c1 589209125 YPBRHVKFWUNQRG-UHFFFAOYSA-N 461.444 5.279 5 20 JKBD Cc1cc(C(=O)N(C[C@H]2CCCO2)c2nc(-c3cccc(C(F)(F)F)c3)cs2)ccc1[N+](=O)[O-] 592950396 OLNNTBNKLSGENS-GOSISDBHSA-N 491.491 5.871 5 20 JKBD Cc1csc(Sc2ccc(C(=O)Nc3cc(Cl)ccc3N3CCOCC3)cc2[N+](=O)[O-])n1 603457454 DUPUDKFOKOJZEH-UHFFFAOYSA-N 490.994 5.253 5 20 JKBD CSc1ccc(C(=O)c2ccccc2C(=O)NCc2ccc3ccccc3n2)cc1[N+](=O)[O-] 603638374 NMOCRLWNDFSDDZ-UHFFFAOYSA-N 457.511 5.026 5 20 JKBD C[C@@H]1CCCCN1C(=O)c1ccc(NC(=O)C2CCN(c3ccccc3[N+](=O)[O-])CC2)cc1Cl 603988061 YRMILKMATCUBFQ-QGZVFWFLSA-N 484.984 5.118 5 20 JKBD COc1ccc([C@@H](NCc2ccc(-c3ccc([N+](=O)[O-])cc3Br)o2)C2CC2)cc1 608835910 XSSCBDDGSWROKB-QFIPXVFZSA-N 457.324 5.867 5 20 JKBD CCOC(=O)N(C)C1CCN(C(=O)c2cc([N+](=O)[O-])ccc2Sc2ccc(Cl)cc2)CC1 726953935 JZUVIVOVNQKOBD-UHFFFAOYSA-N 477.970 5.092 5 20 JKBD COc1ccc(-c2nn(-c3ccccc3)cc2C(=O)Nc2ccc([N+](=O)[O-])c(Cl)c2)c(OC)c1 727711560 KQRYVTRZLMSVHQ-UHFFFAOYSA-N 478.892 5.370 5 20 JKBD COc1ccc(CSCC(=O)N2CCC[C@H]2c2ccccc2C(F)(F)F)cc1[N+](=O)[O-] 728034779 FXELJZRLTRVYSK-KRWDZBQOSA-N 454.470 5.219 5 20 JKBD CCN(C(=O)c1ccc(Br)c([N+](=O)[O-])c1)[C@@H](c1cccnc1)c1ccc(F)c(F)c1 729244771 HJOABNRKJRRXNF-HXUWFJFHSA-N 476.277 5.282 5 20 JKBD Cc1ccc([N+](=O)[O-])cc1C(=O)OCC(=O)N1c2ccccc2Sc2ccc(Cl)cc21 742995890 WHIRGXNYJFIFMC-UHFFFAOYSA-N 454.891 5.543 5 20 JKBD Cc1nc(-c2cccc(NC(=O)c3ccccc3C(=O)c3ccc(N(C)C)c([N+](=O)[O-])c3)c2)[nH]c1C 746883901 KXVQQSSBMVHAGR-UHFFFAOYSA-N 483.528 5.151 5 20 JKBD CN(C(=O)C(C)(C)C)c1ccc(OC(=O)CCNc2ccc(C(F)(F)F)cc2[N+](=O)[O-])cc1 750693814 GZNPPBBYFAVONJ-UHFFFAOYSA-N 467.444 5.030 5 20 JKBD O=C(Nc1cccc(COCC(F)(F)C(F)F)c1)c1cc([N+](=O)[O-])ccc1Br 751097007 WQXJNEQSIHAGKH-UHFFFAOYSA-N 465.197 5.027 5 20 JKBD C[C@@H](OC(=O)c1cc(-c2cccnc2)nc2ccccc12)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 813319633 MNIWVHSYOFBPQB-OAHLLOKOSA-N 467.441 5.173 5 20 JKBD Cc1ccc(NC(=O)Cc2noc(-c3ccc(Oc4ccc(Cl)cc4[N+](=O)[O-])cc3)n2)cc1 904253204 IDXFKZVRUJHOLZ-UHFFFAOYSA-N 464.865 5.580 5 20 JKBD COc1cc2c(cc1OC)[C@H](c1cccs1)N(C(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1)CC2 915309022 KCYPMRKCRCEKGM-OAQYLSRUSA-N 473.938 5.507 5 20 JKBD C[C@H](Sc1ccc(Br)cc1)C(=O)O[C@H](C)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl 919468177 JQFYQOKDBKLXCO-MNOVXSKESA-N 487.759 5.062 5 20 JKBD Cc1csc(SCc2c(C(=O)NCCc3ccc([N+](=O)[O-])cc3)oc3ccccc23)n1 919759373 XWJXMCPCVJOBEZ-UHFFFAOYSA-N 453.545 5.371 5 20 JKBD O=C(OCc1nnc(-c2ccc([N+](=O)[O-])cc2)o1)c1cc2ccc(OCc3ccccc3)cc2[nH]1 920657984 PYAYRYVLALYGOL-UHFFFAOYSA-N 470.441 5.062 5 20 JKBD C[C@H](Cc1cccc(F)c1)C(=O)Oc1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2Cl)cc1 920999222 OSQXSVSCWZDFEJ-CQSZACIVSA-N 456.857 5.424 5 20 JKBD O=C(NC1(c2ccc(NC(=O)c3cccc4ccccc34)cc2)CCC1)c1ccc([N+](=O)[O-])[nH]1 1788897015 LZOPZBMUXKPDEF-UHFFFAOYSA-N 454.486 5.138 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)[C@@H]3C[C@H]3C3CC3)CCC2)cc1)c1cccc([N+](=O)[O-])c1Br 1790636799 SDMLASFZWODYHT-RBUKOAKNSA-N 498.377 5.151 5 20 JKBD CCN1CCC(C(=O)Nc2ccc(C3(NC(=O)c4cc(Cl)cc([N+](=O)[O-])c4C)CCC3)cc2)CC1 1792357589 QRFKISCKOYSHJX-UHFFFAOYSA-N 499.011 5.036 5 20 JKBD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(-c2ccc(Cl)cc2)o1)c1cc(F)cc([N+](=O)[O-])c1 1796964760 DVZYAYNSTYFYCC-ACDBMABISA-N 497.910 5.213 5 20 JKBD CC(C)Oc1ccc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)/C=C/c2ccccc2[N+](=O)[O-])C3)cc1Cl 1800315901 WPKBJLSHVQVZQM-LGMYYNHISA-N 497.979 5.001 5 20 JKBD Cc1cc(CCCC(=O)N2CCCC[C@@H]2c2cc(NC(=O)CC(C)(C)C)n[nH]2)c([N+](=O)[O-])cc1F 1816753969 BFIDVFJQKGJLMG-HXUWFJFHSA-N 487.576 5.217 5 20 JKBD CC(C)[C@H]1CC[C@H](C(=O)N2CCCC[C@@H]2c2cc(NC(=O)c3cccc(F)c3[N+](=O)[O-])n[nH]2)CC1 1821175034 SCSBVLXVQUVBNF-CBGDNZLLSA-N 485.560 5.225 5 20 JKBD O=C(c1sccc1Cl)N1CCC([C@H]2CCCCN2C(=O)CCc2cccc([N+](=O)[O-])c2)CC1 1824841415 IUAGYDUIDPFQQL-OAQYLSRUSA-N 490.025 5.176 5 20 JKBD CC(C)=CCCC(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)CC1 1831060886 KQDGUXGLVKCWFF-QFIPXVFZSA-N 483.634 5.789 5 20 JKBD COC1(CC(=O)N2CCC([C@H]3CCCCN3C(=O)c3cc4cc([N+](=O)[O-])ccc4s3)CC2)CCC1 1831061256 CRSIONFJTKEHIR-OAQYLSRUSA-N 499.633 5.002 5 20 JKBD O=C(c1cccc2c1oc1ccccc12)N1CC2(CCCN2C(=O)/C=C/c2ccccc2[N+](=O)[O-])C1 1847058392 ISLJSNHARBSZEE-BUHFOSPRSA-N 481.508 5.025 5 20 JKBD COc1cc(CSc2nnc(-c3cccc(Br)c3)o2)c([N+](=O)[O-])cc1OC(F)F 11012462 PLIAOJCVFUCVOE-UHFFFAOYSA-N 488.266 5.310 5 20 JKBD O=C(Nc1cccc(C(F)(F)F)c1)c1cccc(NC(=O)c2ccc(-n3ccnc3)c([N+](=O)[O-])c2)c1 14907640 HZEGNSCVDORDEJ-UHFFFAOYSA-N 495.417 5.304 5 20 JKBD Cc1ccc(-c2csc3ncnc(S[C@@H](C)c4nnc(-c5ccc([N+](=O)[O-])cc5)o4)c23)cc1 16048716 UCUICOMEXUCVOB-AWEZNQCLSA-N 475.555 6.478 5 20 JKBD Cc1c(NC(=O)CSc2nnc(-c3ccccc3F)n2-c2ccc(F)cc2)cccc1[N+](=O)[O-] 22408688 PEBWDVODVBXIGY-UHFFFAOYSA-N 481.484 5.160 5 20 JKBD CCCn1c(SCCC(=O)Nc2cc([N+](=O)[O-])ccc2OC)nnc1-c1ccc(Cl)cc1 26224669 DEEMUCKZMNJYQD-UHFFFAOYSA-N 475.958 5.046 5 20 JKBD Cc1sc(C(=O)N[C@H](c2ccccc2)c2ccc3nc(C(F)(F)F)[nH]c3c2)cc1[N+](=O)[O-] 32451691 LYQLIWCGSSFCRQ-GOSISDBHSA-N 460.437 5.379 5 20 JKBD Cc1csc(Sc2ccc(C(=O)Nc3cccc(Cn4cccn4)c3)cc2[N+](=O)[O-])n1 32467142 LLIFQUWWQHVKLE-UHFFFAOYSA-N 451.533 5.008 5 20 JKBD C[C@@H](Sc1nc2ccccc2c(=O)n1C1CCCC1)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl 36795722 QEBIXCOUYKZAFA-CYBMUJFWSA-N 472.954 5.193 5 20 JKBD Cc1sc(NC(=O)c2sc3nc4n(c(=O)c3c2C)CCCCC4)nc1-c1cccc([N+](=O)[O-])c1 195703792 HAWXNSJRNHSBPP-UHFFFAOYSA-N 495.586 5.085 5 20 JKBD Cc1noc(C)c1CCNC(=O)C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1 410307548 LSGHAQSIGKNGDB-AQTBWJFISA-N 462.531 5.099 5 20 JKBD O=C(C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)N1CC[C@@H]1c1ccccc1 478840340 ZRYABMJOHFCKQZ-VVMUCNELSA-N 455.539 6.109 5 20 JKBD COc1cc(C)ccc1Oc1ccc(NC(=O)c2cc(SC)c(OC)cc2[N+](=O)[O-])cc1F 483373091 JHNVNKUUTHHKQH-UHFFFAOYSA-N 472.494 5.826 5 20 JKBD Cc1ccc(NS(=O)(=O)c2ccc(N[C@H](c3ccccc3)c3cccnc3)c([N+](=O)[O-])c2)c(C)c1 488014714 NLZBIYKMOCGTPY-AREMUKBSSA-N 488.569 5.609 5 20 JKBD CCCCc1ccc(N(C(=O)CCn2cc([N+](=O)[O-])nc2C)c2nc3ccccc3s2)cc1 488274898 WITOUKPXKUCWKG-UHFFFAOYSA-N 463.563 5.807 5 20 JKBD CN(C(=O)c1cccc(NC(=O)c2cc(OCC(F)(F)F)ccc2[N+](=O)[O-])c1)c1ccccc1 488975226 NWBGTYUGXNJOGN-UHFFFAOYSA-N 473.407 5.065 5 20 JKBD CC(=O)Nc1cccc2c1CCCN2C(=O)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1 491194578 CIZCRJRADVGXRW-UHFFFAOYSA-N 465.893 5.592 5 20 JKBD CCOc1cc(C(=O)Nc2nc(-c3c(F)cc(F)cc3F)c(C)s2)c([N+](=O)[O-])cc1OC 504739138 BLQLCPMGVKPRHN-UHFFFAOYSA-N 467.425 5.104 5 20 JKBD CN(C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)[C@@H]1CCSc2ccc(Br)cc21 508259144 XKZFNJDBGDIBCZ-OAHLLOKOSA-N 456.749 5.712 5 20 JKBD COc1cc(C(=O)NCc2cnc3ccccc3c2)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 508981517 ZLQGOJBBOTXZJE-UHFFFAOYSA-N 463.877 5.527 5 20 JKBD COc1ccccc1NC(=O)Nc1cc(NC(=O)c2cc(SC)ccc2[N+](=O)[O-])ccc1OC 509429278 HHCRBQWAKLALDV-UHFFFAOYSA-N 482.518 5.230 5 20 JKBD COc1cc(C(=O)Nc2nc3c(ccc4ccccc43)s2)c([N+](=O)[O-])cc1OCc1cscn1 512375807 YMLASVYYQHTHFY-UHFFFAOYSA-N 492.538 5.654 5 20 JKBD O=[N+]([O-])c1ccc(-c2noc(CSc3nnc(Cc4cccs4)n3-c3ccccc3)n2)cc1 514458417 KSHJTKQQLYCOGD-UHFFFAOYSA-N 476.543 5.170 5 20 JKBD Cc1ccc([N+](=O)[O-])cc1C(=O)Nc1ccc(NC(=O)c2ccccc2F)cc1C(F)(F)F 519102571 FPGHNEDBBPJVQV-UHFFFAOYSA-N 461.371 5.566 5 20 JKBD O=C(C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)N(Cc1ccncc1)C1CC1 520063388 KVXJDQQMLLWGTD-HMMYKYKNSA-N 470.554 5.721 5 20 JKBD Cc1ccc2nc([C@H]3CCCN3C(=O)c3ccc(N[C@@H](C)c4ccccn4)c([N+](=O)[O-])c3)[nH]c2c1 522040623 MCRUFBRDZKKXJK-GAJHUEQPSA-N 470.533 5.325 5 20 JKBD CCOCc1cccc(N[C@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Br)c2ccccc2)c1 522623526 UJTJGJYXNVKKAR-QFIPXVFZSA-N 484.350 5.686 5 20 JKBD CC(=O)N1CCCc2cc(NC(=O)c3cc([N+](=O)[O-])ccc3Sc3ccc(Cl)cc3)ccc21 522816329 OPVBTFIOMJOBIR-UHFFFAOYSA-N 481.961 5.951 5 20 JKBD CCOc1ccc([C@H](C)N[C@@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2ccccc2)cc1OC 603598537 JFQHFYOPRFZLFW-UPCLLVRISA-N 483.952 5.686 5 20 JKBD Cc1occc1C(=O)Nc1cc(NC(=O)c2cc(OCC(F)(F)F)ccc2[N+](=O)[O-])ccc1F 603690719 UPNYGGPBPFJNOW-UHFFFAOYSA-N 481.358 5.081 5 20 JKBD COc1cc(CNC[C@H]2CCN(c3ccc(F)c(F)c3)C2)ccc1OCc1ccc([N+](=O)[O-])cc1 608782068 QJNSLMJISJIAAQ-HXUWFJFHSA-N 483.515 5.077 5 20 JKBD O=C1CCCN1C[C@@H](NCc1ccc(-c2ccc([N+](=O)[O-])cc2Br)o1)c1ccccc1 608836062 JBYBUEFOLPSBNA-OAQYLSRUSA-N 484.350 5.071 5 20 JKBD Cc1cc(OCc2cccc(F)c2)ccc1NC(=O)c1ccc(Cn2nc(C)c([N+](=O)[O-])c2C)cc1 609064974 VUBYMFIAWKIHLN-UHFFFAOYSA-N 488.519 5.735 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)Nc2ccccc2C(=O)Nc2ccc(Cl)cc2)cc1SC 728462733 SBNSJQFLRJRFRJ-UHFFFAOYSA-N 471.922 5.483 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)OCC(=O)Nc2c(Cl)cc(Cl)cc2Cl)cc1SC 728651367 TYACYWYUCJPVTO-UHFFFAOYSA-N 479.725 5.081 5 20 JKBD O=C(O[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1)c1cccc(C(F)F)c1 729747205 UBYFOTQYKHQODZ-IBGZPJMESA-N 460.820 5.723 5 20 JKBD O=C(OCc1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[C@H](Oc1ccc(F)c(Cl)c1)c1ccccc1 730646411 UEZIGYATEQMGGY-OAQYLSRUSA-N 483.839 5.301 5 20 JKBD O=C(C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)NCc1ccc(-n2ccnc2)nc1 914723734 XRMFZVLJOFBNGW-DEDYPNTBSA-N 496.552 5.032 5 20 JKBD CCc1ccccc1N(C(C)=O)c1nc(COC(=O)[C@H](C)Sc2ccc([N+](=O)[O-])cc2)cs1 916522892 SSKVEDZIPHUUBW-HNNXBMFYSA-N 485.587 5.522 5 20 JKBD O=[N+]([O-])c1cc(C(F)(F)F)cc([N+](=O)[O-])c1NC1CCN(c2ccc(C(F)(F)F)cn2)CC1 917067668 RWGYXOCAVFQNNT-UHFFFAOYSA-N 479.337 5.017 5 20 JKBD Cc1ccc(C)c(OCC(=O)NC2(c3ccc(NC(=O)/C=C/c4ccc([N+](=O)[O-])o4)cc3)CCC2)c1 1786205834 RLJMOOHFHBYNQM-ZRDIBKRKSA-N 489.528 5.031 5 20 JKBD CNc1ccc(C(=O)NC2(c3ccc(NC(=O)c4c(F)ccc([N+](=O)[O-])c4C)cc3)CCC2)cc1 1790770525 GJEMRBDCLPYJGN-UHFFFAOYSA-N 476.508 5.146 5 20 JKBD Cc1ccc(C(=O)NC2(c3ccc(NC(=O)c4c(F)ccc([N+](=O)[O-])c4C)cc3)CCC2)o1 1790771170 UTJSLIPRTCDOTC-UHFFFAOYSA-N 451.454 5.005 5 20 JKBD O=C(Nc1cc([C@H]2CCCCN2C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)[nH]n1)C1CCCCC1 1816709004 ZEQUYYHINZCJDS-LJQANCHMSA-N 481.578 5.419 5 20 JKBD Cc1cc(CCCC(=O)N2CCCC[C@@H]2c2cc(NC(=O)[C@H]3CC=CCC3)n[nH]2)c([N+](=O)[O-])cc1F 1820825476 IECPUYXRLWMKHP-PGRDOPGGSA-N 497.571 5.137 5 20 JKBD O=C(c1cccc(F)c1Cl)N1CCC([C@H]2CCCCN2C(=O)c2cccc(F)c2[N+](=O)[O-])CC1 1830621712 RLNUJZCHQOBFKC-HXUWFJFHSA-N 491.922 5.074 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cc3ccsc3[nH]2)CC1 1830728875 GZOZAQQTYHSJNI-NRFANRHFSA-N 498.580 5.132 5 20 JKBD C[C@@H](Sc1nnc(-c2ccc(Br)cc2)[nH]1)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 17673519 UZSRMRSBBGBDRI-SNVBAGLBSA-N 473.312 5.046 5 20 JKBD O=C1CSc2ccc(NC(=O)c3ccc(Sc4nc5ccccc5s4)c([N+](=O)[O-])c3)cc2N1 24295334 KMRZMNRCRXNOPH-UHFFFAOYSA-N 494.579 5.652 5 20 JKBD CCOc1ccc([C@H](C)NC(=O)C2CCN(c3ccc(C(F)(F)F)cc3[N+](=O)[O-])CC2)cc1 24830342 AJXQKYQBKGZAFS-HNNXBMFYSA-N 465.472 5.106 5 20 JKBD CC[C@@H](NC(=O)CSc1nc2cc3ccccc3cc2c(=O)n1C)c1ccc(Cl)cc1 26580840 ZWIVXOXKISSAQW-HXUWFJFHSA-N 451.979 5.100 5 20 JKBD Cc1csc(Sc2ccc(C(=O)N3CCC(c4nc5ccccc5[nH]4)CC3)cc2[N+](=O)[O-])n1 29267659 ATBUDHQSGIOQOT-UHFFFAOYSA-N 479.587 5.407 5 20 JKBD CC(=O)NCc1ccc(-c2csc(NC(=O)c3ccc(SCCC(C)C)c([N+](=O)[O-])c3)n2)o1 29355711 XFWNYPOGIXVIMO-UHFFFAOYSA-N 488.591 5.338 5 20 JKBD O=C(Nc1ccc(NC(=O)c2ccco2)c(Cl)c1)c1csc(-c2cccc([N+](=O)[O-])c2)n1 215728999 GSDLULKVKGHBLG-UHFFFAOYSA-N 468.878 5.469 5 20 JKBD O=C(C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)NCCc1c(F)cccc1F 502769667 VNIUEHRWWKJKAD-VKAVYKQESA-N 479.508 5.772 5 20 JKBD C[C@@H](Nc1ccc(C(=O)NCc2csc(-c3ccccc3)n2)cc1[N+](=O)[O-])c1ccccn1 503182574 RBOZYKVUZOGQJP-MRXNPFEDSA-N 459.531 5.216 5 20 JKBD O=C(Nc1nnc(SCc2c(Cl)cccc2Cl)s1)c1ccc([N+](=O)[O-])c(O)c1 510139925 NKYHHWHBDYDHBM-UHFFFAOYSA-N 457.320 5.003 5 20 JKBD CC(C)Oc1ccc([N+](=O)[O-])cc1CSc1nnc(-c2cccs2)n1C[C@@H]1CCCO1 511059063 WWUMRZFEPVWNOM-KRWDZBQOSA-N 460.581 5.173 5 20 JKBD O=C(c1cc([N+](=O)[O-])ccc1Sc1ccccc1)N1CCC(n2c(O)nc3ccccc32)CC1 514368368 OFEWWUCQBCEEPD-UHFFFAOYSA-N 474.542 5.279 5 20 JKBD CCOc1cc(NC(=O)[C@H]2CCCN(C(=O)c3cccc4ccccc34)C2)c([N+](=O)[O-])cc1OCC 514868128 BSKAIEXYWZOUHF-IBGZPJMESA-N 491.544 5.036 5 20 JKBD COc1ccc(CSCC(=O)N2CCc3sccc3[C@@H]2c2cccs2)cc1[N+](=O)[O-] 514901896 OQWJZUOKYRCSTF-OAQYLSRUSA-N 460.602 5.134 5 20 JKBD O=C(NCc1ccc(CN2CCCC2=O)cc1)c1cc([N+](=O)[O-])ccc1Sc1ccc(Cl)cc1 515990859 LXXWCXZBEGKJMK-UHFFFAOYSA-N 495.988 5.452 5 20 JKBD COc1cc(Br)c(CNCc2ccc(-c3ccccc3[N+](=O)[O-])s2)cc1OC 517548314 LHOAQOXFYNFXNE-UHFFFAOYSA-N 463.353 5.393 5 20 JKBD C[C@H](Nc1ccc2c(c1)CCC(=O)N2Cc1ccc(Cl)cc1)C(=O)Nc1cccc([N+](=O)[O-])c1 521046120 KDAAYTHBJVPVNU-INIZCTEOSA-N 478.936 5.167 5 20 JKBD C[C@H](Nc1ccc(C(=O)Nc2c(-c3cccs3)nc3ccccn23)cc1[N+](=O)[O-])c1ccccn1 579273969 AVPAIIMIRZDQBS-INIZCTEOSA-N 484.541 5.791 5 20 JKBD CC(C)Cc1ccc(C(=O)C2CCN(c3ccc([N+](=O)[O-])c(C(=O)N4CCCC4)c3)CC2)cc1 603943958 RLPOHYOPLMCEPV-UHFFFAOYSA-N 463.578 5.129 5 20 JKBD CC(C)CNC(=O)c1ccc(NC(=O)CSc2ccc(C(F)(F)F)cc2[N+](=O)[O-])cc1Cl 604003801 FQPKBPKYMHTJGI-UHFFFAOYSA-N 489.903 5.384 5 20 JKBD C[C@H]1CCC[C@H](C)N1C(=O)c1cc(Cl)ccc1NCc1nc(-c2cccc([N+](=O)[O-])c2)no1 604010098 NOMWLDSIFIEOHL-GJZGRUSLSA-N 469.929 5.313 5 20 JKBD CCCOc1ncccc1CNC(=O)C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1 604441301 PHHXYOGBPISTCL-HKWRFOASSA-N 488.569 5.635 5 20 JKBD C[C@@H]1CCCCN1C(=O)c1ccc(NC(=O)Cn2c3ccccc3c(=O)c3ccccc32)cc1Cl 614889265 KHLPLOLZKIVTNS-GOSISDBHSA-N 487.987 5.461 5 20 JKBD O=C(Cn1c2ccccc2c(=O)c2ccccc21)Nc1ccnn1Cc1ccc(C(F)(F)F)cc1 653577070 OQBFSZJSDUYILJ-UHFFFAOYSA-N 476.458 5.057 5 20 JKBD CC(C)(C)OC(=O)N1CCC(N(C(=O)c2ccc(NCc3ccccc3)c([N+](=O)[O-])c2)C2CC2)CC1 725720361 ZFVMIKTZXXQPTG-UHFFFAOYSA-N 494.592 5.211 5 20 JKBD O=C(COC(=O)[C@@H]1C[C@@H]1c1ccc(Cl)c(Cl)c1)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 727929619 SIULWNSPTAAYJX-VXGBXAGGSA-N 477.222 5.206 5 20 JKBD CCOc1cc(NC(=O)N2CCC[C@H]2c2ccccc2C(F)(F)F)c([N+](=O)[O-])cc1OCC 728116814 AHMOZPURNWJELI-KRWDZBQOSA-N 467.444 5.780 5 20 JKBD C[C@@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)Nc1ccccc1CN(C)C(=O)OC(C)(C)C 742514178 BDRHEMNFUOBBGV-CQSZACIVSA-N 463.918 5.021 5 20 JKBD O=C1CC[C@@H](c2noc(-c3ccccc3Sc3ccccc3[N+](=O)[O-])n2)CN1CC1CCC1 856547062 YZRHQDCPCZAKTK-QGZVFWFLSA-N 464.547 5.302 5 20 JKBD O=C(CSCc1nc(O)c2c(-c3ccccc3)csc2n1)Nc1cc([N+](=O)[O-])c(F)cc1F 897489760 LZQGWNMPODWWIN-UHFFFAOYSA-N 488.497 5.122 5 20 JKBD CSc1ccc(C(=O)c2ccccc2C(=O)N2CCC([C@H](O)c3ccccc3)CC2)cc1[N+](=O)[O-] 914536089 HYVIAOXAZKZLJU-RUZDIDTESA-N 490.581 5.134 5 20 JKBD O=C(Nc1cccc(-c2nnco2)c1)c1cc([N+](=O)[O-])ccc1N1CCC(Cc2ccccc2)CC1 914573503 DIKAGLNKRNHWQG-UHFFFAOYSA-N 483.528 5.356 5 20 JKBD C[C@@H](OC(=O)CNc1ccc(C(F)(F)F)cc1[N+](=O)[O-])c1nc2ccccc2n1C(F)F 917366720 JCLUQHXIVJBWTQ-SNVBAGLBSA-N 458.343 5.075 5 20 JKBD C[C@H](Nc1ccc(C(=O)O[C@@H](C)c2nnc(-c3ccccc3)o2)cc1[N+](=O)[O-])c1ccccn1 920545474 RQSGIESUAVCMQO-HOTGVXAUSA-N 459.462 5.131 5 20 JKBD O=C(O[C@H](C(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1)c1ccccc1)c1cnc(-c2ccccc2)nc1 921215260 VQQVJGJLHSXTQQ-QFIPXVFZSA-N 488.887 5.242 5 20 JKBD CCOc1ccsc1C(=O)Nc1ccc(C2(NC(=O)c3ccc([N+](=O)[O-])c(OC)c3)CCC2)cc1 1785773667 LPIDGUMIFPFPTL-UHFFFAOYSA-N 495.557 5.125 5 20 JKBD O=C(/C=C/c1ccc([N+](=O)[O-])o1)Nc1ccc(C2(NC(=O)c3cccc4nscc34)CCC2)cc1 1786207698 FMFMGFRBURBWKF-PKNBQFBNSA-N 488.525 5.259 5 20 JKBD CC(C)c1cc(C(=O)Nc2ccc(C3(NC(=O)Cc4ccc(Cl)cc4[N+](=O)[O-])CCC3)cc2)on1 1790160732 BSTVXJZYBFSNLI-UHFFFAOYSA-N 496.951 5.350 5 20 JKBD Cc1c(C(=O)NC2(c3ccc(NC(=O)CC[C@H]4CCOC4)cc3)CCC2)cc(Cl)cc1[N+](=O)[O-] 1792026285 VXCWTUUNTSKGRH-KRWDZBQOSA-N 485.968 5.121 5 20 JKBD CC(C)c1ccc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)cc1 1801206674 DHZIWMCQTBRUPV-WKCHPHFGSA-N 477.586 5.499 5 20 JKBD O=C(CCc1cccc([N+](=O)[O-])c1)N1CCCC2(CCN(C(=O)c3csc4c3CCCC4)CC2)C1 1806490443 NEZMPYIFGHJIHU-UHFFFAOYSA-N 495.645 5.013 5 20 JKBD O=C(CSc1ccccc1[N+](=O)[O-])N1CCC2(CCCN(C(=O)c3cc4ccoc4s3)C2)CC1 1810517238 SGRJZELXOPOGEI-UHFFFAOYSA-N 499.614 5.040 5 20 JKBD Cc1cc(Cl)ccc1C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cccc(F)c2[N+](=O)[O-])[nH]n1 1814593550 RTDWZZWLAYBXGU-LJQANCHMSA-N 485.903 5.039 5 20 JKBD Cc1ccc(CC(=O)N2CCCC[C@@H]2c2cc(NC(=O)c3ccccc3C3CC3)n[nH]2)cc1[N+](=O)[O-] 1823134849 LLXTWFHTSKCLIY-HSZRJFAPSA-N 487.560 5.052 5 20 JKBD Cc1c(Cl)cccc1C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2ccc([N+](=O)[O-])cc2F)CC1 1823916553 UTNFMSHBUXYFEK-QHCPKHFHSA-N 487.959 5.243 5 20 JKBD CCCCC[C@@H](C)C(=O)N1CCC([C@H]2CCCCN2C(=O)/C=C/c2ccc([N+](=O)[O-])o2)CC1 1824279374 VNGOBNBJTJWJQH-BKVXWFHVSA-N 459.587 5.037 5 20 JKBD Cc1c(C(=O)N2CCC([C@@H]3CCCCN3C(=O)c3ccccc3)CC2)cc(Cl)cc1[N+](=O)[O-] 1829875487 BPMBLJPAUCQGSM-QFIPXVFZSA-N 469.969 5.104 5 20 JKBD Cc1ccccc1OCc1nnc(SCC(=O)c2ccc([N+](=O)[O-])cc2)n1-c1ccccc1 9372459 QFPLGOZPKHBIBC-UHFFFAOYSA-N 460.515 5.038 5 20 JKBD Cc1ccc(NC(=O)[C@H](Sc2nnc(-c3ccncc3)n2C2CC2)c2ccccc2)c([N+](=O)[O-])c1 11541487 VLRBLSLOJDSXFG-JOCHJYFZSA-N 486.557 5.364 5 20 JKBD C[C@H](OC(=O)CCc1ncc(-c2ccccc2Cl)o1)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl 12253925 XDEFTEHWFHCGFM-LBPRGKRZSA-N 478.288 5.060 5 20 JKBD COc1ccc(C)cc1NC(=O)[C@@H](C)OC(=O)c1ccc(Sc2nc(C)cs2)c([N+](=O)[O-])c1 16903598 JNKKGLCKEBDTJU-CQSZACIVSA-N 487.559 5.012 5 20 JKBD Cc1occc1-c1nnc(SCc2nc(-c3cccc([N+](=O)[O-])c3)no2)n1Cc1ccccc1 31842833 NUBUTTUNPVKSOH-UHFFFAOYSA-N 474.502 5.145 5 20 JKBD O=C(Cc1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1)Nc1nnc(Cc2ccccc2)s1 115231275 QDMDKVZTVAUSQI-UHFFFAOYSA-N 496.552 5.071 5 20 JKBD C[C@@H](SC1=N/C(=C/c2ccccc2)C(=O)N1c1ccc(F)cc1)C(=O)Nc1ccc([N+](=O)[O-])cc1 207432664 HADLEJIRUAYYFJ-QFNCUCFLSA-N 490.516 5.238 5 20 JKBD C[C@H](Nc1ccc(C(=O)NC[C@@H]2CCCO[C@H]2c2ccccc2)cc1[N+](=O)[O-])c1ccccn1 409571664 QZTKDGLXUHGTFL-HMHJJOSWSA-N 460.534 5.061 5 20 JKBD CC(C)NC(=O)c1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2Sc2ccc(Cl)cc2)cc1 489420476 DBSWKWDGSVRELI-UHFFFAOYSA-N 469.950 5.790 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Br)[C@H](c1ccccc1)N1CCO[C@H](c2ccccc2)C1 492515805 PYDFQZIKKCDGCG-GOTSBHOMSA-N 496.361 5.111 5 20 JKBD O=C(NCc1ccccc1[N+](=O)[O-])c1ccccc1SCc1ccc(Br)cc1 500790827 BAHPBFPPWJOKDI-UHFFFAOYSA-N 457.349 5.580 5 20 JKBD CCn1c(SCc2csc(-c3ccc(C(N)=O)cc3)n2)nc2cc3ccccc3cc2c1=O 505898790 RDWVEIQQCDKPLE-UHFFFAOYSA-N 472.595 5.084 5 20 JKBD Cc1ccc(Sc2ccc(CNCc3ccc(Cn4ccccc4=O)cc3)cc2[N+](=O)[O-])cc1 507918148 AOCAGJOJMIHDLV-UHFFFAOYSA-N 471.582 5.554 5 20 JKBD CC1CCN(c2ccc(CNCc3ccc(Oc4ccc(F)cc4)c([N+](=O)[O-])c3)cn2)CC1 508106909 ZPOWELIAKOLYHX-UHFFFAOYSA-N 450.514 5.447 5 20 JKBD CN(C(=O)C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)C1Cc2ccccc2C1 508163630 POMLDNNRCBDLDO-STZFKDTASA-N 469.566 5.761 5 20 JKBD C[C@@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)NCC1(c2ccc(Cl)cc2Cl)CCOCC1 510108369 KJGIBHPVLNJCEA-CQSZACIVSA-N 469.390 5.247 5 20 JKBD Cc1c(NC(=O)[C@H](C)Nc2ccc(NC(=O)c3ccc(Cl)cc3)cc2)cccc1[N+](=O)[O-] 513208826 BJIVVOSBVBZLDO-HNNXBMFYSA-N 452.898 5.248 5 20 JKBD C[C@@H]1CCCN(c2ccc(C(=O)N3CCC(c4nc5ccccc5s4)CC3)cc2[N+](=O)[O-])C1 514301512 OZABRUPZXXYUQG-QGZVFWFLSA-N 464.591 5.461 5 20 JKBD O=C(CSc1ccc(C(F)(F)F)cc1[N+](=O)[O-])NCc1cccc(NC(=O)C2CCCCC2)c1 520593610 CWGMWNQMWIZCTE-UHFFFAOYSA-N 495.523 5.541 5 20 JKBD Cc1[nH]nc(NC(=O)C2CCN(c3ccc(C(F)(F)F)cc3[N+](=O)[O-])CC2)c1-c1ccccc1 522168754 PXZUWYHLBGZPCL-UHFFFAOYSA-N 473.455 5.167 5 20 JKBD CC(C)(C)c1ccc(C(=O)N2CCC[C@@H](c3nc(-c4ccc(Cl)cc4)no3)C2)cc1[N+](=O)[O-] 522577201 BCMVGDPJSDAJDA-QGZVFWFLSA-N 468.941 5.616 5 20 JKBD COc1ccc(C[C@H](NC(=O)[C@H](C)Sc2ccc([N+](=O)[O-])cc2)c2ccccc2)cc1OC 524059316 OXQMLNXEETVRIE-JTSKRJEESA-N 466.559 5.193 5 20 JKBD Cc1ccc(NC(=O)c2ccc(N3CCC(c4c[nH]c5ncccc45)CC3)c([N+](=O)[O-])c2)cc1 524171313 SZSSPFSZNKRYRL-UHFFFAOYSA-N 455.518 5.416 5 20 JKBD CC(C)(C)c1csc(NC(=O)c2ccc(C(=O)Nc3nc(C(C)(C)C)cs3)c([N+](=O)[O-])c2)n1 551100939 LINOFLROTFPONV-UHFFFAOYSA-N 487.607 5.607 5 20 JKBD COc1cc(C(=O)Nc2ccnn2Cc2ccc(Cl)cc2Cl)c([N+](=O)[O-])cc1OC(F)F 585707505 JETVZVDREWKHLH-UHFFFAOYSA-N 487.246 5.009 5 20 JKBD COc1ccccc1-c1cc(NC(=O)c2ccc([N+](=O)[O-])cc2Cl)n(-c2ccc(C)cc2)n1 603760961 YMCIHKNSLPGVPK-UHFFFAOYSA-N 462.893 5.670 5 20 JKBD O=C(CNc1ccccc1Oc1ncc(Cl)cc1Cl)N1CCc2ccc([N+](=O)[O-])cc21 604010249 XFAKFVNVVUBCCW-UHFFFAOYSA-N 459.289 5.090 5 20 JKBD COc1cc(C(=O)Nc2ccc(NC3CCCCC3)cc2)c([N+](=O)[O-])cc1OCc1cscn1 604539652 YNTJGFIOLKEZNS-UHFFFAOYSA-N 482.562 5.636 5 20 JKBD O=C(Nc1ccc(NC2CCCCC2)cc1)c1ccc([N+](=O)[O-])cc1I 608777602 IYJJPKHTVBIVBU-UHFFFAOYSA-N 465.291 5.196 5 20 JKBD CC[C@@H](N[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Br)c1ccccc1)c1nc(C)cs1 609221516 JLZCZUZYVIXRFL-MJGOQNOKSA-N 489.395 5.543 5 20 JKBD COc1ccc([C@H](NCC(=O)Nc2nc(-c3cccc([N+](=O)[O-])c3)cs2)c2ccccc2)cc1 611565375 TZTVMPHAWSCBMI-XMMPIXPASA-N 474.542 5.045 5 20 JKBD CC(=O)N(c1cccc(Cl)c1)c1nc(COC(=O)c2c(Cl)cccc2[N+](=O)[O-])cs1 730643343 LHLGCMHSCSNORO-UHFFFAOYSA-N 466.302 5.400 5 20 JKBD O=C(NCc1ccc(NC(=O)c2cc(F)c(F)cc2[N+](=O)[O-])cc1)c1ccc(C(F)(F)F)cc1 730761482 FQYTVHLFCVZDJD-UHFFFAOYSA-N 479.361 5.074 5 20 JKBD CC(C)N(Cc1nnc(-c2cccc([N+](=O)[O-])c2)o1)C(=O)c1cccc(CN(C)Cc2ccccc2)c1 751057410 PGBBUMQCOBEIMB-UHFFFAOYSA-N 499.571 5.328 5 20 JKBD O=C(Oc1ccc2c(-c3ccc([N+](=O)[O-])cc3)cc(=O)oc2c1)c1cc(F)c(F)c(F)c1F 890308198 XJIMKKVMZYSQCD-UHFFFAOYSA-N 459.307 5.144 5 20 JKBD Cc1ccc(/C(O)=C(/C(=S)Nc2cccc(C(C)C)c2)[n+]2cccc(CO)c2)cc1[N+](=O)[O-] 917612887 ARPDBCGQJLFASI-UHFFFAOYSA-O 464.567 5.130 5 20 JKBD CC(=O)c1ccc(-c2ccc(C(=O)N3CCCC[C@H]3CCOC(=O)c3cccc([N+](=O)[O-])c3)o2)cc1 918637389 JRDUFIVQZKUTDZ-QFIPXVFZSA-N 490.512 5.299 5 20 JKBD CC(C)(C)OC(=O)N1CCCN(C(=O)c2ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])cc2)CC1 918674960 KMBMHCCOSCBONB-UHFFFAOYSA-N 475.929 5.124 5 20 JKBD CC(C)(C)OC(=O)NC[C@H]1CCCN(C(=O)c2ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])cc2)C1 920748394 IOIPDJCMNGYVKA-MRXNPFEDSA-N 489.956 5.417 5 20 JKBD CCOc1ccsc1C(=O)Nc1ccc(C2(NC(=O)Cc3cc([N+](=O)[O-])ccc3F)CCC2)cc1 1785770825 RGTKLAXNAFJYBU-UHFFFAOYSA-N 497.548 5.185 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)c3ccc([N+](=O)[O-])cc3F)CCC2)cc1)c1ccc2scnc2c1 1789340631 FCIGSXZPQXVRLE-UHFFFAOYSA-N 490.516 5.405 5 20 JKBD O=C(NC1(c2ccc(NC(=O)c3cccc(F)c3[N+](=O)[O-])cc2)CCC1)c1ccoc1C(F)(F)F 1790698654 GIOXHDUKFFGOJN-UHFFFAOYSA-N 491.397 5.407 5 20 JKBD C[C@H](C(=O)Nc1ccc(C2(NC(=O)Cc3ccc(Cl)cc3[N+](=O)[O-])CCC2)cc1)c1ccccn1 1791939475 ZCDSPTXNGBBVLH-KRWDZBQOSA-N 492.963 5.124 5 20 JKBD O=C(Nc1cc([C@H]2CCCCN2C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)[nH]n1)c1cccs1 1816345055 CTZHRHDIIWTIDO-MRXNPFEDSA-N 481.559 5.214 5 20 JKBD Cc1c(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)[C@H]3CCC[C@H]3C)[nH]n2)cc(Cl)cc1[N+](=O)[O-] 1821293961 MMABIMQTQDBUKE-AZOIQLNYSA-N 473.961 5.022 5 20 JKBD CCC(C)(C)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)[nH]n1 1821939448 MSKPZBGSOIYLLW-KRWDZBQOSA-N 469.567 5.275 5 20 JKBD CC(C)[C@H](C(=O)N1CCC([C@H]2CCCCN2C(=O)Cc2cccc([N+](=O)[O-])c2)CC1)c1ccccc1 1823677285 SUJGFXBBAHFPLN-IAPPQJPRSA-N 491.632 5.197 5 20 JKBD CC[C@H]1CC[C@H](C(=O)N2CCCC[C@H]2C2CCN(C(=O)Cc3ccc([N+](=O)[O-])cc3F)CC2)CC1 1831695631 YFBDBNGNVQGOGZ-OWHZGTRUSA-N 487.616 5.113 5 20 JKBD CC1(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)Cn3ccc4ccc([N+](=O)[O-])cc43)CC2)CCCCC1 1831791084 RXQFOOFJZPARPT-XMMPIXPASA-N 494.636 5.140 5 20 JKBD Cc1c(C(=O)N2CC3(CCCN3C(=O)c3cc(Cl)sc3Cl)C2)cc(Cl)cc1[N+](=O)[O-] 1844566640 YAXMYWHBHLTVIX-UHFFFAOYSA-N 488.780 5.056 5 20 JKBD CSc1ccc(C(=O)c2ccccc2C(=O)OCc2nc3ccccc3s2)cc1[N+](=O)[O-] 10154421 PABWUPCYBKDIOQ-UHFFFAOYSA-N 464.524 5.514 5 20 JKBD O=C(NCCNc1ccc(C(F)(F)F)cc1[N+](=O)[O-])c1ccc(C2SCCCS2)cc1 15034203 MSXRJLYVJNLADR-UHFFFAOYSA-N 471.526 5.324 5 20 JKBD O=C(CSc1ccc(C(F)(F)F)cc1[N+](=O)[O-])Nc1cccc(C2SCCS2)c1 15036884 WJNYVYFORCNWHV-UHFFFAOYSA-N 460.524 5.823 5 20 JKBD Cc1ccc(C)c(-n2ccnc2SCC(=O)Nc2ccc([N+](=O)[O-])cc2C(F)(F)F)c1 21648999 WRKZNWSWILIVAR-UHFFFAOYSA-N 450.442 5.147 5 20 JKBD COc1cc(/C=C/c2ccc3c([N+](=O)[O-])cccc3n2)ccc1OCC(=O)Nc1ccccc1Cl 23779053 DUBJPHMEAWBYMB-PKNBQFBNSA-N 489.915 5.993 5 20 JKBD COC(=O)C[C@@H](NC(=O)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])c(OC)c1)c1cccs1 25196062 KSXRAFWJUKGRSY-OAHLLOKOSA-N 490.921 5.145 5 20 JKBD C[C@H](Nc1ccc(C(=O)N[C@H](c2ccccc2)c2nccs2)cc1[N+](=O)[O-])c1ccccn1 303231195 VPXNCEMCPJOADP-KSFYIVLOSA-N 459.531 5.139 5 20 JKBD Cc1csc(Sc2ccc(C(=O)Nc3cccc(NC(=O)C4CC4)c3)cc2[N+](=O)[O-])n1 490710366 NTVAOTCCZCXRBL-UHFFFAOYSA-N 454.533 5.112 5 20 JKBD COc1ccc(C(=O)N(CCc2ccccc2)c2nc(-c3ccccc3)cs2)cc1[N+](=O)[O-] 491208465 RCRMGRVDGQGBPS-UHFFFAOYSA-N 459.527 5.616 5 20 JKBD CC[C@@H](C)n1c(S[C@@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2C(F)(F)F)nnc1-c1ccccc1 504322768 XQDCZBMQCHYRGJ-KGLIPLIRSA-N 493.511 5.962 5 20 JKBD CCN(C(=O)c1ccc(-n2ccnc2)c([N+](=O)[O-])c1)[C@H]1CCSc2ccc(Br)cc21 504552553 KPDLMJRDCBOISF-KRWDZBQOSA-N 487.379 5.242 5 20 JKBD Cc1nn(Cc2ccc(C(=O)N[C@@H](C)c3ccc(SC(C)C)cc3)cc2)c(C)c1[N+](=O)[O-] 504702672 IOFAVNAREBVHAM-INIZCTEOSA-N 452.580 5.448 5 20 JKBD CCn1c([C@@H]2CCCN2C(=O)CCNc2ccc(C(F)(F)F)cc2[N+](=O)[O-])nc2ccccc21 506169624 AWLDJCDQAMVNFY-IBGZPJMESA-N 475.471 5.149 5 20 JKBD Cn1cc(C(=O)Nc2nc(-c3ccc(Cl)cc3Cl)cs2)c(-c2ccc([N+](=O)[O-])cc2)n1 506247737 UMLJRUGDSVYRNX-UHFFFAOYSA-N 474.329 5.678 5 20 JKBD Cc1nc(-c2ccccc2)sc1[C@@H](C)NC(=O)c1ccc(N[C@@H](C)c2ccccn2)c([N+](=O)[O-])c1 507543269 ATDTZFIHUDHPDF-DLBZAZTESA-N 487.585 6.086 5 20 JKBD CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)Nc1cccc(COCC(F)(F)C(F)F)c1 509561115 VUAITXIRGODICR-UHFFFAOYSA-N 457.424 5.454 5 20 JKBD O=C(CN1CCC(NCc2ccc(Oc3ccccc3Cl)c([N+](=O)[O-])c2)CC1)Nc1ccccc1 509601049 KQYRTVKCBGIEEJ-UHFFFAOYSA-N 494.979 5.233 5 20 JKBD CCOC(=O)C1CCN(C(=O)c2ccccc2Sc2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 511280171 YMJNAVIZVCDLCT-UHFFFAOYSA-N 482.480 5.180 5 20 JKBD COCCN(C(=O)c1csc(-c2ccccc2F)n1)c1nc(-c2ccc([N+](=O)[O-])cc2)cs1 518875643 SGSCFMFAAFZCKY-UHFFFAOYSA-N 484.534 5.274 5 20 JKBD Cn1ccnc1[C@H](NCc1ccc(Oc2ccc(F)cc2)c([N+](=O)[O-])c1)c1ccccc1F 520210222 BVGIKHGLJSUFAL-HSZRJFAPSA-N 450.445 5.278 5 20 JKBD COCc1cccc2sc(NC(=O)c3cc([N+](=O)[O-])ccc3Sc3ccccc3)nc12 520538642 JEACNXXBZMIPRC-UHFFFAOYSA-N 451.529 5.754 5 20 JKBD Cc1ccc([N+](=O)[O-])cc1C(=O)Nc1nc(-c2ccc(OC(F)F)cc2OC(F)F)cs1 522062387 DYMAMTBDSONGAC-UHFFFAOYSA-N 471.388 5.482 5 20 JKBD O=C(Cn1c2ccccc2c(=O)c2ccccc21)N1CCC[C@H](c2nc(-c3ccc(Cl)cc3)no2)C1 523977328 KEPXNZIDSHEPJF-IBGZPJMESA-N 498.970 5.264 5 20 JKBD O=c1c2cc([N+](=O)[O-])ccc2nc2n1CC/C2=C\c1ccc(-c2ccc(Br)cc2)o1 603781259 GFYVGVVRECZUOB-SDNWHVSQSA-N 464.275 5.272 5 20 JKBD COc1ccccc1OCc1ccc(C(=O)Nc2nc(-c3cccc([N+](=O)[O-])c3)c(C)s2)o1 603998695 CPSCQGFSPOXFHL-UHFFFAOYSA-N 465.487 5.460 5 20 JKBD O=C(Nc1cc(C(=O)N2CCCCC2)ccc1Cl)c1ccc(Nc2ccccc2)c([N+](=O)[O-])c1 608869279 ZTSQEAVFZKMOGP-UHFFFAOYSA-N 478.936 5.870 5 20 JKBD C[C@@H](NC(=O)NCc1ccccc1-c1ccc(Cn2cccn2)cc1)c1cccc([N+](=O)[O-])c1 608914443 OUZVTIQJADOKHP-LJQANCHMSA-N 455.518 5.067 5 20 JKBD Cc1noc(CCCNC(=O)c2c3c(nc4ccccc24)/C(=C/c2cccc([N+](=O)[O-])c2)CCC3)n1 608965774 LSVQOPNDSGZNAJ-XDJHFCHBSA-N 483.528 5.074 5 20 JKBD C[C@@H]1CCCN(C(=O)C2CCN(C(=O)CCC(=O)c3ccc4ccc5cccc6ccc3c4c56)CC2)C1 727755643 GJODOMUUODOXAN-OAQYLSRUSA-N 494.635 6.044 5 20 JKBD C[C@H](NC(=O)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1)c1ccc2c(c1)CC(=O)N2C 728256156 ZYLLUNVRZABREH-AWEZNQCLSA-N 465.893 5.050 5 20 JKBD O=C(CCc1nc2cc(C(F)(F)F)ccc2s1)OCC1CCN(c2ccc([N+](=O)[O-])cn2)CC1 730692973 QZCXEVKTBGPEFO-UHFFFAOYSA-N 494.495 5.011 5 20 JKBD CCOc1cccc(NC(=S)/C(=C(/O)c2ccc([N+](=O)[O-])cc2)[n+]2ccccc2CC)c1 743054251 GNTKSOGIWUDEPF-UHFFFAOYSA-O 450.540 5.167 5 20 JKBD CC(C)Cc1nc(C(=O)O[C@@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2ccccc2)cs1 746607491 XCWZSPWFFFFSMO-HXUWFJFHSA-N 473.938 5.440 5 20 JKBD CC1CCN(c2ccc([N+](=O)[O-])cc2C(=O)N(C)C[C@H]2CCCO[C@@H]2c2ccccc2)CC1 747785061 RIPCYDOELPXPDI-PXDATVDWSA-N 451.567 5.071 5 20 JKBD O=C(Nc1ccc(OC(=O)c2ccccc2Oc2cccnc2)cc1)c1cccc([N+](=O)[O-])c1 748044449 BBNVZQUJBKVOCV-UHFFFAOYSA-N 455.426 5.254 5 20 JKBD Cc1nc([N+](=O)[O-])cn1CCC(=O)C(c1nc2ccccc2s1)c1nc2ccccc2s1 750391512 UISILHQWVQRQQO-UHFFFAOYSA-N 463.544 5.110 5 20 JKBD COc1cc(C(=O)Nc2cc(C(F)(F)F)ccc2NC(=O)OC(C)(C)C)ccc1[N+](=O)[O-] 751338670 YGMOTWQEAQJRQE-UHFFFAOYSA-N 455.389 5.222 5 20 JKBD O=C(Cc1cccc2cccnc12)O[C@@H](C(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1)c1ccccc1 817040116 JZPQKJJTOIXQMT-XMMPIXPASA-N 475.888 5.262 5 20 JKBD CC(C)N(Cc1nnc(-c2cccc([N+](=O)[O-])c2)o1)C(=O)[C@@H](C)Oc1ccc(Cl)c(Cl)c1 916369625 LYDYSQPMJFZYEC-CYBMUJFWSA-N 479.320 5.156 5 20 JKBD O=C(/C=C/c1cnc2ccccc2n1)Nc1cc(Cl)c([N+](=O)[O-])cc1OCc1ccccc1 916827435 ITYCSMZHCJGIPY-ZHACJKMWSA-N 460.877 5.422 5 20 JKBD C[C@H](OC(=O)C1=NN(c2ccccc2)[C@@H](c2ccccc2)C1)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl 934167059 IYUBYJTXMNEOQD-QMHKHESXSA-N 492.919 5.126 5 20 JKBD Cc1cccc(C)c1SCC(=O)NC1(c2ccc(NC(=O)c3ccc([N+](=O)[O-])o3)cc2)CCC1 1785750743 PUXYAAZPRPLWEU-UHFFFAOYSA-N 479.558 5.345 5 20 JKBD COc1cc(CC(=O)Nc2ccc(C3(NC(=O)[C@H](C)c4cccs4)CCC3)cc2)ccc1[N+](=O)[O-] 1790479220 FEDUSJBRQZNPBK-QGZVFWFLSA-N 493.585 5.145 5 20 JKBD CN(C)c1ccc([N+](=O)[O-])cc1C(=O)Nc1ccc(C2(NC(=O)c3cccc4ccoc34)CCC2)cc1 1790793347 ZADXCTHZYCEOOQ-UHFFFAOYSA-N 498.539 5.469 5 20 JKBD Cc1c(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)CC2CCC(C)(C)CC2)C3)cc(Cl)cc1[N+](=O)[O-] 1800711796 VMNQHUJHZIENHW-ACDBMABISA-N 476.017 5.415 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cc3ccccc3o2)n[nH]1 1818631994 HTBBVSLBKYXEQD-LJQANCHMSA-N 491.479 5.131 5 20 JKBD CCCCCc1cccc(CC(=O)Nc2cc([C@H]3CCCCN3C(=O)c3ccc([N+](=O)[O-])o3)[nH]n2)c1 1820710156 CZKQXVRPCGBREI-OAQYLSRUSA-N 493.564 5.192 5 20 JKBD Cc1c(C(=O)Nc2cc([C@H]3CCCCN3C(=O)C3CC4(CCC4)C3)[nH]n2)cc(Cl)cc1[N+](=O)[O-] 1821292339 BVHPCLFCUHYKDH-LJQANCHMSA-N 485.972 5.166 5 20 JKBD CC(C)=CCCC(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cc(Cl)cc([N+](=O)[O-])c2C)n[nH]1 1821294618 RMNNCBMECSFZAG-IBGZPJMESA-N 473.961 5.332 5 20 JKBD CCCCCc1ccc(CC(=O)Nc2cc([C@H]3CCCCN3C(=O)c3ccc([N+](=O)[O-])o3)[nH]n2)cc1 1822286791 AGUWHEHPBPBBFS-OAQYLSRUSA-N 493.564 5.192 5 20 JKBD Cc1ccc(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)CSc3ccccc3[N+](=O)[O-])CC2)cc1C 1830007990 RYHQISAJCOBUOP-HSZRJFAPSA-N 495.645 5.237 5 20 JKBD Cc1ccc(SCC(=O)N2CCC([C@H]3CCCCN3C(=O)c3ccc([N+](=O)[O-])cc3F)CC2)cc1 1830496998 USILYPXUHFPTNX-XMMPIXPASA-N 499.608 5.068 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2sccc2Cl)CC1 1830733738 REZPEXKJCDVHCA-LJQANCHMSA-N 493.988 5.304 5 20 JKBD CC1=CC[C@@H](C(=O)N2CCC([C@H]3CCCCN3C(=O)c3c(F)ccc([N+](=O)[O-])c3C)CC2)CC1 1830733992 TXCDNRGKCZUSRG-NFBKMPQASA-N 471.573 5.022 5 20 JKBD O=C(c1cc(F)ccc1Cl)N1CCC([C@@H]2CCCCN2C(=O)/C=C/c2ccccc2[N+](=O)[O-])CC1 1832905243 SSQQONZDRVRGFJ-HDFUYHJRSA-N 499.970 5.334 5 20 JKBD O=C(c1cc2cc([N+](=O)[O-])ccc2s1)N1CC2(CCCN2C(=O)[C@@H]2C[C@H]2c2ccc(Cl)cc2)C1 1843876922 SYJZOMJKPBKDPO-VQTJNVASSA-N 495.988 5.084 5 20 JKBD C[C@H](Sc1nnc(-c2cccs2)n1-c1ccccc1)C(=O)Nc1ccc([N+](=O)[O-])cc1 11209772 ZJYHDXYYGPNMFL-AWEZNQCLSA-N 451.533 5.023 5 20 JKBD O=C(Cn1c2ccccc2c(=O)c2ccccc21)NCc1ccc(-c2nc3ccccc3s2)o1 14846241 WJFKPXHEMVFHLQ-UHFFFAOYSA-N 465.534 5.341 5 20 JKBD CCOc1cc([N+](=O)[O-])c(C(=O)O[C@@H](C)C(=O)Nc2c(Cl)cc(Cl)cc2Cl)cc1OC 18969305 SRFLWBSEFIJLRN-VIFPVBQESA-N 491.711 5.146 5 20 JKBD COc1ccccc1CN(Cc1cccs1)C(=O)Cn1c2ccccc2c(=O)c2ccccc21 29063546 JEZOQVBRKNKCKQ-UHFFFAOYSA-N 468.578 5.454 5 20 JKBD C[C@H](Sc1nnc(-c2ccncc2)n1-c1ccc(Cl)cc1)C(=O)Nc1ccc([N+](=O)[O-])cc1 255936053 DSGQUDFOIONCTN-AWEZNQCLSA-N 480.937 5.010 5 20 JKBD Cc1c(C(C)(C)C)nn(-c2ccccc2)c1NC(=O)Cn1c2ccccc2c(=O)c2ccccc21 303270436 GCEWWAUXPZHBRP-UHFFFAOYSA-N 464.569 5.585 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)Nc2nc(-c3ccc(OC(F)F)cc3)c(C)s2)cc1SC 481996059 BKGOKXGEOGBNGY-UHFFFAOYSA-N 481.502 5.611 5 20 JKBD O=C(Nc1cc([N+](=O)[O-])ccc1Nc1cccc(C(F)(F)F)c1)c1ccc(CN2CCCC2=O)cc1 498729742 LRNQKDJSCDYGGI-UHFFFAOYSA-N 498.461 5.732 5 20 JKBD C[C@@H](Nc1ccc(C(=O)Nc2ccc(-c3nc4c(F)cccc4[nH]3)cc2)cc1[N+](=O)[O-])c1ccccn1 502432736 SYCCEOWHNYVKGO-MRXNPFEDSA-N 496.502 6.098 5 20 JKBD COc1cc(C(=O)N[C@H](CCc2ccccc2)c2ccccc2)c([N+](=O)[O-])cc1OC(F)F 503019461 QGMRFUMKNVEIIR-LJQANCHMSA-N 456.445 5.309 5 20 JKBD Cc1ncc(CNC(=O)C/C(=C\c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)s1 509862662 FZXOGXGCGQIRHN-MHWRWJLKSA-N 450.545 5.217 5 20 JKBD CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)c1cc(-c2cccnc2)nc2c1cnn2Cc1ccco1 511519850 BQQQZQIAUSQSDB-UHFFFAOYSA-N 496.527 5.094 5 20 JKBD COc1cc(C(=O)N(C)C2CCC(C(C)(C)C)CC2)c([N+](=O)[O-])cc1OCc1cscn1 512323735 OOIZLZAFGMEXAD-UHFFFAOYSA-N 461.584 5.316 5 20 JKBD CCOc1cc(NC(=O)[C@@H]2CCCN(C(=O)c3cccc4ccccc34)C2)c([N+](=O)[O-])cc1OCC 514868129 BSKAIEXYWZOUHF-LJQANCHMSA-N 491.544 5.036 5 20 JKBD COc1ccc(C(=O)Nc2cc(C(=O)Nc3cccc(C(F)(F)F)c3)ccc2C)cc1[N+](=O)[O-] 518889138 BXJKMXPFXPIXKY-UHFFFAOYSA-N 473.407 5.435 5 20 JKBD O=C(Cn1cc([N+](=O)[O-])cn1)Nc1cc(C(F)(F)F)ccc1Oc1ccc(Br)cc1 521180564 LDPCLQGRIUYRCN-UHFFFAOYSA-N 485.216 5.004 5 20 JKBD COCCN(C(=O)[C@@H]1C[C@H]1c1ccc(C(F)(F)F)cc1)c1nc(-c2ccc([N+](=O)[O-])cc2)cs1 589197829 CPWGVNIUMJKUAD-RBUKOAKNSA-N 491.491 5.520 5 20 JKBD Cc1cc(C)nc(NC(=O)c2c3c(nc4ccccc24)/C(=C\c2ccc([N+](=O)[O-])cc2)CCC3)n1 602217061 KSYBYWQKVXPFOH-CYVLTUHYSA-N 465.513 5.679 5 20 JKBD COc1cccc(NC(=O)CSc2ccccc2C(=O)Nc2cc([N+](=O)[O-])c(C)cc2C)c1 603501638 XSJCSBXTGZICHP-UHFFFAOYSA-N 465.531 5.203 5 20 JKBD O=C(Nc1cccc(C(F)(F)F)c1)c1cccc(NC(=O)c2ccn(-c3cccc([N+](=O)[O-])c3)n2)c1 603839797 AUZCYRDEXGDVHX-UHFFFAOYSA-N 495.417 5.304 5 20 JKBD CC(C)(C)c1ccc(Oc2ccc(CNCc3ccc(S(C)(=O)=O)cc3)cc2[N+](=O)[O-])cc1 604448218 HBFPDSWRUHIIQA-UHFFFAOYSA-N 468.575 5.378 5 20 JKBD COc1cc(OC)c(OC)cc1CNCc1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1 604478784 PKFCTJKTNARETH-UHFFFAOYSA-N 458.898 5.356 5 20 JKBD O=C(c1ccc(C(=O)N2CCC[C@@H]2Cc2ccccc2)c([N+](=O)[O-])c1)N1CCC[C@@H]1Cc1ccccc1 609043638 GLHLTNPELKWTIK-CLJLJLNGSA-N 497.595 5.289 5 20 JKBD Cn1cc([N+](=O)[O-])cc1C(=O)N(C[C@H]1CCCO1)c1nc(-c2ccc(Cl)cc2Cl)cs1 612566694 PYTFEMQKGNPPEZ-CQSZACIVSA-N 481.361 5.189 5 20 JKBD O=C(c1cc([N+](=O)[O-])ccc1N1CCCCC1)N1CCC[C@@H](c2nc(-c3ccc(Cl)cc3)no2)C1 726539598 JMKFJCNJFDWLMZ-GOSISDBHSA-N 495.967 5.308 5 20 JKBD CN(C)c1ccc([N+](=O)[O-])cc1C(=O)Nc1cccc(NC(=O)c2cccc(C(F)(F)F)c2)c1 728848862 UOSVEQAVFGEUKA-UHFFFAOYSA-N 472.423 5.184 5 20 JKBD O=C(CCC(=O)c1ccc2ccc3cccc4ccc1c2c34)NC1CCN(C(=O)c2ccoc2)CC1 729258792 PFMJSDQDHAPPNR-UHFFFAOYSA-N 478.548 5.561 5 20 JKBD O=C(OCc1csc(COc2ccc(F)cc2)n1)c1csc(-c2ccc([N+](=O)[O-])cc2)n1 747958621 PWHZDIWFLUAUHI-UHFFFAOYSA-N 471.491 5.250 5 20 JKBD O=C(N[C@@H](c1ccccc1)c1ccc2nc(C(F)(F)F)[nH]c2c1)c1cc(Cl)ccc1[N+](=O)[O-] 844144639 NLGJFCXQSHOOPG-IBGZPJMESA-N 474.826 5.663 5 20 JKBD C[C@H](OC(=O)CSc1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccccc1Oc1ccccc1 852584561 OMOCLTFZIJXQBI-INIZCTEOSA-N 452.488 5.050 5 20 JKBD COc1cc(/C=C\C(=O)Nc2cc([N+](=O)[O-])ccc2OC(F)F)ccc1OCc1c(C)noc1C 915283557 SYPBWYHGDHMUBL-UITAMQMPSA-N 489.431 5.041 5 20 JKBD Cc1ccccc1-c1nnc(SCC(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)n1Cc1ccco1 916664554 GIPQNGAYVPNYSE-UHFFFAOYSA-N 483.937 5.187 5 20 JKBD Cc1nccn1-c1ccc(CNCc2ccc(Oc3ccc(C(C)(C)C)cc3)c([N+](=O)[O-])c2)cn1 916839849 KKWASVRPFYLQGD-UHFFFAOYSA-N 471.561 5.864 5 20 JKBD COc1ccccc1NC(=O)c1cc2ccccc2cc1OC(=O)CSc1ccc([N+](=O)[O-])cc1 916878927 BVEMMKPHSWFBCU-UHFFFAOYSA-N 488.521 5.707 5 20 JKBD O=C(Cn1c(=O)oc2cc([N+](=O)[O-])ccc21)Oc1ccc(-c2nc3ccccc3s2)cc1Cl 917195536 MDHPNOGLSOYNAJ-UHFFFAOYSA-N 481.873 5.038 5 20 JKBD C[C@H](OC(=O)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-])c1nc2ccccc2n1C(F)F 917947001 RJPZKKYXNORPGT-JTQLQIEISA-N 459.327 5.199 5 20 JKBD O=C(/C=C\c1ccsc1)O[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Br)c1ccccc1 917949607 CWUWBOFYUMOHSN-QKWWCAPFSA-N 487.331 5.355 5 20 JKBD O=C(Nc1ccc(N2CCOC2=O)cc1)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1 918681984 CULHSTVEBWDLEU-UHFFFAOYSA-N 453.838 5.249 5 20 JKBD C[C@@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)OCc1nc(O)c2c(-c3ccccc3)csc2n1 1525360676 SICABYYYQLMANT-CYBMUJFWSA-N 467.528 5.196 5 20 JKBD O=C(/C=C/c1ccc([N+](=O)[O-])o1)Nc1ccc(C2(NC(=O)c3cccc(Cl)c3)CCC2)cc1 1786207711 HLROGLXTUPSDSS-PKNBQFBNSA-N 465.893 5.302 5 20 JKBD CC1=CC[C@H](C(=O)NC2(c3ccc(NC(=O)Cn4ccc5ccc([N+](=O)[O-])cc54)cc3)CCC2)CC1 1786277781 UFTXWIGVPVRQJS-NRFANRHFSA-N 486.572 5.430 5 20 JKBD O=C(Cc1cccc2ncccc12)Nc1ccc(C2(NC(=O)Cc3cccc([N+](=O)[O-])c3)CCC2)cc1 1786345057 LMFXTFAKJHAQPP-UHFFFAOYSA-N 494.551 5.062 5 20 JKBD O=C(CCc1cccc([N+](=O)[O-])c1)Nc1ccc(C2(NC(=O)c3cc(F)cnc3Cl)CCC2)cc1 1786602373 KYQRZPMFOHZRMO-UHFFFAOYSA-N 496.926 5.163 5 20 JKBD O=C(Cc1cc([N+](=O)[O-])ccc1F)Nc1ccc(C2(NC(=O)C3CCC(F)(F)CC3)CCC2)cc1 1786669687 JAFZGOVBLSUZBH-UHFFFAOYSA-N 489.494 5.236 5 20 JKBD O=C(Cc1cc(F)ccc1[N+](=O)[O-])NC1(c2ccc(NC(=O)c3ccnc(C(F)F)c3)cc2)CCC1 1787019546 NRRRRFPREOHJKD-UHFFFAOYSA-N 498.461 5.057 5 20 JKBD O=C(/C=C/c1ccc([N+](=O)[O-])o1)NC1(c2ccc(NC(=O)[C@H]3CCc4ccccc43)cc2)CCC1 1791688358 MSXBWKOVGGQBBY-UDFXALJUSA-N 471.513 5.065 5 20 JKBD Cc1oc(C(C)(C)C)cc1C(=O)N1CCCC2(CCN(C(=O)c3cccc(F)c3[N+](=O)[O-])CC2)C1 1808383648 VODIKFSOUOBGLW-UHFFFAOYSA-N 485.556 5.091 5 20 JKBD C/C(=C\c1cccs1)C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cc(F)cc([N+](=O)[O-])c2)CC1 1823718823 SAAICPNPNCIKIC-ILAWTMEDSA-N 485.581 5.132 5 20 JKBD O=C(c1ccc([N+](=O)[O-])cc1F)N1CCC([C@H]2CCCCN2C(=O)c2cc(Cl)ccc2F)CC1 1823938545 GFTSUJWFRDIPNS-JOCHJYFZSA-N 491.922 5.074 5 20 JKBD Cc1ccc(SCC(=O)N2CCCC[C@H]2C2CCN(C(=O)c3ccc([N+](=O)[O-])cc3F)CC2)cc1 1828344139 JSQAJIZLKIVYFX-DEOSSOPVSA-N 499.608 5.068 5 20 JKBD Cc1c([N+](=O)[O-])cc(C(=O)Nc2nc(-c3ccc(Br)s3)cs2)cc1[N+](=O)[O-] 10573162 WVJKNVGQZGWFHL-UHFFFAOYSA-N 469.298 5.011 5 20 JKBD C[C@H](OC(=O)c1ccccc1COc1ccccc1)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl 10852577 HGEWLNIXOSHMKI-HNNXBMFYSA-N 454.866 5.011 5 20 JKBD CCN(CC)c1ccc(-c2nnc(S[C@@H](C)c3nnc(-c4ccc([N+](=O)[O-])cc4)o3)o2)cc1 17663738 ZBOKKAAZJBNTEY-AWEZNQCLSA-N 466.523 5.394 5 20 JKBD Cc1csc(Sc2ccc(C(=O)O[C@@H](C)c3nnc(-c4cccs4)o3)cc2[N+](=O)[O-])n1 17715758 WCBNDIRXEACUFX-NSHDSACASA-N 474.545 5.540 5 20 JKBD O=C(C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)OCc1nnc(-c2ccccc2)o1 18494153 QPGDGYQVZWBDJQ-RGEXLXHISA-N 498.520 5.929 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Br)[C@H](NCCc1ccc(F)cc1)c1ccccc1 21819964 HALCEHYJWWXDRL-OAQYLSRUSA-N 472.314 5.009 5 20 JKBD CC(C)n1c(S[C@H](C)C(=O)Nc2nc(-c3cccc([N+](=O)[O-])c3)cs2)nc2ccccc2c1=O 24834443 TXVVIFJLOVQEPF-CQSZACIVSA-N 495.586 5.128 5 20 JKBD COc1ccc(NC(=O)CCN2CCC(c3nc4cc(Cl)ccc4s3)CC2)c([N+](=O)[O-])c1 25037473 QKZGEEJJOQUSRK-UHFFFAOYSA-N 474.970 5.075 5 20 JKBD O=C(CCNc1ccc(C(F)(F)F)cc1[N+](=O)[O-])Nc1ccccc1NCC(F)(F)F 303024085 PNOOEJMXGKGYNU-UHFFFAOYSA-N 450.339 5.029 5 20 JKBD O=C(Nc1cccc(CN2CCSCC2)c1)c1ccc(NCc2ccccc2)c([N+](=O)[O-])c1 489458681 QGUOHESSOUVHKA-UHFFFAOYSA-N 462.575 5.008 5 20 JKBD CCCN(CCc1ccccn1)C(=O)C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1 489827055 RRBJBJOGYQZLJV-UZYVYHOESA-N 486.597 6.012 5 20 JKBD CC(C)Oc1ccc(NC(=O)C2CCN(c3ccc(C(F)(F)F)cc3[N+](=O)[O-])CC2)c(F)c1 497911998 DQWGGTZXVZAVGA-UHFFFAOYSA-N 469.435 5.395 5 20 JKBD CCc1nc(C(=O)N(Cc2ccc([N+](=O)[O-])cc2)C(C)C)nn1-c1c(Cl)cccc1Cl 502017699 HZEYSOUMXSTIRD-UHFFFAOYSA-N 462.337 5.096 5 20 JKBD Cc1cc(N[C@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2ccccc2)ccc1Oc1cccnc1 512519973 VTCREWPWSBKGSC-VWLOTQADSA-N 488.931 6.536 5 20 JKBD Cc1ccc(NC(=O)c2ccccc2)cc1NC(=O)c1cc([N+](=O)[O-])ccc1NCc1ccccc1 514577355 QPENBARBJNXKGZ-UHFFFAOYSA-N 480.524 6.020 5 20 JKBD C[C@@H](c1ccccc1)n1c(SCC(=O)N2CCc3ccc([N+](=O)[O-])cc32)nnc1-c1ccccc1 515572461 CJIVKOQLHHIAQG-SFHVURJKSA-N 485.569 5.144 5 20 JKBD C[C@@H](NC(=O)N(Cc1ccc(Cl)c(Cl)c1)Cc1ccccn1)c1cccc([N+](=O)[O-])c1 517889407 LFLLCAAMAXXPTK-OAHLLOKOSA-N 459.333 5.770 5 20 JKBD O=C(NCc1noc(-c2cccs2)n1)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1 561577016 NPSWCVHYEFBGNM-UHFFFAOYSA-N 456.867 5.082 5 20 JKBD Cc1cc(N[C@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2ccccc2)ccc1C(=O)NC(C)C 582066604 JXHZMCJXMIFLNH-QHCPKHFHSA-N 480.952 5.487 5 20 JKBD O=C(c1cc2ccccc2c2cccnc12)N1CCC[C@H](c2nc(-c3cccc(F)c3)no2)C1 588109403 XEJWAZKAAGRSED-IBGZPJMESA-N 452.489 5.597 5 20 JKBD COc1ccc(NC(=O)C/C(=C\c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)cc1OC 603470705 JQWWBCBXBJPMIX-GHRIWEEISA-N 475.526 5.791 5 20 JKBD COc1cccc([C@H](C)NC(=O)C/C(=C\c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)c1 603518390 NYRNNQVIADAGCO-TYSUYXETSA-N 473.554 6.021 5 20 JKBD CCOCc1ccccc1CNC(=O)c1ccccc1C(=O)c1ccc(SC)c([N+](=O)[O-])c1 603559461 XUCQFPUWJBMNRR-UHFFFAOYSA-N 464.543 5.014 5 20 JKBD Cc1ccc(-n2c(S[C@@H](C)c3nnc(-c4ccc([N+](=O)[O-])cc4)o3)nnc2-c2ccccn2)c(C)c1 603918385 RQFGCPBMAHYDLY-KRWDZBQOSA-N 499.556 5.758 5 20 JKBD C[C@@H](NC(=O)CSCc1nc(O)c2c(-c3ccccc3)csc2n1)c1cccc([N+](=O)[O-])c1 603965882 PXAOFSZNAPYTLX-CQSZACIVSA-N 480.571 5.083 5 20 JKBD COc1cc(C(=O)N[C@@H](C)c2ccc(OCc3cccc(C)c3)cc2)c([N+](=O)[O-])cc1OC(F)F 609032702 CLBXKUNCKGRCJR-INIZCTEOSA-N 486.471 5.583 5 20 JKBD COc1cc(C(=O)NC(C)(C)c2ccc(C(C)C)cc2)c([N+](=O)[O-])cc1OCc1cscn1 609219130 HIFJYTGYPFIINI-UHFFFAOYSA-N 469.563 5.427 5 20 JKBD COc1cccc(NC(=O)CSc2ccccc2C(=O)Nc2ccc([N+](=O)[O-])c(Cl)c2)c1 727712199 RLNPXKXMOIPBCS-UHFFFAOYSA-N 471.922 5.240 5 20 JKBD CCOc1cccc(NC(=S)/C(=C(/O)c2cccc([N+](=O)[O-])c2)[n+]2ccccc2CC)c1 743052637 PXWDISPSUYLYDU-UHFFFAOYSA-O 450.540 5.167 5 20 JKBD O=C(Nc1ccc(OC(=O)c2ccc(-c3ccco3)nc2O)cc1)c1cc([N+](=O)[O-])ccc1Cl 743607079 FVFADJGTTZJWGR-UHFFFAOYSA-N 479.832 5.080 5 20 JKBD C[C@@H](OC(=O)c1ccc(-c2nc3ccccc3s2)s1)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 745941623 BSCWXXNRERSTQN-GFCCVEGCSA-N 478.511 5.901 5 20 JKBD O=C(Nc1ccccc1-c1nc2ccccc2s1)c1cc([N+](=O)[O-])ccc1Br 751059403 CQLCZDQDRQVPTK-UHFFFAOYSA-N 454.305 5.886 5 20 JKBD CCOc1ccc([C@@H](NC(=O)c2cc([N+](=O)[O-])ccc2Br)c2ccccc2)cc1 751082583 BOKIPXNNDQLDJW-NRFANRHFSA-N 455.308 5.275 5 20 JKBD O=C(Nc1nc(Cc2ccc(Br)cc2)cs1)c1cc([N+](=O)[O-])ccc1Br 751095763 SSCOKFKKFYHJPD-UHFFFAOYSA-N 497.168 5.419 5 20 JKBD C[C@H](OC(=O)CC(c1ccccc1)c1ccccc1)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 765949110 CIMJZHUXYJYZOR-INIZCTEOSA-N 486.446 5.706 5 20 JKBD CSc1ccc(NC(=O)[C@H](C)OC(=O)c2ccc(N[C@@H](C)c3ccccn3)c([N+](=O)[O-])c2)cc1 920548099 PTINEHNPTMXXOM-HOTGVXAUSA-N 480.546 5.069 5 20 JKBD O=C(CCc1cccc([N+](=O)[O-])c1)NC1(c2ccc(NC(=O)C3(C(F)(F)F)CC3)cc2)CCC1 1789195747 VJELGCDATPXFLT-UHFFFAOYSA-N 475.467 5.004 5 20 JKBD COc1cc(C(=O)Nc2ccc(C3(NC(=O)CSc4ccccc4)CCC3)cc2)ccc1[N+](=O)[O-] 1792163703 DVCDBRMFDKCYAS-UHFFFAOYSA-N 491.569 5.143 5 20 JKBD COc1cc(C(=O)Nc2ccc(C3(NC(=O)C4(F)CCCCC4)CCC3)cc2)ccc1[N+](=O)[O-] 1792164657 MFTJWCRHPHIOBP-UHFFFAOYSA-N 469.513 5.024 5 20 JKBD CC1=CC[C@H](C(=O)N2CC[C@@H](CNC(=O)c3cc(Cl)cc([N+](=O)[O-])c3C)[C@@H]2c2cccnc2)CC1 1811794815 UQQZYTISZJEKEJ-WXVUKLJWSA-N 496.995 5.018 5 20 JKBD Cc1c(C(=O)N2CCC([C@H]3CCCCN3C(=O)/C=C/c3ccoc3)CC2)cc(Cl)cc1[N+](=O)[O-] 1825055524 JSKRHACFIHKZAP-IOUFHMPJSA-N 485.968 5.096 5 20 JKBD O=C(c1ccc(O)c([N+](=O)[O-])c1)N1CCC([C@@H]2CCCCN2C(=O)[C@@H]2CCC[C@@H]3CCCC[C@@H]32)CC1 1828460973 VVJJDWLTSDGHQI-LSUHJGNXSA-N 497.636 5.140 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)N1CCCC[C@@H]1C1CCN(C(=O)CCC2CCCC2)CC1 1830728670 BKYUZWMODNVHQJ-HSZRJFAPSA-N 473.589 5.246 5 20 JKBD C[C@H](OC(=O)c1ccccc1Oc1ccccc1)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 11481162 CLHJDLGXGGLNME-AWEZNQCLSA-N 474.391 5.590 5 20 JKBD COc1ccc(-c2cc(C(=O)OCC(=O)Nc3cc([N+](=O)[O-])ccc3Cl)sc2C)cc1 23485656 VEGSODCYTCRMJS-UHFFFAOYSA-N 460.895 5.089 5 20 JKBD O=[N+]([O-])c1cccc(N(Cc2coc(-c3cccc(F)c3)n2)S(=O)(=O)c2ccc(F)c(F)c2)c1 26777858 YBKJDHMWSKONHA-UHFFFAOYSA-N 489.431 5.063 5 20 JKBD O=C1CCc2cc(N[C@@H](C(=O)Nc3ccc([N+](=O)[O-])cc3Br)c3ccccc3)ccc2N1 27017336 VZWCBZWZGWAZHA-JOCHJYFZSA-N 495.333 5.034 5 20 JKBD O=C(COC(=O)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1)Nc1ccccc1OC(F)F 28931217 FDHABYJCMTVKAW-UHFFFAOYSA-N 492.818 5.437 5 20 JKBD CC(C)N(C)c1ccc(NC(=O)c2ccc(N[C@@H](C)c3ccccn3)c([N+](=O)[O-])c2)cc1F 108850415 LSRPWASOUDPSEK-INIZCTEOSA-N 451.502 5.399 5 20 JKBD COc1ccccc1C[C@@H]1CCCN1C(=O)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 478892038 CPAZQQSZSUBPIW-FQEVSTJZSA-N 491.510 5.072 5 20 JKBD CCn1cc(NC(=O)c2c3c(nc4ccccc24)/C(=C/c2ccc([N+](=O)[O-])cc2)CCC3)ccc1=O 486924514 IWWRLONOUAIKSY-KNTRCKAVSA-N 480.524 5.454 5 20 JKBD O=C(Nc1cc(-c2nnc3n2CCCCC3)ccc1Cl)c1csc(-c2ccc([N+](=O)[O-])cc2)n1 496345840 MHZSFNZNIMYOKV-UHFFFAOYSA-N 494.964 5.609 5 20 JKBD O=C(c1ccc(NCc2ccccc2)c([N+](=O)[O-])c1)N(Cc1cccs1)C[C@H]1CCCO1 500485140 KTTTXWDZFHCIOP-HXUWFJFHSA-N 451.548 5.090 5 20 JKBD CCCC(=O)Nc1cccc(NC(=O)c2ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])cc2)c1C 516780029 JYWXMXFAPRFVLF-UHFFFAOYSA-N 467.909 6.340 5 20 JKBD CCOc1ccc(C(F)(F)F)cc1N[C@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 518743986 UQQIYZDXFKRISU-SNVBAGLBSA-N 465.350 5.470 5 20 JKBD Cc1sc(C(=O)Nc2nc(-c3ccc(OC(F)F)cc3OC(F)F)cs2)cc1[N+](=O)[O-] 519939836 FMUKUYNHSWAPOF-UHFFFAOYSA-N 477.417 5.543 5 20 JKBD CN1C/C(=C\c2ccc(-c3ccccc3[N+](=O)[O-])s2)c2nc3ccccc3c(C(=O)O)c2C1 589333567 PZLHHCVFWHHZKI-NTCAYCPXSA-N 457.511 5.556 5 20 JKBD COCCN(C(=O)c1sc(-c2ccc(C)o2)nc1C)c1nc(-c2ccc([N+](=O)[O-])cc2)cs1 603615932 UMWYBYOJEJOBRQ-UHFFFAOYSA-N 484.559 5.345 5 20 JKBD CC(C)OC(=O)C[C@@H](NC(=O)Nc1cccc(NC(=O)c2ccccc2)c1)c1ccccc1[N+](=O)[O-] 603696417 JSDVPHDARXZDNB-JOCHJYFZSA-N 490.516 5.052 5 20 JKBD COc1ccc(C(=O)Nc2ccc(NC(=O)c3ccccc3)cc2C(F)(F)F)cc1[N+](=O)[O-] 603742986 NYSVHPOWJWKJHR-UHFFFAOYSA-N 459.380 5.127 5 20 JKBD CC(=O)Nc1ccc(S[C@H](C)C(=O)Nc2nc(-c3cccc([N+](=O)[O-])c3)c(C)s2)cc1 603999034 QNFDEVLGUCWQCK-CYBMUJFWSA-N 456.549 5.104 5 20 JKBD CC1CCN(c2ccc(C(=O)Nc3ccc(Cl)cc3NC(=O)c3ccco3)cc2[N+](=O)[O-])CC1 604099507 YXQDZBPWPQRDLF-UHFFFAOYSA-N 482.924 5.582 5 20 JKBD C[C@H](Nc1ccc(C(=O)Nc2ccc(-c3cn4cccnc4n3)cc2)cc1[N+](=O)[O-])c1ccccn1 604338030 DVEDFXGEHUXOFR-KRWDZBQOSA-N 479.500 5.125 5 20 JKBD C[C@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)Nc1ccc(NC(=O)C2CC2)cc1C(F)(F)F 604446597 INQCJLAKZUWABX-JTQLQIEISA-N 471.819 5.022 5 20 JKBD O=[N+]([O-])c1ccc(OC(F)F)c(CNCc2cn(-c3ccccc3)nc2-c2ccccc2)c1 604532160 BQULRLASMPRVMH-UHFFFAOYSA-N 450.445 5.339 5 20 JKBD O=[N+]([O-])c1ccc(OC(F)F)c(CNCc2cn(Cc3ccccc3)nc2-c2ccccc2)c1 604532199 IXNWWSROAGTKGW-UHFFFAOYSA-N 464.472 5.398 5 20 JKBD COc1ccc(OC)c([C@@H](C)NCc2ccc(-c3ccc([N+](=O)[O-])cc3Br)o2)c1 608835432 CSALSJBNJTWUGJ-CYBMUJFWSA-N 461.312 5.485 5 20 JKBD O=C(Cn1c2ccccc2c(=O)c2ccccc21)Nc1ccc(F)c(NC(=O)C2CCCCC2)c1 642595904 JNNXJXTUNTYQIM-UHFFFAOYSA-N 471.532 5.451 5 20 JKBD Cc1ccc(C(C)C)c(Oc2ccc(CN[C@H](C)c3ccc4c(c3)CC(=O)N4C)cc2[N+](=O)[O-])c1 728302542 UDSPPIGUYRRQBB-LJQANCHMSA-N 473.573 6.189 5 20 JKBD CC(C)(C)OC(=O)Nc1ccc(NC(=O)c2cc([N+](=O)[O-])cc([N+](=O)[O-])c2)c(C(F)(F)F)c1 729658040 VOWNQDFOTQLHBP-UHFFFAOYSA-N 470.360 5.121 5 20 JKBD O=C(Nc1ccc(OC(=O)[C@H]2CCCN2Cc2ccccc2)cc1)c1cc([N+](=O)[O-])ccc1Cl 745839200 UWYXUERJGBAJJE-HSZRJFAPSA-N 479.920 5.071 5 20 JKBD COc1ccccc1-c1cc(NC(=O)c2ccccc2C(=O)c2ccc(SC)c([N+](=O)[O-])c2)n[nH]1 746398942 NTNIWVJFTOXTTM-UHFFFAOYSA-N 488.525 5.199 5 20 JKBD Cc1c(C(=O)N(C)Cc2cn(-c3ccccc3)nc2-c2cccs2)cc([N+](=O)[O-])c(C)c1[N+](=O)[O-] 748607420 CMNMCEFDWVEHPI-UHFFFAOYSA-N 491.529 5.306 5 20 JKBD O=C(Nc1nc2ccc(OC(F)(F)F)cc2s1)c1cc([N+](=O)[O-])ccc1Br 751068748 NXSUACNYQDEHPZ-UHFFFAOYSA-N 462.203 5.118 5 20 JKBD Cn1c(Sc2cc(Cl)c(C(F)(F)F)cc2[N+](=O)[O-])nnc1[C@@H]1COc2ccccc2O1 800111647 ZOUSKNSVGQHGTD-AWEZNQCLSA-N 472.832 5.059 5 20 JKBD O=[N+]([O-])c1cc(C(F)(F)F)ccc1N1CCC(c2nc(COc3ccc(F)cc3)no2)CC1 904667903 ULQLHBBDZWTGKH-UHFFFAOYSA-N 466.391 5.099 5 20 JKBD CC(C)c1noc2nc(C3CC3)cc(C(=O)N(Cc3nnc(-c4cccc([N+](=O)[O-])c4)o3)C(C)C)c12 915823819 NIKOPQISOOKMQZ-UHFFFAOYSA-N 490.520 5.233 5 20 JKBD Cc1ccc(S(=O)(=O)Nc2ccc(NC(=S)Nc3ccc4ccccc4c3)cc2)cc1[N+](=O)[O-] 915995206 KIVWXWHRHJTGML-UHFFFAOYSA-N 492.582 5.666 5 20 JKBD COc1ccc(N[C@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Br)c2ccccc2)cc1F 917935417 HFJPPJMUFAIZBT-FQEVSTJZSA-N 474.286 5.297 5 20 JKBD CC(=O)Nc1cc(NC(=O)c2cc([N+](=O)[O-])ccc2N2CCC(Cc3ccccc3)CC2)ccc1C 918628549 URPVOMQVDICRGM-UHFFFAOYSA-N 486.572 5.573 5 20 JKBD C[C@@H](OC(=O)Cc1ccc(NC(=O)c2ccc(Br)o2)cc1)c1cccc([N+](=O)[O-])c1 919394900 GFCFVNUXSVUPEV-CYBMUJFWSA-N 473.279 5.050 5 20 JKBD C[C@H](Nc1ccc(C(=O)Nc2ccc(-c3ccccc3)cc2F)cc1[N+](=O)[O-])c1ccccn1 919713535 UPZSQAQMYWIDIH-KRWDZBQOSA-N 456.477 6.221 5 20 JKBD O=C(Cc1ccc(Cl)cc1[N+](=O)[O-])NC1(c2ccc(NC(=O)c3ccc(Cl)o3)cc2)CCC1 1788877008 LLLJBMBELABTOM-UHFFFAOYSA-N 488.327 5.485 5 20 JKBD O=C(CCc1cccnc1)NC1(c2ccc(NC(=O)C3(c4cccc([N+](=O)[O-])c4)CCC3)cc2)CCC1 1790476019 UAXKFZCOPMAJIG-UHFFFAOYSA-N 498.583 5.178 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)c3cc(-c4ccccc4)no3)CCC2)cc1)c1ccc(O)c([N+](=O)[O-])c1 1790620111 VSTXUHYIJABWED-UHFFFAOYSA-N 498.495 5.017 5 20 JKBD COc1c(Cl)cccc1C(=O)Nc1ccc(C2(NC(=O)c3ccc(O)c([N+](=O)[O-])c3)CCC2)cc1 1792146933 KSKJUQNCNVQNQE-UHFFFAOYSA-N 495.919 5.024 5 20 JKBD O=C(c1csc2c1CCCC2)N1CCC([C@H]2CCCCN2C(=O)/C=C/c2ccc([N+](=O)[O-])o2)CC1 1824277544 RRJXVBZXUGXMBN-DQACCSDVSA-N 497.617 5.075 5 20 JKBD Cc1ccc(NC(=O)[C@H](OC(=O)c2ccc([N+](=O)[O-])cc2Cl)c2ccccc2)c([N+](=O)[O-])c1 11028644 XJJOFBVFUPQIOC-HXUWFJFHSA-N 469.837 5.002 5 20 JKBD CCN(CC)S(=O)(=O)c1ccc(Oc2ccc3c(=O)c(-c4ccccc4)coc3c2)c([N+](=O)[O-])c1 14318767 KASWRCQTHFHAIH-UHFFFAOYSA-N 494.525 5.191 5 20 JKBD COc1ccc([C@H]2CCCN2C(=O)CSc2ccc(C(F)(F)F)cc2[N+](=O)[O-])c(OC)c1 15829677 OORDGDRPGHUQQK-MRXNPFEDSA-N 470.469 5.087 5 20 JKBD CN(Cc1cc([N+](=O)[O-])ccc1Cl)Cn1nc(-c2ccccc2)n(Cc2ccco2)c1=S 27533129 ANGRUHDWCGTORG-UHFFFAOYSA-N 469.954 5.373 5 20 JKBD O=C(COC(=O)c1cc([N+](=O)[O-])ccc1NCc1ccccc1)Nc1ccccc1C(F)(F)F 28606626 VVMBYHSBSUQHIS-UHFFFAOYSA-N 473.407 5.021 5 20 JKBD Cc1nn(Cc2ccc(C(=O)Nc3ccccc3SCC(F)(F)F)cc2)c(C)c1[N+](=O)[O-] 46539891 ODTITEPGCDGMFI-UHFFFAOYSA-N 464.469 5.363 5 20 JKBD c1nc2c(ccc3cc(-c4scc5c4OCCO5)cnc32)cc1-c1scc2c1OCCO2 95830624 NNNJFZNRZQYNOQ-UHFFFAOYSA-N 460.536 5.782 5 20 JKBD Cc1cccc(Cn2nccc2NC(=O)C2CCN(c3ccc(C(F)(F)F)cc3[N+](=O)[O-])CC2)c1 105943434 DNZPOYJPKMIIIX-UHFFFAOYSA-N 487.482 5.022 5 20 JKBD COc1ccccc1-c1nnc(SCC(=O)c2cccc([N+](=O)[O-])c2)n1-c1ccc(C)cc1 216416258 GWQCVKNQEINXBJ-UHFFFAOYSA-N 460.515 5.135 5 20 JKBD O=[N+]([O-])c1ccc(-c2nn(-c3ccccc3)cc2CNCc2ccccc2OC(F)F)cc1 218049620 DLXWUNHRACEOAN-UHFFFAOYSA-N 450.445 5.339 5 20 JKBD C[C@H](NC(=O)CSc1ccc(C(F)(F)F)cc1[N+](=O)[O-])c1nc(-c2ccccc2)cs1 410292155 QBSGVBYLBTZDLK-LBPRGKRZSA-N 467.494 5.707 5 20 JKBD CSc1ccc([N+](=O)[O-])c(C(=O)N[C@H](C)c2cccc(NC(=O)Cc3ccccc3F)c2)c1 483290181 BFHLCKMJKJCQSI-OAHLLOKOSA-N 467.522 5.128 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)N2CCC(C(=O)c3ccc(CC(C)C)cc3)CC2)cc1SC 484666021 DEYHZLBIRWSGPV-UHFFFAOYSA-N 470.591 5.259 5 20 JKBD COc1cc(CN[C@@H](C)c2nc(-c3ccccc3)cs2)ccc1OCc1ccc([N+](=O)[O-])cc1 501352045 QWQUWXWBXZWRBH-SFHVURJKSA-N 475.570 6.157 5 20 JKBD Cc1ncc(CN(C)C(=O)C/C(=C\c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)s1 502906442 HKTOVRZTQRISMI-GZTJUZNOSA-N 464.572 5.559 5 20 JKBD O=C1CCCN1Cc1ccccc1CNCc1ccc(Oc2ccccc2Cl)c([N+](=O)[O-])c1 509585885 WTSIJZHTTKULMW-UHFFFAOYSA-N 465.937 5.453 5 20 JKBD O=C(CSc1ccc(C(F)(F)F)cc1[N+](=O)[O-])NCc1cccc(NC(=O)C2CCCC2)c1 515672121 FQXLANYOFMCRQZ-UHFFFAOYSA-N 481.496 5.151 5 20 JKBD C[C@@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)NCC1(c2ccc(Cl)cc2Cl)CCOCC1 518856088 DRSKSEIGWZFRFY-CYBMUJFWSA-N 487.767 5.187 5 20 JKBD COc1ccc(Br)cc1[C@@H]1CCCN1C(=O)Nc1cc([N+](=O)[O-])ccc1OC(F)F 522955973 YBQZRBKDYLKNPK-HNNXBMFYSA-N 486.269 5.336 5 20 JKBD O=C(C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)NCc1cn2ccccc2n1 582679896 XTCAFLVZZDTXDL-AQTBWJFISA-N 469.526 5.099 5 20 JKBD Cc1c(NC(=O)[C@@H](C)Sc2nnc(-c3ccccc3)c(-c3ccccc3)n2)cccc1[N+](=O)[O-] 597224119 YBVZVXDDZVAPBC-QGZVFWFLSA-N 471.542 5.542 5 20 JKBD COc1ccccc1CCNC(=O)C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1 603448789 WAMCVHHEFZIRBF-SILNSSARSA-N 473.554 5.503 5 20 JKBD CCCc1ccc([C@H](NC(=O)C(=O)Nc2cc([N+](=O)[O-])ccc2OC(F)F)c2cccs2)cc1 604140731 XHYMNWYNTMWDBY-FQEVSTJZSA-N 489.500 5.055 5 20 JKBD Cc1csc(Sc2ccc(C(=O)N3CCC[C@H]3c3nc4ccccc4n3C)cc2[N+](=O)[O-])n1 604481221 QRVPVKOAFUDPRF-SFHVURJKSA-N 479.587 5.375 5 20 JKBD COc1ccc([C@H](Nc2cnn(-c3ccc([N+](=O)[O-])cc3)c(=O)c2Cl)c2ccc(F)cc2)cc1 608830787 DWQXOVMSLPRPKQ-HSZRJFAPSA-N 480.883 5.143 5 20 JKBD Cc1ccc([N+](=O)[O-])cc1NC(=O)CC1(CC(=O)Nc2cc([N+](=O)[O-])ccc2C)CCCC1 729827726 SVIRVMMXHYZMMV-UHFFFAOYSA-N 454.483 5.038 5 20 JKBD CC1CCN(c2ccc([N+](=O)[O-])cc2C(=O)Nc2cccc(COCCOC(C)C)c2)CC1 743711582 WOVCBPFIHATJRM-UHFFFAOYSA-N 455.555 5.025 5 20 JKBD Cc1nn(Cc2ccc(C(=O)O[C@@H](C)c3nnc(-c4cccc(Cl)c4)o3)cc2)c(C)c1[N+](=O)[O-] 746206895 VXGUUIKNNRISFE-HNNXBMFYSA-N 481.896 5.078 5 20 JKBD O=C(OCc1nc(-c2ccc(C(F)(F)F)cc2)no1)c1csc(-c2cccc([N+](=O)[O-])c2)n1 747961572 FGZUHINRJRPQIG-UHFFFAOYSA-N 476.392 5.144 5 20 JKBD O=C(Cc1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1)OCc1c(Cl)nc2sccn12 750877408 FVMLSAREXDHIRJ-UHFFFAOYSA-N 493.932 5.096 5 20 JKBD Cc1onc(-c2c(F)cccc2Cl)c1C(=O)O[C@@H](C)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl 766589484 CZFIBOXVJVUDSL-JTQLQIEISA-N 482.251 5.188 5 20 JKBD CCC(CC)c1nnc(NC(=O)c2ccccc2NC(=O)c2ccc([N+](=O)[O-])cc2Cl)s1 894896280 KWSPRZLKAQOBGX-UHFFFAOYSA-N 473.942 5.508 5 20 JKBD O=C(Nc1ccc(Cl)c([N+](=O)[O-])c1)[C@@H](Sc1nncc2ccccc12)c1ccccc1 900667058 LKHBLLZRULYDNN-FQEVSTJZSA-N 450.907 5.664 5 20 JKBD COc1cc(-c2nc(-c3cnn4c(C)cc(C)nc34)no2)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 904378104 ZBDIIIQYLULHAX-UHFFFAOYSA-N 492.879 5.426 5 20 JKBD O=[N+]([O-])c1cc(C(F)(F)F)ccc1N1CCC(c2nc(-c3ccc(Br)o3)no2)CC1 904630867 GYYKLQGKCAKEKT-UHFFFAOYSA-N 487.232 5.403 5 20 JKBD COc1cc(C(=O)Nc2ccc(/C=C/C(=O)O)cc2)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 914730685 IBAGDXHCTIQQAJ-NYYWCZLTSA-N 468.849 5.399 5 20 JKBD C[C@H](SCc1ccccc1)C(=O)Oc1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2Cl)cc1 916037280 VXOGIEMNGMUXQL-HNNXBMFYSA-N 470.934 5.728 5 20 JKBD O=C(C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)Oc1ccc(NC(=O)C2CC2)cc1 918603495 OAWGZUIEJURNSS-CYVLTUHYSA-N 499.548 6.089 5 20 JKBD CC(=O)N(c1cccc(Cl)c1)c1nc(COC(=O)c2cc3cccc([N+](=O)[O-])c3[nH]2)cs1 919526860 WTHRQYHWBYTAIF-UHFFFAOYSA-N 470.894 5.228 5 20 JKBD Cc1c(C(=O)NC2(c3ccc(NC(=O)c4ccco4)cc3)CCC2)cc(Cl)cc1[N+](=O)[O-] 1787271949 AZJXBKGXMDTERH-UHFFFAOYSA-N 453.882 5.211 5 20 JKBD O=C(/C=C/c1ccc([N+](=O)[O-])o1)NC1(c2ccc(NC(=O)c3ccc4scnc4c3)cc2)CCC1 1789338065 OXUDROPJQCXWND-JXMROGBWSA-N 488.525 5.259 5 20 JKBD Cc1cc(C(=O)NC2(c3ccc(NC(=O)c4cccc(Cl)c4)cc3)CCC2)ncc1[N+](=O)[O-] 1790266076 BZLOIHAQFWNDET-UHFFFAOYSA-N 464.909 5.013 5 20 JKBD O=C(CSc1ccccc1[N+](=O)[O-])Nc1ccc(C2(NC(=O)CCc3ccsc3)CCC2)cc1 1791522137 GHKSMJRQXQIDIF-UHFFFAOYSA-N 495.626 5.515 5 20 JKBD Cc1cc(CCCC(=O)N2CCCC[C@H]2C2CCN(C(=O)c3ccoc3C)CC2)c([N+](=O)[O-])cc1F 1824369886 BDRMSXUAAMIIPK-DEOSSOPVSA-N 499.583 5.200 5 20 JKBD O=C(c1ccc(C2CC2)cc1)N1CCC([C@@H]2CCCCN2C(=O)Cc2cc([N+](=O)[O-])ccc2F)CC1 1824948225 CILVZFWTRYLOIW-SANMLTNESA-N 493.579 5.087 5 20 JKBD Cc1cnc(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3cc4cc([N+](=O)[O-])ccc4s3)CC2)s1 1825694769 DGMMTUFMIQXHEA-LJQANCHMSA-N 498.630 5.122 5 20 JKBD O=C(c1ccc([N+](=O)[O-])o1)N1CCC([C@H]2CCCCN2C(=O)c2cc3cccc(F)c3s2)CC1 1828151733 IDDDFAZMPLSCEY-GOSISDBHSA-N 485.537 5.089 5 20 JKBD CC[C@H](C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cc(F)cc([N+](=O)[O-])c2)CC1)c1ccccc1 1830613939 IZRLHSDGZKEGIR-LOSJGSFVSA-N 481.568 5.161 5 20 JKBD O=C(c1cc(F)cc([N+](=O)[O-])c1)N1CCCC[C@@H]1C1CCN(C(=O)C2(c3ccccc3)CCC2)CC1 1830615354 CMOYCPQOGMNQSY-RUZDIDTESA-N 493.579 5.089 5 20 JKBD CSc1ccc(C(=O)O[C@@H](C)C(=O)Nc2c(Cl)cc(Cl)cc2Cl)cc1[N+](=O)[O-] 9621318 DHXXSGGZRIBVFA-QMMMGPOBSA-N 463.726 5.461 5 20 JKBD CNc1ccc(C(=O)OCc2csc(N(C(C)=O)c3c(C)cc(C)cc3C)n2)cc1[N+](=O)[O-] 9924203 PKSZSSARXJVFIN-UHFFFAOYSA-N 468.535 5.060 5 20 JKBD COc1ccc2cc(CN(C)C(=O)CSc3nc4ccc([N+](=O)[O-])cc4s3)ccc2c1 10084277 LFSJOIXHWIFLKJ-UHFFFAOYSA-N 453.545 5.117 5 20 JKBD Cc1ccc(-n2ccnc2S[C@@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2C(F)(F)F)cc1C 23050425 NQPCXFRBVPWMSG-AWEZNQCLSA-N 464.469 5.535 5 20 JKBD Cc1c(-c2ccccc2)nc2ccccc2c1C(=O)OCc1nnc(-c2ccc([N+](=O)[O-])cc2)o1 28614612 ZHMUBZMWDKIKKH-UHFFFAOYSA-N 466.453 5.525 5 20 JKBD Cc1c(NC(=O)[C@H](C)OC(=O)c2cc(-c3cccs3)nc3c2cnn3C(C)C)cccc1[N+](=O)[O-] 28646441 FZWDLRRCUBPFQU-HNNXBMFYSA-N 493.545 5.141 5 20 JKBD CCOc1cc2c(cc1OCC)CN(C(=O)CSc1ccc(C(F)(F)F)cc1[N+](=O)[O-])CC2 29708910 VYVGVBOCUNUTLG-UHFFFAOYSA-N 484.496 5.088 5 20 JKBD CC(=O)c1ccc(Sc2nnc(-c3ccc(Cl)cc3Cl)n2Cc2ccco2)c([N+](=O)[O-])c1 69492430 IPAGEWPRTURJOE-UHFFFAOYSA-N 489.340 6.155 5 20 JKBD Cn1cc(-c2nc(COC(=O)c3ccc(Oc4ccc(Cl)cc4[N+](=O)[O-])cc3)cs2)cn1 108045510 QTVBETLJPSAOLF-UHFFFAOYSA-N 470.894 5.255 5 20 JKBD CCOc1cc(NC(=O)c2cn(-c3ccccc3)nc2-c2ccc(C)o2)c([N+](=O)[O-])cc1OCC 478086492 WSWYEUYWHLZWKO-UHFFFAOYSA-N 476.489 5.399 5 20 JKBD Cc1cc(Oc2nc(CN3CCOCC3)nc3scc(-c4ccccc4)c23)ccc1[N+](=O)[O-] 484187208 JAJYEQSZDNGCJQ-UHFFFAOYSA-N 462.531 5.199 5 20 JKBD CCCCN(CC(F)(F)F)C(=O)Cc1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1 486068205 IYIOJGVHYXEMEJ-UHFFFAOYSA-N 460.456 5.181 5 20 JKBD C[C@H](NC(=O)C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)c1ccc2c(c1)CC(=O)N2 501049669 CHOGKTAPOXOWIT-DEFALTHMSA-N 498.564 5.507 5 20 JKBD C[C@@H](Nc1ccc(C(=O)Nc2ccccc2COCc2ccccc2)cc1[N+](=O)[O-])c1ccccn1 507366494 GQVILOSUPZYEMT-HXUWFJFHSA-N 482.540 6.132 5 20 JKBD COc1cc(C(=O)NCc2nc(-c3ccc(Cl)cc3)c(C)s2)c([N+](=O)[O-])cc1OC(F)F 507890978 RYLHPIGUYTWJCV-UHFFFAOYSA-N 483.880 5.220 5 20 JKBD COc1ccc(CNCc2ccc(Oc3ccccc3Cl)c([N+](=O)[O-])c2)cc1OC(F)F 509614673 BUZULKFOSPCBQY-UHFFFAOYSA-N 464.852 5.940 5 20 JKBD CC(C)[C@@H](C)NC(=O)C1CCN(C(=O)c2cc([N+](=O)[O-])ccc2Sc2ccc(Cl)cc2)CC1 512297526 CLEBSMUBCQIQPQ-MRXNPFEDSA-N 490.025 5.412 5 20 JKBD COc1ccccc1OCC(=O)Nc1cccc(NC(=O)c2cc3ccccc3c3cccnc23)c1 515674713 GLDLJNVILTXPQN-UHFFFAOYSA-N 477.520 5.666 5 20 JKBD C[C@H]1CCCCN1C(=O)c1ccc(NC(=O)CSc2ccc(C(F)(F)F)cc2[N+](=O)[O-])cc1 515697779 XIFDASXFAUVWSF-AWEZNQCLSA-N 481.496 5.359 5 20 JKBD O=C(C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)N1CCc2ccccc2C1 601256996 ITGYOKMNURVCBU-RCCKNPSSSA-N 455.539 5.720 5 20 JKBD O=C(CSc1ccc(C(F)(F)F)cc1[N+](=O)[O-])Nc1cccnc1OCc1ccccc1 603817233 KEXBRRMPMMBWJE-UHFFFAOYSA-N 463.437 5.318 5 20 JKBD Cc1ccc(C(=O)C2CCN(c3c([N+](=O)[O-])cnc4ccc(Br)cc34)CC2)cc1 603932135 NGGJZEGRSTXVEG-UHFFFAOYSA-N 454.324 5.313 5 20 JKBD Cc1csc([C@H](C)NC(=O)c2ccccc2Sc2ccc(C(F)(F)F)cc2[N+](=O)[O-])n1 609015625 VWRQYYLBKFIBGV-LBPRGKRZSA-N 467.494 6.021 5 20 JKBD C[C@H](Nc1ccc(C(=O)N[C@H](C)c2ccc(F)c(Br)c2)cc1[N+](=O)[O-])c1ccccn1 609374975 OENUVHCVQVEEGK-KGLIPLIRSA-N 487.329 5.556 5 20 JKBD CC(=O)N1CCc2ccccc2[C@H]1CC(=O)Nc1cc(Cl)c([N+](=O)[O-])cc1OCc1ccccc1 727960763 CFDLNKHJFILKCM-HSZRJFAPSA-N 493.947 5.302 5 20 JKBD Cc1c(C(=O)N[C@@H]2CCCc3nc(-c4ccc(F)cc4)sc32)cc([N+](=O)[O-])c(C)c1[N+](=O)[O-] 729419127 HNUQLVRMFWLNEE-MRXNPFEDSA-N 470.482 5.190 5 20 JKBD O=C(c1cccc(S(=O)(=O)Cc2ccccc2)c1)N(CC1CC1)c1ccc(Cl)c([N+](=O)[O-])c1 730749082 XYWKFEVXZKEZMC-UHFFFAOYSA-N 484.961 5.279 5 20 JKBD CC(C)(C)c1ccc([C@H]2CCCN2C(=O)COC(=O)c2csc(-c3cccc([N+](=O)[O-])c3)n2)cc1 747955529 INXMXEOARPURID-JOCHJYFZSA-N 493.585 5.536 5 20 JKBD O=C(Nc1cccc(Cl)c1SC(F)F)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-] 751230024 VAOCXXLKOJNIRJ-UHFFFAOYSA-N 456.776 5.756 5 20 JKBD C[C@@H]1CCC[C@@H](C)N1C(=O)c1cc(Cl)ccc1NC(=O)c1cc(Cl)ccc1[N+](=O)[O-] 915154210 LAIIYMTXHBLTKV-CHWSQXEVSA-N 450.322 5.557 5 20 JKBD C[C@@H](OC(=O)c1cc(C2CC2)nc2onc(CC(C)(C)C)c12)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 915581262 IMCCZJQPPQZDAE-CYBMUJFWSA-N 491.504 5.565 5 20 JKBD Cc1ccc(/C(O)=C(/C(=S)Nc2ccc(Cl)cc2)[n+]2ccc(C(C)(C)C)cc2)cc1[N+](=O)[O-] 916204582 ZUIYVXQNZHCHBZ-UHFFFAOYSA-O 483.013 6.465 5 20 JKBD CN(Cc1cc([N+](=O)[O-])ccc1Cl)C(=O)c1ccc(NC(=O)c2ccc(Br)o2)cc1 917069016 HZVBILSGNUYCMC-UHFFFAOYSA-N 492.713 5.128 5 20 JKBD CN(C(=O)c1ccc(NC(=O)c2ccc(Cl)c([N+](=O)[O-])c2)cc1Cl)C1CCCCC1 917754957 OZGBTTLZWPCEEJ-UHFFFAOYSA-N 450.322 5.559 5 20 JKBD Cc1ccc2[nH]c(C(=O)NC3(c4ccc(NC(=O)c5ccc([N+](=O)[O-])o5)cc4)CCC3)cc2c1 1785749005 WPFWEDXKVMWXIP-UHFFFAOYSA-N 458.474 5.039 5 20 JKBD O=C(NC1(c2ccc(NC(=O)c3cccc4c3oc3ccccc34)cc2)CCC1)c1n[nH]cc1[N+](=O)[O-] 1791008257 YZDRQJGMBSGBHP-UHFFFAOYSA-N 495.495 5.279 5 20 JKBD CCC[C@H]1CC[C@H](C(=O)N2CC[C@@H](CNC(=O)c3cccc(F)c3[N+](=O)[O-])[C@@H]2c2cccnc2)CC1 1811322510 FOSXPTDPAXHTJU-RSKVWTTASA-N 496.583 5.055 5 20 JKBD Cc1ccc(-c2ccccc2C(=O)N2CCCC[C@H]2c2cc(NC(=O)c3ccc([N+](=O)[O-])[nH]3)n[nH]2)cc1 1820367267 MEHHNWARCLJYFS-QHCPKHFHSA-N 498.543 5.241 5 20 JKBD O=C(/C=C/C1CCCCC1)Nc1cc([C@@H]2CCCCN2C(=O)/C=C/c2ccccc2[N+](=O)[O-])[nH]n1 1820909596 ALZBTOANKUTSJQ-ZHRBMVOGSA-N 477.565 5.160 5 20 JKBD CCc1ccc(C(=O)N2CCCC[C@H]2C2CCN(C(=O)CSc3ccccc3[N+](=O)[O-])CC2)cc1 1830072698 HQEAISHEZCQHHK-QHCPKHFHSA-N 495.645 5.183 5 20 JKBD CC(C)=CCCC(=O)N1CCCC[C@H]1C1CCN(C(=O)Cc2ccc(Cl)cc2[N+](=O)[O-])CC1 1830249380 FBCQQDZCEPQARO-QFIPXVFZSA-N 476.017 5.157 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)N1CCCC[C@H]1C1CCN(C(=O)[C@@]2(C)CC=CCC2)CC1 1830729739 VTORSHKSMCGJFZ-NVQXNPDNSA-N 471.573 5.022 5 20 JKBD CC1=CC[C@H](C(=O)N2CCC([C@H]3CCCCN3C(=O)CSc3ccccc3[N+](=O)[O-])CC2)CC1 1831776109 JDNKQHSFONKPNU-FCHUYYIVSA-N 485.650 5.053 5 20 JKBD COc1cc(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3ccc(C)cc3Cl)CC2)ccc1[N+](=O)[O-] 1832697539 PDGHATOALRVVMY-JOCHJYFZSA-N 499.995 5.112 5 20 JKBD CCc1ccccc1NC(=O)CN(C)C(=O)c1ccc(NCc2ccccc2Cl)c([N+](=O)[O-])c1 17903798 RASQSMRKQSUCGC-UHFFFAOYSA-N 480.952 5.133 5 20 JKBD CCOc1cc(C(=O)Nc2nc(-c3ccc(OC(F)F)cc3)c(C)s2)c([N+](=O)[O-])cc1OC 21597365 BQSSRZUGKFBKRF-UHFFFAOYSA-N 479.461 5.288 5 20 JKBD Cc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H](c1ccccc1)c1ccc2nc(C(F)(F)F)[nH]c2c1 303079509 UABZIGWILIEHBW-FQEVSTJZSA-N 454.408 5.318 5 20 JKBD CCCOc1cc(C)ccc1NC(=O)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 488364720 WGHRKLOXKHBIIA-UHFFFAOYSA-N 465.472 5.566 5 20 JKBD O=[N+]([O-])c1cccc(F)c1CSc1nnc(-c2ccc(Br)o2)n1Cc1ccccc1 504501945 FSIBLWKLCPXMPQ-UHFFFAOYSA-N 489.326 5.689 5 20 JKBD C[C@@H](c1ccccc1)n1c(SCc2nc(-c3ccc([N+](=O)[O-])cc3)no2)nc2ccccc2c1=O 514458132 FWWUUBJLSCKYSH-INIZCTEOSA-N 485.525 5.256 5 20 JKBD Cc1nn(Cc2ccc(C(=O)N3CCC[C@@H]3c3cccc(Br)c3)cc2)c(C)c1[N+](=O)[O-] 515934681 CKBUENBSVMMPGY-OAQYLSRUSA-N 483.366 5.196 5 20 JKBD COC(=O)c1ccccc1C(=O)c1ccc(N2CCC(OC3CCC(C)CC3)CC2)c([N+](=O)[O-])c1 518661953 OITNQKHDPDUAMD-UHFFFAOYSA-N 480.561 5.177 5 20 JKBD Cc1ccc(NC(=O)Nc2ccccc2)cc1NC(=O)[C@H](C)Oc1ccc(Cl)cc1[N+](=O)[O-] 518832990 RIZDEOJZSJEAOV-HNNXBMFYSA-N 468.897 5.607 5 20 JKBD Cc1ccc(NC(=O)c2cccc(C(F)(F)F)c2)cc1NC(=O)N[C@@H](C)c1cccc([N+](=O)[O-])c1 520489573 XBOGQJLKKWKYBC-HNNXBMFYSA-N 486.450 6.057 5 20 JKBD O=C(Nc1ccccc1Oc1ncc(Cl)cc1Cl)c1ccn(-c2ccc([N+](=O)[O-])cc2)n1 521380602 GVKLTQVQMZLPJG-UHFFFAOYSA-N 470.272 5.527 5 20 JKBD NC(=O)CC[C@H]1CCCN(C(=O)c2c3c(nc4ccccc24)/C(=C\c2ccc([N+](=O)[O-])cc2)CCC3)C1 524039557 FNZFFPSXYIFBQO-HTNUNKGTSA-N 498.583 5.138 5 20 JKBD COc1cc([C@H](C)Nc2ccc(Br)cc2[N+](=O)[O-])ccc1OCc1ccncc1 549782364 PGQTTYWIXIBPDN-AWEZNQCLSA-N 458.312 5.513 5 20 JKBD CN(c1ccccc1)S(=O)(=O)c1cccc(NCc2ccc(C(F)(F)F)cc2[N+](=O)[O-])c1 600860744 OVTMUFMAOHUACG-UHFFFAOYSA-N 465.453 5.051 5 20 JKBD COC(=O)CCCN(C)C(=O)c1c2c(nc3ccccc13)/C(=C\c1cccc([N+](=O)[O-])c1)CCC2 602221294 UIRWEKBMXIOUHF-MNDPQUGUSA-N 473.529 5.045 5 20 JKBD CC(C)(C)c1ccc(C(=O)Nc2cc(-c3nnc4n3CCCCC4)ccc2F)cc1[N+](=O)[O-] 603156541 QOFAUNALDDZRKH-UHFFFAOYSA-N 451.502 5.269 5 20 JKBD CN(C(=O)c1ccc(NC(=O)c2ccc(-n3ccnc3)c([N+](=O)[O-])c2)cc1Cl)C1CCCCC1 603982407 KHQFMJJZNXXKPY-UHFFFAOYSA-N 481.940 5.091 5 20 JKBD C[C@@H]1CN(C(=O)c2ccc(NC(=O)c3cc([N+](=O)[O-])ccc3Sc3ccccc3)cc2)C[C@@H](C)O1 604022563 WBSIPMFXDYKAKQ-QZTJIDSGSA-N 491.569 5.248 5 20 JKBD Cc1ccc(CN[C@@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Br)c2ccccc2)s1 604044689 FXTRQHFWRPLTOT-LJQANCHMSA-N 460.353 5.197 5 20 JKBD CCN(CC)C(=O)c1ccc(NC(=O)c2ccc(N3CCC(C)CC3)c([N+](=O)[O-])c2)cc1Cl 604102790 SXLSOVNKQLRKIF-UHFFFAOYSA-N 472.973 5.219 5 20 JKBD O=C(NCCN1Cc2ccccc2C1)c1ccccc1Sc1ccc(C(F)(F)F)cc1[N+](=O)[O-] 604481325 DIONWQFUFLYPLE-UHFFFAOYSA-N 487.503 5.510 5 20 JKBD COCCOc1ncccc1NC(=O)c1ccc(Sc2nc3ccccc3s2)c([N+](=O)[O-])c1 609062263 JWZVQMJCTJQGQU-UHFFFAOYSA-N 482.543 5.028 5 20 JKBD COc1ccc(CN(Cc2ccc(OC)cc2)C(=O)c2ccc(N3CCCC3)c([N+](=O)[O-])c2)cc1 609130278 NRYLEKFTKPXETM-UHFFFAOYSA-N 475.545 5.055 5 20 JKBD O=C(Nc1nnc(-c2ccco2)s1)c1ccc(NCc2ccccc2Cl)c([N+](=O)[O-])c1 612037992 QSZXYHRPOXSHPQ-UHFFFAOYSA-N 455.883 5.224 5 20 JKBD CC(=O)Nc1cccc(COC(=O)C/C(=C\c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)c1 725918312 HQKZLMXTPNTHGN-DEDYPNTBSA-N 487.537 5.837 5 20 JKBD O=[N+]([O-])c1cc(Br)ccc1Sc1nnc(-c2ccncc2)n1Cc1ccccc1 726786271 DNAPIJOFTIXWAL-UHFFFAOYSA-N 468.336 5.210 5 20 JKBD Cn1ccnc1[C@H](NC(=O)CCC(=O)c1ccc2ccc3cccc4ccc1c2c34)c1ccc(F)cc1 727753764 RJRBUXGLGVUTRM-SSEXGKCCSA-N 489.550 6.325 5 20 JKBD CN1CCN(c2ccc(CNC(=O)CCC(=O)c3ccc4ccc5cccc6ccc3c4c56)cn2)CC1 727766231 TWVGCIRIYISRHX-UHFFFAOYSA-N 490.607 5.010 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)O[C@H](C)C(=O)N[C@H](C)c2ccc(Cl)cc2Cl)cc1SC 728651018 OYWQRFVNSLRPIR-GHMZBOCLSA-N 487.361 5.055 5 20 JKBD Cc1ccsc1C(=O)Nc1ccc(OC(=O)c2cc([N+](=O)[O-])ccc2N2CCCC2)cc1 729215449 DCNCUPOWZGKUEQ-UHFFFAOYSA-N 451.504 5.036 5 20 JKBD O=C(c1c2c(nc3ccccc13)/C(=C/c1ccc([N+](=O)[O-])cc1)CCC2)N1CCC[C@H](C2OCCO2)C1 729361626 YJQOLIONYMALSF-NUTRWHQKSA-N 499.567 5.245 5 20 JKBD C[C@@H](OC(=O)c1csc(-c2ccc([N+](=O)[O-])cc2)n1)C(=O)N[C@H](C)c1ccc2c(c1)CCCC2 747958177 UUJWXSBHKVGBRC-HZPDHXFCSA-N 479.558 5.020 5 20 JKBD C[C@@H](Nc1ccc(C(=O)O[C@@H](c2cccc(F)c2)c2ccccn2)cc1[N+](=O)[O-])c1ccccn1 750629874 AVZHRDGMVMFDMW-NSYGIPOTSA-N 472.476 5.643 5 20 JKBD C[C@@H](NC(=O)c1cc([N+](=O)[O-])ccc1Br)c1ccc(NC(=O)c2ccc(F)cc2)cc1 751096514 CJNVNJIAOSDWED-CYBMUJFWSA-N 486.297 5.240 5 20 JKBD CC(C)n1ncc2cc(C(=O)O[C@@H](C(=O)Nc3ccc(Cl)c([N+](=O)[O-])c3)c3ccccc3)cnc21 811623377 JGMFGURQKQQMOG-OAQYLSRUSA-N 493.907 5.111 5 20 JKBD O=C(Nc1ncc(Cc2ccc(Br)cc2)s1)c1cc(Cl)ccc1[N+](=O)[O-] 812286960 LPSYWYKIYVSYTK-UHFFFAOYSA-N 452.717 5.310 5 20 JKBD CC(C)N(Cc1nnc(-c2cccc([N+](=O)[O-])c2)o1)C(=O)CCOc1ccc2ccccc2c1 914713706 PIYCIJGVYZPYAL-UHFFFAOYSA-N 460.490 5.004 5 20 JKBD CC(=O)N(c1ccc(C)cc1)c1nc(COC(=O)c2cc3cc([N+](=O)[O-])ccc3s2)cs1 918990461 KIVYOTSUQNYQHE-UHFFFAOYSA-N 467.528 5.616 5 20 JKBD Cc1cc(C(=O)O[C@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2ccc(Br)cc2n1 919521771 JPHRJIPQLHHOAZ-LLVKDONJSA-N 492.713 5.051 5 20 JKBD CCN(Cc1ccc(C(F)(F)F)cc1)C(=O)c1cc(OC)c(OCc2cscn2)cc1[N+](=O)[O-] 919999071 SDRZDHIILAYVCE-UHFFFAOYSA-N 495.479 5.320 5 20 JKBD O=C(Nc1nnc(C(F)F)s1)c1cc([N+](=O)[O-])ccc1N1CCC(Cc2ccccc2)CC1 920229423 UPNCJKUAKALOBJ-UHFFFAOYSA-N 473.505 5.095 5 20 JKBD C[C@H](Nc1ccc(C(=O)OCC(=O)Nc2ccccc2C(C)(C)C)cc1[N+](=O)[O-])c1ccccn1 920545145 FZRKVTNGQSRQQG-KRWDZBQOSA-N 476.533 5.256 5 20 JKBD O=C(O[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1)c1ccn(-c2cccc(F)c2)n1 920704091 WFCPYHOFCORSHM-JOCHJYFZSA-N 494.866 5.110 5 20 JKBD CC1=CC[C@@H](C(=O)Nc2ccc(C3(NC(=O)c4cc([N+](=O)[O-])cc5c4OCC5)CCC3)cc2)CC1 1789114599 HYEIZMHFGPWXDF-GOSISDBHSA-N 475.545 5.024 5 20 JKBD Cc1ccc(CC(=O)NC2(c3ccc(NC(=O)c4ccoc4Cl)cc3)CCC2)cc1[N+](=O)[O-] 1790204956 ITKODAWSAIRTLY-UHFFFAOYSA-N 467.909 5.140 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)[C@]3(F)CCCC=C3F)CCC2)cc1)c1cccc(F)c1[N+](=O)[O-] 1790702375 ISRHOPMXUOEHLY-DEOSSOPVSA-N 473.451 5.227 5 20 JKBD CC(C)[C@H](C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cccc(F)c2[N+](=O)[O-])[nH]n1)c1ccccc1 1814931829 QPRQWCVJOATSQG-GGAORHGYSA-N 493.539 5.203 5 20 JKBD Cc1oc(C(C)(C)C)cc1C(=O)N1CCCC[C@@H]1c1cc(NC(=O)/C=C/c2ccc([N+](=O)[O-])o2)n[nH]1 1814966513 KCVHIERAKCOXQG-LHUXKHBRSA-N 495.536 5.129 5 20 JKBD Cc1csc(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)c3cc4cc([N+](=O)[O-])ccc4s3)n[nH]2)c1 1821610972 KFIIQJGIACLBOT-QGZVFWFLSA-N 495.586 5.522 5 20 JKBD O=C(C1CCC(c2ccc(Cl)cc2)CC1)N1CC2(CCCN2C(=O)c2cccc(F)c2[N+](=O)[O-])C1 1845404864 VXTVNIDXXPMICS-UHFFFAOYSA-N 499.970 5.178 5 20 JKBD CN(Cc1ccc2c(c1)OCCO2)C(=O)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1 14058968 RCNWECQOVKXTTJ-UHFFFAOYSA-N 454.866 5.084 5 20 JKBD Cc1ccc(NC(=O)[C@H](OC(=O)Cc2c(C)nn(-c3ccccc3)c2C)c2ccccc2)c([N+](=O)[O-])c1 19195524 RJKSOLUTSSQIQM-HHHXNRCGSA-N 498.539 5.171 5 20 JKBD CCn1c(SCC(=O)c2cc(C)n([C@@H](C)COC)c2C)nc2cc3ccccc3cc2c1=O 22178799 CQAYOPLBYPHHIC-KRWDZBQOSA-N 463.603 5.170 5 20 JKBD Cc1ccc([N+](=O)[O-])cc1NC(=O)CSc1nnc(Nc2ccc(OC(F)(F)F)cc2)s1 22181005 XZOKEOBAOIFELN-UHFFFAOYSA-N 485.469 5.128 5 20 JKBD CC(C)c1ccc(CSc2nnc(SCC(=O)Nc3ccc(F)c([N+](=O)[O-])c3)s2)cc1 24205011 JEXLYLNJUQIRPP-UHFFFAOYSA-N 478.596 5.732 5 20 JKBD CCCn1c(C)cc(-c2csc(NC(=O)c3cc(OCC)c(OC)cc3[N+](=O)[O-])n2)c1C 26770369 BSHVNAHPCIFECV-UHFFFAOYSA-N 458.540 5.206 5 20 JKBD CCOc1ccc(C(=O)NC[C@H](c2cccc(OC)c2OC)c2c[nH]c3ccccc23)cc1[N+](=O)[O-] 45864040 CNAIPXUXBFXUPS-OAQYLSRUSA-N 489.528 5.054 5 20 JKBD COc1ccc(NC(=O)CSc2ccc(C(F)(F)F)cc2[N+](=O)[O-])cc1OCc1ccncc1 116942959 SHIULKDONSZEHD-UHFFFAOYSA-N 493.463 5.327 5 20 JKBD C[C@H](Nc1ccc(C(=O)N[C@H]2CCCc3cc(OC(F)F)ccc32)cc1[N+](=O)[O-])c1ccccn1 302973694 IZXXXECEDVWYTI-BTYIYWSLSA-N 482.487 5.572 5 20 JKBD O=C(Cn1c2ccccc2c(=O)c2ccccc21)Nc1cc(-c2cc(F)cc(Br)c2)[nH]n1 512348116 NDMGBGYPLZOUEL-UHFFFAOYSA-N 491.320 5.085 5 20 JKBD COc1cc(C(=O)N(C)[C@@H](C)c2cccc(Cl)c2)c([N+](=O)[O-])cc1OCc1cscn1 512403399 LBLIQXGMTQOEJV-ZDUSSCGKSA-N 461.927 5.126 5 20 JKBD COc1ccccc1Oc1ccc(N[C@@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2C(F)(F)F)cc1F 512545983 YKEOUUYDRZVFGH-ZDUSSCGKSA-N 493.413 5.993 5 20 JKBD Cc1ccc(-c2csc(NC(=O)C3(c4ccc(Cl)cc4)CCOCC3)n2)cc1[N+](=O)[O-] 512835483 VGKGJSZFEGUPHN-UHFFFAOYSA-N 457.939 5.367 5 20 JKBD COCCN(C(=O)[C@@H](C)Oc1cc(C)ccc1Cl)c1nc(-c2ccc([N+](=O)[O-])cc2)cs1 516462529 YPNXDJVRUBPPES-OAHLLOKOSA-N 475.954 5.127 5 20 JKBD O=C(Nc1cccc([N+](=O)[O-])c1)C(=O)N[C@@H](Cc1ccc(Cl)cc1Cl)c1ccc(F)cc1 518671618 AYZNVURPPIPNOC-FQEVSTJZSA-N 476.291 5.079 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Cl)[C@H](NCCCc1c[nH]c2ccccc12)c1ccccc1 521688759 ISDXGMVLWXZJMM-XMMPIXPASA-N 462.937 5.632 5 20 JKBD O=C(Cn1c2ccccc2c(=O)c2ccccc21)N(Cc1ccccc1)Cc1ccc(F)cc1 521756001 VVCJRWQBOQJRIL-UHFFFAOYSA-N 450.513 5.523 5 20 JKBD CC[C@@H](C)c1ccc(N(Cc2nnc(-c3ccccc3)o2)S(=O)(=O)c2cccc([N+](=O)[O-])c2)cc1 596923431 SRPFDRJVKLOOPF-GOSISDBHSA-N 492.557 5.554 5 20 JKBD C[C@H](NC(=O)c1ccc([N+](=O)[O-])cc1Cl)c1cccc(NC(=O)Cc2ccccc2F)c1 603764963 RKWBAULDGGSUGV-AWEZNQCLSA-N 455.873 5.060 5 20 JKBD O=C(NCc1cccs1)c1ccc(-n2ccnc2SCc2csc([N+](=O)[O-])c2)cc1 603938345 WRYHENUICSFAEP-UHFFFAOYSA-N 456.574 5.126 5 20 JKBD CC1CCN(c2ccc(C(=O)N(C)C[C@H]3CCCO[C@H]3c3ccccc3)cc2[N+](=O)[O-])CC1 604519162 PJHUSSMDFKMUMM-RDGATRHJSA-N 451.567 5.071 5 20 JKBD CC[C@H](NC(=O)Cc1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1)c1nc(C)cs1 609192133 YHMDFGLYGXQGBJ-NRFANRHFSA-N 461.547 5.022 5 20 JKBD CC[C@@H](C)c1ccc(N(Cc2cccc(C(=O)N(C)C)c2)S(=O)(=O)c2cccc([N+](=O)[O-])c2)cc1 609220670 ABPRHUCGBVVJBR-LJQANCHMSA-N 495.601 5.206 5 20 JKBD C[C@@H](Sc1nnc(NCCc2ccccc2)s1)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 611196488 KKMDRNBXAHWIDK-CYBMUJFWSA-N 454.537 5.004 5 20 JKBD COc1cc(C)ccc1Oc1ccc(NC(=O)Cn2c3ccccc3c(=O)c3ccccc32)cn1 642311827 OUIVVSFKCJFEEJ-UHFFFAOYSA-N 465.509 5.298 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)Oc2ccc(N(C)C(=O)c3ccc(C)cc3)cc2)cc1SC 728459340 BQMLZUQLKIDQMY-UHFFFAOYSA-N 466.515 5.130 5 20 JKBD C[C@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)Nc1ccc2c(c1)CCCN2C(=O)OC(C)(C)C 729412864 IKGZZOKFQNTXFQ-AWEZNQCLSA-N 475.929 5.342 5 20 JKBD O=C(OC[C@@H]1CCCN1C(=O)c1ccccc1[N+](=O)[O-])[C@@H]1CC=CC[C@H]1c1nc2ccccc2s1 730704917 WHPYOLYMIOBJHS-IPMKNSEASA-N 491.569 5.102 5 20 JKBD O=[N+]([O-])c1ccc2nc(Sc3nnc(-c4c[nH]c5ccccc45)n3C[C@H]3CCCO3)sc2c1 731208780 LGDSKKLHLBRZKQ-CQSZACIVSA-N 478.559 5.275 5 20 JKBD Cc1ccc(-c2ncc(C(=O)O[C@H](C)C(=O)Nc3ccc([N+](=O)[O-])cc3Cl)s2)c(C)c1 747264657 NONLUMHVWKEZHT-CYBMUJFWSA-N 459.911 5.173 5 20 JKBD O=C(O[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1)c1csc(C2CC2)n1 747506034 BYPPSCYDGSLJIB-SFHVURJKSA-N 457.895 5.119 5 20 JKBD C[C@@H](OC(=O)c1csc(-c2cccc([N+](=O)[O-])c2)n1)C(=O)Nc1ccc(Cl)cc1C(F)(F)F 747961021 CTCSUICKIIKBLX-SNVBAGLBSA-N 499.854 5.575 5 20 JKBD C[C@@H](OC(=O)c1cc2c3ccccc3n(C)c2s1)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 762213285 JOIFJBCFIXSLLC-LLVKDONJSA-N 491.447 5.504 5 20 JKBD CCNc1ccc(C(=O)OCc2csc(N(C(C)=O)c3cccc(C)c3C)n2)cc1[N+](=O)[O-] 795846369 KOMDNUDVFPDIJB-UHFFFAOYSA-N 468.535 5.142 5 20 JKBD Cc1cc(C)c(NC(=O)[C@@H](C)OC(=O)c2ccc(Sc3nc(C)cs3)c([N+](=O)[O-])c2)c(C)c1 849119969 GDCFEIPWZGSYNZ-MRXNPFEDSA-N 485.587 5.620 5 20 JKBD COc1ccc(Oc2ccc([N+](=O)[O-])cc2C(=O)OCC(=O)Nc2c(Cl)cccc2Cl)cc1 915443061 XOLYDRTZFUZQBT-UHFFFAOYSA-N 491.283 5.498 5 20 JKBD CC(=O)N(c1ccc(Cl)cc1)c1nc(COC(=O)c2ccc(C(C)(C)C)c([N+](=O)[O-])c2)cs1 919000663 BRYNSVVHSMOXQO-UHFFFAOYSA-N 487.965 6.044 5 20 JKBD Cc1ccc(NC(=O)[C@@H](OC(=O)c2ccc(-c3ccccc3)nc2O)c2ccccc2)c([N+](=O)[O-])c1 919297866 KLMULEQQJFJFCX-DEOSSOPVSA-N 483.480 5.208 5 20 JKBD CC(=O)N(c1cccc(C(F)(F)F)c1)c1nc(COC(=O)c2ccc([N+](=O)[O-])cc2F)cs1 919569918 GCVDJBIAYFIMNB-UHFFFAOYSA-N 483.399 5.251 5 20 JKBD C[C@H](OC(=O)c1ccc(N[C@H](C)c2ccccn2)c([N+](=O)[O-])c1)C(=O)Nc1cccc2ccccc12 920543657 HIQIUPGTUGPULC-MSOLQXFVSA-N 484.512 5.500 5 20 JKBD CSc1cccc(NC(=O)[C@H](C)OC(=O)c2ccc(N[C@@H](C)c3ccccn3)c([N+](=O)[O-])c2)c1 920547504 OHSHFEJQANSVSF-HOTGVXAUSA-N 480.546 5.069 5 20 JKBD C[C@H](OC(=O)c1cc2ccc(OCc3ccccc3)cc2[nH]1)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 920656899 CRQJHSWHYKRWGN-INIZCTEOSA-N 484.468 5.623 5 20 JKBD C[C@@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)OCC(=O)Nc1c(Cl)cc(Cl)cc1Cl 920777208 HSWBIHYVDHXITF-MRVPVSSYSA-N 482.103 5.158 5 20 JKBD COc1ccc([C@H]2C[C@H]2C(=O)Nc2ccc(C3(NC(=O)Cc4cccc([N+](=O)[O-])c4)CCC3)cc2)cc1 1786328806 UOZSTLNFUGKBKS-CLJLJLNGSA-N 499.567 5.084 5 20 JKBD C[C@H](C(=O)Nc1ccc(C2(NC(=O)c3nc4cc([N+](=O)[O-])ccc4[nH]3)CCC2)cc1)c1cccs1 1791815692 IRDPVQAIVVRRHK-HNNXBMFYSA-N 489.557 5.084 5 20 JKBD C[C@H](C(=O)N1CCCC2(CCN(C(=O)c3ccc([N+](=O)[O-])cc3F)CC2)C1)c1ccc(Cl)cc1 1805198629 QIWBOLSBQZIBNR-KRWDZBQOSA-N 487.959 5.036 5 20 JKBD Cc1ccc2[nH]c(C(=O)Nc3cc([C@H]4CCCCN4C(=O)/C=C/c4ccccc4[N+](=O)[O-])[nH]n3)cc2c1 1818567492 RKPNWNMPVYNXTR-IYNHSRRRSA-N 498.543 5.127 5 20 JKBD Cc1cccc(C(=O)Nc2cc([C@H]3CCCCN3C(=O)c3cccc(F)c3[N+](=O)[O-])[nH]n2)c1Cl 1823184029 VDLFWUQNNSSKAO-GOSISDBHSA-N 485.903 5.039 5 20 JKBD Cc1c(Cl)cccc1C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cc(F)cc([N+](=O)[O-])c2)CC1 1823915766 HXLYMOKYOCSDPV-HSZRJFAPSA-N 487.959 5.243 5 20 JKBD O=C(c1cc2cc([N+](=O)[O-])ccc2s1)N1CCC([C@@H]2CCCCN2C(=O)C[C@@H]2CCCCO2)CC1 1824913453 NCLPUUREQRUBST-VXKWHMMOSA-N 499.633 5.002 5 20 JKBD O=C(/C=C/c1ccccc1[N+](=O)[O-])N1CCC([C@H]2CCCCN2C(=O)CCC2CCCC2)CC1 1826272107 VUPQKECFMLMBQL-DQRYEYLNSA-N 467.610 5.198 5 20 JKBD CC(C)CCC(=O)N1CCC([C@H]2CCCCN2C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)CC1 1831061370 RHFJTPMQCMZMIV-OAQYLSRUSA-N 471.623 5.479 5 20 JKBD C[C@H](CC(=O)N1CCCC[C@H]1C1CCN(C(=O)/C=C/c2ccccc2[N+](=O)[O-])CC1)c1ccccc1 1831510427 MRFQHHULILGEFM-KJGITRAXSA-N 489.616 5.422 5 20 JKBD Cc1ccc(S/C=C/C(=O)N2CCCC23CN(C(=O)c2cc4cc([N+](=O)[O-])ccc4s2)C3)cc1 1844234304 ZIALOUUQWPCYBV-FMIVXFBMSA-N 493.610 5.241 5 20 JKBD CC(C)n1c(S[C@@H](C)C(=O)Nc2ccccc2[N+](=O)[O-])nnc1-c1ccc(Cl)cc1Cl 9826577 OGEMINAAYFXUPX-LBPRGKRZSA-N 480.377 5.860 5 20 JKBD CC(=O)Nc1ccc(C(=O)COC(=O)c2ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])cc2)cc1 21258372 KXMDRBSOVNDLPC-UHFFFAOYSA-N 468.849 5.039 5 20 JKBD CC(C)c1ccccc1-n1c(SCCC(=O)Nc2ccccc2[N+](=O)[O-])nnc1-c1cccnc1 26366459 KWXAEBKLLKSHOG-UHFFFAOYSA-N 488.573 5.482 5 20 JKBD C[C@H](Nc1ccc2oc(C(C)(C)C)nc2c1)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 27043518 KSTUBIXYPUIBPG-NSHDSACASA-N 450.417 5.491 5 20 JKBD Cc1cccc(N2CCN(C(=O)c3ccccc3NC(=O)c3ccc([N+](=O)[O-])cc3Cl)CC2)c1C 30777696 IZTZMSJLERZATD-UHFFFAOYSA-N 492.963 5.080 5 20 JKBD CCN(CC)C(=O)c1cccc(NC(=O)c2cc([N+](=O)[O-])ccc2Oc2ccc(OC)cc2)c1 32687617 CUDVTSINNPPJSL-UHFFFAOYSA-N 463.490 5.130 5 20 JKBD Cn1cnnc1-c1cccc(NC(=O)C/C(=C/c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)c1 33132809 FSUZVRCXEXSXOS-UYRXBGFRSA-N 496.552 5.569 5 20 JKBD Cc1nc(-c2ccc(CCNC(=O)c3ccc(N[C@@H](C)c4ccccn4)c([N+](=O)[O-])c3)s2)cs1 108787357 UYRDNHANRWDXDA-HNNXBMFYSA-N 493.614 5.629 5 20 JKBD COc1ccc([C@H](C)NC(=O)c2ccc(N[C@@H](C)c3ccccn3)c([N+](=O)[O-])c2)cc1Br 115704248 LFAMHBYASUZBPR-GJZGRUSLSA-N 499.365 5.425 5 20 JKBD O=C(Cc1ccccc1)Nc1cc(NC(=O)c2csc(-c3ccc([N+](=O)[O-])cc3)n2)ccc1F 215723876 UJGBDKKYHQBXGF-UHFFFAOYSA-N 476.489 5.291 5 20 JKBD CCOc1cc(NC(=O)c2nc(-c3cccs3)n(-c3ccc(F)cc3)n2)c([N+](=O)[O-])cc1OCC 478081692 NCFJTRAWDNOXQH-UHFFFAOYSA-N 497.508 5.093 5 20 JKBD O=C(NC1CCCCC1)c1ccc(NC(=O)c2csc(-c3cccc([N+](=O)[O-])c3)n2)cc1 496613983 XIMBTFSSYQAQTM-UHFFFAOYSA-N 450.520 5.033 5 20 JKBD Cc1csc(Sc2ccc(C(=O)Nc3ccc(CCC(=O)N4CCCC4)cc3)cc2[N+](=O)[O-])n1 510206334 HTULGWANCOZELR-UHFFFAOYSA-N 496.614 5.318 5 20 JKBD COc1cc(C(=O)N[C@H](c2ccccc2)c2ccc(C)cc2)c([N+](=O)[O-])cc1OCc1cscn1 512583783 VDUSPDFCMQDAQY-RUZDIDTESA-N 489.553 5.467 5 20 JKBD CCCOc1cc(NC(=O)N2CCC[C@H]2c2ccc3c(c2)OCCO3)c([N+](=O)[O-])cc1OCCC 514503940 WIXFRPPJUKRXJN-IBGZPJMESA-N 485.537 5.313 5 20 JKBD CC1CCC(OC2CCN(C(=O)c3ccccc3NC(=O)c3ccc([N+](=O)[O-])cc3Cl)CC2)CC1 517459841 VXKJOUMBEHGDOX-UHFFFAOYSA-N 499.995 5.700 5 20 JKBD C[C@@H](CC(=O)Nc1cccc(N2CCCC2)c1)NCc1ccc(-c2ccc([N+](=O)[O-])cc2)s1 518278459 BXLNUJOLCYPKGV-SFHVURJKSA-N 464.591 5.430 5 20 JKBD CCCNC(=O)c1ccc(NC(=O)c2ccc(N[C@H](C)c3ccccn3)c([N+](=O)[O-])c2)cc1Cl 520423053 DKBBGKHIQVCASO-OAHLLOKOSA-N 481.940 5.208 5 20 JKBD COc1cc(C(=O)Nc2cccc(-c3ncc(C)o3)c2)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 521789130 RQKDRFGVLDSZNT-UHFFFAOYSA-N 479.876 6.265 5 20 JKBD Cc1cc(C(=O)N2CCC[C@@H]2C(=O)Nc2ccc(N[C@@H](C)c3ccccc3)cc2)ccc1[N+](=O)[O-] 523288491 VNFWIUMZDBAUMV-UQBPGWFLSA-N 472.545 5.320 5 20 JKBD COc1ccc(NS(=O)(=O)Cc2ccc(NC(=O)c3cc4cc([N+](=O)[O-])ccc4s3)cc2)cc1 603916938 XOUAPOJXQXSEOG-UHFFFAOYSA-N 497.554 5.012 5 20 JKBD COc1ccc(NC(=O)c2ccc(C)c([N+](=O)[O-])c2)cc1NC(=O)c1ccc(Cl)cc1F 603998174 NNRPQDCLSUBUBB-UHFFFAOYSA-N 457.845 5.209 5 20 JKBD C[C@H](N[C@@H](C)c1cccc([N+](=O)[O-])c1)C(=O)N1N=C(c2ccc(Cl)cc2)C[C@@H]1c1ccco1 604044535 UTAUWMKZCBEDMQ-PONJGIIJSA-N 466.925 5.258 5 20 JKBD O=[N+]([O-])c1cc2c(c(CSCc3csc(COc4ccc(Cl)cc4)n3)c1)OCOC2 604063582 VOTHZWSIKYMDMF-UHFFFAOYSA-N 464.952 5.584 5 20 JKBD Cc1csc(Sc2ccc(C(=O)N3CCC(CN4CCCCCC4)CC3)cc2[N+](=O)[O-])n1 604287363 FMDOTLSAPCIHQP-UHFFFAOYSA-N 474.652 5.239 5 20 JKBD CN(C)CCn1cc(NC(=O)c2c3c(nc4ccccc24)/C(=C\c2cccc([N+](=O)[O-])c2)CCC3)cn1 608878763 IGOOKRSWQJEQHR-HKWRFOASSA-N 496.571 5.030 5 20 JKBD COc1ccc([C@@H]2Nc3ccccc3C(=O)N2CC(F)(F)F)cc1OCc1ccc([N+](=O)[O-])cc1 726874983 FAPLWUDBARZWIF-JOCHJYFZSA-N 487.434 5.311 5 20 JKBD CC(C)(C)OC(=O)Nc1ccc(NC(=O)c2ccc([N+](=O)[O-])cc2Cl)c(C(F)(F)F)c1 729656477 DGJGKOSDWICOKR-UHFFFAOYSA-N 459.808 5.866 5 20 JKBD COC(=O)c1ccoc1COC(=O)C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1 817805704 WCXMXXHDUNEUOU-VBKFSLOCSA-N 478.482 5.258 5 20 JKBD CC(C)N(Cc1nnc(-c2cccc([N+](=O)[O-])c2)o1)C(=O)[C@H](C)Oc1cccc(Cl)c1Cl 915276482 TUUUQVSPPCDPHB-ZDUSSCGKSA-N 479.320 5.156 5 20 JKBD COc1ccc(C)cc1NC(=O)[C@@H](OC(=O)c1cc2cc([N+](=O)[O-])ccc2o1)c1ccccc1 917262975 HXKFCJCNIYFTCM-QHCPKHFHSA-N 460.442 5.195 5 20 JKBD COc1ccccc1-c1cc(C(=O)Nc2cc(Cl)c([N+](=O)[O-])cc2OCc2ccccc2)no1 918146939 AXGAVOSCCSXDCG-UHFFFAOYSA-N 479.876 5.743 5 20 JKBD CCc1ccc(-c2noc(COC(=O)c3ccc(N[C@H](C)c4ccccn4)c([N+](=O)[O-])c3)n2)cc1 920548122 PTXRQNONXJGUJO-MRXNPFEDSA-N 473.489 5.132 5 20 JKBD Cc1cc(C(=O)NC2(c3ccc(NC(=O)c4ccc([N+](=O)[O-])o4)cc3)CCC2)c(C(F)(F)F)o1 1785748468 OVWGQPWWKQDTNX-UHFFFAOYSA-N 477.395 5.170 5 20 JKBD Cc1c(C(=O)NC2(c3ccc(NC(=O)c4ccc([N+](=O)[O-])o4)cc3)CCC2)cc(Cl)cc1[N+](=O)[O-] 1785751038 JBGYFBQDPFJJID-UHFFFAOYSA-N 498.879 5.119 5 20 JKBD O=C(CSC1CCCC1)Nc1ccc(C2(NC(=O)Cc3cc([N+](=O)[O-])ccc3F)CCC2)cc1 1786347412 NZPLCZLXKSPPCD-UHFFFAOYSA-N 485.581 5.086 5 20 JKBD Cc1nc2ccncc2cc1C(=O)Nc1ccc(C2(NC(=O)c3cc(F)cc([N+](=O)[O-])c3)CCC2)cc1 1789248314 FSJMPGFVVNDYOR-UHFFFAOYSA-N 499.502 5.047 5 20 JKBD O=C(Cc1cc([N+](=O)[O-])ccc1F)NC1(c2ccc(NC(=O)c3cccc4ccncc34)cc2)CCC1 1790857887 VAVHDFNYVONZNX-UHFFFAOYSA-N 498.514 5.273 5 20 JKBD COc1cc(C(=O)Nc2ccc(C3(NC(=O)c4nc(C(C)C)cs4)CCC3)cc2)ccc1[N+](=O)[O-] 1792164195 YVPCKOHYGNMABI-UHFFFAOYSA-N 494.573 5.245 5 20 JKBD CC1=CC[C@H](C(=O)N2CCCC[C@@H]2c2cc(NC(=O)C3(c4cccc([N+](=O)[O-])c4)CCC3)n[nH]2)CC1 1820841171 PXUMOMPYZXGUTG-WMZHIEFXSA-N 491.592 5.178 5 20 JKBD Cc1oc(C(C)(C)C)cc1C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cccc(F)c2[N+](=O)[O-])n[nH]1 1821168735 FEDRNYBWJYIYFL-IBGZPJMESA-N 497.527 5.276 5 20 JKBD O=C(/C=C/c1ccccc1[N+](=O)[O-])N1CCC([C@H]2CCCCN2C(=O)c2cccc3cnccc23)CC1 1828656911 ODVYGYFVLQLUCH-TYBKAHOSSA-N 498.583 5.090 5 20 JKBD C[C@@]1(C(=O)N2CCC([C@H]3CCCCN3C(=O)c3cc4cc([N+](=O)[O-])ccc4s3)CC2)CC1(F)F 1831062105 PKQMWPGIAUQHEY-JPYJTQIMSA-N 491.560 5.088 5 20 JKBD O=C(c1ccc(Cl)c(F)c1)N1CCC([C@H]2CCCCN2C(=O)/C=C/c2ccccc2[N+](=O)[O-])CC1 1832903951 IYZKXMNLJGFCCP-BDTMADQZSA-N 499.970 5.334 5 20 JKBD Cc1c(C(=O)Nc2cc(S(=O)(=O)N3CCCCC3)ccc2Oc2ccccc2)cccc1[N+](=O)[O-] 14820008 QDQSUCLSDIDLHQ-UHFFFAOYSA-N 495.557 5.122 5 20 JKBD O=C(CCC(=O)c1ccccc1)O[C@H](C(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1)c1ccccc1 20863471 TWYQXYXXPVYGGM-QHCPKHFHSA-N 466.877 5.134 5 20 JKBD CCCn1c(S[C@@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2C(F)(F)F)nnc1-c1cccc(C)c1 21453372 GYCFVGOWEWIPLF-AWEZNQCLSA-N 493.511 5.710 5 20 JKBD O=C(Nc1ccccc1)c1nnc(/C(Cl)=C/c2ccc(-c3cccc([N+](=O)[O-])c3)o2)s1 22608369 AUAKFGNNHLSLAK-ATVHPVEESA-N 452.879 5.696 5 20 JKBD C[C@H](OC(=O)CCc1ccc(-c2ccccc2)o1)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 26254051 XVMQJZWYUUNACL-AWEZNQCLSA-N 476.407 5.377 5 20 JKBD COc1ccc(NC(=O)CCSc2nnc(-c3cccs3)n2-c2ccccc2)c([N+](=O)[O-])c1 26363010 OFAHVXSQRYCBTD-UHFFFAOYSA-N 481.559 5.034 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Cl)[C@@H](N[C@@H]1CCSc2c(F)cccc21)c1ccccc1 30504658 DXVIFLBEBOIDEU-CTNGQTDRSA-N 471.941 5.894 5 20 JKBD Cc1cc(NC(=O)Cn2c3ccccc3c(=O)c3ccccc32)n(-c2cccc(Br)c2)n1 36759259 GMWBUVGVHRUSJP-UHFFFAOYSA-N 487.357 5.050 5 20 JKBD Cc1sc(NC(=O)[C@@H](NC(=O)c2ccccc2Cl)C(C)C)nc1-c1cccc([N+](=O)[O-])c1 195703929 KQLDEURNUWOMCQ-SFHVURJKSA-N 472.954 5.073 5 20 JKBD CCOc1cc(NC(=O)c2cc(C)nc3cc(Br)ccc23)c([N+](=O)[O-])cc1OCC 302927132 BCXQZYLKQIVZGU-UHFFFAOYSA-N 474.311 5.264 5 20 JKBD O=C(N[C@@H](Cc1ccccc1)C(=O)N1CCCC1)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1 501744445 SVJYNJCLKIFCBI-QFIPXVFZSA-N 493.947 5.004 5 20 JKBD CCc1cccc2c1OCC[C@@H]2NC(=O)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 506972902 NZDAGEOBUYTRRT-IBGZPJMESA-N 477.483 5.032 5 20 JKBD COc1cc(CNCc2cc(F)ccc2Br)ccc1OCc1ccc([N+](=O)[O-])cc1 507922665 LNRYLNVRJYUHSG-UHFFFAOYSA-N 475.314 5.374 5 20 JKBD COc1cc(C(=O)Nc2ncc(-c3ccccc3)s2)c([N+](=O)[O-])cc1OCc1cscn1 511146212 OMYKYTJMFVOWFQ-UHFFFAOYSA-N 468.516 5.015 5 20 JKBD COc1ccc([C@H]2CCCN2C(=O)Cc2cn(-c3ccccc3)nc2-c2ccc([N+](=O)[O-])cc2)cc1 514488233 PULSFWXJTQYOIA-AREMUKBSSA-N 482.540 5.362 5 20 JKBD C[C@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)N1CCC[C@@H](c2nc(-c3ccc(Cl)cc3)no2)C1 522506100 KNJLUXKZQDNIJM-GOEBONIOSA-N 472.954 5.185 5 20 JKBD COc1cc(CCNC(=O)Nc2ccc(O[C@@H](C)c3ccccc3)cc2C)c([N+](=O)[O-])cc1OC 556510851 ACBDVPJMMLVRQC-SFHVURJKSA-N 479.533 5.425 5 20 JKBD CN(Cc1nccn1C)C(=O)c1c2c(nc3ccccc13)/C(=C/c1cccc([N+](=O)[O-])c1)CCC2 600832341 XBJMCCCBDICXRX-XDJHFCHBSA-N 467.529 5.026 5 20 JKBD O=C(NC[C@@H](c1ccc(Cl)cc1Cl)c1c[nH]c2ccccc12)C(=O)Nc1cccc([N+](=O)[O-])c1 603697879 NOIMBHZFTJPAGU-IBGZPJMESA-N 497.338 5.270 5 20 JKBD CC(C)Oc1ncccc1CNC(=O)C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1 603761161 NEIOQFWBYRAVNE-XSFVSMFZSA-N 488.569 5.634 5 20 JKBD CCN(CC)[C@H](CNC(=O)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1)c1ccsc1 603880661 RKZFNLKRKHKVOD-OAQYLSRUSA-N 498.571 5.091 5 20 JKBD COc1cc(C(=O)Nc2cccc(OCc3cccc(F)c3)c2)c([N+](=O)[O-])cc1OC(F)F 603998696 CRFLOPNNIGTNQS-UHFFFAOYSA-N 462.380 5.175 5 20 JKBD C[C@H](N[C@@H](C)c1cccc([N+](=O)[O-])c1)C(=O)N1N=C(c2ccc(Cl)cc2)C[C@H]1c1ccco1 604044539 UTAUWMKZCBEDMQ-WCJKSRRJSA-N 466.925 5.258 5 20 JKBD CCOc1cc([N+](=O)[O-])c(C(=O)Nc2nc(C3CC3)c(Cc3ccccc3Cl)s2)cc1OC 608850117 KHVFHRKMAUAVIH-UHFFFAOYSA-N 487.965 5.833 5 20 JKBD Cc1ccc(C(C)C)c(Oc2ccc(CNc3ccnn3C[C@@H]3CCOC3)cc2[N+](=O)[O-])c1 608982747 RJALFJHNHPSUDH-FQEVSTJZSA-N 450.539 5.664 5 20 JKBD O=C(OCC(=O)N1c2ccccc2Sc2ccccc21)c1cc([N+](=O)[O-])ccc1Br 725984430 BSPZMNRSVWIFCQ-UHFFFAOYSA-N 485.315 5.344 5 20 JKBD O=C(C[C@H](NC(=O)c1ccccc1Cl)c1ccccc1)Nc1ccc([N+](=O)[O-])c(Cl)c1 727711931 QQDSIUSVGWDCND-IBGZPJMESA-N 458.301 5.402 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)O[C@@H](C(=O)Nc2ccc(C)cc2)c2ccccc2)cc1SC 728649270 ILUGSJHVNHWITF-JOCHJYFZSA-N 466.515 5.171 5 20 JKBD O=C(Nc1cccc(NC(=O)c2cccc(C(F)(F)F)c2)c1)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1 728847982 BZUKVZIAPLYHIS-UHFFFAOYSA-N 474.351 5.026 5 20 JKBD COc1ccc(CNCc2c(C)nn(-c3cccc(C(F)(F)F)c3)c2Cl)cc1[N+](=O)[O-] 742717269 FFELZUDBNNNMDM-UHFFFAOYSA-N 454.836 5.060 5 20 JKBD CC(C)[C@H](OC(=O)c1csc(-c2ccc([N+](=O)[O-])cc2)n1)C(=O)Nc1cccc2ncccc12 747957736 SITOLCIMFQDUEG-NRFANRHFSA-N 476.514 5.087 5 20 JKBD C[C@@H](OC(=O)c1csc(-c2cccc([N+](=O)[O-])c2)n1)C(=O)Nc1ccccc1Oc1ccccc1 747962850 VHFQUBYYXWZSJP-MRXNPFEDSA-N 489.509 5.695 5 20 JKBD CC[C@H](C)Sc1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2N2CCOCC2)c(C(F)(F)F)c1 748658665 VUMHOQJCPBCLKQ-AWEZNQCLSA-N 483.512 5.593 5 20 JKBD O=C(NCc1ccc(NC(=O)C(F)(F)F)cc1)c1cc([N+](=O)[O-])ccc1Sc1ccccc1 748688031 QTLFYJIGAAXQPT-UHFFFAOYSA-N 475.448 5.177 5 20 JKBD COc1ccc(Oc2ccc([N+](=O)[O-])cc2C(=O)Oc2cccc(Oc3ncccn3)c2)cc1 751191782 MXYCXVOFXCGRSF-UHFFFAOYSA-N 459.414 5.197 5 20 JKBD CC1CCN(c2ccc([N+](=O)[O-])cc2C(=O)Nc2nc(COc3ccccc3)cs2)CC1 884001838 GFQCBNNQBZKLCJ-UHFFFAOYSA-N 452.536 5.119 5 20 JKBD O=[N+]([O-])c1ccc(F)cc1CSc1nnc(Cn2cnc3ccccc32)n1-c1ccccc1Cl 915790469 ZLJXFTYUVMTLQR-UHFFFAOYSA-N 494.939 5.658 5 20 JKBD COc1ccc(/C=C2/N=C(SCc3csc([N+](=O)[O-])c3)N(c3cccc(OC)c3)C2=O)cc1 917415196 DJRCYCGQTJDXLD-KEBDBYFISA-N 481.555 5.351 5 20 JKBD O=C(c1cc([N+](=O)[O-])ccc1N1CCOCC1)N(c1ccccc1)c1nc2ccccc2s1 917525378 WLYSOFSLMHKEKH-UHFFFAOYSA-N 460.515 5.020 5 20 JKBD C[C@@H](N[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Br)c1ccccc1)c1cccc([N+](=O)[O-])c1 917938109 FWTNLFZKNWIAQD-SZNDQCEHSA-N 499.321 5.296 5 20 JKBD C[C@H](Nc1ccc(C(=O)OCc2noc(-c3ccc(Cl)cc3)n2)cc1[N+](=O)[O-])c1ccccn1 920545760 JCNPYQWVUXAODT-AWEZNQCLSA-N 479.880 5.223 5 20 JKBD C[C@@H](Nc1ccc(C(=O)OCC(=O)c2ccc3ccccc3c2)cc1[N+](=O)[O-])c1ccccn1 920547491 OHKQUGYYODFZEI-QGZVFWFLSA-N 455.470 5.356 5 20 JKBD O=C(Cc1ccc(Cl)cc1[N+](=O)[O-])Nc1ccc(C2(NC(=O)[C@H]3CCCSC3)CCC2)cc1 1786115907 LHQRMKXXCBUQDX-KRWDZBQOSA-N 488.009 5.068 5 20 JKBD CCCc1onc(C)c1C(=O)Nc1ccc(C2(NC(=O)c3cccc(F)c3[N+](=O)[O-])CCC2)cc1 1788778397 DBCINXCLPXXRRQ-UHFFFAOYSA-N 480.496 5.044 5 20 JKBD O=C(C[C@H]1C[C@@H]2CC[C@H]1C2)NC1(c2ccc(NC(=O)c3ccc([N+](=O)[O-])cc3F)cc2)CCC1 1790626378 VWHKEURPGXBRSZ-FGTMMUONSA-N 465.525 5.308 5 20 JKBD Cc1nc(C)c(C(=O)NC2(c3ccc(NC(=O)c4cc5cc([N+](=O)[O-])ccc5s4)cc3)CCC2)o1 1791010783 XTRHAKCPTXXXPM-UHFFFAOYSA-N 490.541 5.476 5 20 JKBD C[C@@H](C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C1(c2cccc([N+](=O)[O-])c2)CCC1)c1ccc(Cl)cc1 1800039235 XHFVQMKFDVCPOW-OCYFJXFZSA-N 496.007 5.112 5 20 JKBD Cc1cscc1C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cc(Cl)cc([N+](=O)[O-])c2C)[nH]n1 1818241809 CYGOPXHOQKMCFG-GOSISDBHSA-N 487.969 5.269 5 20 JKBD O=C(/C=C/c1ccccc1[N+](=O)[O-])N1CCC([C@H]2CCCCN2C(=O)Cc2ccc(Cl)cc2)CC1 1826503551 LNGHJZLKCBKOLT-XOJVXBCLSA-N 496.007 5.124 5 20 JKBD O=C(c1cccc(F)c1Cl)N1CCC([C@H]2CCCCN2C(=O)c2ccc([N+](=O)[O-])cc2F)CC1 1830498660 BTSXEAAYGPUKEV-OAQYLSRUSA-N 491.922 5.074 5 20 JKBD Cc1c(C(=O)N2CCCC[C@H]2C2CCN(C(=O)CCc3ccco3)CC2)cc(Cl)cc1[N+](=O)[O-] 1830734551 MZUAQOKRQAYVPD-QFIPXVFZSA-N 487.984 5.016 5 20 JKBD CCCOc1cc(NC(=O)c2cc(OC)ccc2Br)c([N+](=O)[O-])cc1OCCC 10747038 ANNKGERKOGCJIR-UHFFFAOYSA-N 467.316 5.196 5 20 JKBD COc1ccc(NC(=O)c2ccc(NC(=O)Cn3c4ccccc4c(=O)c4ccccc43)cc2)cc1 11246998 GPLXSDXKPAPLJE-UHFFFAOYSA-N 477.520 5.054 5 20 JKBD C[C@@H](Sc1nnc(Cc2ccccc2)n1-c1ccccc1)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl 12105512 QBIGQUPCQVWOLA-MRXNPFEDSA-N 493.976 5.539 5 20 JKBD COc1ccc(NC(C)=O)cc1NC(=O)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])c(OC)c1 14793165 XEYQOKFIUFOJTE-UHFFFAOYSA-N 485.880 5.268 5 20 JKBD NC(=O)c1ccc(NC(=O)c2ccccc2Sc2ccc(C(F)(F)F)cc2[N+](=O)[O-])cc1 14830639 SVQIFGPHQBXCMB-UHFFFAOYSA-N 461.421 5.116 5 20 JKBD C[C@@H](Sc1nccn1Cc1ccccc1)C(=O)Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1 16685316 DKAMWSPPHKMAQV-OAHLLOKOSA-N 465.560 5.082 5 20 JKBD C[C@H]1c2ccsc2CCN1C(=O)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 16780939 QDAIEPOHIDJRJC-ZDUSSCGKSA-N 453.486 5.037 5 20 JKBD COc1cc(/C=C(\Cl)c2nc3sc(C)c(-c4ccccc4)c3c(=O)[nH]2)cc([N+](=O)[O-])c1O 21190964 RVRBONYNIBCXLT-ZSOIEALJSA-N 469.906 5.319 5 20 JKBD Cc1csc(Sc2ccc(C(=O)N[C@@H](C)c3ccc(NC(=O)C4CC4)cc3)cc2[N+](=O)[O-])n1 31393988 RGQNZFHMPVTSMU-AWEZNQCLSA-N 482.587 5.350 5 20 JKBD CC(C)[C@@H](NC(=O)Cn1c2ccccc2c(=O)c2ccccc21)c1cccc(C(F)(F)F)c1 72081248 FHWZXKYIYXHJHU-XMMPIXPASA-N 452.476 5.687 5 20 JKBD C[C@H](OC(=O)c1cn(Cc2ccccc2)c2ccccc12)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 105220065 YWLFVXVIISJEFF-KRWDZBQOSA-N 468.469 5.566 5 20 JKBD O=C(CSc1ccc(C(F)(F)F)cc1[N+](=O)[O-])Nc1ccc(Cl)cc1C(=O)N1CCCC1 107648649 VALNPMBYRSUVPF-UHFFFAOYSA-N 487.887 5.234 5 20 JKBD Cc1nc(-c2cccc(NC(=O)c3ccc(Oc4ccc(Cl)cc4[N+](=O)[O-])cc3)c2)no1 303047897 RCHPJYGYULDLJP-UHFFFAOYSA-N 450.838 5.651 5 20 JKBD O=C(N[C@@H](c1ccccc1)c1nccs1)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 303160709 FFANWFOETZYGJX-FQEVSTJZSA-N 490.507 5.192 5 20 JKBD Cn1cnnc1Sc1ccc(C(=O)NCc2ccccc2-c2ccc(Cl)cc2)cc1[N+](=O)[O-] 303203580 YAQOKSIPJOGXLZ-UHFFFAOYSA-N 479.949 5.125 5 20 JKBD Cc1nn(Cc2ccc(C(=O)Nc3cccc(NC(=O)c4ccccc4)c3C)cc2)c(C)c1[N+](=O)[O-] 409494521 PPDBMANQLIMMHO-UHFFFAOYSA-N 483.528 5.269 5 20 JKBD O=C(CSc1ccc([N+](=O)[O-])cc1)Nc1ccc(Cl)c(C(=O)NCc2ccccc2F)c1 484290260 LCPYUZOFCLBFRX-UHFFFAOYSA-N 473.913 5.048 5 20 JKBD COc1cc(C(=O)N[C@@H](C)c2ccc(OCc3ccc(F)cc3)cc2)c([N+](=O)[O-])cc1OC(F)F 485621408 ABUWASOCSBIUGB-AWEZNQCLSA-N 490.434 5.414 5 20 JKBD O=C(Nc1nc(-c2sccc2Br)cs1)c1ccc(N2CCCC2)c([N+](=O)[O-])c1 488557026 SHAZMMYUXGRHSY-UHFFFAOYSA-N 479.381 5.395 5 20 JKBD Cc1cc(NC(=O)c2ccc(Sc3nc4ccccc4s3)c([N+](=O)[O-])c2)ccc1C(N)=O 504850022 AQJWZOQFDHJSOW-UHFFFAOYSA-N 464.528 5.015 5 20 JKBD Cc1nc(NC(=O)c2ccc(N[C@H](C)c3ccccn3)c([N+](=O)[O-])c2)sc1Cc1ccccc1F 507390021 PSPMTQVDPIFHJU-OAHLLOKOSA-N 491.548 5.910 5 20 JKBD CC1CCN(c2ccc(C(=O)Nc3ccccc3OC[C@H]3CCCCO3)cc2[N+](=O)[O-])CC1 510011632 DKXYFCZPZNPCMV-HXUWFJFHSA-N 453.539 5.031 5 20 JKBD CCOC(=O)c1sc(-c2cccc([N+](=O)[O-])c2)cc1NC(=O)c1cnn(C(C)(C)C)c1C 516070548 SZXALNCZSCHDJE-UHFFFAOYSA-N 456.524 5.012 5 20 JKBD Cc1sc(NC(=O)c2csc(-c3ccc4c(c3)OCCO4)n2)nc1-c1cccc([N+](=O)[O-])c1 517517815 JRBCWOPBPPABFM-UHFFFAOYSA-N 480.527 5.174 5 20 JKBD O=[N+]([O-])c1ccccc1-c1ccc(CNc2cc(-c3ccc(Br)cc3)nn2CCO)o1 518783200 FRRKYJUPXIXFPS-UHFFFAOYSA-N 483.322 5.085 5 20 JKBD Cc1ccc(C(=O)Nc2cccc(C(F)(F)F)c2)cc1NC(=O)COc1ccccc1[N+](=O)[O-] 518937074 ACZSZYRLORWAMJ-UHFFFAOYSA-N 473.407 5.192 5 20 JKBD CCOc1ccc(N(C(=O)c2cc(SC)ccc2[N+](=O)[O-])C2CCN(CC(F)(F)F)CC2)cc1 519079269 DPKNGCRMYAQRDM-UHFFFAOYSA-N 497.539 5.389 5 20 JKBD CSc1ccc(C(=O)c2ccccc2C(=O)NCc2nc(C(C)(C)C)cs2)cc1[N+](=O)[O-] 521491191 KXHOYVDWLKCOIX-UHFFFAOYSA-N 469.588 5.232 5 20 JKBD O=C(CSc1nnc(-c2ccccc2Cl)o1)Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1 550325542 HLOCDBMFLXPXKV-UHFFFAOYSA-N 473.923 5.153 5 20 JKBD COC1CCN(C(=O)c2c3c(nc4ccccc24)/C(=C/c2ccc([N+](=O)[O-])cc2)CCC3)CC1 590946096 FJESERMQHQAFPW-HTXNQAPBSA-N 457.530 5.271 5 20 JKBD CSc1ccc(Cl)c(C(=O)Nc2ccc(NS(=O)(=O)c3ccc(C)c([N+](=O)[O-])c3)cc2)c1 603501730 ADSLYYBDRSWGSU-UHFFFAOYSA-N 491.978 5.332 5 20 JKBD CCOc1cc(C(=O)Nc2nc(C3CC3)c(Cc3ccccc3Cl)s2)c([N+](=O)[O-])cc1OC 608850304 MRLZXJWIQHSRRD-UHFFFAOYSA-N 487.965 5.833 5 20 JKBD Cc1ccccc1-c1nc(C(=O)O[C@@H](C)C(=O)Nc2nc(-c3cccc([N+](=O)[O-])c3)cs2)cs1 727562353 UDYLZZBGGJSYMQ-AWEZNQCLSA-N 494.554 5.334 5 20 JKBD CCOc1cc(NC(=O)c2cc(-c3cccnc3)nc3ccc(C)cc23)c([N+](=O)[O-])cc1OCC 730457094 KFSWIPXCLSJQIN-UHFFFAOYSA-N 472.501 5.563 5 20 JKBD C[C@@H](Oc1ccc(F)c(F)c1)C(=O)Oc1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2Cl)cc1 743607676 PDKNZIDUPVASOT-GFCCVEGCSA-N 476.819 5.152 5 20 JKBD COc1ccc(NC(=O)c2ccccc2NC(=O)c2csc(-c3ccc([N+](=O)[O-])cc3)n2)cc1 747635775 YOCNVURVVDANBX-UHFFFAOYSA-N 474.498 5.232 5 20 JKBD Cc1ccc(-c2noc([C@@H](C)OC(=O)c3csc(-c4ccc([N+](=O)[O-])cc4)n3)n2)cc1F 747957744 SOAHLVKQBMHNMY-GFCCVEGCSA-N 454.439 5.134 5 20 JKBD O=C(c1ccc([N+](=O)[O-])s1)N1CCC[C@@H]1c1nc(-c2ccc(OCc3ccccc3)cc2)no1 904426470 YEYTVFRNTSGLJA-LJQANCHMSA-N 476.514 5.263 5 20 JKBD O=C(O[C@@H](c1ccccc1)c1ccccn1)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 912906323 BMUCQGACRWYWEX-QHCPKHFHSA-N 485.462 5.558 5 20 JKBD CC(C)N(Cc1nnc(-c2cccc([N+](=O)[O-])c2)o1)C(=O)CCOc1ccccc1-c1ccccc1 914775404 AFMKPRKUOIQVCG-UHFFFAOYSA-N 486.528 5.518 5 20 JKBD C[C@H](OC(=O)c1ccc(OC2CCCC2)cc1)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 914953579 YGHDZBUJODYYGC-ZDUSSCGKSA-N 466.412 5.119 5 20 JKBD Cc1c([N+](=O)[O-])cc(C(=O)Nc2ccc(Cl)cc2C(=O)N2[C@@H](C)CCC[C@H]2C)cc1[N+](=O)[O-] 915153927 FBWRAUFVDPIIKW-BETUJISGSA-N 474.901 5.120 5 20 JKBD O=C(Cc1ccc(Cl)cc1[N+](=O)[O-])Nc1ccc(C2(NC(=O)C3CCSCC3)CCC2)cc1 1786115767 IPPQQULCFMPPMK-UHFFFAOYSA-N 488.009 5.068 5 20 JKBD COc1cc(C(=O)NC2(c3ccc(NC(=O)c4sccc4C)cc3)CCC2)cc([N+](=O)[O-])c1OC 1787279514 WMNLBWPGZKOMOS-UHFFFAOYSA-N 495.557 5.043 5 20 JKBD O=C(NC1(c2ccc(NC(=O)[C@@H]3CCC[C@H]4CCCC[C@H]43)cc2)CCC1)c1ccc([N+](=O)[O-])[nH]1 1789192138 UHVIFQWTBZCBJN-DUXKGJEZSA-N 464.566 5.277 5 20 JKBD O=C(NC1(c2ccc(NC(=O)c3ccccc3C(F)(F)F)cc2)CCC1)c1ccc([N+](=O)[O-])[nH]1 1790249411 FNCIPEFGMSSCNC-UHFFFAOYSA-N 472.423 5.003 5 20 JKBD CCC[C@H]1CC[C@H](C(=O)N2CC[C@@H](CNC(=O)c3ccc([N+](=O)[O-])cc3F)[C@@H]2c2cccnc2)CC1 1810747641 WCOJFQSRYICZQY-DDLLOKISSA-N 496.583 5.055 5 20 JKBD CC1(C)CCC(CC(=O)N2CC[C@@H](CNC(=O)c3cc(F)cc([N+](=O)[O-])c3)[C@H]2c2cccnc2)CC1 1811306921 XFOHIKNNDFNGAN-NBGIEHNGSA-N 496.583 5.055 5 20 JKBD CC(C)c1ccc(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)Cc3ccc([N+](=O)[O-])cc3F)[nH]n2)cc1 1820592590 UWLKGXPGUBSFLB-QHCPKHFHSA-N 493.539 5.129 5 20 JKBD CC1(C)CCC(CC(=O)Nc2cc([C@H]3CCCCN3C(=O)Cc3ccc([N+](=O)[O-])cc3F)[nH]n2)CC1 1820978626 RQZJMMKGPVGIAF-JOCHJYFZSA-N 499.587 5.298 5 20 JKBD Cc1ccc(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)c3cccc(F)c3[N+](=O)[O-])n[nH]2)cc1Cl 1821167908 SDMWAOOPLSOJCB-LJQANCHMSA-N 485.903 5.039 5 20 JKBD O=C(c1cc(F)cc([N+](=O)[O-])c1)N1CCC([C@H]2CCCCN2C(=O)c2cc3ccccc3o2)CC1 1828189793 BUBVVNRLLNJVKD-JOCHJYFZSA-N 479.508 5.027 5 20 JKBD O=C(c1ccc([N+](=O)[O-])cc1F)N1CCC([C@@H]2CCCCN2C(=O)c2ccc(Cl)c(F)c2)CC1 1830486209 LNBLZUXKEVXVOD-QFIPXVFZSA-N 491.922 5.074 5 20 JKBD O=C(Nc1ccc(OC(=O)[C@@H]2Cc3ccccc3S2)cc1)c1cc([N+](=O)[O-])ccc1Cl 9675231 KKALVXYNKREVKG-FQEVSTJZSA-N 454.891 5.123 5 20 JKBD C[C@H](OC(=O)c1ccc(C2SCCS2)cc1)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 9792623 GMZMUAOXYROOHM-NSHDSACASA-N 486.493 5.276 5 20 JKBD C[C@@H](OC(=O)c1ccccc1OCc1ccccc1)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl 10863880 VVWTURWUDKMFGM-OAHLLOKOSA-N 454.866 5.011 5 20 JKBD CC(C)OCc1c(C(=O)O[C@@H](C)C(=O)Nc2cc([N+](=O)[O-])ccc2Cl)oc2ccccc12 11242220 YOHIQKFGOFSXME-ZDUSSCGKSA-N 460.870 5.103 5 20 JKBD COc1cccc(CN(C)C(=O)c2ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])c(OC)c2)c1 15354559 ZCEBMECDGPDCOX-UHFFFAOYSA-N 456.882 5.330 5 20 JKBD O=C(c1ccc(NCc2ccccc2)c([N+](=O)[O-])c1)N1CCC(c2nc3ccccc3s2)CC1 15620285 OVJXTMHNYLEMMY-UHFFFAOYSA-N 472.570 5.836 5 20 JKBD CCOc1ccc(NC(=O)c2ccc(NC(=O)C3CCN(c4ccccc4[N+](=O)[O-])CC3)cc2)cc1 15737199 YXAQLPHVTYAPMS-UHFFFAOYSA-N 488.544 5.101 5 20 JKBD COc1cccc([C@H](CNc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])c2c[nH]c3ccccc23)c1OC 23381114 QKOYNICJMMRCJK-IBGZPJMESA-N 462.462 5.246 5 20 JKBD O=C(c1ccccc1[N+](=O)[O-])N(C[C@@H]1CCCO1)c1nc(-c2cccc(C(F)(F)F)c2)cs1 26131573 LXGWBVWOIXOGQO-INIZCTEOSA-N 477.464 5.563 5 20 JKBD Cc1cc(C(=O)N2CCC[C@@H]2C(=O)Nc2ccc(OCc3cccc(F)c3)c(F)c2)ccc1[N+](=O)[O-] 97548503 LCMDINMIMJZINQ-HSZRJFAPSA-N 495.482 5.004 5 20 JKBD COc1cc(C(=O)N2C[C@H](c3ccccc3)O[C@H](C)C2)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 109045920 XOKQXPMZBKDCIU-VOIUYBSRSA-N 482.920 5.651 5 20 JKBD COc1ccc(/C=C2/CCn3c2nc2sc(C)c(C)c2c3=O)cc1OCc1ccc([N+](=O)[O-])cc1 483384381 ZMUYYQXTFRHEBJ-UNOMPAQXSA-N 489.553 5.515 5 20 JKBD O=C(N[C@H]1CCN2CCC[C@H]2C1)c1ccccc1Sc1ccc(C(F)(F)F)cc1[N+](=O)[O-] 484934072 LQNAVVSUNMQEER-HOTGVXAUSA-N 465.497 5.121 5 20 JKBD O=C(C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)Nc1ccnn1C[C@H]1CCOC1 486244881 MPHZZYPNOUZIOK-ZJYZBMPFSA-N 489.557 5.007 5 20 JKBD O=C(Cn1c2ccccc2c(=O)c2ccccc21)Nc1ccc(OCc2ccccc2F)cc1 493604415 VZUYUQAPAYUQER-UHFFFAOYSA-N 452.485 5.512 5 20 JKBD CCC(=O)N[C@@H]1CCCN(C(=O)c2c3c(nc4ccccc24)/C(=C/c2ccc([N+](=O)[O-])cc2)CCC3)C1 499569393 FOTWAFYBEFZGFZ-DHUDHEQZSA-N 498.583 5.151 5 20 JKBD COCc1c(Br)cccc1NC(=O)c1ccc(N[C@@H](C)c2ccccn2)c([N+](=O)[O-])c1 505399634 KRSVHTIVABFSTA-AWEZNQCLSA-N 485.338 5.324 5 20 JKBD Cc1nc(NC(=O)c2ccc(N[C@@H](C)c3ccccn3)c([N+](=O)[O-])c2)sc1Cc1ccccc1F 507390014 PSPMTQVDPIFHJU-HNNXBMFYSA-N 491.548 5.910 5 20 JKBD Cc1cccc(-c2nc(C(C)C)no2)c1NC(=O)c1ccc(N2C[C@@H](C)C[C@@H](C)C2)c([N+](=O)[O-])c1 508754747 AHRDHGDCXUMIAJ-CALCHBBNSA-N 477.565 5.811 5 20 JKBD C[C@@H](Nc1ccc(C(=O)Nc2ccc(-n3cccn3)c(Cl)c2)cc1[N+](=O)[O-])c1ccccn1 524052616 PHTKYPMQWQVNDI-OAHLLOKOSA-N 462.897 5.254 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1F)[C@@H]1C[C@@H]2CCCC[C@H]2N1C(=O)c1ccc2ccccc2c1 524164150 NSJDMPFDFGVZAQ-GLYQVZKVSA-N 461.493 5.299 5 20 JKBD C[C@@H]1CCCN(c2ccc(C(=O)N(C[C@@H]3CCCO3)c3nc4ccccc4s3)cc2[N+](=O)[O-])C1 602756158 FPEDUDUXSABVJL-MJGOQNOKSA-N 480.590 5.267 5 20 JKBD CC(C)N(CCNC(=O)C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)C(C)C 603453340 WMXCSWNZKUZTLF-HMMYKYKNSA-N 466.607 5.370 5 20 JKBD CCOc1cc(NC(=O)c2sc(NC(=O)c3cccc(F)c3)cc2C)c([N+](=O)[O-])cc1OCC 603952879 MBCUSYXUIGFJEE-UHFFFAOYSA-N 487.509 5.406 5 20 JKBD Cc1ccc(Sc2ccc(C(=O)N3C[C@@H](C(F)(F)F)C[C@@H](C(F)(F)F)C3)cc2[N+](=O)[O-])cc1 604258206 VKCSPUMIROJMSM-GASCZTMLSA-N 492.441 6.257 5 20 JKBD Cc1cc(C(=O)N2CCC[C@H]2C(=O)Nc2cc(Cl)ccc2SC(C)C)ccc1[N+](=O)[O-] 609218262 CHOBICOHUIFTCM-IBGZPJMESA-N 461.971 5.300 5 20 JKBD Cc1cnn([C@@H]2CCCc3ccccc32)c1NC(=O)c1cc([N+](=O)[O-])ccc1Br 727993182 JPIDJFYYCYFIOG-LJQANCHMSA-N 455.312 5.040 5 20 JKBD O=C(Oc1ccc(-c2noc([C@H]3CCCO3)n2)cc1)c1ccc(NCc2ccccc2)c([N+](=O)[O-])c1 729110738 FMQHVTDZFSBQNR-HSZRJFAPSA-N 486.484 5.328 5 20 JKBD Cc1csc(Nc2cccc(NC(=O)c3cc(OCC(F)(F)F)ccc3[N+](=O)[O-])c2)n1 729335697 AWIXKINFOUAXPS-UHFFFAOYSA-N 452.414 5.297 5 20 JKBD CCOC(=O)c1sc(-c2cccc([N+](=O)[O-])c2)cc1NC(=O)c1ccc(Cl)nc1Cl 747622677 PZBIFEXADIMBQO-UHFFFAOYSA-N 466.302 5.454 5 20 JKBD CC(=O)N(c1ccc(C)cc1)c1nc(COC(=O)c2csc(-c3cccc([N+](=O)[O-])c3)n2)cs1 747955824 MRXHESQLOXUEIR-UHFFFAOYSA-N 494.554 5.525 5 20 JKBD O=C(Nc1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2N2CCCCC2)cc1)c1cccs1 749129615 QZBBYYYLBIRKFG-UHFFFAOYSA-N 450.520 5.151 5 20 JKBD C[C@H](OC(=O)/C(=C/c1ccc(F)cc1)c1cccs1)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl 772026606 SBPCRUIFQCIRMA-HNEYUBDGSA-N 474.897 5.560 5 20 JKBD CCOC(=O)c1sc(-c2cccc([N+](=O)[O-])c2)cc1NC(=O)c1ccc([N+](=O)[O-])cc1Cl 903396620 NDXUVWHSBCFUKC-UHFFFAOYSA-N 475.866 5.314 5 20 JKBD O=c1c2ccccc2n(Cc2nc(-c3cccc(CN4CCCCC4)c3)no2)c2ccccc12 904434040 WTMYGVXHVFMUJF-UHFFFAOYSA-N 450.542 5.239 5 20 JKBD Cc1c(-c2ccccc2)oc2c(C(=O)Nc3cc([N+](=O)[O-])ccc3OC(F)F)cccc2c1=O 915283093 HJPOKSPRTFUDNS-UHFFFAOYSA-N 466.396 5.530 5 20 JKBD C[C@@H](NC(=O)C(=O)Nc1cccc(-c2ccc(Cl)c(Cl)c2)c1)c1cccc([N+](=O)[O-])c1 918447747 FTNHGOZLGOHZEF-CYBMUJFWSA-N 458.301 5.385 5 20 JKBD Cc1ccc(F)c(C(=O)NC2(c3ccc(NC(=O)/C=C/c4ccc([N+](=O)[O-])o4)cc3)CCC2)c1 1786207668 AWFKHXIOURWNCQ-DHZHZOJOSA-N 463.465 5.096 5 20 JKBD Cc1ccc(C(=O)Nc2ccc(C3(NC(=O)c4cccc(Br)c4[N+](=O)[O-])CCC3)cc2)o1 1786491938 IFQCUCQECDLYPR-UHFFFAOYSA-N 498.333 5.320 5 20 JKBD COc1ccc(CC(=O)Nc2ccc(C3(NC(=O)[C@]4(C)CC=CCC4)CCC3)cc2)c([N+](=O)[O-])c1 1790573786 LXIMHHRUWXCVCV-AREMUKBSSA-N 477.561 5.026 5 20 JKBD Cc1cc(CCCC(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2sccc2Cl)c([N+](=O)[O-])cc1F 1798974051 WEDGNKXRPBGROD-BJWYYQGGSA-N 493.988 5.032 5 20 JKBD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc2cc([N+](=O)[O-])ccc2s1)c1ccc(Cl)c(F)c1 1801207293 VRVXMVCVVOVDPK-MUJYYYPQSA-N 487.940 5.168 5 20 JKBD C[C@@H](C(=O)N1CCCC[C@H]1c1cc(NC(=O)Cc2cccc([N+](=O)[O-])c2)n[nH]1)c1ccc(Cl)cc1 1814372772 CVBZVRDRWPZIMR-ZHRRBRCNSA-N 495.967 5.010 5 20 JKBD O=C(CCc1cccc([N+](=O)[O-])c1)Nc1cc([C@H]2CCCCN2C(=O)c2cc(Cl)ccc2F)[nH]n1 1815536029 LFRINOLUBDMZDO-OAQYLSRUSA-N 499.930 5.049 5 20 JKBD Cc1cccc2cc(C(=O)Nc3cc([C@H]4CCCCN4C(=O)/C=C/c4ccccc4[N+](=O)[O-])[nH]n3)[nH]c12 1819026555 KHBMQMNRXIXUES-MDRMPYQZSA-N 498.543 5.127 5 20 JKBD O=C(c1cc2sccc2s1)N1CCC([C@H]2CCCCN2C(=O)/C=C/c2ccc([N+](=O)[O-])o2)CC1 1824277130 QLAFNCZTKURBPG-MJICGBHWSA-N 499.614 5.411 5 20 JKBD C/C(=C\c1ccc(C)o1)C(=O)N1CCCC[C@H]1C1CCN(C(=O)CCc2cccc([N+](=O)[O-])c2)CC1 1829005058 RPDTYJFOZAJSBN-IZWLMUMNSA-N 493.604 5.152 5 20 JKBD CC[C@H](C)CC(=O)N1CCC([C@@H]2CCCCN2C(=O)C2(c3cccc([N+](=O)[O-])c3)CCC2)CC1 1830291222 JABBJEKYAOMLED-RDPSFJRHSA-N 469.626 5.072 5 20 JKBD CC[C@H](C)CC(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cccc([N+](=O)[O-])c2Br)CC1 1830516488 FESPWIUYKPAIIC-LPHOPBHVSA-N 494.430 5.027 5 20 JKBD O=C(c1ccc(Cl)cc1F)N1CCC([C@@H]2CCCCN2C(=O)c2cccc(F)c2[N+](=O)[O-])CC1 1830615862 AIGAOAKWXJFWMJ-NRFANRHFSA-N 491.922 5.074 5 20 JKBD O=C(c1cccc(F)c1[N+](=O)[O-])N1CCC([C@H]2CCCCN2C(=O)c2cc(F)cc(Cl)c2)CC1 1832629039 LASDQLVUHUBTIB-OAQYLSRUSA-N 491.922 5.074 5 20 JKBD C[C@H]1CC[C@H](C(=O)N2CCC([C@@H]3CCCCN3C(=O)/C=C/c3ccccc3[N+](=O)[O-])CC2)CC1 1832903435 CEJYZPUYIXQMPO-AXYHNHOLSA-N 467.610 5.054 5 20 JKBD O=[N+]([O-])c1cc2c(c(CSc3nnc(-c4ccccc4Cl)n3C3CCCC3)c1)OCOC2 8988537 FYYNPFUKQYKLAE-UHFFFAOYSA-N 472.954 5.781 5 20 JKBD CSc1ccc(C(=O)c2ccccc2C(=O)OCc2csc(-c3ccccn3)n2)cc1[N+](=O)[O-] 12254335 UJVDYPVMOHRLAN-UHFFFAOYSA-N 491.550 5.423 5 20 JKBD CCOc1ccc(NC(=O)CSc2nnc(-c3ccccc3)c3ccccc23)c([N+](=O)[O-])c1 21749479 XEJCKKURPNZWQY-UHFFFAOYSA-N 460.515 5.335 5 20 JKBD CSc1cccc(N[C@@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Br)c2ccccc2)c1 21818881 OGNSJVLSSJKHLU-HXUWFJFHSA-N 472.364 5.871 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Br)[C@@H](NCc1ccccc1Cl)c1ccccc1 21819448 WRSLVKXEYCNYLN-FQEVSTJZSA-N 474.742 5.480 5 20 JKBD CCOc1cc([N+](=O)[O-])c(C(=O)N(C)Cc2cn(-c3ccccc3)nc2-c2ccccc2)cc1OC 24401828 KHRGKPZKVLXETH-UHFFFAOYSA-N 486.528 5.127 5 20 JKBD C[C@H]1C[C@H](C)CN(c2ccc(C(=O)N(C)CC(=O)Nc3c(Cl)cccc3Cl)cc2[N+](=O)[O-])C1 24860328 MHVFWUIYYPRDBE-GJZGRUSLSA-N 493.391 5.095 5 20 JKBD Cc1ccc(Cc2sc(NC(=O)c3cc([N+](=O)[O-])ccc3I)nc2C)cc1 108358917 KTKJHCYKNSPXMZ-UHFFFAOYSA-N 493.326 5.116 5 20 JKBD C[C@H](NC(=O)C(=O)Nc1ccc(Sc2ccc(Cl)cc2)cc1)c1cccc([N+](=O)[O-])c1 502692567 CETSWIOZVLJCIA-AWEZNQCLSA-N 455.923 5.215 5 20 JKBD CCOc1cc(C(=O)NCC2(c3cccc(C(F)(F)F)c3)CCCC2)c([N+](=O)[O-])cc1OC 503803196 JAASRJUXXHXGCW-UHFFFAOYSA-N 466.456 5.263 5 20 JKBD CC[C@H](C)n1ncc2c(C(=O)N(CCOC)c3nc(-c4ccc([N+](=O)[O-])cc4)cs3)cc(C)nc21 508875270 BWCPGFPWDVRMGD-INIZCTEOSA-N 494.577 5.036 5 20 JKBD CC[C@H](C)NC(=O)c1cccc(CNCc2ccc(Oc3ccccc3Cl)c([N+](=O)[O-])c2)c1 509600883 NJXBYVHUSDMOAU-KRWDZBQOSA-N 467.953 5.859 5 20 JKBD C[C@H](NC(=O)Nc1ccc(NC(=O)c2ccccc2)cc1C(F)(F)F)c1cccc([N+](=O)[O-])c1 509977945 AHSZVFZNFGPRLK-AWEZNQCLSA-N 472.423 5.749 5 20 JKBD COCCOc1c(Cl)cccc1NC(=O)c1ccc(NCc2ccccc2)c([N+](=O)[O-])c1 520723309 QYOLWXFWXWVADV-UHFFFAOYSA-N 455.898 5.138 5 20 JKBD C[C@H](Nc1ccc(C(=O)NCC2(c3ccc(Cl)cc3)CC2)cc1[N+](=O)[O-])c1ccccn1 524058142 CZDLLNCVBBINCR-INIZCTEOSA-N 450.926 5.278 5 20 JKBD O=C(Nc1ncc(Cl)cc1Cl)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 585715560 YUOVIQBWHYKFDU-UHFFFAOYSA-N 463.243 5.171 5 20 JKBD O=C(Nc1cc([N+](=O)[O-])ccc1OC(F)F)c1ccc(COc2cccc(Br)c2)o1 603755678 PXYDRGRJEFLWSS-UHFFFAOYSA-N 483.221 5.383 5 20 JKBD CCCCN(C(=O)c1ccc(N[C@@H](C)c2ccccn2)c([N+](=O)[O-])c1)[C@H](C)c1ccc(C)o1 604491522 WPEQFXCDPRQNKO-RBUKOAKNSA-N 450.539 6.068 5 20 JKBD Cc1ccccc1[C@H](OC[C@@H](O)Cn1cnc2cc3ccccc3cc2c1=O)c1ccccc1 636935165 SWZDBHTWZJKJEE-RBJSKKJNSA-N 450.538 5.025 5 20 JKBD O=C(Cn1c2ccccc2c(=O)c2ccccc21)Nc1ccc(NC(=O)C2CC2)cc1C(F)(F)F 653956286 FIZSVUHBPNIYJB-UHFFFAOYSA-N 479.458 5.161 5 20 JKBD CN(c1ccc(F)cc1)S(=O)(=O)c1ccc(Cl)c(C(=O)Nc2ccc([N+](=O)[O-])c(Cl)c2)c1 727711954 RWTIWCHXTGGVME-UHFFFAOYSA-N 498.319 5.118 5 20 JKBD CCn1c(SCC(=O)O[C@H](C)c2cccc([N+](=O)[O-])c2)nnc1-c1ccc(Cl)cc1Cl 729461275 IYBGXASEUPQPGO-GFCCVEGCSA-N 481.361 5.577 5 20 JKBD Cc1noc2nc(-c3ccccc3C(F)(F)F)cc(C(=O)OCC(=O)c3ccc([N+](=O)[O-])cc3)c12 813378583 QFXWIIALKBPFNC-UHFFFAOYSA-N 485.374 5.165 5 20 JKBD Cc1cc(=O)oc2cc(OCc3ccc(C(=O)Nc4cc([N+](=O)[O-])c(F)cc4F)cc3)ccc12 825487933 IYPDHFMGKMGZFF-UHFFFAOYSA-N 466.396 5.119 5 20 JKBD CCOc1ccc([C@@H](C)Nc2cc([N+](=O)[O-])c(OC)c(Br)c2[N+](=O)[O-])cc1OCC 835071656 RSJUVLSUFSNUEW-LLVKDONJSA-N 484.303 5.245 5 20 JKBD O=[N+]([O-])c1cc(C(F)(F)F)ccc1N1CCC(c2nc(COc3ccccc3F)no2)CC1 904730742 XDYSYIGYPRJQOY-UHFFFAOYSA-N 466.391 5.099 5 20 JKBD O=C(Oc1ccc(-c2ccccc2)cc1[N+](=O)[O-])C1CCN(C(=O)/C=C/c2ccccc2)CC1 920330931 QVHLRMFEKRYGDY-SDNWHVSQSA-N 456.498 5.119 5 20 JKBD Cc1nc(-c2ccc(Cl)s2)sc1C(=O)O[C@H](C)C(=O)Nc1ccc(F)c([N+](=O)[O-])c1 921104073 SHUNYQHKYBVOHN-SECBINFHSA-N 469.903 5.065 5 20 JKBD Cc1cncc(CCC(=O)Nc2ccc(C3(NC(=O)/C=C/c4ccccc4[N+](=O)[O-])CCC3)cc2)c1 1786857694 KODXVHHJZBKOSQ-RIYZIHGNSA-N 484.556 5.078 5 20 JKBD O=C(/C=C/c1cc2ccccc2o1)NC1(c2ccc(NC(=O)c3ccc(O)c([N+](=O)[O-])c3)cc2)CCC1 1790619938 MTYYFIROCBSMFV-ACCUITESSA-N 497.507 5.508 5 20 JKBD O=C(NC1(c2ccc(NC(=O)c3cc4cc([N+](=O)[O-])ccc4s3)cc2)CCC1)c1ccnc(F)c1 1791011201 PUFQQZFUAQJTHF-UHFFFAOYSA-N 490.516 5.405 5 20 JKBD CC(C)(C)CCCCCC(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2ccc(O)c([N+](=O)[O-])c2)[nH]n1 1822116136 PHVNNUDOQYLBRY-IBGZPJMESA-N 485.585 5.326 5 20 JKBD C[C@H](C(=O)N1CCCC[C@H]1C1CCN(C(=O)Cc2cccc([N+](=O)[O-])c2)CC1)c1ccc(Cl)cc1 1823972389 YVDZIVSNGQKORI-DFBJGRDBSA-N 498.023 5.214 5 20 JKBD Cc1cncc(C(=O)N2CCC([C@H]3CCCCN3C(=O)c3cc4cc([N+](=O)[O-])ccc4s3)CC2)c1 1831060077 OCZLXXUEFIERKZ-JOCHJYFZSA-N 492.601 5.060 5 20 JKBD O=C(/C=C/c1ccccc1[N+](=O)[O-])N1CCC([C@@H]2CCCCN2C(=O)[C@H]2C[C@H]2c2ccccc2)CC1 1831790037 FZVFBHMLMYEUIM-WPGFFSIVSA-N 487.600 5.031 5 20 JKBD O=C(O[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1)c1ccc(Cl)c([N+](=O)[O-])c1 11025177 GWNFIHMNLXAITR-LJQANCHMSA-N 490.255 5.347 5 20 JKBD C[C@@H](OC(=O)c1sc2cc(F)ccc2c1Cl)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl 11443873 XSAGLYYETKJRAK-MRVPVSSYSA-N 457.266 5.439 5 20 JKBD COc1ccc(NC(=O)c2ccccc2Sc2ccc(C(F)(F)F)cc2[N+](=O)[O-])cc1OC 15012285 LCKKSVNWSOCDFY-UHFFFAOYSA-N 478.448 6.034 5 20 JKBD C[C@H](c1ccc(-n2cncn2)cc1)N(C)C(=O)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1 15095921 JRMJVBLURXTXET-MRXNPFEDSA-N 477.908 5.454 5 20 JKBD O=C(CSc1ccc(C(F)(F)F)cc1[N+](=O)[O-])N1CCC[C@H]1c1nc2ccccc2s1 15566891 GIOIKYQOBZDKFF-AWEZNQCLSA-N 467.494 5.679 5 20 JKBD C[C@H](Sc1nnc(-c2ccco2)n1Cc1ccccc1)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 17653118 CGBWRDOIJUBAKJ-HNNXBMFYSA-N 474.502 5.398 5 20 JKBD CC[C@@H](C)Cc1c(C)sc2[nH]c(S[C@H](C)c3nnc(-c4ccc([N+](=O)[O-])cc4)o3)nc(=O)c12 17952996 HDASPLCIQLFBAH-DGCLKSJQSA-N 485.591 5.693 5 20 JKBD C[C@H](Sc1nnc(-c2ccc(F)cc2)c2ccccc12)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl 20854425 SDGSRTNKLRVRJH-ZDUSSCGKSA-N 482.924 6.117 5 20 JKBD Cc1ccc(-c2nnc3n2CCCCC3)cc1NC(=O)c1ccc(N2CCC(C)CC2)c([N+](=O)[O-])c1 27629301 ZELCTUFFBFHSCT-UHFFFAOYSA-N 488.592 5.377 5 20 JKBD CC1CCN(c2ccc(C(=O)NC3C[C@H](C(F)(F)F)C[C@@H](C(F)(F)F)C3)cc2[N+](=O)[O-])CC1 33195218 YEJVTPZGDFDIGR-HUUCEWRRSA-N 481.437 5.470 5 20 JKBD C[C@H](Nc1cc(Cl)c(C(F)(F)F)cc1[N+](=O)[O-])c1cc(F)ccc1N1CCC(O)CC1 78656519 DPTIIZSSQHGXLS-NSHDSACASA-N 461.843 5.540 5 20 JKBD C[C@@H](Nc1ccc(C(=O)Nc2ccc3nc(N(C)C)ccc3c2)cc1[N+](=O)[O-])c1ccccn1 195742649 BBEDMGQLAWKRME-MRXNPFEDSA-N 456.506 5.029 5 20 JKBD O=C(Nc1sc2c(c1-c1nc3ccccc3[nH]1)CCCC2)c1ccn(-c2ccc([N+](=O)[O-])cc2)n1 302959634 FUCKAGCXQFNMFY-UHFFFAOYSA-N 484.541 5.516 5 20 JKBD CC1CCN(C[C@H]2CCCN(C(=O)c3ccccc3NC(=O)c3ccc([N+](=O)[O-])cc3Cl)C2)CC1 498502083 FBQCHAQODTZJKX-LJQANCHMSA-N 499.011 5.085 5 20 JKBD C[C@@H](c1ccc(Cl)c(Cl)c1)N(C)C(=O)c1ccc(Sc2nncn2C)c([N+](=O)[O-])c1 499486359 PIKNQLNCFUUTRH-NSHDSACASA-N 466.350 5.015 5 20 JKBD C[C@H](Nc1ccc(C(=O)N(C)CCOc2ccc(Br)cc2)cc1[N+](=O)[O-])c1ccccn1 505987124 NWYCVAPDFZLLLU-INIZCTEOSA-N 499.365 5.076 5 20 JKBD CCOc1cc2c(cc1NC(=O)c1ccc(N[C@H](C)c3ccccn3)c([N+](=O)[O-])c1)O[C@@H](C)C2 506099987 XWTZVRZNLZHBMT-JKSUJKDBSA-N 462.506 5.137 5 20 JKBD COc1cc(C(=O)N[C@H](C)c2cccc3ccccc23)c([N+](=O)[O-])cc1OCc1cscn1 509886221 OEVBGRRQROUXIR-OAHLLOKOSA-N 463.515 5.283 5 20 JKBD C[C@@H](Sc1nc2cc3ccccc3cc2c(=O)n1C)C(=O)N(c1nccs1)C1CCCCC1 514908764 DRWGSVIESJZLHV-MRXNPFEDSA-N 478.643 5.390 5 20 JKBD O=[N+]([O-])c1ccc(-c2ccc(CN[C@H](c3ccc4c(c3)OCCO4)C3CC3)o2)c(Br)c1 517534550 ZCJXUBLFFVIAGA-QHCPKHFHSA-N 485.334 5.629 5 20 JKBD Cc1ccc(C(=O)Nc2cccc(C(F)(F)F)c2)cc1NC(=O)N(C)Cc1ccccc1[N+](=O)[O-] 518948100 KWIZQWIPGWAWFX-UHFFFAOYSA-N 486.450 5.838 5 20 JKBD COc1ccc(Oc2ccc(Cl)cc2NC(=O)COc2ccc([N+](=O)[O-])c(OC)c2)cc1 521354949 NKFWDBDXORSRLG-UHFFFAOYSA-N 458.854 5.075 5 20 JKBD C[C@H](NCc1ccc(-c2ccccc2[N+](=O)[O-])o1)c1cccc(NC(=O)Cc2ccccc2F)c1 521816168 OQXPOGVZKYMTKZ-SFHVURJKSA-N 473.504 6.026 5 20 JKBD CCOc1cc(NC(=O)N2CCC[C@H](c3nc4ccccc4s3)C2)c([N+](=O)[O-])cc1OCC 603651375 JYBKNRCLSVIXRF-HNNXBMFYSA-N 470.551 5.413 5 20 JKBD C[C@@H](N[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1)c1cccc(C(F)(F)F)c1 603744463 OPARBDYHBPOJPI-SZNDQCEHSA-N 477.870 6.298 5 20 JKBD Cn1ccc2c(NC(=O)Cc3cn(-c4ccccc4)nc3-c3ccc([N+](=O)[O-])cc3)cccc21 608882881 WZBLOCIVJJTVJG-UHFFFAOYSA-N 451.486 5.120 5 20 JKBD COCCOc1cc([N+](=O)[O-])c(C(=O)Nc2cc(Cl)ccc2SC(C)C)cc1OC 609218386 IZWCYVAGSDWOMV-UHFFFAOYSA-N 454.932 5.035 5 20 JKBD CSc1ccc([N+](=O)[O-])c(C(=O)N[C@@H]2c3cc(Br)ccc3SC[C@@H]2C)c1 609219121 GSMFGUHUHBHDFG-BTDLBPIBSA-N 453.383 5.292 5 20 JKBD CC(=O)N1CCc2cc(NC(=O)CCC(=O)c3ccc4ccc5cccc6ccc3c4c56)ccc21 727752129 AIFMNOQBHSQGFH-UHFFFAOYSA-N 460.533 6.095 5 20 JKBD C[C@H]1CN(c2ccc(NC(=S)Nc3ccc([N+](=O)[O-])cc3)cc2C(F)(F)F)C[C@@H](C)O1 727981054 ALWVTCPIXGIDAS-BETUJISGSA-N 454.474 5.036 5 20 JKBD CC(C)(C)OC(=O)N1CCCc2cc(NC(=O)CCCNc3ccc([N+](=O)[O-])cc3)ccc21 729410882 ZSBWMHIBNFFIQL-UHFFFAOYSA-N 454.527 5.113 5 20 JKBD O=C(C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)OCc1nc(-c2ccoc2)no1 729865345 MXNKKBRQHZIEQG-GZTJUZNOSA-N 488.481 5.522 5 20 JKBD CC(C)N(Cc1nnc(-c2cccc([N+](=O)[O-])c2)o1)C(=O)[C@H](C)Sc1ccc(Cl)cc1 790124177 OQPOVWFHSMQHDO-AWEZNQCLSA-N 460.943 5.216 5 20 JKBD COc1cc(C(=O)N2CC[C@@H](Oc3ccc(C)cn3)C2)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 858064025 IWZZMEVWLRLGJN-GOSISDBHSA-N 483.908 5.046 5 20 JKBD C[C@H](Oc1ccc(Cl)cc1[N+](=O)[O-])c1nc(-c2ccc(Oc3ccc(F)cc3)nc2)no1 904509575 IDXIUUOYHBQOFK-LBPRGKRZSA-N 456.817 5.765 5 20 JKBD C[C@@H](Oc1ccc(Cl)cc1[N+](=O)[O-])c1nc(-c2ccc(CNC(=O)OC(C)(C)C)cc2)no1 904715583 HNHSUTLUACUZAY-CYBMUJFWSA-N 474.901 5.463 5 20 JKBD Cc1nc(C(C)C)sc1C(=O)Oc1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2Cl)cc1 915274970 PGKKZNQQNLOLCX-UHFFFAOYSA-N 459.911 5.608 5 20 JKBD Cc1ccc(NS(=O)(=O)c2ccc(N[C@@H](C)c3cccc([N+](=O)[O-])c3)c([N+](=O)[O-])c2)c(C)c1 917086453 XYJUMZVXUZWQIH-INIZCTEOSA-N 470.507 5.094 5 20 JKBD O=C(Nc1ccccc1C(=O)N[C@@H]1CCc2cc(F)ccc21)c1ccc([N+](=O)[O-])cc1Cl 919870152 HRJDNZZAHFCRHI-OAQYLSRUSA-N 453.857 5.057 5 20 JKBD COc1cc(C(=O)Oc2cccc(Oc3ccccn3)c2)c([N+](=O)[O-])cc1OCc1cscn1 920108412 ROSZNRRSBOZUTR-UHFFFAOYSA-N 479.470 5.045 5 20 JKBD Cc1noc(C)c1CC(=O)Nc1ccc(C2(NC(=O)c3cc(Cl)cc([N+](=O)[O-])c3C)CCC2)cc1 1786718404 XSUKPRVYLRAYCD-UHFFFAOYSA-N 496.951 5.152 5 20 JKBD COc1cc(CC(=O)Nc2ccc(C3(NC(=O)[C@@]4(C)CC=CCC4)CCC3)cc2)ccc1[N+](=O)[O-] 1790480272 OSUHAYALFGTHAB-SANMLTNESA-N 477.561 5.026 5 20 JKBD COc1cc(C(=O)NC2(c3ccc(NC(=O)c4cc(Cl)cc([N+](=O)[O-])c4C)cc3)CCC2)ccn1 1790774850 UYIIKLQPDMZTLO-UHFFFAOYSA-N 494.935 5.022 5 20 JKBD Cc1ccc(C(=O)N2CCC([C@@H]3CCCCN3C(=O)CCc3cccc([N+](=O)[O-])c3)CC2)c(F)c1F 1824843105 OCEMYIONWFFNNF-QHCPKHFHSA-N 499.558 5.048 5 20 JKBD CC(C)(C)c1ccc(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3cc(O)cc([N+](=O)[O-])c3)CC2)s1 1827903559 FYSFYQRNMJPWMW-OAQYLSRUSA-N 499.633 5.207 5 20 JKBD O=C(c1cc2cc([N+](=O)[O-])ccc2s1)N1CCC([C@H]2CCCCN2C(=O)c2ccccc2F)CC1 1829880068 ZIBLKEWGYAQMDO-JOCHJYFZSA-N 495.576 5.496 5 20 JKBD COc1ccc([N+](=O)[O-])cc1NC(=O)[C@H](C)Sc1nnc(-c2cccs2)n1Cc1ccccc1 3465664 KQJZJJUTBZSIKX-HNNXBMFYSA-N 495.586 5.091 5 20 JKBD C[C@@H](Sc1nnc(-c2c[nH]c3ccccc23)n1C1CC1)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 17883492 IIFUMJSDEIQPSX-CYBMUJFWSA-N 473.518 5.573 5 20 JKBD Cc1csc(Sc2ccc(C(=O)N3CCC(c4nc5ccccc5s4)CC3)cc2[N+](=O)[O-])n1 17960043 NDRSWWVOMREXGR-UHFFFAOYSA-N 496.639 6.140 5 20 JKBD O=C(CSc1nnc(-c2ccccc2)c(-c2ccccc2)n1)Nc1ccc(Cl)cc1[N+](=O)[O-] 20753382 QFFFQPPHSMAMMO-UHFFFAOYSA-N 477.933 5.498 5 20 JKBD Cc1nn(Cc2ccc(C(=O)Nc3cc(Cl)ccc3OCC(F)(F)F)cc2)c(C)c1[N+](=O)[O-] 22615404 JEHZIMDGTVEYSP-UHFFFAOYSA-N 482.846 5.303 5 20 JKBD Cc1ccc(-c2csc(NC(=O)CCc3ncc(-c4ccc(F)cc4F)o3)n2)cc1[N+](=O)[O-] 105472387 CHARJVINEKYVKU-UHFFFAOYSA-N 470.457 5.531 5 20 JKBD C[C@@H](Nc1ccc(C(=O)Nc2cccc(C(=O)Nc3ccccn3)c2)cc1[N+](=O)[O-])c1ccccn1 116586980 ARMYOYCMHVRFEU-QGZVFWFLSA-N 482.500 5.063 5 20 JKBD O=C(Nc1ccccc1C(=O)Nc1ccc(N2CCCCC2)cc1)c1ccc([N+](=O)[O-])cc1Cl 247294831 CCNPQABMPWIYHO-UHFFFAOYSA-N 478.936 5.743 5 20 JKBD COc1ccccc1CN(Cc1cccs1)C(=O)c1csc(-c2cccc([N+](=O)[O-])c2)n1 496534946 LQVQETMZTMTSTJ-UHFFFAOYSA-N 465.556 5.631 5 20 JKBD Cc1noc2ncc(NC(=O)c3ccccc3Sc3ccc(C(F)(F)F)cc3[N+](=O)[O-])cc12 506506353 HMKNYAJEBYWBRT-UHFFFAOYSA-N 474.420 5.862 5 20 JKBD C[C@@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)Nc1cc(C(=O)Nc2ccccc2)ccc1Cl 512321859 HAZCCOFCYLKCRP-CQSZACIVSA-N 455.923 5.620 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Cl)[C@@H](NCC1(c2ccc(F)cc2)CCOCC1)c1ccccc1 513197965 ZWZSAPNEQDOECC-DEOSSOPVSA-N 497.954 5.405 5 20 JKBD O=C(Cn1nccc1[N+](=O)[O-])Nc1cc(C(F)(F)F)ccc1Oc1ccc(Br)cc1 515843711 ROBIGTIGMNYDRH-UHFFFAOYSA-N 485.216 5.004 5 20 JKBD O=C(C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1)N1CCC[C@H]1Cc1ccc(F)cc1 515993358 QDKXJFVYYCAQBU-FQEVSTJZSA-N 479.474 5.203 5 20 JKBD Cc1c(C(=O)Nc2ccc(Oc3ccccc3)cc2C(F)(F)F)nnn1-c1cccc([N+](=O)[O-])c1 520662813 HOKLCXPUYOLHIV-UHFFFAOYSA-N 483.406 5.547 5 20 JKBD CC(=O)N(c1cccc(C(F)(F)F)c1)c1nc(CSc2ncccc2[N+](=O)[O-])cs1 521522174 VIKCGLXZCDEHMJ-UHFFFAOYSA-N 454.455 5.442 5 20 JKBD NC(=O)CC[C@@H]1CCCN(C(=O)c2c3c(nc4ccccc24)/C(=C/c2ccc([N+](=O)[O-])cc2)CCC3)C1 524039555 FNZFFPSXYIFBQO-HKRCYGBASA-N 498.583 5.138 5 20 JKBD O=C(Nc1cccc(C(=O)Nc2ccc([N+](=O)[O-])cc2F)c1)c1ccc(Br)cc1 524163932 DUYIWNXUFSGYAF-UHFFFAOYSA-N 458.243 5.001 5 20 JKBD Cc1ccc(S(=O)(=O)Nc2ccc(NC(=O)c3c(Cl)c4ccccc4n3C)cc2)cc1[N+](=O)[O-] 603780481 GIASNUSUFMATBP-UHFFFAOYSA-N 498.948 5.101 5 20 JKBD CCOC(=O)C[C@@H](c1ccccc1)C1CCN(C(=O)[C@@H](C)Sc2ccc([N+](=O)[O-])cc2)CC1 603928131 LXXKNOVJGJDOAQ-JPYJTQIMSA-N 470.591 5.051 5 20 JKBD COc1cc(C(=O)N2CCC[C@@H](c3cc4ccccc4[nH]3)C2)c([N+](=O)[O-])cc1OCc1cscn1 604354060 GNISZDWKZPSVBK-QGZVFWFLSA-N 492.557 5.140 5 20 JKBD O=C(Nc1cccc(NC(=O)c2cc(F)c(F)cc2[N+](=O)[O-])c1)c1cccc(C(F)(F)F)c1 728848639 NUQFCAMFCKHZAN-UHFFFAOYSA-N 465.334 5.396 5 20 JKBD COc1ccc(CN(Cc2ccc(OC)cc2)C(=O)c2ccc(Br)c([N+](=O)[O-])c2)cc1 729659704 BHRLFVOAOIFNEV-UHFFFAOYSA-N 485.334 5.217 5 20 JKBD COc1ccc([C@H](NC(=O)c2cc([N+](=O)[O-])ccc2Br)c2ccc(C)cc2)cc1 751108041 MIZWLMQHOWXWMZ-OAQYLSRUSA-N 455.308 5.194 5 20 JKBD CC(C)(C)OC(=O)N1CCC(CNC(=O)c2cc([N+](=O)[O-])ccc2Sc2ccccc2)CC1 751158728 DGAFLAVMKDIXOJ-UHFFFAOYSA-N 471.579 5.123 5 20 JKBD O=[N+]([O-])c1cc(C(F)(F)F)c(Cl)cc1Sc1nnc(-c2cccs2)n1C[C@@H]1CCCO1 912728619 YTKDXGKBMLWFKQ-JTQLQIEISA-N 490.916 5.917 5 20 JKBD CC(=O)N(c1ccc(Cl)c(Cl)c1)c1nc(COC(=O)COc2cccc([N+](=O)[O-])c2)cs1 914909538 SLIBGGSMWRSZNH-UHFFFAOYSA-N 496.328 5.165 5 20 JKBD COC(=O)/C=C/c1ccc(N[C@H](C)c2cccc(NC(=O)Cc3ccccc3F)c2)c([N+](=O)[O-])c1 917075308 FATNIQQDEKGZKU-MLFXKNMZSA-N 477.492 5.274 5 20 JKBD CC(=O)NCc1ccc(C(=O)COC(=O)c2cc([N+](=O)[O-])ccc2Sc2ccc(Cl)cc2)cc1 917224331 OJAZZKCZTVHPJZ-UHFFFAOYSA-N 498.944 5.075 5 20 JKBD Cc1c(C(=O)O[C@@H](C(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)c2ccccc2)cnn1C(C)(C)C 919189684 IOZZHEXKDFAQOY-HXUWFJFHSA-N 470.913 5.045 5 20 JKBD C[C@H](Nc1ccc(C(=O)O[C@H](C)C(=O)c2ccc(Cl)cc2)cc1[N+](=O)[O-])c1ccccn1 920548155 QDEFPQPTJHAOMZ-LSDHHAIUSA-N 453.882 5.245 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)[C@H]3C[C@H]3c3ccc(Cl)cc3)CCC2)cc1)c1ccc([N+](=O)[O-])o1 1785750259 AVJGVTIFSRPQSZ-PMACEKPBSA-N 479.920 5.393 5 20 JKBD Cc1ccc2cc(C(=O)NC3(c4ccc(NC(=O)/C=C/c5ccc([N+](=O)[O-])o5)cc4)CCC3)ccc2n1 1786207414 JTQFZJBPQXPTPD-JLHYYAGUSA-N 496.523 5.506 5 20 JKBD O=C(NC1(c2ccc(NC(=O)c3cc4ccccc4o3)cc2)CCC1)c1cc(F)cc([N+](=O)[O-])c1 1789004576 KQYBTCCSNLHIAR-UHFFFAOYSA-N 473.460 5.542 5 20 JKBD COc1c(C(=O)NC2(c3ccc(NC(=O)c4ccc([N+](=O)[O-])cc4F)cc3)CCC2)ccc(F)c1F 1790625777 NISKTTZHRWJNAQ-UHFFFAOYSA-N 499.445 5.082 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)NC1(c2ccc(NC(=O)CCCc3cccnc3)cc2)CCC1 1791951364 XXYNKSVHPKSALM-UHFFFAOYSA-N 490.535 5.208 5 20 JKBD Cc1c(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2ccc(C(C)C)cc2)cc(Cl)cc1[N+](=O)[O-] 1799712021 NWPYTPUNEIWVNR-WKCHPHFGSA-N 469.969 5.246 5 20 JKBD Cc1cc(C(=O)NC[C@H]2CCN(C(=O)CCCCCC(C)(C)C)[C@@H]2c2cccnc2)ncc1[N+](=O)[O-] 1808669183 YFCLQMYZSYGUEG-PXDATVDWSA-N 495.624 5.009 5 20 JKBD O=C(CCC1CCCC1)Nc1cc([C@@H]2CCCCN2C(=O)Cc2ccc(Cl)cc2[N+](=O)[O-])[nH]n1 1816689523 DIOVWBAQVBZAOX-FQEVSTJZSA-N 487.988 5.177 5 20 JKBD CCC[C@H]1CC[C@H](C(=O)N2CCC([C@H]3CCCCN3C(=O)/C=C/c3ccc([N+](=O)[O-])o3)CC2)CC1 1824279346 UISFFDZUZLXBBR-FPFOLYEOSA-N 485.625 5.427 5 20 JKBD O=C(c1cc2cc([N+](=O)[O-])ccc2s1)N1CCC([C@H]2CCCCN2C(=O)CCC(F)(F)F)CC1 1826672372 BKVMGNHSNZCWIQ-GOSISDBHSA-N 497.539 5.385 5 20 JKBD O=C(c1cc2cc([N+](=O)[O-])ccc2s1)N1CC2(CCCN2C(=O)c2c(Cl)cccc2Cl)C1 1844866166 VYQCLZSVLVIFRL-UHFFFAOYSA-N 490.368 5.247 5 20 JKBD Cc1ccc(S(=O)(=O)Nc2ccc(C(=O)Nc3ccc(-c4nccs4)cc3)cc2)cc1[N+](=O)[O-] 17589998 DGHOSPXQVHPIEN-UHFFFAOYSA-N 494.554 5.080 5 20 JKBD COc1ccccc1NC(=O)[C@@H](C)OC(=O)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1 21258420 XTNCDNRWAMLWKQ-CQSZACIVSA-N 470.865 5.233 5 20 JKBD CN(C)[C@@H](CNC(=O)c1ccccc1Sc1ccc(C(F)(F)F)cc1[N+](=O)[O-])c1ccsc1 25815085 GFHODYDRZHATMO-SFHVURJKSA-N 495.548 5.859 5 20 JKBD Cc1c(NC(=O)[C@@H](C)Sc2nnc(Cc3cccs3)n2-c2ccccc2)cccc1[N+](=O)[O-] 26978338 ZUYJBAGHYFFCNY-MRXNPFEDSA-N 479.587 5.256 5 20 JKBD C[C@@H](N[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1)c1ccc(C(F)(F)F)cc1 28383906 BEJCDNDFBHYOGO-SPLOXXLWSA-N 477.870 6.298 5 20 JKBD CC(C)NC(=O)c1ccc(N[C@H](C)c2ccc(NC(=O)c3ccc(F)cc3)cc2)c([N+](=O)[O-])c1 59420568 AMKKPZWTSYQLPP-MRXNPFEDSA-N 464.497 5.298 5 20 JKBD O=C(O[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1)c1ccc(-c2cnco2)cc1 108117866 LTGUSERKEOFXCC-QFIPXVFZSA-N 477.860 5.440 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)Nc2ccc3[nH]c(-c4ccccc4Cl)nc3c2)cc1SC 112533158 HDQACTQRFVIXRO-UHFFFAOYSA-N 468.922 5.774 5 20 JKBD C[C@H](N[C@@H](Cc1cccc(F)c1)c1cccc(F)c1)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 303015495 SAXRWUNAZBZJFB-FPTDNZKUSA-N 493.432 5.792 5 20 JKBD O=C(Cc1ccc([N+](=O)[O-])cc1)N(C[C@@H]1CCCO1)c1nc(-c2cccc(C(F)(F)F)c2)cs1 477244588 PKCHPWISPYSYSE-IBGZPJMESA-N 491.491 5.492 5 20 JKBD Cc1ccc(-c2csc(NC(=O)CSc3nnc(-c4cccs4)n3C3CC3)n2)cc1[N+](=O)[O-] 481952922 OBBYLDKIFWEKLW-UHFFFAOYSA-N 498.615 5.412 5 20 JKBD CC(C)COC1CCN(C(=O)C/C(=C/c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)CC1 490721168 JNCCJBMYJXFGIJ-HKWRFOASSA-N 479.602 5.799 5 20 JKBD Cc1ccsc1CN(C)C(=O)C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1 490801573 KNXBOWQKKZFIEC-QGOAFFKASA-N 463.584 6.164 5 20 JKBD O=C(C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)Nc1ccccc1Cn1cncn1 490880123 WFSWMIMFQAUOBP-MOSHPQCFSA-N 496.552 5.414 5 20 JKBD O=C(Cn1c2ccccc2c(=O)c2ccccc21)NC1(c2ccc(Br)cc2)CCC1 509893328 JZYWBKPPHPVMCX-UHFFFAOYSA-N 461.359 5.113 5 20 JKBD CC(C)(C)[C@@H]1CCc2sc(-c3nnc(SCc4nnc(-c5ccc([N+](=O)[O-])cc5)o4)o3)cc2C1 509950195 ZEDPZGNLKDOHAN-OAHLLOKOSA-N 497.602 6.200 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Cl)NC1CCN(Cc2cccc(C(F)(F)F)c2)CC1 511191056 OMQYIHJKSMSSAG-UHFFFAOYSA-N 456.852 5.053 5 20 JKBD O=C(Nc1ccc(NC2CCOCC2)cc1)c1cc([N+](=O)[O-])ccc1Sc1ccc(Cl)cc1 513057156 DPUFCAISJJKNAQ-UHFFFAOYSA-N 483.977 6.243 5 20 JKBD O=C(Cc1ccccc1)N1CCc2ccc(NCc3ccc(C(F)(F)F)cc3[N+](=O)[O-])cc21 600861516 XOTSORIFMJTBRM-UHFFFAOYSA-N 455.436 5.358 5 20 JKBD CCCN(C(=O)c1ccc(OC)c([N+](=O)[O-])c1)c1nc(-c2ccc(Cl)cc2Cl)cs1 603463272 XQZALRBNZUXPCH-UHFFFAOYSA-N 466.346 6.091 5 20 JKBD O=C(c1cc(N2CCC(c3nc4cc(Cl)ccc4s3)CC2)ccc1[N+](=O)[O-])N1CCCC1 603943296 LZBNDRVLKNQYDX-UHFFFAOYSA-N 470.982 5.478 5 20 JKBD C[C@@H](NCc1ccc(Oc2ccc(F)cc2)c([N+](=O)[O-])c1)c1ccc(OCc2cccnc2)cc1 608781995 XUMNXQBPQXPOQL-LJQANCHMSA-N 473.504 6.351 5 20 JKBD COc1ccc(Oc2ccc([N+](=O)[O-])cc2C(=O)OC[C@@H]2CCCN(C(=O)c3ccc(C)o3)C2)cc1 726359331 VLXNUAWNSGIMFB-GOSISDBHSA-N 494.500 5.006 5 20 JKBD CC(C)(C)OC(=O)Nc1ccc(C(F)(F)F)cc1NC(=O)c1cc([N+](=O)[O-])ccc1Cl 727790316 BKGMVZKCKWGUMY-UHFFFAOYSA-N 459.808 5.866 5 20 JKBD O=C(COC(=O)c1ccccc1C(=O)c1ccc(Cl)c(Cl)c1)Nc1ccc(F)c([N+](=O)[O-])c1 729726514 GTVGEXYMHHVKAI-UHFFFAOYSA-N 491.258 5.067 5 20 JKBD Cc1ccc(C)c(NC(=O)[C@H](OC(=O)c2csc(-c3cccc([N+](=O)[O-])c3)n2)c2ccccc2)c1 747961946 CLEXXICWWNXWJG-HSZRJFAPSA-N 487.537 5.872 5 20 JKBD CC(C)(C)OC(=O)N1CCC[C@H]1[C@H]1CCCCN1C(=O)c1csc(-c2ccc([N+](=O)[O-])cc2)n1 751409121 GVPMYSHAXZHLOZ-UXHICEINSA-N 486.594 5.113 5 20 JKBD Cc1csc(Sc2ccc(C(=O)OCC(=O)Nc3cc(Cl)ccc3F)cc2[N+](=O)[O-])n1 849120427 SCVFKRAJZZOGKH-UHFFFAOYSA-N 481.914 5.099 5 20 JKBD O=C(Nc1ccc2nc(O)[nH]c2c1)c1ccccc1Sc1ccc(C(F)(F)F)cc1[N+](=O)[O-] 857748745 RVNOFBKRSRBJMI-UHFFFAOYSA-N 474.420 5.599 5 20 JKBD C[C@@H](Nc1ccc(-c2nc(-c3cc(Br)cs3)no2)cc1[N+](=O)[O-])c1ccccn1 904394935 WQCICAVXOFRRDG-LLVKDONJSA-N 472.324 5.704 5 20 JKBD CC(=O)Nc1cccc(NC(=S)/C(=C(/O)c2cccc([N+](=O)[O-])c2)[n+]2ccc(C(C)(C)C)cc2)c1 913141251 JRNNZGULNHXDPE-UHFFFAOYSA-O 491.593 5.462 5 20 JKBD C[C@H](OC(=O)c1cc2cc([N+](=O)[O-])ccc2o1)C(=O)Nc1ccc(Cl)cc1C(F)(F)F 917262775 COYVHTJQZYSPEN-VIFPVBQESA-N 456.760 5.197 5 20 JKBD O=C(CCOc1ccccc1[N+](=O)[O-])OCC(=O)N1c2ccccc2Sc2ccc(Cl)cc21 919491902 XBORCQMVHPJSKZ-UHFFFAOYSA-N 484.917 5.390 5 20 JKBD C[C@H](Nc1ccc(C(=O)OCc2cc(=O)oc3cc4c(cc23)CCC4)cc1[N+](=O)[O-])c1ccccn1 920544586 DGEJKVHFJZSQPC-INIZCTEOSA-N 485.496 5.115 5 20 JKBD C[C@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)O[C@@H](C)c1nc(-c2cccc(C(F)(F)F)c2)no1 924160183 FFVJUOLANFIQSM-RYUDHWBXSA-N 467.425 5.449 5 20 JKBD O=C(Cc1cccc([N+](=O)[O-])c1)Nc1ccc(C2(NC(=O)c3ccc4ncccc4c3)CCC2)cc1 1785792229 VCXUEAUEPAKLCA-UHFFFAOYSA-N 480.524 5.133 5 20 JKBD CC1=CC[C@H](C(=O)NC2(c3ccc(NC(=O)c4cc(N(C)C)ccc4[N+](=O)[O-])cc3)CCC2)CC1 1790055659 HPTDBHDAPVMLEI-IBGZPJMESA-N 476.577 5.155 5 20 JKBD COc1cc(C(=O)Nc2ccc(C3(NC(=O)c4cccc5cccnc45)CCC3)cc2)ccc1[N+](=O)[O-] 1792164726 SJTUYDRFIGOFBS-UHFFFAOYSA-N 496.523 5.213 5 20 JKBD CC(C)=CCCC(=O)N1CC[C@H](CNC(=O)c2cc(Cl)cc([N+](=O)[O-])c2C)[C@@H]1c1cccnc1 1811794581 PFBJVJOPHKQMHA-DVECYGJZSA-N 484.984 5.018 5 20 JKBD Cc1cc(Cl)c(Cl)cc1C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2ccc([N+](=O)[O-])o2)n[nH]1 1814312537 PNNRIDCPRGCSNM-MRXNPFEDSA-N 492.319 5.146 5 20 JKBD CC[C@@H](C(=O)N1CCCC[C@H]1c1cc(NC(=O)CCc2cccc([N+](=O)[O-])c2)n[nH]1)c1ccccc1 1815537173 DPVXLNBCCJNDNV-VWNXMTODSA-N 489.576 5.137 5 20 JKBD CC(C)(C)CCCCCC(=O)N1CCCC[C@H]1c1cc(NC(=O)c2ccc(O)c([N+](=O)[O-])c2)n[nH]1 1821046084 AGYQMGLMORAGEY-IBGZPJMESA-N 485.585 5.326 5 20 JKBD CC[C@H]1CC[C@H](C(=O)N2CCC([C@H]3CCCCN3C(=O)c3cc(F)cc([N+](=O)[O-])c3)CC2)CC1 1830616161 UKOPKCGTIFFTLY-DRMXPCRNSA-N 473.589 5.184 5 20 JKBD O=C(c1ccc(F)cc1)N1CCC([C@@H]2CCCCN2C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)CC1 1831061725 XWHOVXKNKPAUQM-QFIPXVFZSA-N 495.576 5.496 5 20 JKBD CCOc1ccc(Oc2ccc(NC(=O)c3ccc(Sc4nncn4C)c([N+](=O)[O-])c3)cc2)cc1 14792117 QJTZRAZMEIGCTC-UHFFFAOYSA-N 491.529 5.318 5 20 JKBD CCOc1ccc(NC(=O)[C@H](C)Oc2ccc3c(-c4ccc([N+](=O)[O-])cc4)cc(=O)oc3c2)cc1 15370808 LJELRZQHVUIBPL-INIZCTEOSA-N 474.469 5.173 5 20 JKBD CNC(=O)c1ccc(NC(=O)c2ccccc2Sc2ccc(C(F)(F)F)cc2[N+](=O)[O-])cc1 16016068 SMIMKDHTDPBPRL-UHFFFAOYSA-N 475.448 5.377 5 20 JKBD CCc1ccc(-c2nc(CC(=O)O[C@@H](C)c3nnc(-c4ccc([N+](=O)[O-])cc4)o3)cs2)cc1 16673497 SJCUUORIUBPLCP-AWEZNQCLSA-N 464.503 5.178 5 20 JKBD COC(=O)c1ccc2c(c1)CCN2C(=O)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])c(OC)c1 25181253 MDSRMTYXQDUMSL-UHFFFAOYSA-N 482.876 5.039 5 20 JKBD C[C@H](Nc1ccc(C(=O)NCc2ccnc(OC3CCCCC3)c2)cc1[N+](=O)[O-])c1ccccn1 60335259 ZTNDNBSSVMHCHA-SFHVURJKSA-N 475.549 5.199 5 20 JKBD Cc1ccc(C)c(OC2CCN(C(=O)c3ccc(N[C@@H](C)c4ccccn4)c([N+](=O)[O-])c3)CC2)c1 302972285 IGVLVDLIVMTTNW-FQEVSTJZSA-N 474.561 5.463 5 20 JKBD Cc1ccc(-c2csc(NC(=O)c3cnc(-c4ccc5c(c4)OCO5)s3)n2)cc1[N+](=O)[O-] 481953812 RXOHIPQTKMSDNQ-UHFFFAOYSA-N 466.500 5.131 5 20 JKBD Cc1nn(-c2ccccc2)c(C)c1NC(=O)c1ccc(N[C@H](C)c2ccccn2)c([N+](=O)[O-])c1 506084549 BCKAMFCDKSPAQQ-MRXNPFEDSA-N 456.506 5.218 5 20 JKBD CN(C)Cc1cccc(NC(=O)C/C(=C\c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)c1 506775509 IQQVNFRZFCEMOP-XSFVSMFZSA-N 472.570 5.836 5 20 JKBD C[C@H](Nc1ccc(C(=O)NCCc2ccc(OC(F)(F)F)cc2)cc1[N+](=O)[O-])c1ccccn1 507356033 XMWWWDHFQJLKFM-HNNXBMFYSA-N 474.439 5.034 5 20 JKBD Cc1cc(Br)cc(Cl)c1NC(=O)c1ccc([N+](=O)[O-])cc1I 508989425 YOFSLNRHSGWBKE-UHFFFAOYSA-N 495.498 5.176 5 20 JKBD O=C(Cc1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1)Nc1nc(C(F)(F)F)cs1 509337183 ICRJCEWNGVQRNL-UHFFFAOYSA-N 473.436 5.104 5 20 JKBD CC(=O)N(c1ccc(Cl)cc1)c1nc(/C=C/c2nc3cc([N+](=O)[O-])ccc3s2)cs1 515598807 BQBOIPJFRHSYON-RUDMXATFSA-N 456.936 6.169 5 20 JKBD COc1cc(C(=O)Nc2ccc(-c3csnn3)cc2)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 516698997 LMSZEJJNBNFHBX-UHFFFAOYSA-N 482.905 5.820 5 20 JKBD C[C@@H](Nc1ccc(C(=O)N2CCCC[C@@H]2c2nc3ccccc3n2C)cc1[N+](=O)[O-])c1ccccn1 517751470 JOFCSGPLDCZWMZ-HOYKHHGWSA-N 484.560 5.417 5 20 JKBD C[C@@H](NC(=O)C(=O)Nc1ccc(Sc2ccccc2)c(Cl)c1)c1cccc([N+](=O)[O-])c1 523636285 NGQUUZHAIRPPRX-CQSZACIVSA-N 455.923 5.215 5 20 JKBD O=C(c1c2c(nc3ccccc13)/C(=C\c1cccc([N+](=O)[O-])c1)CCC2)N1CCC[C@H](c2ncc[nH]2)C1 524339993 KJHAVUSCYRYGEE-LDETYFQJSA-N 493.567 5.763 5 20 JKBD O=C(C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)Nc1cccc2c1OCCO2 551203219 JUBJKGYIPNBYTK-VKAVYKQESA-N 473.510 5.545 5 20 JKBD O=C(Nc1ccc(NC(=O)C2CC2)cc1C(F)(F)F)c1ccc(Nc2ccccc2)c([N+](=O)[O-])c1 592902686 VQFHNRKWFDTAFG-UHFFFAOYSA-N 484.434 5.958 5 20 JKBD CSc1ccc(C(=O)c2ccccc2C(=O)N2CCC(c3c[nH]c4ccccc34)CC2)cc1[N+](=O)[O-] 594735097 JIBFORFVMZUIGP-UHFFFAOYSA-N 499.592 6.049 5 20 JKBD CCN(CC)C(=O)c1cccc(NC(=O)c2cc([N+](=O)[O-])ccc2Sc2ccc(Cl)cc2)c1 602092760 STMWPHWNSSFUEK-UHFFFAOYSA-N 483.977 6.134 5 20 JKBD O=C(Nc1ccc(C(=O)N2CCOCC2)c(Cl)c1)c1cc([N+](=O)[O-])ccc1Sc1ccccc1 603991110 WSIANSXMXZLBAT-UHFFFAOYSA-N 497.960 5.124 5 20 JKBD COc1cccc([C@@H](CNC(=O)c2c[nH]c3cc([N+](=O)[O-])ccc23)c2c[nH]c3ccccc23)c1OC 609586837 WNSFQVYLWUMREI-OAQYLSRUSA-N 484.512 5.137 5 20 JKBD Cc1nn(CC(C)C)c(C)c1CC(=O)Nc1cc(Cl)c([N+](=O)[O-])cc1OCc1ccccc1 727962380 KQAHIHHRWZSODN-UHFFFAOYSA-N 470.957 5.478 5 20 JKBD O=C(COc1ccc([N+](=O)[O-])c(F)c1)Nc1ccc(Oc2ncc(Cl)cc2Cl)cc1 745765861 MLEHEBOLSOTVAZ-UHFFFAOYSA-N 452.225 5.246 5 20 JKBD CC(=O)NCc1ccc(C(=O)[C@H](C)OC(=O)c2ccc(Sc3ccc(C)cc3)c([N+](=O)[O-])c2)s1 785318657 XMBVUJRJXHVQNO-HNNXBMFYSA-N 498.582 5.180 5 20 JKBD CC1=C(C(=O)Nc2cccc(C)c2C)[C@@H](c2ccc(-c3ccc([N+](=O)[O-])cc3)s2)NC(=S)N1 818329454 XFMVENLAZSASQY-JOCHJYFZSA-N 478.599 5.372 5 20 JKBD O=C1CC[C@@H](c2noc(-c3ccc(Nc4ccccc4)c([N+](=O)[O-])c3)n2)CN1CC1CCCC1 856579474 JTFAYYPALAPFRM-LJQANCHMSA-N 461.522 5.285 5 20 JKBD Cc1nn(C(C)(C)C)c2nc(C3CC3)cc(C(=O)N(C)Cc3cc([N+](=O)[O-])ccc3Cl)c12 917069731 ZEKMEQSAUZVPKF-UHFFFAOYSA-N 455.946 5.206 5 20 JKBD CC(=O)N(c1ccc(Cl)cc1)c1nc(/C=C2\C(=O)Nc3cc(Cl)c([N+](=O)[O-])cc32)cs1 917560035 FZOAZANVIOFOEJ-UUASQNMZSA-N 475.313 5.535 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Cl)[C@H](Nc1ccc(N2C(=O)CCCC2=O)cc1)c1ccccc1 917932772 IKJZMRISASKHFT-XMMPIXPASA-N 492.919 5.084 5 20 JKBD O=C(O[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1)c1cc(-c2cccc(F)c2)no1 919189414 BENJJKJIFLEKNW-QFIPXVFZSA-N 495.850 5.579 5 20 JKBD Cc1ccc(C)n1-c1sccc1C(=O)O[C@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 920061166 MTAWWYCXSRMVIK-CYBMUJFWSA-N 481.452 5.267 5 20 JKBD O=[N+]([O-])c1ccc(OC(F)F)c([C@H]2NC(=S)NC(c3cccs3)=C2c2nc3ccccc3[nH]2)c1 920847002 AOZHGHFFQOVNEL-GOSISDBHSA-N 499.524 5.221 5 20 JKBD COc1ccc([C@@H](Cc2ccccc2C)NC(=O)c2cc(Cl)ccc2[N+](=O)[O-])cc1OC 921284206 DAYPBLLIAFWIAZ-HXUWFJFHSA-N 454.910 5.288 5 20 JKBD C[C@H](CC(=O)NC1(c2ccc(NC(=O)Cc3cccc([N+](=O)[O-])c3)cc2)CCC1)Oc1ccccc1 1785795483 QIJNULBEGVDWOA-HXUWFJFHSA-N 487.556 5.129 5 20 JKBD Cc1nc(CC(=O)Nc2ccc(C3(NC(=O)/C=C/c4ccccc4[N+](=O)[O-])CCC3)cc2)c(C)s1 1786948236 JUZJJBJHIITYJI-MDWZMJQESA-N 490.585 5.058 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)c3ccc([N+](=O)[O-])c4c3OCO4)CCC2)cc1)c1ccc2ccoc2c1 1790892779 UBYMKEUJFMIWFA-UHFFFAOYSA-N 499.479 5.131 5 20 JKBD CC[C@H](C)[C@@H](C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1c(F)ccc([N+](=O)[O-])c1C)C2)c1ccccc1 1795575134 WIGHSKSYTGXHOQ-RRJPFGDRSA-N 481.568 5.124 5 20 JKBD Cc1c(C(=O)N2CCC3(CCCN(C(=O)CCc4cccs4)C3)CC2)cc(Cl)cc1[N+](=O)[O-] 1807227081 ZUNLRYQUBRBBBK-UHFFFAOYSA-N 490.025 5.096 5 20 JKBD CC[C@@H](C)[C@H](C(=O)N1CCCC2(CCN(C(=O)c3cccc(F)c3[N+](=O)[O-])CC2)C1)c1ccccc1 1809162373 MLFIDMXLPPVHKM-YKSBVNFPSA-N 495.595 5.409 5 20 JKBD Cc1c(C(=O)N2CCCC[C@H]2c2cc(NC(=O)C(C)(C)C(C)(F)F)n[nH]2)cc(Cl)cc1[N+](=O)[O-] 1815337938 QOGIQBVXXPGKCY-INIZCTEOSA-N 497.930 5.267 5 20 JKBD O=C(C1CCCCC1)N1CCCC[C@H]1c1cc(NC(=O)C2(c3cccc([N+](=O)[O-])c3)CCC2)n[nH]1 1820840506 GQWILMQZDKPZEQ-QFIPXVFZSA-N 479.581 5.012 5 20 JKBD Cc1cccc(C(=O)N2CCC([C@@H]3CCCCN3C(=O)Cc3cccc([N+](=O)[O-])c3)CC2)c1Cl 1823683762 MACODOHBEAQDDT-QHCPKHFHSA-N 483.996 5.033 5 20 JKBD CC[C@H](C)CC(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cc(Br)ccc2[N+](=O)[O-])CC1 1824346072 APIATAIPZPHHCH-JXFKEZNVSA-N 494.430 5.027 5 20 JKBD C[C@@]1(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)Cc3ccc(Cl)cc3[N+](=O)[O-])CC2)CC=CCC1 1832401997 KNUPYMWWFFVYBH-ATIYNZHBSA-N 488.028 5.157 5 20 JKBD C[C@H](Sc1nnc(-c2ccccc2Cl)n1Cc1ccccc1)C(=O)Nc1ccccc1[N+](=O)[O-] 8989160 NXYLTIVPXSZRMV-INIZCTEOSA-N 493.976 5.674 5 20 JKBD C[C@H](OC(=O)CCc1ncc(-c2ccccc2Cl)o1)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl 12252709 SGMVHGXTBVBQJD-LBPRGKRZSA-N 478.288 5.060 5 20 JKBD COc1ccc(-c2[nH]c3ccccc3c2CCC(=O)OCC(=O)Nc2cc([N+](=O)[O-])ccc2F)cc1 12700915 NMTBPUFJZQQVPO-UHFFFAOYSA-N 491.475 5.005 5 20 JKBD Cc1cc(C)c(NC(=O)CN(C)C(=O)c2ccc(NCc3ccccc3Cl)c([N+](=O)[O-])c2)c(C)c1 15768518 XMTFYCVPFBSEBT-UHFFFAOYSA-N 494.979 5.496 5 20 JKBD O=C(CSc1nnc(-c2cccs2)n1C1CC1)Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1 17270485 SRVLBRQGKKWPTQ-UHFFFAOYSA-N 484.588 5.104 5 20 JKBD C[C@@H](Sc1nnc(-c2ccccc2Cl)n1C1CCCC1)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 17657229 DFFNNGUHWPTBKP-CQSZACIVSA-N 496.980 6.525 5 20 JKBD CCOc1cc2c(cc1CN[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1)O[C@@H](C)C2 25704100 WYLGBWNXKRSWSN-IVCQMTBJSA-N 495.963 5.440 5 20 JKBD COc1cc(C(=O)Nc2ncc(Cc3cccc(Cl)c3Cl)s2)c([N+](=O)[O-])cc1OC 26366243 BQPOQGPSPDBZMV-UHFFFAOYSA-N 468.318 5.218 5 20 JKBD COc1ccccc1NS(=O)(=O)c1cc([N+](=O)[O-])ccc1N[C@H]1CCSc2c(F)cccc21 29621950 ZAPZIHPSYYEJQB-KRWDZBQOSA-N 489.550 5.192 5 20 JKBD Cc1nn(-c2ccc(F)cc2)cc1CN[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1 30511715 FEQIBYRMEUAQHR-XMMPIXPASA-N 493.926 5.351 5 20 JKBD O=C(CCCn1c(=O)oc2cc([N+](=O)[O-])ccc21)Nc1cc(Cl)ccc1Oc1ccccc1 36784263 CWJWNWXVWARMLN-UHFFFAOYSA-N 467.865 5.367 5 20 JKBD CCCN(C(=O)C1CCN(c2ccccc2[N+](=O)[O-])CC1)[C@@H](C)c1ccccc1Br 59120416 OIOPDPLPEHSJTR-KRWDZBQOSA-N 474.399 5.574 5 20 JKBD C[C@H](Nc1ccc(C(=O)N(Cc2ccccc2)Cc2ccco2)cc1[N+](=O)[O-])c1ccccn1 72016667 WCOUTXHGEHMYLM-IBGZPJMESA-N 456.502 5.599 5 20 JKBD Cc1cc(C(=O)N2CCC[C@@H]2C(=O)Nc2ccc(NCc3ccccc3)c(Cl)c2)ccc1[N+](=O)[O-] 72083468 NGSXZPDYPFZALN-XMMPIXPASA-N 492.963 5.412 5 20 JKBD O=C(N[C@H](c1ccccc1)c1ccco1)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 105010334 AXIPAXSVRZIOGG-JOCHJYFZSA-N 473.451 5.329 5 20 JKBD CCN(Cc1ccc(OC)cc1)C(=O)Cc1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1 105911177 CLPSBQRRONYWAG-UHFFFAOYSA-N 470.529 5.047 5 20 JKBD C[C@@H](Nc1ccc(C(=O)N(C2CC2)[C@@H]2CCCc3ccccc32)cc1[N+](=O)[O-])c1ccccn1 110573774 ZTHLMJJKJGDXDF-IQGLISFBSA-N 456.546 5.845 5 20 JKBD CCCCn1c(SCc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)nc2sc(C)c(C)c2c1=O 248254478 UCCSCMYSEYUZNW-UHFFFAOYSA-N 471.564 5.125 5 20 JKBD CN(C)C(=O)c1cccc(CNC(=O)c2cc([N+](=O)[O-])ccc2Sc2ccc(Cl)cc2)c1 482822316 IODZCEUHQZXJIW-UHFFFAOYSA-N 469.950 5.031 5 20 JKBD O=C(c1cc([N+](=O)[O-])ccc1Sc1ccccc1)N1CCC(Nc2ccc(F)cc2)CC1 486539271 WYYMNZFJGNXJRK-UHFFFAOYSA-N 451.523 5.602 5 20 JKBD O=[N+]([O-])c1ccc(-c2ccc(CN[C@@H](c3ccccc3)c3cccnc3)o2)c(Br)c1 488594884 RHSKSTIWTXKIIV-QHCPKHFHSA-N 464.319 5.892 5 20 JKBD COC(=O)c1ccc(-c2nc(CSc3nc4cc5ccccc5cc4c(=O)n3C)cs2)cc1 496538371 USNCSAZFHDNOAC-UHFFFAOYSA-N 473.579 5.289 5 20 JKBD CCOc1cc([N+](=O)[O-])c(C(=O)Nc2ccc(Oc3cccc(Br)c3)nc2)cc1OC 503327948 FNDVIXQMUXWMGR-UHFFFAOYSA-N 488.294 5.204 5 20 JKBD Cc1oncc1C(=O)Nc1ccc(NC(=O)c2ccc(SCCC(C)C)c([N+](=O)[O-])c2)cc1 512551120 BTLFONCRJZXSBS-UHFFFAOYSA-N 468.535 5.534 5 20 JKBD COc1ccc(CSc2nnc(SCc3nc(-c4ccc([N+](=O)[O-])cc4)no3)s2)cc1 514572136 VPYUSZGAIUNRME-UHFFFAOYSA-N 473.561 5.090 5 20 JKBD CC(C)N(C(=O)c1ccc(N2CCC[C@@H](C)C2)c([N+](=O)[O-])c1)c1ccc(Br)cn1 515626009 OBZRWOVOKKHJDZ-OAHLLOKOSA-N 461.360 5.044 5 20 JKBD Cc1cc(C(=O)NC2CCCC2)ccc1NC(=O)c1ccc(N2CCC[C@H](C)C2)c([N+](=O)[O-])c1 520465016 CMFLOPZGOMHKBW-KRWDZBQOSA-N 464.566 5.064 5 20 JKBD Cc1ccc(C(=O)Nc2cccc(C(F)(F)F)c2)cc1NC(=O)c1n[nH]c2ccc([N+](=O)[O-])cc12 521293087 KXUTUFIHCZLYBE-UHFFFAOYSA-N 483.406 5.303 5 20 JKBD O=[N+]([O-])c1ccc(-c2ccc(CNCCc3coc(-c4ccc(F)cc4)n3)o2)c(Br)c1 521829494 DGARLBVJVXMUKR-UHFFFAOYSA-N 486.297 5.744 5 20 JKBD Cc1sc(NC(=O)c2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)nc1-c1cccc(Cl)c1 584307184 XQZZIIUIXPJOGE-UHFFFAOYSA-N 453.911 5.333 5 20 JKBD Cc1csc(Sc2ccc(C(=O)Nc3cccc(Cl)c3N3CCOCC3)cc2[N+](=O)[O-])n1 590767124 BKDSKBVCURHZBW-UHFFFAOYSA-N 490.994 5.253 5 20 JKBD Cc1sc(NC(=O)c2ccc(Cl)c(N3CCCC3=O)c2)nc1-c1cccc([N+](=O)[O-])c1 603997863 USVLWGZRDQOFOI-UHFFFAOYSA-N 456.911 5.059 5 20 JKBD CCN(C[C@@H]1CCOC1)C(=O)C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1 604440388 TWRHSCAWARESCH-DYGKOUCMSA-N 451.548 5.020 5 20 JKBD O=C(CCNc1ccc(C(F)(F)F)cc1[N+](=O)[O-])Nc1c(-c2ccccc2)ncn1C1CC1 604544167 UNQLGEIGIHRPCD-UHFFFAOYSA-N 459.428 5.253 5 20 JKBD CCS(=O)(=O)c1ccc(O)c(NC(=O)CCC(=O)c2ccc3ccc4cccc5ccc2c3c45)c1 727764657 FGKLQTYREJIJCT-UHFFFAOYSA-N 485.561 5.685 5 20 JKBD Cc1csc([C@@H](C)NCc2ccc(Sc3nc4ccc([N+](=O)[O-])cc4s3)c([N+](=O)[O-])c2)n1 727837927 YRMVNXUKEXLYKD-GFCCVEGCSA-N 487.588 5.880 5 20 JKBD C[C@@H](OC(=O)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1)c1cccc([N+](=O)[O-])c1 729626675 GMBATMKZWVWEOX-CYBMUJFWSA-N 467.400 5.043 5 20 JKBD CSc1ccc(C(=O)c2ccccc2C(=O)OCc2csc(-c3ccoc3)n2)cc1[N+](=O)[O-] 731061043 OSJHKOYDOYCSCX-UHFFFAOYSA-N 480.523 5.621 5 20 JKBD C[C@H](Nc1ccc(-c2nc([C@@H]3CCC(=O)N(CC4CCCC4)C3)no2)cc1[N+](=O)[O-])c1ccccn1 856577519 IARIZVKKLGPONK-FXAWDEMLSA-N 490.564 5.109 5 20 JKBD COc1ccccc1-c1noc(C/C(=C/c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)n1 904270203 FBKFMBHKTYVNIR-VKAVYKQESA-N 470.510 6.046 5 20 JKBD C[C@@H](Nc1ccc(-c2nc(-c3ccc(Br)cn3)no2)cc1[N+](=O)[O-])c1ccccn1 904848014 FSLRERKSKUWROD-GFCCVEGCSA-N 467.283 5.037 5 20 JKBD COc1ccc(Oc2ccc([N+](=O)[O-])cc2C(=O)O[C@@H](C)C(=O)N2CCC[C@H]2c2cccs2)cc1 915443120 YRJFBOUOSMJGNH-KKSFZXQISA-N 496.541 5.366 5 20 JKBD CC(C)c1ccc(SCC(=O)N(Cc2nnc(-c3cccc([N+](=O)[O-])c3)o2)C(C)C)cc1 915823850 NZIHQKAVWRGWIL-UHFFFAOYSA-N 454.552 5.298 5 20 JKBD COc1cc(NC(=O)c2cc(OCC(F)(F)F)ccc2[N+](=O)[O-])ccc1NC(=O)OC(C)(C)C 916431154 DDGNRRINYRODAQ-UHFFFAOYSA-N 485.415 5.144 5 20 JKBD O=C(Nc1cc(N2CCCC2=O)ccc1F)c1cc([N+](=O)[O-])ccc1Sc1ccc(Cl)cc1 917796631 IGJKIEVCDFTUSN-UHFFFAOYSA-N 485.924 5.918 5 20 JKBD CC1=C(C(=O)Nc2ccc(F)cc2)[C@@H](c2ccc([N+](=O)[O-])o2)NC(=S)N1c1ccc2c(c1)CCC2 918109559 PXGJAHSEZLQTNK-HSZRJFAPSA-N 492.532 5.164 5 20 JKBD Cc1c(NC(=O)[C@H](C)OC(=O)c2csc(-c3cc(Br)cs3)n2)cccc1[N+](=O)[O-] 919632224 QKQBIVNFJYBVIX-JTQLQIEISA-N 496.364 5.035 5 20 JKBD Cc1c(C(=O)N(Cc2nnc(-c3cccc([N+](=O)[O-])c3)o2)C(C)C)sc2ccc(F)cc12 919681012 HEMDSXFQUPSMMF-UHFFFAOYSA-N 454.483 5.358 5 20 JKBD COc1cccc([C@@H](C)C(=O)O[C@@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2ccccc2)c1 919733067 PHDIUFIAPXDZCI-IVZQSRNASA-N 468.893 5.284 5 20 JKBD COc1cc(C(=O)OCc2nc(-c3ccccc3)cs2)c([N+](=O)[O-])cc1OCc1cscn1 920120038 FIYWXCQTGPIZNP-UHFFFAOYSA-N 483.527 5.119 5 20 JKBD O=C(CCC1CCC1)Nc1cc([C@H]2CCCCN2C(=O)C2(c3cccc([N+](=O)[O-])c3)CCC2)[nH]n1 1815051826 XFRKYSZWHQWQSC-JOCHJYFZSA-N 479.581 5.012 5 20 JKBD O=C(Nc1cc([C@H]2CCCCN2C(=O)c2ccc([N+](=O)[O-])cc2F)[nH]n1)c1cc2sccc2s1 1819029537 TZGSITDBDUPZKC-MRXNPFEDSA-N 499.549 5.353 5 20 JKBD CC1(C)CCC(CC(=O)Nc2cc([C@@H]3CCCCN3C(=O)c3cc(F)cc([N+](=O)[O-])c3)[nH]n2)CC1 1820978863 SOSVKEHBFHOFAW-NRFANRHFSA-N 485.560 5.369 5 20 JKBD O=C(Nc1cc([C@@H]2CCCCN2C(=O)C2(F)CCCCC2)[nH]n1)c1cc2cc([N+](=O)[O-])ccc2s1 1821610485 ZYZVDOOMSFMBDH-SFHVURJKSA-N 499.568 5.511 5 20 JKBD CCCn1c(S[C@@H](C)C(=O)Nc2cc([N+](=O)[O-])ccc2Cl)nc2cc(Cl)ccc2c1=O 3370514 GJLKROBEFKPMAH-NSHDSACASA-N 481.361 5.141 5 20 JKBD O=C(Nc1ccc(OC(=O)[C@H]2Cc3ccccc3S2)cc1)c1cc([N+](=O)[O-])ccc1Cl 9675230 KKALVXYNKREVKG-HXUWFJFHSA-N 454.891 5.123 5 20 JKBD CSc1ccc(C(=O)c2ccccc2C(=O)OCC(=O)Nc2cc(Cl)ccc2C)cc1[N+](=O)[O-] 10155000 PCQQECRLMQUVJQ-UHFFFAOYSA-N 498.944 5.305 5 20 JKBD CC(C)c1cccc(C(C)C)c1NC(=O)COC(=O)Cn1c2ccccc2c(=O)c2ccccc21 10722681 SRLIQEXTBUCVKI-UHFFFAOYSA-N 470.569 5.583 5 20 JKBD C[C@H](Sc1nnc(-c2cccs2)n1-c1ccccc1)C(=O)Nc1ccccc1[N+](=O)[O-] 11209816 GRPOGROFBHNHSR-AWEZNQCLSA-N 451.533 5.023 5 20 JKBD CC(=O)N(c1ccc(Cl)c(Cl)c1)c1nc(COC(=O)Cc2ccccc2[N+](=O)[O-])cs1 11466113 OAYNPWVHMXUGIA-UHFFFAOYSA-N 480.329 5.329 5 20 JKBD CCOc1ccc([C@@H](C)N[C@@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2ccccc2)cc1 11708089 GIEKIMWQFJMADS-WAIKUNEKSA-N 453.926 5.678 5 20 JKBD Cc1cccn2c(NC(=O)c3ccc(Br)c([N+](=O)[O-])c3)c(-c3ccccc3)nc12 21832215 TWRDUIDTEHZKPL-UHFFFAOYSA-N 451.280 5.233 5 20 JKBD CC(=O)N(c1cccc(C(F)(F)F)c1)c1nc(COC(=O)c2c(C)cccc2[N+](=O)[O-])cs1 22003819 RPZRLVFCJVOURT-UHFFFAOYSA-N 479.436 5.420 5 20 JKBD Cc1csc(Sc2ccc(C(=O)N(Cc3cccs3)C[C@H]3CCCO3)cc2[N+](=O)[O-])n1 104918800 OULZIRCKSSTYPI-MRXNPFEDSA-N 475.617 5.394 5 20 JKBD COc1ccc([N+](=O)[O-])cc1NC(=O)c1cc(-c2cc(C)sc2C)nc2c1cnn2C(C)C 106923328 DCMBIBSHXXBBPF-UHFFFAOYSA-N 465.535 5.527 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)N[C@@H](c2ccccc2)c2ccc3c(c2)CCCO3)cc1SC 410043103 PYVNTKZZLVFWQF-DEOSSOPVSA-N 464.543 5.170 5 20 JKBD COc1ccc(CSCC(=O)Nc2cc(NC(=O)c3ccccc3)ccc2C)cc1[N+](=O)[O-] 484278679 IURQSFHHVHXWOP-UHFFFAOYSA-N 465.531 5.036 5 20 JKBD Cc1ccc(S(=O)(=O)Nc2ccc(NC(=O)c3csc(-c4ccc([N+](=O)[O-])cc4)n3)cc2)cc1 497264951 YEFNVWPWWTXWIT-UHFFFAOYSA-N 494.554 5.080 5 20 JKBD O=C(NCCc1coc(-c2ccc(F)cc2)n1)c1cc([N+](=O)[O-])ccc1Sc1ccccc1 507149519 MQDPSIVSPJVGHS-UHFFFAOYSA-N 463.490 5.513 5 20 JKBD COc1cc(C(=O)N(Cc2ccco2)c2ccc(F)cc2C)c([N+](=O)[O-])cc1OCc1cscn1 512266577 BPBZFTMDSQZXRO-UHFFFAOYSA-N 497.504 5.526 5 20 JKBD COc1ccc(C(=O)C2CCN(c3c([N+](=O)[O-])cnc4ccc(Br)cc34)CC2)cc1 515549459 QBFNWIZNJKZMDH-UHFFFAOYSA-N 470.323 5.013 5 20 JKBD CC(=O)N(c1nc(COc2ccc(-c3ccccc3)cc2[N+](=O)[O-])cs1)c1ccc(C)cc1C 517912601 ZGEGOMMFCFALQX-UHFFFAOYSA-N 473.554 6.599 5 20 JKBD O=C(Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1)c1cnn(-c2ccccc2)c1C(F)(F)F 585698676 LDRJJDXMDIEOKP-UHFFFAOYSA-N 459.409 5.175 5 20 JKBD O=C(Nc1cc(OCC(F)(F)F)cc(OCC(F)(F)F)c1)c1ccc(Cl)cc1[N+](=O)[O-] 585732893 PIMIADSLPLRXIO-UHFFFAOYSA-N 472.725 5.383 5 20 JKBD CCC(=O)Nc1cccc(CN[C@@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2ccccc2)c1 604045775 QWWBBWVCQSBQKR-HSZRJFAPSA-N 466.925 5.066 5 20 JKBD CN(CCCc1cc(-c2ccc(F)cc2)no1)C(=O)c1cc([N+](=O)[O-])ccc1NCc1ccccc1 604570454 WEMQMRCCRYYNBM-UHFFFAOYSA-N 488.519 5.706 5 20 JKBD COCCN(C(=O)[C@H](C)Oc1ccccc1C(F)(F)F)c1nc(-c2ccc([N+](=O)[O-])cc2)cs1 608895699 GUCCEVUGVAMLAZ-AWEZNQCLSA-N 495.479 5.184 5 20 JKBD COc1cc(CN2CCO[C@@H](c3ccc(Cl)c(Cl)c3)C2)c([N+](=O)[O-])cc1OC(F)F 608975982 GTPJUBWQDSXADX-GOSISDBHSA-N 463.264 5.085 5 20 JKBD CCc1sc(NC(=O)c2cc(OC)c(OC(F)F)cc2[N+](=O)[O-])nc1-c1ccc(OC)cc1 609202684 RFVOWPMVCUEGLF-UHFFFAOYSA-N 479.461 5.152 5 20 JKBD COC(=O)Cc1csc(NC(=O)CCC(=O)c2ccc3ccc4cccc5ccc2c3c45)n1 727766558 DCCNGHHBEKRORC-UHFFFAOYSA-N 456.523 5.358 5 20 JKBD C[C@H]1C[C@@H](C)CN(c2ccc(C(=O)O[C@H](C)C(=O)Nc3ccccc3C(F)(F)F)cc2[N+](=O)[O-])C1 728943842 UZZFZVYEMOSWRY-OWCLPIDISA-N 493.482 5.280 5 20 JKBD O=C(Nc1nc(-c2ccc(OC(F)F)cc2OC(F)F)cs1)c1ccc(Cl)c([N+](=O)[O-])c1 747386607 PSZZNKPYASPLAM-UHFFFAOYSA-N 491.806 5.827 5 20 JKBD COc1ccc(C(=O)N2CCCCCC2)cc1NC(=O)c1cc([N+](=O)[O-])ccc1N1CCC(C)CC1 749139280 PXBKBFUJIRGQDF-UHFFFAOYSA-N 494.592 5.108 5 20 JKBD O=[N+]([O-])c1ccc(-c2nc(-c3ccc(OCc4cccnc4)cc3)no2)c(Br)c1 904464732 HQWRUOYEAPDWMK-UHFFFAOYSA-N 453.252 5.048 5 20 JKBD Cc1nn(C)c(-c2nc(-c3ccc(Oc4ncc(C(F)(F)F)cc4Cl)cc3)no2)c1[N+](=O)[O-] 904667528 AZLWMGNXUUVBQI-UHFFFAOYSA-N 480.790 5.213 5 20 JKBD O=C(NCc1ccccc1COCc1ccccc1)c1ccc(Br)c([N+](=O)[O-])c1 915600452 PLJNJPYBOGJNAR-UHFFFAOYSA-N 455.308 5.004 5 20 JKBD COc1c([N+](=O)[O-])cc(N[C@@H](C)c2ccccc2OC(C)C)c([N+](=O)[O-])c1Br 917077348 JSXLAZUZDSRAMI-NSHDSACASA-N 454.277 5.234 5 20 JKBD COCCOc1cccc(C(=O)Nc2cc(Cl)c([N+](=O)[O-])cc2OCc2ccccc2)c1 919683187 XZWFCHBCBXYGRI-UHFFFAOYSA-N 456.882 5.105 5 20 JKBD C[C@H](Nc1ccc(C(=O)OCC(=O)c2cccc(C(F)(F)F)c2)cc1[N+](=O)[O-])c1ccccn1 920549312 XFOMNPIAFYNRGJ-AWEZNQCLSA-N 473.407 5.221 5 20 JKBD COc1cc(NC(=O)[C@H](C)Oc2ccc(Cl)cc2[N+](=O)[O-])ccc1NC(=O)OC(C)(C)C 920766344 XLQRXNWGASUQGK-LBPRGKRZSA-N 465.890 5.010 5 20 JKBD O=C(Cc1cccc([N+](=O)[O-])c1)Nc1ccc(C2(NC(=O)CSc3ccccc3)CCC2)cc1 1785792730 YEXNEHJSLBIJQQ-UHFFFAOYSA-N 475.570 5.064 5 20 JKBD Cc1c(Cl)cccc1C(=O)Nc1ccc(C2(NC(=O)c3ccc([N+](=O)[O-])o3)CCC2)cc1 1785949872 UZPHHCKSDJXPTG-UHFFFAOYSA-N 453.882 5.211 5 20 JKBD CC(C)n1nccc1C(=O)NC1(c2ccc(NC(=O)Cc3ccc(Cl)cc3[N+](=O)[O-])cc2)CCC1 1786116083 UGBQZGMCHMYLJP-UHFFFAOYSA-N 495.967 5.016 5 20 JKBD Cc1ncccc1C(=O)Nc1ccc(C2(NC(=O)c3cc4cc([N+](=O)[O-])ccc4s3)CCC2)cc1 1787322042 GKNFDZYPXXYCSC-UHFFFAOYSA-N 486.553 5.574 5 20 JKBD O=C(Cc1ccc(F)cc1)Nc1ccc(C2(NC(=O)CSc3ccccc3[N+](=O)[O-])CCC2)cc1 1787763303 RWXUKCKLFOGJMC-UHFFFAOYSA-N 493.560 5.203 5 20 JKBD Cc1c[nH]cc1C(=O)Nc1ccc(C2(NC(=O)c3cccc(Br)c3[N+](=O)[O-])CCC2)cc1 1788731399 MMVJQIPBZJTXIZ-UHFFFAOYSA-N 497.349 5.055 5 20 JKBD CC1=CC[C@@H](C(=O)NC2(c3ccc(NC(=O)c4cc([N+](=O)[O-])cc5c4OCC5)cc3)CCC2)CC1 1790046739 SCHBVHHMOMDOTI-GOSISDBHSA-N 475.545 5.024 5 20 JKBD Cc1ncc(C(=O)NC2(c3ccc(NC(=O)c4cc5cc([N+](=O)[O-])ccc5s4)cc3)CCC2)s1 1791010343 IRRSURLFHGOCLB-UHFFFAOYSA-N 492.582 5.636 5 20 JKBD O=C(Cc1cscn1)NC1(c2ccc(NC(=O)c3cc4cc([N+](=O)[O-])ccc4s3)cc2)CCC1 1791011276 VMYAUXWOWFEYNB-UHFFFAOYSA-N 492.582 5.256 5 20 JKBD Cc1ccc(CCC(=O)NC2(c3ccc(NC(=O)/C=C/c4ccccc4[N+](=O)[O-])cc3)CCC2)cn1 1792315540 YWVMKNVNMAEGAU-MHWRWJLKSA-N 484.556 5.078 5 20 JKBD Cc1c(C(=O)Nc2cc([C@H]3CCCCN3C(=O)c3ccoc3Cl)[nH]n2)cc(Cl)cc1[N+](=O)[O-] 1821293923 KQSNSDZCFZHAKZ-MRXNPFEDSA-N 492.319 5.146 5 20 JKBD Cc1ccc(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)c3cc(F)cc([N+](=O)[O-])c3)[nH]n2)c(Cl)c1 1823185854 DHZKXPDLCVTEDF-FQEVSTJZSA-N 485.903 5.039 5 20 JKBD CC[C@@H](C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cccc(F)c2[N+](=O)[O-])CC1)c1ccccc1 1826316430 GGEIKNFUDCLSAI-QPPBQGQZSA-N 481.568 5.161 5 20 JKBD CC[C@H](C)[C@H](C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2ccc([N+](=O)[O-])o2)CC1)c1ccccc1 1826419306 REXAOGKRZLYJJQ-JTJYXVOQSA-N 481.593 5.251 5 20 JKBD C/C(=C\c1cccs1)C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cccc(F)c2[N+](=O)[O-])CC1 1830617174 SWYCLYJVACZADY-NBRGKURFSA-N 485.581 5.132 5 20 JKBD O=C(c1cc(F)cc(Cl)c1)N1CCC([C@@H]2CCCCN2C(=O)c2cccc(F)c2[N+](=O)[O-])CC1 1830623642 XZJAEZLDBGNVMD-NRFANRHFSA-N 491.922 5.074 5 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IJKOCLKFNVLBMJ-CQSZACIVSA-N 484.867 5.111 5 20 JKBD Cc1onc(-c2ccccc2Cl)c1C(=O)OCC(=O)Nc1ccc(C(F)(F)F)cc1[N+](=O)[O-] 22746625 DCBXUURINWNJJN-UHFFFAOYSA-N 483.786 5.026 5 20 JKBD Cn1c(S[C@@H](C(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)c2ccccc2)nnc1-c1ccccc1 115024054 PJOWJKRHZLTXNM-HXUWFJFHSA-N 479.949 5.516 5 20 JKBD Cc1csc(Sc2ccc(C(=O)N3CCC(n4c(C)ccc4C)CC3)cc2[N+](=O)[O-])n1 116304889 QCOYLJBUXVIACO-UHFFFAOYSA-N 456.593 5.407 5 20 JKBD Cc1cc(NC(=O)COC(=O)c2c3c(nc4ccccc24)/C(=C\c2cccc([N+](=O)[O-])c2)CCC3)no1 207146566 FVMRFOLQZTWQJJ-AQTBWJFISA-N 498.495 5.112 5 20 JKBD Cc1ccc(NC(=O)[C@@H](OC(=O)/C=C\c2ccc3ccccc3n2)c2ccccc2)c([N+](=O)[O-])c1 207427963 VOFNZMIERVJRSK-LUYCFMQYSA-N 467.481 5.388 5 20 JKBD COc1ccc([C@@H](C)N(C)C(=O)C/C(=C\c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)cc1 483220136 KAKYASQYGZSEDZ-WKSXIXGESA-N 487.581 6.363 5 20 JKBD CC(C)(CNC(=O)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-])c1cccc(Br)c1 507097815 SEJBESCMMDLWLS-UHFFFAOYSA-N 475.261 5.006 5 20 JKBD C[C@H]1CN(c2ccc(CNCc3ccc(Oc4ccccc4Cl)c([N+](=O)[O-])c3)cn2)C[C@@H](C)O1 509598619 CLOODRFBQPLPHP-HDICACEKSA-N 482.968 5.339 5 20 JKBD COc1cc(C(=O)Nc2cc(-c3ccncc3)[nH]n2)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 512296634 WKWTYLGOPSBLAH-UHFFFAOYSA-N 465.853 5.087 5 20 JKBD C[C@@H](Nc1ccc(C(=O)NCC2(c3ccc(Cl)cc3)CC2)cc1[N+](=O)[O-])c1ccccn1 524058143 CZDLLNCVBBINCR-MRXNPFEDSA-N 450.926 5.278 5 20 JKBD COc1cccc([C@H]2CCCN2C(=O)C/C(=C\c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)c1 590671062 LRNOPIPBKHRSNR-KZTQLJDNSA-N 499.592 6.508 5 20 JKBD O=C(Cc1ccccc1[N+](=O)[O-])N(C[C@H]1CCCO1)c1nc(-c2cccc(C(F)(F)F)c2)cs1 592950788 UZWRSXGWOFSCIH-GOSISDBHSA-N 491.491 5.492 5 20 JKBD O=[N+]([O-])c1ccc(OCCCSc2nnc(COc3ccc(Cl)cc3Cl)o2)cc1 603947585 KNDHGISXVAITFH-UHFFFAOYSA-N 456.307 5.425 5 20 JKBD O=C(NC1CCCC1)c1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2NCc2ccccc2)cc1 603976009 RPGFFXVZHSSJRR-UHFFFAOYSA-N 458.518 5.132 5 20 JKBD CSCc1ccc(N[C@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Br)c2ccccc2)cc1 608980531 CXOWGEWUPUZAAJ-NRFANRHFSA-N 486.391 6.012 5 20 JKBD Cc1ccc(N(C(=O)C2CCN(c3ccc(C(F)(F)F)cc3[N+](=O)[O-])CC2)C2CCCCC2)nc1 609375669 KJQJNXCFDOALOH-UHFFFAOYSA-N 490.526 5.899 5 20 JKBD COC(=O)Nc1cc(NC(=O)c2ccc(NCc3ccccc3Cl)c([N+](=O)[O-])c2)ccc1F 727335228 QPPITMMTETUNHU-UHFFFAOYSA-N 472.860 5.430 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])c(Cl)c1)c1cc(S(=O)(=O)Nc2ccccc2F)ccc1Cl 727711255 RVJQKZKYSWJSLQ-UHFFFAOYSA-N 484.292 5.094 5 20 JKBD COc1ccc(CC(=O)OCC(=O)N2c3ccccc3Sc3ccc(Cl)cc32)cc1[N+](=O)[O-] 727882350 GDSDIAMKAAGIGO-UHFFFAOYSA-N 484.917 5.172 5 20 JKBD CC(=O)N(c1ccc(C)c(C)c1)c1nc(/C=C2\N=C(c3ccc([N+](=O)[O-])c(C)c3)OC2=O)cs1 812447891 OGPGHSCPEQURTM-JAIQZWGSSA-N 476.514 5.006 5 20 JKBD COc1ccc([C@@H](Nc2cc([N+](=O)[O-])c(OC)c(Br)c2[N+](=O)[O-])C(C)C)cc1 836183455 WNENDHBEQXRWDF-INIZCTEOSA-N 454.277 5.092 5 20 JKBD COc1cc(CCNC(=O)Nc2ccccc2SCc2ccccc2)c([N+](=O)[O-])cc1OC 915329805 JRXKSMJHRJZGKP-UHFFFAOYSA-N 467.547 5.269 5 20 JKBD CC(C)(C)n1ncc(C(=O)Oc2ccc(NC(=O)c3cccc([N+](=O)[O-])c3)cc2)c1C(F)(F)F 916952816 KDTNAOIJWZJNJQ-UHFFFAOYSA-N 476.411 5.037 5 20 JKBD CCCN1C(=S)N[C@H](c2csc([N+](=O)[O-])c2)C(C(=O)Nc2ccccc2C(F)(F)F)=C1C 917375753 URDSNLDMZUWYPW-QGZVFWFLSA-N 484.525 5.229 5 20 JKBD C[C@H](Oc1ccc(C(=O)O[C@@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)cn1)c1ccccc1 919214991 OLDLSYFZCDZTNK-HOTGVXAUSA-N 460.446 5.098 5 20 JKBD O=C(O[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1)c1cnc(-c2ccccc2)nc1 921214719 NFILVKRSDXCUNE-JOCHJYFZSA-N 488.887 5.242 5 20 JKBD O=C(O[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1)c1ccc(CN2CCCC2)cc1 927535781 BTPXCHJXEHKRTP-XMMPIXPASA-N 493.947 5.381 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)c3cc4cc([N+](=O)[O-])ccc4s3)CCC2)cc1)c1cncs1 1787533461 QPACBUHFSRWYNS-UHFFFAOYSA-N 478.555 5.328 5 20 JKBD O=C(NC1(c2ccc(NC(=O)c3nc[nH]c3[N+](=O)[O-])cc2)CCC1)c1ccc(-c2ccccc2)c(F)c1 1788612468 UKBHAEQZMULWNJ-UHFFFAOYSA-N 499.502 5.186 5 20 JKBD Cc1cc(C(=O)Nc2ccc(C3(NC(=O)CSc4ccccc4[N+](=O)[O-])CCC3)cc2)c(C)n1C 1789977453 JSYYAFCFSJALRS-UHFFFAOYSA-N 492.601 5.090 5 20 JKBD O=C(/C=C/c1ccc([N+](=O)[O-])o1)NC1(c2ccc(NC(=O)c3cccc4ccoc34)cc2)CCC1 1790953009 RXSHVTBYDYPYEO-PKNBQFBNSA-N 471.469 5.395 5 20 JKBD COc1cccc(Cl)c1C(=O)Nc1ccc(C2(NC(=O)c3cc(O)cc([N+](=O)[O-])c3)CCC2)cc1 1792146210 UKZXMJUHZSVVMX-UHFFFAOYSA-N 495.919 5.024 5 20 JKBD CC[C@H](C)[C@H](C(=O)N1CCC2(CCCN(C(=O)/C=C/c3ccc([N+](=O)[O-])o3)C2)CC1)c1ccccc1 1805681939 BGVJKVTUZKMEAV-PYEYBSRVSA-N 493.604 5.262 5 20 JKBD CC(C)=CCCC(=O)N1CC[C@H](CNC(=O)c2cc3cc([N+](=O)[O-])ccc3s2)[C@H]1c1cccnc1 1812303822 ORHPPBGOGJBNHS-KBMIEXCESA-N 492.601 5.271 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)Nc1cc([C@H]2CCCCN2C(=O)C[C@H](C)c2ccccc2)[nH]n1 1821285403 CWCAKDMHWJHCBJ-KSFYIVLOSA-N 493.539 5.265 5 20 JKBD C[C@@H](CC(=O)Nc1cc([C@H]2CCCCN2C(=O)/C=C/c2ccccc2[N+](=O)[O-])[nH]n1)c1ccccc1 1822045323 SZCUOLHPYATVFV-AOVICEOCSA-N 487.560 5.217 5 20 JKBD Cc1csc(CCC(=O)N2CCCC[C@H]2c2cc(NC(=O)/C=C/c3ccccc3[N+](=O)[O-])n[nH]2)c1 1823500426 DOGLCPKQFWEFJS-CRWWQRIJSA-N 493.589 5.026 5 20 JKBD O=C([C@@H]1CCC[C@@H]2CCCC[C@H]21)N1CCC([C@H]2CCCCN2C(=O)/C=C/c2ccc([N+](=O)[O-])o2)CC1 1824277102 PWOVFIIZVSYCNB-REURGBFPSA-N 497.636 5.427 5 20 JKBD CCC[C@H]1CC[C@H](C(=O)N2CCC([C@@H]3CCCCN3C(=O)c3ccc(O)c([N+](=O)[O-])c3)CC2)CC1 1830492660 ZQBWLGMMFYIWDO-RRPUWOKSSA-N 485.625 5.140 5 20 JKBD CCCN(CC(=O)Nc1cc(Cl)ccc1Cl)C(=O)c1ccc(Br)c([N+](=O)[O-])c1 15647916 WVGHAGFXHRNTNR-UHFFFAOYSA-N 489.153 5.155 5 20 JKBD CCn1c(S[C@@H](C)C(=O)NCc2ccc(Cl)cc2)nc2cc3ccccc3cc2c1=O 18467388 HTCKEIZJDOYMMV-HNNXBMFYSA-N 451.979 5.020 5 20 JKBD CN(c1ccc(Oc2ncccc2[N+](=O)[O-])cc1)S(=O)(=O)c1ccc(Cl)c(C(F)(F)F)c1 22801298 QWUYXUFGTLHJNZ-UHFFFAOYSA-N 487.843 5.279 5 20 JKBD COc1cc([N+](=O)[O-])ccc1NC(=O)CCN1CCC(c2nc3cc(Cl)ccc3s2)CC1 25037496 OWIFQFNDVJCQGH-UHFFFAOYSA-N 474.970 5.075 5 20 JKBD Cc1c(NC(=O)[C@@H](C)Sc2nnc(-c3c[nH]c4ccccc34)n2C2CC2)cccc1[N+](=O)[O-] 26979934 PCXYSBOKIBULJV-CQSZACIVSA-N 462.535 5.097 5 20 JKBD COc1cc(C(=O)N2CCO[C@H](c3ccccc3)C2)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 27903716 ATTYRKBDWCISGQ-QHCPKHFHSA-N 468.893 5.263 5 20 JKBD CCOc1ccc(C(F)(F)F)cc1NC(=O)c1ccc(N[C@H](C)c2ccccn2)c([N+](=O)[O-])c1 108984900 ZNMSWTKDYLYXDY-CQSZACIVSA-N 474.439 5.833 5 20 JKBD O=C(C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1)N1CCC[C@@H]1c1cccc(F)c1 117569430 SPMPWRWOXKBJAG-LJQANCHMSA-N 465.447 5.333 5 20 JKBD Cc1cc(-c2cc(C(=O)N(C)Cc3cc([N+](=O)[O-])ccc3Cl)c3c(C)noc3n2)c(C)o1 248329286 DCCDFTHYHBWREB-UHFFFAOYSA-N 454.870 5.242 5 20 JKBD Cc1ccc(NC(=O)c2ccc(C(C)(C)C)c([N+](=O)[O-])c2)cc1NS(=O)(=O)c1ccccc1 478490154 WUPWZWKZAVTUNC-UHFFFAOYSA-N 467.547 5.254 5 20 JKBD Cc1csc(CNC(=O)C/C(=C\c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)n1 502816530 YYNSCMJIRNVTHD-MHWRWJLKSA-N 450.545 5.217 5 20 JKBD CCOc1cc(CN[C@H](C)c2cc(C)sc2C)ccc1OCc1cc([N+](=O)[O-])cc2c1OCOC2 509616609 HAYFWZPWKUGHBB-QGZVFWFLSA-N 498.601 5.968 5 20 JKBD COc1cc(C(=O)Nc2cc(C(F)(F)F)ccc2F)c([N+](=O)[O-])cc1OCc1cscn1 524390759 ATWILCHIBLKECH-UHFFFAOYSA-N 471.388 5.049 5 20 JKBD O=C(C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)Nc1ccc(F)cc1F 603470302 KKVSNHFEXCLYDQ-RVDMUPIBSA-N 451.454 6.052 5 20 JKBD COc1cc(C(=O)Nc2cc(-c3nc(C)no3)ccc2C)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 603987210 GGPJBBXOSTZGKT-UHFFFAOYSA-N 494.891 5.968 5 20 JKBD O=C(Nc1cc([N+](=O)[O-])ccc1Nc1cccc(C(F)(F)F)c1)c1ccc(Cn2cncn2)cc1 604232246 LOHMWIYQPDHSMH-UHFFFAOYSA-N 482.422 5.249 5 20 JKBD CN(C[C@@H]1CCCO[C@H]1c1ccccc1)C(=O)c1cc([N+](=O)[O-])ccc1Sc1ccccc1 604519686 OLOBPYZWZCNEHT-CPJSRVTESA-N 462.571 5.986 5 20 JKBD CC1CCN(c2ccc(C(=O)N3CCC([C@H]4C(=O)Nc5cc(Cl)ccc54)CC3)cc2[N+](=O)[O-])CC1 608971618 NIKQLHGZRPRPAT-XMMPIXPASA-N 496.995 5.073 5 20 JKBD C[C@H](NCc1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1)c1cccc(S(=O)(=O)N(C)C)c1 608983112 HVLUBLPJQUIHJG-INIZCTEOSA-N 489.981 5.142 5 20 JKBD O=C(CCC(=O)N1CCC(c2nnc3ccccn23)CC1)c1ccc2ccc3cccc4ccc1c2c34 727752688 VNMMDNCTZCQOOE-UHFFFAOYSA-N 486.575 5.996 5 20 JKBD C[C@H]1CN(c2ccc(NC(=O)c3cc([N+](=O)[O-])ccc3N3CCCC3)cc2C(F)(F)F)C[C@@H](C)O1 728036937 FGZBJAZVPPPXQD-IYBDPMFKSA-N 492.498 5.080 5 20 JKBD Cc1cc([N+](=O)[O-])ccc1NC(=O)COC(=O)c1ccccc1C(=O)c1ccc(Cl)c(Cl)c1 729727788 UFWIZXIMWANXND-UHFFFAOYSA-N 487.295 5.237 5 20 JKBD CC(C)(C)c1ccc([C@H]2CCCN2C(=O)COC(=O)c2csc(-c3ccc([N+](=O)[O-])cc3)n2)cc1 747954700 KLAMEUMMDWVRPR-JOCHJYFZSA-N 493.585 5.536 5 20 JKBD O=C(Nc1nc2c(s1)C[C@H](c1ccccc1)CC2)c1cc([N+](=O)[O-])ccc1Br 751110140 ZUTTUDVRXIIARW-CYBMUJFWSA-N 458.337 5.339 5 20 JKBD CCc1cc2oc(=O)cc(COC(=O)Cn3c4ccccc4c(=O)c4ccccc43)c2cc1Cl 841978223 KXZTXKIPZKSDJI-UHFFFAOYSA-N 473.912 5.220 5 20 JKBD C[C@H](Nc1ccc(-c2nc(-c3ccc(C(F)(F)F)s3)no2)cc1[N+](=O)[O-])c1ccccn1 904970856 MAHMYMBHZCEAKC-NSHDSACASA-N 461.425 5.960 5 20 JKBD COc1ccc(Oc2ccc([N+](=O)[O-])cc2C(=O)O[C@H](C)C(=O)Nc2c(C)cccc2C)cc1 915442104 MLOUJLMHUHPVRI-QGZVFWFLSA-N 464.474 5.197 5 20 JKBD O=C(OCc1nc2ccccc2c2ccccc12)[C@@H]1CCCN(C(=O)Nc2ccccc2F)C1 915564889 GICCXPIXUOXCKS-GOSISDBHSA-N 457.505 5.514 5 20 JKBD Cc1ccc(C(=O)N2C[C@@H](C)C[C@H](C)C2)cc1NC(=O)c1ccc(Br)c([N+](=O)[O-])c1 917741977 LSGASMOBPQBSBX-KBPBESRZSA-N 474.355 5.036 5 20 JKBD CC(=O)N(c1ccc(Cl)cc1)c1nc(COC(=O)/C=C\c2ccc([N+](=O)[O-])cc2)cs1 918860837 CWNZJLDDKGOKSX-WCIBSUBMSA-N 457.895 5.146 5 20 JKBD C[C@@H](SCc1nc(O)c2c(-c3ccccc3)csc2n1)C(=O)O[C@H](C)c1ccc([N+](=O)[O-])cc1 920155593 XWPDUDFGZQTPHJ-HUUCEWRRSA-N 495.582 5.898 5 20 JKBD C[C@@H](OC(=O)c1ccc(N[C@H](C)c2ccccn2)c([N+](=O)[O-])c1)C(=O)c1cccc(Cl)c1 920547579 OQNAWZXPKISCIE-HUUCEWRRSA-N 453.882 5.245 5 20 JKBD Cn1c(CC(=O)NC2(c3ccc(NC(=O)Cc4cccc([N+](=O)[O-])c4)cc3)CCC2)cc2ccccc21 1785791800 JYNYVZKWZVMDAC-UHFFFAOYSA-N 496.567 5.006 5 20 JKBD Cc1nc2ccncc2cc1C(=O)Nc1ccc(C2(NC(=O)c3cccc(F)c3[N+](=O)[O-])CCC2)cc1 1789248497 OJXVEQLYVUZNMT-UHFFFAOYSA-N 499.502 5.047 5 20 JKBD O=C(CCOc1ccc(F)cc1)NC1(c2ccc(NC(=O)c3ccc([N+](=O)[O-])cc3F)cc2)CCC1 1790620889 AIVGROMHTFITNR-UHFFFAOYSA-N 495.482 5.090 5 20 JKBD Cc1ccc(C(=O)NC2(c3ccc(NC(=O)c4cccc(Br)c4[N+](=O)[O-])cc3)CCC2)o1 1790751544 JIAZBARHZHQBFE-UHFFFAOYSA-N 498.333 5.320 5 20 JKBD O=C(Cc1cc([N+](=O)[O-])ccc1F)NC1(c2ccc(NC(=O)c3ccc4ccoc4c3)cc2)CCC1 1790893841 XRAVDCSIDOIWKX-UHFFFAOYSA-N 487.487 5.471 5 20 JKBD CN1CCCC[C@@H]1C(=O)NC1(c2ccc(NC(=O)c3cc4cc([N+](=O)[O-])ccc4s3)cc2)CCC1 1791009967 FGUCHKFXKCOQSG-OAQYLSRUSA-N 492.601 5.042 5 20 JKBD O=C(CCCn1cccc1)Nc1ccc(C2(NC(=O)CSc3ccccc3[N+](=O)[O-])CCC2)cc1 1791903413 HIKISUMMSJQAKR-UHFFFAOYSA-N 492.601 5.103 5 20 JKBD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc2c1oc1ccccc12)c1cccc(F)c1[N+](=O)[O-] 1801203587 NFPPUHBONUNMOB-BJWYYQGGSA-N 487.487 5.199 5 20 JKBD C[C@H](Cc1ccc(F)cc1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc2cc([N+](=O)[O-])ccc2s1 1801207244 QUSPENYVBDOXNR-HUJKARHJSA-N 495.576 5.079 5 20 JKBD Cc1c(C(=O)NC[C@@H]2CCN(C(=O)[C@@]3(C)CC=CCC3)[C@H]2c2cccnc2)cc(Cl)cc1[N+](=O)[O-] 1811797867 XBWNRDRPCHNABC-CZZAQMAHSA-N 496.995 5.018 5 20 JKBD CC1(C(=O)Nc2cc([C@H]3CCCCN3C(=O)c3cc4cc([N+](=O)[O-])ccc4s3)[nH]n2)CCCC1 1814531874 XOFAWTTYOJSAAA-GOSISDBHSA-N 481.578 5.419 5 20 JKBD O=C(Nc1cc([C@H]2CCCCN2C(=O)c2ccc([N+](=O)[O-])o2)[nH]n1)c1ccc(-c2ccccc2)cc1 1823287201 PPZFEGIBQYGWJW-OAQYLSRUSA-N 485.500 5.198 5 20 JKBD O=C(Cc1cccc([N+](=O)[O-])c1)N1CCC([C@@H]2CCCCN2C(=O)[C@@H]2CCC[C@H]3CCCC[C@@H]32)CC1 1828455354 AAEQRBVXVGAIRN-CYRJMILMSA-N 495.664 5.364 5 20 JKBD O=C(c1cc(F)cc(Cl)c1)N1CCC([C@@H]2CCCCN2C(=O)c2cc(F)cc([N+](=O)[O-])c2)CC1 1830616076 DOYBETREAPOVMO-QFIPXVFZSA-N 491.922 5.074 5 20 JKBD Cc1ccc(NC(=O)[C@H](OC(=O)c2nc(Cl)ccc2Cl)c2ccccc2)c([N+](=O)[O-])c1 9644924 HVCVGNLKQJPWLG-LJQANCHMSA-N 460.273 5.142 5 20 JKBD C[C@H](Sc1nnc(Nc2ccccc2F)s1)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl 10316320 QTRAXHGQMVMYOV-VIFPVBQESA-N 453.908 5.102 5 20 JKBD C[C@@H](OC(=O)c1ccc([N+](=O)[O-])cc1Cl)C(=O)Nc1c(Cl)cc(Cl)cc1Cl 11028836 WVLMAQOVRVZEGA-SSDOTTSWSA-N 452.077 5.392 5 20 JKBD COc1ccc(/C=C(\Cl)c2nc3c(C)cccc3c(=O)[nH]2)cc1OCc1ccc([N+](=O)[O-])cc1 18076478 PWMHPDSGJBMIHF-NDENLUEZSA-N 477.904 5.464 5 20 JKBD COc1ccccc1NC(=O)[C@@H](C)OC(=O)c1ccc(NCc2ccccc2Cl)c([N+](=O)[O-])c1 21452001 RQNFFCYBZRZMLZ-OAHLLOKOSA-N 483.908 5.053 5 20 JKBD CC(=O)N(c1nc(COC(=O)c2ccc(C)c([N+](=O)[O-])c2)cs1)c1c(C)cc(C)cc1C 24668979 VCKDOJADUBNASH-UHFFFAOYSA-N 453.520 5.327 5 20 JKBD CCn1c(SCc2csc(-c3cccc(OC)c3OC)n2)nc2cc3ccccc3cc2c1=O 24892130 QOQHMTPAZZATER-UHFFFAOYSA-N 489.622 6.003 5 20 JKBD CCOc1cc([N+](=O)[O-])c(C(=O)Nc2nnc(SCc3ccc(Cl)cc3)s2)cc1OC 28242703 SRGNMVRAXATBEC-UHFFFAOYSA-N 480.955 5.052 5 20 JKBD C[C@@H](NC(=O)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1)c1ccccc1OC(F)F 29138054 ALUSDGVRNMVFRV-CYBMUJFWSA-N 487.425 5.309 5 20 JKBD O=[N+]([O-])c1ccc(-c2nnc(CSc3nnc(-c4ccccc4)n3-c3ccc(F)cc3F)o2)cc1 29826124 GOQMELAMPDJERH-UHFFFAOYSA-N 492.467 5.463 5 20 JKBD Cc1nc(-c2ccc(F)cc2)sc1C(=O)N(Cc1ccccc1[N+](=O)[O-])CC(F)(F)F 59253390 DFXWBZZYNISOCK-UHFFFAOYSA-N 453.417 5.371 5 20 JKBD CSc1nc(-c2ccco2)nc(C)c1C(=O)Nc1nc(-c2ccc(C)c([N+](=O)[O-])c2)cs1 69541594 WBOJVKWCAZTATP-UHFFFAOYSA-N 467.532 5.359 5 20 JKBD COc1cc(C(=O)N2C[C@H](C)O[C@@H](c3ccccc3)C2)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 109045922 XOKQXPMZBKDCIU-UPCLLVRISA-N 482.920 5.651 5 20 JKBD C[C@@H](Sc1ncc(-c2ccccc2)n1CC(F)(F)F)C(=O)Nc1ccc([N+](=O)[O-])cc1 109622960 JQYDEQZBKHVHRQ-CYBMUJFWSA-N 450.442 5.140 5 20 JKBD C[C@@H]1CN(CC2CCN(C(=O)c3ccc(Oc4ccc(Cl)cc4[N+](=O)[O-])cc3)CC2)C[C@@H](C)O1 110460094 XZLQLXILWIYAJQ-QZTJIDSGSA-N 487.984 5.002 5 20 JKBD C[C@@H](Nc1ccc(C(=O)Nc2cc(F)ccc2OC[C@@H]2CCCO2)cc1[N+](=O)[O-])c1ccccn1 502287230 ZOKWVQDALJXIGW-APWZRJJASA-N 480.496 5.112 5 20 JKBD Cc1cc(C(=O)N(CC(=O)Nc2ccc(Cl)cc2C(F)(F)F)C(C)C)cc([N+](=O)[O-])c1 504814381 RYCSDTXVHGHLJQ-UHFFFAOYSA-N 457.836 5.065 5 20 JKBD Cc1ccc(NC(=O)C(C)C)cc1NC(=O)c1ccc(N[C@H](C)c2ccccn2)c([N+](=O)[O-])c1 507072238 QLCUWLUZGXRTMD-QGZVFWFLSA-N 461.522 5.318 5 20 JKBD C[C@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccc(NC(=O)c2ccc(Cl)cc2)cc1 507647405 AOLMQIWJDQLCJJ-AWEZNQCLSA-N 455.923 5.620 5 20 JKBD O=C(Nc1ccccc1)NC1CCN(C(=O)c2ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])cc2)CC1 509686720 RVJJNYDBBHTFIO-UHFFFAOYSA-N 494.935 5.467 5 20 JKBD COc1cc(C(=O)N[C@@H]2CCC(C)(C)c3ccccc32)c([N+](=O)[O-])cc1OCc1cscn1 520953985 JCRQOBNIMDIWJB-LJQANCHMSA-N 467.547 5.181 5 20 JKBD Cc1c(C(=O)Nc2ccc(Oc3ccc(F)cc3)c3ccncc23)nnn1-c1cccc([N+](=O)[O-])c1 524098047 UDVJTWXLDRSZHT-UHFFFAOYSA-N 484.447 5.216 5 20 JKBD Cc1nn(-c2ccc(Cl)c(Cl)c2)c(C)c1CC(=O)Nc1cc2c(cc1[N+](=O)[O-])OCCCO2 603639139 ZJFVLNWDLSZWST-UHFFFAOYSA-N 491.331 5.047 5 20 JKBD Cc1ccc(C(=O)N(C)C)cc1NC(=O)c1cc([N+](=O)[O-])ccc1Sc1ccc(Cl)cc1 603759723 FVZQONFGTOUQHR-UHFFFAOYSA-N 469.950 5.662 5 20 JKBD Cc1cccc([C@H]2CCCN2C(=O)C2CCN(c3ccc(C(F)(F)F)cc3[N+](=O)[O-])CC2)c1 604024384 KQAQLHUILBAWGB-HXUWFJFHSA-N 461.484 5.502 5 20 JKBD COc1cc(C(=O)Nc2ccc(COc3ccc(Br)cc3)cc2)c([N+](=O)[O-])cc1OC 610421901 PZWCCNZUADTQFX-UHFFFAOYSA-N 487.306 5.206 5 20 JKBD O=C(c1c2c(nc3ccccc13)/C(=C\c1cccc([N+](=O)[O-])c1)CCC2)N1CCC(C2OCCO2)CC1 726773909 NSPOCIDCCJKCEN-FXBPSFAMSA-N 499.567 5.245 5 20 JKBD CCOC(=O)N1CCC(NC(=O)CCC(=O)c2ccc3ccc4cccc5ccc2c3c45)CC1 727752241 DZUVFXYBALHJTM-UHFFFAOYSA-N 456.542 5.284 5 20 JKBD C[C@@H]1CN(c2ccc(NC(=O)N[C@H](C)c3cccc([N+](=O)[O-])c3)cc2C(F)(F)F)C[C@@H](C)O1 728130134 MAGJDJLHJVFHEX-RBSFLKMASA-N 466.460 5.110 5 20 JKBD O=C(COC(=O)Cn1ccc2cc([N+](=O)[O-])ccc21)Nc1c(Cl)c(Cl)cc(Cl)c1Cl 744622872 DWRLIVFWZGVMLF-UHFFFAOYSA-N 491.114 5.345 5 20 JKBD C[C@@H](Nc1ccc(OCc2ccccc2F)cc1)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 747458718 SEYMPYHGGCNSAM-CQSZACIVSA-N 477.414 5.771 5 20 JKBD O=C(Oc1c(Br)cccc1Br)c1csc(-c2cccc([N+](=O)[O-])c2)n1 747650449 RKWUAXPWMZLADK-UHFFFAOYSA-N 484.125 5.463 5 20 JKBD C[C@H](OC(=O)c1csc(-c2ccc([N+](=O)[O-])cc2)n1)C(=O)Nc1ccccc1Cc1ccccc1 747957298 NHKADQUAENDKMM-KRWDZBQOSA-N 487.537 5.493 5 20 JKBD O=C(c1cc([N+](=O)[O-])ccc1NCc1ccccc1)N1CCC(c2cc3ccccc3[nH]2)CC1 751114105 VOKNEYKQVHAMNO-UHFFFAOYSA-N 454.530 5.708 5 20 JKBD Cc1cc(C(=O)N2CCC[C@H]2c2nc(-c3ccc(COc4ccccc4)cc3)no2)ccc1[N+](=O)[O-] 904445303 DPYHMVISVOJUAE-DEOSSOPVSA-N 484.512 5.510 5 20 JKBD CC(C)(C)OC(=O)NCc1ccc(-c2noc(C(C)(C)c3ccc([N+](=O)[O-])cc3F)n2)cc1 904716787 OFLHPYVASQYRQO-UHFFFAOYSA-N 456.474 5.135 5 20 JKBD O=[N+]([O-])c1ccc(-c2nn(-c3ccccc3)cc2Cc2nc(COc3cccc(F)c3)no2)cc1 904721595 CAYNWCTYMIOWET-UHFFFAOYSA-N 471.448 5.139 5 20 JKBD O=C(c1cc2ccccc2c2cccnc12)N1CCN(c2c(F)c(F)c(F)c(F)c2F)CC1 915824892 IABZZPBDCFXNMN-UHFFFAOYSA-N 457.402 5.046 5 20 JKBD O=C(Nc1cc(F)c(N2CCCC2)c(F)c1)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 917768955 VQRABSXVFYBBMD-UHFFFAOYSA-N 498.452 5.347 5 20 JKBD C[C@@H](OC(=O)CCCCc1ccc(Br)cc1)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 919357114 GJKKLBVEKZVVQO-CQSZACIVSA-N 474.311 5.425 5 20 JKBD COc1cc(C(=O)Oc2ccc(Cl)c(Cl)c2)c([N+](=O)[O-])cc1OCc1cscn1 919975980 WGIKMUASLXJXPR-UHFFFAOYSA-N 455.275 5.165 5 20 JKBD Cc1ccc(CC(=O)NC2(c3ccc(NC(=O)[C@@H]4CCC(F)(F)C4)cc3)CCC2)cc1[N+](=O)[O-] 1785805348 WNHZBIXTSSOAJU-GOSISDBHSA-N 471.504 5.015 5 20 JKBD O=C(CCc1cccc([N+](=O)[O-])c1)NC1(c2ccc(NC(=O)C3CCC(F)(F)CC3)cc2)CCC1 1786242398 JWGQNELUXZMIKX-UHFFFAOYSA-N 485.531 5.487 5 20 JKBD O=C(CCc1cccc([N+](=O)[O-])c1)Nc1ccc(C2(NC(=O)c3ccoc3Cl)CCC2)cc1 1786602245 HBRYFFQFQMOGDJ-UHFFFAOYSA-N 467.909 5.222 5 20 JKBD O=C(CCCCn1cccc1)Nc1ccc(C2(NC(=O)c3cccc(F)c3[N+](=O)[O-])CCC2)cc1 1789604037 NKMBKZFWEHCORH-UHFFFAOYSA-N 478.524 5.154 5 20 JKBD O=C(Cc1cc([N+](=O)[O-])ccc1F)NC1(c2ccc(NC(=O)c3cccc4ccoc34)cc2)CCC1 1790953093 FIEMZYIYDHGIEC-UHFFFAOYSA-N 487.487 5.471 5 20 JKBD Cc1c(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)/C=C/c2ccccc2[N+](=O)[O-])[nH]c2c(Cl)cccc12 1804342701 XODNNWRGVIKLCP-UNGCYLFBSA-N 492.963 5.003 5 20 JKBD O=C(Nc1cc([C@H]2CCCCN2C(=O)c2ccc([N+](=O)[O-])[nH]2)[nH]n1)c1cc2c(Cl)cccc2s1 1818775259 STSVQUXTBMPGLD-MRXNPFEDSA-N 498.952 5.134 5 20 JKBD Cc1c(Cl)cccc1-n1c(S[C@@H](C)C(=O)Nc2ccccc2[N+](=O)[O-])nnc1-c1ccncc1 10318176 UISLBVIYBJXLFI-HNNXBMFYSA-N 494.964 5.319 5 20 JKBD CC(=O)N(c1nc(COC(=O)c2cc([N+](=O)[O-])ccc2Cl)cs1)c1ccc(C)cc1C 10665523 FWGVNCZJYGFREN-UHFFFAOYSA-N 459.911 5.363 5 20 JKBD COc1cc(C(=O)Nc2nc(-c3ccc4ccccc4c3)cs2)c([N+](=O)[O-])cc1OC(F)F 10960326 UMMXZVAHSWIDCQ-UHFFFAOYSA-N 471.441 5.734 5 20 JKBD CC(=O)c1c(C)[nH]c(C(=O)[C@H](C)OC(=O)c2ccc(Sc3nc(C)cs3)c([N+](=O)[O-])c2)c1C 15749321 VUBQMWAAYCLLQK-AWEZNQCLSA-N 487.559 5.087 5 20 JKBD CNC(=O)c1ccc(NC(=O)C/C(=C/c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)cc1 16016065 YYYOLWOPFLDJIY-JXAWBTAJSA-N 472.526 5.134 5 20 JKBD Cc1nc(S[C@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)c2cc(-c3ccccc3)sc2n1 17661174 PKBVECXORZAYEN-CYBMUJFWSA-N 475.555 6.478 5 20 JKBD COc1cccc([C@@H](CNc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])c2c[nH]c3ccccc23)c1OC 23381113 QKOYNICJMMRCJK-LJQANCHMSA-N 462.462 5.246 5 20 JKBD CN(C(=O)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1)c1nc2ccccc2s1 26963077 FZOTYPZYFSBFGJ-UHFFFAOYSA-N 464.469 5.103 5 20 JKBD C[C@@H](NC(=O)c1ccc(NC2CC2)c([N+](=O)[O-])c1)c1ccc(NC(=O)c2ccc(F)cc2)cc1 59812588 FTABRHKTZSCHNM-OAHLLOKOSA-N 462.481 5.052 5 20 JKBD O=C(OCc1nnc(-c2ccc([N+](=O)[O-])cc2)o1)c1ccccc1Cc1nc2ccccc2s1 105094529 AITCSSKGIGSLDB-UHFFFAOYSA-N 472.482 5.202 5 20 JKBD C[C@@H](Nc1ccc(C(=O)Nc2ccc(Br)cc2F)cc1[N+](=O)[O-])c1ccccn1 108751234 GFAVXNCYADIVMK-GFCCVEGCSA-N 459.275 5.317 5 20 JKBD Cc1ccc(C)c(OC2CCN(C(=O)c3ccc(N[C@H](C)c4ccccn4)c([N+](=O)[O-])c3)CC2)c1 302972288 IGVLVDLIVMTTNW-HXUWFJFHSA-N 474.561 5.463 5 20 JKBD COc1cc(C(=O)N[C@H](C)c2cccc(C(F)(F)F)c2)c([N+](=O)[O-])cc1OCc1cscn1 303047993 XLWIHSICHWUDEW-GFCCVEGCSA-N 481.452 5.149 5 20 JKBD Cc1cc(C)n(-c2ccc(NC(=O)c3ccc(N[C@H](C)c4ccccn4)c([N+](=O)[O-])c3)cc2F)n1 410055367 QIUBFXYDGKQPEZ-QGZVFWFLSA-N 474.496 5.357 5 20 JKBD O=C(C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1)N1CC=C(c2c[nH]c3ncccc23)CC1 485356664 KONDGKLGTOZKQM-UHFFFAOYSA-N 499.493 5.022 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Cl)[C@H](Nc1cccc(CN2CCCCC2=O)c1)c1ccccc1 497509088 JPVGYYICDVVNOA-RUZDIDTESA-N 492.963 5.553 5 20 JKBD C[C@H](Nc1ccc(C(=O)Nc2cnccc2Oc2ccccc2)cc1[N+](=O)[O-])c1ccccn1 499622760 SCSIIZJIIFIMGB-KRWDZBQOSA-N 455.474 5.603 5 20 JKBD C[C@@H](Nc1ccc(C(=O)Nc2ccc(OCc3ccccc3)nc2)cc1[N+](=O)[O-])c1ccccn1 518431038 RAFQAKBVLUFYGD-GOSISDBHSA-N 469.501 5.389 5 20 JKBD CCc1nc(CCNC(=O)C/C(=C\c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)cs1 522543730 LQPUGVJLOYVVJG-GHRIWEEISA-N 478.599 5.513 5 20 JKBD COc1cccc(N2CC[C@H](CNC(=O)c3cc([N+](=O)[O-])ccc3Sc3ccccc3)C2)c1 522558970 ARWOJKZAXPKYFN-GOSISDBHSA-N 463.559 5.011 5 20 JKBD Cc1cc(C(=O)N2CCC[C@@H]2C(=O)Nc2nc(-c3ccc(F)c(Cl)c3)cs2)ccc1[N+](=O)[O-] 522572540 BHMLDEZOAHHUTN-LJQANCHMSA-N 488.928 5.063 5 20 JKBD O=C(C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)Nc1ccc2c(c1)OCO2 600988108 OCPPXJHWKPBJQK-LFIBNONCSA-N 459.483 5.503 5 20 JKBD CCCN(Cc1ccc(F)cc1)C(=O)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 603527516 UMMWDFHXKQANID-UHFFFAOYSA-N 467.463 5.408 5 20 JKBD C[C@H]1CN(C(=O)c2ccc(NC(=O)c3cc([N+](=O)[O-])ccc3Sc3ccccc3)cc2)C[C@H](C)O1 604022564 WBSIPMFXDYKAKQ-ROUUACIJSA-N 491.569 5.248 5 20 JKBD O=C(c1ccc(NCc2ccccc2)c([N+](=O)[O-])c1)N1C[C@@H](C(F)(F)F)C[C@H](C(F)(F)F)C1 604262521 NAUJQDXUAVEGDV-HOTGVXAUSA-N 475.389 5.410 5 20 JKBD CCN(C[C@H]1CCOC1)C(=O)c1c2c(nc3ccccc13)/C(=C/c1cccc([N+](=O)[O-])c1)CCC2 604431430 HNUJIWWXSBCFHZ-LNKKFFRNSA-N 471.557 5.519 5 20 JKBD Cc1ccc(NC(=O)c2cccc(C(F)(F)F)c2)cc1NC(=O)c1cc2c(cc1[N+](=O)[O-])OCO2 604449361 GOLKMZKHBRQQMF-UHFFFAOYSA-N 487.390 5.155 5 20 JKBD CC(=O)NCCc1ccc(-c2csc(NC(=O)c3cc4ccccc4c4cccnc34)n2)cc1 643121500 NPDUXQYSJFJHPR-UHFFFAOYSA-N 466.566 5.442 5 20 JKBD C[C@H](Nc1ccc(C(=O)Nc2ccc(NC(=O)OC(C)(C)C)cc2)cc1[N+](=O)[O-])c1ccccn1 729403204 PYMMPCZOGZSXOB-INIZCTEOSA-N 477.521 5.762 5 20 JKBD O=C(OCc1cc(F)ccc1[N+](=O)[O-])c1cnn(-c2ncc(C(F)(F)F)cc2Cl)c1C(F)F 730966072 RNHDFOYDCNINGU-UHFFFAOYSA-N 494.735 5.281 5 20 JKBD O=C(CCc1cnn(-c2ccccc2)c1)Oc1ccc2c(-c3ccc([N+](=O)[O-])cc3)cc(=O)oc2c1 746114211 UYTLWQZUTKTFMC-UHFFFAOYSA-N 481.464 5.092 5 20 JKBD C[C@H](OC(=O)c1c[nH]c2ccc([N+](=O)[O-])cc12)C(=O)Nc1c(Cl)cc(Cl)cc1Cl 749318237 UNSHVDAUOSLUSM-QMMMGPOBSA-N 456.669 5.220 5 20 JKBD Cc1cc(-c2cc(C(=O)N(C)Cc3cc([N+](=O)[O-])ccc3Cl)c3cnn(C(C)C)c3n2)c(C)o1 824181247 PKHBNEOCQLDILF-UHFFFAOYSA-N 481.940 5.723 5 20 JKBD O=C(OCC(=O)N(Cc1ccccc1)c1nc(-c2ccc(F)cc2)cs1)c1ccc([N+](=O)[O-])s1 916600295 MTFHVDIURSORIP-UHFFFAOYSA-N 497.529 5.309 5 20 JKBD C[C@H](NC(=O)c1ccc(Br)c([N+](=O)[O-])c1)c1ccc(NC(=O)c2ccc(F)cc2)cc1 917841275 KVHRBFXFVWATTR-ZDUSSCGKSA-N 486.297 5.240 5 20 JKBD CC(=O)N(c1ccc(C)cc1)c1nc(COC(=O)[C@@H](C)Sc2ccc([N+](=O)[O-])cc2)cs1 918875487 NQGXNWLVPDAOOT-OAHLLOKOSA-N 471.560 5.268 5 20 JKBD C[C@@H](Nc1ccc(C(=O)Nc2ccc(-c3ccccc3)cc2F)cc1[N+](=O)[O-])c1ccccn1 919713536 UPZSQAQMYWIDIH-QGZVFWFLSA-N 456.477 6.221 5 20 JKBD Cc1c(C(=O)NC2(c3ccc(NC(=O)c4cscn4)cc3)CCC2)cc(Cl)cc1[N+](=O)[O-] 1787420245 RMQLHFXLVHOKPH-UHFFFAOYSA-N 470.938 5.075 5 20 JKBD O=C(NC1(c2ccc(NC(=O)c3cccc4ncsc34)cc2)CCC1)c1cccc(F)c1[N+](=O)[O-] 1789344219 AHDRPMCZCDMKBA-UHFFFAOYSA-N 490.516 5.405 5 20 JKBD O=C(/C=C/c1ccc([N+](=O)[O-])o1)NC1(c2ccc(NC(=O)c3ccc(Cl)cc3)cc2)CCC1 1790294868 ZQACXNAZVZTCHB-ZRDIBKRKSA-N 465.893 5.302 5 20 JKBD Cc1c(C(=O)Nc2ccc(C3(NC(=O)c4ccncc4)CCC3)cc2)cc(Cl)cc1[N+](=O)[O-] 1790773692 FYEFYGCSWJJMRK-UHFFFAOYSA-N 464.909 5.013 5 20 JKBD Cc1c(C(=O)Nc2ccc(C3(NC(=O)c4ccco4)CCC3)cc2)cc(Cl)cc1[N+](=O)[O-] 1790774639 UVLZEKRWJHGXLR-UHFFFAOYSA-N 453.882 5.211 5 20 JKBD O=C(CC1CCC1)Nc1ccc(C2(NC(=O)c3cccc([N+](=O)[O-])c3Br)CCC2)cc1 1792272312 PERDOZJFBBIISA-UHFFFAOYSA-N 486.366 5.295 5 20 JKBD O=C(Cc1ccc(Cl)cc1[N+](=O)[O-])N1CCCC2(CCN(C(=O)c3sccc3Cl)CC2)C1 1805485694 HHNGTLILTLYQGG-UHFFFAOYSA-N 496.416 5.051 5 20 JKBD O=C(Cc1cccc([N+](=O)[O-])c1)Nc1cc([C@H]2CCCCN2C(=O)/C=C/c2cc3ccccc3o2)[nH]n1 1814374756 DEHPHGOBRNEJTR-HRBBJJPOSA-N 499.527 5.012 5 20 JKBD O=C(CCC(F)(F)F)Nc1cc([C@@H]2CCCCN2C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)[nH]n1 1817098051 BJOCEVNCRCFZMT-HNNXBMFYSA-N 495.483 5.181 5 20 JKBD CC1=CC[C@@H](C(=O)N2CCCC[C@H]2C2CCN(C(=O)c3cc4cc([N+](=O)[O-])ccc4s3)CC2)CC1 1828352277 KBSVVBZTEQLWEW-OFNKIYASSA-N 495.645 5.789 5 20 JKBD Cc1ccc(C(=O)N2CCC([C@H]3CCCCN3C(=O)c3cc(Cl)cc([N+](=O)[O-])c3C)CC2)c(C)n1 1830734273 AXKKUYAENAAKHG-HSZRJFAPSA-N 499.011 5.116 5 20 JKBD O=C(c1ccccc1)N1CCC([C@H]2CCCCN2C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)CC1 1831060606 AHBVQEOUEZJQOK-JOCHJYFZSA-N 477.586 5.357 5 20 JKBD O=C(c1cc(Cl)ccc1F)N1CCC([C@H]2CCCCN2C(=O)/C=C/c2ccccc2[N+](=O)[O-])CC1 1832901407 SUDWCLPMXQEAON-OXHGWOFKSA-N 499.970 5.334 5 20 JKBD COc1cc(C(=O)Nc2ncc(Cc3ccccc3Cl)s2)c([N+](=O)[O-])cc1OC(F)F 10973295 VNXWRDPXBLMYOI-UHFFFAOYSA-N 469.853 5.158 5 20 JKBD COc1ccccc1NC(=O)c1cc2ccccc2cc1OCc1cc([N+](=O)[O-])cc2c1OCOC2 14736035 IEJSHYRTGHQSMN-UHFFFAOYSA-N 486.480 5.454 5 20 JKBD NC(=O)c1ccc(COC(=O)c2c3c(nc4ccccc24)/C(=C/c2cccs2)CC3)c([N+](=O)[O-])c1 16760525 VXIMWJBUXNOTIY-NTCAYCPXSA-N 485.521 5.147 5 20 JKBD Cc1nc2cc(C(=O)O[C@H](C)c3nnc(-c4ccc([N+](=O)[O-])cc4)o3)ccc2n1-c1ccccc1 17702567 FNXUUNMQNMGELO-OAHLLOKOSA-N 469.457 5.210 5 20 JKBD C[C@@H](OC(=O)c1ccccc1SCc1ccco1)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl 18410874 JTPOTDVIEOVMFS-CYBMUJFWSA-N 460.895 5.318 5 20 JKBD Cc1c(NC(=O)[C@H](C)Sc2nnc(-c3ccc(C(C)(C)C)cc3)n2C)cccc1[N+](=O)[O-] 23998441 GTHUAMNIQHVEHA-HNNXBMFYSA-N 453.568 5.116 5 20 JKBD CC(=O)Nc1ccc(CC(=O)Nc2cc([N+](=O)[O-])ccc2Nc2cccc(C(F)(F)F)c2)cc1 25727303 JWHGEWXTOBCYQN-UHFFFAOYSA-N 472.423 5.497 5 20 JKBD CC(C)(C)NS(=O)(=O)c1cccc(NC(=O)c2cc([N+](=O)[O-])ccc2Sc2ccccc2)c1 25939327 VTVMRSZGBWTXOG-UHFFFAOYSA-N 485.587 5.075 5 20 JKBD O=C(CCSc1nnc(-c2ccccc2F)n1Cc1ccccc1)Nc1ccc([N+](=O)[O-])cc1 26231891 SCRZBOZPBUSQJE-UHFFFAOYSA-N 477.521 5.162 5 20 JKBD C[C@@H]1Oc2ccc(NC(=O)c3ccc(Sc4nc5ccccc5s4)c([N+](=O)[O-])c3)cc2NC1=O 29993793 FNCIYEFVRLLKQN-LBPRGKRZSA-N 492.538 5.327 5 20 JKBD O=C(Nc1cccc(C(=O)N(Cc2ccccc2[N+](=O)[O-])CC(F)(F)F)c1)C1CCCCC1 59253385 XHPXYMWTAWOZKJ-UHFFFAOYSA-N 463.456 5.318 5 20 JKBD O=C(CSCc1coc(-c2ccccc2)n1)Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1 59272352 MFXMORSFTSBSFP-UHFFFAOYSA-N 452.517 5.245 5 20 JKBD CC(=O)Nc1cc(NC(=O)c2ccccc2NC(=O)c2ccc([N+](=O)[O-])cc2Cl)ccc1C 108653306 OMMYPRLTFJDLIF-UHFFFAOYSA-N 466.881 5.020 5 20 JKBD Cc1csc(Sc2ccc(C(=O)Nc3c(C)cccc3-c3nc(C(C)C)no3)cc2[N+](=O)[O-])n1 110641440 ZDJUCYIBVGRHHA-UHFFFAOYSA-N 495.586 6.245 5 20 JKBD CSc1ccc([N+](=O)[O-])c(C(=O)N[C@@H](c2ccccc2)c2ccc(Br)cc2)c1 302950633 AKZOSQNWKVRVLE-FQEVSTJZSA-N 457.349 5.599 5 20 JKBD COc1ccc(Oc2ccc([N+](=O)[O-])cc2C(=O)Nc2ccc(N3CCSCC3)cc2C)cc1 497334044 MQJOHVPMIHSXEI-UHFFFAOYSA-N 479.558 5.510 5 20 JKBD O=C(Nc1cc(C(F)(F)F)cnc1O)c1ccc(Sc2nc3ccccc3s2)c([N+](=O)[O-])c1 499533973 RWWXQMRKHKCAPQ-UHFFFAOYSA-N 492.460 5.727 5 20 JKBD CCOc1ccc(C(=O)Nc2nc(-c3sccc3Br)cs2)cc1[N+](=O)[O-] 500737051 JOWVXVSFKDRGKR-UHFFFAOYSA-N 454.327 5.193 5 20 JKBD COc1cc(C(=O)N(c2ccccc2)c2nc(C)cs2)c([N+](=O)[O-])cc1OCc1cscn1 512355121 QWDDAAUHGSYHQM-UHFFFAOYSA-N 482.543 5.382 5 20 JKBD Cc1c(NC(=O)c2ccccc2)cccc1NC(=O)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-] 515742147 FQAZSSJYFBFYMO-UHFFFAOYSA-N 473.407 5.349 5 20 JKBD CCc1nc(CNC(=O)c2ccccc2Sc2ccc(C(F)(F)F)cc2[N+](=O)[O-])cs1 520759444 AATIWGZTSMNRPI-UHFFFAOYSA-N 467.494 5.714 5 20 JKBD Cc1ccc2c(c1)CC[C@@H]2NC(=O)c1ccc(C(=O)N[C@@H]2CCc3cc(C)ccc32)cc1[N+](=O)[O-] 524353946 SUDRPVWOLFCNIU-RPBOFIJWSA-N 469.541 5.046 5 20 JKBD Cc1cc(O[C@H](C)c2ccccc2)ccc1NC(=O)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-] 524381574 JJUNIIQJVIDWDT-MRXNPFEDSA-N 474.435 6.237 5 20 JKBD CC(=O)N1CCc2c(sc3nc(-c4cc5c(cc4[N+](=O)[O-])OCO5)cc(-c4ccc(C)cc4)c23)C1 543444058 BYUUANXIZGGAOO-UHFFFAOYSA-N 487.537 5.480 5 20 JKBD CC1CCN(c2ccc(C(=O)N3C[C@@H](C(F)(F)F)C[C@@H](C(F)(F)F)C3)cc2[N+](=O)[O-])CC1 604258284 WXQIATFCDYGJDD-GASCZTMLSA-N 467.410 5.034 5 20 JKBD CN(C[C@@H]1CCCO[C@H]1c1ccccc1)C(=O)c1ccc(NCc2ccccc2Cl)c([N+](=O)[O-])c1 604519121 MENLUPBBMXXWTO-NVQXNPDNSA-N 493.991 6.100 5 20 JKBD CC(C)C[C@@H](NC(=O)C(=O)Nc1cc([N+](=O)[O-])ccc1OC(F)F)c1cccc(C(F)(F)F)c1 608865388 KUHGWIUVBBPUAX-OAHLLOKOSA-N 489.397 5.057 5 20 JKBD Cc1c(Br)cccc1NC(=O)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 608872678 YCVLCHBUZJCALS-UHFFFAOYSA-N 486.288 5.540 5 20 JKBD CCOCCOc1ccc(Cl)cc1NC(=O)c1ccc(N2CCC(C)CC2)c([N+](=O)[O-])c1 609103492 FVWDWJIZAWWIMU-UHFFFAOYSA-N 461.946 5.152 5 20 JKBD COc1ccc(OC)c(NC(=S)/C(=C(/O)c2cccc([N+](=O)[O-])c2)[n+]2ccc(C(C)(C)C)cc2)c1 726570857 SCPXXWVRNJVEAJ-UHFFFAOYSA-O 494.593 5.520 5 20 JKBD C[C@H]1Cc2cc([N+](=O)[O-])ccc2N1C(=O)c1cc(-c2ccncc2)nc2ccc(Br)cc12 728809727 LJNHYBJLARAQEK-AWEZNQCLSA-N 489.329 5.559 5 20 JKBD COc1ccc(NC(=O)c2c(NC(=O)c3ccc([N+](=O)[O-])c(OC)c3)sc3c2CCCC3)cc1 751052427 RYJTXERNEINPNE-UHFFFAOYSA-N 481.530 5.057 5 20 JKBD CC(C)N(Cc1nnc(-c2cccc([N+](=O)[O-])c2)o1)C(=O)CC(c1ccccc1)c1ccccc1 864244841 QNSSYQSOWALGDF-UHFFFAOYSA-N 470.529 5.604 5 20 JKBD COc1ccccc1-c1noc(C/C(=C\c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)n1 904270202 FBKFMBHKTYVNIR-SAPNQHFASA-N 470.510 6.046 5 20 JKBD COc1cccc([C@H](CNC(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)c2c[nH]c3ccccc23)c1OC 915307511 FTOGJQCHCYCETL-IBGZPJMESA-N 494.935 5.700 5 20 JKBD C[C@@H](NC(=S)/C(=C(/O)c1ccc([N+](=O)[O-])cc1)[n+]1ccc2c(c1)CCCC2)c1ccccc1 917611844 FUIXIHSQQGBZAI-GOSISDBHSA-O 460.579 5.323 5 20 JKBD O=C(CC12C[C@@H]3C[C@H](C1)CC(C(=O)Nc1ccc([N+](=O)[O-])cc1)(C3)C2)Nc1ccc([N+](=O)[O-])cc1 919985675 SALUJPKVBBYWIN-PHBHNISSSA-N 478.505 5.057 5 20 JKBD O=C(NC1(c2ccc(NC(=O)c3c(Cl)cccc3Cl)cc2)CCC1)c1ccc([N+](=O)[O-])[nH]1 1790227047 YSGRAWGMVUKUBI-UHFFFAOYSA-N 473.316 5.291 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)c3ccc([N+](=O)[O-])[nH]3)CCC2)cc1)c1cccc(C(F)(F)F)c1 1790281537 KSSXBBJTESNWKI-UHFFFAOYSA-N 472.423 5.003 5 20 JKBD O=C(/C=C/c1ccc([N+](=O)[O-])o1)NC1(c2ccc(NC(=O)c3ccc4ccoc4c3)cc2)CCC1 1790893302 LLIUJCBBHJJEQG-CSKARUKUSA-N 471.469 5.395 5 20 JKBD O=C(Cc1ccc([N+](=O)[O-])cc1F)Nc1ccc(C2(NC(=O)C3CCC(F)(F)CC3)CCC2)cc1 1791182116 IQCINROIXADCPF-UHFFFAOYSA-N 489.494 5.236 5 20 JKBD Cc1c(C(=O)NC2(c3ccc(NC(=O)[C@H](C)n4ccnc4C)cc3)CCC2)cc(Cl)cc1[N+](=O)[O-] 1791932848 ZMQLOKTYDYUQAU-INIZCTEOSA-N 495.967 5.070 5 20 JKBD COc1cc(C(=O)Nc2ccc(C3(NC(=O)CCC=C(C)C)CCC3)cc2)ccc1[N+](=O)[O-] 1792165862 RVHLQJYXDLIRBR-UHFFFAOYSA-N 451.523 5.098 5 20 JKBD Cc1c(C(=O)N2CC[C@H](CNC(=O)/C=C/C3CCCC3)[C@@H]2c2cccnc2)cc(Cl)cc1[N+](=O)[O-] 1808492213 CHBBAIMXAHYZBT-LEQOFBOASA-N 496.995 5.018 5 20 JKBD CC1=CC[C@@H](C(=O)Nc2cc([C@H]3CCCCN3C(=O)c3cc4cc([N+](=O)[O-])ccc4s3)[nH]n2)CC1 1818809338 XTKIOBOWRJYYNM-OXQOHEQNSA-N 493.589 5.585 5 20 JKBD CC(C)[C@@H](C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2ccc([N+](=O)[O-])cc2F)n[nH]1)c1ccccc1 1821049643 UTKBQCFQRQRSTF-ISKFKSNPSA-N 493.539 5.203 5 20 JKBD O=C(c1c(Cl)cccc1Cl)N1CCC([C@@H]2CCCCN2C(=O)c2ccc([N+](=O)[O-])o2)CC1 1823613947 OGJNHKKAUSBYEM-KRWDZBQOSA-N 480.348 5.042 5 20 JKBD O=C(/C=C/c1ccccc1[N+](=O)[O-])N1CCC([C@H]2CCCCN2C(=O)c2ccc(Cl)cc2F)CC1 1823900023 CDDKCLJLLZRNTG-OXHGWOFKSA-N 499.970 5.334 5 20 JKBD Cc1cc(CCCC(=O)N2CCCC[C@@H]2C2CCN(C(=O)[C@@]3(C)C[C@H]3C)CC2)c([N+](=O)[O-])cc1F 1824369880 AVSVQAVWXJZFFQ-PSNDRKBRSA-N 487.616 5.031 5 20 JKBD O=C(/C=C/c1cccs1)N1CCC([C@@H]2CCCCN2C(=O)/C=C/c2ccccc2[N+](=O)[O-])CC1 1832906968 KHLQBVUQVOYCPN-ARVPNPJDSA-N 479.602 5.003 5 20 JKBD O=C(CSc1nc(-c2cccs2)c(-c2cccs2)[nH]1)Nc1cc([N+](=O)[O-])ccc1F 9099380 RJAYHEZUPOQMFE-UHFFFAOYSA-N 460.537 5.645 5 20 JKBD C[C@@H](OC(=O)c1cc2c(s1)-c1ccccc1OC2)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 9816857 SRAYIMMRMXGOPM-LLVKDONJSA-N 492.431 5.419 5 20 JKBD Cc1cccc(Nc2nnc(S[C@@H](C)C(=O)Nc3ccc([N+](=O)[O-])cc3C(F)(F)F)s2)c1C 10211196 BAOYMIPMYXQWDB-LBPRGKRZSA-N 497.524 5.945 5 20 JKBD CC(=O)N(c1cccc(C(F)(F)F)c1)c1nc(COc2cc(C)ccc2[N+](=O)[O-])cs1 10346761 ZIJJAGBLMDIHRJ-UHFFFAOYSA-N 451.426 5.642 5 20 JKBD CCOc1ccc(-n2c(SCC(=O)Nc3c(C)cccc3[N+](=O)[O-])nnc2-c2ccccc2)cc1 11197213 QQYOZSXXMDWRLF-UHFFFAOYSA-N 489.557 5.280 5 20 JKBD Cc1cc([N+](=O)[O-])ccc1NC(=O)CSc1nnc(SCc2ccc(C(C)C)cc2)s1 23597938 NNDUEWYUGBMWMI-UHFFFAOYSA-N 474.633 5.901 5 20 JKBD Cc1cc([N+](=O)[O-])ccc1NC(=O)CSC1=N/C(=C\c2ccccc2)C(=O)N1c1ccc(F)cc1 23646962 LEBLABULCQRJDU-HMAPJEAMSA-N 490.516 5.158 5 20 JKBD CCOc1cc(C(=O)Nc2nnc(SCc3ccc(Cl)cc3)s2)c([N+](=O)[O-])cc1OC 26768035 RQIPDLYHDMERGY-UHFFFAOYSA-N 480.955 5.052 5 20 JKBD CCOc1cc([N+](=O)[O-])c(C(=O)O[C@H](C)C(=O)N2c3ccccc3Sc3ccccc32)cc1OC 27402007 VKYYBMCOJPVIEJ-OAHLLOKOSA-N 494.525 5.377 5 20 JKBD C[C@@H](c1cccs1)N(C)C(=O)C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1 30049912 YJZZQZACQJKGOF-IYWFSZBXSA-N 463.584 6.416 5 20 JKBD Cc1ccc(C(=O)Nc2ccc(C)c([N+](=O)[O-])c2)cc1NC(=O)c1ccc(Br)cc1 31809479 XYXYSSYAQWZUML-UHFFFAOYSA-N 468.307 5.479 5 20 JKBD O=C(CSc1ccc(C(F)(F)F)cc1[N+](=O)[O-])Nc1ccc(C(=O)Nc2nccs2)cc1 105953088 XBIYWDLVABJHMJ-UHFFFAOYSA-N 482.465 5.053 5 20 JKBD C[C@H](Nc1ccc(C(=O)Nc2cc(C(F)(F)F)ccc2N2CCCC2)cc1[N+](=O)[O-])c1ccccn1 108790332 HZYSXGQVGTYRPI-INIZCTEOSA-N 499.493 6.034 5 20 JKBD CCn1c(CCNC(=O)c2ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])c(OC)c2)nc2ccccc21 195724407 SMAGTESMXJGZPL-UHFFFAOYSA-N 494.935 5.391 5 20 JKBD O=[N+]([O-])c1cc(Cl)ccc1Oc1ccc(CNCc2ccccc2CN2CCOCC2)cc1 215644963 WAEOGHGGRUTAFP-UHFFFAOYSA-N 467.953 5.163 5 20 JKBD Cc1nn(Cc2ccccc2)c(C)c1CNCc1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1 216500640 YDPHPNICCPRJCW-UHFFFAOYSA-N 492.583 5.599 5 20 JKBD CCCN(Cc1nc(O)c2ccc(Cl)cc2n1)C(=O)c1ccc(C(C)(C)C)c([N+](=O)[O-])c1 301946616 UXLCJTZRRIOPON-UHFFFAOYSA-N 456.930 5.247 5 20 JKBD C[C@@H](Nc1ccc(C(=O)N[C@@H](c2ccccc2)c2nccs2)cc1[N+](=O)[O-])c1ccccn1 303231197 VPXNCEMCPJOADP-ZHRRBRCNSA-N 459.531 5.139 5 20 JKBD COc1cc(CN(C)C(=O)c2cc(SC)c(OC)cc2[N+](=O)[O-])ccc1OCc1ccccc1 481989213 FROMIWCGLDLSIB-UHFFFAOYSA-N 482.558 5.185 5 20 JKBD COc1ccccc1NC(=O)c1ccc(NC(=O)c2csc(-c3ccc([N+](=O)[O-])cc3)n2)cc1 496590073 FXWKINYUSDLLEW-UHFFFAOYSA-N 474.498 5.232 5 20 JKBD COc1ccc([C@@H]2CCN(C(=O)Cc3cn(-c4ccccc4)nc3-c3ccc([N+](=O)[O-])cc3)C2)cc1 504931884 BDEQUOOVQSVCJS-JOCHJYFZSA-N 482.540 5.015 5 20 JKBD CCCOc1cc(NC(=O)N2CC[C@H](c3ccc(OC)cc3)C2)c([N+](=O)[O-])cc1OCCC 506147759 IJASRZYYPANTAA-SFHVURJKSA-N 457.527 5.202 5 20 JKBD Cn1cc(C(=O)Nc2ncc(Cc3ccc(Br)cc3)s2)c(-c2ccc([N+](=O)[O-])cc2)n1 507146449 WPJAWQPOBSSYSX-UHFFFAOYSA-N 498.362 5.057 5 20 JKBD COc1cc(CNC(=O)c2ccc(N[C@H](C)c3ccccn3)c([N+](=O)[O-])c2)ccc1OC1CCCC1 507346849 CPDDHDBXHLMHBF-GOSISDBHSA-N 490.560 5.423 5 20 JKBD COc1ccc(-c2[nH]c3ccccc3c2CCC(=O)Nc2cccc([N+](=O)[O-])c2C)c(OC)c1 508807973 WWDYUIFAZVEDGA-UHFFFAOYSA-N 459.502 5.640 5 20 JKBD COc1cc([C@@H](C)NC(=O)N(Cc2ccc([N+](=O)[O-])cc2)C(C)C)ccc1OCc1ccncc1 509784291 VPGMYRNYBGBTGR-LJQANCHMSA-N 478.549 5.259 5 20 JKBD O=C(Cc1sc(-c2ccccc2)nc1-c1cccs1)Nc1cc2c(cc1[N+](=O)[O-])OCCCO2 514720863 BLODJTGNBKFTNO-UHFFFAOYSA-N 493.566 5.789 5 20 JKBD CNS(=O)(=O)c1cccc([C@@H](C)NCc2ccc(Oc3cc(C)ccc3C(C)C)c([N+](=O)[O-])c2)c1 518783616 PHDAXEHCAQPTLH-LJQANCHMSA-N 497.617 5.578 5 20 JKBD CCc1nc2cc(NC(=O)C3CCN(c4ccc(C(F)(F)F)cc4[N+](=O)[O-])CC3)ccc2o1 604176454 XHTMNXVAJHFURP-UHFFFAOYSA-N 462.428 5.172 5 20 JKBD COc1cc(C(=O)Nc2ccc(N[C@@H](C)c3ccccc3)c(Cl)c2)c([N+](=O)[O-])cc1OC 609071985 AJTDKXMCPOWPDV-AWEZNQCLSA-N 455.898 5.691 5 20 JKBD O=C(C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)OCc1ccnc(Cl)c1 726199466 FXUYUJHUTLQBJK-BOPFTXTBSA-N 465.918 5.927 5 20 JKBD C[C@@H]1CN(c2ccc(NC(=O)c3cc([N+](=O)[O-])ccc3N3CCCC3)cc2C(F)(F)F)C[C@@H](C)O1 728036934 FGZBJAZVPPPXQD-HZPDHXFCSA-N 492.498 5.080 5 20 JKBD CN(C(=O)c1ccc(Br)c([N+](=O)[O-])c1)[C@H]1CCSc2ccc(Br)cc21 728844791 BUEJPHADABVAEI-AWEZNQCLSA-N 486.185 5.429 5 20 JKBD CC(C)N(Cc1nnc(-c2cccc([N+](=O)[O-])c2)o1)C(=O)CCc1nc2cc(Cl)ccc2s1 730451712 XWWHKBPRYRWZEZ-UHFFFAOYSA-N 485.953 5.278 5 20 JKBD C[C@@H](SCc1nc(O)c2c(-c3ccccc3)csc2n1)C(=O)Nc1cc([N+](=O)[O-])ccc1F 767217012 UYSCOFPHTBGRAB-GFCCVEGCSA-N 484.534 5.372 5 20 JKBD O=[N+]([O-])c1c(-c2nc(-c3ccc(OCc4cccnc4)cc3)no2)ccnc1-c1ccccc1 904467735 MFLCRINDSPHKDB-UHFFFAOYSA-N 451.442 5.348 5 20 JKBD O=C1[C@H](c2ccccc2)N(Cc2ccccc2)C(=O)N1Cc1c(Br)cccc1[N+](=O)[O-] 915668722 NNWNODOQQCFJIR-NRFANRHFSA-N 480.318 5.063 5 20 JKBD O=C(CCc1ccc(Cl)s1)Oc1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2Cl)cc1 916035599 CMWZKFXKGXXDJA-UHFFFAOYSA-N 465.314 5.754 5 20 JKBD O=C(OCC(=O)N1CCC[C@H]1c1ccc(Cl)c(Cl)c1)c1ccc(Cl)c([N+](=O)[O-])c1 918849191 AQFCVOKNACVIDO-INIZCTEOSA-N 457.697 5.076 5 20 JKBD Cc1cc(C(=O)O[C@@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2ccccc2)nn1C(C)(C)C 919352256 OQQYGXVMGIEWLZ-HXUWFJFHSA-N 470.913 5.045 5 20 JKBD C[C@H](Nc1ccc(C(=O)Nc2cccc(COc3ccccc3)c2)cc1[N+](=O)[O-])c1ccccn1 919755007 GNWOWBKXTHJGER-IBGZPJMESA-N 468.513 5.994 5 20 JKBD O=C(CSc1ccccc1)Nc1ccc(C2(NC(=O)c3ccc([N+](=O)[O-])cc3F)CCC2)cc1 1787774918 UVHWWNJBWFBVOX-UHFFFAOYSA-N 479.533 5.274 5 20 JKBD CC(F)(F)C(C)(C)C(=O)NC1(c2ccc(NC(=O)c3ccc([N+](=O)[O-])cc3F)cc2)CCC1 1790622855 ULKOHJIJVGKFLO-UHFFFAOYSA-N 463.456 5.163 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)[C@H]3C[C@H]3C3CC3)CCC2)cc1)c1cccc(Br)c1[N+](=O)[O-] 1790751404 BVNCYNYDVHCBTL-OALUTQOASA-N 498.377 5.151 5 20 JKBD C[C@@H](Cc1ccncc1)C(=O)NC1(c2ccc(NC(=O)/C=C/c3ccccc3[N+](=O)[O-])cc2)CCC1 1792317436 PNZFVVDVPMFANZ-BESKYLIDSA-N 484.556 5.016 5 20 JKBD COc1ccc(Cl)c(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cc4cc([N+](=O)[O-])ccc4s2)C3)c1 1803511095 YVXOYSWFAWZBPK-MUJYYYPQSA-N 499.976 5.037 5 20 JKBD Cc1cc2cccc(C(=O)Nc3cc([C@H]4CCCCN4C(=O)/C=C/c4ccccc4[N+](=O)[O-])[nH]n3)c2[nH]1 1818653941 PVQURUYHXKOVJB-MDRMPYQZSA-N 498.543 5.127 5 20 JKBD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2ccc([N+](=O)[O-])cc2F)[nH]n1)[C@@H]1CCC[C@@H]2CCCC[C@H]21 1818931162 JGKZDUUPDXAYKY-YIKPNSEUSA-N 497.571 5.369 5 20 JKBD O=C([C@@H]1CCC[C@@H]2CCCC[C@H]21)N1CCC([C@@H]2CCCCN2C(=O)Cc2cccc([N+](=O)[O-])c2)CC1 1823679553 OSZXQUNBTHBQDV-FDBFMKMFSA-N 495.664 5.364 5 20 JKBD CCCCC[C@H](C)C(=O)N1CCC([C@H]2CCCCN2C(=O)Cc2ccc([N+](=O)[O-])cc2F)CC1 1831294850 RZASYPQCPWWKHA-YADARESESA-N 475.605 5.113 5 20 JKBD C[C@@H](C(=O)N1CCC([C@H]2CCCCN2C(=O)/C=C/c2ccccc2[N+](=O)[O-])CC1)c1cccs1 1832903422 BWBSFMRDSALGIS-RJHNZLOYSA-N 481.618 5.093 5 20 JKBD C/C(=C\c1ccc(C)o1)C(=O)N1CCC([C@H]2CCCCN2C(=O)/C=C/c2ccccc2[N+](=O)[O-])CC1 1832905617 ZLAHJUSLQGRXEB-PGTXPIOFSA-N 491.588 5.233 5 20 JKBD C[C@@H](OC(=O)c1c(Cl)cccc1Cl)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 11112421 WHQNUDAWRUYNGI-MRVPVSSYSA-N 451.184 5.104 5 20 JKBD CC1CCN(c2ccc([N+](=O)[O-])cc2C(=O)O[C@@H](C)C(=O)Nc2ccccc2C(F)(F)F)CC1 16925222 JVBMSSXQKICEAY-HNNXBMFYSA-N 479.455 5.034 5 20 JKBD C[C@@H](Sc1nnc(-c2cccs2)n1-c1ccccc1)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 17652170 YRRKYYWUWHLAOD-CQSZACIVSA-N 476.543 5.807 5 20 JKBD C[C@@H](Sc1nnc(-c2ccncc2)n1Cc1ccccc1)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 17664430 GNPOLQJYDMMLMZ-MRXNPFEDSA-N 485.529 5.200 5 20 JKBD C[C@H](NC(=O)CSc1nc2cc3ccccc3cc2c(=O)n1C)c1cccc2ccccc12 19417878 VUHQWDJGMJJHKE-KRWDZBQOSA-N 453.567 5.209 5 20 JKBD Cc1c(NC(=O)[C@@H](C)OC(=O)c2cccc3c(=O)c(C)c(-c4ccccc4)oc23)cccc1[N+](=O)[O-] 21844375 PSADUJTYDLYESM-QGZVFWFLSA-N 486.480 5.169 5 20 JKBD CCCc1ccc([C@@H](NC(=O)CCCn2c(=O)oc3cc([N+](=O)[O-])ccc32)c2cccs2)cc1 24136447 GPZLCYNXERZCRH-XMMPIXPASA-N 479.558 5.203 5 20 JKBD COc1cc2c(cc1OC)[C@@H](c1cccs1)N(C(=O)c1cc(SC)ccc1[N+](=O)[O-])CC2 24475948 GZXRUEQWLRIJAA-QFIPXVFZSA-N 470.572 5.183 5 20 JKBD O=C(Nc1ccccc1C(=O)OCc1csc(-c2ccco2)n1)c1ccc([N+](=O)[O-])cc1Cl 25524086 RAGOVPJEDBCTDG-UHFFFAOYSA-N 483.889 5.574 5 20 JKBD CSc1ccc(C(=O)c2ccccc2C(=O)Nc2ccc(NC(=O)NC3CC3)cc2)cc1[N+](=O)[O-] 26920041 IUXACKIYIOBWBI-UHFFFAOYSA-N 490.541 5.084 5 20 JKBD c1ccc(-c2ccc(-c3ccnc4c3ccc3c(-c5ccc(-c6ccccc6)cc5)ccnc34)cc2)cc1 95830656 PPDYSQZUNLCLKO-UHFFFAOYSA-N 484.602 9.451 5 20 JKBD Cc1c(CN2CCSCC2)cccc1NC(=O)c1ccc(N[C@@H](C)c2ccccn2)c([N+](=O)[O-])c1 109499006 WGDHWDYVDIHREB-IBGZPJMESA-N 491.617 5.272 5 20 JKBD O=C(Cn1c2ccccc2c(=O)c2ccccc21)NCc1ccc(-c2ccc3c(c2)CCO3)cc1 489882832 KTSPKSAYIMQWAR-UHFFFAOYSA-N 460.533 5.073 5 20 JKBD CN(C(=O)Cn1ccc2cc([N+](=O)[O-])ccc21)[C@H]1CCSc2ccc(Br)cc21 504604541 GCPUNKSWSLIENQ-SFHVURJKSA-N 460.353 5.008 5 20 JKBD CC(C)NC(=O)c1ccc(NCc2ccccc2-c2ccc(Cn3ccnc3)cc2)c([N+](=O)[O-])c1 505608284 IIVHUXFJNVILHY-UHFFFAOYSA-N 469.545 5.257 5 20 JKBD COc1ccc(COCc2cccc(NC(=O)N(Cc3ccc([N+](=O)[O-])cc3)C(C)C)c2)cc1 509198939 WDWMQNBZWADNCM-UHFFFAOYSA-N 463.534 5.763 5 20 JKBD C[C@H]1CCCN(c2ccc(C(=O)Nc3cc(Cl)ccc3OC[C@H]3CCCO3)cc2[N+](=O)[O-])C1 509790311 XHHLAROJGUEUEP-QFBILLFUSA-N 473.957 5.295 5 20 JKBD COC(=O)c1cc(NC(=O)c2cc([N+](=O)[O-])ccc2Sc2ccc(Cl)cc2)c(F)cc1F 514985833 SVPRQDGKMCRDIE-UHFFFAOYSA-N 478.860 5.717 5 20 JKBD CC(C)c1noc(-c2ccc(NC(=O)c3ccc(N[C@H](C)c4ccccn4)c([N+](=O)[O-])c3)cc2)n1 524375226 DXNMLCKBLSNJEP-MRXNPFEDSA-N 472.505 5.589 5 20 JKBD C[C@H]1CCCN(c2ccc(C(=O)N3CCC[C@@H](c4nc5ccccc5s4)C3)cc2[N+](=O)[O-])C1 603437194 BZRQOZAWBLKXPP-PKOBYXMFSA-N 464.591 5.461 5 20 JKBD CCN(Cc1nc(O)c2ccccc2n1)C(=O)c1cc([N+](=O)[O-])ccc1Sc1ccc(Cl)cc1 603463935 NIAYLTRDJVBTLU-UHFFFAOYSA-N 494.960 5.711 5 20 JKBD CN(Cc1ccc(Br)s1)C(=O)CSc1ccc(C(F)(F)F)cc1[N+](=O)[O-] 603821180 DGSBAGAVZPCUQD-UHFFFAOYSA-N 469.304 5.188 5 20 JKBD COc1ccccc1OCC(=O)Nc1cccc(NC(=O)c2cc3cc([N+](=O)[O-])ccc3s2)c1 603937422 SKJYATVEYLHFAS-UHFFFAOYSA-N 477.498 5.088 5 20 JKBD Cc1nc(NC(=O)c2ccc(N[C@@H](C)c3ccccn3)c([N+](=O)[O-])c2)sc1Cc1ccccc1 604309673 UXMRQBXGHRYGOS-INIZCTEOSA-N 473.558 5.771 5 20 JKBD CCN(C[C@@H]1CCOC1)C(=O)c1ccccc1Sc1ccc(C(F)(F)F)cc1[N+](=O)[O-] 604440344 PBEVCSOIQZOZOG-AWEZNQCLSA-N 454.470 5.263 5 20 JKBD O=C(Nc1ccccc1OCc1ncc(-c2cccc(Cl)c2)o1)c1ccc([N+](=O)[O-])cc1Cl 608851180 ULQGTTFNXPSFKX-UHFFFAOYSA-N 484.295 6.388 5 20 JKBD O=C(c1cc([N+](=O)[O-])ccc1NCc1ccccc1)N1CCC(c2nc(-c3ccccc3)no2)CC1 609141917 RISNZNBJSHAFHJ-UHFFFAOYSA-N 483.528 5.277 5 20 JKBD CN1CCN(C(=O)C/C(=C/c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)[C@H](c2ccccc2)C1 612591600 DJDCEZKCIUALJJ-BDPRQDHOSA-N 498.608 5.651 5 20 JKBD Cc1cc[n+](/C(C(=S)Nc2ccccc2-c2ccccc2)=C(/O)c2cccc([N+](=O)[O-])c2)cc1 725762551 BBEORZXTEMBWKB-UHFFFAOYSA-O 468.558 6.181 5 20 JKBD Cc1c(NC(=O)[C@@H](C)OC(=O)c2csc(-c3cccc(C(F)(F)F)c3)n2)cccc1[N+](=O)[O-] 725994308 GLYVRCNNDDNVOU-GFCCVEGCSA-N 479.436 5.230 5 20 JKBD O=C(c1csc(-c2ccc([N+](=O)[O-])cc2)n1)N(CC1CC1)c1ccc(Cl)c([N+](=O)[O-])c1 728165018 GLYNTGWDQQMPEG-UHFFFAOYSA-N 458.883 5.337 5 20 JKBD COc1ccc(-c2ccc(/C=C(/Cl)c3nc(=O)c4cc(Cl)ccc4[nH]3)o2)c([N+](=O)[O-])c1 730582550 DRHVOFMPJHPFBB-CXUHLZMHSA-N 458.257 5.490 5 20 JKBD Cc1nn(Cc2ccc(C(=O)O[C@H](C)c3nnc(-c4cccc(Cl)c4)o3)cc2)c(C)c1[N+](=O)[O-] 746206900 VXGUUIKNNRISFE-OAHLLOKOSA-N 481.896 5.078 5 20 JKBD O=C(CCCn1c(=O)oc2cc([N+](=O)[O-])ccc21)Oc1ccccc1-c1nc2ccccc2s1 747572949 HZSSLSDSMSFTMN-UHFFFAOYSA-N 475.482 5.165 5 20 JKBD O=C(OCC(=O)N1Cc2ccccc2[C@H](c2ccccc2)C1)c1csc(-c2cccc([N+](=O)[O-])c2)n1 747954507 ACGPDOHWONTHTN-QHCPKHFHSA-N 499.548 5.049 5 20 JKBD Cc1cc(SC2CCCCC2)ccc1NC(=O)c1cc([N+](=O)[O-])ccc1N1CCOCC1 748194830 LGGREPYODSJYSU-UHFFFAOYSA-N 455.580 5.417 5 20 JKBD Cc1cccc(C(C)C)c1NC(=O)[C@@H](C)OC(=O)c1ccc(N2CCC(C)CC2)c([N+](=O)[O-])c1 783302037 RVPGTMXNJIJKBR-LJQANCHMSA-N 467.566 5.447 5 20 JKBD COc1ccc(CNc2cccc(N=S(C)(C)=O)c2)cc1OCc1ccc([N+](=O)[O-])cc1 864015024 AQLPXEHIZWSLNE-UHFFFAOYSA-N 455.536 5.154 5 20 JKBD CCOc1cc([N+](=O)[O-])c(C(=O)O[C@@H](C)c2cccc(NC(=O)c3ccccc3)c2)cc1OC 918907278 XTQCYGWPLHEYSJ-INIZCTEOSA-N 464.474 5.172 5 20 JKBD O=C(CSc1ccccc1[N+](=O)[O-])NC1(c2ccc(NC(=O)C3CCCC3)cc2)CCC1 1787612508 XGJLUSIQRZEQTP-UHFFFAOYSA-N 453.564 5.011 5 20 JKBD COc1cc(C(=O)Nc2ccc(C3(NC(=O)c4cccc5ccoc45)CCC3)cc2)ccc1[N+](=O)[O-] 1792166039 XPVASMMFIKIQHW-UHFFFAOYSA-N 485.496 5.411 5 20 JKBD CC(C)[C@@H](C(=O)N1CCC2(CCCN(C(=O)c3ccc([N+](=O)[O-])o3)C2)CC1)c1ccc(Cl)cc1 1804654491 WVJAOSJANSYZPN-JOCHJYFZSA-N 487.984 5.126 5 20 JKBD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2cc(F)cc([N+](=O)[O-])c2)[nH]n1)[C@@H]1CCC[C@@H]2CCCC[C@H]21 1818930900 DJGQUISICRNXDT-NCDVDMNXSA-N 497.571 5.369 5 20 JKBD CC(C)[C@@H](C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2ccc([N+](=O)[O-])[nH]2)[nH]n1)c1ccc(Cl)cc1 1821856796 IDBHKUSHEQEVND-SIKLNZKXSA-N 498.971 5.045 5 20 JKBD Cc1ccc(CC(=O)N2CCCC[C@@H]2c2cc(NC(=O)C[C@@H](C)c3ccccc3)n[nH]2)cc1[N+](=O)[O-] 1822045146 NSJBGRHVWDNECX-AUSIDOKSSA-N 489.576 5.055 5 20 JKBD O=C(/C=C/C1CCCCC1)N1CCC([C@@H]2CCCCN2C(=O)c2cccc(F)c2[N+](=O)[O-])CC1 1830620777 GEHTWFMNQVSVMX-OTOIZHKDSA-N 471.573 5.104 5 20 JKBD CCCn1c(SCC(=O)Nc2ccc(OCC)cc2[N+](=O)[O-])nnc1-c1ccc(Cl)cc1 9139767 ZSUBIXZWPYRLTG-UHFFFAOYSA-N 475.958 5.046 5 20 JKBD CSc1ccc(C(=O)c2ccccc2C(=O)OCC(=O)Nc2ccccc2C(C)C)cc1[N+](=O)[O-] 10155152 BSJMNSTZRGHXFG-UHFFFAOYSA-N 492.553 5.467 5 20 JKBD O=C(c1ccccc1)c1ccc(Sc2nnc(-c3ccc(OC(F)F)cc3)o2)c([N+](=O)[O-])c1 20667528 BIULFKGODMVNEH-UHFFFAOYSA-N 469.425 5.628 5 20 JKBD Cc1nn(Cc2ccc(C(=O)Nc3cccc(NC(=O)c4cccs4)c3)cc2)c(C)c1[N+](=O)[O-] 24028872 LPZDIAFIFAIXNZ-UHFFFAOYSA-N 475.530 5.023 5 20 JKBD COc1ccc(-c2nnc(SCC(=O)Nc3ccc(OC)cc3[N+](=O)[O-])n2C2CCCCC2)cc1 28606474 JRVCKSBSJKLHOW-UHFFFAOYSA-N 497.577 5.107 5 20 JKBD C[C@@H](Sc1nc2ccc([N+](=O)[O-])cc2s1)C(=O)Nc1c(Cl)cc(Cl)cc1Cl 28673249 KDVIHASTMUNEAX-SSDOTTSWSA-N 462.767 6.284 5 20 JKBD CCn1c(Sc2ccc(C(=O)c3ccccc3)cc2[N+](=O)[O-])nnc1-c1ccccc1OC 249695019 QFICIFLKXUWGKZ-UHFFFAOYSA-N 460.515 5.264 5 20 JKBD COc1cc(C(=O)Nc2cc(NC(C)=O)ccc2C)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 479069161 IIJLKEOAOZXNTH-UHFFFAOYSA-N 469.881 5.568 5 20 JKBD Cc1ccccc1-c1nnc(SCC(=O)Nc2ccc(Cl)cc2[N+](=O)[O-])n1Cc1ccco1 479696256 XUUOKTVJBKSBKZ-UHFFFAOYSA-N 483.937 5.187 5 20 JKBD O=C(N[C@@H]1CCN2CCC[C@H]2C1)c1c2c(nc3ccccc13)/C(=C\c1ccc([N+](=O)[O-])cc1)CCC2 485014286 OGIAHCLCNJPCAE-GGXSWMBQSA-N 482.584 5.377 5 20 JKBD Cc1c(C(=O)Nc2ccc(F)cc2-c2ccc(Cl)cc2)nnn1-c1cccc([N+](=O)[O-])c1 485677307 LRMFETMYSDOHFF-UHFFFAOYSA-N 451.845 5.196 5 20 JKBD NC(=O)Cc1ccc(NC(=O)c2c3c(nc4ccccc24)/C(=C\c2ccc([N+](=O)[O-])cc2)CCC3)cc1 497379815 AVLXMMGLSHRVSB-SILNSSARSA-N 492.535 5.300 5 20 JKBD C[C@@H](NC(=O)C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)c1ccc2c(c1)CC(=O)N2 501049671 CHOGKTAPOXOWIT-SDLDRHLBSA-N 498.564 5.507 5 20 JKBD O=C(CCc1nnc(-c2ccccc2)o1)Nc1cc([N+](=O)[O-])ccc1Nc1cccc(C(F)(F)F)c1 506831671 ZRRAZSVAFYSKQD-UHFFFAOYSA-N 497.433 5.979 5 20 JKBD Cn1cc(C(=O)Nc2ncc(Cc3cccc(Cl)c3Cl)s2)c(-c2ccc([N+](=O)[O-])cc2)n1 507248509 WCKOKUBOUONSCN-UHFFFAOYSA-N 488.356 5.602 5 20 JKBD COc1cc(CN[C@@H](c2ccc(F)cc2)[C@@H]2CCCO2)ccc1OCc1ccc([N+](=O)[O-])cc1 507910627 ABMGSKQTDPVOPG-AHWVRZQESA-N 466.509 5.331 5 20 JKBD Cc1cc(C)n(-c2ccc(CNC(=O)N(Cc3ccc([N+](=O)[O-])cc3)C(C)C)c(C(F)(F)F)c2)n1 509749465 ZIIYCBCDHKYPPJ-UHFFFAOYSA-N 489.498 5.536 5 20 JKBD Cc1cc(C)n(-c2ccc(CNCc3ccc(Oc4ccc(Cl)cc4[N+](=O)[O-])cc3)cn2)n1 512857406 VGDNFDISFDGOKR-UHFFFAOYSA-N 463.925 5.528 5 20 JKBD CN(Cc1cccnc1)C(=O)c1c2c(nc3ccccc13)/C(=C/c1ccc([N+](=O)[O-])cc1)CCC2 514963063 RWNGDTXGEOEDLU-LTGZKZEYSA-N 464.525 5.687 5 20 JKBD O=[N+]([O-])c1ccc(-c2nn(-c3ccccc3)cc2CNC[C@H]2CCN(c3ccccc3)C2)cc1 518769755 ZNDKWJVRVPWGJU-OAQYLSRUSA-N 453.546 5.064 5 20 JKBD COc1ccc(CN[C@H](c2ccccc2)c2ccccn2)cc1OCc1ccc([N+](=O)[O-])cc1 518771737 VGXHLUCIUVPLJF-HHHXNRCGSA-N 455.514 5.457 5 20 JKBD COc1cc(OCC(=O)N(Cc2ccccc2)c2nc3c(C)cccc3s2)ccc1[N+](=O)[O-] 553254492 DWUJGYSVWSMHCW-UHFFFAOYSA-N 463.515 5.134 5 20 JKBD O=C(Nc1ccc(Cl)cc1)N1CCCN(C(=O)c2cc3ccccc3c3cccnc23)CC1 588097002 YHOUZCPHJLEZOW-UHFFFAOYSA-N 458.949 5.421 5 20 JKBD CN(Cc1ccc(F)cc1F)C(=O)C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1 603263227 GTCMARXLNFCBTC-PDGQHHTCSA-N 479.508 6.072 5 20 JKBD C[C@@H](NC(=O)N(CCO)Cc1cccc(OCc2ccccc2Cl)c1)c1cccc([N+](=O)[O-])c1 604126144 JNGIAKPONWTOTB-GOSISDBHSA-N 483.952 5.092 5 20 JKBD COc1ccc([C@H](NCc2ccc(-c3ccc([N+](=O)[O-])cc3Br)o2)C2CC2)cc1 608835909 XSSCBDDGSWROKB-JOCHJYFZSA-N 457.324 5.867 5 20 JKBD COc1ccc(C[C@@H](N[C@@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2ccccc2)cc1OC 608980573 DOCYHNSLSFHUCN-KSFYIVLOSA-N 483.952 5.166 5 20 JKBD COc1ccc([N+](=O)[O-])cc1NC(=O)[C@@H](C)Nc1ccc(OCc2cccc(F)c2)cc1C 728066792 STNPPWMHDBEGOU-MRXNPFEDSA-N 453.470 5.069 5 20 JKBD CC(C)(C(=O)Oc1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2Cl)cc1)c1ccc(F)cc1 728456857 QCWQPZKLNQURNR-UHFFFAOYSA-N 456.857 5.523 5 20 JKBD O=C(O[C@H](c1ccccc1)c1ccncc1)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 744964835 BXMCLUHAYHBDNQ-HSZRJFAPSA-N 485.462 5.558 5 20 JKBD CCn1c(/C(Cl)=C\c2ccc(C(C)C)c([N+](=O)[O-])c2)nc2cc(S(=O)(=O)N(C)C)ccc21 747126202 BUGRVXKXTMEIEC-WOJGMQOQSA-N 476.986 5.075 5 20 JKBD Cc1c(C(=O)Nc2ncc(Cc3cccc(C(F)(F)F)c3)s2)cc([N+](=O)[O-])c(C)c1[N+](=O)[O-] 748619910 YYVWNIMXAFLQSH-UHFFFAOYSA-N 480.424 5.438 5 20 JKBD CC(=O)N(c1nc(COC(=O)c2c[nH]c3cc([N+](=O)[O-])ccc23)cs1)c1cccc(C)c1C 756766986 GEHZLKBTFJJVPM-UHFFFAOYSA-N 464.503 5.191 5 20 JKBD O=C(Nc1cc(OCC(F)(F)F)cc(OCC(F)(F)F)c1)c1cc([N+](=O)[O-])ccc1Cl 790052206 FDKWUOHRQSBBFJ-UHFFFAOYSA-N 472.725 5.383 5 20 JKBD Cc1ccc2sc(-c3ccc(N(C(=O)c4cc([N+](=O)[O-])cn4C)C4=NCCCS4)cc3)nc2c1 826861719 YIYBJVDDTPESRZ-UHFFFAOYSA-N 491.598 5.658 5 20 JKBD Cc1ccc(C)c(C(=O)c2ccccc2C(=O)O[C@@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c1 844149099 LWGFKHNUQXTQGS-INIZCTEOSA-N 480.904 5.280 5 20 JKBD Cc1csc(Sc2ccc([N+](=O)[O-])cc2C(=O)OCc2nnc(-c3ccccc3Cl)o2)n1 849132396 ILEMPZQXKMEZKU-UHFFFAOYSA-N 488.934 5.571 5 20 JKBD COc1ccc(CNc2ccc([C@@H](O)C(F)(F)F)cc2)cc1OCc1ccc([N+](=O)[O-])cc1 864043195 HMRKEFXLPRFTFB-JOCHJYFZSA-N 462.424 5.390 5 20 JKBD O=C(Nc1ccccc1C(=O)Nc1cccc(OC[C@H]2CCCO2)c1)c1ccc([N+](=O)[O-])cc1Cl 913153552 ZBDDKMRGWJCSTQ-LJQANCHMSA-N 495.919 5.311 5 20 JKBD C[C@@H](NC(=O)c1cc([N+](=O)[O-])ccc1N1CCCC1)c1ccc(NC(=O)c2ccc(F)cc2)cc1 918677914 VMZUHTYXPWEDKJ-QGZVFWFLSA-N 476.508 5.077 5 20 JKBD C[C@@H](Cc1cccc(F)c1)C(=O)Oc1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2Cl)cc1 920999220 OSQXSVSCWZDFEJ-AWEZNQCLSA-N 456.857 5.424 5 20 JKBD Cc1ccc(C(=O)Nc2ccc(C3(NC(=O)c4cc(Br)ccc4[N+](=O)[O-])CCC3)cc2)o1 1786494060 XJPPFKLFMZPKAO-UHFFFAOYSA-N 498.333 5.320 5 20 JKBD O=C(/C=C/c1ccccc1[N+](=O)[O-])NC1(c2ccc(NC(=O)Cc3ccsc3)cc2)CCC1 1788243047 ZAEVBDNXIZGRRY-IZZDOVSWSA-N 461.543 5.046 5 20 JKBD O=C(NC1(c2ccc(NC(=O)c3ccc([N+](=O)[O-])[nH]3)cc2)CCC1)c1ccc2c(Cl)ccnc2c1 1790186740 LICZPAQRQKJHSF-UHFFFAOYSA-N 489.919 5.186 5 20 JKBD COc1cc(CC(=O)Nc2ccc(C3(NC(=O)[C@@H](C)c4cccs4)CCC3)cc2)ccc1[N+](=O)[O-] 1790479219 FEDUSJBRQZNPBK-KRWDZBQOSA-N 493.585 5.145 5 20 JKBD CN(C)c1ccc([N+](=O)[O-])c(C(=O)NC2(c3ccc(NC(=O)C[C@@H]4C[C@@H]5CC[C@H]4C5)cc3)CCC2)c1 1791322849 BANSRXWYUWLXDK-AABGKKOBSA-N 490.604 5.235 5 20 JKBD COc1cc(C(=O)Nc2ccc(C3(NC(=O)CCCC(F)(F)F)CCC3)cc2)ccc1[N+](=O)[O-] 1792163673 LEINNHTXOLQHNI-UHFFFAOYSA-N 479.455 5.084 5 20 JKBD COc1cscc1C(=O)NC1(c2ccc(NC(=O)/C=C/c3ccccc3[N+](=O)[O-])cc2)CCC1 1792318000 YVEIJSJYQRZVEO-KPKJPENVSA-N 477.542 5.126 5 20 JKBD O=C(Cc1cccc([N+](=O)[O-])c1)NC1(c2ccc(NC(=O)[C@]3(F)CCCC=C3F)cc2)CCC1 1792375015 LMHUOGOUXLFDAF-VWLOTQADSA-N 469.488 5.017 5 20 JKBD CC(C)(C)c1cc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2ccc([N+](=O)[O-])o2)C3)cc(C(C)(C)C)c1 1800556659 YTMOLXPDGVONLW-WKCHPHFGSA-N 481.593 5.348 5 20 JKBD O=C(Nc1cc([C@@H]2CCCCN2C(=O)Cc2cccs2)[nH]n1)c1cc2cc([N+](=O)[O-])ccc2s1 1821609703 KUFQPMJTJLWNBZ-SFHVURJKSA-N 495.586 5.143 5 20 JKBD CC(C)(C)CCCCCC(=O)Nc1cc([C@H]2CCCCN2C(=O)/C=C/c2ccc([N+](=O)[O-])o2)[nH]n1 1822114065 LDJZLJUEXFUGNH-VSFZPWCASA-N 485.585 5.613 5 20 JKBD CCC[C@@H](C(=O)N1CCCC[C@@H]1C1CCN(C(=O)/C=C/c2ccccc2[N+](=O)[O-])CC1)n1cccc1 1827635149 XOAJCCATBIPENW-YHXKCMJXSA-N 492.620 5.071 5 20 JKBD CC(C)(C)c1ccc(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)/C=C/c3ccc([N+](=O)[O-])o3)CC2)s1 1827903604 ALDFPIIHJUNMBW-WUTDNEBXSA-N 499.633 5.494 5 20 JKBD CC(C)CCC(=O)N1CCC([C@H]2CCCCN2C(=O)c2cc(Br)ccc2[N+](=O)[O-])CC1 1830564066 NTSKIIORMCMSBD-HXUWFJFHSA-N 494.430 5.027 5 20 JKBD CC[C@H]1CC[C@H](C(=O)N2CCC([C@@H]3CCCCN3C(=O)c3cc([N+](=O)[O-])c(O)cc3C)CC2)CC1 1830790271 RLKXVYBQUOARIP-RRPUWOKSSA-N 485.625 5.059 5 20 JKBD O=C(C1CCCC1)N1CCC([C@H]2CCCCN2C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)CC1 1831060876 KIXCUKJVFXUHRI-OAQYLSRUSA-N 469.607 5.233 5 20 JKBD CCCCC[C@@H](C)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2ccc([N+](=O)[O-])c(OC)c2)CC1 1831467788 AMRFMQHZEZFIJY-DENIHFKCSA-N 473.614 5.053 5 20 JKBD COc1ccc(NC(=O)[C@H](C)OC(=O)c2ccc(-c3nc4ccccc4s3)s2)c([N+](=O)[O-])c1 21248438 NEGFCGYDGANGBV-LBPRGKRZSA-N 483.527 5.126 5 20 JKBD Cn1c(SCC(=O)Nc2ccc(Cl)cc2C(F)(F)F)nc2cc3ccccc3cc2c1=O 22252750 CHNBJJPSFOQXQP-UHFFFAOYSA-N 477.895 5.490 5 20 JKBD O=C(CCCNc1ccc([N+](=O)[O-])cc1)Oc1ccc(NC(=O)c2ccccc2Br)cc1 29472396 LJYZBZYNDPOOFS-UHFFFAOYSA-N 498.333 5.407 5 20 JKBD O=C(Cn1c2ccccc2c(=O)c2ccccc21)NCc1ccc(CN2CCc3ccccc32)cc1 31818693 ASVPQXXKDBWCOH-UHFFFAOYSA-N 473.576 5.034 5 20 JKBD CCN(C(=O)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1)c1ccc(F)c(F)c1 105908392 BTNHGMNPMSORJD-UHFFFAOYSA-N 457.399 5.161 5 20 JKBD Cc1noc(C)c1NC(=O)c1c2c(nc3ccccc13)/C(=C\c1cccc([N+](=O)[O-])c1)CCC2 499450756 FCIPFLQEQNGJCM-AQTBWJFISA-N 454.486 5.877 5 20 JKBD C[C@H](Nc1ccc(C(=O)N2CCCc3cc(Br)cc(F)c32)cc1[N+](=O)[O-])c1ccccn1 502778419 DULCNIXWRIIKSU-AWEZNQCLSA-N 499.340 5.658 5 20 JKBD CCN(C(=O)c1ccc([N+](=O)[O-])c(OC)c1)[C@H]1CCSc2ccc(Br)cc21 504633862 IKLQCFNOBDFVTH-HNNXBMFYSA-N 451.342 5.065 5 20 JKBD C[C@H](Nc1ccc(C(=O)N(C)Cc2ccc(OC(F)F)cc2)cc1[N+](=O)[O-])c1ccccn1 505999675 LNPURDHPVINCOK-HNNXBMFYSA-N 456.449 5.037 5 20 JKBD O=C(C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)NCCc1cn2c(n1)CCCC2 506844763 OLDOTYQMFVJGPD-CYVLTUHYSA-N 487.585 5.027 5 20 JKBD CC(C)CCSc1ccc(C(=O)N2CCCN(C(=O)c3ccc(Cl)cc3)CC2)cc1[N+](=O)[O-] 508011373 CUYPCGRGHHLBPV-UHFFFAOYSA-N 490.025 5.375 5 20 JKBD Cc1sc(NC(=O)Cc2csc(-c3ccc4c(c3)OCO4)n2)nc1-c1cccc([N+](=O)[O-])c1 508949095 NMOPHWBJNKRENX-UHFFFAOYSA-N 480.527 5.060 5 20 JKBD O=C(Nc1ccc(-c2nnco2)cc1)c1ccc(Sc2nc3ccccc3s2)c([N+](=O)[O-])c1 511983600 NZEOTJOHOOMIDD-UHFFFAOYSA-N 475.511 5.658 5 20 JKBD CCCCc1c(C)nc2nc(S[C@H](C)C(=O)Nc3ccc([N+](=O)[O-])cc3C(F)(F)F)nn2c1C 515565103 CTRUWGIGCRWMBP-CYBMUJFWSA-N 496.515 5.130 5 20 JKBD CCOc1cccc([C@@H](C)N[C@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2ccccc2)c1 520140177 FATDXKJMRDZIOT-MWTRTKDXSA-N 453.926 5.678 5 20 JKBD Cc1csc(Sc2ccc(C(=O)Nc3ccnn3CCc3ccccc3)cc2[N+](=O)[O-])n1 523676032 NCCXYWQNIMTQKV-UHFFFAOYSA-N 465.560 5.202 5 20 JKBD Cc1ccc(NC(=O)[C@H](Sc2nnc(-c3sc(C)nc3C)o2)c2ccccc2)c([N+](=O)[O-])c1 600864656 PYVYPIRYVKAFAJ-LJQANCHMSA-N 481.559 5.499 5 20 JKBD CSc1ccc(C(=O)Nc2ccc(S(=O)(=O)Nc3ccc(Cl)cc3)cc2)cc1[N+](=O)[O-] 603492764 JBCQOWJVVWKDKT-UHFFFAOYSA-N 477.951 5.023 5 20 JKBD COc1cc2c(cc1OC)[C@H](c1ccccc1)N(C(=O)c1cc3cc([N+](=O)[O-])ccc3o1)CC2 603730470 FMXVSDATIXCMRK-VWLOTQADSA-N 458.470 5.146 5 20 JKBD O=C(Nc1cc(C(=O)N2CCCCC2)ccc1Cl)c1cc([N+](=O)[O-])ccc1Sc1ccccc1 608872247 AYKFZFQEIXOPHM-UHFFFAOYSA-N 495.988 6.278 5 20 JKBD O=C(Nc1nc2c(s1)C(=O)CCC2)c1ccccc1Sc1ccc(C(F)(F)F)cc1[N+](=O)[O-] 609021379 PAPFSFAMUPEMEC-UHFFFAOYSA-N 493.488 5.993 5 20 JKBD Cc1c(NC(=O)c2ccc(N3CCC[C@@H](C)C3)c([N+](=O)[O-])c2)cccc1OCC(F)(F)F 609022526 QENNMFVJLIIBES-CQSZACIVSA-N 451.445 5.333 5 20 JKBD O=C(OCc1nc2ccccc2c2ccccc12)c1occc1CS(=O)(=O)c1ccccc1 798089218 MZAIXFJWYZDBDX-UHFFFAOYSA-N 457.507 5.312 5 20 JKBD CC(=O)N[C@@H](CC(=O)Nc1cc(Cl)c([N+](=O)[O-])cc1OCc1ccccc1)c1cccs1 822219432 FGKHDRWSDGUHII-SFHVURJKSA-N 473.938 5.095 5 20 JKBD CN(C(=O)c1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2Cl)cc1Cl)C1CCCCC1 917754654 FYFLBFBLZUUVHJ-UHFFFAOYSA-N 450.322 5.559 5 20 JKBD CCCN(CCC)C(=O)c1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2N2CCCCC2)cc1 918643077 IGLPXKJEHFJRON-UHFFFAOYSA-N 452.555 5.100 5 20 JKBD O=C(Nc1ccc(OC(=O)C(F)(F)c2ccc(F)cc2)cc1)c1cc([N+](=O)[O-])ccc1Cl 920838533 DWTLZJCNBMMHOD-UHFFFAOYSA-N 464.783 5.337 5 20 JKBD CCOC(=O)c1sc(NC(=O)c2cc([N+](=O)[O-])ccc2Cl)c(C(=O)OC(C)(C)C)c1C 933553139 GRSXTCBEVUAOKW-UHFFFAOYSA-N 468.915 5.002 5 20 JKBD O=C(/C=C/c1ccc([N+](=O)[O-])o1)Nc1ccc(C2(NC(=O)CCc3ccccc3F)CCC2)cc1 1786208044 HFPCHTZQHKBJRB-SDNWHVSQSA-N 477.492 5.107 5 20 JKBD O=C(CCCC(F)(F)F)Nc1ccc(C2(NC(=O)c3cc([N+](=O)[O-])cc4c3OCC4)CCC2)cc1 1786622770 JEPAAVBHOFBALD-UHFFFAOYSA-N 491.466 5.010 5 20 JKBD Cc1ccc(CC(=O)NC2(c3ccc(NC(=O)c4ccc5cnccc5c4)cc3)CCC2)cc1[N+](=O)[O-] 1789014686 MSCZYYMCOANHAQ-UHFFFAOYSA-N 494.551 5.442 5 20 JKBD COc1cc(CC(=O)Nc2ccc(C3(NC(=O)CCCC(F)(F)F)CCC3)cc2)ccc1[N+](=O)[O-] 1790477736 ARDMJNRGPWTCNG-UHFFFAOYSA-N 493.482 5.013 5 20 JKBD Cc1ccc2oc(C(=O)NC3(c4ccc(NC(=O)Cc5ccc(C)c([N+](=O)[O-])c5)cc4)CCC3)cc2n1 1790526385 TYWUHAMJWIJDDI-UHFFFAOYSA-N 498.539 5.343 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)c3ccc(-c4ncc[nH]4)cc3)CCC2)cc1)c1cc(F)cc([N+](=O)[O-])c1 1790699403 GKJUHANBQZUGDU-UHFFFAOYSA-N 499.502 5.186 5 20 JKBD O=C(NC1(c2ccc(NC(=O)c3ccc(F)cc3C(F)(F)F)cc2)CCC1)c1ccc([N+](=O)[O-])[nH]1 1792171515 RSNYISNPNYIKLB-UHFFFAOYSA-N 490.413 5.142 5 20 JKBD O=C(NC1(c2ccc(NC(=O)[C@H]3CC[C@H](C(F)(F)F)CC3)cc2)CCC1)c1ccc([N+](=O)[O-])[nH]1 1792242294 FIKNHSZYOKTEHV-KOMQPUFPSA-N 478.471 5.039 5 20 JKBD CSCC(C)(C)C(=O)N1CCCC2(CCN(C(=O)c3cc4cc([N+](=O)[O-])ccc4s3)CC2)C1 1806096422 XCBWWWNXWQSVIT-UHFFFAOYSA-N 489.663 5.044 5 20 JKBD Cc1oc(C(C)(C)C)cc1C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cc(F)cc([N+](=O)[O-])c2)[nH]n1 1816462782 FGDRDMAGEODIDG-FQEVSTJZSA-N 497.527 5.276 5 20 JKBD C[C@@H](C(=O)Nc1cc([C@H]2CCCCN2C(=O)Cc2ccc(Cl)cc2[N+](=O)[O-])[nH]n1)c1ccccc1 1823492494 XLLHWQCEPLWTGB-IIBYNOLFSA-N 495.967 5.010 5 20 JKBD O=C(c1cc2sccc2s1)N1CCC([C@@H]2CCCCN2C(=O)c2cc(O)cc([N+](=O)[O-])c2)CC1 1830703954 BBSJHARAAIJJOF-IBGZPJMESA-N 499.614 5.124 5 20 JKBD O=C(CSc1ccccc1[N+](=O)[O-])N1CCC([C@H]2CCCCN2C(=O)C23CCC(CC2)CC3)CC1 1832391735 JSBWSZZPCZPIFP-QHMKHHNBSA-N 499.677 5.277 5 20 JKBD O=C(Cc1ccc2ccccc2c1)N1CC2(CCCN2C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)C1 1845738717 PVCFBFALUUXHOY-UHFFFAOYSA-N 485.565 5.022 5 20 JKBD CC(C)CCn1c(SCC(=O)Nc2ccc([N+](=O)[O-])cc2C(F)(F)F)nc2ccccc2c1=O 11209502 ICJNAPFQAHIYBC-UHFFFAOYSA-N 494.495 5.100 5 20 JKBD COc1cc(NC(=O)c2ccc(Nc3ccccc3)c([N+](=O)[O-])c2)ccc1NC(=O)c1cccnc1 26240876 QDTCHEUYQRGACS-UHFFFAOYSA-N 483.484 5.247 5 20 JKBD Cc1nc2c(cnn2C(C)C)cc1C(=O)Oc1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2Cl)cc1 27151802 VTRVIBBHWJOQRM-UHFFFAOYSA-N 493.907 5.354 5 20 JKBD Cc1cccc(C)c1NS(=O)(=O)c1ccc(NC(=O)[C@@H](C)Sc2ccc([N+](=O)[O-])cc2)cc1 108239164 LLAARCXRYIPEPW-QGZVFWFLSA-N 485.587 5.132 5 20 JKBD CCC(C)(C)NC(=O)c1ccc(NC(=O)c2ccc(N[C@H](C)c3ccccn3)c([N+](=O)[O-])c2)cc1 108883033 SLJGSZHQXAYJCJ-QGZVFWFLSA-N 475.549 5.334 5 20 JKBD Cc1sc2ncn(NC(=O)c3ccc(C(C)(C)C)c([N+](=O)[O-])c3)c(=O)c2c1-c1ccccc1 218330311 IPOQOOJVSPMTNY-UHFFFAOYSA-N 462.531 5.023 5 20 JKBD CCOC(=O)c1sc(-c2ccccc2)cc1NC(=O)c1cc(SC)c(OC)cc1[N+](=O)[O-] 482101894 HARCPYUAUMKRTK-UHFFFAOYSA-N 472.544 5.483 5 20 JKBD Cn1cnnc1Sc1ccc(C(=O)Nc2ccc(OCc3ccccc3Cl)cc2)cc1[N+](=O)[O-] 490626802 AMPNYVOHDVVLAL-UHFFFAOYSA-N 495.948 5.359 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Br)[C@@H](c1ccccc1)N1CCO[C@H](c2ccccc2)C1 492515806 PYDFQZIKKCDGCG-XZOQPEGZSA-N 496.361 5.111 5 20 JKBD Cc1ccc(-n2c(S[C@H](C)c3nnc(-c4ccc([N+](=O)[O-])cc4)o3)nnc2-c2ccncc2)cc1C 501269181 NYJWMYSRXJPMCA-QGZVFWFLSA-N 499.556 5.758 5 20 JKBD C[C@H](NCC1(c2c(F)cccc2F)CCCC1)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 501984149 NZDUKZBGCPGVSK-ZDUSSCGKSA-N 471.426 5.320 5 20 JKBD CCn1c(SCC(=O)N2c3ccc([N+](=O)[O-])cc3C[C@H]2C)nnc1-c1ccc(Cl)cc1Cl 504311016 COVQXFVMHNVVLA-GFCCVEGCSA-N 492.388 5.250 5 20 JKBD C[C@@H](Nc1ccc(C(=O)Nc2ccccc2NC(=O)N2CCCC2)cc1[N+](=O)[O-])c1ccccn1 508949058 IGQQCFVLGMCNDX-QGZVFWFLSA-N 474.521 5.043 5 20 JKBD COc1cc(C(=O)N[C@H](C)c2ccc(C(F)(F)F)cc2)c([N+](=O)[O-])cc1OCc1cscn1 509917101 SVCLDJWPKXRGPC-GFCCVEGCSA-N 481.452 5.149 5 20 JKBD Cc1ccc(NC(=O)c2ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])cc2)c(OCC(=O)N(C)C)c1 510027301 DPYCXHJARGCUPY-UHFFFAOYSA-N 483.908 5.068 5 20 JKBD CC[C@@H](C)c1ccc([C@H](NC(=O)c2cc(OC)c(OC)cc2[N+](=O)[O-])c2cccs2)cc1 512408165 BPTTWKOIYUGLCE-CMJOXMDJSA-N 454.548 5.706 5 20 JKBD C[C@H](NCc1ccc(Oc2ccc(F)cc2)c([N+](=O)[O-])c1)c1cccc(OCc2ccccn2)c1 513125781 JTPOXTNZDDKZLB-IBGZPJMESA-N 473.504 6.351 5 20 JKBD CCOc1ccc(OCC)c(NC(=O)C2CCN(c3ccc(C(F)(F)F)cc3[N+](=O)[O-])CC2)c1 515323444 OZGLHKUVQKOCMX-UHFFFAOYSA-N 481.471 5.266 5 20 JKBD CC(=O)Nc1cc(NC(=O)c2ccc(N[C@H](C)c3ccccn3)c([N+](=O)[O-])c2)ccc1Cl 516370853 SDBZLZUMAPLNJF-CYBMUJFWSA-N 453.886 5.027 5 20 JKBD COc1cc(C(=O)Nc2cc(C)nn2-c2ccc(Cl)cc2)c([N+](=O)[O-])cc1OCc1cscn1 516700189 XZIXUCPQVLOUCD-UHFFFAOYSA-N 499.936 5.039 5 20 JKBD COc1cc(C(=O)N(CCc2ccccc2)c2nc3ccccc3s2)c([N+](=O)[O-])cc1OC(F)F 517306623 SUFUBAUYEJVIED-UHFFFAOYSA-N 499.495 5.704 5 20 JKBD O=C(Cc1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1)N1C[C@H]2CCCN2c2ccccc21 518287464 HCVNNAYZGJGXQS-XMMPIXPASA-N 479.540 5.006 5 20 JKBD O=C(CNCc1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1)Nc1ccc(F)c(F)c1F 518771662 JOTPWWSIKURNQY-UHFFFAOYSA-N 465.815 5.186 5 20 JKBD C[C@H](S[C@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F)c1ccc(OC(F)(F)F)cc1 518917016 NWPCICUTWYRVKX-WDEREUQCSA-N 482.402 6.334 5 20 JKBD Cc1ccc(Sc2ccc(C(=O)N3CCC(NC(=O)CC4CCCC4)CC3)cc2[N+](=O)[O-])cc1 520917072 LOXHWQWGEQKHDI-UHFFFAOYSA-N 481.618 5.356 5 20 JKBD Cc1csc(Sc2ccc(C(=O)Nc3scnc3-c3ccccc3)cc2[N+](=O)[O-])n1 523350267 UMACDMHNXNTOFQ-UHFFFAOYSA-N 454.558 5.887 5 20 JKBD CCn1c(SCc2nnc(-c3c(Cl)cccc3Cl)o2)nc2cc3ccccc3cc2c1=O 588011527 CUYVVSYGFFJSSL-UHFFFAOYSA-N 483.380 6.219 5 20 JKBD COc1ccc([C@H](NCc2ccc(Oc3ccc(F)cc3)c([N+](=O)[O-])c2)c2nccn2C)cc1 603633609 XMTBJWRWPZZVIR-DEOSSOPVSA-N 462.481 5.148 5 20 JKBD Cc1cccc(NC(=O)Nc2cccc(CNc3ccc(C(=O)NC4CC4)cc3[N+](=O)[O-])c2)c1 603870600 FOJOFQQZBNQUPH-UHFFFAOYSA-N 459.506 5.052 5 20 JKBD COc1cc(C)ccc1NC(=O)C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1 604006809 YNXBZGDNHXLEGZ-NBVRZTHBSA-N 459.527 6.091 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Cl)[C@@H](NCc1ccc(OC2CCCC2)nc1)c1ccccc1 604046262 VHQWNMYQSSVDLS-DEOSSOPVSA-N 480.952 5.434 5 20 JKBD Cc1csc(Sc2ccc(NC(=O)c3ccc(Sc4nncn4C)c([N+](=O)[O-])c3)c(C)c2)n1 604563878 UMRYCMCXVVEVIG-UHFFFAOYSA-N 498.615 5.351 5 20 JKBD Cc1cc(Sc2ncccn2)ccc1NC(=O)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-] 608895501 NJLSMSQYKOCHNU-UHFFFAOYSA-N 464.425 5.038 5 20 JKBD CC(C)(Cc1ccc(Br)cc1)NC(=O)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-] 608949661 PHFUVLMRRGPTEI-UHFFFAOYSA-N 475.261 5.050 5 20 JKBD Cc1cc(O[C@@H](C)c2ccccc2)ccc1NC(=O)c1cn(C)nc1-c1ccc([N+](=O)[O-])cc1 609067263 SXZDDCGHROVXEE-SFHVURJKSA-N 456.502 5.696 5 20 JKBD CCOC(=O)c1sc(-c2cccc([N+](=O)[O-])c2)cc1NC(=O)c1ccc(C(=O)N(CC)CC)cc1 609149209 UEPKSSBILZEKFV-UHFFFAOYSA-N 495.557 5.234 5 20 JKBD COc1cc(C(=O)Nc2cnc3c(cnn3C(C)C)c2)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 610912701 VOVVJKUDLZBHKS-UHFFFAOYSA-N 481.896 5.627 5 20 JKBD Cc1oc(-c2ccsc2)nc1COC(=O)c1ccccc1NC(=O)c1ccc([N+](=O)[O-])cc1Cl 726808650 GOXPGGBHJMBXAT-UHFFFAOYSA-N 497.916 5.882 5 20 JKBD CC(C)OC(=O)C[C@@H](NC(=O)Nc1cccc(SC(F)F)c1)c1ccccc1[N+](=O)[O-] 727598504 ONRZPLJEIYJPEN-MRXNPFEDSA-N 453.467 5.114 5 20 JKBD Cc1ccc(Cl)c(NC(=S)/C(=C(/O)c2ccc([N+](=O)[O-])cc2)[n+]2ccccc2)c1Cl 728558442 KTCVBZDTQNEROO-UHFFFAOYSA-O 461.350 5.821 5 20 JKBD Cc1noc([C@@H]2CCCN(C(=O)CCC(=O)c3ccc4ccc5cccc6ccc3c4c56)C2)n1 729259972 SUDASBQPHPXVQL-OAQYLSRUSA-N 451.526 5.645 5 20 JKBD CCOC(=O)c1c(-c2ccc(F)cc2)csc1NC(=O)c1cc(SC)ccc1[N+](=O)[O-] 755475805 ZGWVOZDMIPOKPS-UHFFFAOYSA-N 460.508 5.613 5 20 JKBD O=C(COC(=O)c1cc(-c2ccncc2)nc2ccccc12)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 793123790 NBZSGBYNPNYRDK-UHFFFAOYSA-N 496.401 5.019 5 20 JKBD CSCC[C@@H](NC(=O)c1ccc(Cl)c([N+](=O)[O-])c1)C(=O)O[C@H](C)c1ccc(Cl)cc1 857760874 UAVWXSPIEABUDI-SJKOYZFVSA-N 471.362 5.058 5 20 JKBD O=[N+]([O-])c1cccc(Br)c1CNc1cccc(CS(=O)(=O)C2CCCCC2)c1 864028610 VJRSZQOGRLIQEU-UHFFFAOYSA-N 467.385 5.217 5 20 JKBD C[C@@H](Nc1ccc(-c2nc(C[C@@H](C)N(C)C(=O)OC(C)(C)C)no2)cc1[N+](=O)[O-])c1ccccn1 904654835 IIETYGXVIDKVLU-HZPDHXFCSA-N 482.541 5.011 5 20 JKBD Cc1ccc(OCCC(=O)Oc2ccc(NC(=O)c3cc([N+](=O)[O-])ccc3Cl)cc2)cc1C 912984503 HGVHDIJGZKFBJK-UHFFFAOYSA-N 468.893 5.492 5 20 JKBD CC(C)[C@H](OC(=O)[C@H](C)Sc1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccccc1C(F)(F)F 915371058 MWFJLRNJWDSPTC-UGSOOPFHSA-N 470.469 5.301 5 20 JKBD Cc1ccc(C(=O)O[C@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)cc1NC(=O)c1ccccc1F 915515182 RMAPPLWBBYLQIG-OAHLLOKOSA-N 490.447 5.263 5 20 JKBD C[C@@H](NC(=O)c1ccc(Cl)c([N+](=O)[O-])c1)c1cccc(NC(=O)Cc2ccccc2F)c1 916074701 XHLUUQAGLCYNNV-CQSZACIVSA-N 455.873 5.060 5 20 JKBD CCOc1cc(NC(=O)c2ccc3c(c2)C[C@H](c2ccccc2)OC3=O)c([N+](=O)[O-])cc1OCC 918558493 OHYIJLBWUYPBSV-JOCHJYFZSA-N 476.485 5.099 5 20 JKBD CN(Cc1cc(Cl)cc(Cl)c1)C(=O)c1ccccc1NC(=O)c1ccc([N+](=O)[O-])cc1Cl 918624960 MWXIJGQUSYXCTN-UHFFFAOYSA-N 492.746 6.080 5 20 JKBD COc1ccc(COC(=O)CCc2ncc(-c3ccc(Cl)cc3Cl)o2)cc1[N+](=O)[O-] 919054440 HDIQKOUFQDEWRE-UHFFFAOYSA-N 451.262 5.241 5 20 JKBD Cc1cc(O)c([N+](=O)[O-])cc1C(=O)NC1(c2ccc(NC(=O)CSc3ccccc3)cc2)CCC1 1787774555 DVKCAEHOSJZLJL-UHFFFAOYSA-N 491.569 5.149 5 20 JKBD COc1cc(CC(=O)Nc2ccc(C3(NC(=O)[C@@H]4CC=C(C)CC4)CCC3)cc2)ccc1[N+](=O)[O-] 1790477791 ACLUHPBEHABOLP-HXUWFJFHSA-N 477.561 5.026 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)c3cccc(Cl)c3)CCC2)cc1)c1ccc(O)c([N+](=O)[O-])c1 1790618715 HPNDYJJFMIAXHR-UHFFFAOYSA-N 465.893 5.015 5 20 JKBD Cc1cc2cc(C(=O)Nc3ccc(C4(NC(=O)c5ccc(O)c([N+](=O)[O-])c5)CCC4)cc3)ccc2[nH]1 1790989071 URCIXSQFEICEEH-UHFFFAOYSA-N 484.512 5.152 5 20 JKBD CC1(C)CCC(CC(=O)N2CCCC[C@H]2C2CCN(C(=O)c3cc(F)cc([N+](=O)[O-])c3)CC2)CC1 1830423740 XKWDLGXXZJBNCB-DEOSSOPVSA-N 487.616 5.574 5 20 JKBD O=C(c1ccc(C2CC2)cc1)N1CCC([C@H]2CCCCN2C(=O)c2cccc(F)c2[N+](=O)[O-])CC1 1830620665 DJPHYQUPUHHCAJ-XMMPIXPASA-N 479.552 5.158 5 20 JKBD Cc1cc(O)c([N+](=O)[O-])cc1C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2ccccc2C2CC2)CC1 1830792248 KBMJJHYDOJMCSL-XMMPIXPASA-N 491.588 5.033 5 20 JKBD O=C(c1cc2cc([N+](=O)[O-])ccc2s1)N1CC2(CCCN2C(=O)Cc2ccc3ccccc3c2)C1 1842661066 AVXHHSNGOVGFMI-UHFFFAOYSA-N 485.565 5.022 5 20 JKBD Cc1nn(Cc2ccc(C(=O)Nc3ccc(-c4nc5ccccc5o4)cc3)cc2)c(C)c1[N+](=O)[O-] 10422333 UAFHPVLNMXJZFT-UHFFFAOYSA-N 467.485 5.517 5 20 JKBD CCOc1ccc(C(=O)Nc2ccc(C)c(S(=O)(=O)Nc3ccccc3Cl)c2)cc1[N+](=O)[O-] 19005982 GULYHDRDPNTGNQ-UHFFFAOYSA-N 489.937 5.008 5 20 JKBD C[C@H](OC(=O)c1ccc(NC(=O)OC(C)(C)C)cc1)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 19426207 CUDULAUWMPUIPC-LBPRGKRZSA-N 497.426 5.145 5 20 JKBD C[C@H](Sc1nnc(-c2ccc(C(C)(C)C)cc2)o1)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 22250324 RWKNPNGCGYSUDY-LBPRGKRZSA-N 494.495 6.080 5 20 JKBD CC(C)(C)c1ccc(C(=O)Nc2ccccc2NC(=O)c2ccc([N+](=O)[O-])cc2Cl)cc1 24646813 ICBXUYTUGZINNE-UHFFFAOYSA-N 451.910 6.050 5 20 JKBD CSc1ccc([N+](=O)[O-])c(C(=O)N[C@@H](c2ccccc2)c2ccc3nc(C(F)(F)F)[nH]c3c2)c1 26130227 RVIJMXCTMMVYBA-FQEVSTJZSA-N 486.475 5.731 5 20 JKBD COc1cc(CNC(=O)c2cc([N+](=O)[O-])ccc2Sc2ccccc2)ccc1OC(F)F 26188407 VQIDSCGYOIYZLR-UHFFFAOYSA-N 460.458 5.286 5 20 JKBD Cc1c(NC(=O)[C@H](C)Sc2nc3scc(-c4ccc(F)cc4)c3c(=O)[nH]2)cccc1[N+](=O)[O-] 26819931 WWDGHLSMPAZVJS-LBPRGKRZSA-N 484.534 5.127 5 20 JKBD CCn1c([C@@H](C)NC(=O)C2CCN(c3ccc(C(F)(F)F)cc3[N+](=O)[O-])CC2)nc2ccccc21 72045150 FVPMKGXETVIECV-OAHLLOKOSA-N 489.498 5.077 5 20 JKBD CC[C@H](NC(=O)c1ccc(N[C@H](C)c2ccccn2)c([N+](=O)[O-])c1)c1ccccc1OC(F)F 108779493 BCHYMMUUFLXCLZ-QAPCUYQASA-N 470.476 5.645 5 20 JKBD O=C(Cc1csc(-c2ccc(Cl)s2)n1)N(Cc1ccccc1[N+](=O)[O-])CC(F)(F)F 195647802 YEWZPRVOQAZKHS-UHFFFAOYSA-N 475.901 5.567 5 20 JKBD Cc1cc(Sc2nnc(Cc3cccs3)n2C2CC2)nc(-c2ccc([N+](=O)[O-])cc2)n1 489274828 FEEHSFSHACXSRU-UHFFFAOYSA-N 450.549 5.090 5 20 JKBD COc1ccc(NC(=O)c2ccc(NCc3ccccc3Cl)c([N+](=O)[O-])c2)c(C(F)(F)F)c1 500767115 JZOKTOOSJMGMPI-UHFFFAOYSA-N 479.842 6.140 5 20 JKBD CCOc1cc(NC(=O)Cc2cn(-c3ccccc3)nc2-c2ccc([N+](=O)[O-])cc2)ccc1OC 502049729 LOXFMIHCRYNIQW-UHFFFAOYSA-N 472.501 5.036 5 20 JKBD O=C(CSc1ccc(C(F)(F)F)cc1[N+](=O)[O-])Nc1cccc(OCc2cccnc2)c1 502109241 KRXPGHNYWSLGRX-UHFFFAOYSA-N 463.437 5.318 5 20 JKBD CCCN(CCC)C(=O)c1ccc(NC(=O)Cn2c3ccccc3c(=O)c3ccccc32)cc1 502546162 ZEXRZJOFSLYZRZ-UHFFFAOYSA-N 455.558 5.056 5 20 JKBD C[C@H](Nc1ccc(C(=O)N(C)[C@H](C)c2nc3ccccc3s2)cc1[N+](=O)[O-])c1ccccn1 504280407 PPYSBUIEPGXFOZ-JKSUJKDBSA-N 461.547 5.606 5 20 JKBD CCN(Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[C@@H]1CCSc2ccc(Br)cc21 509068362 XFZZAUQNOLUMME-QGZVFWFLSA-N 475.368 5.466 5 20 JKBD CCCN(CC)C(=O)c1ccc(C(=O)Nc2nc(-c3ccc(C)c([N+](=O)[O-])c3)cs2)cc1 511989365 LGNRWLYMLYPMFQ-UHFFFAOYSA-N 452.536 5.151 5 20 JKBD Cc1noc(C)c1CNC(=O)c1c2c(nc3ccccc13)/C(=C/c1ccc([N+](=O)[O-])cc1)CCC2 516779547 UZHOTNQWMOPAMS-XMHGGMMESA-N 468.513 5.555 5 20 JKBD CCCc1noc2nc(-c3ccco3)cc(C(=O)Nc3cc([N+](=O)[O-])ccc3OC(F)F)c12 517904455 JFTPLHUJXIFJRN-UHFFFAOYSA-N 458.377 5.197 5 20 JKBD COc1cc(OCC(=O)N(Cc2cccs2)c2ccc(Br)cc2)ccc1[N+](=O)[O-] 519985652 KQIJIBRQEDGATE-UHFFFAOYSA-N 477.336 5.040 5 20 JKBD CC(C)COC1CCN([C@@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Br)c2ccccc2)CC1 520041430 YCERNFWLXCSAIZ-JOCHJYFZSA-N 490.398 5.174 5 20 JKBD CC(C)(C)c1ccc(C(=O)N2CCC[C@@H](c3nc(-c4cccc(F)c4)no3)C2)cc1[N+](=O)[O-] 522570809 AJOSIOAROYYPGV-QGZVFWFLSA-N 452.486 5.101 5 20 JKBD C[C@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)N(Cc1cccs1)c1ccc2c(c1)OCCO2 598401744 AOICLENBGLNUPH-AWEZNQCLSA-N 474.922 5.082 5 20 JKBD CCOc1cc([N+](=O)[O-])c(C(=O)Nc2sc3c(c2C(=O)OC(C)C)CC[C@@H](C)C3)cc1OC 603673392 ORKLMWBWABXDHJ-CYBMUJFWSA-N 476.551 5.006 5 20 JKBD Cc1sc(NC(=O)c2ccc(Cl)c(NC(=O)c3cccs3)c2)nc1-c1cccc([N+](=O)[O-])c1 609098122 OODZJQMINFQNMU-UHFFFAOYSA-N 498.973 6.246 5 20 JKBD CCOc1cc(NC(=O)C2CCN(C(=O)c3cccc4ccccc34)CC2)c([N+](=O)[O-])cc1OCC 619212870 STVJTGSFSVPNLV-UHFFFAOYSA-N 491.544 5.036 5 20 JKBD CC(C)N(Cc1nnc(-c2cccc([N+](=O)[O-])c2)o1)C(=O)c1cc(-c2ccccn2)nc2ccccc12 864244951 WARRBNOPEDWWHG-UHFFFAOYSA-N 494.511 5.306 5 20 JKBD Cn1cc([N+](=O)[O-])cc1-c1nc(-c2ccc(Oc3ncc(C(F)(F)F)cc3Cl)cc2)no1 904668514 LDFRGPWFALUGLQ-UHFFFAOYSA-N 465.775 5.510 5 20 JKBD Cc1ccc(OCCC(=O)Oc2ccc(NC(=O)c3cc([N+](=O)[O-])ccc3Cl)cc2)c(C)c1 914222024 NKMOEJRZSQYIBH-UHFFFAOYSA-N 468.893 5.492 5 20 JKBD O=C(O)/C=C\c1ccc(NC(=O)C/C(=C/c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)cc1 914730695 IEMGNWLYTKIIJF-BUXXSPIWSA-N 485.521 5.872 5 20 JKBD CC1=C(C(=O)Nc2ccccc2)[C@H](c2cc([N+](=O)[O-])c(F)cc2F)NC(=O)N1Cc1cccs1 916725829 IDVDBAZAAJRZCC-NRFANRHFSA-N 484.484 5.114 5 20 JKBD O=[N+]([O-])c1ccc(/C(O)=C(/C(=S)Nc2ccc3ccccc3c2)[n+]2ccc3c(c2)CCCC3)cc1 917610884 YIVWCGRSCZALJP-UHFFFAOYSA-O 482.585 6.238 5 20 JKBD COc1cc(NC(=O)c2ccccc2Cl)c(C(=O)OCc2cccc([N+](=O)[O-])c2C)cc1OC 918824505 GDDMXNQVQVRGRF-UHFFFAOYSA-N 484.892 5.183 5 20 JKBD O=C(/C=C/c1ccc([N+](=O)[O-])o1)Nc1ccc(C2(NC(=O)[C@@H]3C[C@H]3c3ccc(F)cc3)CCC2)cc1 1786205609 LABNZMHQONSDFZ-BUHQFNOLSA-N 489.503 5.278 5 20 JKBD CN(C)c1ccc([N+](=O)[O-])cc1C(=O)NC1(c2ccc(NC(=O)CSC3CCCC3)cc2)CCC1 1786348615 VOFDFDSPUIZYRD-UHFFFAOYSA-N 496.633 5.084 5 20 JKBD Cc1occc1C(=O)Nc1ccc(C2(NC(=O)c3cccc([N+](=O)[O-])c3Br)CCC2)cc1 1787364521 IGGUIQGHKYHCMO-UHFFFAOYSA-N 498.333 5.320 5 20 JKBD C[C@H]1CCC[C@@H]1C(=O)Nc1ccc(C2(NC(=O)CSc3ccccc3[N+](=O)[O-])CCC2)cc1 1789213977 OEDOTKGTDVPANW-PXNSSMCTSA-N 467.591 5.257 5 20 JKBD COc1cc(C(=O)NC2(c3ccc(NC(=O)CCCCn4cccc4)cc3)CCC2)ccc1[N+](=O)[O-] 1789605840 LLHDVYHMKRWTGE-UHFFFAOYSA-N 490.560 5.023 5 20 JKBD COc1cc(C(=O)NC2(c3ccc(NC(=O)c4ccc5ccoc5c4)cc3)CCC2)ccc1[N+](=O)[O-] 1790894037 BDJSHCJTTXTIAM-UHFFFAOYSA-N 485.496 5.411 5 20 JKBD CC[C@H](C)[C@H](C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)/C=C/c1ccccc1[N+](=O)[O-])C2)c1ccccc1 1795575200 UOMNVJARSAUSCR-DLJNGFGQSA-N 475.589 5.076 5 20 JKBD CC(C)(C)CCCCCC(=O)N1CC[C@H](CNC(=O)Cc2cccc([N+](=O)[O-])c2)[C@H]1c1cccnc1 1802382162 OOTWCJOMYKIDQB-YIXXDRMTSA-N 494.636 5.235 5 20 JKBD Cc1scc(C(=O)Nc2cc([C@H]3CCCCN3C(=O)CSc3ccccc3[N+](=O)[O-])[nH]n2)c1C 1816615170 NUNMFJRXTYTHIR-GOSISDBHSA-N 499.618 5.094 5 20 JKBD Cc1c(C(=O)N2CCCC[C@H]2c2cc(NC(=O)[C@@H](C)Cc3ccco3)n[nH]2)cc(Cl)cc1[N+](=O)[O-] 1822846937 MBKVIPIEWZKFLK-XOBRGWDASA-N 499.955 5.057 5 20 JKBD Cc1c(C(=O)N2CCCC[C@H]2c2cc(NC(=O)C3CC4(CCC4)C3)n[nH]2)cc(Cl)cc1[N+](=O)[O-] 1823057000 ULLWCFFKZLYPHF-IBGZPJMESA-N 485.972 5.166 5 20 JKBD COc1cc(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)c3ccc(C(C)C)cc3)[nH]n2)ccc1[N+](=O)[O-] 1823285259 SOHMCZBEUOYXJW-NRFANRHFSA-N 491.548 5.070 5 20 JKBD O=C(C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)NC[C@H]1CCN(c2ccccc2)C1 27839215 SYDSRNYCVPRUDD-NCJDQSJGSA-N 498.608 5.778 5 20 JKBD Cc1nn(Cc2ccc(C(=O)N(Cc3ccc(C(F)(F)F)cc3)C3CC3)cc2)c(C)c1[N+](=O)[O-] 30301045 WIQLRYIOECBXBV-UHFFFAOYSA-N 472.467 5.280 5 20 JKBD Cc1ccc(-c2csc(NC(=O)CSc3ccc(C(F)(F)F)cn3)n2)cc1[N+](=O)[O-] 105353513 WOPGPEYAOWGIFT-UHFFFAOYSA-N 454.455 5.171 5 20 JKBD C[C@H](Sc1nnc(C[C@@H](C)c2ccccc2)o1)C(=O)Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1 255939844 VJCRELCAJYUOHL-CABCVRRESA-N 495.586 5.567 5 20 JKBD C[C@H](Nc1ccc(NC(=O)c2ccc(N[C@H](C)c3ccccn3)c([N+](=O)[O-])c2)cc1)c1ccccc1 302974698 DRFGUQUGAVJXTF-VQTJNVASSA-N 481.556 6.588 5 20 JKBD C[C@H](NC(=O)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1)c1ccc(NC(=O)NC2CC2)cc1 483209838 PSJJLEMFUOKXJY-HNNXBMFYSA-N 494.935 5.815 5 20 JKBD CCc1cccc(Oc2ccc(NC(=O)c3cc(OCC(F)(F)F)ccc3[N+](=O)[O-])cn2)c1 484114898 RACUDWSLWGQRJU-UHFFFAOYSA-N 461.396 5.538 5 20 JKBD Cc1nn(Cc2ccc(C(=O)N[C@H]3CCOc4c(-c5ccccc5)cccc43)cc2)c(C)c1[N+](=O)[O-] 505173499 QRWKDYDEGXAHPI-VWLOTQADSA-N 482.540 5.377 5 20 JKBD C[C@@H](c1ccco1)N(C(=O)C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)C1CC1 509840480 RDRMGZCNDFVWFJ-BYFYWULKSA-N 473.554 6.480 5 20 JKBD CC(C)(C)Cc1noc2nc(C3CC3)cc(C(=O)Nc3cc4c(cc3[N+](=O)[O-])OCCCO4)c12 514433580 XTPAIOFBCWIJDJ-UHFFFAOYSA-N 466.494 5.011 5 20 JKBD O=C(Nc1ccc(Cc2nc3ccccc3s2)cc1)N1CCN(c2ccccc2[N+](=O)[O-])CC1 515381914 IIPZYBATHANCPE-UHFFFAOYSA-N 473.558 5.149 5 20 JKBD CCOc1cc(C(=O)N2CC[C@@H](C)Sc3ccc(C(F)(F)F)cc32)c([N+](=O)[O-])cc1OC 515699563 HTKXGWFEFQEDKI-GFCCVEGCSA-N 470.469 5.552 5 20 JKBD CC(C)(C)c1ccc(Oc2ccc(CNc3ccnn3C[C@@H]3CCOC3)cc2[N+](=O)[O-])cc1 517550880 QEUSDYHJTQZNFD-IBGZPJMESA-N 450.539 5.530 5 20 JKBD O=C(C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)NCc1ccc2c(c1)CCO2 522278835 JISVKIVQZHJDDF-MOSHPQCFSA-N 471.538 5.387 5 20 JKBD O=C(Cn1c2ccccc2c(=O)c2ccccc21)N1CCO[C@@H](c2ccc(Cl)c(Cl)c2)C1 589539078 SEGXIKTYYFQSTG-HSZRJFAPSA-N 467.352 5.062 5 20 JKBD Cc1c(NC(=O)[C@H](C)Sc2nnc(-c3ccncc3)n2-c2ccc(Cl)cc2)cccc1[N+](=O)[O-] 597255686 YSLGLFXOJJGFQR-HNNXBMFYSA-N 494.964 5.319 5 20 JKBD CC(C)c1c(C(=O)Nc2cc([N+](=O)[O-])ccc2OC(F)F)cnn1-c1ccc(C(F)(F)F)cn1 603638297 JYFRECZCLYWXSE-UHFFFAOYSA-N 485.369 5.171 5 20 JKBD COc1ccc(-c2nnc(SCc3nc(-c4ccc([N+](=O)[O-])cc4)no3)n2-c2ccccc2)cc1 603680237 MXLFXEOWKHCEMS-UHFFFAOYSA-N 486.513 5.193 5 20 JKBD COc1cc2c(cc1CNCc1cn(-c3ccccc3)nc1-c1ccc([N+](=O)[O-])cc1)O[C@H](C)C2 608835777 PJXQWAZVUOLSNA-GOSISDBHSA-N 470.529 5.069 5 20 JKBD O=C(Nc1ccccc1)[C@H]1CCc2ccccc2N1C(=O)c1csc(-c2ccc([N+](=O)[O-])cc2)n1 608871914 GPKGOSMZFKKDCG-HSZRJFAPSA-N 484.537 5.319 5 20 JKBD COc1cc(C(=O)Nc2ccc(Sc3nc(C)cs3)c(Cl)c2)c([N+](=O)[O-])cc1OC 608874177 BXOPWOKNHWEXRZ-UHFFFAOYSA-N 465.940 5.434 5 20 JKBD C[C@@H]1CCCN(c2ccc(C(=O)N3CCC([C@@H]4C(=O)Nc5cc(Cl)ccc54)CC3)cc2[N+](=O)[O-])C1 608971106 IGQFRTNXLXZQPP-GYCJOSAFSA-N 496.995 5.073 5 20 JKBD Cc1ccc(Sc2ccc(CN[C@H](C)c3cccc(S(=O)(=O)N(C)C)c3)cc2[N+](=O)[O-])cc1 608983117 IPUNVLPLZGAOGV-GOSISDBHSA-N 485.631 5.156 5 20 JKBD O=C(Nc1cc(Cl)ccc1Cl)[C@@H]1CCCCN1C(=O)c1c[nH]c2cc([N+](=O)[O-])ccc12 609169439 DGTLRJISAMDBEK-IBGZPJMESA-N 461.305 5.016 5 20 JKBD c1ccc2c(SCc3nc4ccccc4c4ccccc34)nc(CN3CCOCC3)nc2c1 685896975 QUAAKUDUNYXDRM-UHFFFAOYSA-N 452.583 5.456 5 20 JKBD COc1ccc([N+](=O)[O-])cc1NC(=O)[C@H](C)Nc1ccc(OCc2cccc(F)c2)cc1C 728066790 STNPPWMHDBEGOU-INIZCTEOSA-N 453.470 5.069 5 20 JKBD C[C@@H]1C[C@@H](C)CN(c2ccc(C(=O)O[C@H](C)C(=O)Nc3ccccc3C(F)(F)F)cc2[N+](=O)[O-])C1 728943840 UZZFZVYEMOSWRY-BZUAXINKSA-N 493.482 5.280 5 20 JKBD Cc1nc(C)c(COC(=O)C/C(=C\c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)s1 729654438 NBHUFRUEGHODGZ-GZTJUZNOSA-N 465.556 5.952 5 20 JKBD O=C(Nc1cc(Cl)c([N+](=O)[O-])cc1OCc1ccccc1)c1sccc1SC(F)F 730469282 BTYLNJHEFZCSRN-UHFFFAOYSA-N 470.906 6.456 5 20 JKBD CNC(=O)c1ccc(COC(=O)C/C(=C/c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)cc1 731374692 YDEBVOIMBKSVFJ-ZHZULCJRSA-N 487.537 5.238 5 20 JKBD CCCOc1ccc(Oc2ncccc2CNC(=O)c2cc([N+](=O)[O-])ccc2Br)cc1 751091472 VUSJJKMQAMJIHF-UHFFFAOYSA-N 486.322 5.263 5 20 JKBD CC(C)(C)OC(=O)Nc1cccc(-c2noc([C@@H]3CCCN3C(=O)c3ccc([N+](=O)[O-])s3)n2)c1 904636023 OXYLFGMKEVCCLB-HNNXBMFYSA-N 485.522 5.031 5 20 JKBD C[C@@H](Nc1ccc(C(=O)OCC(=O)N[C@H](C)c2cccc3ccccc23)cc1[N+](=O)[O-])c1ccccn1 920544958 OJPUBJTXBXCVCO-RTBURBONSA-N 498.539 5.350 5 20 JKBD C[C@H](OC(=O)[C@@H](C)Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)N1c2ccccc2Sc2ccccc21 920777562 KVGGQFSKCQSMLR-LSDHHAIUSA-N 498.944 5.777 5 20 JKBD O=C(Oc1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2Cl)cc1)c1csc(-c2ccccn2)n1 920999980 ZGQISGUQTHFUNA-UHFFFAOYSA-N 480.889 5.238 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)c3ccc([N+](=O)[O-])o3)CCC2)cc1)c1cc2c(F)cc(F)cc2[nH]1 1788983506 WVUKOFZTODWIQT-UHFFFAOYSA-N 480.427 5.009 5 20 JKBD Cc1oncc1C(=O)NC1(c2ccc(NC(=O)c3cc4cc([N+](=O)[O-])ccc4s3)cc2)CCC1 1791009824 AIZPTPBUWCPYLY-UHFFFAOYSA-N 476.514 5.167 5 20 JKBD COc1ccc(CC(=O)NC2(c3ccc(NC(=O)[C@@H]4C[C@@H]4c4ccccc4)cc3)CCC2)c([N+](=O)[O-])c1 1791534698 VFZQBFIXAKIKSO-JWQCQUIFSA-N 499.567 5.084 5 20 JKBD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc2c1oc1ccccc12)c1cc(F)cc([N+](=O)[O-])c1 1801203732 VBFOCGRPKIPZLM-REPLKXPHSA-N 487.487 5.199 5 20 JKBD O=C(c1cccc(F)c1[N+](=O)[O-])N1CCC([C@H]2CCCCN2C(=O)c2cc3ccccc3o2)CC1 1828192239 ZFGPVQOBWSHFQM-OAQYLSRUSA-N 479.508 5.027 5 20 JKBD CC(C)(C)CCCCCC(=O)N1CCC([C@H]2CCCCN2C(=O)c2ccc([N+](=O)[O-])[nH]2)CC1 1829835724 HWECHFQPYPSCMZ-OAQYLSRUSA-N 460.619 5.153 5 20 JKBD CC[C@H]1CC[C@H](C(=O)N2CCC([C@@H]3CCCCN3C(=O)c3cc([N+](=O)[O-])ccc3N(C)C)CC2)CC1 1830766972 WVKMOADKRBRASW-XTJBDQBJSA-N 498.668 5.111 5 20 JKBD [O-][N+]1(CCCCOc2ccc3ccc(O)nc3c2)CC[N+]([O-])(c2cccc3sccc23)CC1 2048531976 UFAZRHMCTHWTFW-UHFFFAOYSA-N 465.575 5.148 5 20 JKBD C[C@@H](OC(=O)c1ccc([N+](=O)[O-])cc1Cl)C(=O)Nc1ccc(Cl)cc1C(F)(F)F 15710053 AVVAVZHCUPKZMQ-MRVPVSSYSA-N 451.184 5.104 5 20 JKBD COc1cc(C(=O)NC2CCN(Cc3ccccc3)CC2)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 17362872 LLQCSMMJPSDEEK-UHFFFAOYSA-N 495.963 5.444 5 20 JKBD Cc1cc(C)cc(-c2nnc(SCC(=O)Nc3ccc([N+](=O)[O-])cc3C(F)(F)F)o2)c1 22236680 QVRNKYIGMDPJEI-UHFFFAOYSA-N 452.414 5.011 5 20 JKBD O=C(Nc1ccccc1)[C@@H]1CCCN(C(=O)c2ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])cc2)C1 27243045 RHEYSGKKPJRENZ-GOSISDBHSA-N 479.920 5.531 5 20 JKBD CC(=O)Nc1cccc([C@H](C)NC(=O)c2cc([N+](=O)[O-])ccc2Sc2ccc(Cl)cc2)c1 31304713 OKHSEFANHNFMCQ-AWEZNQCLSA-N 469.950 5.849 5 20 JKBD COc1cc(C(=O)NCc2ccc(NC(=O)C(C)C)cc2)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 33091491 AMASMTKPSGEBNW-UHFFFAOYSA-N 497.935 5.574 5 20 JKBD COc1ccc([N+](=O)[O-])cc1NC(=O)c1oc2ccccc2c1CSc1nc(C)cs1 104797455 IXDQSVDZGVOTHN-UHFFFAOYSA-N 455.517 5.659 5 20 JKBD CC(C)n1ncc2ccc(NC(=O)C3CCN(c4ccc(C(F)(F)F)cc4[N+](=O)[O-])CC3)cc21 195743743 NLWODJCNKLVWNO-UHFFFAOYSA-N 475.471 5.399 5 20 JKBD COc1ccc(NC(=O)c2ccc([N+](=O)[O-])cc2C)cc1NC(=O)c1ccc(Cl)cc1F 303102878 IMGUPOFRQBKNEV-UHFFFAOYSA-N 457.845 5.209 5 20 JKBD O=C(C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)NCc1cccc2c1OCO2 490747419 SCQOKCQBACWZEW-LDADJPATSA-N 473.510 5.180 5 20 JKBD CSc1ccc([N+](=O)[O-])c(C(=O)Nc2nc(-c3sccc3Br)cs2)c1 500708587 IVQGARSOKKPWJY-UHFFFAOYSA-N 456.368 5.517 5 20 JKBD CCOc1cc([N+](=O)[O-])c(C(=O)Nc2ncc(Cc3ccc(Cl)cc3C)s2)cc1OC 502559991 OLFZTWYZNJQLQP-UHFFFAOYSA-N 461.927 5.264 5 20 JKBD CC(C)N(C)C(=O)c1ccc(Cl)c(NC(=O)c2cc([N+](=O)[O-])ccc2NCc2ccccc2)c1 509289541 MUOYJSBAHGAUHZ-UHFFFAOYSA-N 480.952 5.593 5 20 JKBD COc1cc(C)ccc1Oc1ccc(NC(=O)c2cc(OCC(F)(F)F)ccc2[N+](=O)[O-])cc1F 510238150 HYZRFKUQZHABKO-UHFFFAOYSA-N 494.397 6.037 5 20 JKBD CCOc1cc(NC(=O)c2cc(-c3ccccc3)nc3c2cnn3CC)c([N+](=O)[O-])cc1OCC 514922765 WAAXROVIZVLCPQ-UHFFFAOYSA-N 475.505 5.076 5 20 JKBD O=C(Nc1nc(-c2ccc3c(c2)CCC3)cs1)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-] 516070150 ZSDRNAPQOITXKM-UHFFFAOYSA-N 463.437 5.400 5 20 JKBD CCSc1ccc(Cl)cc1NC(=O)c1ccc([N+](=O)[O-])cc1I 517860774 ZOEJRMSRZCEHQY-UHFFFAOYSA-N 462.696 5.217 5 20 JKBD COc1cc(OCC(=O)Nc2sc3c(c2-c2nc4ccccc4[nH]2)CCCC3)ccc1[N+](=O)[O-] 519036021 RWEUNDIQHIVEBU-UHFFFAOYSA-N 478.530 5.105 5 20 JKBD O=C(C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1)N1CCCC[C@@H]1Cc1ccc(F)cc1 519132798 CEQCDZJQYIUICK-OAQYLSRUSA-N 493.501 5.593 5 20 JKBD COC1CCN(C2(CNCc3ccc(-c4ccc([N+](=O)[O-])cc4Br)o3)CCCC2)CC1 520230869 FKBHDMAZHHTCBV-UHFFFAOYSA-N 492.414 5.131 5 20 JKBD Cc1ccc(-c2ccncc2)cc1NC(=O)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 523576851 HKJCCMJPCDMPOL-UHFFFAOYSA-N 484.478 5.839 5 20 JKBD CCCc1ccc(-c2cc(NC(=O)c3cc(OC)c(OCc4cscn4)cc3[N+](=O)[O-])n[nH]2)cc1 523823788 HYSCVNFZEVEGQN-UHFFFAOYSA-N 493.545 5.234 5 20 JKBD O=C(c1nc(-c2ccccc2)n(-c2cccc(C(F)(F)F)c2)n1)N1CCc2ccc([N+](=O)[O-])cc21 604137415 OERUCCMWOYDUEA-UHFFFAOYSA-N 479.418 5.064 5 20 JKBD C[C@@H](NCc1ccccc1-c1ccc(Cn2cccn2)cc1)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl 608910238 KEADGJPCYJYZOW-GOSISDBHSA-N 489.963 5.277 5 20 JKBD COc1ccc(NC(=O)CCNc2ccccc2[N+](=O)[O-])cc1OCc1ccc2ccccc2n1 609066041 BJLSXVNRUJVRSD-UHFFFAOYSA-N 472.501 5.171 5 20 JKBD COc1cc(C(=O)N[C@@H](C)c2sc(-c3ccc(F)cc3)nc2C)c([N+](=O)[O-])cc1OC(F)F 609186664 YQUDGUHTYHUELX-JTQLQIEISA-N 481.452 5.267 5 20 JKBD CN(CCCc1cc(-c2ccc(F)cc2)no1)C(=O)Cn1c2ccccc2c(=O)c2ccccc21 625048806 MODTYUSBLVFOCA-UHFFFAOYSA-N 469.516 5.040 5 20 JKBD O=C(Cn1c2ccccc2c(=O)c2ccccc21)N(c1cccc(Cl)c1)c1nc2ccccc2s1 651595531 WJCPEEJCZNZPQZ-UHFFFAOYSA-N 495.991 6.783 5 20 JKBD CC(=O)N1CCN(c2ccc(C(=O)Nc3ccc(-c4cccc(Cl)c4)cc3C)cc2[N+](=O)[O-])CC1 726766285 PVLPTISMIVGNAY-UHFFFAOYSA-N 492.963 5.144 5 20 JKBD COC(=O)CNC(=O)c1ccc(NC(=O)CCC(=O)c2ccc3ccc4cccc5ccc2c3c45)cc1 727753074 JBFPYLDTRMEMCM-UHFFFAOYSA-N 492.531 5.088 5 20 JKBD Cc1ccc(OC[C@H](C)NC(=O)c2ccccc2NC(=O)c2ccc([N+](=O)[O-])cc2Cl)cc1 742433722 QYWFCWXKZSVKJN-INIZCTEOSA-N 467.909 5.006 5 20 JKBD COc1ccc(-c2nc(COC(=O)c3csc(-c4cccc([N+](=O)[O-])c4)n3)cs2)c(OC)c1 747961573 FIYZVFJDMNEXFW-UHFFFAOYSA-N 483.527 5.216 5 20 JKBD CC(C)[C@H](OC(=O)c1csc(-c2cccc([N+](=O)[O-])c2)n1)C(=O)Nc1ccccc1Cl 747962288 QCVUUAJCSFHRKH-SFHVURJKSA-N 459.911 5.192 5 20 JKBD O=C(Nc1ccc(Cl)c(-c2nnc3n2CCCCC3)c1)c1cc([N+](=O)[O-])ccc1Br 751072520 NGGCWGUFVVQHSY-UHFFFAOYSA-N 490.745 5.248 5 20 JKBD O=C(OCC(=O)N1c2ccccc2Sc2ccc(Cl)cc21)c1ccc(Cl)cc1[N+](=O)[O-] 798123354 AAQVFAKMWYSJEV-UHFFFAOYSA-N 475.309 5.888 5 20 JKBD O=[N+]([O-])c1cccc(Br)c1CNc1ccc(CCn2cc(Br)cn2)cc1 864021382 BHIDLUVFBYBBRX-UHFFFAOYSA-N 480.160 5.171 5 20 JKBD Cc1ccc(Nc2nn(CN(Cc3ccccc3[N+](=O)[O-])CC(F)(F)F)c(=S)s2)cc1 917450163 JMJXWSUFOSNFEU-UHFFFAOYSA-N 469.514 5.656 5 20 JKBD COc1cc(C(=O)O[C@H](C)c2ccccc2Br)c([N+](=O)[O-])cc1OCc1cscn1 920651901 HACDEOHLVSWYHS-GFCCVEGCSA-N 493.335 5.319 5 20 JKBD C[C@H](OC(=O)[C@@H](C)Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)Nc1ccc(Cl)cc1C(F)(F)F 920777756 GCCFZJQLBNGFJX-VHSXEESVSA-N 495.237 5.258 5 20 JKBD O=C(Cc1ccc(Cl)cc1[N+](=O)[O-])Nc1ccc(C2(NC(=O)c3cc(C4CC4)on3)CCC2)cc1 1786114916 NGQLUGBXCSSXAU-UHFFFAOYSA-N 494.935 5.104 5 20 JKBD Cc1ccsc1C(=O)Nc1ccc(C2(NC(=O)/C=C/c3ccc([N+](=O)[O-])o3)CCC2)cc1 1787277188 HPWBWJGCCIEXGP-VQHVLOKHSA-N 451.504 5.019 5 20 JKBD CC[C@H]1CC[C@H](C(=O)N2CCC([C@H]3CCCCN3C(=O)/C=C/c3ccc([N+](=O)[O-])o3)CC2)CC1 1824278280 DNIBDKDHLGTCGX-SMKSDRDFSA-N 471.598 5.037 5 20 JKBD O=C(c1cc2cc([N+](=O)[O-])ccc2s1)N1CCC([C@H]2CCCCN2C(=O)CC2CCCC2)CC1 1826262905 NYFVQJFPWSXBBY-JOCHJYFZSA-N 483.634 5.623 5 20 JKBD CC(C)Cn1c(S[C@@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2C(F)(F)F)nnc1-c1ccco1 9566954 ZWZNIGZFYBAFEB-LBPRGKRZSA-N 483.472 5.240 5 20 JKBD CC(=O)N(c1cccc(C(F)(F)F)c1)c1nc(COC(=O)c2ccc([N+](=O)[O-])cc2Cl)cs1 11028611 ZHNMMLWUESAJIF-UHFFFAOYSA-N 499.854 5.765 5 20 JKBD O=C(Nc1ccc(N2CCCC2=O)c(Cl)c1)c1ccc(NCc2ccccc2)c([N+](=O)[O-])c1 11417574 KATYSPDFHBDSFP-UHFFFAOYSA-N 464.909 5.239 5 20 JKBD C[C@@H](Oc1ccc2c(-c3ccc([N+](=O)[O-])cc3)cc(=O)oc2c1)C(=O)Nc1ccc(F)c(F)c1 15370863 ZBNBHKLVCAVNEQ-CYBMUJFWSA-N 466.396 5.052 5 20 JKBD Cc1occc1-c1nnc(SCC(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)n1Cc1ccccc1 21684828 QFEDDIIOBARBIB-UHFFFAOYSA-N 483.937 5.187 5 20 JKBD CCn1c(SCc2nnc(-c3ccc(Br)o3)o2)nc2cc3ccccc3cc2c1=O 24891059 LKOHCRWSWIYFNF-UHFFFAOYSA-N 483.347 5.267 5 20 JKBD CSc1ccc([N+](=O)[O-])c(C(=O)Nc2nc(-c3ccc(Br)s3)cs2)c1 26866584 XDQIKMXQKYUCDD-UHFFFAOYSA-N 456.368 5.517 5 20 JKBD O=C(Cn1c2ccccc2c(=O)c2ccccc21)NCc1ccc(-c2nc3ccccc3[nH]2)cc1 97543579 XJGABGVAVFESGY-UHFFFAOYSA-N 458.521 5.014 5 20 JKBD CCN(Cc1ccc(C(=O)N(C)C)cc1)C(=O)c1ccc(NCc2ccccc2Cl)c([N+](=O)[O-])c1 476387160 AMEKCZDAEHECFA-UHFFFAOYSA-N 494.979 5.224 5 20 JKBD O=C(NC[C@H]1CCCN(Cc2cccs2)C1)c1cc([N+](=O)[O-])ccc1Sc1ccccc1 494312848 DKBQNQIHZSZBIP-GOSISDBHSA-N 467.616 5.450 5 20 JKBD Cc1sc(C(=O)Nc2ccc(CNC(=O)c3ccc(C(F)(F)F)cc3)cc2)cc1[N+](=O)[O-] 502449870 ZJRSWMISCZTUSM-UHFFFAOYSA-N 463.437 5.166 5 20 JKBD O=C(Nc1cccc(COCc2ccco2)c1)c1cc([N+](=O)[O-])ccc1NCc1ccccc1 502698754 HJNKZFCOJHGIJW-UHFFFAOYSA-N 457.486 5.769 5 20 JKBD CCN(C(=O)c1cnn(-c2ccc([N+](=O)[O-])cc2)c1)[C@H]1CCSc2ccc(Br)cc21 504551358 BJHOHHHWPPOLJY-IBGZPJMESA-N 487.379 5.242 5 20 JKBD COc1cc(C(=O)N[C@@H](c2ccccc2)c2nccs2)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 505086721 IRJWCTMRVAAGPT-QFIPXVFZSA-N 495.944 6.025 5 20 JKBD Cc1csc(Sc2ccc(NC(=O)c3ccc([N+](=O)[O-])cc3I)cc2)n1 508981425 RUWUPTBUKNJKHH-UHFFFAOYSA-N 497.339 5.368 5 20 JKBD COc1cc(CNCC2(c3ccccc3)CCOCC2)c([N+](=O)[O-])cc1OCc1ccccc1 509580315 WHPLTYNLRFUXDU-UHFFFAOYSA-N 462.546 5.020 5 20 JKBD O=C(Nc1cccc(N2CCCC2)c1)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 511305400 ZRQWBUFANNYGPY-UHFFFAOYSA-N 462.472 5.069 5 20 JKBD COc1cc(C(=O)N[C@@H](CC(F)(F)F)c2ccccc2)c([N+](=O)[O-])cc1OCc1cscn1 512622620 NFNFWCULRVFPTK-INIZCTEOSA-N 481.452 5.062 5 20 JKBD CCOc1ccc(Oc2cc(CNC(=O)Cn3c4ccccc4c(=O)c4ccccc43)ccn2)cc1 515676616 NRXUWJYJQHSTKL-UHFFFAOYSA-N 479.536 5.057 5 20 JKBD CC[C@@H](NCc1ccc(-c2cccc([N+](=O)[O-])c2)o1)c1ccccc1OCC(=O)N1CCCC1 517534630 ZHQRAYAAKWPUEJ-HSZRJFAPSA-N 463.534 5.097 5 20 JKBD O=C(Cc1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1)N[C@@H](c1ccccc1)[C@H]1CCCO1 523275396 VSGYJOXMLIABTH-NAKRPHOHSA-N 482.540 5.027 5 20 JKBD O=C(Nc1cccc2cccnc12)c1ccc(C(=O)Nc2cccc3cccnc23)c([N+](=O)[O-])c1 524353078 KSCNYEMUQPEMMF-UHFFFAOYSA-N 463.453 5.196 5 20 JKBD CCOc1cc(C(=O)Nc2cc(C(F)(F)F)ccc2-n2nc(C)cc2C)c([N+](=O)[O-])cc1OC 603756585 YSKOXXSBPBANDW-UHFFFAOYSA-N 478.427 5.076 5 20 JKBD COc1cc([C@H](C)NC(=O)[C@H](C)Oc2ccc(Cl)cc2[N+](=O)[O-])ccc1OC1CCCC1 604442621 MFSGLJKFRXGWCE-GJZGRUSLSA-N 462.930 5.223 5 20 JKBD CS(=O)(=O)c1ccc(Oc2ccc(NC(=O)c3cc4cc([N+](=O)[O-])ccc4s3)cc2)cc1 608809297 AEIYWRXHQHJZOB-UHFFFAOYSA-N 468.512 5.258 5 20 JKBD COc1ccc(CNC(=O)N(Cc2ccc(Cl)c(Cl)c2)Cc2ccccn2)cc1[N+](=O)[O-] 609211732 RUNRECAXNOTHKH-UHFFFAOYSA-N 475.332 5.217 5 20 JKBD O=C(CNC(=O)c1c(Cl)cccc1[N+](=O)[O-])Nc1ccc(Oc2ccc(F)cc2)c2ccncc12 609392642 JZUGLAPNEXEFQT-UHFFFAOYSA-N 494.866 5.096 5 20 JKBD Cc1cc(Br)cc(Cl)c1NC(=O)Cn1c2ccccc2c(=O)c2ccccc21 643199685 GBNAPMWEETXRRG-UHFFFAOYSA-N 455.739 5.518 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)O[C@@H](C)c2cccc(NC(=O)c3ccccc3)c2)cc1SC 728650326 XCTPBMNFTZBWOX-HNNXBMFYSA-N 466.515 5.496 5 20 JKBD Cc1nnc([C@@H](C)OC(=O)C/C(=C\c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)o1 744497877 RVEAKSCNQUJMKG-KWWJGWKXSA-N 450.476 5.131 5 20 JKBD COc1ccc(C2(C(=O)Oc3ccc(NC(=O)c4cc([N+](=O)[O-])ccc4Cl)cc3)CCC2)cc1 751054475 NIECAFILLXWROG-UHFFFAOYSA-N 480.904 5.536 5 20 JKBD O=C(/C=C\c1ccc([N+](=O)[O-])cc1)OCC(=O)N1c2ccccc2Sc2ccc(Cl)cc21 798129514 PWODDJJANUSCPN-GHXNOFRVSA-N 466.902 5.634 5 20 JKBD Cc1cccc(-n2ncc(C(=O)O[C@H](C)c3nnc(-c4ccc([N+](=O)[O-])cc4)o3)c2C(F)(F)F)c1 904954599 GVXROHKHELRZMX-CYBMUJFWSA-N 487.394 5.076 5 20 JKBD COc1ccc(-c2cc(C(=O)OCc3nc(-c4cccc([N+](=O)[O-])c4)no3)sc2C)cc1 914883862 UNGJSKOEQCVILJ-UHFFFAOYSA-N 451.460 5.047 5 20 JKBD CC(C)CCSc1ccc(C(=O)Nc2ccc(N3C(=O)CCCC3=O)cc2)cc1[N+](=O)[O-] 915296831 UTRYCFJKFKMYJE-UHFFFAOYSA-N 455.536 5.029 5 20 JKBD Cc1cc[n+](/C(C(=S)Nc2ccc3ccccc3c2)=C(/O)c2ccc(C)c([N+](=O)[O-])c2)cc1 917610362 NDYSJXRIIAITTN-UHFFFAOYSA-O 456.547 5.976 5 20 JKBD CN(Cc1cc([N+](=O)[O-])ccc1Cl)C(=O)CSc1nnc(-c2ccc3ccccc3c2)o1 917983485 FTWBCPFVWKRHRQ-UHFFFAOYSA-N 468.922 5.202 5 20 JKBD O=C(NC1(c2ccc(NC(=O)c3ccc([N+](=O)[O-])o3)cc2)CCC1)c1ccc(Cl)c(Cl)c1 1785750138 UZIUBNYRKOAWCW-UHFFFAOYSA-N 474.300 5.556 5 20 JKBD C[C@@H](Sc1cccs1)C(=O)NC1(c2ccc(NC(=O)c3ccc([N+](=O)[O-])o3)cc2)CCC1 1785750786 RGNFFMUHPQZFOY-CQSZACIVSA-N 471.560 5.178 5 20 JKBD O=C(Cc1ccsc1)Nc1ccc(C2(NC(=O)CSc3ccccc3[N+](=O)[O-])CCC2)cc1 1788237754 AFDNJOOJRKYJHA-UHFFFAOYSA-N 481.599 5.125 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)c3cccc(F)c3[N+](=O)[O-])CCC2)cc1)c1ccc2cnccc2c1 1789014717 QHJPBPITTYPDAG-UHFFFAOYSA-N 484.487 5.344 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)c3ccc(C(F)(F)F)[nH]3)CCC2)cc1)c1cc(F)cc([N+](=O)[O-])c1 1790697680 LGQKQXTXAIHLCW-UHFFFAOYSA-N 490.413 5.142 5 20 JKBD C[C@@H]1CCC[C@@H]1C(=O)NC1(c2ccc(NC(=O)CSc3ccccc3[N+](=O)[O-])cc2)CCC1 1791522446 TVDKMPGBDFLHAP-XLIONFOSSA-N 467.591 5.257 5 20 JKBD Cc1ccc2[nH]c(C(=O)N[C@@H]3C[C@@H]4CC[C@H](C3)N4C(=O)c3cc4cc([N+](=O)[O-])ccc4s3)cc2c1 1801206652 GZMRJWVNNKLLJO-REPLKXPHSA-N 488.569 5.165 5 20 JKBD CC1(C)CCC(CC(=O)N2CC[C@H](CNC(=O)c3ccc([N+](=O)[O-])cc3F)[C@@H]2c2cccnc2)CC1 1810749593 KOQMMFNHPBBVFE-NLFFAJNJSA-N 496.583 5.055 5 20 JKBD Cc1ccc2cc(C(=O)N3CCC([C@@H]4CCCCN4C(=O)c4ccc([N+](=O)[O-])o4)CC3)sc2c1 1823614821 CHFIMYOANCDABO-IBGZPJMESA-N 481.574 5.258 5 20 JKBD C[C@H](Sc1ccccc1)C(=O)N1CCC([C@@H]2CCCCN2C(=O)/C=C/c2ccc([N+](=O)[O-])o2)CC1 1824277473 ZBBJENQTYWGPRF-UEGYMVRISA-N 497.617 5.002 5 20 JKBD Cc1noc(C)c1CSc1ccccc1C(=O)O[C@@H](C)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl 8712717 MFFJTZFPINYWDG-AWEZNQCLSA-N 489.937 5.329 5 20 JKBD COc1cc(C(=O)Nc2nc(-c3cccc4ccccc34)cs2)c([N+](=O)[O-])cc1OC(F)F 10960518 YFWLVBJNBRYECP-UHFFFAOYSA-N 471.441 5.734 5 20 JKBD C[C@@H](OC(=O)c1ccccc1C(=O)c1ccc(Cl)c([N+](=O)[O-])c1)C(=O)NCCC1=CCCCC1 11029242 OXHAEBLOCVIKPS-MRXNPFEDSA-N 484.936 5.031 5 20 JKBD COc1cc(NC(=O)C2CCN(c3ccc(C(F)(F)F)cc3[N+](=O)[O-])CC2)c(OC)cc1Cl 15970466 AOYXWMFJYGDXCI-UHFFFAOYSA-N 487.862 5.139 5 20 JKBD C[C@@H](OC(=O)c1ccc(Br)c([N+](=O)[O-])c1)C(=O)Nc1ccc(Cl)cc1C(F)(F)F 16927552 FUCNEWBPXBIVHC-MRVPVSSYSA-N 495.635 5.214 5 20 JKBD C[C@@H](Sc1nnc2c(Cl)cc(C(F)(F)F)cn12)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 17715056 BUSOKXZEFNQFOS-MRVPVSSYSA-N 470.820 5.213 5 20 JKBD Cc1nc(-c2ccc(F)cc2)sc1C(=O)O[C@@H](C)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl 18017955 NGQDMRMYNWSEPM-NSHDSACASA-N 463.874 5.003 5 20 JKBD Cc1ccc(NC(=O)[C@@H](OC(=O)c2csc(-c3ccc(F)cc3)n2)c2ccccc2)c([N+](=O)[O-])c1 19616566 SLTHTNHPFCANLT-QFIPXVFZSA-N 491.500 5.703 5 20 JKBD O=C(Nc1ccc(CNC(=O)c2cc([N+](=O)[O-])ccc2Sc2ccccc2)cc1)c1ccco1 26729115 SOMZZSGAJGGBTC-UHFFFAOYSA-N 473.510 5.521 5 20 JKBD COc1ccccc1N(C(C)=O)c1nc(COC(=O)c2c3ccccc3cc3ccccc23)cs1 39587576 SGQPONUOBHKFEU-UHFFFAOYSA-N 482.561 6.500 5 20 JKBD O=C(Cc1cccs1)Nc1ccccc1NC(=O)c1ccc(Nc2ccccc2)c([N+](=O)[O-])c1 409976364 KQQFUMMAFIZUHX-UHFFFAOYSA-N 472.526 5.833 5 20 JKBD C[C@H](Cn1ccnc1)NC(=O)c1c2c(nc3ccccc13)/C(=C/c1cccc([N+](=O)[O-])c1)CCC2 481310959 OGOGEYRCLMSGIC-SQVRNEIYSA-N 467.529 5.035 5 20 JKBD O=c1c2c3c(sc2nc(Sc2ccc([N+](=O)[O-])c4cnccc24)n1C[C@@H]1CCCO1)CCCC3 497727644 OMEVSAQTLMXYDP-AWEZNQCLSA-N 494.598 5.123 5 20 JKBD O=C(Nc1ccc(NC(=O)c2cccs2)cc1)c1ccc(NCc2ccccc2)c([N+](=O)[O-])c1 502049140 YTPTYZNDBRBCRT-UHFFFAOYSA-N 472.526 5.773 5 20 JKBD O=C(Nc1ccc(Oc2ccncc2)c(Cl)c1)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-] 504737837 PWCOBVQJAYIWOD-UHFFFAOYSA-N 467.787 5.629 5 20 JKBD CC[C@H](C(=O)N1CCC(NCc2ccc(Oc3ccc(F)cc3)c([N+](=O)[O-])c2)CC1)c1ccccc1 507949166 KFFJSFRPWLGVGO-VWLOTQADSA-N 491.563 5.801 5 20 JKBD C[C@@H](c1ccco1)N(C(=O)Cc1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1)C1CC1 509826155 GDEXJNZDCXCJDQ-SFHVURJKSA-N 456.502 5.335 5 20 JKBD Cn1cnnc1Sc1ccc(C(=O)N(Cc2ccccc2Cl)C2CCCC2)cc1[N+](=O)[O-] 511927844 SRRZIFHRLVTBJO-UHFFFAOYSA-N 471.970 5.113 5 20 JKBD O=C(Cc1csc(Cc2cccc(Cl)c2)n1)Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1 512141854 CWCHBDSYDXNWHU-UHFFFAOYSA-N 470.963 5.600 5 20 JKBD O=C(Nc1cc([N+](=O)[O-])ccc1OC(F)F)c1c(-n2cccc2)sc2c1CCSC2 514501577 SXJDIQKBAIIENT-UHFFFAOYSA-N 451.476 5.090 5 20 JKBD CCN(CC)S(=O)(=O)c1ccc(Oc2ccc(C)cc2)c(NC(=O)c2csc([N+](=O)[O-])c2)c1 514569051 PBNUFJNZBNBUDJ-UHFFFAOYSA-N 489.575 5.040 5 20 JKBD C[C@@H](N[C@H](CCc1ccccc1)c1ccccc1)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 515431932 RHROHHHKSVXUQT-VGOFRKELSA-N 471.479 5.904 5 20 JKBD COCCN(C(=O)[C@@H](C)Sc1ccc(C)cc1)c1nc(-c2ccc([N+](=O)[O-])cc2)cs1 517303163 KEYCNDXYXPCRSN-MRXNPFEDSA-N 457.577 5.187 5 20 JKBD Cc1nc(COc2ccc(NC(=O)c3ccc(SCCC(C)C)c([N+](=O)[O-])c3)cc2)no1 518663874 WKXFVTWCTSMJSL-UHFFFAOYSA-N 456.524 5.256 5 20 JKBD CC[C@H](NCc1ccc(-c2ccccc2[N+](=O)[O-])s1)c1ccccc1OCC(=O)N(C)C 549558493 OTSWURLVGOUXPN-FQEVSTJZSA-N 453.564 5.031 5 20 JKBD COc1ccc(C2(NC(=O)c3ccc(N[C@@H](C)c4ccccn4)c([N+](=O)[O-])c3)CCCC2)cc1 574298224 VHOZYJZRIHTQQU-SFHVURJKSA-N 460.534 5.371 5 20 JKBD O=C(Nc1ccc(C(=O)NC2CC2)cc1)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1 589736506 CBTPLRNVEZHCCQ-UHFFFAOYSA-N 451.866 5.185 5 20 JKBD CC(C)Sc1ccc([N+](=O)[O-])cc1C(=O)N1C[C@H]2CC[C@H]1[C@@H]1CN(Cc3ccccc3)C[C@@H]21 594660286 KFJQJHJRPSMJAY-GOUWZUTHSA-N 465.619 5.078 5 20 JKBD COc1ccc(Oc2ccc([N+](=O)[O-])cc2C(=O)Nc2nnc(-c3ccsc3)s2)cc1 604118823 LKKMYOSDWWODSM-UHFFFAOYSA-N 454.489 5.228 5 20 JKBD C[C@H](Nc1ccc(C(=O)N(C)C[C@@H]2CCCO[C@H]2c2ccccc2)cc1[N+](=O)[O-])c1ccccn1 604519716 QVKKTBVHJPANCR-NHZRIVAWSA-N 474.561 5.403 5 20 JKBD O=[N+]([O-])c1ccc(-c2nn(-c3ccccc3)cc2CNCc2ccnc(Oc3ccccc3)c2)cc1 608836288 BNADQGPXYNNEMR-UHFFFAOYSA-N 477.524 5.925 5 20 JKBD CCCCC1CCC(C(=O)Nc2ccc(CNC(=O)C(=O)Nc3cccc([N+](=O)[O-])c3C)cc2)CC1 608922294 WIQOTBJDPYEJJY-UHFFFAOYSA-N 494.592 5.093 5 20 JKBD C[C@H](NCc1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2n1C(F)F 609006378 BNZWEIGMVNUWRE-KRWDZBQOSA-N 488.498 6.043 5 20 JKBD Cc1ccc(OCc2nc(COC(=O)c3cc([N+](=O)[O-])ccc3Br)cs2)cc1 725985518 LMPUJZOFWMVNGP-UHFFFAOYSA-N 463.309 5.058 5 20 JKBD CCOc1ccccc1NC(=O)[C@H](OC(=O)c1c[nH]c2cc([N+](=O)[O-])ccc12)c1ccccc1 756765206 AHXDWGGFLHHKPU-HSZRJFAPSA-N 459.458 5.012 5 20 JKBD O=[N+]([O-])c1ccc(-c2nc(-c3c(Cl)cccc3Cl)no2)c(I)c1 904309614 FMMBTCVYCZOKHP-UHFFFAOYSA-N 462.030 5.223 5 20 JKBD CCC(CC)c1cc[n+](/C(C(=S)Nc2ccc(Cl)cc2)=C(/O)c2ccc([N+](=O)[O-])cc2)cc1 916204055 BYPPELVJWXENFX-UHFFFAOYSA-O 483.013 6.763 5 20 JKBD COc1cc([C@@H](C)Nc2c([N+](=O)[O-])cc(C(F)(F)F)cc2[N+](=O)[O-])ccc1OCc1ccncc1 917085580 VUOJHRGNMSPATN-CYBMUJFWSA-N 492.410 5.678 5 20 JKBD O=C(Nc1ccc(I)cc1Cl)c1cc([N+](=O)[O-])ccc1N1CCCCC1 918608050 ATDLDCMOYKLBFI-UHFFFAOYSA-N 485.709 5.095 5 20 JKBD C[C@H](OC(=O)c1cc([N+](=O)[O-])ccc1Oc1ccccc1)C(=O)Nc1ncc(Cl)cc1Cl 919191795 DIDXSASOIFSJRW-LBPRGKRZSA-N 476.272 5.273 5 20 JKBD CC[C@H](C)CC(=O)Nc1ccc(C2(NC(=O)Cn3ccc4ccc([N+](=O)[O-])cc43)CCC2)cc1 1786255192 LYESSZJBVRBLPQ-SFHVURJKSA-N 462.550 5.120 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)C3(c4cccc([N+](=O)[O-])c4)CCC3)CCC2)cc1)C12CC(F)(C1)C2 1786424268 PDFNSIFWDGQMFA-UHFFFAOYSA-N 477.536 5.043 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)NC1(c2ccc(NC(=O)c3cnnc4ccccc34)cc2)CCC1 1788959713 VLHRCBMAPDBRMR-UHFFFAOYSA-N 499.502 5.047 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)c3cc([N+](=O)[O-])cc4c3OCC4)CCC2)cc1)c1cc2ccccc2o1 1789004695 RCZSALGQGXJTDD-UHFFFAOYSA-N 497.507 5.337 5 20 JKBD CCSc1cccnc1C(=O)NC1(c2ccc(NC(=O)c3cccc(F)c3[N+](=O)[O-])cc2)CCC1 1790700924 BGGMTDVMUZDCIE-UHFFFAOYSA-N 494.548 5.302 5 20 JKBD COc1cc(C(=O)Nc2ccc(C3(NC(=O)C4(F)CCCCC4)CCC3)cc2)cc([N+](=O)[O-])c1OC 1790815159 PFNURFIBPOGNCA-UHFFFAOYSA-N 499.539 5.032 5 20 JKBD O=C(CC1CCC1)Nc1ccc(C2(NC(=O)c3cccc(Br)c3[N+](=O)[O-])CCC2)cc1 1792271514 CKYZYQIXYQJUCL-UHFFFAOYSA-N 486.366 5.295 5 20 JKBD O=C(/C=C/c1cc2ccccc2o1)Nc1cc([C@@H]2CCCCN2C(=O)Cc2cccc([N+](=O)[O-])c2)[nH]n1 1818811057 VMSNICBZPFXUQA-RGPPVUSESA-N 499.527 5.012 5 20 JKBD O=C(Nc1cc([C@@H]2CCCCN2C(=O)/C=C/c2ccc([N+](=O)[O-])o2)[nH]n1)[C@@H]1CCC[C@@H]2CCCC[C@H]21 1818926831 BVUMPXASHNVPRR-DIWOXLPOSA-N 495.580 5.223 5 20 JKBD Cc1occc1C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cc(Cl)cc([N+](=O)[O-])c2C)CC1 1825909420 IINKESOLMCPQPI-OAQYLSRUSA-N 473.957 5.005 5 20 JKBD Cc1cc(C(=O)N2CCCC[C@H]2C2CCN(C(=O)c3cc(C(C)(C)C)oc3C)CC2)ncc1[N+](=O)[O-] 1827828487 AJCKRZCRKJFRDW-QFIPXVFZSA-N 496.608 5.044 5 20 JKBD Cc1ccc2[nH]c(C(=O)N3CCCC[C@@H]3C3CCN(C(=O)c4cc(F)cc([N+](=O)[O-])c4)CC3)cc2c1 1828123335 PAIHURBHJCQQJR-RUZDIDTESA-N 492.551 5.071 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)N1CCC([C@H]2CCCCN2C(=O)c2ccc(Cl)cc2)CC1 1830028077 RXRZYWCQIMZOEZ-JOCHJYFZSA-N 487.959 5.243 5 20 JKBD Cc1ccc(C(=O)N2CCC([C@@H]3CCCCN3C(=O)c3cccc(F)c3[N+](=O)[O-])CC2)c(Cl)c1 1830622443 JBBLVUSPFVRHGC-QFIPXVFZSA-N 487.959 5.243 5 20 JKBD COc1ccc(Oc2ccc([N+](=O)[O-])cc2C(=O)Nc2ccc(C(=O)Nc3cccnc3)cc2)cc1 24908891 MSEBBMPEVXNMMB-UHFFFAOYSA-N 484.468 5.295 5 20 JKBD O=C(c1cccc([N+](=O)[O-])c1)N(C[C@H]1CCCO1)c1nc(-c2cccc(C(F)(F)F)c2)cs1 26131590 NVRPTYONLQDWNT-GOSISDBHSA-N 477.464 5.563 5 20 JKBD C[C@H](Sc1nnc(-c2ccc(Cl)cc2)n1Cc1ccccc1)C(=O)Nc1ccccc1[N+](=O)[O-] 45266980 KFOLVASNOOYVCT-INIZCTEOSA-N 493.976 5.674 5 20 JKBD O=C(Nc1ccc(NC(=O)c2ccc(NC3CC3)c([N+](=O)[O-])c2)c(C(F)(F)F)c1)c1ccoc1 107888005 MYUHQEOSRWEVNR-UHFFFAOYSA-N 474.395 5.286 5 20 JKBD CCC[C@@H](NC(=O)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1)c1nnc2ccccn12 116458604 HFSTXKDJXJOSQD-GOSISDBHSA-N 465.897 5.354 5 20 JKBD CC(=O)c1ccc(Sc2nnc(-c3ccncc3)n2-c2ccc(Cl)cc2)c([N+](=O)[O-])c1 302917806 SDBUCIJECQIMGH-UHFFFAOYSA-N 451.895 5.245 5 20 JKBD O=C(Cc1ccc([N+](=O)[O-])cc1)N(C[C@H]1CCCO1)c1nc(-c2cccc(C(F)(F)F)c2)cs1 477244589 PKCHPWISPYSYSE-LJQANCHMSA-N 491.491 5.492 5 20 JKBD O=C(Nc1nc2ccccc2n1CCCn1ccnc1)c1cc([N+](=O)[O-])ccc1NCc1ccccc1 485426905 HDVISPNBKJTUCC-UHFFFAOYSA-N 495.543 5.096 5 20 JKBD O=C(Nc1ccc(F)cc1-c1ccc(Cl)cc1)C1CCN(c2ccccc2[N+](=O)[O-])CC1 485813235 FYAHNCBOPOVAEA-UHFFFAOYSA-N 453.901 5.909 5 20 JKBD Cc1nn(C(C)(C)C)c2nc(C(C)C)cc(C(=O)N(Cc3ccccc3[N+](=O)[O-])CC(F)(F)F)c12 486080413 ZCHUESZXMJGVFB-UHFFFAOYSA-N 491.514 5.731 5 20 JKBD O=C(COc1cccc(NC(=O)c2ccc(NCc3ccccc3)c([N+](=O)[O-])c2)c1)Nc1ccccc1 488195907 GARMTUOILKQRRQ-UHFFFAOYSA-N 496.523 5.477 5 20 JKBD COc1ccc([C@H](NC(=O)N[C@@H](C)c2cccc([N+](=O)[O-])c2)c2ccccc2)cc1Br 490268207 CNWFIMMUJPACRS-OYHNWAKOSA-N 484.350 5.516 5 20 JKBD CCn1c(SCc2nc(O)c3c4c(sc3n2)CCCC4)nc2cc3ccccc3cc2c1=O 495114307 AGDPFQBZSNVLKJ-UHFFFAOYSA-N 474.611 5.451 5 20 JKBD O=C(c1ccc(NCc2ccccc2)c([N+](=O)[O-])c1)N1CCO[C@H](c2cccc(Br)c2)C1 500237749 RBZXTENDXQAXKU-QHCPKHFHSA-N 496.361 5.183 5 20 JKBD CC(C)N(CC(=O)Nc1ccc(Cl)cc1C(F)(F)F)C(=O)c1cc2cc([N+](=O)[O-])ccc2s1 504781812 IUKRKVOXAQSZSC-UHFFFAOYSA-N 499.898 5.971 5 20 JKBD COc1ccc(NC(=O)c2ccc(N[C@H](C)c3ccccn3)c([N+](=O)[O-])c2)cc1OCc1ccncc1 506230272 BMKWUFIMRAXWFZ-GOSISDBHSA-N 499.527 5.398 5 20 JKBD O=C(Nc1ccc(CNCc2ccc(Oc3ccccc3Cl)c([N+](=O)[O-])c2)cc1)c1cccnc1 507897913 VWGQQSPNLBPCKX-UHFFFAOYSA-N 488.931 5.978 5 20 JKBD COCCOc1ccccc1NC(=O)c1ccc(Sc2nc3ccccc3s2)c([N+](=O)[O-])c1 512868623 GHVFWVGNYRBERA-UHFFFAOYSA-N 481.555 5.633 5 20 JKBD Cc1ccc([N+](=O)[O-])cc1NC(=O)CSc1nnc(-c2ccccc2)c(-c2ccccc2)n1 513803411 FYRVEUCMIHTZCT-UHFFFAOYSA-N 457.515 5.153 5 20 JKBD CC(C)c1ccc(N(C(=O)CCNC(=O)c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)cc1 514470794 VFVIDMAORQHPAN-UHFFFAOYSA-N 488.569 5.813 5 20 JKBD CC(C)NC(=O)c1ccc(N[C@@H](C)c2cccc(NC(=O)Cc3ccccc3F)c2)c([N+](=O)[O-])c1 515550857 QXTCIVLSLQTQLC-KRWDZBQOSA-N 478.524 5.226 5 20 JKBD O=C(CSc1ccc(C(F)(F)F)cc1[N+](=O)[O-])Nc1ccc(Cl)cc1NC(=O)c1ccco1 516135174 JWQFQRNDGDJYHS-UHFFFAOYSA-N 499.854 5.843 5 20 JKBD CCOC(=O)c1cccc(N(CC)C(=O)c2ccc(N[C@H](C)c3ccccn3)c([N+](=O)[O-])c2)c1 516629393 JAMKBNHDYDLSKY-QGZVFWFLSA-N 462.506 5.006 5 20 JKBD O=C(CSc1ccc(C(F)(F)F)cc1[N+](=O)[O-])N(Cc1cscn1)c1ccccc1 518696621 GXCMCQIELGBCKN-UHFFFAOYSA-N 453.467 5.396 5 20 JKBD C[C@@H](NC(=O)Nc1ccc2c(c1)CCC(=O)N2Cc1ccc(Cl)cc1)c1cccc([N+](=O)[O-])c1 519501110 ILDVOIIPEYUCFI-MRXNPFEDSA-N 478.936 5.610 5 20 JKBD COc1ccc(Sc2ccc(NC(=O)c3cc(OC)c(OC)cc3[N+](=O)[O-])cc2Cl)cc1 519976276 GPUAFOOSVTUSER-UHFFFAOYSA-N 474.922 5.678 5 20 JKBD CC[C@@H](NCc1ccc(Oc2cc(C)ccc2C(C)C)c([N+](=O)[O-])c1)c1nnc2n1CCCCC2 521831876 UTAPSCLGRPOIEJ-JOCHJYFZSA-N 477.609 6.378 5 20 JKBD Cc1ccc(S(=O)(=O)Nc2ccc(NC(=O)c3occc3-c3ccccc3)cc2)cc1[N+](=O)[O-] 594668833 NNZAJXGHJLTEBE-UHFFFAOYSA-N 477.498 5.216 5 20 JKBD CCOc1ccc(Oc2ccccc2NC(=O)C2CCN(c3ccccc3[N+](=O)[O-])CC2)cc1 603461526 MDMOPXKFAJYGHU-UHFFFAOYSA-N 461.518 5.641 5 20 JKBD CN(Cc1nc(-c2cccc([N+](=O)[O-])c2)no1)[C@@H]1CCSc2ccc(Br)cc21 609157487 VKVRKALWFGBSCM-MRXNPFEDSA-N 461.341 5.076 5 20 JKBD Cn1c(S[C@@H](C(=O)NCc2ccccc2)c2ccccc2)nc2cc3ccccc3cc2c1=O 677801562 VEEJJJQMRAHEKC-RUZDIDTESA-N 465.578 5.237 5 20 JKBD CCCc1cc[n+](/C(C(=S)Nc2ccc(OC(C)C)cc2)=C(/O)c2cccc([N+](=O)[O-])c2)cc1 726573960 KDTSMJVHKCUZPO-UHFFFAOYSA-O 478.594 5.945 5 20 JKBD C[C@H]1C[C@@H](C)CN(c2ccc(C(=O)O[C@H](C)c3nnc(-c4cccs4)o3)cc2[N+](=O)[O-])C1 745930534 OPBFYERZOZFJKX-QLFBSQMISA-N 456.524 5.107 5 20 JKBD O=C(OCc1csc(Cc2ccc(Cl)cc2)n1)c1csc(-c2cccc([N+](=O)[O-])c2)n1 747961574 FKTMQFKLDJJAMO-UHFFFAOYSA-N 471.947 5.776 5 20 JKBD Cc1cc(C(=O)Nc2cc(Cl)c([N+](=O)[O-])cc2OCc2ccccc2)c2cnn(C(C)C)c2n1 786664333 ZJRWBRIDFOWCPP-UHFFFAOYSA-N 479.924 5.714 5 20 JKBD Cc1c(C(=O)Nc2cc(Cl)c([N+](=O)[O-])cc2OCc2ccccc2)oc2c1C(=O)CCC2 915827750 GZJJDSYQZJQWDC-UHFFFAOYSA-N 454.866 5.500 5 20 JKBD Cc1ccc(C(=O)N2C[C@H](C)C[C@@H](C)C2)cc1NC(=O)c1cc([N+](=O)[O-])ccc1N1CCCCC1 917742049 OSSKRGHIAWWKNT-RTBURBONSA-N 478.593 5.264 5 20 JKBD CCn1c(SCC(=O)Nc2ccc(N3CCCCC3)cc2)nc2cc3ccccc3cc2c1=O 918028738 OOOIKRNQMQBGKD-UHFFFAOYSA-N 472.614 5.291 5 20 JKBD Cc1cc(/C=C\C(=O)OCc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)c(C)n1C1CCCCC1 918035802 HJWBJMNLTYREFM-RAXLEYEMSA-N 450.495 5.325 5 20 JKBD Cc1ccnc2sc(C(=O)N3CCCC[C@@H]3CCOC(=O)c3cccc([N+](=O)[O-])c3)c(C)c12 918633608 PRNQWXOOMSVAQR-GOSISDBHSA-N 467.547 5.063 5 20 JKBD O=C(/C=C/c1ccc([N+](=O)[O-])o1)Nc1ccc(C2(NC(=O)c3ccc4occc4c3)CCC2)cc1 1786207513 UAAAWXNEJXDSTO-JXMROGBWSA-N 471.469 5.395 5 20 JKBD Cc1nc2ccccn2c1C(=O)Nc1ccc(C2(NC(=O)/C=C/c3ccccc3[N+](=O)[O-])CCC2)cc1 1788928991 RXOXJXREAQUHOC-XNTDXEJSSA-N 495.539 5.012 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)c3cccc4ccncc34)CCC2)cc1)c1ccc([N+](=O)[O-])cc1F 1790625782 NUWLESDSSNXFKJ-UHFFFAOYSA-N 484.487 5.344 5 20 JKBD Cc1cc2[nH]c(C(=O)Nc3ccc(C4(NC(=O)c5cc(O)cc([N+](=O)[O-])c5)CCC4)cc3)cc2s1 1790881122 JBVGUEDFPVQIKW-UHFFFAOYSA-N 490.541 5.213 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)c3cc([N+](=O)[O-])cc4c3OCC4)CCC2)cc1)c1ccc2ccoc2c1 1790892425 KWHAJGVFUQOKJZ-UHFFFAOYSA-N 497.507 5.337 5 20 JKBD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccccc1CSc1ccccc1)c1ccc([N+](=O)[O-])o1 1800665662 DREMFTILPLOVNJ-ACDBMABISA-N 491.569 5.046 5 20 JKBD CC(C)[C@@H](C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cc(F)cc([N+](=O)[O-])c2)n[nH]1)c1ccccc1 1821163887 YQWRGXZBVZEQIW-LADGPHEKSA-N 493.539 5.203 5 20 JKBD Cc1cc(Cl)cc(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)c3cc(F)cc([N+](=O)[O-])c3)n[nH]2)c1 1821169347 VMVGBBNZVQCWFN-HXUWFJFHSA-N 485.903 5.039 5 20 JKBD Cc1cc(Cl)cc(C(=O)N2CCCC[C@H]2c2cc(NC(=O)c3cccc(F)c3[N+](=O)[O-])n[nH]2)c1 1821175267 ZDIMDPUBOKFYIS-IBGZPJMESA-N 485.903 5.039 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cccc3cc[nH]c23)CC1 1830733929 SAQJEUBPTCQSGF-HSZRJFAPSA-N 492.551 5.071 5 20 JKBD Cc1ccc([C@@H](C)C(=O)N2CCC([C@H]3CCCCN3C(=O)Cc3cc(F)ccc3[N+](=O)[O-])CC2)cc1 1832888113 FJMZFVWIPCRPSF-CJFMBICVSA-N 495.595 5.008 5 20 JKBD C[C@H](OC(=O)c1cc([N+](=O)[O-])ccc1Cl)C(=O)N1c2ccccc2Sc2ccccc21 22495199 YRHHFTXGCRFFFV-ZDUSSCGKSA-N 454.891 5.623 5 20 JKBD CCOC(=O)c1sc2ncnc(Oc3ccc(NC(=O)c4cccc([N+](=O)[O-])c4)cc3)c2c1C 23744384 YGDANHNJMVDSHF-UHFFFAOYSA-N 478.486 5.129 5 20 JKBD Cc1ccc([N+](=O)[O-])cc1NC(=O)COC(=O)c1sc(-c2ccc(C(F)(F)F)cc2)nc1C 25663667 POUCCRVOJSTZAS-UHFFFAOYSA-N 479.436 5.149 5 20 JKBD CCn1c(S[C@@H](C(=O)Nc2ccccc2OC)C(C)C)nc2cc3ccccc3cc2c1=O 31747586 PROPBRZASHZPLX-HSZRJFAPSA-N 461.587 5.334 5 20 JKBD COc1ccc(Oc2ccc([N+](=O)[O-])cc2C(=O)N[C@H](C)c2ccc(NC(=O)C3CC3)cc2)cc1 33019197 JDIYOKGZCHPBKB-MRXNPFEDSA-N 475.501 5.235 5 20 JKBD Cc1ccc(-c2noc([C@@H](C)N3CCN(C(=O)c4cc5ccccc5c5cccnc45)CC3)n2)cc1 108089119 LYPCWAWCIGQFCR-HXUWFJFHSA-N 477.568 5.265 5 20 JKBD O=C(N[C@@H](c1ccccc1)c1ccncc1)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 247314151 JNJSOZASQIZMAA-QHCPKHFHSA-N 484.478 5.131 5 20 JKBD O=[N+]([O-])c1cc(Cl)ccc1Oc1ccc(CN[C@@H](c2ccccc2)c2nccs2)cc1 507912528 HBYGEMPIEIDHMQ-QFIPXVFZSA-N 451.935 6.376 5 20 JKBD Cc1c(NC(=O)c2ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])cc2)cccc1C(=O)N1CCOCC1 509814481 KVCMQVPOICPUGR-UHFFFAOYSA-N 495.919 5.074 5 20 JKBD CSc1ccc(C(=O)c2ccccc2C(=O)Nc2ccc(-c3cnco3)cc2)cc1[N+](=O)[O-] 511229504 QLWBGMYLDQCPJW-UHFFFAOYSA-N 459.483 5.455 5 20 JKBD O=C(Nc1ccccc1)c1ccc(Cl)c(NC(=O)c2ccc(N3CCCC3)c([N+](=O)[O-])c2)c1 512311840 ABPVRAZHMALZNZ-UHFFFAOYSA-N 464.909 5.353 5 20 JKBD CCc1ccc(CN(C(=O)c2cc(OC)c(OCc3cscn3)cc2[N+](=O)[O-])C2CC2)cc1 512444683 REBXYCCYGOMGOX-UHFFFAOYSA-N 467.547 5.006 5 20 JKBD COc1ccc(-c2cc(NC(=O)c3cc(OC)ccc3[N+](=O)[O-])n(-c3cccc(C)c3)n2)cc1 516758154 RWRLCGFNDNVIPQ-UHFFFAOYSA-N 458.474 5.025 5 20 JKBD O=C(Nc1nc2cc(F)c(F)cc2s1)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 520337038 DEKSIJWZJCEKRL-UHFFFAOYSA-N 486.422 5.357 5 20 JKBD CO[C@H](C)C(=O)Nc1cccc(N[C@@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2ccccc2)c1 520466937 KLLPEUHUKFSONY-IVZQSRNASA-N 482.924 5.014 5 20 JKBD Cc1ccc(NC(=O)c2cccc(C(F)(F)F)c2)cc1NC(=O)c1cc([N+](=O)[O-])ccc1C 520725837 BFUWHJWUSQUTIC-UHFFFAOYSA-N 457.408 5.735 5 20 JKBD CCOC(=O)c1sc(-c2cccc([N+](=O)[O-])c2)cc1NC(=O)c1sccc1Br 603730991 WBVMDUMCTIHWKM-UHFFFAOYSA-N 481.349 5.576 5 20 JKBD Cc1c(NC(=O)c2ccc(N3CCC[C@@H](C)C3)c([N+](=O)[O-])c2)cccc1-c1nnc2n1CCCCC2 603962177 JKBOVPISLZYCAW-GOSISDBHSA-N 488.592 5.377 5 20 JKBD Cc1cc(C(=O)NC2CCCCC2)ccc1NC(=O)c1ccc(Cn2nc(C)c([N+](=O)[O-])c2C)cc1 603970275 PDCIYBNHGUKPDX-UHFFFAOYSA-N 489.576 5.080 5 20 JKBD COc1ccc(CNC(=O)Nc2cccc(C(=O)Nc3cccc(C(F)(F)F)c3)c2)cc1[N+](=O)[O-] 604082819 ASMBAMBOUXNSJQ-UHFFFAOYSA-N 488.422 5.196 5 20 JKBD Cn1ccnc1[C@@H](NCc1ccc(-c2ccc([N+](=O)[O-])cc2Br)o1)c1ccccc1 608835594 AZPOWGRARPVHGC-NRFANRHFSA-N 467.323 5.230 5 20 JKBD CCOc1cc(CNCc2ccc(-c3ccc([N+](=O)[O-])cc3Br)o2)ccc1OC(F)F 608836042 IFYVYXQVQDEPLH-UHFFFAOYSA-N 497.292 5.907 5 20 JKBD COc1ccccc1[C@@H](C)CC(=O)O[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1 728657704 CKHQXOPJYSUNMX-FYSMJZIKSA-N 482.920 5.674 5 20 JKBD COc1ccc(NC(=O)[C@@H](C)OC(=O)Cc2c(C)nc3ccccc3c2-c2ccccc2)c([N+](=O)[O-])c1 729235790 UPQJBNNEUGRXNW-GOSISDBHSA-N 499.523 5.240 5 20 JKBD COc1cc(C(=O)N[C@H](Cn2ccnc2)C(C)(C)C)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 729343741 ZINDQOXZUFNNKT-OAQYLSRUSA-N 472.929 5.090 5 20 JKBD Cc1c(C(=O)Nc2ccc(NC(=O)OC(C)(C)C)cc2C(F)(F)F)cc([N+](=O)[O-])cc1[N+](=O)[O-] 729658409 YVYQCEXQLBNFLB-UHFFFAOYSA-N 484.387 5.430 5 20 JKBD O=C(Nc1ccc2c(c1)CCC(=O)N2Cc1ccc(Cl)cc1)c1cc([N+](=O)[O-])ccc1F 743714558 CODPFFPQIBVJCE-UHFFFAOYSA-N 453.857 5.119 5 20 JKBD CC[C@H](C)Sc1ccc(NC(=O)c2cc([N+](=O)[O-])c(C)c([N+](=O)[O-])c2)c(C(F)(F)F)c1 748658180 RGIHZCKFJWMTGL-JTQLQIEISA-N 457.430 5.973 5 20 JKBD CCOC(=O)c1c(-c2ccc(F)cc2)csc1NC(=O)c1cc(OC)c(OCC)cc1[N+](=O)[O-] 750548420 CXMLBQYMVQEUKZ-UHFFFAOYSA-N 488.493 5.299 5 20 JKBD O=C(Nc1ccc(NC(=O)c2cc(Cl)ccc2[N+](=O)[O-])c(C(F)(F)F)c1)c1ccco1 836832262 XKUFVFNQDOMTFD-UHFFFAOYSA-N 453.760 5.365 5 20 JKBD COc1ccc(C)cc1NC(=O)COC(=O)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1 849192533 YDCJFIUKBHZARB-UHFFFAOYSA-N 470.865 5.153 5 20 JKBD CCOc1cc(NC(=O)c2ccccc2)c(OCC)cc1NC(=O)/C=C\c1ccc([N+](=O)[O-])cc1 892021817 NXJMGPMTQCSVTH-QINSGFPZSA-N 475.501 5.296 5 20 JKBD CC(C)(C)OC(=O)N1CCc2nc(NC(=O)c3cc4ccccc4c4cccnc34)sc2C1 915839666 IFPWTPPLFPUBIZ-UHFFFAOYSA-N 460.559 5.390 5 20 JKBD Cc1cccc(C2(C(=O)Oc3ccc(NC(=O)c4cc([N+](=O)[O-])ccc4Cl)cc3)CC2)c1 919679525 UYOSMRCXNXLRBU-UHFFFAOYSA-N 450.878 5.446 5 20 JKBD Cc1ccc(NC(=O)CS[C@@H](C)C(=O)Oc2ccc(-c3ccccc3)cc2[N+](=O)[O-])cc1 920330378 BICNDWPLQMRNHA-KRWDZBQOSA-N 450.516 5.236 5 20 JKBD CC(C)N(Cc1nnc(-c2cccc([N+](=O)[O-])c2)o1)C(=O)c1ccc(C2SCCCS2)cc1 921194944 SCIGZAOTAPPUJQ-UHFFFAOYSA-N 484.603 5.564 5 20 JKBD CCc1noc(C)c1C(=O)Nc1ccc(C2(NC(=O)Cc3ccc(Cl)cc3[N+](=O)[O-])CCC2)cc1 1789812190 RCKPOCUUJXMFJS-UHFFFAOYSA-N 496.951 5.097 5 20 JKBD COc1ccc(CC(=O)Nc2ccc(C3(NC(=O)[C@H]4C[C@@H]4c4ccccc4)CCC3)cc2)c([N+](=O)[O-])c1 1790572416 ZTRVMYKMWVTEBT-RPBOFIJWSA-N 499.567 5.084 5 20 JKBD COc1ccc(CC(=O)Nc2ccc(C3(NC(=O)[C@H](C)c4ccccc4)CCC3)cc2)c([N+](=O)[O-])c1 1790573998 QJOZGSOICPQEQD-LJQANCHMSA-N 487.556 5.084 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)Nc1ccc(C2(NC(=O)c3ccc4cnccc4n3)CCC2)cc1 1790770703 MBHQHIIMLKENRX-UHFFFAOYSA-N 499.502 5.047 5 20 JKBD O=C(NC1(c2ccc(NC(=O)c3cc4ccsc4[nH]3)cc2)CCC1)c1cc(F)cc([N+](=O)[O-])c1 1790877195 LOIYKHXWSCGQKV-UHFFFAOYSA-N 478.505 5.338 5 20 JKBD Cc1c(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)/C=C\c2c[nH]c4ccccc24)C3)cc(Cl)cc1[N+](=O)[O-] 1800713092 POFKNKULYUXQKO-NGSSCAIFSA-N 492.963 5.003 5 20 JKBD Cc1cc(C)cc(CCC(=O)N2CCCC[C@@H]2C2CCN(C(=O)/C=C/c3ccc([N+](=O)[O-])o3)CC2)c1 1832041209 BZZRWGKFTYZXAB-CZNRWDAFSA-N 493.604 5.070 5 20 JKBD O=C(c1cc2cc([N+](=O)[O-])ccc2s1)N1CC2(CCCN2C(=O)c2ccc(Cl)c(Cl)c2)C1 1844906180 KZLKSWWWMDXEOY-UHFFFAOYSA-N 490.368 5.247 5 20 JKBD O=[N+]([O-])c1cc2c(c(CSc3nnc(Cc4ccccc4)n3-c3ccc(Cl)cc3)c1)OCOC2 9570515 OZEXQMPTDKCWGW-UHFFFAOYSA-N 494.960 5.579 5 20 JKBD C[C@H](OC(=O)Cn1c2ccccc2c(=O)c2ccccc21)c1nc(-c2cccc(C(F)(F)F)c2)no1 10723572 ANMUOWQVAJGKRV-HNNXBMFYSA-N 493.441 5.528 5 20 JKBD C[C@@H](OC(=O)c1cc(Cl)cc(Cl)c1)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 11117829 SVXHFXXKUUPHRD-MRVPVSSYSA-N 451.184 5.104 5 20 JKBD Cc1ccccc1-c1cc(C(=O)O[C@H](C)C(=O)Nc2ccccc2[N+](=O)[O-])c2cnn(C(C)C)c2n1 14362369 XSEJXLVZTXDNPG-QGZVFWFLSA-N 487.516 5.080 5 20 JKBD C[C@H](Sc1nnc(-c2ccccc2)n1-c1ccccc1)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 17899352 MYXJQBYSOXOOGU-INIZCTEOSA-N 470.514 5.746 5 20 JKBD O=C(OCc1nnc(-c2ccc([N+](=O)[O-])cc2)o1)c1ccccc1CSc1nc2ccccc2o1 104510459 CJRUKEVMTLSQHD-UHFFFAOYSA-N 488.481 5.435 5 20 JKBD Cc1ccc(Br)cc1NC(=O)c1ccc(N[C@@H](C)c2ccccn2)c([N+](=O)[O-])c1 108830499 HXFKJLPDDXIZSE-AWEZNQCLSA-N 455.312 5.486 5 20 JKBD COc1cc(C(=O)Nc2nc(-c3ccc(OC(F)F)cc3)cs2)c([N+](=O)[O-])cc1OC(F)F 482776160 MAPRRDAITVUUTD-UHFFFAOYSA-N 487.387 5.182 5 20 JKBD O=C(NCc1cscn1)c1c2c(nc3ccccc13)/C(=C/c1cccc([N+](=O)[O-])c1)CCC2 495563867 RAYGJFQHFSILDZ-GZTJUZNOSA-N 456.527 5.406 5 20 JKBD CC(C)CN1CCC(NC(=O)C/C(=C\c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)CC1 502625609 LWTNLRPGGYIGLA-HMMYKYKNSA-N 478.618 5.372 5 20 JKBD CSc1ccc(C(=O)NCc2ccccc2-c2ccc(Cn3ccnc3)cc2)cc1[N+](=O)[O-] 504781867 JIHLAGIKSYCJCM-UHFFFAOYSA-N 458.543 5.159 5 20 JKBD CC(=O)N(c1ccc(F)cc1)c1nc(CSc2nc3cc4ccccc4cc3c(=O)n2C)cs1 515604503 IKYXHEKLJZAHSX-UHFFFAOYSA-N 490.585 5.659 5 20 JKBD COc1cccc(OC)c1Oc1ccc(CNC(=O)c2cc3ccccc3c3cccnc23)cn1 515642872 TZFYNXXDFWCDNB-UHFFFAOYSA-N 465.509 5.523 5 20 JKBD Cc1nn(Cc2ccc(C(=O)N3CC=C(c4cccc5ccccc45)CC3)cc2)c(C)c1[N+](=O)[O-] 520094884 CUQTUGRPKXVZCW-UHFFFAOYSA-N 466.541 5.539 5 20 JKBD COc1cc([C@@H](C)Nc2ccc(Br)cc2[N+](=O)[O-])ccc1OCc1ccncc1 549782382 PGQTTYWIXIBPDN-CQSZACIVSA-N 458.312 5.513 5 20 JKBD O=C1c2ccccc2N[C@H](c2ccc(Oc3cccc([N+](=O)[O-])c3)cc2)N1Cc1cccnc1 602757366 JZJVLHAPCCSPKP-VWLOTQADSA-N 452.470 5.549 5 20 JKBD Cc1nn(C)c(C)c1CCNC(=O)c1ccccc1Sc1ccc(C(F)(F)F)cc1[N+](=O)[O-] 603573675 CRYWEGRVMJEYOW-UHFFFAOYSA-N 478.496 5.088 5 20 JKBD O=C(Nc1nccs1)c1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2Oc2ccccc2)cc1 603738624 AHUZMXKIBFZCRM-UHFFFAOYSA-N 460.471 5.348 5 20 JKBD CCOc1cc(C(=O)Nc2cc(NC(=O)Nc3ccccc3)ccc2C)c([N+](=O)[O-])cc1OC 603742737 LYXAPFDMLBSEHV-UHFFFAOYSA-N 464.478 5.207 5 20 JKBD C[C@@H]1CCN(C(=O)c2ccc(-n3ccnc3)c([N+](=O)[O-])c2)c2cc(C(F)(F)F)ccc2S1 603961956 QPWFXBWRDKVWME-CYBMUJFWSA-N 462.453 5.330 5 20 JKBD C[C@H](Nc1ccc(C(=O)NCC2(c3cccc(C(F)(F)F)c3)CC2)cc1[N+](=O)[O-])c1ccccn1 608948367 GTHPWDATPMLDJI-INIZCTEOSA-N 484.478 5.643 5 20 JKBD CCN1CCC(n2nccc2NCc2ccc(Oc3ccccc3Cl)c([N+](=O)[O-])c2)CC1 608982406 DCQIBBNADBYIGB-UHFFFAOYSA-N 455.946 5.506 5 20 JKBD C[C@@H](NCc1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2n1C(F)F 609006379 BNZWEIGMVNUWRE-QGZVFWFLSA-N 488.498 6.043 5 20 JKBD O=C(CSc1ccc(C(F)(F)F)cc1[N+](=O)[O-])N1CCC(c2nc(-c3ccccc3)no2)CC1 609141812 MEHPYEXWCFSJJC-UHFFFAOYSA-N 492.479 5.162 5 20 JKBD Cc1cc(OCc2cccc(F)c2)ccc1NC(=O)c1cc([N+](=O)[O-])ccc1Br 728006533 MCUVXINSJVSGFK-UHFFFAOYSA-N 459.271 5.636 5 20 JKBD CN(Cc1cc([N+](=O)[O-])ccc1Cl)C(=O)CC[C@@H](NC(=O)OC(C)(C)C)c1ccccc1 729306715 AJNMFDFLBFTXKU-HXUWFJFHSA-N 461.946 5.253 5 20 JKBD Cc1ccc(NC(=O)[C@H](C)OC(=O)Cc2cn(-c3ccccc3)nc2-c2ccc([N+](=O)[O-])cc2)c(C)c1 729847814 VZBCYWPGEARAKW-FQEVSTJZSA-N 498.539 5.177 5 20 JKBD O=C(OCc1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[C@@H](Oc1ccc(F)c(Cl)c1)c1ccccc1 730646410 UEZIGYATEQMGGY-NRFANRHFSA-N 483.839 5.301 5 20 JKBD O=C(Nc1ccccc1C(=O)NCc1csc(Br)c1)c1ccc([N+](=O)[O-])cc1Cl 915201399 OGYPZNBDYPSYEG-UHFFFAOYSA-N 494.754 5.255 5 20 JKBD CSc1ccc([N+](=O)[O-])c(C(=O)O[C@@H](C(=O)Nc2ccccc2C(F)(F)F)C(C)C)c1 915374416 IMHMSRNKLOZHJE-QGZVFWFLSA-N 456.442 5.156 5 20 JKBD O=C(OCC[C@@H]1CCCCN1C(=O)c1ccc(C2SCCS2)cc1)c1cccc([N+](=O)[O-])c1 916690421 QDFZAAJXRWSDAR-FQEVSTJZSA-N 486.615 5.315 5 20 JKBD C[C@@H](C(=O)Nc1ccc(C2(NC(=O)c3ccc([N+](=O)[O-])o3)CCC2)cc1)c1ccc(Cl)cc1 1785986764 BDFIZKSYBJEFKB-OAHLLOKOSA-N 467.909 5.393 5 20 JKBD O=C(Cc1ccc([N+](=O)[O-])cc1F)Nc1ccc(C2(NC(=O)CCCC(F)(F)F)CCC2)cc1 1791183817 KPTMLZAERBDAQK-UHFFFAOYSA-N 481.446 5.143 5 20 JKBD O=C(CSc1ccccc1[N+](=O)[O-])Nc1ccc(C2(NC(=O)C3(C(F)(F)F)CC3)CCC2)cc1 1791522489 YEQACGPVZLUVFE-UHFFFAOYSA-N 493.507 5.164 5 20 JKBD CC(C)c1ccc(C(=O)N2CCC([C@@H]3CCCCN3C(=O)/C=C/c3ccc([N+](=O)[O-])o3)CC2)cc1 1824276521 VIWVDKZUVJUAIY-YKATVRGKSA-N 479.577 5.258 5 20 JKBD Cc1cc(Cl)ccc1C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cccc(F)c2[N+](=O)[O-])CC1 1830616820 PGMLZBORVDWUNN-QFIPXVFZSA-N 487.959 5.243 5 20 JKBD O=C(c1ccc(F)cc1)N1CCC([C@H]2CCCCN2C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)CC1 1831061722 XWHOVXKNKPAUQM-JOCHJYFZSA-N 495.576 5.496 5 20 JKBD C[C@@H](OC(=O)C1(c2ccc(F)cc2)CCCC1)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 10799447 SHWZKGUNVXARAB-CYBMUJFWSA-N 468.403 5.135 5 20 JKBD Cc1sc2ncnc(N3CCC(C(=O)Nc4nc(-c5cccc([N+](=O)[O-])c5)cs4)CC3)c2c1C 22400047 AYMPCJVRVNLXBZ-UHFFFAOYSA-N 494.602 5.195 5 20 JKBD CCOC(=O)c1cc(C(=O)O[C@@H](C)C(=O)N2c3ccccc3Sc3ccccc32)cc([N+](=O)[O-])c1 22437645 AICUKEPVXJQQCZ-HNNXBMFYSA-N 492.509 5.146 5 20 JKBD CC(C)c1ccc(CSc2nnc(SCc3nnc(-c4ccc([N+](=O)[O-])cc4)o3)s2)cc1 22532505 CKINZNHBDGCQMF-UHFFFAOYSA-N 485.616 6.204 5 20 JKBD O=C(/C=C/c1cnc2ccccc2n1)O[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1 23647909 DGAIXJKQJUIYKU-XOJVXBCLSA-N 488.887 5.128 5 20 JKBD CSc1ccc(C(=O)c2ccccc2C(=O)N(C)Cc2cnn(-c3ccccc3)c2)cc1[N+](=O)[O-] 26324860 RSBYFOBSHDBFMG-UHFFFAOYSA-N 486.553 5.006 5 20 JKBD Cn1c(S[C@H](C(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)c2ccccc2)nc2sccc2c1=O 28607537 UMWLFMWRGQAZMD-KRWDZBQOSA-N 486.962 5.029 5 20 JKBD COc1ccccc1NS(=O)(=O)c1cc([N+](=O)[O-])ccc1N[C@@H]1CCSc2c(F)cccc21 29621948 ZAPZIHPSYYEJQB-QGZVFWFLSA-N 489.550 5.192 5 20 JKBD COc1ccc([N+](=O)[O-])c(C(=O)Nc2ccc(COc3ccc(Br)cc3)cc2)c1 410030341 OJWMWOADLCLCIH-UHFFFAOYSA-N 457.280 5.197 5 20 JKBD COc1ccc(CNC(=O)C/C(=C\c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)c(OC)c1 498872026 LMFMNSRXLYYSAZ-CPNJWEJPSA-N 489.553 5.469 5 20 JKBD CC[C@H](C)Sc1ccc(NC(=O)c2cc(OC)c(OC(F)F)cc2[N+](=O)[O-])c(C(F)(F)F)c1 499586324 DHYPDISGLPGPMZ-JTQLQIEISA-N 494.438 6.367 5 20 JKBD C[C@@H](Nc1ccc(NC(=O)c2cccs2)cc1)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 501989293 NEWZMBYTRFFUOF-GFCCVEGCSA-N 478.452 5.367 5 20 JKBD CCOc1cc([N+](=O)[O-])c(C(=O)N[C@H](C)c2sc(-c3ccc(C)cc3)nc2C)cc1OC 502411507 BFSLZHSFYAFYOD-CQSZACIVSA-N 455.536 5.233 5 20 JKBD COc1ccc(C2(CNC(=O)c3cc([N+](=O)[O-])ccc3Sc3ccccc3)CCOCC2)cc1 510177634 USHMSRLKGJJSNK-UHFFFAOYSA-N 478.570 5.233 5 20 JKBD Cc1ccn2cc(CNC(=O)C/C(=C/c3ccc([N+](=O)[O-])cc3)c3nc4ccccc4s3)nc2c1 512694406 VHTFXGOADQLQBA-UYRXBGFRSA-N 483.553 5.408 5 20 JKBD COc1cc(C)ccc1Oc1ccc(F)cc1NC(=O)c1ccc(-n2ccnc2)c([N+](=O)[O-])c1 512816993 JVXZMLJWIGLWSV-UHFFFAOYSA-N 462.437 5.281 5 20 JKBD CCCNC(=O)c1cccc(CNC(=O)c2ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])c(OC)c2)c1 514577075 ZSKRFGZLCGSEJR-UHFFFAOYSA-N 497.935 5.119 5 20 JKBD COc1ccc(CN[C@@H]2CCSc3c(F)cccc32)cc1OCc1ccc([N+](=O)[O-])cc1 517538161 NXWMCAAYTJVVAJ-OAQYLSRUSA-N 454.523 5.648 5 20 JKBD Cn1cnnc1Sc1ccc(C(=O)Nc2ccccc2Oc2ccc(Cl)cc2)cc1[N+](=O)[O-] 518654287 PRNFNCXMVANQLP-UHFFFAOYSA-N 481.921 5.573 5 20 JKBD O=C(Nc1ccc(SCc2cccnc2)cc1)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-] 603732885 CFLVQHWEBLQHJU-UHFFFAOYSA-N 463.437 5.476 5 20 JKBD Cc1ccc(NS(=O)(=O)c2ccc(N[C@@H](C)c3ccc4c(c3)CCC(=O)N4)c([N+](=O)[O-])c2)c(C)c1 603863945 YIEPGMZGJOGHSW-KRWDZBQOSA-N 494.573 5.070 5 20 JKBD O=C(Nc1ccc(Cl)c(S(=O)(=O)Nc2ccccc2Cl)c1)c1ccc([N+](=O)[O-])cc1F 604033756 XQIIGQDSTLPJDT-UHFFFAOYSA-N 484.292 5.094 5 20 JKBD Cc1ccc(C(=O)N2C[C@@H](C)C[C@@H](C)C2)cc1NC(=O)[C@@H](C)Oc1ccc(Cl)cc1[N+](=O)[O-] 604443680 KJUSQDGPFWLESI-HLLBOEOZSA-N 473.957 5.081 5 20 JKBD Cc1sc(C(=O)Nc2ccccc2OCc2ncc(-c3cccc(Cl)c3)o2)cc1[N+](=O)[O-] 608851227 WEXQQPXTLLYEKZ-UHFFFAOYSA-N 469.906 6.104 5 20 JKBD Cc1oc(-c2ccsc2)nc1CC(=O)Oc1ccc(NC(=O)c2cccc([N+](=O)[O-])c2)cc1 726911366 MPDFSXPUJNGJDU-UHFFFAOYSA-N 463.471 5.020 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)Nc2ccc3c(c2)CCCN3C(=O)OC(C)(C)C)cc1SC 729411910 GEPNJMDEQADBMI-UHFFFAOYSA-N 473.551 5.265 5 20 JKBD Cc1ccc(NC(=O)c2ccc(N3CCC([C@H](O)c4ccc(F)cc4)CC3)c([N+](=O)[O-])c2)cc1 731028101 DFJSCZNDTWIHLW-RUZDIDTESA-N 463.509 5.245 5 20 JKBD O=C(COC(=O)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1)c1ccc2c(c1)COC2 746542170 KVWKBSJWLPXNBS-UHFFFAOYSA-N 453.834 5.110 5 20 JKBD C[C@H](OC(=O)c1csc(-c2cccc([N+](=O)[O-])c2)n1)C(=O)Nc1ccc(Cl)cc1C(F)(F)F 747961020 CTCSUICKIIKBLX-JTQLQIEISA-N 499.854 5.575 5 20 JKBD COc1ccc(Cl)c(C(=O)O[C@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2ccccc2)c1N 750228466 JLWRBWBFYZFYPQ-FQEVSTJZSA-N 490.299 5.029 5 20 JKBD COc1cc([C@@H](C)NC(=O)c2cc([N+](=O)[O-])ccc2Br)ccc1OC1CCCC1 751085623 ADUGVOHXORMCKL-CYBMUJFWSA-N 463.328 5.178 5 20 JKBD O=C(Nc1cc(Cl)ccc1Cl)[C@@H]1CCCCN1C(=O)c1cc(Cl)ccc1[N+](=O)[O-] 751244985 BMOXCLZNGJHWQX-KRWDZBQOSA-N 456.713 5.188 5 20 JKBD CCOc1ccc(NC(=O)c2ccccc2NC(=O)c2ccc([N+](=O)[O-])cc2Cl)cc1OC 916562767 BGFDQSLYMHAZKH-UHFFFAOYSA-N 469.881 5.160 5 20 JKBD C[C@H](OC(=O)CCCc1c[nH]c2ccccc12)C(=O)Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1 916582037 XXVHJSPYOJNGHD-HNNXBMFYSA-N 478.530 5.093 5 20 JKBD CCOC(=O)C[C@H](c1ccccc1)C1CCN(C(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)CC1 916706305 UWDONGLRYCDMHT-LJQANCHMSA-N 459.930 5.229 5 20 JKBD O=C(Oc1ccc2c(-c3ccc([N+](=O)[O-])cc3)cc(=O)oc2c1)C1(c2ccc(F)cc2)CCOCC1 919978904 QEPZPIGRAROLNJ-UHFFFAOYSA-N 489.455 5.161 5 20 JKBD CC(=O)Nc1cccc([C@H](C)OC(=O)c2ccc(Sc3nc(C)cs3)c([N+](=O)[O-])c2)c1 920264802 WIBWMUZFJHIMNU-ZDUSSCGKSA-N 457.533 5.387 5 20 JKBD C[C@H](Nc1ccc(C(=O)OCc2coc(-c3cccc(Cl)c3)n2)cc1[N+](=O)[O-])c1ccccn1 920544621 DLRJINAPIJULMU-HNNXBMFYSA-N 478.892 5.828 5 20 JKBD COc1cc(C(=O)NC2(c3ccc(NC(=O)/C=C/c4ccccc4)cc3)CCC2)ccc1[N+](=O)[O-] 1787781467 BTZFNZGUSFVLRK-OVCLIPMQSA-N 471.513 5.065 5 20 JKBD O=C(CCc1ccsc1)Nc1ccc(C2(NC(=O)c3cccc(F)c3[N+](=O)[O-])CCC2)cc1 1788186822 HPTWPDWWPHJBJN-UHFFFAOYSA-N 467.522 5.176 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)[C@]3(F)CCCC=C3F)CCC2)cc1)c1cc(F)cc([N+](=O)[O-])c1 1790700264 WJSURRDYTUZQAU-DEOSSOPVSA-N 473.451 5.227 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)c3ccc([N+](=O)[O-])o3)CCC2)cc1)c1cnc2cccc(Cl)c2c1 1790975039 VWTYWFLZRBYVAY-UHFFFAOYSA-N 490.903 5.451 5 20 JKBD O=C(CSc1ccccc1[N+](=O)[O-])Nc1ccc(C2(NC(=O)c3ccc(Cl)cn3)CCC2)cc1 1791522108 DLEWUUBGRKSSKP-UHFFFAOYSA-N 496.976 5.183 5 20 JKBD C[C@H](C(=O)Nc1ccc(C2(NC(=O)c3nc4cc([N+](=O)[O-])ccc4[nH]3)CCC2)cc1)c1ccccc1 1792313484 YLUZWPGIRPBTKP-KRWDZBQOSA-N 483.528 5.023 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)N1CCC2(CCCN(C(=O)c3cc4ccoc4s3)C2)CC1 1810510485 VLCQGQYARQHSNY-UHFFFAOYSA-N 485.537 5.009 5 20 JKBD O=C(Cc1cccc([N+](=O)[O-])c1)Nc1cc([C@@H]2CCCCN2C(=O)/C=C/c2cc3ccccc3o2)[nH]n1 1814374764 DEHPHGOBRNEJTR-RGPPVUSESA-N 499.527 5.012 5 20 JKBD CC1(C)CCC(CC(=O)Nc2cc([C@@H]3CCCCN3C(=O)c3cccc(F)c3[N+](=O)[O-])[nH]n2)CC1 1820978289 IDVVVBYJZWPWSR-FQEVSTJZSA-N 485.560 5.369 5 20 JKBD Cc1c(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3ccc(Cl)o3)CC2)cc(Cl)cc1[N+](=O)[O-] 1830736156 RTRPBPNQGUUNDM-GOSISDBHSA-N 494.375 5.350 5 20 JKBD Cc1ccc(-n2ccnc2S[C@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2C(F)(F)F)c(C)c1 11424628 MFGDCVONHWVGDW-CQSZACIVSA-N 464.469 5.535 5 20 JKBD O=C(C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)OCC(=O)N1CCCCCC1 18493979 CXKBBSPAPOOYCG-CYVLTUHYSA-N 479.558 5.081 5 20 JKBD C[C@H](OC(=O)[C@@H](C)Sc1ccc(Cl)cc1)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 21457612 PJOBHQAZLMVHJD-WDEREUQCSA-N 476.860 5.318 5 20 JKBD C[C@@H](Sc1nc(-c2ccccc2)cs1)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 21957888 UUTOSRBIBQDGAT-LLVKDONJSA-N 453.467 5.856 5 20 JKBD CCCCSc1nnc(S[C@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2C(F)(F)F)s1 22490738 GMRUCWQVAVTWOT-SECBINFHSA-N 466.532 5.477 5 20 JKBD CN(Cc1ccc(F)cc1F)C(=O)c1ccccc1NC(=O)c1ccc([N+](=O)[O-])cc1Cl 29110171 QROHCGRMCKWCRW-UHFFFAOYSA-N 459.836 5.051 5 20 JKBD CN(Cc1nccn1C(F)F)C(=O)c1ccc(Sc2nc3ccccc3s2)c([N+](=O)[O-])c1 29181437 NHVPMZTZCLCVFE-UHFFFAOYSA-N 475.502 5.220 5 20 JKBD O=C(Nc1ccccc1C(=O)N1CCC(COc2ccccc2)CC1)c1ccc([N+](=O)[O-])cc1Cl 303239530 IPXIHTZRYHULRJ-UHFFFAOYSA-N 493.947 5.432 5 20 JKBD CN(Cc1ccccc1[N+](=O)[O-])C(=O)c1ccc(COc2ccccc2Br)cc1 410323103 AUBHSEPZZBECAB-UHFFFAOYSA-N 455.308 5.209 5 20 JKBD COCc1ccccc1NC(=O)c1ccc(Sc2nc3ccccc3s2)c([N+](=O)[O-])c1 481880621 JEGTXFORGXGWKC-UHFFFAOYSA-N 451.529 5.754 5 20 JKBD O=C(NC[C@H]1CC2c3ccccc3C1c1ccccc12)C1CCN(c2ccccc2[N+](=O)[O-])CC1 491372454 FHKLNBAITRVNOV-KSMUDLHBSA-N 467.569 5.225 5 20 JKBD CNC(=O)c1ccc(Cl)c(NC(=O)c2ccc(Sc3ccc(C)cc3)c([N+](=O)[O-])c2)c1 500273189 JHRATQFDTMNRII-UHFFFAOYSA-N 455.923 5.320 5 20 JKBD Cn1cnnc1Sc1ccc(C(=O)N[C@H](c2ccc(Cl)cc2)c2cccs2)cc1[N+](=O)[O-] 500774627 MVNPCTMTZCTGTC-LJQANCHMSA-N 485.978 5.109 5 20 JKBD COC(=O)[C@H](NC(=O)C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)c1cccs1 509170129 QWCZNANNEBNFMI-FOYQMUPJSA-N 493.566 5.227 5 20 JKBD O=C(CSc1nnc(-c2ccccc2)c2ccccc12)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 514298948 DRVSFOGGHYTWHZ-UHFFFAOYSA-N 484.459 5.955 5 20 JKBD CC[C@H](C(=O)N1CCC(NCc2ccc(-c3ccc(OC)cc3[N+](=O)[O-])o2)CC1)c1ccccc1 520964888 DOJAHKUZJKTFLF-QHCPKHFHSA-N 477.561 5.138 5 20 JKBD Cc1ccc(NC(=O)c2cccc(C(F)(F)F)c2)cc1NS(=O)(=O)c1c(F)cccc1[N+](=O)[O-] 553806269 CGCNKEGTVSLPMS-UHFFFAOYSA-N 497.426 5.114 5 20 JKBD O=C(NCc1nccn1C(F)F)c1c2c(nc3ccccc13)/C(=C/c1ccc([N+](=O)[O-])cc1)CCC2 561501650 CUHGIRJGYACPTQ-SAPNQHFASA-N 489.482 5.542 5 20 JKBD Cc1nc2ccccc2c2c(NC(=O)c3oc4ccccc4c3CS(C)(=O)=O)c3ccccc3n12 588016557 MNNQDWYBVYHKLZ-UHFFFAOYSA-N 483.549 5.492 5 20 JKBD CCOc1cc(NC(=O)NCc2ccc(-c3csc(C)n3)s2)c([N+](=O)[O-])cc1OCC 603651218 AOIWZQDPOXKFPF-UHFFFAOYSA-N 462.553 5.207 5 20 JKBD O=C(N[C@H](c1ccc(F)cc1)c1cccs1)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-] 603732660 PSTVYXVJPYFRGP-GOSISDBHSA-N 454.401 5.256 5 20 JKBD O=C(Nc1nc(-c2ccc3c(c2)Cc2ccccc2-3)cs1)c1cc2c(cc1[N+](=O)[O-])OCCO2 603965650 GGSQXYWHEMFTRE-UHFFFAOYSA-N 471.494 5.313 5 20 JKBD COc1cc(CN[C@H]2CCc3nc(-c4ccccc4)ncc3C2)ccc1OCc1ccc([N+](=O)[O-])cc1 608782226 VFXGCTIAKVFAKK-DEOSSOPVSA-N 496.567 5.287 5 20 JKBD C[C@H](Sc1cc2c(cc1Cl)OCCO2)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 608930452 WZPZTEGOKJKYSD-VIFPVBQESA-N 462.833 5.158 5 20 JKBD Cc1ccc(NC(=O)c2c[nH]c3cc([N+](=O)[O-])ccc23)cc1S(=O)(=O)Nc1ccc(Cl)cc1 610896712 IHQTYHZMCARZBD-UHFFFAOYSA-N 484.921 5.091 5 20 JKBD C[C@H](OC(=O)c1csc(-c2ccccc2Cl)n1)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 727562360 AHWPYQVMYYMSDU-JTQLQIEISA-N 499.854 5.575 5 20 JKBD CN(C)S(=O)(=O)c1ccccc1CNC(=O)CCC(=O)c1ccc2ccc3cccc4ccc1c2c34 727753885 YWWVBVMJZNDSLG-UHFFFAOYSA-N 498.604 5.114 5 20 JKBD CC(C)N(Cc1nnc(-c2cccc([N+](=O)[O-])c2)o1)C(=O)c1cccc(NC(=O)OC(C)(C)C)c1 744001384 DLJQGFWVURPAOY-UHFFFAOYSA-N 481.509 5.043 5 20 JKBD CCOc1cc(C(=O)Nc2ccccc2C(=O)Nc2cccc(Cl)c2)c([N+](=O)[O-])cc1OC 747533254 JVHFJRFNDYPBFX-UHFFFAOYSA-N 469.881 5.160 5 20 JKBD Cc1ccc(Oc2ccccc2NC(=O)COC(=O)c2csc(-c3cccc([N+](=O)[O-])c3)n2)cc1 747963586 WNJOLUIIDNAJED-UHFFFAOYSA-N 489.509 5.615 5 20 JKBD CC(C)(C)OC(=O)N1CCC[C@@H]1[C@@H]1CCCN(C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)C1 749658423 DBEUWHFGMSGKHQ-CRAIPNDOSA-N 459.568 5.061 5 20 JKBD O=C(C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)NC[C@@H]1CC1(Cl)Cl 914610755 ZOELTTZZIUERDV-HNRFISLBSA-N 462.358 5.445 5 20 JKBD C[C@H](OC(=O)c1[nH]c2ccc(Cl)cc2c1Cl)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 915417371 YSDRYPFQQJGNIK-QMMMGPOBSA-N 490.221 5.586 5 20 JKBD COc1ccc(N2C(=S)N[C@@H](c3ccc([N+](=O)[O-])cc3)C(C(=O)Nc3ccccc3C)=C2C)cc1 916167705 BWFJGXVHDFVFEB-DEOSSOPVSA-N 488.569 5.260 5 20 JKBD CC(C)c1cccc(C(C)C)c1NC(=S)/C(=C(/O)c1ccc([N+](=O)[O-])cc1)[n+]1cccc(CO)c1 917609851 BQNKCLUGQBWLLH-UHFFFAOYSA-O 492.621 5.945 5 20 JKBD Cc1ccc(C(=O)N2C[C@@H](C)C[C@@H](C)C2)cc1NC(=O)c1ccc(Br)c([N+](=O)[O-])c1 917741978 LSGASMOBPQBSBX-OKILXGFUSA-N 474.355 5.036 5 20 JKBD CSCC[C@@H](NC(=O)c1cccc([N+](=O)[O-])c1)C(=O)O[C@H](C)c1ccc(Cl)c(Cl)c1 917963378 VLLFDPLWIGGCPK-KZULUSFZSA-N 471.362 5.058 5 20 JKBD C[C@H](OC(=O)[C@@H](C)Sc1ccc(Br)cc1)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl 919468179 JQFYQOKDBKLXCO-WDEREUQCSA-N 487.759 5.062 5 20 JKBD CCOC(=O)c1c(NC(=O)c2cc(OC)ccc2[N+](=O)[O-])sc(C)c1-c1ccc(F)cc1 920278653 OEMXBTIZOOHPGK-UHFFFAOYSA-N 458.467 5.208 5 20 JKBD Cc1ccc2[nH]c(C(=O)Nc3ccc(C4(NC(=O)c5ccc([N+](=O)[O-])o5)CCC4)cc3)cc2c1 1788965530 ZEGQWQVFSJNIKH-UHFFFAOYSA-N 458.474 5.039 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)[C@H](F)c3ccccc3)CCC2)cc1)c1cccc(F)c1[N+](=O)[O-] 1790699880 RDPLLBBTNHWKTL-OAQYLSRUSA-N 465.456 5.192 5 20 JKBD Cc1c(C(=O)NC2(c3ccc(NC(=O)[C@@H](C)n4ccnc4C)cc3)CCC2)cc(Cl)cc1[N+](=O)[O-] 1791932850 ZMQLOKTYDYUQAU-MRXNPFEDSA-N 495.967 5.070 5 20 JKBD Cc1cc(Cl)ccc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cc3cc([N+](=O)[O-])ccc3s1)C2 1792738200 LTFNDDTVAKKOGW-BCDXTJNWSA-N 483.977 5.337 5 20 JKBD CC(=O)CCc1ccc2oc(C(=O)O[C@@H](C)C(=O)Nc3cc([N+](=O)[O-])ccc3Cl)c(C)c2c1 8807432 BHCIUZXSQJQIPM-AWEZNQCLSA-N 472.881 5.008 5 20 JKBD CC(=O)N(c1nc(COC(=O)c2ccc(N3CCCC3)c([N+](=O)[O-])c2)cs1)c1cccc(C)c1C 10733627 CEIYFHIEAGPQIW-UHFFFAOYSA-N 494.573 5.310 5 20 JKBD C[C@@H](OC(=O)c1ccc(Cl)c([N+](=O)[O-])c1)C(=O)Nc1c(Cl)cc(Cl)cc1Cl 11025339 BNBBYPHXWDLNAT-SSDOTTSWSA-N 452.077 5.392 5 20 JKBD CCS(=O)(=O)c1ccc(NC(=O)c2ccc(Sc3ccc(C)cc3)c([N+](=O)[O-])c2)cc1 11542032 OOALJHCOBKWWCW-UHFFFAOYSA-N 456.545 5.100 5 20 JKBD C[C@H](NC(=O)c1cc([N+](=O)[O-])ccc1Sc1ccccc1)c1nc2ccccc2n1C(F)F 14368317 BWBKPGBIYRXHLC-AWEZNQCLSA-N 468.485 5.982 5 20 JKBD CS(=O)(=O)c1ccc(Cl)c(NC(=O)c2cc([N+](=O)[O-])ccc2Sc2ccccc2)c1 14622766 ICYDNMQLZSDVJU-UHFFFAOYSA-N 462.936 5.055 5 20 JKBD CCN(CC)S(=O)(=O)c1ccc(Oc2ccc(C)cc2)c(NC(=O)c2ccc([N+](=O)[O-])s2)c1 14819936 ZSIURPNHOXVQRX-UHFFFAOYSA-N 489.575 5.040 5 20 JKBD O=C(Oc1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2Cl)cc1)c1csc(-c2ccc(F)cc2)n1 15516105 AAGWQEIRRCFQQO-UHFFFAOYSA-N 497.891 5.982 5 20 JKBD CCOc1ccc([C@@H](CNC(=O)c2ccc(NC)c([N+](=O)[O-])c2)c2c[nH]c3ccccc23)cc1OC 16176661 PJAIIWFTXGGVLI-HXUWFJFHSA-N 488.544 5.087 5 20 JKBD C[C@H](Sc1nnc(-c2cccc(Br)c2)o1)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 17665769 INBLQSSMRVENSQ-JTQLQIEISA-N 474.296 5.311 5 20 JKBD Cc1c(NC(=O)[C@H](C)Sc2nnc(-c3cccs3)n2-c2ccccc2)cccc1[N+](=O)[O-] 23284627 ZZQVCXYDVOACHE-HNNXBMFYSA-N 465.560 5.332 5 20 JKBD Cc1sc(NC(=O)c2cnn(-c3ccccc3F)c2C(F)(F)F)nc1-c1cccc([N+](=O)[O-])c1 195704249 IBMQNZNDKAJVDX-UHFFFAOYSA-N 491.426 5.623 5 20 JKBD CSc1ccc(C(=O)c2ccccc2C(=O)Nc2cccc(NC(C)=O)c2C)cc1[N+](=O)[O-] 484263528 MKHSSNCDPMCQIK-UHFFFAOYSA-N 463.515 5.067 5 20 JKBD Cc1csc(N(C)C(=O)c2c3c(nc4ccccc24)/C(=C\c2cccc([N+](=O)[O-])c2)CCC3)n1 488525052 CQXBBYMVCIXSGO-AQTBWJFISA-N 470.554 6.061 5 20 JKBD Cn1cnnc1Sc1ccc(C(=O)Nc2ccc(OC3CCCC3)c(Cl)c2)cc1[N+](=O)[O-] 509006508 BMKKFBXVOSBVLF-UHFFFAOYSA-N 473.942 5.102 5 20 JKBD COc1ccc(Oc2ccc([N+](=O)[O-])cc2C(=O)N[C@H](C)c2nc3ccccc3n2C(F)F)cc1 512244290 OLYWMLVBJFGSQB-CQSZACIVSA-N 482.443 5.632 5 20 JKBD O=[N+]([O-])c1ccc(Sc2nnc(COc3ccccc3Cl)n2C2CC2)c2ccncc12 515164349 FGPPTQHIMVWSFD-UHFFFAOYSA-N 453.911 5.453 5 20 JKBD CCN(Cc1ccc(OCc2cccs2)c(OC)c1)C(=O)c1cnn(-c2ccc([N+](=O)[O-])cc2)c1 515287289 MLPVXQWEAFFBNK-UHFFFAOYSA-N 492.557 5.092 5 20 JKBD O=[N+]([O-])c1ccc(-c2ccc(CNCc3cccnc3Oc3cccc(F)c3)o2)c(Br)c1 517536116 ZHICPQCLNNHJME-UHFFFAOYSA-N 498.308 6.234 5 20 JKBD C[C@@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)Nc1ccc(N(C)C(=O)c2ccc(Cl)cc2)cc1 521249750 CFWAJMSGZOBTOT-CQSZACIVSA-N 488.327 5.584 5 20 JKBD CN(C)CCn1ccc(NC(=O)c2c3c(nc4ccccc24)/C(=C\c2cccc([N+](=O)[O-])c2)CCC3)n1 523062436 HECCPBNRTYIJGT-JZJYNLBNSA-N 496.571 5.030 5 20 JKBD C[C@@H](NC(=O)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1)c1cccc(C(F)(F)F)c1 603437391 ZYELJOKTUCAWHG-CYBMUJFWSA-N 489.416 5.726 5 20 JKBD COc1cc(C(=O)N2CCC[C@H]2c2cc(C)no2)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 603902954 UXMHJRPVBDWSHW-INIZCTEOSA-N 457.870 5.323 5 20 JKBD CN(Cc1cn(-c2ccccc2)nc1-c1ccccc1)C(=O)c1c[nH]c2cc([N+](=O)[O-])ccc12 609600146 BLLCJAAJAMYGGA-UHFFFAOYSA-N 451.486 5.201 5 20 JKBD CC(C)OC(=O)C[C@H](NC(=O)Cc1csc(-c2ccc(Cl)cc2)n1)c1ccccc1[N+](=O)[O-] 610925534 YEFBONHDUDKZQN-IBGZPJMESA-N 487.965 5.113 5 20 JKBD COc1cc(C(=O)N(c2ccc3[nH]ccc3c2)[C@H](C)CC(C)C)c([N+](=O)[O-])cc1OC(F)F 726917155 VKWRLMVEQGGVFO-CQSZACIVSA-N 461.465 5.768 5 20 JKBD CCNc1ccc(C(=O)Nc2ccc(NC(=O)OC(C)(C)C)cc2C(F)(F)F)cc1[N+](=O)[O-] 729657196 JVACEVCOQSQQRV-UHFFFAOYSA-N 468.432 5.645 5 20 JKBD Cc1c(C(=O)Nc2ccc(Cl)cc2C(=O)N2[C@H](C)CCC[C@H]2C)cc([N+](=O)[O-])c(C)c1[N+](=O)[O-] 748617506 KTSWCLDBJCLMJA-CHWSQXEVSA-N 488.928 5.429 5 20 JKBD Cc1ccc(C)c(NC(=O)[C@@H](OC(=O)c2cc([N+](=O)[O-])c(C)c([N+](=O)[O-])c2C)c2ccccc2)c1 748951855 ROKDRUZPHMWFNE-QHCPKHFHSA-N 477.473 5.273 5 20 JKBD Cc1sc2ncn(NC(=O)c3ccc(Nc4ccccc4)c([N+](=O)[O-])c3)c(=O)c2c1-c1ccccc1 751177111 CKROQXDYVQOTQH-UHFFFAOYSA-N 497.536 5.469 5 20 JKBD COc1ccc(-c2cc3nc(CSc4nc5ccc([N+](=O)[O-])cc5s4)[nH]c(=O)c3s2)cc1 791223525 JLCNIAWPNAHRHH-UHFFFAOYSA-N 482.568 5.470 5 20 JKBD Cc1ccc(S(=O)(=O)Nc2ccc(NC(=O)c3ccc(SC(F)F)cc3)cc2)cc1[N+](=O)[O-] 840516484 KDWJUYJNEOLFOP-UHFFFAOYSA-N 493.513 5.271 5 20 JKBD CCOc1cc(NC(=O)c2ccc(-c3nnc(-c4cccc(C)c4)o3)cc2)c([N+](=O)[O-])cc1OCC 880335044 WWYOUMGLIKFHRU-UHFFFAOYSA-N 488.500 5.670 5 20 JKBD Cc1oc2cc(OS(=O)(=O)Cc3ccc([N+](=O)[O-])cc3)ccc2c(=O)c1-c1ccccc1Cl 914578618 PGXPFJVZZJKMSR-UHFFFAOYSA-N 485.901 5.239 5 20 JKBD C[C@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)OCC(=O)Nc1cc(Cl)c(Cl)cc1Cl 920778905 QTWKNCWVVGHARC-QMMMGPOBSA-N 482.103 5.158 5 20 JKBD Cc1cnc(Cl)c(C(=O)Nc2ccc(C3(NC(=O)c4cccc(F)c4[N+](=O)[O-])CCC3)cc2)c1 1787568072 FLCBKHOQRUPINV-UHFFFAOYSA-N 482.899 5.152 5 20 JKBD Cc1c(C(=O)NC2(c3ccc(NC(=O)c4ccc[nH]4)cc3)CCC2)cc(Br)cc1[N+](=O)[O-] 1789685242 SGKVODKJTDTWSE-UHFFFAOYSA-N 497.349 5.055 5 20 JKBD CC(C)=CCCC(=O)Nc1ccc(C2(NC(=O)c3cc([N+](=O)[O-])cc4c3OCC4)CCC2)cc1 1790451955 ZOXUUDATIKDBLM-UHFFFAOYSA-N 463.534 5.024 5 20 JKBD O=C(Cc1cccc([N+](=O)[O-])c1)NC1(c2ccc(NC(=O)c3cccc4ccncc34)cc2)CCC1 1790856772 NKFXLCPCIXGBJL-UHFFFAOYSA-N 480.524 5.133 5 20 JKBD O=C(Cc1ccc(Cl)cc1[N+](=O)[O-])NC1(c2ccc(NC(=O)[C@@H]3CCCSC3)cc2)CCC1 1792283464 OBAJSRHKZJYHFZ-QGZVFWFLSA-N 488.009 5.068 5 20 JKBD Cc1cc(CCCC(=O)N2CCCC[C@H]2C2CCN(C(=O)CC3CCC3)CC2)c([N+](=O)[O-])cc1F 1824370061 KESZLUQVUQBKLM-DEOSSOPVSA-N 487.616 5.175 5 20 JKBD CC[C@H](C(=O)N1CCCC[C@H]1C1CCN(C(=O)Cc2ccc([N+](=O)[O-])cc2F)CC1)c1ccccc1 1826317282 SFRVZBUYLPTYSN-AHWVRZQESA-N 495.595 5.090 5 20 JKBD C[C@@H](Sc1ccccc1)C(=O)N1CCC([C@H]2CCCCN2C(=O)c2ccc([N+](=O)[O-])cc2F)CC1 1830492297 BKLSNKNPBPXBMC-HOYKHHGWSA-N 499.608 5.148 5 20 JKBD CC(C)(C)Oc1ccc(C(=O)N2CCCC23CN(C(=O)c2cc4cc([N+](=O)[O-])ccc4s2)C3)cc1 1845389767 OVNNLVVNOOKZKO-UHFFFAOYSA-N 493.585 5.118 5 20 JKBD O=C(/C=C/c1ccc([N+](=O)[O-])o1)N1CC[C@H]2[C@@H]1CCN2C(=O)CCCCCCCCc1ccccc1 1847656171 WPTAMXHMHHJRCC-WTJIERMWSA-N 493.604 5.376 5 20 JKBD O=C(Nc1ccc(F)c([N+](=O)[O-])c1)c1ccc(-n2nc(SCc3ccccc3)sc2=S)cc1 15592229 YRZMLZKVGUICNX-UHFFFAOYSA-N 498.586 6.255 5 20 JKBD C[C@H](Sc1nnc(-c2ccc(F)cc2)n1-c1ccccc1)C(=O)Nc1ccccc1[N+](=O)[O-] 21741819 HWDYMDGPDMFZQS-HNNXBMFYSA-N 463.494 5.101 5 20 JKBD COc1ccc([N+](=O)[O-])cc1NC(=O)[C@@H](C)Sc1ncnc2sc(-c3ccccc3)cc12 23560363 WMPBHOKXRXNGIQ-CYBMUJFWSA-N 466.544 5.394 5 20 JKBD Cc1nc2ccccc2nc1S[C@@H](C)C(=O)Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1 28190971 WZQLXPVFFXSZBM-ZDUSSCGKSA-N 451.533 5.089 5 20 JKBD CCOCc1ccc(CN[C@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2ccccc2)cc1 28386460 TVRBHNUHWSZZJN-QHCPKHFHSA-N 453.926 5.254 5 20 JKBD COc1cc(C(=O)Nc2ccc(CN(C)C)cc2)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 29953043 DQHXPBPPZDEUJB-UHFFFAOYSA-N 455.898 5.363 5 20 JKBD Cc1ccc(NC(=O)[C@H](Sc2nc3ccccc3c(=O)n2C(C)C)c2ccccc2)c([N+](=O)[O-])c1 36855548 XXPFRTGYILYWKJ-HSZRJFAPSA-N 488.569 5.666 5 20 JKBD C[C@@H](Nc1ccc(C(=O)NCc2ccc(Oc3cccnc3)c(F)c2)cc1[N+](=O)[O-])c1ccccn1 108997884 MATZVGFRDWSYKE-QGZVFWFLSA-N 487.491 5.419 5 20 JKBD C[C@H](Nc1ccc(C(=O)N(CCN(C)C)Cc2cccc(Cl)c2)cc1[N+](=O)[O-])c1ccccn1 303046503 IERQKURDMDBEKO-SFHVURJKSA-N 481.984 5.020 5 20 JKBD COc1cc2c(cc1OC)[C@@H](c1ccccc1)N(C(=O)c1cc(SC)c(OC)cc1[N+](=O)[O-])CC2 481919593 KVEYXXAGGIIMGB-RUZDIDTESA-N 494.569 5.130 5 20 JKBD O=C(NCc1ccc(N2CCCCC2)nc1)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1 483100764 QSDSTJWAHDYRAX-UHFFFAOYSA-N 466.925 5.356 5 20 JKBD CCOc1cc([N+](=O)[O-])c(C(=O)N[C@@H](C)c2ccc(OCc3ccc(F)cc3)cc2)cc1OC 485466545 HRTXIQIMKSXXJR-INIZCTEOSA-N 468.481 5.211 5 20 JKBD CSc1ccc([N+](=O)[O-])c(C(=O)N(C)[C@@H]2CCSc3ccc(Br)cc32)c1 504602360 WRUMQZWPAGZWQA-OAHLLOKOSA-N 453.383 5.388 5 20 JKBD C[C@@H](Nc1ccc(C(=O)NCCOc2ccc3ccccc3c2)cc1[N+](=O)[O-])c1ccccn1 506084412 BBJORJAJKAXSNY-GOSISDBHSA-N 456.502 5.125 5 20 JKBD C[C@H](Nc1ccc(C(=O)N2CCC[C@@H]2Cc2c(F)cccc2Cl)cc1[N+](=O)[O-])c1ccccn1 507388444 KAWYBGBJTOCBGC-FUHWJXTLSA-N 482.943 5.803 5 20 JKBD CCOc1cc(CN[C@H]2CCSc3c(F)cccc32)ccc1OCCn1c([N+](=O)[O-])cnc1C 509609800 SLZOSNSJRXFKQB-FQEVSTJZSA-N 486.569 5.043 5 20 JKBD COc1ccc([C@H](NC(=O)C2CCN(c3ccccc3[N+](=O)[O-])CC2)c2ccc(C)cc2)cc1 512880053 OIPAXNFPWBJCAF-AREMUKBSSA-N 459.546 5.034 5 20 JKBD CCOc1cc([N+](=O)[O-])c(C(=O)Nc2cc(NC(=O)Nc3ccccc3)ccc2C)cc1OC 515296056 WFBVNIBMEMJAKD-UHFFFAOYSA-N 464.478 5.207 5 20 JKBD O=C(Nc1cccc(CSc2ccccn2)c1)c1ccc([N+](=O)[O-])cc1I 522245342 ZOOLPVHILDMCQM-UHFFFAOYSA-N 491.310 5.139 5 20 JKBD CCOCc1cccc(N[C@@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Br)c2ccccc2)c1 522623525 UJTJGJYXNVKKAR-JOCHJYFZSA-N 484.350 5.686 5 20 JKBD Cc1cc(C(=O)N2CCC[C@H]2C(=O)Nc2ccc(N[C@H](C)c3ccccc3)cc2)ccc1[N+](=O)[O-] 523288488 VNFWIUMZDBAUMV-CLOONOSVSA-N 472.545 5.320 5 20 JKBD O=C(CNc1cc([N+](=O)[O-])ccc1OC(F)F)N1N=C(c2cccs2)C[C@@H]1c1cccs1 604006180 OEXBHXBSSJYVIZ-OAHLLOKOSA-N 478.502 5.109 5 20 JKBD O=C(Nc1cc(C(=O)N2CCCCC2)ccc1Cl)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-] 608873143 SFUSXGUNSKHELA-UHFFFAOYSA-N 485.846 5.068 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Cl)[C@H](c1ccccc1)N1CCO[C@@H](c2cccc(F)c2)C1 608975948 BAPDHHSIMXTSLL-PKTZIBPZSA-N 469.900 5.141 5 20 JKBD COc1ccc(CC(=O)Nc2ncc(Cc3cccc(Cl)c3Cl)s2)cc1[N+](=O)[O-] 609009864 COPNEMZVKYCHDO-UHFFFAOYSA-N 452.319 5.139 5 20 JKBD COc1ccc(CSc2nc3cc4ccccc4cc3c(=O)n2C)c(Br)c1OC 614509530 IGYJHJCSWBBNPW-UHFFFAOYSA-N 471.376 5.159 5 20 JKBD C[C@H](OC(=O)[C@@H](C)c1c(Cl)cccc1Cl)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 726029445 QHIQNGOKCVAAOQ-UWVGGRQHSA-N 479.238 5.594 5 20 JKBD O=C(COC(=O)c1csc(-c2ccccc2Cl)n1)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 727562529 CZRDVILCFYUFKI-UHFFFAOYSA-N 485.827 5.186 5 20 JKBD O=C(CCC(=O)c1ccc2ccc3cccc4ccc1c2c34)Nc1cnn(CC(=O)NC2CCCC2)c1 727767564 DMRCBLOOAIISBX-UHFFFAOYSA-N 492.579 5.441 5 20 JKBD CS(=O)(=O)c1cccc(NC(=O)CCC(=O)c2ccc3ccc4cccc5ccc2c3c45)c1 728151417 BGQKLXHPKOSMLB-UHFFFAOYSA-N 455.535 5.589 5 20 JKBD Cc1ccc(Cl)c(NC(=S)/C(=C(/O)c2cccc([N+](=O)[O-])c2)[n+]2cccc(CO)c2)c1Cl 728558744 PTEBLRLGKFHLPO-UHFFFAOYSA-O 491.376 5.313 5 20 JKBD O=C(Nc1ccc(OS(=O)(=O)c2cc(F)ccc2Cl)cc1)c1cc([N+](=O)[O-])ccc1Cl 728582875 NOOPNSCVFIIEQD-UHFFFAOYSA-N 485.276 5.061 5 20 JKBD O=C(OCC[C@H]1CCCCN1C(=O)Cc1coc(-c2ccc(Cl)cc2)n1)c1cccc([N+](=O)[O-])c1 729325206 QQRPBMACLIPOTJ-OAQYLSRUSA-N 497.935 5.074 5 20 JKBD CCNc1ccc(C(=O)OCc2csc(N(C(C)=O)c3ccc(CC)cc3)n2)cc1[N+](=O)[O-] 795845844 PLUCHZHHKVVJLD-UHFFFAOYSA-N 468.535 5.087 5 20 JKBD Cc1cc([N+](=O)[O-])ccc1NC(=O)COC(=O)c1sc(-c2ccco2)nc1-c1ccccc1 900278159 LHDKZDIPEVTQLW-UHFFFAOYSA-N 463.471 5.082 5 20 JKBD CC(C)(C)OC(=O)NCc1ccc(-c2noc(-c3csc(-c4cccc([N+](=O)[O-])c4)n3)n2)cc1 904715452 GHJQQUQOOUEOSK-UHFFFAOYSA-N 479.518 5.460 5 20 JKBD CC1=C(C(=O)Nc2ccc(F)cc2)[C@@H](c2csc([N+](=O)[O-])c2)NC(=O)N1Cc1cccs1 917963410 WNALRALXBNYPPZ-LJQANCHMSA-N 472.523 5.036 5 20 JKBD O=C(COC(=O)c1ccc(SCc2ccccc2)cc1)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 919504138 JVXZVLXMPLRWBV-UHFFFAOYSA-N 490.459 5.701 5 20 JKBD CC(C)N(Cc1ccc([N+](=O)[O-])cc1)Cn1nc(-c2ccc(F)cc2)n(C[C@H]2CCCO2)c1=S 919950910 XFXNWZPTONXZDK-JOCHJYFZSA-N 485.585 5.175 5 20 JKBD CCc1ncsc1C(=O)NC1(c2ccc(NC(=O)Cc3ccc(Cl)cc3[N+](=O)[O-])cc2)CCC1 1786115642 BXKSJMPBLOULMX-UHFFFAOYSA-N 498.992 5.258 5 20 JKBD O=C(/C=C/c1ccc([N+](=O)[O-])o1)Nc1ccc(C2(NC(=O)[C@H]3CCc4ccccc43)CCC2)cc1 1786208287 XBVQLKORRPGZEN-UDFXALJUSA-N 471.513 5.065 5 20 JKBD Cc1cc(C(=O)NC2(c3ccc(NC(=O)CCCc4cc(C)c(F)cc4[N+](=O)[O-])cc3)CCC2)on1 1786275004 VWFDLVRIJCGZKR-UHFFFAOYSA-N 494.523 5.109 5 20 JKBD O=C(Cc1cc([N+](=O)[O-])ccc1F)Nc1ccc(C2(NC(=O)CSc3ccccc3)CCC2)cc1 1786672966 XMFWADZLVWVPGZ-UHFFFAOYSA-N 493.560 5.203 5 20 JKBD O=C(/C=C/c1ccccc1[N+](=O)[O-])NC1(c2ccc(NC(=O)c3scnc3C3CC3)cc2)CCC1 1787186947 JBBAECAEYDCMJH-MDWZMJQESA-N 488.569 5.390 5 20 JKBD Cc1c(C(=O)Nc2ccc(C3(NC(=O)[C@@H]4[C@@H]5C=CS[C@@H]45)CCC3)cc2)cc(Cl)cc1[N+](=O)[O-] 1790774677 OIBRDYGNLPMZQP-IOMROCGXSA-N 483.977 5.179 5 20 JKBD CC(C)c1cc(C(=O)NC2(c3ccc(NC(=O)CSc4ccccc4[N+](=O)[O-])cc3)CCC2)on1 1791522863 BCMVTNRHRQRSKI-UHFFFAOYSA-N 494.573 5.246 5 20 JKBD Cc1ccc2[nH]c(C(=O)Nc3cc([C@@H]4CCCCN4C(=O)/C=C/c4ccccc4[N+](=O)[O-])[nH]n3)cc2c1 1818567495 RKPNWNMPVYNXTR-YKATVRGKSA-N 498.543 5.127 5 20 JKBD O=C(Nc1cc([C@@H]2CCCCN2C(=O)/C=C/c2ccco2)[nH]n1)c1cc2cc([N+](=O)[O-])ccc2s1 1821612077 QXNSIZPJJYPGGL-XSBJJCPUSA-N 491.529 5.145 5 20 JKBD O=C(/C=C/c1ccccc1[N+](=O)[O-])Nc1cc([C@@H]2CCCCN2C(=O)c2ccccc2C2CC2)[nH]n1 1823503194 OGWLMCPHSGMUOU-ZXYASIKESA-N 485.544 5.215 5 20 JKBD O=C(CSc1ccccc1[N+](=O)[O-])N1CCC([C@H]2CCCCN2C(=O)CCC2CCCC2)CC1 1826272402 XTQSRMNSNVEAPB-JOCHJYFZSA-N 487.666 5.277 5 20 JKBD O=C(c1cc2cc([N+](=O)[O-])ccc2s1)N1CCC([C@@H]2CCCCN2C(=O)c2cccc(F)c2)CC1 1829963519 KREROVSQEPDQNX-QFIPXVFZSA-N 495.576 5.496 5 20 JKBD O=C(c1cc2sccc2[nH]1)N1CCC([C@@H]2CCCCN2C(=O)/C=C/c2ccccc2[N+](=O)[O-])CC1 1832903639 FKIDQVMYAIPRBT-UVIRAJKCSA-N 492.601 5.084 5 20 JKBD O=C(c1ccc2ncccc2c1)N1CCC([C@H]2CCCCN2C(=O)/C=C/c2ccccc2[N+](=O)[O-])CC1 1832907570 YUASVBQTSZJRGQ-HEAKDJBOSA-N 498.583 5.090 5 20 JKBD O=C(Nc1cc2c(cc1[N+](=O)[O-])OCCCO2)c1oc2ccccc2c1COc1ccccc1 10965006 CHZXUYFJGFVHOR-UHFFFAOYSA-N 460.442 5.334 5 20 JKBD O=[N+]([O-])c1cc2c(c(CSc3nnc(Cc4cccs4)n3CCc3ccccc3)c1)OCOC2 12743908 ONZJEYGQZOBGIB-UHFFFAOYSA-N 494.598 5.240 5 20 JKBD Cc1ccc(-c2nc(C(=O)O[C@@H](C)C(=O)Nc3nc(-c4cccc([N+](=O)[O-])c4)cs3)cs2)cc1 17939518 JWQZNSULYCSQNQ-AWEZNQCLSA-N 494.554 5.334 5 20 JKBD O=C(Cc1ccc(OC(F)F)cc1)O[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1 26117142 VSMGWTYPZBXNED-NRFANRHFSA-N 490.846 5.315 5 20 JKBD CSc1ccc([N+](=O)[O-])c(C(=O)Nc2ncc(Cc3cccc(Cl)c3Cl)s2)c1 26366947 VQNJBIXTIIAGGP-UHFFFAOYSA-N 454.360 5.923 5 20 JKBD CSc1ccc([N+](=O)[O-])c(C(=O)Nc2nc(-c3ccc(I)cc3)cs2)c1 26868280 SBZTYDZRDRFNEU-UHFFFAOYSA-N 497.339 5.297 5 20 JKBD CC(C)n1ncc2c(C(=O)Nc3cc(-c4cccc([N+](=O)[O-])c4)n[nH]3)cc(-c3cccs3)nc21 78549425 RZVUKNOKDGLLCQ-UHFFFAOYSA-N 473.518 5.291 5 20 JKBD COc1ccc(/C=C\C(=O)O[C@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2ccccc2)cc1OC 215037843 ZYVOSXUBNNAUSJ-KKFNYGJBSA-N 496.903 5.202 5 20 JKBD Cc1sc2ncnc(S[C@@H](C)C(=O)Nc3nc(-c4cccc([N+](=O)[O-])c4)cs3)c2c1C 255941260 KDSOWMSULZBJII-LBPRGKRZSA-N 471.589 5.459 5 20 JKBD C[C@H](Nc1ccc(C(=O)N[C@@H]2CCCc3cc(OC(F)F)ccc32)cc1[N+](=O)[O-])c1ccccn1 302973701 IZXXXECEDVWYTI-YCRPNKLZSA-N 482.487 5.572 5 20 JKBD COc1cc(C(=O)N[C@@H](C)c2cccc(C(F)(F)F)c2)c([N+](=O)[O-])cc1OCc1cscn1 303047995 XLWIHSICHWUDEW-LBPRGKRZSA-N 481.452 5.149 5 20 JKBD CCOc1ccc(NC(=O)c2ccc(NC(=O)c3cc(SC)c(OC)cc3[N+](=O)[O-])cc2)cc1 482290863 DIGJFUGSQFBGIP-UHFFFAOYSA-N 481.530 5.229 5 20 JKBD C[C@H]1C[C@@H](C)CN(c2ccc(C(=O)Nc3cccc(NC(=O)c4ccoc4)c3)cc2[N+](=O)[O-])C1 499607174 XQECWOFWRIGRLH-CALCHBBNSA-N 462.506 5.175 5 20 JKBD CCOc1ccc(-c2csc(NC(=O)Cn3c4ccccc4c(=O)c4ccccc43)n2)cc1 500277039 DEKJPJUQPPNDGK-UHFFFAOYSA-N 455.539 5.316 5 20 JKBD CNC(=O)c1ccc(Cl)c(NC(=O)c2cc([N+](=O)[O-])ccc2Sc2ccc(Cl)cc2)c1 500297220 JUIUEMZAIPQYMH-UHFFFAOYSA-N 476.341 5.665 5 20 JKBD COc1cccc(/C=C(/CC(=O)NCc2ccccc2[N+](=O)[O-])c2nc3ccccc3s2)c1 500771818 GWGRZODMTQMTDK-UYRXBGFRSA-N 459.527 5.460 5 20 JKBD C[C@@H](Nc1ccc(S(=O)(=O)N2CCCCC2)cc1[N+](=O)[O-])c1nc(-c2ccccc2)cs1 501245876 NNAAXMVIWXNEAG-MRXNPFEDSA-N 472.592 5.066 5 20 JKBD CN(C(=O)C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)C1Cc2ccccc2C1 508163621 POMLDNNRCBDLDO-KGENOOAVSA-N 469.566 5.761 5 20 JKBD COc1ccc2[nH]cc(C3CCN(C(=O)c4ccc(N5CCC(C)CC5)c([N+](=O)[O-])c4)CC3)c2c1 509087228 YAAHGDDUYPAZKC-UHFFFAOYSA-N 476.577 5.341 5 20 JKBD CC(C)N(C)C(=O)c1ccc(Cl)c(NC(=O)c2ccc(N[C@@H](C)c3ccccn3)c([N+](=O)[O-])c2)c1 509299272 BVBQGZPVQSZMEA-INIZCTEOSA-N 495.967 5.549 5 20 JKBD O=C(Nc1ccc(Cl)cc1Cl)[C@H]1CCCCN1C(=O)CSc1ccc([N+](=O)[O-])cc1 515204015 RVJCZSWUHNVCGW-GOSISDBHSA-N 468.362 5.014 5 20 JKBD CCCC(=O)Nc1cccc(CNc2ccc(S(=O)(=O)Nc3ccc(C)cc3C)cc2[N+](=O)[O-])c1 515480929 MTNZJFQAOHPAPJ-UHFFFAOYSA-N 496.589 5.363 5 20 JKBD C[C@@H](Nc1ccc(C(=O)Nc2ccc(OCc3ccncc3)cc2)cc1[N+](=O)[O-])c1ccccn1 517844461 OJCKBLGHIZCNNL-GOSISDBHSA-N 469.501 5.389 5 20 JKBD Cc1cccc(C)c1NS(=O)(=O)c1ccc(NC(=O)c2cc3cc([N+](=O)[O-])ccc3o2)cc1 517971028 DUZMBGCLXLHBEU-UHFFFAOYSA-N 465.487 5.011 5 20 JKBD O=C(NC1CC1)c1ccc(N2CCC(c3nc4cc(Cl)ccc4s3)CC2)c([N+](=O)[O-])c1 589807113 VTRWEVAFSNDPGR-UHFFFAOYSA-N 456.955 5.134 5 20 JKBD O=C(Nc1cc([N+](=O)[O-])ccc1OC(F)F)c1ccc(COc2ccc3ccccc3c2)o1 603638850 HZVMHKPOLGXVOR-UHFFFAOYSA-N 454.385 5.774 5 20 JKBD CCN(C(=O)c1ccccc1C(=O)c1ccc(SC)c([N+](=O)[O-])c1)c1nc2ccccc2s1 603942202 PWPHETHKMYOMBW-UHFFFAOYSA-N 477.567 5.824 5 20 JKBD Cc1sc(NC(=O)CS[C@H](C)c2nc3ccccc3[nH]2)nc1-c1cccc([N+](=O)[O-])c1 603996762 CMIOYEARBOOYBX-CYBMUJFWSA-N 453.549 5.336 5 20 JKBD CCc1ccc(N(C(=O)COc2ccc([N+](=O)[O-])c(OC)c2)c2nc3ccccc3s2)cc1 604456086 RYNJTMMYFRDFAO-UHFFFAOYSA-N 463.515 5.519 5 20 JKBD CN(C[C@@H]1CCCO[C@@H]1c1ccccc1)C(=O)CCNc1ccc(C(F)(F)F)cc1[N+](=O)[O-] 604519044 GHVBAXRETVGENR-HTAPYJJXSA-N 465.472 5.042 5 20 JKBD O=C(C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)NC[C@@H]1CCOc2ccccc21 609409195 SHBBOVIZVPIAQT-AZGFIHASSA-N 485.565 5.818 5 20 JKBD CC(C)c1nc(C(=O)O[C@@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2ccccc2)cs1 726690100 UMELMSBQTQWWSF-GOSISDBHSA-N 459.911 5.365 5 20 JKBD COc1ccc(NC(=S)/C(=C(/O)c2ccc([N+](=O)[O-])cc2)[n+]2cccc(C)c2)cc1Cl 726962079 OGMRILIDYGDFEN-UHFFFAOYSA-O 456.931 5.176 5 20 JKBD CC(=O)Nc1ccc(Cl)c(NC(=O)CCC(=O)c2ccc3ccc4cccc5ccc2c3c45)c1 727756085 NJSAHIPUAVYWJS-UHFFFAOYSA-N 468.940 6.797 5 20 JKBD Cc1csc(Sc2ccc(C(=O)N3c4ccc([N+](=O)[O-])cc4C[C@@H]3C)cc2[N+](=O)[O-])n1 728808235 CRJFIALFRCTCKH-LBPRGKRZSA-N 456.505 5.011 5 20 JKBD C[C@H](Nc1ccc(C(=O)Nc2ccc(N3CCCC3)c(Cl)c2)cc1[N+](=O)[O-])c1ccccn1 730841073 ZAVVLEIEZBUOKO-INIZCTEOSA-N 465.941 5.669 5 20 JKBD CN(CCCCCc1cc(-c2cccc(F)c2)no1)C(=O)c1ccc(Br)c([N+](=O)[O-])c1 745822704 LOKCRELPXMSOLW-UHFFFAOYSA-N 490.329 5.636 5 20 JKBD Cc1c(C(=O)N[C@@H](C)c2ccc(NC(=O)c3ccc(F)cc3)cc2)cc([N+](=O)[O-])c(C)c1[N+](=O)[O-] 748625416 FMLHCNCGWMDAPF-HNNXBMFYSA-N 480.452 5.002 5 20 JKBD Cc1nc(COc2ccc(F)cc2)sc1C(=O)O[C@H](C)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 818168921 UNEFOGUIZYJQTI-CYBMUJFWSA-N 484.465 5.046 5 20 JKBD O=C(Cc1cccc2cccnc12)O[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1 834076096 ZKKDFFUMPKRQHF-DEOSSOPVSA-N 475.888 5.262 5 20 JKBD CCn1cc([N+](=O)[O-])c(-c2nc(-c3ccc(Oc4ncc(C(F)(F)F)cc4Cl)cc3)no2)n1 904668499 KQKRFPHRRGOOMW-UHFFFAOYSA-N 480.790 5.388 5 20 JKBD CCCCn1c(-c2ccc(Cl)cc2)nn(CCC(=O)N(C)Cc2ccccc2[N+](=O)[O-])c1=S 914728931 MKIUIWMICRBLCI-UHFFFAOYSA-N 488.013 5.491 5 20 JKBD Cc1sc(NC(=O)c2ccccc2OCc2cn3ccccc3n2)nc1-c1cccc([N+](=O)[O-])c1 917791509 SHSVYETVNYQDIX-UHFFFAOYSA-N 485.525 5.506 5 20 JKBD CCOc1ccccc1CN(C)C(=O)c1ccccc1NC(=O)c1ccc([N+](=O)[O-])cc1Cl 918643482 RUAYEJKOUXDPFF-UHFFFAOYSA-N 467.909 5.171 5 20 JKBD CSc1ccc([N+](=O)[O-])c(C(=O)OCC(=O)N2CCC[C@@H]2c2ccc(Cl)c(Cl)c2)c1 918921552 QNXGRDOSWVBAPF-QGZVFWFLSA-N 469.346 5.144 5 20 JKBD O=C(OCC[C@@H]1CCCCN1C(=O)c1ccc(Oc2cccnc2)cc1)c1cccc([N+](=O)[O-])c1 920342664 GXBIPMULXLJNIX-NRFANRHFSA-N 475.501 5.024 5 20 JKBD C[C@H](Nc1ccc(C(=O)OCc2csc(-c3cccs3)n2)cc1[N+](=O)[O-])c1ccccn1 920548774 SKFCVAWGCLIFBN-AWEZNQCLSA-N 466.544 5.705 5 20 JKBD O=C(NC1(c2ccc(NC(=O)c3ccc([N+](=O)[O-])cc3F)cc2)CCC1)c1ccc(-c2ncc[nH]2)cc1 1790624223 GARQSOJXYWFABY-UHFFFAOYSA-N 499.502 5.186 5 20 JKBD C[C@@H](CC(=O)Nc1ccc(C2(NC(=O)Cc3cccc([N+](=O)[O-])c3)CCC2)cc1)Oc1ccccc1 1791144114 KAJIPQCPUMAWEX-FQEVSTJZSA-N 487.556 5.129 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CCCCCC(C)(C)C)C2 1800699256 MWSHZYPLHKWVFP-REPLKXPHSA-N 461.578 5.291 5 20 JKBD Cc1cc(Cl)cc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)c1 1801208861 VCPRLTDZCDSIGK-REPLKXPHSA-N 483.977 5.337 5 20 JKBD CC1(C)CC(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)c3cc4cc([N+](=O)[O-])ccc4s3)[nH]n2)C1 1822475216 HTDSWFHOGSEMEI-SFHVURJKSA-N 481.578 5.275 5 20 JKBD CN(Cc1cc([N+](=O)[O-])ccc1Cl)C(=O)C[C@@H](NC(=O)c1ccccc1Cl)c1ccccc1 10899677 DCOQPTWPUVXGAY-JOCHJYFZSA-N 486.355 5.421 5 20 JKBD CC(C)n1ncc2c(C(=O)N(C)Cc3cc([N+](=O)[O-])ccc3Cl)cc(-c3ccco3)nc21 10904342 ABYVESPGQVZNIY-UHFFFAOYSA-N 453.886 5.106 5 20 JKBD Cc1ccc(Sc2ccc(C(=O)NC3CCN(C(=O)Nc4ccccc4)CC3)cc2[N+](=O)[O-])cc1 12797496 CJDWQUXWWUAPFW-UHFFFAOYSA-N 490.585 5.481 5 20 JKBD C[C@@H](c1ccc(-n2cncn2)cc1)N(C)C(=O)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1 15095922 JRMJVBLURXTXET-INIZCTEOSA-N 477.908 5.454 5 20 JKBD C[C@H](Sc1nc(-c2ccc(Cl)cc2)n[nH]1)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 21451575 LSBDZQMMHDBHQV-VIFPVBQESA-N 471.848 5.171 5 20 JKBD C[C@@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)N[C@H](C)c1ccc(NC(=O)c2ccc(F)cc2)cc1 71988243 QJFVBXCEIUFAIQ-HZPDHXFCSA-N 467.522 5.344 5 20 JKBD Cc1ccc(NC(=O)CSc2ccc(C(F)(F)F)cc2[N+](=O)[O-])c(OCC(F)(F)F)c1 72023868 RJEKMMWBEYYYFG-UHFFFAOYSA-N 468.375 5.594 5 20 JKBD COc1ccc([C@@H](CNC(=O)c2cc(SC)ccc2[N+](=O)[O-])c2c[nH]c3ccccc23)cc1 105256153 CFGQUERYHZYOFN-OAQYLSRUSA-N 461.543 5.369 5 20 JKBD O=C(Nc1ccc(NC(=O)N2CCCCCC2)cc1)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-] 109666873 GWUQXOWKSLVYOB-UHFFFAOYSA-N 480.443 5.196 5 20 JKBD C[C@H](Sc1ncccc1[N+](=O)[O-])C(=O)N1N=C(c2ccc(Cl)cc2)C[C@@H]1c1ccco1 195660994 ULFJQJIDNKKRCA-SCLBCKFNSA-N 456.911 5.095 5 20 JKBD CC(C)Oc1ccc(NC(=O)Cc2cn(-c3ccccc3)nc2-c2ccc([N+](=O)[O-])cc2)c(F)c1 303033332 OMLKCYKUKFNJNO-UHFFFAOYSA-N 474.492 5.555 5 20 JKBD C[C@H](Nc1ccc(C(=O)Nc2c(F)cccc2Oc2ccccc2)cc1[N+](=O)[O-])c1ccccn1 410032423 CNQCOUQOZODMAG-KRWDZBQOSA-N 472.476 6.347 5 20 JKBD Cc1cc(N2CCOCC2)ccc1NC(=O)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1 497336201 JKTPTNQIYHMZJB-UHFFFAOYSA-N 467.909 5.438 5 20 JKBD O=C(NCc1ccccc1-c1ccc(Cn2ccnc2)cc1)c1cc2cc([N+](=O)[O-])ccc2s1 504804909 HLNOZVPXOQGRAC-UHFFFAOYSA-N 468.538 5.651 5 20 JKBD C[C@@H](Nc1ccc(C(=O)N[C@@H](c2ccccc2)c2ccc(F)cc2)cc1[N+](=O)[O-])c1ccccn1 506178427 KHLHKAQUYWVHFZ-DWXRJYCRSA-N 470.504 5.821 5 20 JKBD O=C(c1c2c(nc3ccccc13)/C(=C/c1cccc([N+](=O)[O-])c1)CCC2)N1CCC(c2ncc[nH]2)CC1 509951278 GAKBHEWVSMGCOG-HEHNFIMWSA-N 493.567 5.763 5 20 JKBD C[C@@H](S[C@H](C)c1ccc(OC(F)(F)F)cc1)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 518917013 NWPCICUTWYRVKX-GHMZBOCLSA-N 482.402 6.334 5 20 JKBD O=[N+]([O-])c1ccc(-c2ccc(CNCc3ccnc(OCc4ccccc4)c3)o2)c(Br)c1 520204886 LHEZIYMMUFGJCC-UHFFFAOYSA-N 494.345 5.881 5 20 JKBD O=[N+]([O-])c1ccc(-c2ccc(CNCc3ccc(-n4cccn4)cc3)o2)c(Br)c1 520204906 LSWXICFCQVKJFZ-UHFFFAOYSA-N 453.296 5.093 5 20 JKBD CN(C[C@H]1CCCOC1)C(=O)c1c2c(nc3ccccc13)/C(=C\c1ccc([N+](=O)[O-])cc1)CCC2 521683996 LVTNCSWZIPNTSD-JSZIULHXSA-N 471.557 5.519 5 20 JKBD C[C@H]1CCCN(c2ccc(C(=O)Nc3ccccc3NC(=O)c3cccs3)cc2[N+](=O)[O-])C1 522557443 NWVANCHKBJAPIY-INIZCTEOSA-N 464.547 5.397 5 20 JKBD COc1ccc(CC[C@H]2CCCCN2C(=O)c2cc(OCC(F)(F)F)ccc2[N+](=O)[O-])cc1OC 523565614 JMVKAOYFASGECX-QGZVFWFLSA-N 496.482 5.181 5 20 JKBD O=C(CSc1ccc(C(F)(F)F)cc1[N+](=O)[O-])Nc1ccc(C(=O)N2CCCCCC2)cc1 603990738 LYWMDZZTJKXERG-UHFFFAOYSA-N 481.496 5.361 5 20 JKBD CC(C)CCSc1ccc(C(=O)N2C[C@@H](C(F)(F)F)C[C@H](C(F)(F)F)C2)cc1[N+](=O)[O-] 604257971 RCZVMPYODDMGLY-KBPBESRZSA-N 472.451 5.936 5 20 JKBD O=C(Nc1cc(Br)ccc1Cl)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-] 608945834 OWAFRNRWJUGZJS-UHFFFAOYSA-N 453.598 5.204 5 20 JKBD C[C@@H](OC(=O)[C@H](C)c1c(Cl)cccc1Cl)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 726029443 QHIQNGOKCVAAOQ-NXEZZACHSA-N 479.238 5.594 5 20 JKBD CCOc1ccccc1NC(=O)[C@H](OC(=O)c1c[nH]c2ccc([N+](=O)[O-])cc12)c1ccccc1 749318602 WDHWUGQTZUSPBY-HSZRJFAPSA-N 459.458 5.012 5 20 JKBD Cc1oc(-c2cccs2)nc1CC(=O)Oc1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2Cl)cc1 818828796 YDOMITLWPYOYGX-UHFFFAOYSA-N 497.916 5.674 5 20 JKBD O=C(Cc1cccc2cccnc12)Oc1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2Cl)cc1 832804611 NNSOGGBJTAOOGY-UHFFFAOYSA-N 461.861 5.197 5 20 JKBD Cc1ccccc1OCCCC(=O)Nc1ccc(CNC(=S)Nc2ccc([N+](=O)[O-])cc2)cc1 916014958 RUEFQXKZHXWJKM-UHFFFAOYSA-N 478.574 5.188 5 20 JKBD C[C@H](OC(=O)[C@H](C)Sc1ccc([N+](=O)[O-])cc1)C(=O)Nc1c(Cl)cc(Cl)cc1Cl 916522716 JPYILOSFHKPATG-UWVGGRQHSA-N 477.753 5.606 5 20 JKBD C[C@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)OCC(=O)N1c2ccccc2Sc2ccccc21 916523263 YQUAOZKMXISZDV-HNNXBMFYSA-N 466.540 5.448 5 20 JKBD CCOc1ccccc1NC(=O)[C@@H](OC(=O)c1cc2cc([N+](=O)[O-])ccc2o1)c1ccccc1 917263150 LFBFCIWRVGNIRW-QHCPKHFHSA-N 460.442 5.277 5 20 JKBD Cc1cc(C(=O)N2CCCC[C@H]2C)ccc1NC(=O)c1cc([N+](=O)[O-])ccc1N1CCCCC1 921153331 INWGZODRQBDQLD-LJQANCHMSA-N 464.566 5.160 5 20 JKBD Cc1oc(C(C)(C)C)cc1C(=O)NC1(c2ccc(NC(=O)c3ccc([N+](=O)[O-])o3)cc2)CCC1 1785747804 CMOZBLQVZQGPDR-UHFFFAOYSA-N 465.506 5.448 5 20 JKBD COc1cc(C(=O)NC2(c3ccc(NC(=O)[C@@H]4CC=C(C)CC4)cc3)CCC2)ccc1[N+](=O)[O-] 1789113932 GPIQDCCMSZNJPF-GOSISDBHSA-N 463.534 5.098 5 20 JKBD O=C(Cc1cc(F)ccc1[N+](=O)[O-])NC1(c2ccc(NC(=O)c3cccc4cnccc34)cc2)CCC1 1789327980 VMPKHOHKGRCUDP-UHFFFAOYSA-N 498.514 5.273 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)c3cccc4cccnc34)CCC2)cc1)c1cccc(F)c1[N+](=O)[O-] 1790698930 OHMKUNYWTKEAGA-UHFFFAOYSA-N 484.487 5.344 5 20 JKBD COc1cc(C(=O)Nc2ccc(C3(NC(=O)c4cc(C)cs4)CCC3)cc2)cc([N+](=O)[O-])c1OC 1790812668 KSZVWRSIGDGADY-UHFFFAOYSA-N 495.557 5.043 5 20 JKBD O=C(/C=C/c1ccccc1[N+](=O)[O-])Nc1ccc(C2(NC(=O)CCCn3cccc3)CCC2)cc1 1792319384 PNLLVWBXFQKPON-XNTDXEJSSA-N 472.545 5.024 5 20 JKBD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H]1C[C@@H]1c1ccc(F)cc1)c1cc2cc([N+](=O)[O-])ccc2s1 1792918493 RRWLJMACNFYXMD-MGFHSNFOSA-N 493.560 5.004 5 20 JKBD Cc1cc(Cl)c(Cl)cc1C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2ccc([N+](=O)[O-])o2)[nH]n1 1821336937 RIKRDWGVVBNRTL-INIZCTEOSA-N 492.319 5.146 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)N1CCCC[C@@H]1C1CCN(C(=O)[C@@H](C)c2cccs2)CC1 1830728494 DLGWHVQHJROYNH-LAUBAEHRSA-N 487.597 5.141 5 20 JKBD C[C@@H]1CCC[C@H]1C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)CC1 1831061589 WUPYXDWCMGNBSG-YHYVQYDKSA-N 483.634 5.479 5 20 JKBD COc1cc(C(=O)O[C@@H](C)C(=O)Nc2cc([N+](=O)[O-])ccc2Cl)ccc1OCc1ccccc1 9180215 PPWWEBFPGBDFRI-HNNXBMFYSA-N 484.892 5.020 5 20 JKBD COc1cc(C(=O)O[C@H](C)c2nc3ccccc3c(=O)[nH]2)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 10912170 DZPBKOCIYJGIIS-CYBMUJFWSA-N 495.875 5.204 5 20 JKBD CC(C)N(Cc1nnc(-c2cccc([N+](=O)[O-])c2)o1)C(=O)c1cccc(Oc2ccccc2)c1 16014841 VGBCZTYOHCWNCC-UHFFFAOYSA-N 458.474 5.488 5 20 JKBD CSc1ccc([N+](=O)[O-])c(C(=O)OCc2csc(N(C(C)=O)c3c(C)cc(C)cc3C)n2)c1 16196876 CGSCDRSNNJFANM-UHFFFAOYSA-N 485.587 5.740 5 20 JKBD CN(Cc1cc([N+](=O)[O-])ccc1Cl)Cn1nc(-c2ccncc2)n(Cc2ccccc2)c1=S 27533117 QYWWHRHBBSMWIC-UHFFFAOYSA-N 480.981 5.175 5 20 JKBD O=[N+]([O-])c1ccc(-c2nnc(CSc3nnc(-c4ccccc4)n3-c3ccc(F)cc3)o2)cc1 29825812 YBUXGHVYDGJDDC-UHFFFAOYSA-N 474.477 5.324 5 20 JKBD C[C@@H](Nc1ccc(C(=O)N(Cc2ccccc2)Cc2ccco2)cc1[N+](=O)[O-])c1ccccn1 72016668 WCOUTXHGEHMYLM-LJQANCHMSA-N 456.502 5.599 5 20 JKBD COc1cc(C(=O)N(C[C@H]2CCCO2)[C@H]2CCSC2)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 106000827 SSDGGHHCFRQYFU-ZWKOTPCHSA-N 492.981 5.176 5 20 JKBD C[C@@H](Nc1ccc(C(=O)N(Cc2cccc(F)c2)C[C@@H]2CCCO2)cc1[N+](=O)[O-])c1ccccn1 109589169 AQLUSWIYUOIMGQ-GCJKJVERSA-N 478.524 5.123 5 20 JKBD C[C@@H]1C[C@@H](C)CN(c2ccc(C(=O)Nc3ccc(C(=O)Nc4nccs4)cc3)cc2[N+](=O)[O-])C1 302929939 GBEXSAHQABREHD-HZPDHXFCSA-N 479.562 5.038 5 20 JKBD O=C(Nc1ccccc1Oc1ccccc1Cl)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-] 478131087 GRGZQJDRRAJLRA-UHFFFAOYSA-N 466.799 6.234 5 20 JKBD Cc1cc(C(=O)Nc2nc(-c3cccc([N+](=O)[O-])c3)cs2)c2cnn(Cc3cccs3)c2n1 483745163 KWCZDUNBQBLQEQ-UHFFFAOYSA-N 476.543 5.134 5 20 JKBD C[C@@H]1CCCN(c2ccc(C(=O)Nc3nnc(SCc4cccs4)s3)cc2[N+](=O)[O-])C1 498606324 LGQBQRXGFPCFAN-CYBMUJFWSA-N 475.621 5.289 5 20 JKBD O=C(Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1)c1oc2ccccc2c1CSc1ncccn1 499329374 VNKSNUKTCPXKFS-UHFFFAOYSA-N 489.538 5.799 5 20 JKBD COc1cc(OC)c(CNCc2ccc(Oc3ccccc3Cl)c([N+](=O)[O-])c2)c(OC)c1 509602307 RNXVSWHKYZGCDB-UHFFFAOYSA-N 458.898 5.356 5 20 JKBD CC(=O)Nc1ccc(Cl)c(NC(=O)c2ccc(Sc3nc(C)cs3)c([N+](=O)[O-])c2)c1 515728246 AYCWCVIPWBJNFJ-UHFFFAOYSA-N 462.940 5.375 5 20 JKBD O=C(NCc1nnc2c(Cl)cc(C(F)(F)F)cn12)c1cc([N+](=O)[O-])ccc1Oc1ccccc1 516504943 GBLDNJUXHVMRNQ-UHFFFAOYSA-N 491.813 5.032 5 20 JKBD CC[C@H](NCc1ccc(-c2ccccc2[N+](=O)[O-])s1)c1ccccc1OCC(=O)N1CCCC1 518263507 PUOYMOUQAKQGEC-QFIPXVFZSA-N 479.602 5.565 5 20 JKBD COC(=O)c1cc(-c2cccc(C(F)(F)F)c2)ccc1NC(=O)c1cc([N+](=O)[O-])cnc1C 521392116 FOXXXGVVZGEJKD-UHFFFAOYSA-N 459.380 5.023 5 20 JKBD Cn1ccnc1[C@H](NCc1ccc(Oc2ccc(F)cc2)c([N+](=O)[O-])c1)c1ccc(Cl)cc1 521821500 ZSTFTHLZQWTEPL-HSZRJFAPSA-N 466.900 5.792 5 20 JKBD Cc1ccc(-c2nc(C)sc2CC(=O)N(Cc2ccccc2[N+](=O)[O-])CC(F)(F)F)cc1 603741288 WZDQPXBMJQSSJQ-UHFFFAOYSA-N 463.481 5.469 5 20 JKBD CN(Cc1cc(Br)cs1)C(=O)CSc1ccc(C(F)(F)F)cc1[N+](=O)[O-] 603762550 SCQJARIDTDHQDD-UHFFFAOYSA-N 469.304 5.188 5 20 JKBD CC(C)c1ccc([C@H](NC(=O)N2CCN(C(=O)c3ccc([N+](=O)[O-])s3)CC2)c2cccs2)cc1 603802010 WNOWQPJNILMCFN-QFIPXVFZSA-N 498.630 5.098 5 20 JKBD C[C@H](NC(=O)[C@@H](C)Oc1ccc(Cl)cc1[N+](=O)[O-])c1ccc(NC(=O)c2ccc(F)cc2)cc1 604443827 QHTFAMPJJWYBOS-LSDHHAIUSA-N 485.899 5.284 5 20 JKBD Cc1noc(CCCNC(=O)c2c3c(nc4ccccc24)/C(=C\c2ccc([N+](=O)[O-])cc2)CCC3)n1 608965565 ICMAKXCCQCORGQ-MNDPQUGUSA-N 483.528 5.074 5 20 JKBD O=C(c1cccc(CS(=O)(=O)c2ccccc2)c1)N(CC1CC1)c1ccc(Cl)c([N+](=O)[O-])c1 728165631 MOHCUTMXRZYIMT-UHFFFAOYSA-N 484.961 5.279 5 20 JKBD CSCC[C@H](NC(=O)c1ccc(Cl)cc1Cl)C(=O)O[C@H](C)c1cccc([N+](=O)[O-])c1 729357372 JNTYTULFWDXENZ-XIKOKIGWSA-N 471.362 5.058 5 20 JKBD O=C(Nc1ccc(Cl)c([N+](=O)[O-])c1)c1cnn(-c2ncccc2Cl)c1C(F)(F)Cl 730957597 BWDROHNLEQVZFT-UHFFFAOYSA-N 462.627 5.023 5 20 JKBD C[C@@H](OC(=O)c1ccc(C(C)(C)C)c([N+](=O)[O-])c1)C(=O)Nc1ccc(NC(=O)c2cccs2)cc1 750115816 NLPMQMNWPXKODN-OAHLLOKOSA-N 495.557 5.390 5 20 JKBD COc1ccc(C(=O)Oc2ccc(NC(=O)c3cc([N+](=O)[O-])ccc3Cl)cc2)cc1OC(F)F 915811509 VTUQBNWKFQUAAR-UHFFFAOYSA-N 492.818 5.330 5 20 JKBD Cc1ccc(OCCCC(=O)Nc2ccc(CNC(=S)Nc3ccc([N+](=O)[O-])cc3)cc2)cc1 916012575 OPLRVOGNSDAAMK-UHFFFAOYSA-N 478.574 5.188 5 20 JKBD O=C(Oc1ccc2c(-c3ccc([N+](=O)[O-])cc3)cc(=O)oc2c1)[C@@H]1CCC[C@H](C(F)(F)F)C1 916035252 IBXORKZHYRAJGX-CABCVRRESA-N 461.392 5.642 5 20 JKBD Cc1ccc([N+](=O)[O-])cc1OC(=O)[C@H](C)SCc1nc(O)c2c(-c3ccccc3)csc2n1 916403111 SIOJFQBYRJIEPK-AWEZNQCLSA-N 481.555 5.508 5 20 JKBD CCN(Cc1cccc(NC(=O)Cn2c3ccccc3c(=O)c3ccccc32)c1)C(=O)OC(C)(C)C 918106602 VUJQMAMJUAPKFU-UHFFFAOYSA-N 485.584 5.550 5 20 JKBD Cc1cc(NC(=O)c2cc([N+](=O)[O-])ccc2N2CCC(C)CC2)ccc1NC(=O)c1ccco1 918668386 XZAGNGGBJMHZRF-UHFFFAOYSA-N 462.506 5.237 5 20 JKBD C[C@H](OC(=O)c1cc([N+](=O)[O-])ccc1Oc1ccccc1)C(=O)N(C)Cc1nc2ccccc2s1 919193487 SGLOUNIJYUIFSR-INIZCTEOSA-N 491.525 5.201 5 20 JKBD Cc1cc(C)c(NC(=S)/C(=C(/O)c2ccc(C)c([N+](=O)[O-])c2)[n+]2cc(O)ccc2C)c(Cl)c1 920484370 GNBRBRRZZYCLHO-UHFFFAOYSA-O 484.985 5.798 5 20 JKBD CSc1cccc(NC(=O)[C@@H](C)OC(=O)c2ccc(N[C@@H](C)c3ccccn3)c([N+](=O)[O-])c2)c1 920547511 OHSHFEJQANSVSF-JKSUJKDBSA-N 480.546 5.069 5 20 JKBD CC(C)Oc1ccc(Cl)cc1C(=O)O[C@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 920619117 ZRYGWBKUTXXGNY-LLVKDONJSA-N 474.819 5.238 5 20 JKBD O=C(Cc1cccc([N+](=O)[O-])c1)Nc1ccc(C2(NC(=O)c3cc4ccsc4[nH]3)CCC2)cc1 1785795460 PGPKITADDUWEHZ-UHFFFAOYSA-N 474.542 5.128 5 20 JKBD O=C(/C=C/c1ccc([N+](=O)[O-])o1)Nc1ccc(C2(NC(=O)c3cc(F)c(F)cc3F)CCC2)cc1 1786207664 AJUVLVIJBJANMN-SOFGYWHQSA-N 485.418 5.066 5 20 JKBD CSc1ccc(CC(=O)NC2(c3ccc(NC(=O)/C=C/c4ccc([N+](=O)[O-])o4)cc3)CCC2)cc1 1786208213 NZPNLSZIJWNOJQ-UKTHLTGXSA-N 491.569 5.300 5 20 JKBD O=C(/C=C/c1ccc([N+](=O)[O-])o1)Nc1ccc(C2(NC(=O)CCc3ccc(F)cc3)CCC2)cc1 1786208288 XFQSGJFUZQHFAY-SDNWHVSQSA-N 477.492 5.107 5 20 JKBD O=C(CSC1CCCC1)Nc1ccc(C2(NC(=O)Cc3ccc([N+](=O)[O-])cc3F)CCC2)cc1 1786348282 KMHWBQCULKWLER-UHFFFAOYSA-N 485.581 5.086 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)c3ccc([N+](=O)[O-])c4c3OCO4)CCC2)cc1)c1ccc(Cl)s1 1787327440 XOCYGSXNSLCPLF-UHFFFAOYSA-N 499.932 5.100 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)c3cccc4ncsc34)CCC2)cc1)c1cccc(F)c1[N+](=O)[O-] 1790700940 DHRGAQNAPVEXHX-UHFFFAOYSA-N 490.516 5.405 5 20 JKBD CCn1nccc1C(=O)NC1(c2ccc(NC(=O)c3cc4cc([N+](=O)[O-])ccc4s3)cc2)CCC1 1791009933 CLMXXKGMVANUEZ-UHFFFAOYSA-N 489.557 5.087 5 20 JKBD O=C(Cc1cc(F)ccc1[N+](=O)[O-])NC1(c2ccc(NC(=O)[C@]3(F)CCCC=C3F)cc2)CCC1 1792378569 UVWCMDSVBMJZEV-VWLOTQADSA-N 487.478 5.156 5 20 JKBD C[C@H]1CC[C@H](C(=O)N2CCCC[C@H]2c2cc(NC(=O)Cc3ccc(Cl)cc3[N+](=O)[O-])n[nH]2)CC1 1814846801 WPAXDQFIYOSGAY-FTRWYGJKSA-N 487.988 5.032 5 20 JKBD Cc1c(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)CCC(C)C)[nH]n2)cc(Cl)cc1[N+](=O)[O-] 1821292180 BGRBDWQILKTAMA-SFHVURJKSA-N 461.950 5.022 5 20 JKBD O=C(c1cc2cc([N+](=O)[O-])ccc2s1)N1CCC([C@@H]2CCCCN2C(=O)C[C@H]2CCCCO2)CC1 1824913454 NCLPUUREQRUBST-YADHBBJMSA-N 499.633 5.002 5 20 JKBD C/C(=C\c1cccs1)C(=O)N1CCC([C@H]2CCCCN2C(=O)Cc2cc([N+](=O)[O-])ccc2F)CC1 1824945965 AARIBXMQRZMGRD-MMYRTMNYSA-N 499.608 5.061 5 20 JKBD Cc1ccc(CC(=O)N2CCC([C@H]3CCCCN3C(=O)c3cccc(Cl)c3)CC2)cc1[N+](=O)[O-] 1829975017 BVZZXTIECAFUNW-HSZRJFAPSA-N 483.996 5.033 5 20 JKBD C/C(=C\c1cccs1)C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cccc(F)c2[N+](=O)[O-])CC1 1830617176 SWYCLYJVACZADY-QWYDYZLZSA-N 485.581 5.132 5 20 JKBD CSc1ccc(C(=O)c2ccccc2C(=O)OCc2ncc(-c3ccccc3)o2)cc1[N+](=O)[O-] 10154856 LPMGYFSGBNIAKN-UHFFFAOYSA-N 474.494 5.560 5 20 JKBD Cc1ccccc1-n1c(S[C@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)nnc1-c1cccnc1 20753558 DNZWXMNBYXPXMH-OAHLLOKOSA-N 494.964 5.319 5 20 JKBD CCCCCn1c(SCc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)nc2cc(Cl)ccc2c1=O 36228164 KNYREIPIZUHNGQ-UHFFFAOYSA-N 485.953 5.491 5 20 JKBD CC1CCN([C@@H](CNC(=O)c2ccc(N[C@@H](C)c3ccccn3)c([N+](=O)[O-])c2)c2cccs2)CC1 108751795 YWQJZKCEUVSKAU-CYFREDJKSA-N 493.633 5.427 5 20 JKBD Cc1csc(Sc2ccc(C(=O)N3CCC(COc4ccccc4)CC3)cc2[N+](=O)[O-])n1 410129073 WSTQHZULYMVPOH-UHFFFAOYSA-N 469.588 5.442 5 20 JKBD O=C(Nc1ccccc1)c1ccc(Cl)c(NC(=O)c2csc(-c3cccc([N+](=O)[O-])c3)n2)c1 496365622 ULQWCABVRXCNRA-UHFFFAOYSA-N 478.917 5.876 5 20 JKBD CC(C)OC(=O)C[C@@H](NC(=O)c1ccc(NC(=O)Nc2ccccc2)cc1)c1ccccc1[N+](=O)[O-] 504389207 VADYAKADANIDHZ-JOCHJYFZSA-N 490.516 5.052 5 20 JKBD O=C(Nc1nc2c(C(F)(F)F)cccc2s1)c1ccc([N+](=O)[O-])cc1I 508779115 OXIBNLBTJGPAHS-UHFFFAOYSA-N 493.204 5.080 5 20 JKBD CC(C)NC(=O)c1ccc(N[C@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2ccccc2)cc1 511019294 VRRZIBWSCHQLMJ-QFIPXVFZSA-N 466.925 5.178 5 20 JKBD COc1cc(C(=O)N(C2CC2)[C@@H](C)c2ccccc2Cl)c([N+](=O)[O-])cc1OCc1cscn1 512415839 PFNDXLFDMFTYDE-AWEZNQCLSA-N 487.965 5.658 5 20 JKBD O=C(CN1CCC[C@H]1c1cccs1)Nc1cc(N2CCC[C@H]2c2cccs2)ccc1[N+](=O)[O-] 514884973 QAVYPUZPXDGSOA-SFTDATJTSA-N 482.631 5.835 5 20 JKBD C[C@@H](SCc1nc(O)c2c(-c3ccccc3)csc2n1)C(=O)N[C@H](C)c1cccc([N+](=O)[O-])c1 515681839 YKOKOXVTCIFTJJ-HUUCEWRRSA-N 494.598 5.471 5 20 JKBD COc1cc(C(=O)NC[C@@H](OC)c2ccccc2)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 516138621 GYJRIEUOSIUEKJ-JOCHJYFZSA-N 456.882 5.167 5 20 JKBD COc1cc(C(=O)Nc2cccc(Cl)c2OC)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 517654262 IYLGKBCFUGSGRL-UHFFFAOYSA-N 463.273 5.963 5 20 JKBD COCCN(C(=O)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1)[C@H](C)c1ccccc1 603529018 BKGSTOAYVNTKOY-QGZVFWFLSA-N 479.499 5.066 5 20 JKBD COc1ccc([N+](=O)[O-])cc1C(=O)Nc1ccc(NC(=O)c2ccc(F)cc2)cc1C(F)(F)F 603742843 GIDAAPJBJFXLFR-UHFFFAOYSA-N 477.370 5.266 5 20 JKBD Cc1ccc(NC(=O)c2ccccc2)cc1NC(=O)C1CCN(c2ccccc2[N+](=O)[O-])CC1 603774405 XWNRDDUKTBMYQH-UHFFFAOYSA-N 458.518 5.011 5 20 JKBD C[C@H]1C[C@@H](C)CN(c2ccc(C(=O)N3C[C@H](C(F)(F)F)C[C@@H](C(F)(F)F)C3)cc2[N+](=O)[O-])C1 604257912 OJJCKNLHPVJZML-OCVGTWLNSA-N 481.437 5.280 5 20 JKBD CCCC(=O)Nc1cccc(CNCc2ccc(Oc3ccccc3Cl)c([N+](=O)[O-])c2)c1 608781970 QJMKUAFGRNPDDY-UHFFFAOYSA-N 453.926 6.069 5 20 JKBD C[C@H](CC(=O)Nc1cccc(N2CCCC2)c1)NCc1ccc(-c2ccccc2[N+](=O)[O-])s1 608837260 QNDMHUBYNPJJAN-GOSISDBHSA-N 464.591 5.430 5 20 JKBD O=C(C1CCN(c2ccccc2[N+](=O)[O-])CC1)N1CCCC[C@@H]1c1ccccc1C(F)(F)F 608945297 DUYVEQHIIYQEDW-HXUWFJFHSA-N 461.484 5.584 5 20 JKBD CCN(Cc1ccccc1)C(=O)c1cc(NC(=O)Cc2ccc(OC)c([N+](=O)[O-])c2)ccc1Cl 609011080 XYTHXUXPWIAMBV-UHFFFAOYSA-N 481.936 5.100 5 20 JKBD Cc1oc(-c2ccsc2)nc1COC(=O)c1ccccc1C(=O)c1ccc(Cl)c([N+](=O)[O-])c1 726804720 NXIGXFZZTKDNLG-UHFFFAOYSA-N 482.901 5.861 5 20 JKBD C[C@H](OC(=O)[C@@H](C)Oc1cc(Cl)cc(Cl)c1)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 727216798 DGVPVNUZTSYTLH-WDEREUQCSA-N 452.250 5.023 5 20 JKBD O=C(O[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1)c1cc(F)c(F)c(F)c1 728652347 HPVCEBKEVHMASX-IBGZPJMESA-N 464.783 5.202 5 20 JKBD C[C@H](OC(=O)c1cn(C(C)(C)C)nc1-c1ccccc1Cl)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 731089231 WOTCHKWGIVCKKC-AWEZNQCLSA-N 495.923 5.835 5 20 JKBD CC1CCN(c2ccc([N+](=O)[O-])cc2C(=O)N[C@H](C)c2nc3ccccc3n2C(F)F)CC1 823765261 IULAFAOZXRPNMO-OAHLLOKOSA-N 457.481 5.067 5 20 JKBD COc1cc2c(cc1OC)[C@@H](c1ccccc1)N(C(=O)c1cc(Cl)ccc1[N+](=O)[O-])CC2 863930732 OUFJNFDMYSYCMA-HSZRJFAPSA-N 452.894 5.053 5 20 JKBD C[C@@H](OC(=O)CCOc1ccccc1-c1ccccc1)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 914999769 COPXHPPARKPOPI-QGZVFWFLSA-N 459.458 5.385 5 20 JKBD Cc1noc(C)c1CN(C)C(=O)c1ccc(Sc2nc3ccccc3s2)c([N+](=O)[O-])c1 915195413 ZOVNYFJFXAKHGB-UHFFFAOYSA-N 454.533 5.233 5 20 JKBD CN(C(=O)c1cccs1)c1ccccc1C(=O)OCCOc1ccc([N+](=O)[O-])c(C(F)(F)F)c1 920146148 QJWTWNVSJTUBSE-UHFFFAOYSA-N 494.447 5.188 5 20 JKBD CC(C)CCC(=O)NC1(c2ccc(NC(=O)Cn3ccc4ccc([N+](=O)[O-])cc43)cc2)CCC1 1786276913 PLPXIKMJUCPEHG-UHFFFAOYSA-N 462.550 5.120 5 20 JKBD O=C(Cc1cc([N+](=O)[O-])ccc1F)Nc1ccc(C2(NC(=O)C[C@H]3C[C@@H]4CC[C@H]3C4)CCC2)cc1 1786671598 NOIAVQWVZLKOOJ-CEXWTWQISA-N 479.552 5.237 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)c3ccc([N+](=O)[O-])o3)CCC2)cc1)c1ccc2occ(Cl)c2c1 1790089210 NSYPRFLIESRNOB-UHFFFAOYSA-N 479.876 5.649 5 20 JKBD COc1c(C(=O)NC2(c3ccc(NC(=O)c4cc(F)cc([N+](=O)[O-])c4)cc3)CCC2)ccc(F)c1F 1790699396 NRWCVSHIKIBEMA-UHFFFAOYSA-N 499.445 5.082 5 20 JKBD C[C@H](Sc1ccccn1)C(=O)Nc1ccc(C2(NC(=O)c3ccc([N+](=O)[O-])cc3F)CCC2)cc1 1791835481 WDJKSWASLNKZTR-INIZCTEOSA-N 494.548 5.057 5 20 JKBD Cc1cccc2cc(C(=O)N3[C@H]4CC[C@@H]3C[C@H](NC(=O)c3cc5cc([N+](=O)[O-])ccc5s3)C4)[nH]c12 1798027629 PCOQYVCAWAVDCF-REPLKXPHSA-N 488.569 5.165 5 20 JKBD CC(C)(C)c1cc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)ccn1 1801206207 VPLBNKHPCBTHHT-REPLKXPHSA-N 492.601 5.068 5 20 JKBD CC1=CC[C@H](C(=O)NC[C@@H]2CCN(C(=O)c3cc(Cl)cc([N+](=O)[O-])c3C)[C@H]2c2cccnc2)CC1 1809481878 AMWRHBXPJAAIGE-WXVUKLJWSA-N 496.995 5.018 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2c[nH]c(C(C)(C)C)c2)[nH]n1 1821282908 GKRPMJIQIDXBNP-LJQANCHMSA-N 496.543 5.011 5 20 JKBD O=C(Nc1cc([C@@H]2CCCCN2C(=O)/C=C/c2ccccc2[N+](=O)[O-])[nH]n1)c1ccc2ccoc2c1 1821461494 KDNJOHPJQKNFAM-NEQMZLFVSA-N 485.500 5.083 5 20 JKBD O=C(c1ccc(Cl)o1)N1CCCC[C@H]1C1CCN(C(=O)C2(c3cccc([N+](=O)[O-])c3)CCC2)CC1 1827984398 AVJSFAVVYGXTGA-NRFANRHFSA-N 499.995 5.196 5 20 JKBD O=C(CCc1cccc([N+](=O)[O-])c1)N1CCC([C@@H]2CCCCN2C(=O)c2ccc3occc3c2)CC1 1828255878 RYYXBSJOBUKQPM-VWLOTQADSA-N 489.572 5.207 5 20 JKBD CC[C@@H](C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cc(F)cc([N+](=O)[O-])c2)CC1)c1ccccc1 1830613940 IZRLHSDGZKEGIR-RPBOFIJWSA-N 481.568 5.161 5 20 JKBD C[C@H](OC(=O)c1c2c(nc3ccccc13)/C(=C/c1ccco1)CC2)C(=O)Nc1ccccc1[N+](=O)[O-] 8620794 ZECQIWRZRAXOHQ-UYTDBDHRSA-N 483.480 5.407 5 20 JKBD O=C(CSc1nnc(-c2ccc(Cl)cc2)n1Cc1ccco1)Nc1cc([N+](=O)[O-])ccc1F 21622981 DCZJXQDNVVWDPX-UHFFFAOYSA-N 487.900 5.018 5 20 JKBD C[C@H](Nc1ccc(C(=O)NCc2ccc(CN3CCCC[C@@H]3C)cc2)cc1[N+](=O)[O-])c1ccccn1 302979518 JJIDPSDTTMVSQL-SFTDATJTSA-N 487.604 5.467 5 20 JKBD COc1cccc(CCNC(=O)C/C(=C/c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)c1 483765500 ZHLGXPDGPHWAAJ-HKWRFOASSA-N 473.554 5.503 5 20 JKBD Cc1ccc(C(=O)N2C[C@@H](C)C[C@H](C)C2)cc1NC(=O)c1csc(-c2ccc([N+](=O)[O-])cc2)n1 498781441 RLMAFTADTVGLLD-HOTGVXAUSA-N 478.574 5.397 5 20 JKBD CN(CCc1ccncc1)C(=O)c1c2c(nc3ccccc13)/C(=C/c1ccc([N+](=O)[O-])cc1)CCC2 499945901 PAOJVXDSVUEXJL-ZBJSNUHESA-N 478.552 5.730 5 20 JKBD CCN(C(=O)c1ccc(N[C@@H](C)c2ccccn2)c([N+](=O)[O-])c1)c1cccc(Br)c1 506204124 OJFXQIGUDHAVHU-HNNXBMFYSA-N 469.339 5.592 5 20 JKBD Cc1ccc(Sc2ccc(CNCc3ccc(N4C[C@@H](C)O[C@H](C)C4)nc3)cc2[N+](=O)[O-])cc1 509598645 CUBAPYISACVOLN-WOJBJXKFSA-N 478.618 5.353 5 20 JKBD CCCN(C(=O)c1ccc(Cn2nc(C)c([N+](=O)[O-])c2C)cc1)[C@@H](C)c1ccccc1OC 514495629 NFMWAILQOOKIFX-SFHVURJKSA-N 450.539 5.078 5 20 JKBD O=C(C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)NCc1cn2ccsc2n1 518976923 SVCUSNKOQOJQKR-LFIBNONCSA-N 475.555 5.161 5 20 JKBD Cc1nc(-c2ccc(F)cc2)sc1[C@H](C)N[C@@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl 520634571 UIPWFJXACZIXJF-AAEUAGOBSA-N 462.934 5.497 5 20 JKBD COc1ccc(C[C@@H](NC(=O)Cn2c3ccccc3c(=O)c3ccccc32)c2ccccc2)cc1OC 589400493 QXUKMGBDZNUJHJ-RUZDIDTESA-N 492.575 5.272 5 20 JKBD CN1CCC(N(C)C(=O)c2c3c(nc4ccccc24)/C(=C\c2cccc([N+](=O)[O-])c2)CCC3)CC1 590780394 HKOYAFYKWPIPHL-JZJYNLBNSA-N 470.573 5.186 5 20 JKBD C[C@@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)N(Cc1cccs1)c1ccc2c(c1)OCCO2 598401745 AOICLENBGLNUPH-CQSZACIVSA-N 474.922 5.082 5 20 JKBD O=C(Cc1ccccc1[N+](=O)[O-])Nc1nnc(SCc2c(Cl)cccc2Cl)s1 603440674 FLCAHSAHSYYIEO-UHFFFAOYSA-N 455.348 5.227 5 20 JKBD Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)c1cnn(-c2cccc(C(F)(F)F)c2)c1C(F)(F)F 603441043 ROPQELHTPSTJOE-UHFFFAOYSA-N 472.345 5.687 5 20 JKBD CCOC(=O)c1c(NC(=O)c2cc3cc([N+](=O)[O-])ccc3o2)sc(C(=O)Nc2ccccc2)c1C 603728730 WXARZNPHPIRTJT-UHFFFAOYSA-N 493.497 5.392 5 20 JKBD Cc1cc(NC(=O)c2ccc(F)cc2Cl)sc1C(=O)N1CCc2ccc([N+](=O)[O-])cc21 603954144 GTJKCAHIZMRNDB-UHFFFAOYSA-N 459.886 5.212 5 20 JKBD CC1CCN(c2ccc(C(=O)Nc3cccc(OCC(=O)Nc4ccccc4)c3)cc2[N+](=O)[O-])CC1 603977910 VKOIZFRBPZSXGX-UHFFFAOYSA-N 488.544 5.101 5 20 JKBD O=C(c1cc([N+](=O)[O-])ccc1Oc1ccccc1)N1C[C@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1 604257303 FKFJWZFEJSSAKL-CHWSQXEVSA-N 462.346 5.590 5 20 JKBD COCCOc1cc([N+](=O)[O-])c(C(=O)Nc2ccc(Sc3ccccc3Cl)cc2)cc1OC 604453370 BOJDKSJRRLURMM-UHFFFAOYSA-N 488.949 5.686 5 20 JKBD C[C@H](NCc1ccc(-c2ccc([N+](=O)[O-])cc2Br)o1)c1ccc(NC(=O)NC2CC2)cc1 608836020 HHKXQFOTJLJMMX-AWEZNQCLSA-N 499.365 5.752 5 20 JKBD O=C(c1c2c(nc3ccccc13)/C(=C\c1ccc([N+](=O)[O-])cc1)CCC2)N1CC[C@@H](N2CCCC2)C1 608906285 WFXCOPNZJGPXEW-WGJMRCBWSA-N 482.584 5.330 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)OCc2csc(N(C(C)=O)c3ccc(C)cc3)n2)cc1SC 728650324 XBYJZGAJMLETBW-UHFFFAOYSA-N 487.559 5.132 5 20 JKBD CC(C)(C)OC(=O)N1CCCc2cc(NC(=O)c3cc([N+](=O)[O-])ccc3Br)ccc21 729659360 URJPIXWJJMQTTQ-UHFFFAOYSA-N 476.327 5.297 5 20 JKBD CC(=O)N(c1nc(COC(=O)c2c[nH]c3ccc([N+](=O)[O-])cc23)cs1)c1c(C)cc(C)cc1C 749314959 LZGOSDKDJUYVRN-UHFFFAOYSA-N 478.530 5.499 5 20 JKBD Cc1nc(-c2ccccc2)ccc1C(=O)N(Cc1nnc(-c2cccc([N+](=O)[O-])c2)o1)C(C)C 754774751 KPCTTYDAILISDI-UHFFFAOYSA-N 457.490 5.066 5 20 JKBD O=C(Nc1ccc(Cl)c([N+](=O)[O-])c1)[C@H](Sc1n[nH]c(-c2ccccc2O)n1)c1ccccc1 914868286 YMKSSFDEBJVVOM-LJQANCHMSA-N 481.921 5.211 5 20 JKBD CC(=O)N(c1ccccc1)c1nc(COC(=O)c2cc([N+](=O)[O-])ccc2Oc2ccccc2)cs1 919193131 RAWYZCRLYWUOLF-UHFFFAOYSA-N 489.509 5.885 5 20 JKBD C[C@H](OC(=O)c1ccc(Cl)c2cccnc12)C(=O)Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1 919261078 DFUUUQGQBDVAOR-LBPRGKRZSA-N 482.905 5.104 5 20 JKBD COc1cc(C(=O)OCc2ccccc2C(F)(F)F)c([N+](=O)[O-])cc1OCc1cscn1 920116470 FJGMPZJSRBEGTD-UHFFFAOYSA-N 468.409 5.015 5 20 JKBD CC(C)(C)OC(=O)Nc1ccc(C(F)(F)F)cc1NC(=O)CCOc1ccccc1[N+](=O)[O-] 920291148 UXSBYUHSDYBQKQ-UHFFFAOYSA-N 469.416 5.368 5 20 JKBD C[C@@H](Nc1ccc(C(=O)OCc2cccc(C(=O)N3CCCCC3)c2)cc1[N+](=O)[O-])c1ccccn1 920544248 KGDLXUUGGQEMDA-LJQANCHMSA-N 488.544 5.146 5 20 JKBD O=C(Cn1ccc2ccc([N+](=O)[O-])cc21)NC1(c2ccc(NC(=O)c3ccc(Cl)o3)cc2)CCC1 1788877116 PHPPLXNNJKVBFI-UHFFFAOYSA-N 492.919 5.244 5 20 JKBD CCOc1cccc(C(=O)NC2(c3ccc(NC(=O)Cc4ccc([N+](=O)[O-])cc4F)cc3)CCC2)c1 1791183383 COOQGTYJXLVUGC-UHFFFAOYSA-N 491.519 5.123 5 20 JKBD C[C@@H](C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cc(F)cc([N+](=O)[O-])c2)[nH]n1)c1ccc(Cl)cc1 1814662093 YXISGRZJOKMPBV-SPLOXXLWSA-N 499.930 5.220 5 20 JKBD O=C(/C=C/C1CCCCC1)Nc1cc([C@H]2CCCCN2C(=O)/C=C/c2ccccc2[N+](=O)[O-])[nH]n1 1820909595 ALZBTOANKUTSJQ-NJKWBRDDSA-N 477.565 5.160 5 20 JKBD O=C(Nc1cc([C@H]2CCCCN2C(=O)Cc2ccccc2)[nH]n1)c1cc2cc([N+](=O)[O-])ccc2s1 1821610163 UDRINUJQZLRHJO-HXUWFJFHSA-N 489.557 5.081 5 20 JKBD Cc1c(C(=O)N2CCCC[C@H]2C2CCN(C(=O)[C@H]3CC=CCC3)CC2)cc(Cl)cc1[N+](=O)[O-] 1830735233 IBYYYQFNPUADGS-UGKGYDQZSA-N 474.001 5.146 5 20 JKBD Cc1c(C(=O)N2CCCC[C@H]2C2CCN(C(=O)C3CC(C)(C)C3)CC2)cc(Cl)cc1[N+](=O)[O-] 1830738854 VSKQWLYMOFWHEM-NRFANRHFSA-N 476.017 5.226 5 20 JKBD O=C(/C=C/c1ccccc1[N+](=O)[O-])N1CCC([C@@H]2CCCCN2C(=O)[C@H]2C[C@@H]2c2ccccc2)CC1 1831790027 FZVFBHMLMYEUIM-NBVRWERZSA-N 487.600 5.031 5 20 JKBD Cc1cc(CCCC(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)[C@@H]2CCC[C@@H]3CCCC[C@H]32)c([N+](=O)[O-])cc1F 1847713847 DEVAVTINQKERPB-NUQPDKNGSA-N 499.627 5.173 5 20 JKBD Cc1ccc(NC(=O)[C@@H](Sc2nnc(-c3ccco3)n2CC(C)C)c2ccccc2)c([N+](=O)[O-])c1 9566549 NHOVQZZDHDECJY-QFIPXVFZSA-N 491.573 5.883 5 20 JKBD CC(C)n1ncc2c(C(=O)O[C@H](C)c3nnc(-c4ccc([N+](=O)[O-])cc4)o3)cc(-c3ccco3)nc21 11046291 VWFQRBCZVRSFIZ-CQSZACIVSA-N 488.460 5.148 5 20 JKBD Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)N1CCC(C(=O)Nc2c(C(C)C)cccc2C(C)C)CC1 14473357 WBQCGOQRZSSVSP-UHFFFAOYSA-N 487.622 5.189 5 20 JKBD O=C(Cn1c2ccccc2c(=O)c2ccccc21)N(CCc1ccccc1)c1nc2ccccc2s1 14729674 SFCNARYDEHEWGF-UHFFFAOYSA-N 489.600 6.040 5 20 JKBD C[C@H](Sc1nc2cc3ccccc3cc2c(=O)n1C)C(=O)Nc1c(Cl)cc(Cl)cc1Cl 22253582 LAPDSXZLVHHSCP-NSHDSACASA-N 492.815 6.166 5 20 JKBD O=C(Nc1ccccc1)C1CCN(C(=O)c2cc([N+](=O)[O-])ccc2Sc2ccccc2)CC1 26799601 YINGKJKKJVCIGA-UHFFFAOYSA-N 461.543 5.237 5 20 JKBD COc1ccc(NC(=O)c2ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])c(OC)c2)cc1NC(C)=O 27996316 VQKHQVJFYBPXGP-UHFFFAOYSA-N 485.880 5.268 5 20 JKBD CCS(=O)(=O)c1ccc(NC(=O)c2ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])cc2)cc1 32618863 NTRWTOOGCXJEBK-UHFFFAOYSA-N 460.895 5.086 5 20 JKBD O=C(Cn1c2ccccc2c(=O)c2ccccc21)NC1C[C@@H](C(F)(F)F)C[C@H](C(F)(F)F)C1 33196873 OFMXQDVGWIZMJO-KBPBESRZSA-N 470.413 5.180 5 20 JKBD CCc1ccc(N(C(=O)Cn2c(=O)oc3cc([N+](=O)[O-])ccc32)c2nc3ccccc3s2)cc1 69834938 USRQKJBJCRKARR-UHFFFAOYSA-N 474.498 5.040 5 20 JKBD CC(=O)Nc1cccc(NC(=O)c2cc([N+](=O)[O-])ccc2Sc2ccc(Cl)cc2)c1C 484086573 FUEHIVMGEDXJFL-UHFFFAOYSA-N 455.923 5.919 5 20 JKBD O=C(c1csc(-c2ccc([N+](=O)[O-])cc2)n1)N1CCN(C(c2ccccc2)c2ccccc2)CC1 497183750 VARULEJYSWKJFU-UHFFFAOYSA-N 484.581 5.266 5 20 JKBD Cc1ccc(-c2csc(NC(=O)c3nnn(-c4ccccc4F)c3C(F)(F)F)n2)cc1[N+](=O)[O-] 508799371 FCCBBKAMXCPJAA-UHFFFAOYSA-N 492.414 5.018 5 20 JKBD COc1ccc(-c2csc(NC(=O)c3cc(OC)c(OCc4cscn4)cc3[N+](=O)[O-])n2)cc1 511638760 BJOWROMESZUVKV-UHFFFAOYSA-N 498.542 5.023 5 20 JKBD O=C(c1ccc(Sc2nc3ccccc3s2)c([N+](=O)[O-])c1)N1CCC[C@H](OCC(F)(F)F)C1 518302004 YCKMNVPTQZDVQK-AWEZNQCLSA-N 497.520 5.539 5 20 JKBD CC(=O)N(c1ccc(Cl)cc1)c1nc(COc2ccc(-c3ccccc3)cc2[N+](=O)[O-])cs1 518658517 AWTVOUKNTRSOEN-UHFFFAOYSA-N 479.945 6.635 5 20 JKBD Cc1ccc(-c2c(C(=O)Nc3ccc([N+](=O)[O-])cc3)c(C)nc3sc4c(c23)CCOC4)cc1 544408556 ZNOHDXVISXAYEL-UHFFFAOYSA-N 459.527 5.813 5 20 JKBD COc1ccc(NC(=O)C/C(=C\c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)c(OC)c1 598805198 FYHHBYVBNOQQNQ-GHRIWEEISA-N 475.526 5.791 5 20 JKBD CC1CCN(c2ccc(C(=O)Nc3cc(-c4nnc5n4CCCCC5)ccc3F)cc2[N+](=O)[O-])CC1 599820890 QCGDMRYUJVJZDU-UHFFFAOYSA-N 492.555 5.207 5 20 JKBD COc1ccc(NC(=O)c2ccc(N3CCC(C)CC3)c([N+](=O)[O-])c2)cc1OCC(F)(F)F 603573603 XRPNFQRFUBTNDA-UHFFFAOYSA-N 467.444 5.033 5 20 JKBD O=C(Nc1cccc(-c2nccs2)c1)N1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 604091390 FDIYMEZLBMRJRT-UHFFFAOYSA-N 477.468 5.091 5 20 JKBD CN(CCCc1cc(-c2ccc(F)cc2)no1)C(=O)c1csc(-c2ccc([N+](=O)[O-])cc2)n1 604570278 MQKOWMFBPHKQRH-UHFFFAOYSA-N 466.494 5.217 5 20 JKBD COc1ccc([C@H](CNc2cc3c(cc2[N+](=O)[O-])CCC(=O)N3)c2c[nH]c3ccccc23)cc1 725784365 HJNSVOBZIZDNAW-FQEVSTJZSA-N 456.502 5.213 5 20 JKBD O=C(O[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1)c1sccc1OC(F)F 729775188 QNQBGKZIMSSDMD-INIZCTEOSA-N 482.848 5.448 5 20 JKBD O=C(Cc1csc(-c2ccc(Cl)cc2Cl)n1)OCc1nc(-c2cccc([N+](=O)[O-])c2)no1 747258164 IEPFQXOUWBQXKX-UHFFFAOYSA-N 491.312 5.361 5 20 JKBD Cc1cc(C(=O)COC(=O)c2csc(-c3cccc([N+](=O)[O-])c3)n2)c(C)n1Cc1ccccc1 747963171 ZZEWZAIFXJXMKZ-UHFFFAOYSA-N 475.526 5.225 5 20 JKBD O=C(OCC1CCN(c2ncccc2[N+](=O)[O-])CC1)[C@@H]1CC=CC[C@@H]1c1nc2ccccc2s1 749358647 MWNBXAXNSNJYHC-RBUKOAKNSA-N 478.574 5.109 5 20 JKBD O=C(Nc1ccccc1C(=O)OCc1cc(F)cc2cccnc12)c1ccc([N+](=O)[O-])cc1Cl 914894764 VGSZYFAMHWLHKM-UHFFFAOYSA-N 479.851 5.545 5 20 JKBD O=C(Nc1ccc2oc3ccccc3c2c1)c1cc([N+](=O)[O-])ccc1I 915275674 YTHJNWCTSAWUFF-UHFFFAOYSA-N 458.211 5.351 5 20 JKBD O=C(Nc1cc([N+](=O)[O-])ccc1OC(F)F)c1cc([N+](=O)[O-])ccc1Sc1ccccc1 915283316 KQEFYFJNEZFZTH-UHFFFAOYSA-N 461.402 5.508 5 20 JKBD Cc1ccc(Cl)cc1NC(=O)[C@@H](C)OC(=O)c1ccc(N[C@@H](C)c2ccccn2)c([N+](=O)[O-])c1 920548169 QFMLDDQLDSUFCP-JKSUJKDBSA-N 482.924 5.309 5 20 JKBD COc1cccc2[nH]cc(C(=O)Nc3ccc(C4(NC(=O)Cc5cccc([N+](=O)[O-])c5)CCC4)cc3)c12 1790917896 FRPIRNRWLUZNQG-UHFFFAOYSA-N 498.539 5.075 5 20 JKBD O=C(Cc1cc(F)ccc1[N+](=O)[O-])Nc1ccc(C2(NC(=O)c3cc4ccccc4o3)CCC2)cc1 1792308903 ZPXIVFUQRLUZHV-UHFFFAOYSA-N 487.487 5.471 5 20 JKBD Cc1c(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)C[C@@H](C)c2ccccc2)C3)cc(Cl)cc1[N+](=O)[O-] 1800712929 MXCHVQYRMLHLTB-HUJKARHJSA-N 469.969 5.002 5 20 JKBD COc1cccc(Cl)c1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc2cc([N+](=O)[O-])ccc2s1 1801208975 ZSDHBWJYTHFOHI-MUJYYYPQSA-N 499.976 5.037 5 20 JKBD Cc1ccsc1C(=O)N1CCCC2(CCN(C(=O)c3cc4cc([N+](=O)[O-])ccc4s3)CC2)C1 1808082793 HFWJJQLTLFMRQO-UHFFFAOYSA-N 483.615 5.338 5 20 JKBD CC1(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)C3(c4cccc([N+](=O)[O-])c4)CCC3)[nH]n2)CCCC1 1814532071 QBFQRQNXXTUXLP-NRFANRHFSA-N 479.581 5.012 5 20 JKBD Cc1cc(Cl)cc(C(=O)N2CCCC[C@H]2c2cc(NC(=O)c3ccc([N+](=O)[O-])cc3F)n[nH]2)c1 1821051183 VGVLVPUGUYQXEP-FQEVSTJZSA-N 485.903 5.039 5 20 JKBD Cc1c(C(=O)N2CCCC[C@H]2C2CCN(C(=O)/C=C/c3ccccc3[N+](=O)[O-])CC2)ccc(F)c1F 1832620531 IGMQHGQCVQOPGH-SRLUVNLFSA-N 497.542 5.128 5 20 JKBD O=C(c1cc2cc([N+](=O)[O-])ccc2s1)N1CC2(CCCN2C(=O)c2ncccc2-c2ccccc2)C1 1843545305 HQRDOXCLXSBPSJ-UHFFFAOYSA-N 498.564 5.002 5 20 JKBD CCn1c(S[C@H](C)C(=O)Nc2nc(-c3cccc([N+](=O)[O-])c3)cs2)nnc1-c1ccccc1 9484730 DMBFQJQZCYHISL-CQSZACIVSA-N 480.575 5.116 5 20 JKBD COc1ccc(C)cc1NC(=O)[C@H](OC(=O)c1cc([N+](=O)[O-])ccc1Cl)c1ccccc1 10665310 OWFWUJNBPFDPFM-OAQYLSRUSA-N 454.866 5.102 5 20 JKBD CC(C)c1cccc(NC(=O)COC(=O)c2ccccc2NC(=O)c2ccc([N+](=O)[O-])cc2Cl)c1 11710359 RKYZXKIHDBCRCA-UHFFFAOYSA-N 495.919 5.419 5 20 JKBD CC(C)c1ccc(/C=C(\Cl)c2nnc(C(=O)NCc3ccc(F)cc3)s2)cc1[N+](=O)[O-] 28185975 YYSZQGKZSKRFNB-MFOYZWKCSA-N 460.918 5.376 5 20 JKBD COCCOc1cc([N+](=O)[O-])c(C(=O)Nc2ccccc2Oc2ccccc2Cl)cc1OC 105336957 VKMDPDJOYYHCFM-UHFFFAOYSA-N 472.881 5.327 5 20 JKBD Cc1ccc(-c2csc(NC(=O)c3cnn(-c4ccccc4)c3C(F)(F)F)n2)cc1[N+](=O)[O-] 217164869 CPNHULKCVWVKRY-UHFFFAOYSA-N 473.436 5.484 5 20 JKBD O=C(NCCCSc1ccc(F)cc1)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 247318058 KWQPQBSIXDEWBY-UHFFFAOYSA-N 485.503 5.268 5 20 JKBD C[C@@H]1Cc2cc([N+](=O)[O-])ccc2N1C(=O)c1ccc(NC(=O)c2ccc(Br)cc2)cc1 504300093 TXFGVADESQZGSD-CQSZACIVSA-N 480.318 5.201 5 20 JKBD COc1cc(C(=O)N[C@@H]2CCOc3c(-c4ccccc4)cccc32)c([N+](=O)[O-])cc1OC(F)F 505104058 KDVZSQCISCSMPR-GOSISDBHSA-N 470.428 5.125 5 20 JKBD C[C@H](Nc1cccc(NC(=O)c2cccc(C(F)(F)F)c2)c1)C(=O)Nc1ccc([N+](=O)[O-])cc1 507549206 JPNJTGZDJUIQAJ-AWEZNQCLSA-N 472.423 5.305 5 20 JKBD CC(C)(C)[C@H]1CCc2sc(-c3nnc(SCc4ccc(C(N)=O)cc4[N+](=O)[O-])o3)cc2C1 514315008 UAQGCDIUNNJVMR-HNNXBMFYSA-N 472.592 5.249 5 20 JKBD CC(=O)CCc1ccc2oc(C(=O)Nc3nc(-c4ccc(C)c([N+](=O)[O-])c4)cs3)c(C)c2c1 515164649 KHNBDYAJAVULDR-UHFFFAOYSA-N 463.515 5.855 5 20 JKBD O=C(CCc1nnc(-c2cc3ccccc3o2)o1)Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1 522390054 XRQDGKKQNFNAIE-UHFFFAOYSA-N 461.459 5.086 5 20 JKBD Cc1csc([C@@H](C)NC(=O)C/C(=C/c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)n1 524323142 OUXUWBDCCDLOCB-QJISPJEISA-N 464.572 5.778 5 20 JKBD CCOC(=O)c1csc(NC(=O)C/C(=C/c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)n1 550262045 NJAUYDZUGMMOOU-PTNGSMBKSA-N 494.554 5.407 5 20 JKBD COc1ccc(-c2nn(Cc3ccccc3)cc2C(=O)N[C@H](C)c2cccc([N+](=O)[O-])c2)cc1OC 603966503 BMMNIASMGQPDJA-GOSISDBHSA-N 486.528 5.015 5 20 JKBD CCN(C[C@@H]1CCOC1)C(=O)c1c2c(nc3ccccc13)/C(=C\c1ccc([N+](=O)[O-])cc1)CCC2 604431457 ODQLDQAQTBOCRR-CVVHJZTLSA-N 471.557 5.519 5 20 JKBD O=C(c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1)N1CCO[C@H](c2ccc(F)c(F)c2)C1 608964640 KIIJMZCMPGAOEW-QFIPXVFZSA-N 474.847 5.532 5 20 JKBD COc1ccc(NC(=O)[C@H](C)Sc2ccc([N+](=O)[O-])cc2)cc1OCc1ccc2ccccc2n1 609066621 RPAMJOYUZVEASD-KRWDZBQOSA-N 489.553 5.850 5 20 JKBD O=C(CC1CCCC1)N1CCCN(C(=O)c2cc([N+](=O)[O-])ccc2Sc2ccccc2)CC1 609346520 FPLXUWVIGGYVEY-UHFFFAOYSA-N 467.591 5.001 5 20 JKBD C[C@H](OC(=O)c1ccn(-c2ccc([N+](=O)[O-])cc2)n1)C(=O)N1c2ccccc2Sc2ccccc21 743123170 WXKRAUROKKJLFJ-INIZCTEOSA-N 486.509 5.155 5 20 JKBD CCOc1ccc(-c2nc(COC(=O)c3csc(-c4cccc([N+](=O)[O-])c4)n3)cs2)cc1OC 747960842 CQYQNLYJENVDMT-UHFFFAOYSA-N 497.554 5.606 5 20 JKBD COc1cc(-c2nc(CC(=O)Nc3ccccc3)no2)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 904383060 QAXGUQQSKUOZMW-UHFFFAOYSA-N 480.864 5.280 5 20 JKBD CC(C)(C)OC(=O)C1(c2noc(C3CCN(c4ccc(C(F)(F)F)cc4[N+](=O)[O-])CC3)n2)CCC1 904820046 JFYZAWJKHLXFSY-UHFFFAOYSA-N 496.486 5.144 5 20 JKBD CC(C)(C)OC(=O)NC1CCN(C(=O)c2cc([N+](=O)[O-])ccc2Sc2ccc(Cl)cc2)CC1 917209911 DMASEWVCVFHKEO-UHFFFAOYSA-N 491.997 5.529 5 20 JKBD C[C@@H](Nc1ccc(C(=O)OCc2c(F)c(F)c(F)c(F)c2F)cc1[N+](=O)[O-])c1ccccn1 920546535 KLSCDDSYFOTVRZ-SNVBAGLBSA-N 467.350 5.215 5 20 JKBD Cc1cc(C(=O)N2CCCC[C@@H]2C)ccc1NC(=O)c1cc([N+](=O)[O-])ccc1N1CCCCC1 921153328 INWGZODRQBDQLD-IBGZPJMESA-N 464.566 5.160 5 20 JKBD COc1ccc(CC(=O)NC2(c3ccc(NC(=O)CCC4CCCC4)cc3)CCC2)c([N+](=O)[O-])c1 1787619690 ZPSCPSYVVBBWCL-UHFFFAOYSA-N 479.577 5.250 5 20 JKBD Cc1c(C(=O)Nc2ccc(C3(NC(=O)/C=C/c4ccc([N+](=O)[O-])o4)CCC3)cc2)oc2ccccc12 1788966086 KYNGSXMEOPNTML-ACCUITESSA-N 485.496 5.704 5 20 JKBD Cc1c(C(=O)N2CC[C@@H](CNC(=O)C3(C)CCCCC3)[C@@H]2c2cccnc2)cc(Cl)cc1[N+](=O)[O-] 1813006577 YCGSAFFGUYGVME-CVDCTZTESA-N 499.011 5.242 5 20 JKBD C/C(=C\c1cccs1)C(=O)N1CCCC[C@H]1C1CCN(C(=O)Cc2ccc(C)c([N+](=O)[O-])c2)CC1 1823718782 PPYFOXPIUGETNR-YEZCMDQSSA-N 495.645 5.230 5 20 JKBD O=C(c1cc2cc([N+](=O)[O-])ccc2s1)N1CCC([C@@H]2CCCCN2C(=O)/C=C/c2ccoc2)CC1 1825056476 YHPKPVWCGBDDGQ-SNXGKTBFSA-N 493.585 5.349 5 20 JKBD Cc1cc(C(=O)N2CCCC[C@H]2C2CCN(C(=O)CC3CCC(C)(C)CC3)CC2)ncc1[N+](=O)[O-] 1827829775 ZTCHYQJSXHUBIK-QHCPKHFHSA-N 484.641 5.138 5 20 JKBD O=C(c1cc2ccccc2o1)N1CCC([C@@H]2CCCCN2C(=O)c2cc(F)cc([N+](=O)[O-])c2)CC1 1830617892 UYEIRIPKPDEGHB-QFIPXVFZSA-N 479.508 5.027 5 20 JKBD Cc1ccc(/C=C/C(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3cccc(F)c3[N+](=O)[O-])CC2)s1 1832174012 PJSWZAQSONFEQI-NELJVSICSA-N 485.581 5.051 5 20 JKBD C[C@@H](Sc1nnc(-c2ccccc2)n1-c1ccc(F)cc1F)C(=O)Nc1ccccc1[N+](=O)[O-] 10317134 WXNMIQHJSNHSDI-CQSZACIVSA-N 481.484 5.240 5 20 JKBD CCCOc1c(Cl)cc(C(=O)O[C@@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)cc1OC 17740535 PJYHUMJVWYZCCM-LBPRGKRZSA-N 461.858 5.014 5 20 JKBD COC(=O)c1cc(CN(C)C(=O)c2ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])cc2)oc1C 27167665 YXJAJEGUKWHLRW-UHFFFAOYSA-N 458.854 5.001 5 20 JKBD C[C@@H]1CCC[C@@H](OCc2cccc(NC(=O)CCCn3c(=O)oc4cc([N+](=O)[O-])ccc43)c2)C1 303027513 WGHSLVHPNBYFPH-DYESRHJHSA-N 467.522 5.017 5 20 JKBD CCCC(=O)Nc1cccc(NC(=O)N2CCN(c3ccc(C(F)(F)F)cc3[N+](=O)[O-])CC2)c1C 409815648 KAAZKGGXUHCJAH-UHFFFAOYSA-N 493.486 5.015 5 20 JKBD O=C(Cc1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1)Nc1cccc(-c2nccs2)c1 489688941 XQFWJNOSEIYGQU-UHFFFAOYSA-N 481.537 5.752 5 20 JKBD O=C(Cn1cc([N+](=O)[O-])ccc1=O)N(c1ccc(Cl)c(Cl)c1)c1nc2ccccc2s1 499337913 GXNVDRAOYKZHAH-UHFFFAOYSA-N 475.313 5.038 5 20 JKBD COc1ccc([C@@H]2CCN(C(=O)C/C(=C/c3ccc([N+](=O)[O-])cc3)c3nc4ccccc4s3)C2)cc1 504947402 DHSWWJMSANVSTJ-NCJDQSJGSA-N 499.592 6.160 5 20 JKBD COc1cc(CN[C@H]2CCSc3ccc(F)cc32)ccc1OCc1ccc([N+](=O)[O-])cc1 507952785 UOJIAFUAUKPWJO-NRFANRHFSA-N 454.523 5.648 5 20 JKBD CCCNC(=O)c1ccc(NC(=O)c2ccc(N3C[C@H](C)C[C@@H](C)C3)c([N+](=O)[O-])c2)cc1Cl 509373504 OPAOXYASSBMGJP-HZPDHXFCSA-N 472.973 5.123 5 20 JKBD CCOc1cc([N+](=O)[O-])c(C(=O)Nc2ccc3nc(-c4ccccc4Cl)[nH]c3c2)cc1OC 516368417 BQPVZCAFZXDHGJ-UHFFFAOYSA-N 466.881 5.451 5 20 JKBD CCCC(=O)Nc1cccc(NC(=O)c2ccc(Sc3ccc(C)cc3)c([N+](=O)[O-])c2)c1C 516781625 YRPNWJVHHQDWAX-UHFFFAOYSA-N 463.559 6.354 5 20 JKBD O=[N+]([O-])c1ccc(-c2ccc(CNCc3csc(Br)c3)o2)c(Br)c1 518777773 UWUCSQBATCGNOW-UHFFFAOYSA-N 472.158 5.731 5 20 JKBD O=C(Nc1ccc2nc([C@@H]3CCCO3)[nH]c2c1)c1cc([N+](=O)[O-])ccc1Sc1ccc(Cl)cc1 520261809 NPNCHELRASATLC-NRFANRHFSA-N 494.960 6.380 5 20 JKBD COc1cc2c(cc1OC)[C@@H](c1ccccc1)N(C(=O)[C@H](C)Oc1ccc(Cl)cc1[N+](=O)[O-])CC2 520436406 UZFSTNWWSKNNDS-IVCQMTBJSA-N 496.947 5.207 5 20 JKBD O=C(NCc1cccc(NC(=O)C2CCCCC2)c1)Nc1cc([N+](=O)[O-])ccc1OC(F)F 521371498 QMHIFDZXDVANJZ-UHFFFAOYSA-N 462.453 5.037 5 20 JKBD Cc1cc(C)n([C@@H](C)C(=O)Nc2ccc(NC(=O)c3ccc(NC4CC4)c([N+](=O)[O-])c3)cc2Cl)n1 521537140 MXMZXRUDQQMFTM-HNNXBMFYSA-N 496.955 5.088 5 20 JKBD O=C(C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)Nc1ncn(Cc2ccccc2)n1 521803293 XPXMGMVCNSNLKX-XSFVSMFZSA-N 496.552 5.414 5 20 JKBD O=C(Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1)[C@@H]1C[C@@H]2CCCC[C@@H]2N1C(=O)c1ccccc1 524290497 RCIXJFYVQKDOMF-NYVOZVTQSA-N 476.558 5.130 5 20 JKBD COc1cc(C(=O)Nc2nc(-c3cc4ccccc4o3)cs2)c([N+](=O)[O-])cc1OC(F)F 585692040 PNMZGWAYVQEJOP-UHFFFAOYSA-N 461.402 5.327 5 20 JKBD O=C(CN1CCCCCC1)Nc1ccc(NCc2ccc(C(F)(F)F)cc2[N+](=O)[O-])cc1 600853166 XUVYOXNXDYOOCW-UHFFFAOYSA-N 450.461 5.040 5 20 JKBD O=C(C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)N1CCN(C2CCCC2)CC1 603554150 PPEKFGDYXBWMAI-JZJYNLBNSA-N 476.602 5.222 5 20 JKBD Cc1ccccc1C(=O)NC1CCN(C(=O)c2cc([N+](=O)[O-])ccc2Sc2ccccc2)CC1 603639468 LBMAEPMOXWKNEV-UHFFFAOYSA-N 475.570 5.089 5 20 JKBD Cc1ccc(NS(=O)(=O)c2ccc(NCc3cc(-c4ccccc4)no3)c([N+](=O)[O-])c2)c(C)c1 603854792 VMHCXKMJQSKSQY-UHFFFAOYSA-N 478.530 5.280 5 20 JKBD O=C(c1ccccc1)N1CCC(NCc2ccc(-c3ccc([N+](=O)[O-])cc3Br)o2)CC1 608836411 FOJIGBFECVWHKG-UHFFFAOYSA-N 484.350 5.012 5 20 JKBD COc1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2NCc2ccccc2)c(Br)c1 608901478 ZPMPHJAZCIRYRG-UHFFFAOYSA-N 456.296 5.230 5 20 JKBD COc1cc(C(=O)Nc2ccc(Sc3nncs3)c(Cl)c2)c([N+](=O)[O-])cc1OC(F)F 609107669 PZDYDGNPGDRTPF-UHFFFAOYSA-N 488.881 5.113 5 20 JKBD O=C(Cn1c2ccccc2c(=O)c2ccccc21)NCCc1ccc(OCc2ccccc2)cc1 611984882 FVQVZHVBWVTLKZ-UHFFFAOYSA-N 462.549 5.093 5 20 JKBD C[C@H](c1nnc(SCc2nc3ccccc3c3ccccc23)n1-c1ccc(F)cc1)N(C)C 620677418 ZXEXTQWUVULBSI-QGZVFWFLSA-N 457.578 6.023 5 20 JKBD C[C@H](OC(=O)[C@H](OC1CCCC1)c1ccccc1)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 727017378 PETPAUQWAIIUFO-VBKZILBWSA-N 480.439 5.184 5 20 JKBD C[C@H](OC(=O)Cc1cc(Cl)ccc1Cl)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 748388966 CKUADJBNMDDCTE-VIFPVBQESA-N 465.211 5.033 5 20 JKBD O=[N+]([O-])c1cc(C(F)(F)F)ccc1N1CCC(c2nc(-c3ccc(F)c(F)c3)no2)CC1 904365753 PGHFEEJXWYSDBK-UHFFFAOYSA-N 454.355 5.326 5 20 JKBD COc1ccc(NC(=O)c2nnc(/C(Cl)=C\c3ccc(-c4ccccc4[N+](=O)[O-])o3)s2)cc1 912965064 DBMPFNRDXJFAKZ-SFQUDFHCSA-N 482.905 5.704 5 20 JKBD COc1ccc2[nH]cc(CC(=O)Oc3ccc(NC(=O)c4cc([N+](=O)[O-])ccc4Cl)cc3)c2c1 915279153 OYAPNNFCAWPARP-UHFFFAOYSA-N 479.876 5.139 5 20 JKBD CC(C)OC(=O)C[C@H](NC(=O)Nc1ccccc1SC(F)F)c1ccccc1[N+](=O)[O-] 915317691 DBPNMHJNAVGTKW-HNNXBMFYSA-N 453.467 5.114 5 20 JKBD CC[C@H](C)c1ccc([C@H](NC(=O)C(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)c2cccs2)cc1 915743848 WQKKLACLMQODES-QKKBWIMNSA-N 471.966 5.668 5 20 JKBD Cc1ccc(NC(=O)c2ccccc2)cc1NC(=O)c1cc([N+](=O)[O-])ccc1N1CCCCC1 916084001 KFGZPEZPJOECMS-UHFFFAOYSA-N 458.518 5.398 5 20 JKBD COc1cccc(SCC(=O)O[C@@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2ccccc2)c1 917290899 AZXXAECRCKUOHZ-JOCHJYFZSA-N 486.933 5.272 5 20 JKBD CNC(=O)c1ccc(Cl)cc1NC(=O)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])c(OC)c1 917398745 DATOAZHVAHXSAZ-UHFFFAOYSA-N 490.299 5.314 5 20 JKBD CCOc1ccsc1C(=O)Nc1ccc(C2(NC(=O)Cc3cc(F)ccc3[N+](=O)[O-])CCC2)cc1 1785773803 YWCBDJCCIOTMGZ-UHFFFAOYSA-N 497.548 5.185 5 20 JKBD Cc1cc(C(=O)Nc2ccc(C3(NC(=O)C4(c5cccc([N+](=O)[O-])c5)CCC4)CCC3)cc2)ccn1 1789751281 WHYSKQIATUUULP-UHFFFAOYSA-N 484.556 5.168 5 20 JKBD O=C(CC1CCC1)NC1(c2ccc(NC(=O)c3cccc([N+](=O)[O-])c3Br)cc2)CCC1 1790637963 HOXNRVGNJHZWGV-UHFFFAOYSA-N 486.366 5.295 5 20 JKBD Cc1c(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cc(Cl)c(F)cc2F)C3)cc(Cl)cc1[N+](=O)[O-] 1800711264 FXVXHZNSROIYJY-BTTYYORXSA-N 498.313 5.054 5 20 JKBD O=C(C1CCCCC1)N1CCCC[C@@H]1c1cc(NC(=O)C2(c3cccc([N+](=O)[O-])c3)CCC2)n[nH]1 1820840503 GQWILMQZDKPZEQ-JOCHJYFZSA-N 479.581 5.012 5 20 JKBD Cc1ccc(C(=O)N2CCCC[C@H]2c2cc(NC(=O)c3cccc(F)c3[N+](=O)[O-])n[nH]2)c(Cl)c1 1821175248 YWPCYRGSOYBJDL-IBGZPJMESA-N 485.903 5.039 5 20 JKBD Cc1cc2cc(C(=O)N3CCC([C@@H]4CCCCN4C(=O)c4ccc([N+](=O)[O-])cc4F)CC3)ccc2[nH]1 1830497302 DHRGNQILAUSBRV-VWLOTQADSA-N 492.551 5.071 5 20 JKBD C[C@H](Oc1ccc2c(-c3ccc([N+](=O)[O-])cc3)cc(=O)oc2c1)C(=O)Nc1ccc(F)c(F)c1 15370865 ZBNBHKLVCAVNEQ-ZDUSSCGKSA-N 466.396 5.052 5 20 JKBD COc1cc(CN(C)C(=O)c2ccc(NCc3ccccc3)c([N+](=O)[O-])c2)ccc1OC(F)F 23497781 IPFLKWQXGRSNOR-UHFFFAOYSA-N 471.460 5.089 5 20 JKBD Cn1cnnc1Sc1ccc(C(=O)N[C@@H](c2ccccc2)c2cc3ccccc3o2)cc1[N+](=O)[O-] 24877139 WFELDYBMYNBLPT-QHCPKHFHSA-N 485.525 5.140 5 20 JKBD COc1ccc(NC(=O)[C@H](OC(=O)c2cccc(C)c2[N+](=O)[O-])c2ccccc2)cc1Cl 104495725 BGNXBDRZIHJFQN-OAQYLSRUSA-N 454.866 5.102 5 20 JKBD Cc1csc(N(CC(F)(F)F)C(=O)c2ccc(N3C[C@H](C)C[C@@H](C)C3)c([N+](=O)[O-])c2)n1 195644750 UOBZXINDVRXTBA-CHWSQXEVSA-N 456.490 5.051 5 20 JKBD C[C@@H](NCc1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1)c1ccc2c(c1)OCCO2 215863340 LGDZMEPLNFXDGY-GOSISDBHSA-N 456.502 5.070 5 20 JKBD CCOc1ccc(CN(C)C(=O)c2ccccc2NC(=O)c2ccc([N+](=O)[O-])cc2Cl)cc1 253386142 VTICKWDQDIGNMY-UHFFFAOYSA-N 467.909 5.171 5 20 JKBD Cn1cnnc1Sc1ccc(NC(=O)c2ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])cc2)cc1 494696125 WWPARXQBSACQDV-UHFFFAOYSA-N 481.921 5.573 5 20 JKBD CCN(c1ccccc1)S(=O)(=O)c1ccc(N[C@H](c2ccccc2)c2nccs2)c([N+](=O)[O-])c1 505571412 ZEWHETADEZKNBB-HSZRJFAPSA-N 494.598 5.468 5 20 JKBD C[C@H](Nc1ccc(C(=O)Nc2ccccc2Cc2ccccc2)cc1[N+](=O)[O-])c1ccccn1 506085487 HVWATEBACXHGSK-IBGZPJMESA-N 452.514 6.006 5 20 JKBD COc1ccc(-c2csc(NC(=O)c3ccc(N[C@@H](C)c4ccccn4)c([N+](=O)[O-])c3)n2)cc1 506233204 DSERCTFBDXQOBN-HNNXBMFYSA-N 475.530 5.547 5 20 JKBD Cc1noc2ncc(NC(=O)C/C(=C/c3ccc([N+](=O)[O-])cc3)c3nc4ccccc4s3)cc12 506525095 PWZFJZNNULUENH-YBEGLDIGSA-N 471.498 5.619 5 20 JKBD C[C@@H](COc1ccccc1C(F)(F)F)NC(=O)c1ccc(N[C@@H](C)c2ccccn2)c([N+](=O)[O-])c1 507980565 SKJOOEQDMLPVMR-HOTGVXAUSA-N 488.466 5.379 5 20 JKBD CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccc(S(=O)(=O)c2ccc(F)cc2)cc1 509210013 JBJJGOXHICNJEP-UHFFFAOYSA-N 471.510 5.009 5 20 JKBD O=[N+]([O-])c1ccc(-c2ccc(CNC3CCN(Cc4ccccc4)CC3)o2)c(Br)c1 518248179 LFQIESIEYXNESF-UHFFFAOYSA-N 470.367 5.372 5 20 JKBD C[C@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)Nc1ccc(F)c(NC(=O)C2CCCCC2)c1 518831482 GRUWITBLKJLGOP-ZDUSSCGKSA-N 463.893 5.312 5 20 JKBD C[C@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)N1CCC[C@H](c2nc(-c3ccc(Cl)cc3)no2)C1 523281330 LDPNMPZVQUERCO-ZFWWWQNUSA-N 491.331 5.125 5 20 JKBD Cc1cc([N+](=O)[O-])ccc1NC(=O)CNc1ccc(Cl)cc1C(=O)N1[C@H](C)CCC[C@H]1C 604009983 JEJOJAIFPLCROV-HZPDHXFCSA-N 458.946 5.010 5 20 JKBD Cc1cccc(OC(F)F)c1NC(=O)C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1 608808155 SLKVNLBUYXIDKB-LGMDPLHJSA-N 495.507 6.684 5 20 JKBD C[C@@H](Nc1ccc(C(=O)NCC2(c3cccc(C(F)(F)F)c3)CC2)cc1[N+](=O)[O-])c1ccccn1 608948373 GTHPWDATPMLDJI-MRXNPFEDSA-N 484.478 5.643 5 20 JKBD O=C(CCCCOc1ccc(Br)cc1)Nc1cc([N+](=O)[O-])ccc1OC(F)F 609410181 KDHXZUZLFAAIAG-UHFFFAOYSA-N 459.243 5.147 5 20 JKBD Cc1ccc(-c2csc(NC(=O)c3ccc(Cl)c(N4CCCC4=O)c3)n2)cc1[N+](=O)[O-] 619729636 QPJGJXOIBIFFCZ-UHFFFAOYSA-N 456.911 5.059 5 20 JKBD CC(C)(C)c1cc[n+](/C(C(=S)NC23CC4CC(CC(C4)C2)C3)=C(/O)c2ccc([N+](=O)[O-])cc2)cc1 725763726 LBUPWTZLUUFSAY-UHFFFAOYSA-O 492.665 5.949 5 20 JKBD C[C@H](OC(=O)c1cc([N+](=O)[O-])ccc1Br)C(=O)N[C@H](C)c1ccc(Cl)cc1Cl 725985002 NIKPSAZGAOUIPR-ZJUUUORDSA-N 490.137 5.087 5 20 JKBD O=C(OCc1nccn1CC(F)(F)F)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1 727771495 OCPUCOYCBRJRHN-UHFFFAOYSA-N 455.776 5.156 5 20 JKBD COc1cc(C(=O)O[C@H](C)c2ccc(C(F)(F)F)cc2)c([N+](=O)[O-])cc1OCc1cscn1 728334073 MNRJFTOFASOAPU-GFCCVEGCSA-N 482.436 5.576 5 20 JKBD CC[C@@H](NC(=O)c1ccccc1NC(=O)c1ccc([N+](=O)[O-])cc1Cl)c1nc(C)cs1 729449285 POVYGKGYQOBPDK-QGZVFWFLSA-N 458.927 5.147 5 20 JKBD C[C@H](OC(=O)[C@@H]1C[C@@H]1c1ccc(Cl)cc1Cl)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 730613829 MHVLAEMWTBEFLQ-CUOATXAZSA-N 491.249 5.594 5 20 JKBD COc1ccc(-c2ccc(C(=O)O[C@H](C)c3nnc(-c4ccc([N+](=O)[O-])cc4)o3)c(F)c2)c(F)c1 730635302 KGFVZUXPXXDYGB-CYBMUJFWSA-N 481.411 5.517 5 20 JKBD COc1ccc(-c2nn(-c3ccccc3)cc2CC(=O)N(C)Cc2cc([N+](=O)[O-])ccc2Cl)cc1 824177318 WKHSAGGQDQNVNJ-UHFFFAOYSA-N 490.947 5.311 5 20 JKBD CCCCN(c1ccccc1)S(=O)(=O)c1cccc(C(=O)Nc2cc([N+](=O)[O-])c(F)cc2F)c1 897449052 NMYZIIJLNUNCKR-UHFFFAOYSA-N 489.500 5.121 5 20 JKBD CC(C)(C)n1nc(C(=O)Oc2ccc(NC(=O)c3cc([N+](=O)[O-])ccc3Cl)cc2)cc1C1CC1 916950769 CTEGAWKIAZIUCA-UHFFFAOYSA-N 482.924 5.549 5 20 JKBD C[C@H](OC(=O)c1cccc(-n2nccc2-c2ccccc2)c1)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 920706906 POFXUGHHOOJAIX-KRWDZBQOSA-N 481.468 5.416 5 20 JKBD C[C@H](OC(=O)c1ccc(-n2cnc3ccccc32)cc1)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 921175926 CJVAROKRDNQBGG-AWEZNQCLSA-N 498.417 5.137 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)c3cccc(F)c3[N+](=O)[O-])CCC2)cc1)c1cc2[nH]ccc2s1 1789104595 RZQOETDOUADIDI-UHFFFAOYSA-N 478.505 5.338 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)c3ccc([N+](=O)[O-])cc3F)CCC2)cc1)c1ccc(C(F)(F)F)[nH]1 1789674281 LRVMDBULILUVPV-UHFFFAOYSA-N 490.413 5.142 5 20 JKBD COc1cc(C(=O)Nc2ccc(C3(NC(=O)c4cccc(Cl)c4)CCC3)cc2)c([N+](=O)[O-])cc1O 1790084348 SFCCKCXIXZRTGU-UHFFFAOYSA-N 495.919 5.024 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)c3ccc(Cl)o3)CCC2)cc1)c1cc(F)cc([N+](=O)[O-])c1 1790696675 WGOJCEJBCJOGLK-UHFFFAOYSA-N 457.845 5.042 5 20 JKBD Cc1c(C(=O)Nc2ccc(C3(NC(=O)COC(C)(C)C)CCC3)cc2)cc(Cl)cc1[N+](=O)[O-] 1790774567 RUCQMXPMWUARFX-UHFFFAOYSA-N 473.957 5.119 5 20 JKBD CC(C)CCC(=O)Nc1ccc(C2(NC(=O)CSc3ccccc3[N+](=O)[O-])CCC2)cc1 1791256091 WDZMDGRDGOZTDH-UHFFFAOYSA-N 455.580 5.257 5 20 JKBD CC(C)(C)c1ccc(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)/C=C/c3ccc([N+](=O)[O-])o3)[nH]n2)s1 1818341036 DXLOSIGNKVTKKH-ZBZNSMLMSA-N 497.577 5.289 5 20 JKBD O=C(Nc1cc([C@H]2CCCCN2C(=O)CCc2cccc([N+](=O)[O-])c2)[nH]n1)c1cccc(F)c1Cl 1821117539 NARNWLFLMNVBHB-HXUWFJFHSA-N 499.930 5.049 5 20 JKBD CC(C)(C)C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)CC1 1826405487 AHYSRKNZVAJJFN-IBGZPJMESA-N 457.596 5.089 5 20 JKBD Cc1cccc(Cl)c1C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cccc(F)c2[N+](=O)[O-])CC1 1830595643 IJUZFRRGTXPFHJ-NRFANRHFSA-N 487.959 5.243 5 20 JKBD CC[C@@H](C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cc([N+](=O)[O-])c(O)cc2C)CC1)c1ccccc1 1830788275 IMBDMLNNDNCTGI-VWNXMTODSA-N 493.604 5.036 5 20 JKBD COc1cc(C(=O)N2CCCC[C@H]2C2CCN(C(=O)c3c(C)cccc3Cl)CC2)ccc1[N+](=O)[O-] 1832695689 GRYWBRUTMXUEDT-NRFANRHFSA-N 499.995 5.112 5 20 JKBD CC[C@@H]1CCc2sc(-c3nnc(SCC(=O)Nc4c(C)cccc4[N+](=O)[O-])n3C)cc2C1 10440098 OUOALXUEATWEHV-CQSZACIVSA-N 471.608 5.006 5 20 JKBD COc1cc([N+](=O)[O-])ccc1NC(=O)CSc1nc(-c2cccs2)nc2ccccc12 12424686 KIIXLIQBEKVCJR-UHFFFAOYSA-N 452.517 5.006 5 20 JKBD Cc1occc1-c1nnc(SCC(=O)Nc2cc(Cl)ccc2[N+](=O)[O-])n1Cc1ccccc1 21743667 ZHMAUYBGRVACSQ-UHFFFAOYSA-N 483.937 5.187 5 20 JKBD COCCCn1c(-c2ccccc2Cl)nn(CN(C)Cc2cc([N+](=O)[O-])ccc2Cl)c1=S 27533019 XQFWLFPPNZQSBM-UHFFFAOYSA-N 496.420 5.422 5 20 JKBD C[C@@H](Sc1nnc(-c2ccccc2)c(-c2ccccc2)n1)C(=O)Nc1ccc(F)c([N+](=O)[O-])c1 36801988 WRRCXWNMKSJTBO-OAHLLOKOSA-N 475.505 5.372 5 20 JKBD COCCOc1cc([N+](=O)[O-])c(C(=O)Nc2ccccc2-c2ccc(-c3ccccc3)cc2)cc1OC 410037731 IOUCOMQFQJOPSQ-UHFFFAOYSA-N 498.535 6.215 5 20 JKBD O=C(Nc1cccc(NC(=O)c2ccoc2)c1)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1 499526167 CPAJVBVOVFAUML-UHFFFAOYSA-N 477.860 6.138 5 20 JKBD O=C(NCc1ccccc1-c1ccc(Cn2ccnc2)cc1)Nc1cc([N+](=O)[O-])ccc1OC(F)F 509260549 RNTKKOQZVWCDCP-UHFFFAOYSA-N 493.470 5.430 5 20 JKBD Cc1ccc(S(=O)(=O)Nc2cc(NC(=O)c3cccc(C(F)(F)F)c3)ccc2C)c([N+](=O)[O-])c1 509540667 KVDCPSUAJNAIKL-UHFFFAOYSA-N 493.463 5.284 5 20 JKBD COc1cc(C(=O)Nc2ccc(OCC(C)C)c(Cl)c2)c([N+](=O)[O-])cc1OCc1cscn1 511159964 RPIDWZMOFNILFX-UHFFFAOYSA-N 491.953 5.579 5 20 JKBD O=C(Cc1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1)N1CCC(Nc2ccc(F)cc2)CC1 512150488 VEECCYWLESNMDV-UHFFFAOYSA-N 499.546 5.232 5 20 JKBD COc1cc(C(=O)N(Cc2cccc(C)c2)Cc2ccco2)c([N+](=O)[O-])cc1OCc1cscn1 512444080 KMAJQFOHEHEWLP-UHFFFAOYSA-N 493.541 5.383 5 20 JKBD O=C(CSc1nc(-c2cccs2)nc2ccccc12)Nc1cc2c(cc1[N+](=O)[O-])OCCCO2 514836685 NFVOBOVEVUXPDA-UHFFFAOYSA-N 494.554 5.159 5 20 JKBD CCC(CC)C(=O)N1CCC(NC(=O)c2cc([N+](=O)[O-])ccc2Sc2ccc(Cl)cc2)CC1 518064001 FOXGZVHVHCJZJC-UHFFFAOYSA-N 490.025 5.556 5 20 JKBD O=C(Nc1ccc(Oc2ccccc2)cc1C(F)(F)F)c1cnn(-c2ccc([N+](=O)[O-])cc2)c1 519098269 XLOXPIYCWYISHU-UHFFFAOYSA-N 468.391 5.844 5 20 JKBD CCCCc1nc2ccc(NC(=O)c3cc(OC)c(OCc4cscn4)cc3[N+](=O)[O-])cc2[nH]1 519921755 YMYNHVHOBLYUDT-UHFFFAOYSA-N 481.534 5.110 5 20 JKBD Cc1cc(Oc2ncccn2)ccc1NC(=O)c1ccc(NCc2ccccc2)c([N+](=O)[O-])c1 519953371 MFVDXHVWHDAMDL-UHFFFAOYSA-N 455.474 5.350 5 20 JKBD COc1cc(CN[C@H]2CCSc3c(F)cccc32)ccc1OCc1ccc([N+](=O)[O-])cc1 521818899 CGOKQZSGHZDHJR-NRFANRHFSA-N 454.523 5.648 5 20 JKBD C[C@H](Nc1ccc(C(=O)Nc2ccnn2[C@@H]2CCCc3ccccc32)cc1[N+](=O)[O-])c1ccccn1 522247200 KJQXEYQHGVKYGZ-MHECFPHRSA-N 482.544 5.537 5 20 JKBD Cc1ccc(-c2c(C(=O)Nc3ccc([N+](=O)[O-])cc3)c(C)nc3sc4c(c23)CCN(C)C4)cc1 543444526 NCDIENOJUYVPOY-UHFFFAOYSA-N 472.570 5.729 5 20 JKBD C[C@@H]1CCCN(c2ccc(C(=O)NC3C[C@@H](C(F)(F)F)C[C@H](C(F)(F)F)C3)cc2[N+](=O)[O-])C1 603572879 KNRCABMGMRMOSB-SNPRPXQTSA-N 481.437 5.470 5 20 JKBD O=C(c1cc(F)ccc1F)C1CCN(C(=O)c2ccc(NCc3ccccc3)c([N+](=O)[O-])c2)CC1 603905105 BPHVZMUXESEQJK-UHFFFAOYSA-N 479.483 5.220 5 20 JKBD CCSCc1ccc(C(=O)N(CCOC)c2nc(-c3ccc([N+](=O)[O-])cc3)cs2)cc1 603946846 RCWPIKMLKAYBDK-UHFFFAOYSA-N 457.577 5.265 5 20 JKBD C[C@H](NC(=O)c1ccccc1OCC(=O)Nc1cccc(C(F)(F)F)c1)c1cccc([N+](=O)[O-])c1 603966529 FHDIZEXRKYHAKC-HNNXBMFYSA-N 487.434 5.122 5 20 JKBD CN(C[C@@H]1CCCO[C@@H]1c1ccccc1)C(=O)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1 604519245 WKNMMEZXXMCVGM-NBGIEHNGSA-N 480.948 6.280 5 20 JKBD CN(Cc1cc([N+](=O)[O-])ccc1Cl)C(=O)C1(c2ccccc2)CCN(C(=O)OC(C)(C)C)CC1 727124452 MRSPAZWVPFIGFL-UHFFFAOYSA-N 487.984 5.176 5 20 JKBD O=C(Nc1nc(-c2ccc(OC(F)F)cc2OC(F)F)cs1)c1cc(F)c(F)cc1[N+](=O)[O-] 727709554 TVELEBRDMBVRRA-UHFFFAOYSA-N 493.341 5.452 5 20 JKBD CC(C)c1nc(C(=O)N(CC2CC2)c2ccc(Cl)c([N+](=O)[O-])c2)nn1-c1ccccc1Cl 728165635 MVVHAADLFREZOB-UHFFFAOYSA-N 474.348 5.663 5 20 JKBD Cc1cc[n+](/C(C(=S)Nc2c(Cl)ccc(C)c2Cl)=C(/O)c2ccc([N+](=O)[O-])cc2)cc1 728558533 OXMXEUQMMKGQLM-UHFFFAOYSA-O 475.377 6.129 5 20 JKBD CC(C)(C)OC(=O)Nc1ccc(NC(=O)NCCNc2ccc([N+](=O)[O-])cc2)c(C(F)(F)F)c1 729572292 GJHJZRQERDZPGI-UHFFFAOYSA-N 483.447 5.194 5 20 JKBD C[C@H](OC(=O)Cn1c2ccccc2c(=O)c2ccccc21)c1ccc(NC(=O)c2ccccc2)cc1 748014172 KORRXKOSKJHBGA-FQEVSTJZSA-N 476.532 5.711 5 20 JKBD O=C(OCc1nc(-c2ccc([N+](=O)[O-])cc2)no1)c1c(Cl)cc(C(F)(F)F)cc1Cl 919295637 DPAXLEZHLHAHSF-UHFFFAOYSA-N 462.167 5.327 5 20 JKBD C[C@H](OC(=O)CCSc1ccc(Br)cc1)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 920581444 GATYLTTUZCULRR-LBPRGKRZSA-N 478.324 5.194 5 20 JKBD O=C(Cc1cc(F)ccc1[N+](=O)[O-])NC1(c2ccc(NC(=O)C3CCC(F)(F)CC3)cc2)CCC1 1786245658 MLJWRXIBLXUBSJ-UHFFFAOYSA-N 489.494 5.236 5 20 JKBD Cc1cccc2cc(C(=O)Nc3ccc(C4(NC(=O)c5ccc(O)c([N+](=O)[O-])c5)CCC4)cc3)[nH]c12 1789254612 KSQCPKWPBQHMRU-UHFFFAOYSA-N 484.512 5.152 5 20 JKBD Cc1cc[nH]c1C(=O)NC1(c2ccc(NC(=O)c3cc(Br)ccc3[N+](=O)[O-])cc2)CCC1 1790664138 UDANLLUMCCSMEZ-UHFFFAOYSA-N 497.349 5.055 5 20 JKBD CSc1ccc(CC(=O)Nc2ccc(C3(NC(=O)/C=C/c4ccc([N+](=O)[O-])o4)CCC3)cc2)cc1 1791734504 IQYIQFUJZNNZBL-UKTHLTGXSA-N 491.569 5.300 5 20 JKBD Cc1ccc(CCC(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cc4cc([N+](=O)[O-])ccc4s2)C3)cc1F 1793529507 ZNTOFDMDNLTLRI-ACDBMABISA-N 495.576 5.142 5 20 JKBD Cc1c(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)C2(c4cccc([N+](=O)[O-])c4)CCC2)C3)oc2ccccc12 1797418258 LLZQFQHEGSRDLZ-WKCHPHFGSA-N 487.556 5.023 5 20 JKBD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CSc1ccccc1[N+](=O)[O-])c1ccc2occ(Cl)c2c1 1802184177 RZRPQUUDYLSEQE-BJWYYQGGSA-N 499.976 5.039 5 20 JKBD CC(C)[C@H](C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2ccc([N+](=O)[O-])o2)n[nH]1)c1ccc(Cl)cc1 1814307506 GFUUSNOAHPAHEY-AVRDEDQJSA-N 499.955 5.310 5 20 JKBD Cc1cccc(Cl)c1C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cccc(F)c2[N+](=O)[O-])n[nH]1 1821171592 FONIUGJBIKASSA-GOSISDBHSA-N 485.903 5.039 5 20 JKBD CC1=CC[C@H](C(=O)N2CCCC[C@@H]2c2cc(NC(=O)c3cc(Cl)cc([N+](=O)[O-])c3C)n[nH]2)CC1 1821294639 RTCVQLJDCCXSEL-OXJNMPFZSA-N 485.972 5.332 5 20 JKBD O=C(/C=C/c1ccccc1[N+](=O)[O-])Nc1cc([C@H]2CCCCN2C(=O)c2cc3ccoc3s2)[nH]n1 1823501190 PFBLSYLTGXIAAY-CSHXORCISA-N 491.529 5.145 5 20 JKBD O=C(/C=C/c1ccccc1[N+](=O)[O-])Nc1cc([C@@H]2CCCCN2C(=O)c2cc(F)ccc2Cl)[nH]n1 1823502602 CGVVUAVCUWAAAX-MAIVGLDJSA-N 497.914 5.130 5 20 JKBD Cc1cc(F)c(C(=O)N2CCC([C@H]3CCCCN3C(=O)CCc3cccc([N+](=O)[O-])c3)CC2)cc1F 1824841859 CJOKHQVLFUMZHA-RUZDIDTESA-N 499.558 5.048 5 20 JKBD O=C(c1cccc2ccccc12)N1CCC([C@@H]2CCCCN2C(=O)c2ccc([N+](=O)[O-])cc2F)CC1 1830497042 WMNXZBVNASQMTP-SANMLTNESA-N 489.547 5.434 5 20 JKBD O=C(CCCc1ccccc1F)N1CCC([C@H]2CCCCN2C(=O)c2cccc(F)c2[N+](=O)[O-])CC1 1830616780 MYTMLMDQTQMYQU-XMMPIXPASA-N 499.558 5.129 5 20 JKBD CC1(C(=O)N2CCC([C@H]3CCCCN3C(=O)c3cc4cc([N+](=O)[O-])ccc4s3)CC2)CCC1 1831060053 NCYBRPVQTOGZRF-HXUWFJFHSA-N 469.607 5.233 5 20 JKBD C[C@H](CC(=O)N1CCCC[C@H]1C1CCN(C(=O)CCc2cccc([N+](=O)[O-])c2)CC1)c1ccccc1 1831503051 HSJVKPYKURTFFK-AMGIVPHBSA-N 491.632 5.341 5 20 JKBD C[C@@H](CC(=O)N1CCC([C@H]2CCCCN2C(=O)Cc2cc(F)ccc2[N+](=O)[O-])CC1)c1ccccc1 1832888067 BSMLXWKBMILRQK-NBGIEHNGSA-N 495.595 5.090 5 20 JKBD O=C(c1cc2cc([N+](=O)[O-])ccc2s1)N1CC2(CCCN2C(=O)c2ccc(-c3ccccc3)nc2)C1 1844601908 RXTBIHTUGJKSFC-UHFFFAOYSA-N 498.564 5.002 5 20 JKBD C[C@@H](Sc1nnc(N2CCCCC2)n1-c1ccccc1)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 17952602 JWRSVQAOXATUHS-MRXNPFEDSA-N 477.550 5.069 5 20 JKBD Cc1ccc(NC(=O)[C@H](Sc2nnc(C)n2-c2ccccc2)c2ccccc2)c([N+](=O)[O-])c1 28606709 VSHURAPQDCVJJM-JOCHJYFZSA-N 459.531 5.264 5 20 JKBD Cc1ccc(NC(=O)[C@@H](Sc2nnc(/C=C/c3ccccc3)[nH]2)c2ccccc2)c([N+](=O)[O-])c1 69525548 WBCLNXIZRVFJMM-JLQMKUNGSA-N 471.542 5.664 5 20 JKBD C[C@@H](c1ccc(S(C)(=O)=O)cc1)N(C)C(=O)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1 105731239 RMNHCJVOSCLHIS-HNNXBMFYSA-N 488.949 5.277 5 20 JKBD C[C@H](Nc1ccc(C(=O)Nc2ncc(Cc3ccccc3)s2)cc1[N+](=O)[O-])c1ccccn1 115701040 CADMUCTWZAMBIZ-INIZCTEOSA-N 459.531 5.463 5 20 JKBD CC(C)c1nccn1Cc1cccc(NC(=O)c2ccc(N3CCC[C@@H](C)C3)c([N+](=O)[O-])c2)c1 117470892 ABGUDMRPPBOLNU-LJQANCHMSA-N 461.566 5.452 5 20 JKBD O=C(Nc1nnc(Cc2cccc(F)c2)s1)c1cc([N+](=O)[O-])ccc1Sc1ccccc1 410032889 KUSXJVXDDRIABS-UHFFFAOYSA-N 466.519 5.580 5 20 JKBD Cc1nn(Cc2ccc(C(=O)N[C@@H](C)c3nc(-c4ccccc4)cs3)cc2)c(C)c1[N+](=O)[O-] 410287485 KJNXHHWQGPNPQI-INIZCTEOSA-N 461.547 5.071 5 20 JKBD COc1cccc(CNC(=O)c2ccccc2Sc2ccc(C(F)(F)F)cc2[N+](=O)[O-])n1 498034043 XJQMDZCGEGCLNM-UHFFFAOYSA-N 463.437 5.098 5 20 JKBD C[C@@H](Sc1nnc(-c2ccccc2Br)o1)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 501173107 HGQJHMSGOGOAAG-SNVBAGLBSA-N 474.296 5.311 5 20 JKBD COc1cc(C(=O)N[C@H](c2ccc(C(C)C)cc2)C(C)C)c([N+](=O)[O-])cc1OCc1cscn1 512306919 VTWXNRIRDLLUEE-DEOSSOPVSA-N 483.590 5.889 5 20 JKBD O=C(c1ccc(NCc2ccccc2)c([N+](=O)[O-])c1)N1CCO[C@H](c2ccc(Br)cc2)C1 516322961 MNYLPDRBIYBBLZ-QHCPKHFHSA-N 496.361 5.183 5 20 JKBD CC(C)c1noc(CCCNC(=O)c2cc([N+](=O)[O-])ccc2Sc2ccc(Cl)cc2)n1 519936707 DAVGQDRRJUJYEJ-UHFFFAOYSA-N 460.943 5.268 5 20 JKBD COC(=O)c1ccccc1C(=O)c1ccc(NCc2cc(Br)cs2)c([N+](=O)[O-])c1 603865084 QOMIVZRGNOJLFM-UHFFFAOYSA-N 475.320 5.049 5 20 JKBD COc1cc(C(=O)N2CC[C@H](C)Sc3ccc(C(F)(F)F)cc32)c([N+](=O)[O-])cc1OC 603961988 UDLBXMCYFUQCPE-NSHDSACASA-N 456.442 5.162 5 20 JKBD COc1ccc(N(C)C(=O)C/C(=C/c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)cc1OC 604440203 YHAAJHABIJABAV-JXAWBTAJSA-N 489.553 5.815 5 20 JKBD Cc1ccc(NC(=O)c2cccc(C(F)(F)F)c2)cc1NCC(=O)Nc1ccc([N+](=O)[O-])cc1C 604448362 XAVXAHIMBKHCOJ-UHFFFAOYSA-N 486.450 5.533 5 20 JKBD COc1ccc([C@@H](NCc2cn(-c3ccccc3)nc2-c2ccc([N+](=O)[O-])cc2)C2CC2)cc1 608835704 LQLZZCQCPXQDOL-SANMLTNESA-N 454.530 5.697 5 20 JKBD Cc1c(NC(=O)c2ccc(N3CCC[C@H](C)C3)c([N+](=O)[O-])c2)cccc1OCC(F)(F)F 609022524 QENNMFVJLIIBES-AWEZNQCLSA-N 451.445 5.333 5 20 JKBD O=C(c1ccc(C(=O)N2CCC[C@@H]2c2cccs2)cc1[N+](=O)[O-])N1CCC[C@H]1c1cccs1 609043744 PUEFHFAAJDWVNN-MOPGFXCFSA-N 481.599 5.672 5 20 JKBD Cc1cccc(-c2nnc(S[C@H](C(=O)Nc3ccc(C)cc3[N+](=O)[O-])c3ccccc3)o2)c1 614785646 GYCIMZOACYTBFQ-NRFANRHFSA-N 460.515 5.734 5 20 JKBD Cc1nn(CCC(=O)Nc2cc([N+](=O)[O-])ccc2Nc2cccc(C(F)(F)F)c2)c(C)c1[N+](=O)[O-] 726497781 CLRDXSJHQUVORJ-UHFFFAOYSA-N 492.414 5.108 5 20 JKBD Cc1ccc(S(=O)(=O)Nc2ccc(C(=O)Nc3cccc(SC(F)F)c3)cc2)cc1[N+](=O)[O-] 727414703 XKMMWGLCSORJDR-UHFFFAOYSA-N 493.513 5.271 5 20 JKBD Cc1cccc(C(C)C)c1NC(=O)[C@H](C)OC(=O)c1csc(-c2ccc([N+](=O)[O-])cc2)n1 747958612 PKLBHCODFOMQET-HNNXBMFYSA-N 453.520 5.334 5 20 JKBD C[C@H](OC(=O)c1ccccc1NC(=O)c1ccc([N+](=O)[O-])cc1Cl)C(=O)NCCC1=CCCCC1 847375841 XBTWDVLWYHGPPT-INIZCTEOSA-N 499.951 5.053 5 20 JKBD COc1ccc(-c2ccc(CN3CC4(CCOCC4)[C@H]3c3cnn(CC(C)C)c3)o2)c([N+](=O)[O-])c1 849478984 LNUIXALQWADTDD-RUZDIDTESA-N 480.565 5.070 5 20 JKBD Cc1cc(C)c(NC(=O)[C@H](C)Oc2ccc3c(-c4ccc([N+](=O)[O-])cc4)cc(=O)oc3c2)c(Cl)c1 851958761 JNCMYUZLUKWFOU-INIZCTEOSA-N 492.915 6.044 5 20 JKBD Cc1cc(C(=O)N2CCC[C@@H]2c2nc(-c3ccc(Oc4ccccc4)nc3)no2)ccc1[N+](=O)[O-] 904455396 XQZQUKCSQBENHK-OAQYLSRUSA-N 471.473 5.118 5 20 JKBD C[C@@H](Nc1ccc(-c2nc(-c3cccc(OCc4cccnc4)c3)no2)cc1[N+](=O)[O-])c1ccccn1 904500430 LUOKCKZQHVYBAA-GOSISDBHSA-N 494.511 5.854 5 20 JKBD CC(C)c1cc(C(=O)Oc2ccc(NC(=O)c3cc([N+](=O)[O-])ccc3Cl)cc2)nn1C(C)(C)C 916950835 DEQBAASLPMOYPA-UHFFFAOYSA-N 484.940 5.795 5 20 JKBD Cc1ccccc1-c1nnc(S[C@@H](C)C(=O)Nc2ccc(F)c([N+](=O)[O-])c2)n1Cc1ccco1 917232072 OYRJDLBRPRVIPR-HNNXBMFYSA-N 481.509 5.061 5 20 JKBD CC(=O)N(c1ccc(C)c(C)c1)c1nc(COC(=O)c2ccc(C(C)(C)C)c([N+](=O)[O-])c2)cs1 917349228 BGRQIIPIMJJMJJ-UHFFFAOYSA-N 481.574 6.007 5 20 JKBD CC(C)N(Cc1nnc(-c2cccc([N+](=O)[O-])c2)o1)C(=O)c1ccc(Br)cc1Cl 917590738 ATQNRABKCXBVPQ-UHFFFAOYSA-N 479.718 5.112 5 20 JKBD CC(C)CCSc1ccc(C(=O)N(C)C2CCN(C(=O)OC(C)(C)C)CC2)cc1[N+](=O)[O-] 918123462 BEPBJCBVWGFXON-UHFFFAOYSA-N 465.616 5.205 5 20 JKBD Cc1ccc(NC(=O)[C@@H](OC(=O)c2csc(-c3ccccc3F)n2)c2ccccc2)c([N+](=O)[O-])c1 920730063 WPDRGAUMHWKUPB-QFIPXVFZSA-N 491.500 5.703 5 20 JKBD Cc1c(C(=O)NC2(c3ccc(NC(=O)/C=C/c4ccc([N+](=O)[O-])o4)cc3)CCC2)oc2ccccc12 1786207535 WFAPEWUUDDUVTF-ACCUITESSA-N 485.496 5.704 5 20 JKBD COc1cc(CC(=O)Nc2ccc(C3(NC(=O)[C@]4(F)CCCC=C4F)CCC3)cc2)ccc1[N+](=O)[O-] 1790480264 NVGVUTHAAAUQQV-SANMLTNESA-N 499.514 5.026 5 20 JKBD Cc1c(C(=O)N2CCC3(CCCN(C(=O)[C@@H]4CCCCC4(F)F)C3)CC2)cc(Cl)cc1[N+](=O)[O-] 1806207254 GTWZCIRJHWJQMM-IBGZPJMESA-N 497.970 5.227 5 20 JKBD CCC1(C(=O)N2CC[C@H](CNC(=O)c3cc4cc([N+](=O)[O-])ccc4s3)[C@H]2c2cccnc2)CCC1 1812303983 SYNQOORFPZIQBB-WZONZLPQSA-N 492.601 5.104 5 20 JKBD C/C(=C\c1cccs1)C(=O)Nc1cc([C@H]2CCCCN2C(=O)CCc2cccc([N+](=O)[O-])c2)[nH]n1 1814409731 FVKIUZAPSCVEHF-JWIKTPOESA-N 493.589 5.108 5 20 JKBD Cc1c(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)C3CC4(CCC4)C3)[nH]n2)cc(Cl)cc1[N+](=O)[O-] 1821292333 BVHPCLFCUHYKDH-IBGZPJMESA-N 485.972 5.166 5 20 JKBD CC[C@H](C)CC(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cc(Br)ccc2[N+](=O)[O-])CC1 1824346073 APIATAIPZPHHCH-OXJNMPFZSA-N 494.430 5.027 5 20 JKBD Cc1c(C(=O)N2CCC([C@H]3CCCCN3C(=O)c3ccsc3)CC2)cc(Cl)cc1[N+](=O)[O-] 1825796814 RCSYAJVZQWMYPB-HXUWFJFHSA-N 475.998 5.165 5 20 JKBD Cc1cc(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3cc(Cl)cc([N+](=O)[O-])c3C)CC2)c(C)o1 1825879865 OFXQVEFVOHDBBQ-JOCHJYFZSA-N 487.984 5.314 5 20 JKBD Cc1cc(F)ccc1C(=O)N1CCC([C@H]2CCCCN2C(=O)CSc2ccccc2[N+](=O)[O-])CC1 1831777058 AOYKNYZQOKLLLD-JOCHJYFZSA-N 499.608 5.068 5 20 JKBD CC(=O)N(c1ccccc1)c1nc(CSc2nc3ccccc3c3nc4ccccc4n23)cs1 8760658 UXNQFHVUULYJHC-UHFFFAOYSA-N 481.606 6.469 5 20 JKBD COc1cc(CNC(=O)Cn2c3ccccc3c(=O)c3ccccc32)ccc1OCc1ccccc1 14729746 FHLUPNNJMZPCNM-UHFFFAOYSA-N 478.548 5.059 5 20 JKBD C[C@H](OC(=O)c1cc(Cl)ccc1[N+](=O)[O-])C(=O)Nc1ccc(Cl)cc1C(F)(F)F 15798253 ZWWSSNORGBPPOW-QMMMGPOBSA-N 451.184 5.104 5 20 JKBD C[C@@H](OC(=O)C(c1ccccc1)c1ccccc1)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 20989068 BCMDODLIZBUHFU-OAHLLOKOSA-N 472.419 5.316 5 20 JKBD C[C@H](N[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1)c1ccc(NC(=O)C2CC2)cc1 28346976 FMIAZXGNFMKWAY-FYSMJZIKSA-N 492.963 5.627 5 20 JKBD O=C(CCC(=O)c1ccccc1)O[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1 28611036 JOQDCKOHYZXSCZ-HSZRJFAPSA-N 466.877 5.134 5 20 JKBD CSc1ccc([N+](=O)[O-])c(C(=O)Nc2ncc(Cc3ccc(Br)cc3)s2)c1 28642629 VQHVQLSYCIVYAX-UHFFFAOYSA-N 464.366 5.379 5 20 JKBD COc1ccc(-c2nnc(S[C@H](C(=O)Nc3ccc(C)cc3[N+](=O)[O-])c3ccccc3)n2C)cc1 36855630 FKISZSZPNDDCOP-QFIPXVFZSA-N 489.557 5.179 5 20 JKBD COc1ccc2cc(CNC(=O)C3CCN(c4ccc(C(F)(F)F)cc4[N+](=O)[O-])CC3)ccc2c1 477675834 GWWJPECMQRCFLV-UHFFFAOYSA-N 487.478 5.308 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)Nc2ccnn2Cc2ccc(Cl)cc2Cl)cc1SC 481991442 LRWIRWMBGPSRFT-UHFFFAOYSA-N 467.334 5.129 5 20 JKBD COc1cc(CCC2CCN(C(=O)c3csc(-c4cccc([N+](=O)[O-])c4)n3)CC2)cc(OC)c1 495413347 WALWOMPZLZQVBG-UHFFFAOYSA-N 481.574 5.221 5 20 JKBD Cc1cc(C(=O)N2CCCC[C@H]2C)ccc1NC(=O)c1csc(-c2cccc([N+](=O)[O-])c2)n1 495495654 VLSYYSNZISSVRY-MRXNPFEDSA-N 464.547 5.294 5 20 JKBD CC[C@H](C)Sc1ccc(NC(=O)C2CCN(c3ccccc3[N+](=O)[O-])CC2)c(C(F)(F)F)c1 499563446 VAXRVPJWJXOBNE-HNNXBMFYSA-N 481.540 6.359 5 20 JKBD Cc1cccc(-c2nc(C(C)C)no2)c1NC(=O)c1ccc(N[C@@H](C)c2ccccn2)c([N+](=O)[O-])c1 505434086 URHZGTHUPPHJPH-KRWDZBQOSA-N 486.532 5.897 5 20 JKBD COc1ccc(OC)c([C@@H]2CCCN2C(=O)c2ccc(N[C@H](C)c3ccccn3)c([N+](=O)[O-])c2)c1 506088041 TWSJOLYOTRYSQU-HXOBKFHXSA-N 476.533 5.157 5 20 JKBD CNC(=O)Nc1cccc(NC(=O)c2ccc(Sc3nc4ccccc4s3)c([N+](=O)[O-])c2)c1 514976887 JGXJJJOCQJHHGH-UHFFFAOYSA-N 479.543 5.359 5 20 JKBD O=C(Nc1sc2c(c1-c1nc3ccccc3[nH]1)CCCC2)c1cnn(-c2ccc([N+](=O)[O-])cc2)c1 516463088 IVSDKSFJSITYGK-UHFFFAOYSA-N 484.541 5.516 5 20 JKBD Cc1csc(Sc2ccc(C(=O)Nc3ccccc3NCC(F)(F)F)cc2[N+](=O)[O-])n1 517892329 QILSNYLLPCEDSS-UHFFFAOYSA-N 468.482 5.737 5 20 JKBD Cc1ccc(C(=O)Nc2cccc(C(F)(F)F)c2)cc1NC(=O)c1cc([N+](=O)[O-])cnc1C 518932214 WKXHXWBVBJZLHW-UHFFFAOYSA-N 458.396 5.130 5 20 JKBD COc1ccc([C@@H](Cc2ccc(F)cc2)NC(=O)c2cc(OCC(F)(F)F)ccc2[N+](=O)[O-])cc1 520618270 LBCKXYFRGUMMPS-OAQYLSRUSA-N 492.425 5.397 5 20 JKBD Cc1ccc(C)c(OCc2nnc(S[C@H](C)C(=O)Nc3ccc([N+](=O)[O-])cc3C(F)(F)F)o2)c1 594640108 BJDBIMVIADYBFE-CYBMUJFWSA-N 496.467 5.312 5 20 JKBD NC(=O)c1ccc(NCc2ccc(Oc3ccccc3Cl)c([N+](=O)[O-])c2)cc1N1CCCCC1 600847667 LQNOCMWUJWWKOD-UHFFFAOYSA-N 480.952 5.742 5 20 JKBD O=[N+]([O-])c1cc(C(F)(F)F)ccc1CNc1cccc(CS(=O)(=O)C2CCCCC2)c1 600852848 AEANENMEYJRFKA-UHFFFAOYSA-N 456.486 5.473 5 20 JKBD COc1ccc(NC(=O)c2cc3cccc([N+](=O)[O-])c3[nH]2)cc1OCc1ccc2ccccc2n1 609074132 GVYMGSPZZIVIQK-UHFFFAOYSA-N 468.469 5.464 5 20 JKBD CC1=C(C(=O)Nc2ccccc2C)[C@H](c2ccc([N+](=O)[O-])cc2)NC(=O)N1CCc1cccs1 731855877 DZWRRLPDOVUTBL-QHCPKHFHSA-N 476.558 5.186 5 20 JKBD COc1ccc(CCCC(=O)Oc2ccc(NC(=O)c3cc([N+](=O)[O-])ccc3Cl)cc2)cc1 747112094 WRUUQSGYTFHDPV-UHFFFAOYSA-N 468.893 5.437 5 20 JKBD Cn1ccnc1SCc1cccc(C(=O)Oc2ccc(NC(=O)c3cccc([N+](=O)[O-])c3)cc2)c1 749162918 VNOXFQWYDSIFDF-UHFFFAOYSA-N 488.525 5.092 5 20 JKBD O=C(NO[C@@H]1CCCCO1)c1c2c(nc3ccccc13)/C(=C\c1cccc([N+](=O)[O-])c1)CCC2 749620361 RFDSUFBWZAHRCX-NTOIIUQRSA-N 459.502 5.208 5 20 JKBD CCOc1cc(NC(=O)c2cccc3c(=O)c(C)c(-c4ccccc4)oc23)c([N+](=O)[O-])cc1OCC 790626400 IFWVGKQHCVGXLP-UHFFFAOYSA-N 488.496 5.726 5 20 JKBD COc1cc([C@H](C[N+](=O)[O-])c2c[nH]c3ccccc23)ccc1OS(=O)(=O)c1ccc(Cl)cc1 916098037 CILLIIIUMULDDQ-FQEVSTJZSA-N 486.933 5.006 5 20 JKBD COc1ccc(C(C)=O)cc1CC(=O)Nc1cc(Cl)c([N+](=O)[O-])cc1OCc1ccccc1 916827663 PTZFILPXUPHWAA-UHFFFAOYSA-N 468.893 5.220 5 20 JKBD COc1ccc([N+](=O)[O-])c(C(=O)Nc2nc(-c3cc(C)n(CCc4ccccc4)c3C)cs2)c1 920277927 JUPGBPLEQRIYPZ-UHFFFAOYSA-N 476.558 5.640 5 20 JKBD Cc1sc2nc([C@H](C)OC(=O)c3ccc(N[C@@H](C)c4ccccn4)c([N+](=O)[O-])c3)nc(O)c2c1C 920543356 BYLFHIRKZYHITC-KBPBESRZSA-N 493.545 5.408 5 20 JKBD CCc1ccc2c(COC(=O)c3ccc(N[C@@H](C)c4ccccn4)c([N+](=O)[O-])c3)cc(=O)oc2c1 920544547 CORHMJQPVXWDSB-INIZCTEOSA-N 473.485 5.189 5 20 JKBD Cc1nc2cc(C(=O)NC3(c4ccc(NC(=O)c5ccc([N+](=O)[O-])o5)cc4)CCC3)ccc2s1 1785748974 SNGIIPIQZWGEGR-UHFFFAOYSA-N 476.514 5.167 5 20 JKBD C/C(=C\c1ccc(C)o1)C(=O)Nc1ccc(C2(NC(=O)c3nc4cc([N+](=O)[O-])ccc4[nH]3)CCC2)cc1 1789585899 ZFQAJRNIYZHASL-JQIJEIRASA-N 499.527 5.224 5 20 JKBD O=C(CCCOc1ccc(Cl)cc1)NC1(c2ccc(NC(=O)c3ccc([N+](=O)[O-])[nH]3)cc2)CCC1 1790184218 FGCJYWNOJOSSKU-UHFFFAOYSA-N 496.951 5.183 5 20 JKBD Cc1cc(O)c([N+](=O)[O-])cc1C(=O)Nc1ccc(C2(NC(=O)C3CCC(F)(F)CC3)CCC2)cc1 1790807212 SJDWEZBIJLRRAL-UHFFFAOYSA-N 487.503 5.182 5 20 JKBD COc1cc(C(=O)Nc2ccc(C3(NC(=O)[C@@H]4CCCCC4(F)F)CCC3)cc2)ccc1[N+](=O)[O-] 1792163985 QJPMFSVZNXIYIY-IBGZPJMESA-N 487.503 5.177 5 20 JKBD Cc1ccc(C2(C(=O)N3[C@H]4CC[C@@H]3C[C@H](NC(=O)/C=C/c3ccc([N+](=O)[O-])o3)C4)CCCCC2)cc1 1802621390 NIPMPKMLCLJWIE-QZSXNWDBSA-N 491.588 5.050 5 20 JKBD O=C(Nc1cc([C@@H]2CCCCN2C(=O)C2CCCC2)[nH]n1)c1cc2cc([N+](=O)[O-])ccc2s1 1821610322 YFKQXBDVTCPTIR-SFHVURJKSA-N 467.551 5.029 5 20 JKBD O=C(CCC1CCC1)N1CCC([C@H]2CCCCN2C(=O)C2(c3cccc([N+](=O)[O-])c3)CCC2)CC1 1830291484 OFAFJXJSQZLNMG-RUZDIDTESA-N 481.637 5.217 5 20 JKBD O=C(c1ccc(Cl)c(F)c1)N1CCC([C@@H]2CCCCN2C(=O)c2cc(F)cc([N+](=O)[O-])c2)CC1 1830618204 MPUWUCDMVMNHHV-QFIPXVFZSA-N 491.922 5.074 5 20 JKBD Cc1ccc([C@@H](C)C(=O)N2CCC([C@H]3CCCCN3C(=O)Cc3ccc([N+](=O)[O-])cc3F)CC2)cc1 1831293742 HLBRDEIVUFXSGV-FQRUVTKNSA-N 495.595 5.008 5 20 JKBD O=C(CSc1nnc(-c2ccccc2F)n1Cc1ccccc1)Nc1cc(Cl)ccc1[N+](=O)[O-] 9330691 GXOLPNFLARQRAD-UHFFFAOYSA-N 497.939 5.425 5 20 JKBD CC(C)Cn1c(SCC(=O)Nc2cc([N+](=O)[O-])ccc2F)nnc1-c1ccc(Cl)cc1Cl 9847738 FXDPNAPORGDJKK-UHFFFAOYSA-N 498.367 5.686 5 20 JKBD Cc1ccc(C)c(NC(=O)[C@@H](OC(=O)c2ccc(Br)c([N+](=O)[O-])c2)c2ccccc2)c1 9848893 PWHSETAQBBFZOI-NRFANRHFSA-N 483.318 5.511 5 20 JKBD O=C(C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1)N1CCC(OCc2ccccc2)CC1 10272689 ZQCZVLYMQHHUCL-UHFFFAOYSA-N 491.510 5.038 5 20 JKBD CC(=O)Nc1ccc(-c2csc(NC(=O)c3cc([N+](=O)[O-])ccc3Sc3ccccc3)n2)cc1 15991575 RTUGCZREGHEFIL-UHFFFAOYSA-N 490.566 6.080 5 20 JKBD CC[C@H](C)Cc1c(C)sc2[nH]c(S[C@H](C)c3nnc(-c4ccc([N+](=O)[O-])cc4)o3)nc(=O)c12 17952999 HDASPLCIQLFBAH-WCQYABFASA-N 485.591 5.693 5 20 JKBD CCn1cnnc1-c1cccc(NC(=O)c2ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])c(OC)c2)c1 25278781 IUQHIADGORPGAN-UHFFFAOYSA-N 493.907 5.580 5 20 JKBD O=C(c1ccc(NCc2ccccc2)c([N+](=O)[O-])c1)N1CCC(c2nc3ccccc3[nH]2)CC1 29267620 HJWHBMKBKWULSU-UHFFFAOYSA-N 455.518 5.103 5 20 JKBD O=C(c1cc([N+](=O)[O-])ccc1N1CCCCC1)N1CCC(c2nc3cc(Cl)ccc3o2)CC1 108247637 BZDVDQLDUBICNG-UHFFFAOYSA-N 468.941 5.400 5 20 JKBD C[C@@H](Nc1ccc(C(=O)Nc2ccc(N3CCCCCC3)cc2)cc1[N+](=O)[O-])c1ccccn1 108831778 GRGNYPQRABYTOJ-LJQANCHMSA-N 459.550 5.796 5 20 JKBD CCOc1cc(NC(=O)c2sc3nc(C(F)(F)F)ccc3c2C)c([N+](=O)[O-])cc1OCC 195531804 YZRVINRPSAESIO-UHFFFAOYSA-N 469.441 5.581 5 20 JKBD Cc1sc2ncnc(S[C@H](C)C(=O)Nc3nc(-c4cccc([N+](=O)[O-])c4)cs3)c2c1C 255941257 KDSOWMSULZBJII-GFCCVEGCSA-N 471.589 5.459 5 20 JKBD COc1cc(C(=O)Nc2nnc(C(F)F)s2)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 409459984 XSWVUCZAZXKUBP-UHFFFAOYSA-N 456.814 5.091 5 20 JKBD CC[C@@H](C)n1c(SCc2cc(OC)c(OC(F)F)cc2[N+](=O)[O-])nnc1-c1ccccc1 504323013 YXJRXPJLROEXTD-CYBMUJFWSA-N 464.494 5.727 5 20 JKBD O=C(c1ccc(NCc2ccccc2)c([N+](=O)[O-])c1)N1CCO[C@@H](c2ccccc2Cl)C1 505154313 GNNRLZOKLOQDPX-HSZRJFAPSA-N 451.910 5.074 5 20 JKBD C[C@@H](NCc1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1)c1ccc(S(=O)(=O)N(C)C)cc1 513632106 NAQAGKMNASEDHE-MRXNPFEDSA-N 489.981 5.142 5 20 JKBD C[C@H](SCc1nc(O)c2c(-c3ccccc3)csc2n1)C(=O)N[C@@H](C)c1cccc([N+](=O)[O-])c1 515681838 YKOKOXVTCIFTJJ-GJZGRUSLSA-N 494.598 5.471 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Cl)[C@@H](NCc1cc(F)ccc1Br)c1ccccc1 515735781 HDVRGJPABAGHOD-FQEVSTJZSA-N 492.732 5.619 5 20 JKBD CC(C)N(Cc1cccc(Br)c1)C(=O)C1CCN(c2ccccc2[N+](=O)[O-])CC1 516251546 HXJFGUPXECJEMG-UHFFFAOYSA-N 460.372 5.011 5 20 JKBD C[C@H](Sc1nnc(-c2ccccc2F)o1)C(=O)Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1 592947150 UGMUNSBULKKKHC-NSHDSACASA-N 471.495 5.027 5 20 JKBD O=C(c1csc([N+](=O)[O-])c1)N(C[C@@H]1CCCO1)c1nc(-c2ccc(Br)cc2)cs1 603750255 HOGFPAXDIPNWQA-HNNXBMFYSA-N 494.392 5.368 5 20 JKBD Cc1ccc(NS(=O)(=O)c2ccc(Sc3nnc(-c4ccccc4C)o3)c([N+](=O)[O-])c2)c(C)c1 603839651 SUJARDKHZMLSHB-UHFFFAOYSA-N 496.570 5.522 5 20 JKBD Cc1noc(-c2ccc(C)c(NC(=O)c3ccc(Oc4ccc(Cl)cc4[N+](=O)[O-])cc3)c2)n1 603988165 XBQAEOYICMHPDV-UHFFFAOYSA-N 464.865 5.960 5 20 JKBD O=C(C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)NC[C@@H]1Cc2ccccc21 604249160 XFZSZMNJNKCAJC-ACSPXDACSA-N 455.539 5.591 5 20 JKBD C[C@@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)N[C@@H]1C[C@@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1 604442930 WOMYPHWPYXVWSU-SVDPJWKOSA-N 462.774 5.041 5 20 JKBD Cc1c(NC(=O)c2csc(-c3ccc([N+](=O)[O-])cc3)n2)cccc1-c1nnc2n1CCCCC2 604517538 JWVKDPZLMGXTFJ-UHFFFAOYSA-N 474.546 5.264 5 20 JKBD Cn1c(=O)oc2ccc(NC(=O)C/C(=C\c3ccc([N+](=O)[O-])cc3)c3nc4ccccc4s3)cc21 608808324 AXAKHQAQWJXFQL-FOWTUZBSSA-N 486.509 5.219 5 20 JKBD CC(C)CCSc1ccc(C(=O)N(C)C2CCN(C(=O)c3ccccc3)CC2)cc1[N+](=O)[O-] 608953039 RRQRJQKYJMTDFV-UHFFFAOYSA-N 469.607 5.110 5 20 JKBD COc1ccc(NS(=O)(=O)c2ccc([N+](=O)[O-])cc2Cl)cc1OCc1ccc2ccccc2n1 609069832 VWDZZCCXLCRASX-UHFFFAOYSA-N 499.932 5.185 5 20 JKBD C[C@H](OC(=O)c1cc([N+](=O)[O-])ccc1Br)C(=O)Nc1c(Cl)cc(Cl)cc1Cl 725985221 ISKUVDJCWAOLRC-ZETCQYMHSA-N 496.528 5.502 5 20 JKBD Cc1ccc(/C(O)=C(/C(=S)N[C@H](C)c2ccc(Cl)cc2Cl)[n+]2ccccc2)cc1[N+](=O)[O-] 726571707 XEORMZIROOWEAY-OAHLLOKOSA-O 489.404 6.060 5 20 JKBD CC(C)CCSc1ccc(C(=O)N2CCC(NC(=O)Oc3ccccc3)CC2)cc1[N+](=O)[O-] 727336190 IKGPCAUGWMSVNJ-UHFFFAOYSA-N 471.579 5.126 5 20 JKBD O=C(NC1CCN(C(=O)CCC(=O)c2ccc3ccc4cccc5ccc2c3c45)CC1)c1ccccc1 727753316 FNBIYFMWWSSKGR-UHFFFAOYSA-N 488.587 5.968 5 20 JKBD COC(=O)N(C)c1ccc(NC(=O)CCC(=O)c2ccc3ccc4cccc5ccc2c3c45)cc1 727755699 CGMFARUKUNROQK-UHFFFAOYSA-N 464.521 6.388 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)O[C@H](C)C(=O)Nc2c(Cl)cc(Cl)cc2Cl)cc1SC 728655056 AEURLLITTAOGFM-MRVPVSSYSA-N 493.752 5.470 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])c(Cl)c1)c1cnn(-c2ncc(Cl)cc2Cl)c1C(F)(F)F 730753063 DQISZWXQNGTUFA-UHFFFAOYSA-N 480.617 5.407 5 20 JKBD CCOc1cc([C@@H](C[N+](=O)[O-])c2c[nH]c3ccccc23)ccc1OS(=O)(=O)C1CCCCC1 731215030 FIFLFQVLDIWYKV-OAQYLSRUSA-N 472.563 5.017 5 20 JKBD O=C(COC(=O)c1nc(-c2ccccc2)oc1-c1ccccc1)Nc1cc([N+](=O)[O-])ccc1Cl 731377194 OMHZTBRKYBVESE-UHFFFAOYSA-N 477.860 5.366 5 20 JKBD CCOc1cc(C(=O)O[C@H](C)c2ccc(NC(=O)c3ccccc3)cc2)c([N+](=O)[O-])cc1OC 748014514 OHGAZICEUCCAMZ-MRXNPFEDSA-N 464.474 5.172 5 20 JKBD COc1ccc(COc2cccc(F)c2)cc1NC(=O)c1cc([N+](=O)[O-])ccc1Br 751112724 DFVVPXLZMSZYHU-UHFFFAOYSA-N 475.270 5.336 5 20 JKBD COc1ccc([N+](=O)[O-])cc1OC(=O)[C@@H](C)SCc1nc(O)c2c(-c3ccccc3)csc2n1 818033422 MHBQNODHGNPNCR-CYBMUJFWSA-N 497.554 5.208 5 20 JKBD CC1=C(C(=O)Nc2ccccc2)[C@@H](c2cc([N+](=O)[O-])c(F)cc2F)NC(=O)N1Cc1cccs1 916725830 IDVDBAZAAJRZCC-OAQYLSRUSA-N 484.484 5.114 5 20 JKBD Cc1ccccc1-c1nnc(S[C@H](C)C(=O)Nc2ccc(F)c([N+](=O)[O-])c2)n1Cc1ccco1 917232073 OYRJDLBRPRVIPR-OAHLLOKOSA-N 481.509 5.061 5 20 JKBD COc1ccc(N[C@H](C)C(=O)Nc2ccccc2[N+](=O)[O-])cc1NC(=O)c1ccc(Cl)cc1F 917939934 WPNZCADKENFGRE-CYBMUJFWSA-N 486.887 5.087 5 20 JKBD CC1=C(C(=O)Nc2cc(C)on2)[C@H](c2ccc([N+](=O)[O-])cc2)NC(=S)N1c1cccc(C(C)C)c1 918135265 MNEQSCICZZBOQQ-QHCPKHFHSA-N 491.573 5.363 5 20 JKBD O=C(Nc1ccc(Cl)cc1NC(=O)c1ccco1)c1ccc(Br)c([N+](=O)[O-])c1 918648121 WNGKWLRRDGLVRA-UHFFFAOYSA-N 464.659 5.108 5 20 JKBD CC(C)[C@@H](OC(=O)c1ccc(N[C@@H](C)c2ccccn2)c([N+](=O)[O-])c1)C(=O)N(C)c1ccccc1 920543396 DQMZQWXUTMMHRR-MHECFPHRSA-N 476.533 5.007 5 20 JKBD CCSc1cccnc1C(=O)NC1(c2ccc(NC(=O)/C=C/c3ccc([N+](=O)[O-])o3)cc2)CCC1 1786207995 XWKLRXMDFLSHNZ-ZRDIBKRKSA-N 492.557 5.156 5 20 JKBD O=C(CCc1cccc([N+](=O)[O-])c1)Nc1ccc(C2(NC(=O)c3ccc4cnccc4c3)CCC2)cc1 1786600319 MVFFRIFLDAEWCG-UHFFFAOYSA-N 494.551 5.524 5 20 JKBD O=C(NC1(c2ccc(NC(=O)c3ccc(Cl)s3)cc2)CCC1)c1nc2cc([N+](=O)[O-])ccc2[nH]1 1787328075 CUTMZUGAEVYOSV-UHFFFAOYSA-N 495.948 5.248 5 20 JKBD COc1cc(C(=O)NC2(c3ccc(NC(=O)CCc4ccsc4)cc3)CCC2)ccc1[N+](=O)[O-] 1788188122 CIZQFLPWWCMCLS-UHFFFAOYSA-N 479.558 5.045 5 20 JKBD COc1cc(C(=O)NC2(c3ccc(NC(=O)c4ccc5ncccc5c4)cc3)CCC2)ccc1[N+](=O)[O-] 1788909564 USHRXKFUTTXRNF-UHFFFAOYSA-N 496.523 5.213 5 20 JKBD O=C(Cc1ccc(Cl)cc1[N+](=O)[O-])NC1(c2ccc(NC(=O)c3cnccc3Cl)cc2)CCC1 1789678452 PQCYWSAEKGFSED-UHFFFAOYSA-N 499.354 5.287 5 20 JKBD CC(C)(C)CCCCCC(=O)NC[C@H]1CCN(C(=O)c2ccc([N+](=O)[O-])cc2F)[C@H]1c1cccnc1 1812808746 IDNHUZPLZYSOLT-NLFFAJNJSA-N 498.599 5.445 5 20 JKBD Cc1cc(Cl)ccc1C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cc(F)cc([N+](=O)[O-])c2)[nH]n1 1814593343 JWVXFDSGAPRKKE-FQEVSTJZSA-N 485.903 5.039 5 20 JKBD CC(C)Cn1c(S[C@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2C(F)(F)F)nnc1-c1ccco1 9566955 ZWZNIGZFYBAFEB-GFCCVEGCSA-N 483.472 5.240 5 20 JKBD Cc1cc(C)cc(-c2nnc(S[C@@H](C)C(=O)Nc3nc(-c4cccc([N+](=O)[O-])c4)cs3)o2)c1 22236890 YXWPCYXSCXGYBY-AWEZNQCLSA-N 481.559 5.504 5 20 JKBD O=C(CCCn1c(=O)oc2cc([N+](=O)[O-])ccc21)N[C@H](c1ccc2c(c1)CCCC2)c1cccs1 24659319 DDTGLSIUSKGYKZ-RUZDIDTESA-N 491.569 5.129 5 20 JKBD C[C@@H](c1nnc(Sc2ccc(C(=O)c3ccccc3)cc2[N+](=O)[O-])n1-c1ccc(F)cc1)N(C)C 29001514 BEUXFOLWBAFIHD-INIZCTEOSA-N 491.548 5.319 5 20 JKBD CCNc1nc(S[C@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2C(F)(F)F)nc2ccccc12 31766452 HRHNNQFETRJKIF-LLVKDONJSA-N 465.457 5.108 5 20 JKBD O=C1CN(C(=O)c2ccc(NC(=O)c3cc4ccccc4c4cccnc34)cc2)c2ccccc2N1 302929092 FPGGLYRSNOOXPI-UHFFFAOYSA-N 472.504 5.239 5 20 JKBD O=C(C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)Nc1cccnc1-n1cccn1 484320320 VLPPZKFSUGKNSZ-OBGWFSINSA-N 482.525 5.355 5 20 JKBD O=C(Nc1ccc(NC(=O)[C@H]2CCCO2)cc1)c1ccc(NCc2ccccc2Cl)c([N+](=O)[O-])c1 502873143 UOTVBQYYEKMWNT-HSZRJFAPSA-N 494.935 5.230 5 20 JKBD CCN(C(=O)c1ccc([N+](=O)[O-])c(OC)c1)[C@@H]1CCSc2ccc(Br)cc21 504633863 IKLQCFNOBDFVTH-OAHLLOKOSA-N 451.342 5.065 5 20 JKBD CCOc1cc([N+](=O)[O-])c(C(=O)Nc2nc(-c3cccc(Br)c3)cs2)cc1OC 506766959 KBIODXBFUDMDPW-UHFFFAOYSA-N 478.324 5.140 5 20 JKBD O=C(CN[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1)Nc1cccc2ccccc12 507879736 LQXXVVWJSBXGKE-RUZDIDTESA-N 488.931 5.310 5 20 JKBD COc1cc(C(=O)Nc2ccc(-c3cnc(C4CC4)o3)cc2)c([N+](=O)[O-])cc1OCc1cscn1 512216276 ZJIPJHROVXREBQ-UHFFFAOYSA-N 492.513 5.424 5 20 JKBD O=C(Nc1ccc(Cl)cc1Cl)[C@H]1CCCCN1C(=O)c1cc2cc([N+](=O)[O-])ccc2o1 515282600 WRUAJIXXMXHTMM-QGZVFWFLSA-N 462.289 5.281 5 20 JKBD CS(=O)(=O)c1ccc(N[C@@H](c2ccccc2)c2ccc(Br)cc2F)c([N+](=O)[O-])c1 515554473 JEVIIODSNRBGOV-FQEVSTJZSA-N 479.327 5.101 5 20 JKBD CCC(CC)C(=O)N1CCC(NCc2ccc(-c3ccc([N+](=O)[O-])cc3Br)o2)CC1 517534610 WUYTXTHCSHWVMC-UHFFFAOYSA-N 478.387 5.134 5 20 JKBD COc1cc(C(=O)N2CCC(CN(C)C(C)C)CC2)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 520188210 DXYCVXNFHKJTRY-UHFFFAOYSA-N 475.973 5.242 5 20 JKBD COc1ccc(COCc2cccc(NC(=O)[C@H](C)Oc3ccc(Cl)cc3[N+](=O)[O-])c2)cc1 520674644 DMYMOEWXJQCHMC-INIZCTEOSA-N 470.909 5.380 5 20 JKBD O=[N+]([O-])c1ccc(-c2nn(-c3ccccc3)cc2CN[C@@H](c2ccccc2)[C@@H]2CCCO2)cc1 520962178 STOMYOIVCVTPHD-BDYUSTAISA-N 454.530 5.457 5 20 JKBD Cc1ccc(NC(=O)[C@@H](Sc2nnc(-c3ccc(Cl)cc3)o2)c2ccccc2)c([N+](=O)[O-])c1 588960005 WXAILICZAUWMDP-FQEVSTJZSA-N 480.933 6.079 5 20 JKBD O=C(NCc1ccc(Cn2ccnc2)cc1)c1cc([N+](=O)[O-])ccc1Sc1ccc(Cl)cc1 603558814 ULYZHPJWAZSXNL-UHFFFAOYSA-N 478.961 5.574 5 20 JKBD CC(=O)N(c1ccc(Cl)cc1)c1nc(/C=C/c2ccc3c([N+](=O)[O-])cccc3n2)cs1 603945578 IVDVCLXYMXICHS-BQYQJAHWSA-N 450.907 6.108 5 20 JKBD O=C(Cn1ccc([N+](=O)[O-])n1)Nc1nc(-c2ccccc2Cl)c(-c2ccccc2Cl)s1 603947125 JOPUXIUEMZZDGI-UHFFFAOYSA-N 474.329 5.527 5 20 JKBD O=C(c1c2c(nc3ccccc13)/C(=C\c1ccc([N+](=O)[O-])cc1)CCC2)N1CCC[C@@H](c2cc[nH]n2)C1 608813491 YEJUBKLOWPQTCY-OJLMNSMJSA-N 493.567 5.763 5 20 JKBD Cc1ccc(CNC(=O)c2cccc(CNCc3ccc(-c4ccccc4[N+](=O)[O-])o3)c2)cc1 608836275 YSYWFVZEBCAOOE-UHFFFAOYSA-N 455.514 5.383 5 20 JKBD O=C(OCc1nc(-c2ccc([N+](=O)[O-])cc2)no1)c1csc(-c2cccc(C(F)(F)F)c2)n1 725995621 HXOBOBFKRIKSNX-UHFFFAOYSA-N 476.392 5.144 5 20 JKBD Cc1cc(C(=O)N(Cc2nnc(-c3cccc([N+](=O)[O-])c3)o2)C(C)C)sc1-c1ccc(F)cc1 726499616 IKDHJWJZYNNLBF-UHFFFAOYSA-N 480.521 5.872 5 20 JKBD COc1ccc(-c2ccc(C(=O)O[C@@H](C)c3nnc(-c4ccc([N+](=O)[O-])cc4)o3)c(F)c2)c(F)c1 730635304 KGFVZUXPXXDYGB-ZDUSSCGKSA-N 481.411 5.517 5 20 JKBD O=C(c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1)N1CCC([C@@H](O)c2ccccc2)CC1 914538581 WVQYEBSKSOFJCY-DEOSSOPVSA-N 466.921 5.626 5 20 JKBD O=C(Nc1ccc(N2CCCCC2)c(Cl)c1)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-] 919851673 XXRHMYDANNJUFU-UHFFFAOYSA-N 457.836 5.432 5 20 JKBD O=C(OCC[C@@H]1CCCCN1C(=O)c1cnc(-c2ccccc2F)s1)c1cccc([N+](=O)[O-])c1 920291179 VXXRFRBNZGADTQ-KRWDZBQOSA-N 483.521 5.099 5 20 JKBD COc1ccc2c(c1)CCC[C@@H]2CC(=O)O[C@@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 920665185 WMHRWQYRMHQRGS-DZGCQCFKSA-N 480.439 5.003 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)[C@H]3C[C@@H]3C3CC3)CCC2)cc1)c1cccc([N+](=O)[O-])c1Br 1790636796 SDMLASFZWODYHT-MOPGFXCFSA-N 498.377 5.151 5 20 JKBD CCN(CC)[C@@H](C(=O)Nc1ccc(C2(NC(=O)c3ccc([N+](=O)[O-])o3)CCC2)cc1)c1ccccc1 1791127520 YOZLCCOHWNGDCB-XMMPIXPASA-N 490.560 5.019 5 20 JKBD O=C([C@@H]1CCC[C@H]2CCCC[C@@H]21)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)C1(c3cccc([N+](=O)[O-])c3)CCC1)C2 1797874188 JKIZXIZMJAJENE-HPWVNZJPSA-N 493.648 5.261 5 20 JKBD O=C(c1ccc([N+](=O)[O-])cc1F)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)C1(c3cccc(Cl)c3)CCCC1)C2 1800352802 YSNQXYCOVLOFJI-ACDBMABISA-N 499.970 5.151 5 20 JKBD Cc1c(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)c3sccc3F)[nH]n2)cc(Cl)cc1[N+](=O)[O-] 1821290071 MTWRMDKHDJRJIP-INIZCTEOSA-N 491.932 5.100 5 20 JKBD O=C(/C=C/c1ccccc1[N+](=O)[O-])Nc1cc([C@H]2CCCCN2C(=O)/C=C/C2CCCCC2)[nH]n1 1823504052 ZJNBIZXSUQBQMX-NXQKSZMYSA-N 477.565 5.160 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)N1CCC([C@H]2CCCCN2C(=O)c2sccc2Cl)CC1 1829448899 YDAVSWXXRCGYSA-LJQANCHMSA-N 493.988 5.304 5 20 JKBD Cc1c(C(=O)N2CCC([C@H]3CCCCN3C(=O)c3ccccc3)CC2)cc(Cl)cc1[N+](=O)[O-] 1829875482 BPMBLJPAUCQGSM-JOCHJYFZSA-N 469.969 5.104 5 20 JKBD COc1ccccc1NC(=O)c1cc2ccccc2cc1OS(=O)(=O)c1ccc(C)c([N+](=O)[O-])c1 15329497 MCSCQYIACNPTTF-UHFFFAOYSA-N 492.509 5.085 5 20 JKBD COc1ccc(-c2nc(C(=O)Oc3ccc(NC(=O)c4cccc([N+](=O)[O-])c4)cc3)cs2)cc1 15515705 SOWPTHJYLHBEHY-UHFFFAOYSA-N 475.482 5.198 5 20 JKBD O=C(Nc1ccccc1)Nc1cccc(NC(=O)c2ccc(Br)c([N+](=O)[O-])c2)c1 25092723 WXKRDNJYIUVPGJ-UHFFFAOYSA-N 455.268 5.254 5 20 JKBD O=C(OCc1nnc(-c2ccc([N+](=O)[O-])cc2)o1)c1ccc(COc2ccc3ccccc3c2)o1 25192555 VUYOZRCWPNBZLK-UHFFFAOYSA-N 471.425 5.327 5 20 JKBD C[C@@H](Nc1ccc(C(=O)NCc2ccnc(OC3CCCCC3)c2)cc1[N+](=O)[O-])c1ccccn1 60335260 ZTNDNBSSVMHCHA-GOSISDBHSA-N 475.549 5.199 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)N(C/C=C/c2ccccc2)c2ccc3c(c2)OCCO3)cc1SC 481989200 FRGAXUGYWFMBBB-RMKNXTFCSA-N 492.553 5.457 5 20 JKBD C[C@@H](Nc1ccc(C(=O)Nc2ccnn2-c2cccc(Cl)c2)cc1[N+](=O)[O-])c1ccccn1 485946261 UEUSMPMSPOCSIT-OAHLLOKOSA-N 462.897 5.254 5 20 JKBD Cc1ccc(C(=O)C2CCN(C(=O)c3ccc(NCc4ccccc4Cl)c([N+](=O)[O-])c3)CC2)cc1 490724490 WGZGXJJSIXKIEK-UHFFFAOYSA-N 491.975 5.904 5 20 JKBD COCCOc1ccc(C(F)(F)F)cc1NC(=O)c1csc(-c2ccc([N+](=O)[O-])cc2)n1 493637954 GVYXLYVDOBPCIV-UHFFFAOYSA-N 467.425 5.015 5 20 JKBD O=C(Nc1ccc(NC(=O)[C@H]2CCCO2)cc1)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1 503036942 YVESNIQNAARDAC-JOCHJYFZSA-N 481.892 5.410 5 20 JKBD C[C@H](Nc1ccc(C(=O)NCc2cccnc2Oc2cccc(F)c2)cc1[N+](=O)[O-])c1ccccn1 507048075 NPMFTZKKXSWUMC-KRWDZBQOSA-N 487.491 5.419 5 20 JKBD COc1ccc(CN[C@@H]2CCOc3c(Cl)cccc32)cc1OCc1ccc([N+](=O)[O-])cc1 507904653 QTADDVLLQPNWKG-OAQYLSRUSA-N 454.910 5.449 5 20 JKBD CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccc(I)cc1Cl 510051018 RLGDIHWDJGILKQ-UHFFFAOYSA-N 473.698 5.295 5 20 JKBD Cc1ccc([N+](=O)[O-])cc1NC(=O)CNc1ccc(Cl)cc1C(=O)N1[C@H](C)CCC[C@H]1C 515662800 JTLYBFOWCDYWHL-HZPDHXFCSA-N 458.946 5.010 5 20 JKBD CC(C)OCc1cccc(N[C@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2ccccc2)c1 516834600 CFCYVBWUONUSET-QHCPKHFHSA-N 453.926 5.965 5 20 JKBD Cc1cc(C(=O)N2CCCC[C@@H]2C)ccc1NC(=O)c1cc([N+](=O)[O-])ccc1Sc1ccccc1 519077462 GOAOOADFEJYGJP-IBGZPJMESA-N 489.597 6.321 5 20 JKBD CC(C)(C)OCc1cccc(CNC(=O)CSc2ccc(C(F)(F)F)cc2[N+](=O)[O-])c1 522398583 CNUIAPCTCSCFKZ-UHFFFAOYSA-N 456.486 5.337 5 20 JKBD O=C(Nc1ccc(Sc2nncs2)c(Cl)c1)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-] 524489482 WIVDRBGGNAUCJY-UHFFFAOYSA-N 490.872 5.444 5 20 JKBD COc1cc(C(=O)Nc2ccc(Oc3ccc(Br)cc3)cc2)c([N+](=O)[O-])cc1OC 603466698 RTLGRASSRJSFTM-UHFFFAOYSA-N 473.279 5.419 5 20 JKBD Cc1ccc(-c2nn(-c3ccccc3)cc2C(=O)Nc2cc([N+](=O)[O-])ccc2OC(F)F)o1 603639219 ZVDYWSODYYKUEH-UHFFFAOYSA-N 454.389 5.203 5 20 JKBD COc1cc([C@@H](C)NC(=O)c2cc(OCC(F)(F)F)ccc2[N+](=O)[O-])ccc1OC1CCCC1 603695261 BMKIGVOULRNGOY-CQSZACIVSA-N 482.455 5.357 5 20 JKBD C[C@H]1CCN(C(=O)c2ccc(-n3ccnc3)c([N+](=O)[O-])c2)c2cc(C(F)(F)F)ccc2S1 603961957 QPWFXBWRDKVWME-ZDUSSCGKSA-N 462.453 5.330 5 20 JKBD Cc1ccc(Sc2ccc(C(=O)N3C[C@H](C(F)(F)F)C[C@@H](C(F)(F)F)C3)cc2[N+](=O)[O-])cc1 604258213 VKCSPUMIROJMSM-HUUCEWRRSA-N 492.441 6.257 5 20 JKBD C[C@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)N[C@@H](C)c1cccc(NC(=O)Cc2ccccc2F)c1 604442237 BWHUFRSXIMGAES-HOTGVXAUSA-N 499.926 5.213 5 20 JKBD O=C(c1ccc(C(=O)N2CCC[C@@H]2C2CCCC2)c([N+](=O)[O-])c1)N1CCC[C@H]1C1CCCC1 609044633 NQKUNXYECOBPEL-XZOQPEGZSA-N 453.583 5.184 5 20 JKBD O=C(O[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1)c1ccc(C(F)F)cc1 726667016 ZQAXQCAAWXIDEO-IBGZPJMESA-N 460.820 5.723 5 20 JKBD O=C(O[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1)c1cc(F)c(Cl)nc1Cl 727522072 UNRWTMWTYYJJOD-MRXNPFEDSA-N 498.681 5.626 5 20 JKBD O=C(Oc1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2Cl)cc1)c1cnc(-c2ccco2)s1 728801005 PHKGECHNZKKQRO-UHFFFAOYSA-N 469.862 5.436 5 20 JKBD C[C@H](Nc1ccc(C(=O)Oc2ccc(NC(=O)c3ccsc3)cc2)cc1[N+](=O)[O-])c1ccccn1 728885196 QDFPVRXUQFJTCB-INIZCTEOSA-N 488.525 5.696 5 20 JKBD Cc1ccccc1Nc1nc(COC(=O)Cn2c3ccccc3c(=O)c3ccccc32)cs1 841974440 VGODYSAULWDGRW-UHFFFAOYSA-N 455.539 5.407 5 20 JKBD CC(C)Oc1cccc(CN[C@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Br)c2ccccc2)c1 917938936 PBFBBAIIMGNTFD-QHCPKHFHSA-N 498.377 5.614 5 20 JKBD CC(C)c1ccc(-c2nc(CC(=O)N(Cc3ccccc3[N+](=O)[O-])CC(F)(F)F)cs2)cc1 918613251 QGCQGEMRQQHRIV-UHFFFAOYSA-N 477.508 5.975 5 20 JKBD Cc1cc([N+](=O)[O-])ccc1NC(=O)COC(=O)[C@H](C)SCc1ncc(-c2ccc(Cl)cc2)o1 920672766 IZGNIAALAUZCJG-AWEZNQCLSA-N 489.937 5.015 5 20 JKBD CC(C)CC(=O)Nc1ccc(C2(NC(=O)c3cccc(Br)c3[N+](=O)[O-])CCC2)cc1 1787664260 DGHNFOZMPUOPFI-UHFFFAOYSA-N 474.355 5.151 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)c3cc(F)cc([N+](=O)[O-])c3)CCC2)cc1)c1ccc2occc2c1 1789049196 AWCVHVFCDYEBLQ-UHFFFAOYSA-N 473.460 5.542 5 20 JKBD O=C(NC1(c2ccc(NC(=O)c3n[nH]cc3[N+](=O)[O-])cc2)CCC1)c1cc2c(Cl)cccc2s1 1789689242 KPKXMSRPRGKMKF-UHFFFAOYSA-N 495.948 5.248 5 20 JKBD C[C@@H](C(=O)NC1(c2ccc(NC(=O)c3cc4cc([N+](=O)[O-])ccc4s3)cc2)CCC1)n1ccnc1 1791009910 CHFAPKJIFVNDMW-INIZCTEOSA-N 489.557 5.015 5 20 JKBD CC(C)(F)C(=O)NC1(c2ccc(NC(=O)c3cc4cc([N+](=O)[O-])ccc4s3)cc2)CCC1 1791010820 GCTNQMFIDRFFEH-UHFFFAOYSA-N 455.511 5.305 5 20 JKBD CC(C)(C)CCCCCC(=O)NC[C@H]1CCN(C(=O)c2cc(O)cc([N+](=O)[O-])c2)[C@H]1c1cccnc1 1812808794 JATGNCRLLFBOCV-NLFFAJNJSA-N 496.608 5.012 5 20 JKBD O=C(c1cc2cc([N+](=O)[O-])ccc2s1)N1CCC([C@@H]2CCCCN2C(=O)C2CCCCC2)CC1 1826282706 QXRDMVODSCRWAC-QFIPXVFZSA-N 483.634 5.623 5 20 JKBD C[C@@H](Sc1ccccc1)C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cc(F)cc([N+](=O)[O-])c2)CC1 1830612322 ANLDBDCLERQIGQ-KOSHJBKYSA-N 499.608 5.148 5 20 JKBD O=C(c1cccc2ccoc12)N1CCC([C@H]2CCCCN2C(=O)c2cccc(F)c2[N+](=O)[O-])CC1 1830621617 NKICBSPDHXRFBM-JOCHJYFZSA-N 479.508 5.027 5 20 JKBD O=C([C@@H]1CCC[C@H]2CCCC[C@@H]21)N1CC2(CCCN2C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)C1 1845739030 FAXIXCMLUNMZIG-JRGCBEDISA-N 481.618 5.233 5 20 JKBD Cc1ccc(-c2nnc(S[C@H](C)C(=O)Nc3nc(-c4cccc([N+](=O)[O-])c4)cs3)o2)cc1C 10842757 KIMJRKCWIRZMDM-CQSZACIVSA-N 481.559 5.504 5 20 JKBD O=[N+]([O-])c1cc(C(F)(F)F)ccc1Sc1nnc(-c2cccs2)n1C[C@H]1CCCO1 15130878 MLXIKKJVRGXKPZ-GFCCVEGCSA-N 456.471 5.264 5 20 JKBD CC(C)CCn1c(S[C@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)nc2cc(Cl)ccc2c1=O 17670481 GAMWDICHQXJMMI-CQSZACIVSA-N 499.980 5.908 5 20 JKBD C[C@H](Sc1nnc(-c2ccco2)n1C1CCCCC1)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 17709628 SZJOEWWYASQZQL-AWEZNQCLSA-N 466.523 5.855 5 20 JKBD CC[C@@H](C)Cc1c(C)sc2[nH]c(S[C@@H](C)c3nnc(-c4ccc([N+](=O)[O-])cc4)o3)nc(=O)c12 17952990 HDASPLCIQLFBAH-YPMHNXCESA-N 485.591 5.693 5 20 JKBD Cc1nc(-c2ccc(F)cc2)sc1C(=O)O[C@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl 18017824 GIDDUSLZJOULCQ-LLVKDONJSA-N 463.874 5.003 5 20 JKBD CSc1ccc(C(=O)O[C@H](C)C(=O)Nc2ccccc2Oc2ccccc2)cc1[N+](=O)[O-] 22161804 WOJLWWXDGXYVAK-OAHLLOKOSA-N 452.488 5.293 5 20 JKBD CC(=O)N(c1nc(CSc2nc3cc4ccccc4cc3c(=O)n2C)cs1)c1ccccc1F 24970131 FSKURQIWNVHJLZ-UHFFFAOYSA-N 490.585 5.659 5 20 JKBD CCOc1cc([N+](=O)[O-])c(C(=O)Nc2nc(-c3ccc(Br)s3)cs2)cc1OC 28257423 TXICEBLQMAWDMY-UHFFFAOYSA-N 484.353 5.202 5 20 JKBD CCc1cccc(C)c1NC(=O)COC(=O)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1 28931235 KPCJCHFXLNKWNG-UHFFFAOYSA-N 468.893 5.707 5 20 JKBD O=[N+]([O-])c1ccc(-c2noc(CSc3nnc(COc4ccccc4Cl)n3C3CC3)n2)cc1 107673228 PZLYNWQYPBCYSD-UHFFFAOYSA-N 484.925 5.096 5 20 JKBD CSCC[C@@H](NC(=O)c1ccc([N+](=O)[O-])o1)C(=O)Nc1ccc(-c2cc3ccccc3o2)cc1 497192149 VQBYVPVEGYNPOR-GOSISDBHSA-N 479.514 5.091 5 20 JKBD CCCN(C(=O)CSc1ccc(C(N)=O)cc1[N+](=O)[O-])[C@H](C)c1ccc(Cl)c(Cl)c1 502821593 HEZLBKLUMPGUDP-GFCCVEGCSA-N 470.378 5.092 5 20 JKBD C[C@H](Nc1ccc(C(=O)NCCOc2ccc3ccccc3c2)cc1[N+](=O)[O-])c1ccccn1 506084413 BBJORJAJKAXSNY-SFHVURJKSA-N 456.502 5.125 5 20 JKBD CC(=O)Nc1ccc(Br)cc1NC(=O)c1ccc(Nc2ccccc2)c([N+](=O)[O-])c1 506238080 LKJIZGUCWMULNZ-UHFFFAOYSA-N 469.295 5.312 5 20 JKBD Cc1cccc(C)c1Oc1ccccc1NC(=O)c1ccc(Sc2nncn2C)c([N+](=O)[O-])c1 509768516 XYAYCGCAELLGML-UHFFFAOYSA-N 475.530 5.536 5 20 JKBD COCCN(C(=O)[C@@H](C)Sc1ccccc1Cl)c1nc(-c2ccc([N+](=O)[O-])cc2)cs1 515438161 SHVHVAQQXFOZOY-CQSZACIVSA-N 477.995 5.532 5 20 JKBD COc1cc(C(=O)Nc2cc(C(C)(C)C)nn2-c2cccc(Cl)c2)c([N+](=O)[O-])cc1OC(F)F 516112449 GPHSGAIFUSUKEU-UHFFFAOYSA-N 494.882 5.594 5 20 JKBD CCC(CC)(CNC(=O)CNC(=O)c1c(Cl)cccc1[N+](=O)[O-])c1ccc(Cl)c(Cl)c1 520821526 JLPKSYBTPMBZKN-UHFFFAOYSA-N 486.783 5.159 5 20 JKBD O=C(c1oc2ccccc2c1CSc1ccccc1F)N1CCN(c2ccc([N+](=O)[O-])nc2)CC1 521382031 TYMANIUHDOJGGN-UHFFFAOYSA-N 492.532 5.130 5 20 JKBD COc1cc(C(=O)Nc2ccc3oc(CC(C)(C)C)nc3c2)c([N+](=O)[O-])cc1OCc1cscn1 521770694 GRMVBQHSKUGPQN-UHFFFAOYSA-N 496.545 5.621 5 20 JKBD CNS(=O)(=O)c1ccc([C@@H](C)NCc2ccc(Oc3cc(C)ccc3C(C)C)c([N+](=O)[O-])c2)cc1 521814038 QTAOQVFYOOJNSH-LJQANCHMSA-N 497.617 5.578 5 20 JKBD C[C@@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)Nc1ccc(Sc2nncs2)c(Cl)c1 524490803 ZCDYQBDHXIKYJD-SECBINFHSA-N 471.347 5.310 5 20 JKBD COc1c(-c2cccc([N+](=O)[O-])c2)nc2sc3c(c2c1-c1ccc(C)cc1)CCN(C(C)=O)C3 541585537 BVQXLKUJKFUYTC-UHFFFAOYSA-N 473.554 5.760 5 20 JKBD O=C(Nc1cccc(-c2nn[nH]n2)c1)c1ccccc1Sc1ccc(C(F)(F)F)cc1[N+](=O)[O-] 559379184 XAYWNZFJHPVHLF-UHFFFAOYSA-N 486.435 5.197 5 20 JKBD CCOC(=O)c1csc(NC(=O)c2cc([N+](=O)[O-])ccc2Sc2ccc(Cl)cc2)n1 600844128 DQNYBJKHKOALIQ-UHFFFAOYSA-N 463.924 5.285 5 20 JKBD COc1ccc(CSCC(=O)NC[C@@H](c2ccccc2)c2c[nH]c3ccccc23)cc1[N+](=O)[O-] 603563558 UGWQDTDZVIADBR-NRFANRHFSA-N 475.570 5.266 5 20 JKBD O=C(Nc1ccc(Cl)c(-c2nnc3n2CCCCC3)c1)c1cc2cc([N+](=O)[O-])ccc2o1 603737147 BQYZHFHXNVSOLU-UHFFFAOYSA-N 451.870 5.232 5 20 JKBD COc1cccc([C@@H](CNC(=O)c2cc3cc([N+](=O)[O-])ccc3o2)c2c[nH]c3ccccc23)c1OC 603780882 PZKFZPDYVGDWMZ-OAQYLSRUSA-N 485.496 5.401 5 20 JKBD CCN(Cc1ccccc1)C(=O)c1cc(NC(=O)c2cc([N+](=O)[O-])ccc2OC)ccc1Cl 603989405 GWBIKKDZRXXQIF-UHFFFAOYSA-N 467.909 5.171 5 20 JKBD CCCN(CC(F)(F)F)C(=O)C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1 604243661 DAZNIMNIAGCGSP-FOWTUZBSSA-N 463.481 5.936 5 20 JKBD Cc1nnnn1-c1cc(NC(=O)c2cc([N+](=O)[O-])ccc2Sc2ccc(Cl)cc2)ccc1F 609034074 UPYGTWRHCNXSKU-UHFFFAOYSA-N 484.900 5.075 5 20 JKBD CCc1cc(N2CCC(c3nc(-c4ccccc4)no3)CC2)nc(-c2ccc([N+](=O)[O-])cc2)n1 609143707 PEKWRRGWFHOHPR-UHFFFAOYSA-N 456.506 5.048 5 20 JKBD COc1ccc(OCc2nnc(Sc3ccc(C(C)=O)cc3[N+](=O)[O-])n2-c2ccccc2F)cc1 619674737 LVTSBAUVTQEPDT-UHFFFAOYSA-N 494.504 5.256 5 20 JKBD CC(C)c1cccc(C(C)C)c1NC(=O)COC(=O)c1cc([N+](=O)[O-])ccc1Br 725985262 PKXXZVAQFNYUOU-UHFFFAOYSA-N 463.328 5.400 5 20 JKBD C[C@@H](OC(=O)c1cc([N+](=O)[O-])ccc1Br)c1nc(-c2cccc(C(F)(F)F)c2)no1 725985463 KGVBJBWIPDYFTF-SECBINFHSA-N 486.200 5.344 5 20 JKBD CC(C)(C)c1nc(C(=O)O[C@@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2ccccc2)cs1 726687045 RTXQSEIXGDVQCA-GOSISDBHSA-N 473.938 5.539 5 20 JKBD CC(=O)N(c1nc(COC(=O)Cn2ccc3cc([N+](=O)[O-])ccc32)cs1)c1cccc(C)c1C 728337149 RZVMQGDFIQRTFS-UHFFFAOYSA-N 478.530 5.051 5 20 JKBD CC(C)Sc1ccc([C@H](C)NC(=O)c2cc([N+](=O)[O-])ccc2I)cc1 728832246 IVXSBKHDVTWGQL-LBPRGKRZSA-N 470.332 5.191 5 20 JKBD Cc1c([N+](=O)[O-])cc(C(=O)Nc2cccc(NC(=O)c3cccc(C(F)(F)F)c3)c2)cc1[N+](=O)[O-] 728848603 MFZABEBGOWLOPM-UHFFFAOYSA-N 488.378 5.335 5 20 JKBD CC(C)c1ncc(Cl)c(C(=O)O[C@@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2ccccc2)n1 744675673 LNRJURZQJPRPJC-LJQANCHMSA-N 489.315 5.352 5 20 JKBD COc1cc([C@H](C)NC(=O)c2cc([N+](=O)[O-])ccc2Br)ccc1OCCC(C)C 751089897 BWQUIGNTZQMJQC-AWEZNQCLSA-N 465.344 5.282 5 20 JKBD COc1ccc(/C=C2/N=C(SCc3ccccc3[N+](=O)[O-])N(c3cccc(OC)c3)C2=O)cc1 780729775 FSQNNVRGBZEDQH-HYARGMPZSA-N 475.526 5.289 5 20 JKBD CN(Cc1cc([N+](=O)[O-])ccc1Cl)C(=O)c1ccccc1SCC(=O)N1CCc2ccccc21 812211224 VADPUFAVZHCMEC-UHFFFAOYSA-N 495.988 5.202 5 20 JKBD Cc1ccc(NC(=O)[C@@H](OC(=O)/C=C\c2nc3ccccc3s2)c2ccccc2)c([N+](=O)[O-])c1 849190033 VEYJZRGFWOFZSH-XWDDPXMASA-N 473.510 5.449 5 20 JKBD C[C@@H](OC(=O)c1sc(-c2ccco2)nc1-c1ccccc1)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 900284725 UWICDGFKVZPAMG-CQSZACIVSA-N 488.481 5.946 5 20 JKBD CN(Cc1ccc(F)c(F)c1)C(=O)c1ccccc1NC(=O)c1ccc([N+](=O)[O-])cc1Cl 912753163 RTYLDVCFXJQIDL-UHFFFAOYSA-N 459.836 5.051 5 20 JKBD COc1cc(/C=C/C(=O)Nc2cc([N+](=O)[O-])ccc2OC(F)F)ccc1OCc1c(C)noc1C 915283558 SYPBWYHGDHMUBL-WEVVVXLNSA-N 489.431 5.041 5 20 JKBD COc1ccc(Oc2ccc([N+](=O)[O-])cc2C(=O)O[C@H](C)C(=O)Nc2c(C)cccc2C(C)C)cc1 915442659 ONORYSXFSBAZBF-GOSISDBHSA-N 492.528 6.012 5 20 JKBD O=C(Nc1ccc(C(=O)Nc2cc([N+](=O)[O-])ccc2F)cc1)c1cccc(Br)c1 918554727 XGSMXVYYCPPQMO-UHFFFAOYSA-N 458.243 5.001 5 20 JKBD CN(Cc1cc([N+](=O)[O-])ccc1Cl)C(=O)Cc1ccc(NC(=O)c2cc3ccccc3o2)cc1 919812341 HIGANHCIIOKGQK-UHFFFAOYSA-N 477.904 5.448 5 20 JKBD O=C(/C=C/c1ccc([N+](=O)[O-])o1)Nc1ccc(C2(NC(=O)Cc3ccc(Cl)cc3)CCC2)cc1 1786206575 TWWBVPMVTAQQBJ-ZRDIBKRKSA-N 479.920 5.231 5 20 JKBD Cc1cnc(Cl)c(C(=O)NC2(c3ccc(NC(=O)/C=C/c4ccc([N+](=O)[O-])o4)cc3)CCC2)c1 1786206627 XFEYJOHGYRRTOA-VQHVLOKHSA-N 480.908 5.006 5 20 JKBD O=C(CSc1ccccc1)Nc1ccc(C2(NC(=O)c3cc(F)cc([N+](=O)[O-])c3)CCC2)cc1 1787774836 OXANAXIOWKEGCX-UHFFFAOYSA-N 479.533 5.274 5 20 JKBD O=C(Cc1ccc(Cl)cc1[N+](=O)[O-])Nc1cc([C@@H]2CCCCN2C(=O)CCC2CCCC2)[nH]n1 1814844339 DEHMZECWYBIVIO-FQEVSTJZSA-N 487.988 5.177 5 20 JKBD O=C(c1cccc2ccoc12)N1CCC([C@@H]2CCCCN2C(=O)CCc2cccc([N+](=O)[O-])c2)CC1 1824843129 OTCQXLUGSYUECS-VWLOTQADSA-N 489.572 5.207 5 20 JKBD Cc1ccc(CC(=O)N2CCC([C@H]3CCCCN3C(=O)c3sccc3Cl)CC2)cc1[N+](=O)[O-] 1829447418 XCPGGEQMFQMJKH-HXUWFJFHSA-N 490.025 5.094 5 20 JKBD Cc1c(C(=O)N2CCCC[C@H]2C2CCN(C(=O)[C@@H]3CCC(F)(F)C3)CC2)cc(Cl)cc1[N+](=O)[O-] 1830734247 GQTHLNRPOGBSOQ-XLIONFOSSA-N 497.970 5.225 5 20 JKBD CC[C@H]1CC[C@H](C(=O)N2CCCC[C@H]2C2CCN(C(=O)/C=C/c3ccc([N+](=O)[O-])o3)CC2)CC1 1831691815 PQASKFYHZHIBSF-QHXBOCPTSA-N 471.598 5.037 5 20 JKBD Cc1cccc(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3ccc([N+](=O)[O-])cc3F)CC2)c1Cl 1832602783 FCFGWXWFUGNPBD-JOCHJYFZSA-N 487.959 5.243 5 20 JKBD O=C(c1cc2cc([N+](=O)[O-])ccc2s1)N1CC2(CCCN2C(=O)C2(c3cccc(Cl)c3)CC2)C1 1843817236 LNTKBVWPVDBAPK-UHFFFAOYSA-N 495.988 5.012 5 20 JKBD Cc1ccsc1C(=O)O[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Br)c1ccccc1 10647314 RXAFQLZBJZLHFG-QGZVFWFLSA-N 475.320 5.264 5 20 JKBD Cc1ccc(Sc2ccc(C(=O)N(C)CC(=O)Nc3c(C)cccc3C)cc2[N+](=O)[O-])cc1 15473977 PFACMCQNDOTLQU-UHFFFAOYSA-N 463.559 5.382 5 20 JKBD C[C@H](OC(=O)c1ccccc1C(=O)c1ccc(Cl)c([N+](=O)[O-])c1)C(=O)Nc1ccccc1Cl 15710197 OMDUERREXBRYPA-ZDUSSCGKSA-N 487.295 5.317 5 20 JKBD O=C(COc1ccc([N+](=O)[O-])cc1-c1cccs1)Nc1ccc(Br)cc1F 16324868 BCGRYKHDVXOMAH-UHFFFAOYSA-N 451.273 5.242 5 20 JKBD C[C@H](Sc1nnc([C@@H](C)N(C)C)n1-c1ccc(Cl)cc1)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 17718186 JWNHPENHHMQIIO-KGLIPLIRSA-N 499.984 5.355 5 20 JKBD C[C@@H](Sc1nnc(-c2ccc(Cl)cc2)n1Cc1ccco1)C(=O)Nc1ccccc1[N+](=O)[O-] 21743927 OYMINGZGQBMTQJ-CQSZACIVSA-N 483.937 5.267 5 20 JKBD CCN(CC)C(=O)c1cccc(NC(=O)c2ccccc2C(=O)c2ccc(SC)c([N+](=O)[O-])c2)c1 25712562 USJMVXZLKJHIRJ-UHFFFAOYSA-N 491.569 5.282 5 20 JKBD O=C(Cc1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1)Nc1ccccc1OC(F)(F)F 27825292 CYXMZEBKBJGBPS-UHFFFAOYSA-N 482.418 5.527 5 20 JKBD O=[N+]([O-])c1ccccc1CSc1nnc(-c2cccnc2)n1-c1ccc(Br)cc1 32570880 QMZOLBYLDPHRCD-UHFFFAOYSA-N 468.336 5.292 5 20 JKBD Cc1ccc(C)c(-c2nn(CN(Cc3ccccc3[N+](=O)[O-])CC(F)(F)F)c(=O)c3ccccc23)c1 71966606 RURWMPUVXDVROZ-UHFFFAOYSA-N 496.489 5.611 5 20 JKBD COc1ccc(CSCC(=O)N[C@@H](c2ccc(Cl)cc2)c2cccs2)cc1[N+](=O)[O-] 107959322 ASYARSZELMSPGS-NRFANRHFSA-N 462.980 5.457 5 20 JKBD C[C@@H](Nc1ccc(C(=O)c2nccn2C)cc1[N+](=O)[O-])c1ccc(NC(=O)c2ccc(F)cc2)cc1 109306732 XHXMUJLWAIALDP-MRXNPFEDSA-N 487.491 5.124 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)Nc2cc(-c3cccc(C)c3)nn2Cc2ccccc2)cc1SC 482521272 XLXARBGPSFMGFI-UHFFFAOYSA-N 488.569 5.798 5 20 JKBD O=C(CSc1ccc(C(F)(F)F)cc1[N+](=O)[O-])NCc1ccnc(Oc2ccc(F)cc2)c1 503299710 AJRAUDARGMXTIJ-UHFFFAOYSA-N 481.427 5.349 5 20 JKBD CCc1cc(Sc2nnc([C@H](C)N(C)C)n2-c2ccc(F)cc2)nc(-c2ccc([N+](=O)[O-])cc2)n1 507133283 VMGJIIOZPHJTAW-HNNXBMFYSA-N 493.568 5.108 5 20 JKBD O=C(Nc1ccc(Cl)cc1Cl)[C@@H]1CCCCN1C(=O)c1cc2cccc([N+](=O)[O-])c2[nH]1 507359687 QBZASMSVEAMGNA-SFHVURJKSA-N 461.305 5.016 5 20 JKBD CCOc1cc([N+](=O)[O-])c(C(=O)Nc2ccc(Sc3nc(C)cs3)cc2C)cc1OC 508511892 OLNFZFUUXRNWST-UHFFFAOYSA-N 459.549 5.479 5 20 JKBD O=C(c1ccc(-n2cncn2)c([N+](=O)[O-])c1)N(Cc1ccc(-c2ccccc2C(F)(F)F)o1)C1CC1 510021977 XSHGAWREJOUUFB-UHFFFAOYSA-N 497.433 5.259 5 20 JKBD O=C(C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)Nc1ccccc1N1CCCC1=O 512345993 JYGFTFTZMSZXLG-KNTRCKAVSA-N 498.564 5.901 5 20 JKBD CN(c1ccccc1)c1ccc(CNCc2ccc(OCc3ccccn3)cc2)cc1[N+](=O)[O-] 513061231 JCKJVHHAGGYJFV-UHFFFAOYSA-N 454.530 5.627 5 20 JKBD O=C(Nc1sc2c(c1-c1nc3ccccc3[nH]1)CCCC2)c1ccn(-c2cccc([N+](=O)[O-])c2)n1 516072452 NOMCKWIAZJAGEG-UHFFFAOYSA-N 484.541 5.516 5 20 JKBD CC(=O)Nc1cccc([C@H](C)N(Cc2ccccc2)C(=O)[C@H](C)Oc2ccc(Cl)cc2[N+](=O)[O-])c1 518878500 GXMGQTVAMUYTKD-ROUUACIJSA-N 495.963 5.764 5 20 JKBD COc1ccc(COCc2cccc(NC(=O)c3ccc(N4CCCC4)c([N+](=O)[O-])c3)c2)cc1 520006142 LXYHVURZODSUNN-UHFFFAOYSA-N 461.518 5.173 5 20 JKBD Cc1nc([N+](=O)[O-])cn1CC(=O)N(Cc1ccc(F)cc1)c1nc(-c2ccccc2Cl)cs1 520961141 BUIZAXFKUJDVFM-UHFFFAOYSA-N 485.928 5.249 5 20 JKBD Cc1ccc(Cl)cc1N1CC[C@H](CNC(=O)c2ccc(N[C@H](C)c3ccccn3)c([N+](=O)[O-])c2)C1 523267222 NKXJPXGQBJRNTH-RTBURBONSA-N 493.995 5.381 5 20 JKBD COCCOc1ncccc1NC(=O)C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1 524421739 IDNJDTKBPLERIZ-OBGWFSINSA-N 490.541 5.194 5 20 JKBD COc1cc(CCNC(=O)c2sc3cccc(Cl)c3c2Cl)c([N+](=O)[O-])cc1OC 603485384 KYWWJVXZBATHHW-UHFFFAOYSA-N 455.319 5.106 5 20 JKBD Cc1noc(-c2ccc(C)c(NC(=O)c3ccc(NCc4ccccc4Cl)c([N+](=O)[O-])c3)c2)n1 603987723 RGQHUNXLLCJVQO-UHFFFAOYSA-N 477.908 5.779 5 20 JKBD C[C@H](NC(=O)N(CCO)Cc1cccc(OCc2ccccc2Cl)c1)c1cccc([N+](=O)[O-])c1 604126145 JNGIAKPONWTOTB-SFHVURJKSA-N 483.952 5.092 5 20 JKBD Cc1nnc(SCc2c(C(=O)Nc3cc(-c4cccc([N+](=O)[O-])c4)[nH]n3)oc3ccccc23)s1 609202058 GRAJMRGPIXPUQF-UHFFFAOYSA-N 492.542 5.436 5 20 JKBD O=C(CCC(=O)N1CCC(NC(=O)C2CCCCC2)CC1)c1ccc2ccc3cccc4ccc1c2c34 727756829 GMQJTJZGCVOSAF-UHFFFAOYSA-N 494.635 6.234 5 20 JKBD COc1cc(C(=O)O[C@@H](C)c2cnc3ccccc3c2)c([N+](=O)[O-])cc1OCc1cscn1 747354693 MQLKNJUFZRYVLB-AWEZNQCLSA-N 465.487 5.105 5 20 JKBD CCCOc1ccc(-c2nc(C(=O)O[C@@H](C)C(=O)Nc3cc([N+](=O)[O-])ccc3Cl)cs2)cc1 750274854 IOPXZCCQEOIOEG-ZDUSSCGKSA-N 489.937 5.345 5 20 JKBD O=C(Nc1ccc2nc(Cc3ccccc3F)[nH]c2c1)c1cc([N+](=O)[O-])ccc1Br 751109496 RONAURLGQVZPLH-UHFFFAOYSA-N 469.270 5.216 5 20 JKBD CC(=O)N(c1nc(COC(=O)c2c[nH]c3cc([N+](=O)[O-])ccc23)cs1)c1c(C)cc(C)cc1C 756768458 OAGDYRHRRHRRMY-UHFFFAOYSA-N 478.530 5.499 5 20 JKBD O=C(C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)OCc1nc(-c2ccco2)no1 899217502 GIGUYICRSLSDLQ-VBKFSLOCSA-N 488.481 5.522 5 20 JKBD Cc1ccc(-n2c(S[C@H](C)C(=O)Nc3ccc(F)c([N+](=O)[O-])c3)nnc2-c2ccccn2)c(C)c1 917255658 CEHMURNWNCISFT-MRXNPFEDSA-N 492.536 5.113 5 20 JKBD CCCCn1c(-c2ccc(Cl)cc2)nn(CCC(=O)N[C@@H](C)c2cccc([N+](=O)[O-])c2)c1=S 917701432 TVCMMGGLEUGMFR-INIZCTEOSA-N 488.013 5.710 5 20 JKBD Cc1ccccc1-n1c(-c2ccncc2)nn(CN(Cc2ccc([N+](=O)[O-])cc2)C(C)C)c1=S 919950696 PRBNLFUERCUXHD-UHFFFAOYSA-N 474.590 5.550 5 20 JKBD Nc1ccc(C(=O)O[C@@H](C(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)c2ccccc2)c(Cl)c1 920542028 WOLVHACNNOOUQB-LJQANCHMSA-N 460.273 5.021 5 20 JKBD C[C@H](OC(=O)c1ccc(N[C@H](C)c2ccccn2)c([N+](=O)[O-])c1)c1nnc(-c2cccs2)o1 920545238 HOCNLLKNHWUXAK-KGLIPLIRSA-N 465.491 5.192 5 20 JKBD O=C(CCc1cccc([N+](=O)[O-])c1)Nc1ccc(C2(NC(=O)CCCC(F)(F)F)CCC2)cc1 1786599109 LMISOZYKADKYLK-UHFFFAOYSA-N 477.483 5.394 5 20 JKBD O=C(/C=C/c1ccccc1[N+](=O)[O-])NC1(c2ccc(NC(=O)c3cnc4ccoc4c3)cc2)CCC1 1788486992 KAWBYYXWVMJWMF-IZZDOVSWSA-N 482.496 5.197 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)c3cc([N+](=O)[O-])cc4c3OCC4)CCC2)cc1)c1ccc2cc[nH]c2c1 1788914621 PPLWVACMNNGBDZ-UHFFFAOYSA-N 496.523 5.073 5 20 JKBD O=C(NC1(c2ccc(NC(=O)c3ncccc3F)cc2)CCC1)c1cc2cc([N+](=O)[O-])ccc2s1 1789911313 WHQRNMISIPOYEU-UHFFFAOYSA-N 490.516 5.405 5 20 JKBD COc1cc(C(=O)Nc2ccc(C3(NC(=O)C4(C(C)C)CCC4)CCC3)cc2)cc([N+](=O)[O-])c1OC 1790813116 RXGXJDNZMPBHFC-UHFFFAOYSA-N 495.576 5.186 5 20 JKBD CSc1ccc(CC(=O)Nc2ccc(C3(NC(=O)c4ccc(O)c([N+](=O)[O-])c4)CCC3)cc2)cc1 1791735810 DOUPSGGLPRDDFB-UHFFFAOYSA-N 491.569 5.013 5 20 JKBD Cc1cc(O)c([N+](=O)[O-])cc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1sc3ccccc3c1Cl)C2 1800803167 XIQIHJNXDXVLGQ-QDMKHBRRSA-N 499.976 5.043 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)N1CCC2(CCCN(C(=O)CCCc3ccccc3F)C2)CC1 1805498200 ZVADVYBKZOIZHY-UHFFFAOYSA-N 499.558 5.049 5 20 JKBD CC(C)(C)c1ccc(C(=O)N2CCCC[C@H]2c2cc(NC(=O)c3ccc(O)c([N+](=O)[O-])c3)n[nH]2)s1 1821046299 ZTPBDIKXHLFUSE-INIZCTEOSA-N 497.577 5.002 5 20 JKBD CC(C)(C)CC(=O)N1CCCC[C@H]1C1CCN(C(=O)C2(c3cccc([N+](=O)[O-])c3)CCC2)CC1 1826334823 MALSGESUGBNXLP-QHCPKHFHSA-N 469.626 5.072 5 20 JKBD Cc1cccc(Cl)c1C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cc(F)cc([N+](=O)[O-])c2)CC1 1830595555 HJVFKTUTFHCMDE-QFIPXVFZSA-N 487.959 5.243 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)N1CCCC12CN(C(=O)c1sc3ccccc3c1Cl)C2 1845493252 SFVHTHSWMYRNNS-UHFFFAOYSA-N 487.940 5.041 5 20 JKBD CCn1c(S[C@@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2C(F)(F)F)nnc1-c1ccccc1 9485123 MCEDBVUTENGKRQ-LBPRGKRZSA-N 465.457 5.011 5 20 JKBD C[C@H](OC(=O)c1ccccc1COc1ccccc1)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl 10851755 ASNQVZVYVUVIQD-HNNXBMFYSA-N 454.866 5.011 5 20 JKBD O=C(COC(=O)c1ccccc1C(=O)c1ccc(Cl)c([N+](=O)[O-])c1)Nc1cc(Cl)ccc1F 11029132 PXJOICHEVJCEFH-UHFFFAOYSA-N 491.258 5.067 5 20 JKBD C[C@@H](OC(=O)Cc1ccc(Cl)c(Cl)c1)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 11121282 XATRACKDIYLYDW-SECBINFHSA-N 465.211 5.033 5 20 JKBD O=C(c1cccc([N+](=O)[O-])c1)N(C[C@H]1CCCO1)c1nc(-c2ccc(Br)cc2)cs1 14819584 RBZOXBUVCLWBFV-GOSISDBHSA-N 488.363 5.307 5 20 JKBD COc1cc(C(=O)O[C@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)ccc1OCc1ccccc1 17536259 AJZNGELAFASWQJ-MRXNPFEDSA-N 475.457 5.150 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Cl)[C@@H](NCc1cccc(C(F)(F)F)c1)c1ccccc1 21820182 QMBMGEBWTBDGFG-FQEVSTJZSA-N 463.843 5.737 5 20 JKBD Cc1cc(C(=O)N2CCC[C@H]2C(=O)Nc2ccc(NCc3ccccc3)c(Cl)c2)ccc1[N+](=O)[O-] 72083469 NGSXZPDYPFZALN-DEOSSOPVSA-N 492.963 5.412 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)N[C@H](c2ccc(C(C)C)cc2)c2cccs2)cc1SC 112530066 ILAIVQUDZOVPOL-JOCHJYFZSA-N 456.589 6.030 5 20 JKBD CCC(C)(C)NC(=O)c1ccc(NC(=O)c2ccc(N3CCC[C@@H](C)C3)c([N+](=O)[O-])c2)cc1 117545414 XEBHXUQWHNCBHN-QGZVFWFLSA-N 452.555 5.002 5 20 JKBD O=C(Cn1c(=O)oc2cc([N+](=O)[O-])ccc21)N(Cc1ccc(Cl)cc1)c1ccccc1Cl 195534088 LYEPAXYQXYUGCK-UHFFFAOYSA-N 472.284 5.043 5 20 JKBD O=C(CSc1nnc(-c2ccc(Br)o2)n1Cc1ccccc1)c1cccc([N+](=O)[O-])c1 216805538 QRJKRMGXJWXPEJ-UHFFFAOYSA-N 499.346 5.232 5 20 JKBD CC(=O)Nc1cccc([C@@H](C)N(Cc2ccccc2)C(=O)c2cnn(-c3ccc([N+](=O)[O-])cc3)c2)c1 302938958 KNNUMNJYZKUJTH-LJQANCHMSA-N 483.528 5.143 5 20 JKBD COCCN(C(=O)C[C@@H](c1ccccc1)C(F)(F)F)c1nc(-c2ccc([N+](=O)[O-])cc2)cs1 482290784 CTQFMWXPPLKKHP-SFHVURJKSA-N 479.480 5.434 5 20 JKBD O=C(NC1CCN(c2nc3ccccc3s2)CC1)c1ccc(NCc2ccccc2)c([N+](=O)[O-])c1 489976777 AGPQTLQVNGATOM-UHFFFAOYSA-N 487.585 5.215 5 20 JKBD CC[C@@H](C)Sc1ccc(NC(=O)c2ccn(-c3cccc([N+](=O)[O-])c3)n2)c(C(F)(F)F)c1 499556593 SGZZEBQRLGVTKW-CYBMUJFWSA-N 464.469 5.942 5 20 JKBD CCC(=O)N[C@H]1CCCN(C(=O)c2c3c(nc4ccccc24)/C(=C/c2cccc([N+](=O)[O-])c2)CCC3)C1 499568441 BPTHAFULPYGFQM-UZLGTAQGSA-N 498.583 5.151 5 20 JKBD CC(=O)N(C)C1CCN(C(=O)c2c3c(nc4ccccc24)/C(=C\c2cccc([N+](=O)[O-])c2)CCC3)CC1 500031408 SBPGSSGOORSZGY-FXBPSFAMSA-N 498.583 5.103 5 20 JKBD Cc1nc(-c2ccccc2)sc1[C@@H](C)NC(=O)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-] 501628765 NYMXJIVVTFWNCL-GFCCVEGCSA-N 465.453 5.459 5 20 JKBD C[C@@H](NCc1ccc(Oc2ccccc2Cl)c([N+](=O)[O-])c1)c1ccc(NC(=O)C2CC2)cc1 509572097 VQLDFZUHPSFPNW-MRXNPFEDSA-N 465.937 6.240 5 20 JKBD O=C(Nc1ccc(Cc2nc3ccccc3s2)cc1)c1cnn(-c2ccc([N+](=O)[O-])cc2)c1 512178554 VFDWARXBXVLFKR-UHFFFAOYSA-N 455.499 5.233 5 20 JKBD Cc1nn(C)c(C(=O)N2C[C@H](c3ccccc3Cl)c3c([nH]c4ccccc34)[C@@H]2C)c1[N+](=O)[O-] 512291912 DUOKABIYALADEN-WMLDXEAASA-N 463.925 5.120 5 20 JKBD Cc1cc(Br)ccc1NC(=O)CN(C)C(=O)c1cc([N+](=O)[O-])ccc1Oc1ccccc1 515284975 WANRRKXXFMZIDR-UHFFFAOYSA-N 498.333 5.169 5 20 JKBD C[C@H](NC(=O)c1ccc(NC(=O)c2cccc(Br)c2)cc1)c1cccc([N+](=O)[O-])c1 517099347 NGZQAUYYLXYGSD-AWEZNQCLSA-N 468.307 5.101 5 20 JKBD CCOc1cc(NC(=O)N(C)[C@H](C)c2ccc(C(F)(F)F)cc2)c([N+](=O)[O-])cc1OCC 519906169 LWZIRMUJVWXBIU-CYBMUJFWSA-N 455.433 5.636 5 20 JKBD O=C(Nc1ccccc1)c1ccc(NC(=O)c2cc(OCC(F)(F)F)ccc2[N+](=O)[O-])cc1 520078960 ARTHPXIIXZMCIS-UHFFFAOYSA-N 459.380 5.041 5 20 JKBD C[C@@H](c1ccccn1)N(C)C(=O)C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1 520088333 NFLGYYWFWDNYCS-BYFYWULKSA-N 458.543 5.750 5 20 JKBD CC(C)Sc1ccc(Cl)cc1NC(=O)c1ccc(Sc2nncn2C)c([N+](=O)[O-])c1 520540927 XWHDCQUGUIOCDD-UHFFFAOYSA-N 463.972 5.281 5 20 JKBD C[C@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccc(C(=O)N2CCCC[C@H]2C)c(Cl)c1 603987175 LQMKWZFNHFBECW-CABCVRRESA-N 461.971 5.382 5 20 JKBD Cc1ccc(NC(=O)CS[C@@H](C)C(=O)Nc2nc(-c3cccc([N+](=O)[O-])c3)c(C)s2)cc1 603996764 COGAUIKVXGRJME-HNNXBMFYSA-N 470.576 5.034 5 20 JKBD Cc1ccccc1CN1CCC(N[C@@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2ccccc2)CC1 604045784 UFYKCLFUXKDUSW-AREMUKBSSA-N 493.007 5.491 5 20 JKBD Cc1ccc(NC(=O)c2ccc(Sc3nnc(-c4ccc(F)cc4)o3)c([N+](=O)[O-])c2)cc1 608971715 ORHOIGYAKLZQRW-UHFFFAOYSA-N 450.451 5.496 5 20 JKBD COc1cc(C(=O)Nc2ccc(N[C@H](C)c3ccccc3)c(Cl)c2)c([N+](=O)[O-])cc1OC 609071988 AJTDKXMCPOWPDV-CQSZACIVSA-N 455.898 5.691 5 20 JKBD C[C@H](NC(=O)c1cccc([N+](=O)[O-])c1)C(=O)Nc1ccc(N[C@@H](C)c2ccccc2)c(Cl)c1 609072005 CEJLXKBIOXEUDI-HOTGVXAUSA-N 466.925 5.178 5 20 JKBD Cc1ccc2c(CC(=O)O[C@H](C(=O)Nc3ccc([N+](=O)[O-])cc3Cl)c3ccccc3)c[nH]c2c1 726223433 LLAHLVFHAAEPRM-DEOSSOPVSA-N 477.904 5.504 5 20 JKBD O=C(Nc1ccc(F)c([N+](=O)[O-])c1)c1cnn(-c2ncc(C(F)(F)F)cc2Cl)c1C(F)F 730958781 ZXKLWINQLZQHJH-UHFFFAOYSA-N 479.724 5.177 5 20 JKBD Cc1cccc(NC(=O)Cn2c3ccccc3c(=O)c3ccccc32)c1C(=O)NCCc1ccccc1 745070161 VAYGVLTWMGRXOZ-UHFFFAOYSA-N 489.575 5.074 5 20 JKBD COc1cc(C(=O)OCc2csc(C3CCCC3)n2)c([N+](=O)[O-])cc1OCc1cscn1 746585357 IAALJZNYQXCBNG-UHFFFAOYSA-N 475.548 5.110 5 20 JKBD CC1=C(C(=O)Nc2cccc(Cl)c2)[C@@H](c2ccc([N+](=O)[O-])o2)NC(=O)N1Cc1ccccc1 812507062 JPAVADFMLGQVPN-OAQYLSRUSA-N 466.881 5.020 5 20 JKBD C[C@]1(C(=O)NC2(c3ccc(NC(=O)c4cc([N+](=O)[O-])cc5c4OCC5)cc3)CCC2)CC=CCC1 1790045561 UUIYMMDTKRNEGJ-SANMLTNESA-N 475.545 5.024 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)c3nc4cc([N+](=O)[O-])ccc4[nH]3)CCC2)cc1)c1ccc(Cl)cc1 1790295620 BPEBQUKTWICCMS-UHFFFAOYSA-N 489.919 5.186 5 20 JKBD CCc1oncc1C(=O)NC1(c2ccc(NC(=O)c3cc(Cl)cc([N+](=O)[O-])c3C)cc2)CCC1 1790773837 IUMADZNAYSNNIV-UHFFFAOYSA-N 482.924 5.169 5 20 JKBD C[C@H](Cc1ccco1)C(=O)NC1(c2ccc(NC(=O)CSc3ccccc3[N+](=O)[O-])cc2)CCC1 1791522884 DDSWVSZGUOBYMM-GOSISDBHSA-N 493.585 5.293 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)c3cccc(F)c3[N+](=O)[O-])CCC2)cc1)c1ccc(-c2ncc[nH]2)cc1 1792154856 UZDNDBOISFHLAC-UHFFFAOYSA-N 499.502 5.186 5 20 JKBD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)Cc1ccc(Cl)cc1[N+](=O)[O-])[C@@H]1CCC[C@@H]2CCCC[C@H]21 1793079295 PUHWQSBIPAPHLT-HFJIGHFISA-N 488.028 5.035 5 20 JKBD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H]1CCC[C@@H]2CCCC[C@@H]21)c1cc2cc([N+](=O)[O-])ccc2s1 1797878838 WJDSUXQHJMHKHH-CZVSCRFZSA-N 495.645 5.668 5 20 JKBD Cc1ccc(CCC(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)cc1 1801206666 CODHYSCPNBQIIE-WKCHPHFGSA-N 477.586 5.003 5 20 JKBD CC(C)[C@H](C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2ccc([N+](=O)[O-])cc2F)n[nH]1)c1ccccc1 1821049645 UTKBQCFQRQRSTF-UPVQGACJSA-N 493.539 5.203 5 20 JKBD O=C(Nc1cc([C@@H]2CCCCN2C(=O)[C@@H]2CCC[C@@H]3CCCC[C@@H]32)[nH]n1)c1cc(F)cc([N+](=O)[O-])c1 1821166451 WRIUUHHFVZZTMN-GCUYEVCFSA-N 497.571 5.369 5 20 JKBD O=C(c1cccc(F)c1[N+](=O)[O-])N1CCC([C@H]2CCCCN2C(=O)c2ccc3ccoc3c2)CC1 1830913108 SWWLLNRDFUXNMW-JOCHJYFZSA-N 479.508 5.027 5 20 JKBD O=C(c1ccc2ncccc2c1)N1CCC([C@@H]2CCCCN2C(=O)/C=C/c2ccccc2[N+](=O)[O-])CC1 1832907571 YUASVBQTSZJRGQ-PUHSMXRQSA-N 498.583 5.090 5 20 JKBD C[C@H](Sc1nnc(Cc2cccs2)n1CCc1ccccc1)C(=O)Nc1cccc([N+](=O)[O-])c1 12743858 GVOHCZBBJXJOKM-KRWDZBQOSA-N 493.614 5.201 5 20 JKBD O=C(COC(=O)c1cc2cc([N+](=O)[O-])ccc2s1)N[C@H](c1ccc(F)cc1)c1cccs1 18549048 LOZJZQYHVSONKN-OAQYLSRUSA-N 470.503 5.073 5 20 JKBD Cn1ncc2c1CCC[C@@H]2NC(=O)C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1 24994307 HRZGCUAQISLDBI-QUHSPFQSSA-N 473.558 5.063 5 20 JKBD CC(C)C(=O)N1CCC(NC(=O)c2ccccc2Sc2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 25755064 OTQQFGDODTZLFH-UHFFFAOYSA-N 495.523 5.142 5 20 JKBD Cc1nnc(S[C@H](C(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)c2ccccc2)n1Cc1ccccc1 28609139 LZVPXFDAGOFMPA-QFIPXVFZSA-N 493.976 5.669 5 20 JKBD O=C(Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1)C1CCN(C(=O)c2cccc3ccccc23)CC1 71807193 ZMBVGWIPDXFFJX-UHFFFAOYSA-N 486.553 5.362 5 20 JKBD CCOc1cccc2cc([C@@H](C)NC(=O)c3ccc(N[C@@H](C)c4ccccn4)c([N+](=O)[O-])c3)oc12 108789315 NXFSUBUIBKJBMD-DLBZAZTESA-N 474.517 5.799 5 20 JKBD C[C@H](Nc1ccc(C(=O)N2CCCc3cc(Br)ccc32)cc1[N+](=O)[O-])c1ccccn1 108886302 GACRGWNXHBQJBG-HNNXBMFYSA-N 481.350 5.518 5 20 JKBD CN(CC(=O)Nc1ccccc1Br)c1cc(Cl)c(C(F)(F)F)cc1[N+](=O)[O-] 248009127 OXZDPPHEUIMZKD-UHFFFAOYSA-N 466.641 5.104 5 20 JKBD Cc1ccccc1-c1nnc(S[C@@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)n1Cc1ccco1 479829703 IVBKHLRAEAHUIA-HNNXBMFYSA-N 497.964 5.576 5 20 JKBD Cc1ccc(C(=O)N(C)C)cc1NC(=O)c1ccc(Sc2nc3ccccc3s2)c([N+](=O)[O-])c1 481593013 BYNFDJZERMNSCA-UHFFFAOYSA-N 492.582 5.618 5 20 JKBD C[C@@H](NC(=O)c1csc(-c2ccc([N+](=O)[O-])cc2)n1)c1cccc(NC(=O)c2ccccc2)c1 496354436 BJQQRAQFHLJYKP-MRXNPFEDSA-N 472.526 5.462 5 20 JKBD C[C@H](c1ccc(-n2cncn2)cc1)N(C)C(=O)c1ccc(NCc2ccccc2Cl)c([N+](=O)[O-])c1 499208025 YXMFTTUCFPABLH-QGZVFWFLSA-N 490.951 5.274 5 20 JKBD CN(CCc1ccncc1)C(=O)C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1 499947648 IWCDCUZNLONGAD-CAPFRKAQSA-N 458.543 5.231 5 20 JKBD Cc1cc(F)ccc1N(Cc1ccco1)C(=O)c1ccc(Cn2nc(C)c([N+](=O)[O-])c2C)cc1 501148722 INCRGEYSLDKMKD-UHFFFAOYSA-N 462.481 5.344 5 20 JKBD Cc1cc(Br)cc(Cl)c1NC(=O)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-] 501233103 CIPOCXHDVDMJTF-UHFFFAOYSA-N 467.625 5.513 5 20 JKBD C[C@@H](NC(=O)NCC1(c2ccc(Cl)cc2Cl)CCOCC1)c1cccc([N+](=O)[O-])c1 510513866 JTVZNVJPWKLYNG-CQSZACIVSA-N 452.338 5.010 5 20 JKBD CS(=O)(=O)c1ccc(C(=O)Nc2ccc(Oc3ccc(Cl)cc3Cl)c(F)c2)cc1[N+](=O)[O-] 511562941 ACKNHWOYJUNICQ-UHFFFAOYSA-N 499.303 5.489 5 20 JKBD O=[N+]([O-])c1ccc(-c2ccc(CNCc3ccc(-n4ccnc4)c(F)c3)o2)c(Br)c1 518779986 AFOQGUXTABVRAS-UHFFFAOYSA-N 471.286 5.232 5 20 JKBD C[C@H](c1ccccn1)N(C)C(=O)C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1 520088334 NFLGYYWFWDNYCS-JFPYRBRCSA-N 458.543 5.750 5 20 JKBD Cc1ccc(NC(=O)CSc2ccc(C(F)(F)F)cc2[N+](=O)[O-])cc1NC(=O)c1ccncc1 520745639 UZECZMHJBBYISI-UHFFFAOYSA-N 490.463 5.300 5 20 JKBD O=[N+]([O-])c1ccc(-c2nn(-c3ccccc3)cc2CNC[C@@H]2CCCO[C@H]2c2ccccc2)cc1 520960599 GGURUZORWOCBBB-FIPFOOKPSA-N 468.557 5.705 5 20 JKBD Cc1cc(NC(=O)c2ccc([N+](=O)[O-])cc2Cl)n(-c2cc(C(F)(F)F)ccc2Cl)n1 550546553 HPHBLHRGLHYPHH-UHFFFAOYSA-N 459.211 5.667 5 20 JKBD COc1cc([C@H](C)Nc2ccc([N+](=O)[O-])c(C(=O)N3CCCC3)c2)ccc1OC1CCCC1 603943468 IKXWDFWZTZHLNI-KRWDZBQOSA-N 453.539 5.334 5 20 JKBD O=[N+]([O-])c1cc(Br)ccc1Sc1nnc(-c2ccc(F)cc2)n1C[C@H]1CCCO1 608855758 IJTQNBIUTOZBAB-OAHLLOKOSA-N 479.331 5.085 5 20 JKBD CSc1ccc(C(=O)c2ccccc2C(=O)N2CCCO[C@@H](c3ccccc3)C2)cc1[N+](=O)[O-] 609230883 RYVSBHCYRMZSKJ-HSZRJFAPSA-N 476.554 5.152 5 20 JKBD COc1cc(CSc2nc(-c3ccc(Br)cc3)n[nH]2)c([N+](=O)[O-])cc1OC(F)F 619254715 NGAIZOCYASNRMS-UHFFFAOYSA-N 487.282 5.045 5 20 JKBD C[C@H]1CN(c2ccc(NC(=O)N[C@H](C)c3cccc([N+](=O)[O-])c3)cc2C(F)(F)F)C[C@@H](C)O1 728130133 MAGJDJLHJVFHEX-QLFBSQMISA-N 466.460 5.110 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)O[C@@H](C(=O)Nc2cc(Cl)ccc2Cl)C(C)C)cc1SC 728649847 SDKJYMLWWPOKBV-GOSISDBHSA-N 487.361 5.452 5 20 JKBD COC(=O)/C=C\c1ccc(NCc2ccccc2-c2ccc(Cn3ccnc3)cc2)c([N+](=O)[O-])c1 728910346 ZQHMOXOWEPATBR-LCYFTJDESA-N 468.513 5.305 5 20 JKBD C[C@H](SCc1nc(O)c2c(-c3ccccc3)csc2n1)C(=O)OCc1c(F)cccc1[N+](=O)[O-] 728987762 CLXHDOOBMCSOLK-ZDUSSCGKSA-N 499.545 5.476 5 20 JKBD O=C(Nc1cc([N+](=O)[O-])c(F)cc1F)[C@H](Oc1ccc(Br)cc1F)c1ccccc1 730471435 YBUUSNGRTAQWTI-LJQANCHMSA-N 481.224 5.533 5 20 JKBD COc1ccc(-c2nnc(S[C@@H](C)C(=O)Nc3cc([N+](=O)[O-])ccc3Cl)n2CC(C)C)cc1 792729132 PBEZYDMMILABHN-AWEZNQCLSA-N 489.985 5.291 5 20 JKBD COc1ccc(CCC(=O)Oc2ccc(NC(=O)c3cccc([N+](=O)[O-])c3)cc2)cc1Cl 818025956 XHJIBATXHDHJRL-UHFFFAOYSA-N 454.866 5.047 5 20 JKBD Cc1cc([N+](=O)[O-])c(F)c(C(=O)Nc2ccc(OC(F)(F)F)c(Br)c2)c1F 834768594 KPMOVLXCBPNBCG-UHFFFAOYSA-N 455.133 5.095 5 20 JKBD COc1ccc(Oc2ccc([N+](=O)[O-])cc2C(=O)O[C@H](C)c2nc(O)c3c(C)c(C)sc3n2)cc1 915441477 DOGWQOIKFBJQKK-CYBMUJFWSA-N 495.513 5.641 5 20 JKBD CC1=C(C(=O)Nc2ccccc2C)[C@H](c2ccc([N+](=O)[O-])cc2)NC(=O)N1Cc1ccccc1 916159205 NINIAGKBVRBUKK-DEOSSOPVSA-N 456.502 5.082 5 20 JKBD Cc1cc2cc(C(=O)NC3(c4ccc(NC(=O)Cc5cccc([N+](=O)[O-])c5)cc4)CCC3)ccc2[nH]1 1785795398 MFPWZHFSPOEONG-UHFFFAOYSA-N 482.540 5.375 5 20 JKBD O=C(/C=C/c1ccc([N+](=O)[O-])o1)Nc1ccc(C2(NC(=O)/C=C/c3cc4ccccc4o3)CCC2)cc1 1786207462 OTRSBPQJXWGECZ-IFQMDVHZSA-N 497.507 5.795 5 20 JKBD Cc1nc(C(=O)NC2(c3ccc(NC(=O)CCCc4cc(C)c(F)cc4[N+](=O)[O-])cc3)CCC2)co1 1786274880 ODNASALLZLNBFN-UHFFFAOYSA-N 494.523 5.109 5 20 JKBD CN(C)c1ccc([N+](=O)[O-])c(C(=O)NC2(c3ccc(NC(=O)CSC4CCCC4)cc3)CCC2)c1 1786348855 QALRLUVYFCMIBC-UHFFFAOYSA-N 496.633 5.084 5 20 JKBD CCSc1cccnc1C(=O)Nc1ccc(C2(NC(=O)c3cc(F)cc([N+](=O)[O-])c3)CCC2)cc1 1790210150 FTYGWHILMDLDMW-UHFFFAOYSA-N 494.548 5.302 5 20 JKBD Cc1cc(O)c([N+](=O)[O-])cc1C(=O)Nc1ccc(C2(NC(=O)c3cc4sccc4[nH]3)CCC2)cc1 1790809054 BKJWUSLOOOJEFP-UHFFFAOYSA-N 490.541 5.213 5 20 JKBD CC(C)(C)CCCCCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)Cc1ccc(Cl)cc1[N+](=O)[O-] 1793081098 QYYXBOMCCNTCIE-WKCHPHFGSA-N 478.033 5.426 5 20 JKBD Cc1cc(Cl)c(Cl)cc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)Cc1ccc(C)c([N+](=O)[O-])c1)C2 1800791541 ZVCDKFZMFPBOQR-BCDXTJNWSA-N 490.387 5.013 5 20 JKBD Cc1cccc2[nH]c(C(=O)N[C@@H]3C[C@@H]4CC[C@H](C3)N4C(=O)c3cc4cc([N+](=O)[O-])ccc4s3)cc12 1801207363 LRKDYBWRSXKYFK-BCDXTJNWSA-N 488.569 5.165 5 20 JKBD CC(C)(C)CCCCCC(=O)N1CC[C@@H](CNC(=O)Cc2cccc([N+](=O)[O-])c2)[C@@H]1c1cccnc1 1802382157 OOTWCJOMYKIDQB-HOFKKMOUSA-N 494.636 5.235 5 20 JKBD O=C(Nc1cc([C@H]2CCCCN2C(=O)Cc2cccc([N+](=O)[O-])c2)[nH]n1)c1cc2sccc2s1 1819026757 UNONQNNBMOGKST-QGZVFWFLSA-N 495.586 5.143 5 20 JKBD Cc1cc(CCCC(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)c2cccc3ccccc23)c([N+](=O)[O-])cc1F 1847714526 YGUDYNMRXCTKLO-DQEYMECFSA-N 489.547 5.034 5 20 JKBD C[C@@H](OC(=O)c1cc(Br)ccc1Cl)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 11481525 ABBQMJGIXPUGMF-MRVPVSSYSA-N 495.635 5.214 5 20 JKBD O=c1cc(CNc2cc([N+](=O)[O-])ccc2Nc2cccc(C(F)(F)F)c2)nc2sccn12 11725345 JWOAXSPWCRRGFP-UHFFFAOYSA-N 461.425 5.039 5 20 JKBD Cc1cccc([N+](=O)[O-])c1NC(=O)CSc1nc2ccccc2c(=O)n1CCC1=CCCCC1 21120231 PLUOPVCTLMNSMR-UHFFFAOYSA-N 478.574 5.234 5 20 JKBD CCN(Cc1cccc(N[C@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2ccccc2)c1)C(C)=O 30494056 FYMXNAGBSVJHCF-DEOSSOPVSA-N 480.952 5.409 5 20 JKBD O=C(Nc1cc(Cl)ccc1C(=O)N1CCCCC1)c1csc(-c2cccc([N+](=O)[O-])c2)n1 303236879 ZZRXCCHQZGQAIN-UHFFFAOYSA-N 470.938 5.250 5 20 JKBD Cc1ccc(NC(=O)Nc2ccccc2)cc1NC(=O)[C@@H](C)Sc1ccc([N+](=O)[O-])cc1 480346517 INBGAMNXAPVWMR-MRXNPFEDSA-N 450.520 5.667 5 20 JKBD Cc1nc(C2(NC(=O)c3ccc(Oc4ccc(Cl)cc4[N+](=O)[O-])cc3)CCCCC2)no1 492593982 XMNONWGQQUXUQU-UHFFFAOYSA-N 456.886 5.321 5 20 JKBD C[C@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)NCc1ccccc1-c1ccc(Cn2ccnc2)cc1 504776475 SAPMFMSJNZEGPL-SFHVURJKSA-N 490.947 5.244 5 20 JKBD Cc1sc(NC(=O)c2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)nc1-c1ccc(OC(F)F)cc1 506162952 HFZWMUAQLCWRAV-UHFFFAOYSA-N 485.472 5.281 5 20 JKBD CC(=O)N(c1cccc(C(F)(F)F)c1)c1nc(-c2nc3cc([N+](=O)[O-])ccc3n2C)cs1 513857261 JFBOXPQANPTWDP-UHFFFAOYSA-N 461.425 5.308 5 20 JKBD O=[N+]([O-])c1ccc(-c2nn(-c3ccccc3)cc2CNCc2ccc(N3CCCCC3)nc2)cc1 518761356 OBBLNTSNZKKYOO-UHFFFAOYSA-N 468.561 5.123 5 20 JKBD COCCN(C(=O)CCc1ncc(-c2ccc(C)cc2)o1)c1nc(-c2ccc([N+](=O)[O-])cc2)cs1 590614017 NWFMJURURMDTEY-UHFFFAOYSA-N 492.557 5.294 5 20 JKBD O=C(Nc1cccc(C(F)(F)F)c1)c1cccc(NC(=O)c2ccc(Cl)cc2[N+](=O)[O-])c1 603468592 LCYRQHVIEUGQTR-UHFFFAOYSA-N 463.799 5.772 5 20 JKBD CC(C)N1CCC(NC(=O)C/C(=C\c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)CC1 603573881 XVLNSUWGTLLFJS-XDJHFCHBSA-N 464.591 5.124 5 20 JKBD COc1cc(CNCc2cn(-c3ccccc3)nc2-c2ccc([N+](=O)[O-])cc2)ccc1OC(F)F 608840813 DCJCMDNKSFAJNU-UHFFFAOYSA-N 480.471 5.347 5 20 JKBD COCCc1ccc(Oc2ccc(NC(=O)c3cc(SC)c(OC)cc3[N+](=O)[O-])cc2)cc1 609375810 JWPHRGQBCYOGTN-UHFFFAOYSA-N 468.531 5.559 5 20 JKBD CC(=O)N(c1cccc(C(F)(F)F)c1)c1nc(COC(=O)c2c(Cl)cccc2[N+](=O)[O-])cs1 730645232 YXTQLVGOGBGDIQ-UHFFFAOYSA-N 499.854 5.765 5 20 JKBD C[C@@H](OC(=O)CCC(=O)c1ccc2c(c1)-c1ccccc1C2)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 746633173 FXBZGZLZMAYMBM-MRXNPFEDSA-N 483.480 5.483 5 20 JKBD O=C(Oc1ccc(NC(=O)c2cccs2)cc1)c1csc(-c2cccc([N+](=O)[O-])c2)n1 747624813 CINMBPGJASIFFK-UHFFFAOYSA-N 451.485 5.251 5 20 JKBD COc1c(C)cnc(CNC(=O)C/C(=C/c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)c1C 747675674 UGEYZWQLZVAFAW-UNOMPAQXSA-N 488.569 5.472 5 20 JKBD C[C@@H](OC(=O)c1csc(-c2cccc([N+](=O)[O-])c2)n1)c1ccc(NC(=O)c2ccccc2)cc1 748016910 PRLOJLAKULKIHD-MRXNPFEDSA-N 473.510 5.889 5 20 JKBD CC(C)OC(=O)C[C@H](NC(=O)c1nc(Cl)c(Cl)c(Cl)c1Cl)c1ccccc1[N+](=O)[O-] 836978726 VCBMVOHYQJHFOU-JTQLQIEISA-N 495.146 5.416 5 20 JKBD COc1cc(C(=O)O[C@@H](C)c2nc(C(C)C)no2)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 914893702 VIOMBLBSPJOLJR-LBPRGKRZSA-N 461.858 5.474 5 20 JKBD CCOC(=O)/C(=C\c1ccc(-c2cccc([N+](=O)[O-])c2)o1)c1nc(O)c2c(C)c(C)sc2n1 916126795 KLKOHGKXROOQNA-BOPFTXTBSA-N 465.487 5.286 5 20 JKBD CC1=C(C(=O)Nc2ccccc2C(F)(F)F)[C@@H](c2cc([N+](=O)[O-])ccc2Cl)NC(=S)N1C 916168019 DAGABCVEOLZVOL-QGZVFWFLSA-N 484.887 5.041 5 20 JKBD CN(C(=O)c1ccc(CSc2ccccc2)cc1)S(=O)(=O)c1ccc(Cl)c([N+](=O)[O-])c1 916989886 FMXHZNQKEOYBSN-UHFFFAOYSA-N 476.963 5.001 5 20 JKBD O=C(Nc1cccc(OC(=O)c2cc(OCC(F)(F)F)ccc2[N+](=O)[O-])c1)c1ccccc1 917057301 ZTIAXDKFOQOGOU-UHFFFAOYSA-N 460.364 5.007 5 20 JKBD Cc1ccc(N2CCCN(C(=O)c3ccc(Sc4nc(C)cs4)c([N+](=O)[O-])c3)CC2)cc1 917825051 UQHCTLZIKAJVMJ-UHFFFAOYSA-N 468.604 5.172 5 20 JKBD COC(=O)Nc1ccc(OC(=O)C/C(=C/c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)cc1 918602609 BZACJPKEXJGZHS-VKAVYKQESA-N 489.509 5.919 5 20 JKBD CSc1nc(-c2ccc(F)cc2)nc(C)c1C(=O)O[C@H](C)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 919183108 COABCWZROKQJNU-CYBMUJFWSA-N 495.492 5.189 5 20 JKBD C[C@H](Nc1ccc(C(=O)Oc2ccc(N(C)C(=O)C(C)(C)C)cc2)cc1[N+](=O)[O-])c1ccccn1 919682731 SQGOBLCPFFOCGY-KRWDZBQOSA-N 476.533 5.391 5 20 JKBD CC(=O)N(c1ccc(C(F)(F)F)cc1)c1nc(COC(=O)c2csc([N+](=O)[O-])c2)cs1 920529252 QDNXUKOERFQSPI-UHFFFAOYSA-N 471.438 5.173 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)[C@@H]3CCC=CO3)CCC2)cc1)c1cc2cc([N+](=O)[O-])ccc2s1 1791010727 SMDFUPZCCYWSNO-FQEVSTJZSA-N 477.542 5.250 5 20 JKBD Cc1ccc(C2(C(=O)N3CCC4(CCCN(C(=O)c5ccc([N+](=O)[O-])o5)C4)CC3)CCCCC2)cc1 1804650045 OBGVFYWWJONEPS-UHFFFAOYSA-N 493.604 5.243 5 20 JKBD CC(C)(C)CCCCCC(=O)N1CC[C@H](CNC(=O)c2ccc(O)c([N+](=O)[O-])c2)[C@@H]1c1cccnc1 1810718863 ZNEYNSXFAROJLT-BWKNWUBXSA-N 496.608 5.012 5 20 JKBD Cc1cc(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)C3(c4cccc([N+](=O)[O-])c4)CCC3)CC2)c(C)o1 1825879006 SRGPSBAMJCQLRC-RUZDIDTESA-N 493.604 5.160 5 20 JKBD Cc1oc(C(C)(C)C)cc1C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2ccc([N+](=O)[O-])cc2F)CC1 1830493987 SIISLDUOCFXWCI-QHCPKHFHSA-N 499.583 5.480 5 20 JKBD O=C(Cc1ccsc1)N1CCC([C@@H]2CCCCN2C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)CC1 1831061245 QGQSLLXHXRNNBO-NRFANRHFSA-N 497.642 5.347 5 20 JKBD COc1cc(C(=O)N2CCC([C@@H]3CCCCN3C(=O)c3cc(C)cc(Cl)c3)CC2)ccc1[N+](=O)[O-] 1832612541 WUEXCXHQXCSRKP-QFIPXVFZSA-N 499.995 5.112 5 20 JKBD Cc1ccc(C(=O)CCC(=O)O[C@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2ccccc2)cc1 8929526 NTDNYXQXJFENRS-DEOSSOPVSA-N 480.904 5.443 5 20 JKBD CCn1c(S[C@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)nnc1-c1ccc(Cl)cc1 9070827 XPVBEFUPPGNPNE-LLVKDONJSA-N 466.350 5.299 5 20 JKBD O=C(COC(=O)c1ccccc1CSc1nc2ccccc2o1)Nc1ccc([N+](=O)[O-])cc1Cl 9555916 QMQDZIIAHMESST-UHFFFAOYSA-N 497.916 5.477 5 20 JKBD O=C(Nc1ccc(-c2nnc3n2CCCCC3)cc1)c1ccc(NCc2ccccc2)c([N+](=O)[O-])c1 15839815 PMZTZPDPIBGIFI-UHFFFAOYSA-N 482.544 5.444 5 20 JKBD Cc1cc(CSc2ccccc2C(=O)O[C@@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)on1 16542385 ARGPACZDYQZQFK-ZDUSSCGKSA-N 475.910 5.021 5 20 JKBD C[C@H](Sc1nc(C(F)(F)F)nc2ccccc12)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl 22248120 REIBUJNXBMRPIV-VIFPVBQESA-N 456.833 5.330 5 20 JKBD Cc1c(Cl)cccc1Nc1nnc(S[C@@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)s1 24506318 CEWFZXVSWCWZRD-NSHDSACASA-N 474.955 6.055 5 20 JKBD CC(C)CCSc1ccc(C(=O)N(C)CC(=O)Nc2ccccc2Br)cc1[N+](=O)[O-] 24819877 DUSCCOCIPPLZEL-UHFFFAOYSA-N 494.411 5.206 5 20 JKBD Cc1nn(-c2ccc(Cl)cc2)c2sc(C(=O)OCc3nnc(-c4ccc([N+](=O)[O-])cc4)o3)cc12 28614451 MSTZYDYGVXFZHF-UHFFFAOYSA-N 495.904 5.364 5 20 JKBD C[C@@H]1Oc2ccc(NC(=O)c3cc([N+](=O)[O-])ccc3Sc3ccc(Cl)cc3)cc2NC1=O 30560558 WJWCLIYIVZHVML-LBPRGKRZSA-N 469.906 5.371 5 20 JKBD CC(C)NC(=O)Nc1ccc(NC(=O)Cc2cn(-c3ccccc3)nc2-c2ccc([N+](=O)[O-])cc2)cc1 31023029 BJFKGERWJBBJPS-UHFFFAOYSA-N 498.543 5.159 5 20 JKBD CC(C)Oc1ccc([N+](=O)[O-])cc1CSc1nnc(-c2c[nH]c3ccccc23)n1C[C@@H]1CCCO1 78443193 LNRMVHXIUFRBJA-IBGZPJMESA-N 493.589 5.593 5 20 JKBD COc1cc(C(=O)NC[C@@H]2CCN(c3ccccc3)C2)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 106138040 MZDSZLZDBZSDRT-KRWDZBQOSA-N 481.936 5.305 5 20 JKBD O=C(Nc1ccc2[nH]c(Cc3ccccc3F)nc2c1)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-] 109444865 MXWOEWRHBUFDCJ-UHFFFAOYSA-N 488.397 5.394 5 20 JKBD O=C(NCc1ccccc1)c1nnc(/C(Cl)=C\c2ccc(-c3ccccc3[N+](=O)[O-])o2)s1 209438863 ASMXDJWNFUNNNJ-SFQUDFHCSA-N 466.906 5.373 5 20 JKBD COc1ccc([C@H]2CCCCCN2C(=O)c2ccc(N[C@@H](C)c3ccccn3)c([N+](=O)[O-])c2)cc1 303037767 VMUQXJCECNATDR-UQBPGWFLSA-N 474.561 5.929 5 20 JKBD C[C@H](Nc1ccc(C(=O)NCCc2cc(Br)ccc2F)cc1[N+](=O)[O-])c1ccccn1 303074036 YIARWHXBVOYRLH-AWEZNQCLSA-N 487.329 5.037 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)Nc2cc(C3CCCC3)nn2-c2ccccc2)cc1SC 481967938 PSUJPJCAYDLGDV-UHFFFAOYSA-N 452.536 5.421 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)N(Cc2ccc(Br)cc2)C(C)C)cc1SC 482430488 CSYQNUCRBJFVJO-UHFFFAOYSA-N 453.358 5.139 5 20 JKBD COc1cc(CCNC(=O)[C@@H](Sc2ccc(F)cc2F)c2ccccc2)c([N+](=O)[O-])cc1OC 499664680 ZPXFHGVAYODFKP-QHCPKHFHSA-N 488.512 5.083 5 20 JKBD CCOc1ccc(C(=O)N2CCC(NCc3ccc(Oc4ccc(F)cc4)c([N+](=O)[O-])c3)CC2)cc1 507915599 UWVSFNUFVZPPLK-UHFFFAOYSA-N 493.535 5.319 5 20 JKBD Cc1csc(Sc2ccc(C(=O)N(C)Cc3ccc(Br)o3)cc2[N+](=O)[O-])n1 509443231 YKTYXWWBVYIMFB-UHFFFAOYSA-N 468.354 5.139 5 20 JKBD Cc1ccccc1C1(CNC(=O)c2cc([N+](=O)[O-])ccc2Sc2ccccc2)CCOCC1 510103461 VRLNMOVASLRIMM-UHFFFAOYSA-N 462.571 5.533 5 20 JKBD COc1ccc2[nH]cc(C3CCN(C(=O)Nc4cc([N+](=O)[O-])ccc4OC(F)F)CC3)c2c1 510624339 HBAXAGWUFBDELK-UHFFFAOYSA-N 460.437 5.098 5 20 JKBD COc1cc(C(=O)Nc2cccc(-c3cnco3)c2)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 511390640 JMXCPKQPNLEAQJ-UHFFFAOYSA-N 465.849 5.956 5 20 JKBD COc1cc(C(=O)Nc2nc(-c3ccc(C)s3)cs2)c([N+](=O)[O-])cc1OCc1cscn1 512600328 TUDKFPMZGYBFRE-UHFFFAOYSA-N 488.572 5.385 5 20 JKBD Cc1nn(CCC(=O)N(Cc2ccc(-c3ccccc3C(F)(F)F)o2)C2CC2)c(C)c1[N+](=O)[O-] 523286775 NHYRHEXLCQTZMF-UHFFFAOYSA-N 476.455 5.268 5 20 JKBD Cc1csc(Sc2ccc(C(=O)Nc3ccccc3C(=O)N3CCC(C)CC3)cc2[N+](=O)[O-])n1 604013201 OPRAUZABCUUFKC-UHFFFAOYSA-N 496.614 5.635 5 20 JKBD Cc1nc(-c2cccc(NC(=O)C/C(=C/c3ccc([N+](=O)[O-])cc3)c3nc4ccccc4s3)c2)no1 604441080 YWDUYXMYUDGZPD-UYRXBGFRSA-N 497.536 6.132 5 20 JKBD C[C@@H](NCc1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1)c1ccc(NC(=O)C2CC2)cc1 608835630 GXDJIJYMAXHSQN-LJQANCHMSA-N 481.556 5.647 5 20 JKBD CSc1ccc(C(=O)N2c3ccccc3CC[C@H]2C(=O)Nc2ccc(F)cc2)cc1[N+](=O)[O-] 608873126 VWGHVWWZHFFABB-FQEVSTJZSA-N 465.506 5.056 5 20 JKBD Cc1nc(-c2ccc(F)cc2)sc1[C@H](C)NC(=O)C1CCN(c2ccccc2[N+](=O)[O-])CC1 609186393 LWXPUUOOGDKBMH-HNNXBMFYSA-N 468.554 5.260 5 20 JKBD O=C(O[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Br)c1ccccc1)c1cccc(F)c1F 726679901 CDNACMKECVZCDA-LJQANCHMSA-N 491.244 5.172 5 20 JKBD O=C(O[C@@H](c1ccccc1)c1cccnc1)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 728419586 VKFVEXPQCKRRSH-QHCPKHFHSA-N 485.462 5.558 5 20 JKBD C[C@@H](Sc1nnc(COc2ccc(Cl)cc2Cl)o1)C(=O)Nc1ccc(F)c([N+](=O)[O-])c1 745941951 NGWTYWNCOGJATH-SECBINFHSA-N 487.296 5.122 5 20 JKBD O=C(Nc1nc2cc(C(F)(F)F)ccc2n1Cc1ccco1)c1cc([N+](=O)[O-])ccc1Cl 790905295 KOENBLUVCOHNEL-UHFFFAOYSA-N 464.787 5.510 5 20 JKBD Cc1cc(C(=O)O[C@@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)c(C)n1[C@H](C)c1ccccc1 914662684 KXJMERTULMABSK-AEFFLSMTSA-N 460.490 5.590 5 20 JKBD Cc1nc(Cc2ccc(F)cc2)sc1C(=O)O[C@H](C)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 915399896 XOLHLCHSSVLBIW-CYBMUJFWSA-N 468.466 5.058 5 20 JKBD O=C1/C(=C\c2ccc(Oc3ccc(F)cc3)c([N+](=O)[O-])c2)c2ccccc2C(=O)N1Cc1ccccn1 915852875 PPXQYULTMNLQQH-IWIPYMOSSA-N 495.466 5.644 5 20 JKBD Cn1c(-c2ccccc2Cl)nn(CN(Cc2ccccc2[N+](=O)[O-])CC(F)(F)F)c1=S 917451088 SHNNKCNYQYKNRN-UHFFFAOYSA-N 471.892 5.202 5 20 JKBD O=C(C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)Nc1ccc2oc(=O)ccc2c1 918670314 JIPNCIBTSDZLBO-QGOAFFKASA-N 483.505 5.880 5 20 JKBD C[C@H](SCc1nc(O)c2c(-c3ccccc3)csc2n1)C(=O)O[C@@H](C)c1ccc([N+](=O)[O-])cc1 920155592 XWPDUDFGZQTPHJ-GJZGRUSLSA-N 495.582 5.898 5 20 JKBD CC(C)[C@H](OC(=O)c1ccc(N[C@H](C)c2ccccn2)c([N+](=O)[O-])c1)C(=O)N(C)c1ccccc1 920543393 DQMZQWXUTMMHRR-KOSHJBKYSA-N 476.533 5.007 5 20 JKBD O=C(c1cc2cc([N+](=O)[O-])ccc2s1)N1CCC(C(O)(c2ccccc2)c2ccccc2)CC1 920656673 JSDYQQDCBBGUSG-UHFFFAOYSA-N 472.566 5.598 5 20 JKBD O=C(Cc1ccc(Cl)cc1[N+](=O)[O-])NC1(c2ccc(NC(=O)c3ccnc(Cl)c3)cc2)CCC1 1787380737 YLHBIUZAQJJBKC-UHFFFAOYSA-N 499.354 5.287 5 20 JKBD CN(C)c1ccc([N+](=O)[O-])cc1C(=O)NC1(c2ccc(NC(=O)c3ccc4cc[nH]c4c3)cc2)CCC1 1788913568 FOUHPCPQTDGNFX-UHFFFAOYSA-N 497.555 5.204 5 20 JKBD O=C(/C=C/c1ccc([N+](=O)[O-])o1)NC1(c2ccc(NC(=O)[C@@]3(F)CCCCC3(F)F)cc2)CCC1 1789164260 ZATFCDPKTRJJPF-LBQODKDLSA-N 491.466 5.253 5 20 JKBD CC(C)=CCCC(=O)Nc1ccc(C2(NC(=O)Cc3cc([N+](=O)[O-])ccc3F)CCC2)cc1 1790450280 MKGHNXGRQIREGB-UHFFFAOYSA-N 453.514 5.157 5 20 JKBD CC(C)=CCCC(=O)Nc1ccc(C2(NC(=O)c3cc([N+](=O)[O-])ccc3N(C)C)CCC2)cc1 1790452468 BHBNIPFGGMQFOG-UHFFFAOYSA-N 464.566 5.155 5 20 JKBD Cc1cc2cc(C(=O)NC3(c4ccc(NC(=O)c5ccc(O)c([N+](=O)[O-])c5)cc4)CCC3)ccc2[nH]1 1790622658 GPMGFWMTPVWEIV-UHFFFAOYSA-N 484.512 5.152 5 20 JKBD Cc1cc2cc(C(=O)NC3(c4ccc(NC(=O)c5cc(O)cc([N+](=O)[O-])c5)cc4)CCC3)ccc2[nH]1 1790757368 BPHQCRINFVXXBT-UHFFFAOYSA-N 484.512 5.152 5 20 JKBD C[C@H](C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cc3cc([N+](=O)[O-])ccc3s1)C2)c1ccc(Cl)cc1 1792820917 IVHKYANORRBMOS-GAZPGATBSA-N 498.004 5.518 5 20 JKBD O=C(CSc1ccccc1[N+](=O)[O-])Nc1cc([C@@H]2CCCCN2C(=O)C23CCC(CC2)CC3)[nH]n1 1822315362 QBGPCWGLRUIJRR-HTHJYTGDSA-N 497.621 5.073 5 20 JKBD O=C(Cc1ccccc1Cl)N1CCC([C@@H]2CCCCN2C(=O)CCc2cccc([N+](=O)[O-])c2)CC1 1824838430 HTJWNSXXCQSNBK-VWLOTQADSA-N 498.023 5.043 5 20 JKBD CC[C@H](C(=O)N1CCCC[C@@H]1C1CCN(C(=O)Cc2cc([N+](=O)[O-])ccc2F)CC1)c1ccccc1 1826309449 BYWJSMGWUGDFHD-AZGAKELHSA-N 495.595 5.090 5 20 JKBD Cc1ccc(SCC(=O)N2CCC([C@H]3CCCCN3C(=O)c3cccc(F)c3[N+](=O)[O-])CC2)cc1 1830621438 KNJBXOMUJJOZSO-HSZRJFAPSA-N 499.608 5.068 5 20 JKBD CC/C=C(\C)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)CC1 1832520313 OOVUDTVUCBDLMO-FRKKFGCYSA-N 469.607 5.399 5 20 JKBD CSc1cccc(NC(=O)COC(=O)c2ccccc2C(=O)c2ccc(SC)c([N+](=O)[O-])c2)c1 10155296 OLDGTKUEWPOAFJ-UHFFFAOYSA-N 496.566 5.065 5 20 JKBD COc1ccc(Cl)cc1CN(C)C(=O)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 105058890 CPBPHHNERHUOGN-UHFFFAOYSA-N 485.890 5.151 5 20 JKBD O=C(O[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1)c1cccc2ncccc12 105482198 LWZKEOLNSAULFX-QFIPXVFZSA-N 461.861 5.333 5 20 JKBD O=C(Nc1ncc(Cc2cccc(C(F)(F)F)c2)s1)c1cnn(-c2ccc([N+](=O)[O-])cc2)c1 107784291 RVVLGHSMWTWBBV-UHFFFAOYSA-N 473.436 5.099 5 20 JKBD CN(Cc1cn(-c2ccccc2)nc1-c1ccccc1)C(=O)c1c[nH]c2ccc([N+](=O)[O-])cc12 109853404 GVNDAAPQJJPKJG-UHFFFAOYSA-N 451.486 5.201 5 20 JKBD C[C@H](Nc1ccc(C(=O)N(C2CC2)[C@H]2CCCc3ccccc32)cc1[N+](=O)[O-])c1ccccn1 110573778 ZTHLMJJKJGDXDF-BVZFJXPGSA-N 456.546 5.845 5 20 JKBD CC(C)CCSc1ccc(C(=O)N2CCC(C(=O)N3CCc4ccccc43)CC2)cc1[N+](=O)[O-] 195687935 ANDPJKNGOMRSON-UHFFFAOYSA-N 481.618 5.175 5 20 JKBD C[C@@H](Nc1ccc(C(=O)N[C@@H](CC(F)(F)F)c2ccccc2)cc1[N+](=O)[O-])c1ccccn1 409893499 WDVCWHOTNWFPKQ-QRWLVFNGSA-N 458.440 5.586 5 20 JKBD O=C(Nc1ccc(F)c(NS(=O)(=O)c2cccs2)c1)c1cc2cc([N+](=O)[O-])ccc2s1 485794603 ZULISBTZGPFSRH-UHFFFAOYSA-N 477.520 5.063 5 20 JKBD COc1ccc(NC(=O)c2c[nH]c3cc([N+](=O)[O-])ccc23)cc1NC(=O)c1ccc(Cl)cc1F 489803155 HHLWXSBPAZZVPL-UHFFFAOYSA-N 482.855 5.382 5 20 JKBD C[C@H]1C[C@@H](C)CN(c2ccc(C(=O)Nc3ccc(CS(=O)(=O)C(C)(C)C)cc3)cc2[N+](=O)[O-])C1 497781505 GWJNLZYKVZPUIQ-HDICACEKSA-N 487.622 5.043 5 20 JKBD CC(C)N(CC(=O)Nc1ccccc1C(F)(F)F)C(=O)Cn1c2ccccc2c(=O)c2ccccc21 505272983 NDQSRCDBKMGCJP-UHFFFAOYSA-N 495.501 5.049 5 20 JKBD COc1ccc(C(=O)N2CCC(C(=O)N(Cc3ccc([N+](=O)[O-])cc3)C(C)C)CC2)c2ccccc12 509721928 YUMRLXSBSRSWNR-UHFFFAOYSA-N 489.572 5.046 5 20 JKBD CCOc1cc(NC(=O)N2CCC[C@@H]2c2cccc(Br)c2)c([N+](=O)[O-])cc1OCC 511284612 JMKOQZJJOFWFKI-QGZVFWFLSA-N 478.343 5.524 5 20 JKBD O=C(C[C@H](NC(=O)c1ccccc1Cl)c1ccccc1)Nc1cc(-c2cccc([N+](=O)[O-])c2)[nH]n1 517880676 CUQXFDAERHLYLA-NRFANRHFSA-N 489.919 5.138 5 20 JKBD Cc1ccccc1NC(=O)Cc1nc(COc2ccc(-c3ccccc3)cc2[N+](=O)[O-])cs1 517912994 UOXZMKISUBWDJY-UHFFFAOYSA-N 459.527 5.787 5 20 JKBD COc1cccc(OC)c1Oc1ccc(CNc2ccc(Br)cc2[N+](=O)[O-])cn1 524220902 IQERSXVMPBYORT-UHFFFAOYSA-N 460.284 5.174 5 20 JKBD COc1ccc(Cl)cc1NC(=O)CN(C)C(=O)c1cc([N+](=O)[O-])ccc1Sc1ccccc1 598948361 CRODDPXNAJBMLQ-UHFFFAOYSA-N 485.949 5.119 5 20 JKBD CC(=O)N(c1ccc(Cl)cc1)c1nc(/C=C\c2ccc3c([N+](=O)[O-])cccc3n2)cs1 603945579 IVDVCLXYMXICHS-FPLPWBNLSA-N 450.907 6.108 5 20 JKBD C[C@H](Nc1ccc(C(=O)N2C[C@@H](C(F)(F)F)C[C@H](C(F)(F)F)C2)cc1[N+](=O)[O-])c1ccccn1 604310685 CXYXTUIEEYHQDE-QEJZJMRPSA-N 490.404 5.366 5 20 JKBD O=C(Nc1cccc(CNCc2ccc(-c3ccc([N+](=O)[O-])cc3Br)o2)c1)C1CCC1 608835631 HNDNDSDCHDQGOJ-UHFFFAOYSA-N 484.350 5.646 5 20 JKBD CC[C@@H](Nc1ccc(S(=O)(=O)Nc2ccc(C)cc2C)cc1[N+](=O)[O-])c1nc(C)cs1 609193320 AZXPIECQHHGJJC-QGZVFWFLSA-N 460.581 5.341 5 20 JKBD C[C@@H](OC(=O)c1sccc1-c1ccc(F)cc1)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 744608726 UIMCEXCOSONMHV-LLVKDONJSA-N 482.411 5.665 5 20 JKBD O=C(c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1)N(Cc1ccc(F)cc1)c1nc2ccccc2s1 749131098 OTLMMLIOHNTIJO-UHFFFAOYSA-N 452.423 5.099 5 20 JKBD O=C(NCc1ccc(COCc2ccccc2)cc1)c1cc([N+](=O)[O-])ccc1Br 751088207 BICDCPMUJJHXAJ-UHFFFAOYSA-N 455.308 5.004 5 20 JKBD O=C(Nc1nc(-c2ccc(F)c(Cl)c2)cs1)c1cc([N+](=O)[O-])ccc1Br 751106515 DNWLPEGXPJAWCD-UHFFFAOYSA-N 456.680 5.526 5 20 JKBD O=C(COC(=O)/C(=C\c1ccc(F)cc1)c1cccs1)Nc1ccc(Cl)cc1[N+](=O)[O-] 772146173 NRTRHHYVTGVJIW-YBEGLDIGSA-N 460.870 5.171 5 20 JKBD C[C@H](OC(=O)c1ccc(-c2nc3ccccc3s2)o1)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl 773982708 LMLJPLKUWQWQGN-NSHDSACASA-N 471.878 5.302 5 20 JKBD O=C(C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)OCc1nnc(-c2ccco2)o1 804858505 BUYZBOLOMXOKOM-FOWTUZBSSA-N 488.481 5.522 5 20 JKBD O=C(CSc1nnc(-c2ccccc2)c2ccccc12)Nc1cc(Cl)ccc1[N+](=O)[O-] 849209790 SMAVAHSCDNHKCU-UHFFFAOYSA-N 450.907 5.589 5 20 JKBD C[C@H](Oc1ccc(Cl)cc1[N+](=O)[O-])c1nc(C(C)(C)NC(=O)c2cccc(Cl)c2)no1 904595446 DJAGAVXLUPPRDV-NSHDSACASA-N 465.293 5.090 5 20 JKBD Cc1nc2ccccc2c(-c2ccccc2)c1CC(=O)OCc1nc(-c2cccc([N+](=O)[O-])c2)no1 914797941 WDQTWPVHLGMSOD-UHFFFAOYSA-N 480.480 5.454 5 20 JKBD COc1ccc(-c2[nH]c3ccccc3c2CCC(=O)OCc2nc(-c3cccc([N+](=O)[O-])c3)no2)cc1 914798190 UEJLJLVPMCUPJD-UHFFFAOYSA-N 498.495 5.478 5 20 JKBD O=C1CCCc2cc(C(=O)Nc3cc(Cl)c([N+](=O)[O-])cc3OCc3ccccc3)ccc2N1 915139242 XKOIUNRFHPBCJF-UHFFFAOYSA-N 465.893 5.354 5 20 JKBD CC1=C(C(=O)Nc2ccc(F)cc2)[C@H](c2ccccc2[N+](=O)[O-])NC(=S)N1c1ccccc1 916161051 IKASNNHQMRINKH-QFIPXVFZSA-N 462.506 5.082 5 20 JKBD COc1ccc(/C=C(/Cl)c2nc(=O)c3ccc(Cl)cc3[nH]2)cc1OCc1ccc([N+](=O)[O-])cc1 917039522 HUJYGNNTBJIDEX-VXLYETTFSA-N 498.322 5.809 5 20 JKBD COC(=O)Nc1ccc(N[C@@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2ccccc2)cc1 917938973 RKGXZNSCGPWMEG-HXUWFJFHSA-N 454.870 5.218 5 20 JKBD Cc1ccc(S(=O)(=O)c2ccc(COC(=O)Cn3c4ccccc4c(=O)c4ccccc43)cc2)cc1 919054874 CPPDCDWHIRJCPT-UHFFFAOYSA-N 497.572 5.039 5 20 JKBD COCCOc1ccccc1C(=O)Nc1cc(Cl)c([N+](=O)[O-])cc1OCc1ccccc1 919682432 LCBRSKTVMDIOEL-UHFFFAOYSA-N 456.882 5.105 5 20 JKBD CC(C)N(Cc1ccc([N+](=O)[O-])cc1)Cn1nc([C@H](C)N(C)C)n(-c2ccc(Cl)cc2)c1=S 919950383 IWQBRRWATAHTTF-KRWDZBQOSA-N 489.045 5.456 5 20 JKBD O=C(OCc1nnc(C2CC2)o1)c1ccccc1Sc1ccc(C(F)(F)F)cc1[N+](=O)[O-] 920490170 FIXAYIGHIJWQBJ-UHFFFAOYSA-N 465.409 5.382 5 20 JKBD CSc1ccccc1NC(=O)[C@@H](C)OC(=O)c1ccc(N[C@H](C)c2ccccn2)c([N+](=O)[O-])c1 920544976 ORLKLRDLBWKBNO-HZPDHXFCSA-N 480.546 5.069 5 20 JKBD COc1ccc(-c2cc(COC(=O)c3ccc(N[C@@H](C)c4ccccn4)c([N+](=O)[O-])c3)on2)cc1 920545680 HSMSBNRXCWPHTQ-INIZCTEOSA-N 474.473 5.184 5 20 JKBD Cc1ccc2cc(C(=O)NC3(c4ccc(NC(=O)c5ccc([N+](=O)[O-])o5)cc4)CCC3)ccc2n1 1785748970 RXAJLTSJFUDFNC-UHFFFAOYSA-N 470.485 5.106 5 20 JKBD Cc1cc(O)c([N+](=O)[O-])cc1C(=O)NC1(c2ccc(NC(=O)[C@H]3CCCCC3(F)F)cc2)CCC1 1786465769 VFCKJOWBVWHONR-LJQANCHMSA-N 487.503 5.182 5 20 JKBD O=C(NC1(c2ccc(NC(=O)[C@@H]3CCC[C@H]4CCCC[C@@H]43)cc2)CCC1)c1ccc([N+](=O)[O-])[nH]1 1789192144 UHVIFQWTBZCBJN-JRGCBEDISA-N 464.566 5.277 5 20 JKBD O=C(/C=C/c1ccccc1[N+](=O)[O-])NC1(c2ccc(NC(=O)c3cccc4cnccc34)cc2)CCC1 1789327521 IZUXMIYANZUPRN-NTEUORMPSA-N 492.535 5.604 5 20 JKBD Cc1cc(O)c([N+](=O)[O-])cc1C(=O)NC1(c2ccc(NC(=O)CCCCn3cccc3)cc2)CCC1 1789604118 RNHKIXLTESPPRJ-UHFFFAOYSA-N 490.560 5.029 5 20 JKBD Cc1c(C(=O)NC2(c3ccc(NC(=O)c4ccc([N+](=O)[O-])[nH]4)cc3)CCC2)oc2ccccc12 1790186477 VTNMUGLKBLSABW-UHFFFAOYSA-N 458.474 5.039 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)C3CCC(F)(F)CC3)CCC2)cc1)c1ccc([N+](=O)[O-])cc1F 1790621304 XLKQNCIXTHPQHX-UHFFFAOYSA-N 475.467 5.307 5 20 JKBD O=C(Cc1ccc([N+](=O)[O-])cc1F)Nc1ccc(C2(NC(=O)c3cc4sccc4[nH]3)CCC2)cc1 1791183617 JEXBUSWRXHUUIN-UHFFFAOYSA-N 492.532 5.267 5 20 JKBD CC/C=C(\C)C(=O)Nc1ccc(C2(NC(=O)Cn3ccc4ccc([N+](=O)[O-])cc43)CCC2)cc1 1792061939 UWTQMKOKNJKWQG-BLLMUTORSA-N 460.534 5.040 5 20 JKBD Cc1cccnc1CCC(=O)NC1(c2ccc(NC(=O)/C=C/c3ccccc3[N+](=O)[O-])cc2)CCC1 1792315325 BVNXSNTVCPHXED-OQLLNIDSSA-N 484.556 5.078 5 20 JKBD O=C(Cc1ccc(Cl)cc1[N+](=O)[O-])N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1c(Cl)cccc1Cl 1799545142 IOSAILAPPJADCA-MUJYYYPQSA-N 496.778 5.050 5 20 JKBD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc2cc([N+](=O)[O-])ccc2s1)c1csc2c1CCCC2 1801207577 VSZWWSHHBFDZBP-BJWYYQGGSA-N 495.626 5.315 5 20 JKBD C[C@@H](OC(=O)c1ccc(C2SCCS2)cc1)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 9792627 GMZMUAOXYROOHM-LLVKDONJSA-N 486.493 5.276 5 20 JKBD Cc1nc(-c2ccc(Cl)cc2)sc1C(=O)OCc1nnc(-c2ccc([N+](=O)[O-])cc2)o1 10696977 LBRHPLCBSFDFMM-UHFFFAOYSA-N 456.867 5.087 5 20 JKBD CC(=O)N(c1nc(COC(=O)c2ccc(Cl)cc2[N+](=O)[O-])cs1)c1c(C)cc(C)cc1C 10748674 OSGCNJDAPOQQFC-UHFFFAOYSA-N 473.938 5.672 5 20 JKBD O=C(O[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Br)c1ccccc1)c1cc2ccccc2[nH]1 11225983 JJZZQXCJAPOYNP-NRFANRHFSA-N 494.301 5.375 5 20 JKBD C[C@H](OC(=O)c1cc(-c2ccco2)nc2ccccc12)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl 11398164 AGVRWZBIJPMOND-ZDUSSCGKSA-N 465.849 5.240 5 20 JKBD O=C(Nc1ccc(NC(=O)c2ccc([N+](=O)[O-])cc2Cl)c(C(F)(F)F)c1)c1ccco1 14367048 BFMBNUFBTLILMD-UHFFFAOYSA-N 453.760 5.365 5 20 JKBD Cc1ccc(NC(=O)[C@@H](Sc2nnc(C3CC3)n2Cc2ccco2)c2ccccc2)c([N+](=O)[O-])c1 21623245 FSZSRVPZRPOZPR-QFIPXVFZSA-N 489.557 5.486 5 20 JKBD Cc1c(NC(=O)[C@@H](C)OC(=O)Cc2csc(-c3ccc(C(C)C)cc3)n2)cccc1[N+](=O)[O-] 22390220 OMWUQYWCPXLGSH-MRXNPFEDSA-N 467.547 5.263 5 20 JKBD CC(=O)c1ccc(-c2ccc(C(=O)O[C@@H](C)C(=O)Nc3ccc([N+](=O)[O-])cc3C(F)(F)F)o2)cc1 22847313 XQVFPYVMJGMVGQ-ZDUSSCGKSA-N 490.390 5.260 5 20 JKBD O=[N+]([O-])c1ccc(-c2nnc(CN3CCN(Cc4ccc(-c5ccccc5Cl)s4)CC3)o2)cc1 27903696 XABRGZSSTJUERU-UHFFFAOYSA-N 495.992 5.345 5 20 JKBD Cc1ccc(-n2c(SCC(=O)Nc3ccc([N+](=O)[O-])cc3Cl)nnc2-c2ccccn2)c(C)c1 68728090 BMMDPMTVZLLJOE-UHFFFAOYSA-N 494.964 5.239 5 20 JKBD COc1ccc(CSCC(=O)N[C@@H](c2ccc(Cl)cc2)c2ccsc2)cc1[N+](=O)[O-] 108944738 QXYQFMZDWVMVIR-NRFANRHFSA-N 462.980 5.457 5 20 JKBD Cc1ccc(-c2nnc3n2CCCCC3)cc1NC(=O)c1cc([N+](=O)[O-])ccc1NCc1ccccc1 477746269 QDJJBJKCVHXXIT-UHFFFAOYSA-N 496.571 5.753 5 20 JKBD CC(C)(CNC(=O)Cn1c2ccccc2c(=O)c2ccccc21)c1ccc(Br)cc1 481456621 UHYNJLJRQBZZSY-UHFFFAOYSA-N 463.375 5.011 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)Nc2ncc(Cc3ccc(Br)cc3)s2)cc1SC 482018799 XOWRNQNRYNXOHW-UHFFFAOYSA-N 494.392 5.387 5 20 JKBD O=C(Nc1ccc(F)c(NC(=O)C2CCCCC2)c1)c1csc(-c2cccc([N+](=O)[O-])c2)n1 496242105 DBZJUBGCWJNLJZ-UHFFFAOYSA-N 468.510 5.629 5 20 JKBD COc1ccc(CNCc2cc(Cl)c3c(c2)OCCCO3)cc1OCc1ccc([N+](=O)[O-])cc1 508330922 XFMKWHCPVAFNAG-UHFFFAOYSA-N 484.936 5.287 5 20 JKBD CCc1cccc(Cc2cnc(NC(=O)c3ccc([N+](=O)[O-])cc3I)s2)c1 512195754 KLRFXGIGIIQKEI-UHFFFAOYSA-N 493.326 5.061 5 20 JKBD CO[C@@H](C)C(=O)Nc1cccc(N[C@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2ccccc2)c1 520466938 KLLPEUHUKFSONY-NYHFZMIOSA-N 482.924 5.014 5 20 JKBD COc1ccc(COCc2cccc(NC(=O)[C@@H](C)Oc3ccc(Cl)cc3[N+](=O)[O-])c2)cc1 520674646 DMYMOEWXJQCHMC-MRXNPFEDSA-N 470.909 5.380 5 20 JKBD O=[N+]([O-])c1ccc(-c2ccc(CNC[C@@H]3CCCO[C@@H]3c3ccccc3)o2)c(Br)c1 521830314 RXKKMFZMBYJMPW-GAJHUEQPSA-N 471.351 5.875 5 20 JKBD Cc1nn(Cc2ccc(C(=O)NCc3cccc(NC(=O)Nc4ccccc4)c3)cc2)c(C)c1[N+](=O)[O-] 524352190 QWXJLFNCDACQHL-UHFFFAOYSA-N 498.543 5.030 5 20 JKBD Cc1ccc(C(C)C)c(Oc2ccc(CNCc3cccc(NS(C)(=O)=O)c3)cc2[N+](=O)[O-])c1 556204526 CASQABLQCGKBFX-UHFFFAOYSA-N 483.590 5.480 5 20 JKBD O=C(C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)N1CC=C(c2ccc(O)cc2)CC1 592629493 QFZPGITXBOXKSH-OQKWZONESA-N 497.576 6.157 5 20 JKBD CCOc1cc([N+](=O)[O-])c(C(=O)Nc2nc(C)c(Cc3cccc(Cl)c3)s2)cc1OC 603973575 QORNJVLFVHRELF-UHFFFAOYSA-N 461.927 5.264 5 20 JKBD O=C(NC[C@H](c1ccccc1)c1c[nH]c2ccccc12)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-] 604078192 SLQSIARXUPJRKA-HXUWFJFHSA-N 483.446 5.579 5 20 JKBD O=C(Nc1ccc(NC(=O)c2cc(OCC(F)(F)F)ccc2[N+](=O)[O-])cc1Cl)c1ccco1 604119575 KOVYNEXRQYGBNT-UHFFFAOYSA-N 483.786 5.287 5 20 JKBD COc1cc(C(=O)N2CCO[C@H](c3cccc(F)c3)C2)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 608965114 QONVAGRSCBKPGV-QHCPKHFHSA-N 486.883 5.402 5 20 JKBD O=C(Cn1c2ccccc2c(=O)c2ccccc21)NCC1(c2ccc(Br)cc2)CCC1 617419394 QISXLMPUGHSYFY-UHFFFAOYSA-N 475.386 5.155 5 20 JKBD O=C(c1cc([N+](=O)[O-])ccc1N1CCCCC1)N1CCC[C@H](c2nc(-c3ccc(Cl)cc3)no2)C1 726539601 JMKFJCNJFDWLMZ-SFHVURJKSA-N 495.967 5.308 5 20 JKBD Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)Oc1ccc(C(=O)Nc2ccc(F)cc2C(F)(F)F)cc1 728006288 HWTWPYLAZZWDKD-UHFFFAOYSA-N 498.410 5.081 5 20 JKBD O=C(OC[C@H]1CCCN1C(=O)c1ccccc1[N+](=O)[O-])c1sc2cc(F)ccc2c1Cl 730704626 PRBBBLHSAMQUBZ-CYBMUJFWSA-N 462.886 5.064 5 20 JKBD O=C(COC(=O)c1csc(-c2cccc([N+](=O)[O-])c2)n1)Nc1ccc(Oc2ccccc2)cc1 747961031 DGKKBOFUYLYUFN-UHFFFAOYSA-N 475.482 5.306 5 20 JKBD Cc1sc(NC(=O)c2cc([N+](=O)[O-])ccc2Br)nc1-c1ccc(OC(F)F)cc1 751061134 CDYGVIKAWQPGQX-UHFFFAOYSA-N 484.278 5.643 5 20 JKBD COc1ccc(C(=O)Nc2cc(Cl)c([N+](=O)[O-])cc2OCc2ccccc2)c(Br)c1 751064995 RNPYZBRWNQXTLB-UHFFFAOYSA-N 491.725 5.851 5 20 JKBD Cc1cc(C(=O)Oc2ccc(NC(=O)c3cccc([N+](=O)[O-])c3)cc2)c(C)n1CC(F)(F)F 793465501 UKEKTQCVLXNQIE-UHFFFAOYSA-N 461.396 5.047 5 20 JKBD Cc1ccc(OC(=O)[C@@H](C)SCc2nc(O)c3c(-c4ccccc4)csc3n2)c([N+](=O)[O-])c1 818037587 RABWMLTUVWOQPZ-CQSZACIVSA-N 481.555 5.508 5 20 JKBD CC(C)(C)OC(=O)N1CCO[C@@H](c2ccc(NCc3ccc(C(F)(F)F)cc3[N+](=O)[O-])cc2)C1 864041477 OZJIESDYMHXSLE-HXUWFJFHSA-N 481.471 5.534 5 20 JKBD O=C(OCC(=O)N1c2ccccc2Sc2ccccc21)c1cc2cc([N+](=O)[O-])ccc2s1 916541087 HOOZKCODLAUOKO-UHFFFAOYSA-N 462.508 5.796 5 20 JKBD CCCc1c(C(=O)Oc2ccc(NC(=O)c3cc([N+](=O)[O-])ccc3Cl)cc2)[nH]c(C)c1C(C)=O 916952051 OKNBEHKUEBMRMS-UHFFFAOYSA-N 483.908 5.511 5 20 JKBD CC(C)N(Cc1nnc(-c2cccc([N+](=O)[O-])c2)o1)C(=O)c1ccc(-c2ccc(F)cc2)s1 917205470 DDSKWSHIUWFFGI-UHFFFAOYSA-N 466.494 5.563 5 20 JKBD COc1ccc(NC(=O)[C@H]2CCCN2C(=O)c2ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])cc2)cc1 918568334 CZCLGVZMAILBPB-OAQYLSRUSA-N 495.919 5.292 5 20 JKBD C[C@@H](OC(=O)COc1ccc2cc(Br)ccc2c1)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 919381923 OWVCYQZHNBPDFJ-CYBMUJFWSA-N 498.289 5.244 5 20 JKBD COc1ccc(C(=O)NC2(c3ccc(NC(=O)Cn4ccc5ccc([N+](=O)[O-])cc54)cc3)CCC2)cc1 1786277087 JZHIEQGGVQMCPW-UHFFFAOYSA-N 498.539 5.006 5 20 JKBD O=C(Cc1cc(F)ccc1[N+](=O)[O-])Nc1ccc(C2(NC(=O)c3cc4[nH]ccc4s3)CCC2)cc1 1792308716 CSOVNWWEYMPOJL-UHFFFAOYSA-N 492.532 5.267 5 20 JKBD CC(C)(C)c1ccc(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)c3cc(O)cc([N+](=O)[O-])c3)[nH]n2)s1 1818343524 ZIPITUYAMSMOPF-SFHVURJKSA-N 497.577 5.002 5 20 JKBD O=C(Nc1cc([C@H]2CCCCN2C(=O)c2cccc3c2oc2ccccc23)[nH]n1)c1ccc([N+](=O)[O-])[nH]1 1820366704 GDWYOBRPKLHHPI-HXUWFJFHSA-N 498.499 5.165 5 20 JKBD CC(C)c1csc(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)CCc3cccc([N+](=O)[O-])c3)CC2)n1 1825383660 UNFPUOWRQSRLLP-HSZRJFAPSA-N 498.649 5.041 5 20 JKBD CC(C)(C)c1cc(C(=O)N2CCCC[C@H]2C2CCN(C(=O)CCc3cccc([N+](=O)[O-])c3)CC2)c[nH]1 1825437555 WOOILPATJVLWIV-DEOSSOPVSA-N 494.636 5.087 5 20 JKBD O=C(c1ccc([N+](=O)[O-])o1)N1CCC([C@@H]2CCCCN2C(=O)c2cc3cc(F)ccc3s2)CC1 1828602192 WCCPZEZLAKITKJ-SFHVURJKSA-N 485.537 5.089 5 20 JKBD Cc1ccc(CC(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3ccc4occc4c3)CC2)cc1[N+](=O)[O-] 1830367518 YLBBTQJXAQSPGC-XMMPIXPASA-N 489.572 5.125 5 20 JKBD O=C(C1CC(F)(F)C1)N1CCC([C@@H]2CCCCN2C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)CC1 1831059450 GIPVDBPDHSWQLG-IBGZPJMESA-N 491.560 5.088 5 20 JKBD C[C@H](C(=O)N1CCCC[C@H]1C1CCN(C(=O)CCc2cccc([N+](=O)[O-])c2)CC1)c1cccs1 1832137700 BZNPQJPDHJCSSY-CVDCTZTESA-N 483.634 5.012 5 20 JKBD C[C@@H](C(=O)N1CCCC[C@H]1C1CCN(C(=O)/C=C/c2ccccc2[N+](=O)[O-])CC1)c1ccccc1 1832900545 OLVAZRFLGJESLR-ALQDDPBUSA-N 475.589 5.031 5 20 JKBD CCCCn1c(S[C@@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)nc2ccccc2c1=O 17536603 ODEFCVITAHYBTB-AWEZNQCLSA-N 451.508 5.008 5 20 JKBD C[C@@H](Sc1nnc(-c2ccco2)n1Cc1ccccc1)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 17653117 CGBWRDOIJUBAKJ-OAHLLOKOSA-N 474.502 5.398 5 20 JKBD Cc1cccc(-c2nnc(S[C@@H](C)C(=O)Nc3ccc([N+](=O)[O-])cc3Cl)n2Cc2ccco2)c1 22045547 SZDZRJVZSNHIHZ-HNNXBMFYSA-N 497.964 5.576 5 20 JKBD COc1cccc([C@H](CNC(=O)Nc2cccc([N+](=O)[O-])c2)c2c[nH]c3ccccc23)c1OC 24367339 FFIMUPKKIFPNTK-NRFANRHFSA-N 460.490 5.047 5 20 JKBD C[C@@H](Sc1nnc(NCCc2cccs2)s1)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 45619611 UQQNSCLIYLMNLS-LLVKDONJSA-N 460.566 5.066 5 20 JKBD O=[N+]([O-])c1ccc(-c2noc(CSc3nnc(Nc4cccc(Br)c4)s3)n2)cc1 46864945 XODPAUCQZUXIRF-UHFFFAOYSA-N 491.352 5.295 5 20 JKBD Cc1c(C(=O)N2CC[C@H](C)Sc3ccc(C(F)(F)F)cc32)nnn1-c1cccc([N+](=O)[O-])c1 195695791 SNHDKHXLFKTVNI-LBPRGKRZSA-N 477.468 5.034 5 20 JKBD COCCOc1c(Cl)cccc1NC(=O)c1ccc(NCc2ccccc2Cl)c([N+](=O)[O-])c1 303007296 JAYYGDBBPDLKDK-UHFFFAOYSA-N 490.343 5.791 5 20 JKBD CC(C)Cc1ccc(C(=O)C2CCN(C(=O)c3csc(-c4ccc([N+](=O)[O-])cc4)n3)CC2)cc1 303029893 NTNKRQADFYCQLZ-UHFFFAOYSA-N 477.586 5.652 5 20 JKBD C[C@@H](NC(=O)C1CCN(c2ccccc2[N+](=O)[O-])CC1)c1ccc(NC(=O)Nc2ccccc2)cc1 480803341 GBWOMOLMMZDKPD-LJQANCHMSA-N 487.560 5.333 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)Nc2cccc(C(=O)Nc3ccccc3)c2C)cc1SC 483579275 AQGJJQACBGMQIP-UHFFFAOYSA-N 451.504 5.138 5 20 JKBD CNC(=O)Nc1cccc(NC(=O)C/C(=C\c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)c1 485227834 DJXMQNWCPQZCHF-GHRIWEEISA-N 487.541 5.525 5 20 JKBD C[C@H](c1ccccc1F)N(C)C(=O)Cc1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1 498330356 PNBCWTWENKRFRK-GOSISDBHSA-N 458.493 5.349 5 20 JKBD COc1cc(C(=O)N(C)c2ccc(Oc3ccccc3)cc2)c([N+](=O)[O-])cc1OCc1cscn1 503399322 UUAVFNYZPKWZNB-UHFFFAOYSA-N 491.525 5.708 5 20 JKBD O=C(c1ccc(Nc2ccccc2)c([N+](=O)[O-])c1)N1CCC[C@@H](c2nc(-c3cccc(F)c3)no2)C1 507990250 RANFZSBOVDCQGO-LJQANCHMSA-N 487.491 5.547 5 20 JKBD COc1cc(C(=O)Nc2ccc(Sc3ccccc3)cc2C)c([N+](=O)[O-])cc1OC(F)F 512856839 OXJWAQOQIWQSTQ-UHFFFAOYSA-N 460.458 5.917 5 20 JKBD COc1ccc(CNC(=O)c2cc([N+](=O)[O-])ccc2Sc2ccccc2)cc1OC(F)F 512907624 SJXTWESCINFLEE-UHFFFAOYSA-N 460.458 5.286 5 20 JKBD CC(C)c1noc(CCCNC(=O)c2ccccc2Sc2ccc(C(F)(F)F)cc2[N+](=O)[O-])n1 519936719 LCZWIRMFFZPPTK-UHFFFAOYSA-N 494.495 5.634 5 20 JKBD CC(=O)Nc1ccc(C(F)(F)F)cc1NC(=O)c1ccc(N2CCC(C)CC2)c([N+](=O)[O-])c1 521239610 YGPZWZYMNPNQRR-UHFFFAOYSA-N 464.444 5.061 5 20 JKBD C[C@H](NC(=O)CSc1ccc(C(F)(F)F)cc1[N+](=O)[O-])c1cccc(OC(F)F)c1 603665230 SNMPYJNGYGYLGI-JTQLQIEISA-N 450.385 5.185 5 20 JKBD C[C@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccc(NC(=O)c2ccoc2)cc1C(F)(F)F 603761317 DEPRIHWPHGXVJY-LBPRGKRZSA-N 479.436 5.578 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Cl)[C@H](NCc1cc(F)cc(Br)c1)c1ccccc1 604047445 RBUSJVJQQUFOSC-HXUWFJFHSA-N 492.732 5.619 5 20 JKBD CC(C)N(C)Cc1ccccc1CNCc1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1 608836326 JJAFCQINOXPINT-UHFFFAOYSA-N 469.589 5.578 5 20 JKBD O=C(Nc1ccccc1)Nc1cccc(CNC(=O)c2cc(OCC(F)(F)F)ccc2[N+](=O)[O-])c1 609044662 KFJYQIAHSMFLDC-UHFFFAOYSA-N 488.422 5.110 5 20 JKBD C[C@@H](Sc1ncnc2sc3c(c12)CCCC3)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 619835578 NNJYMIIYFPMBTP-SNVBAGLBSA-N 482.509 5.616 5 20 JKBD Cc1cnc(-c2cccc(NC(=O)c3ccccc3NC(=O)c3ccc([N+](=O)[O-])cc3Cl)c2)o1 731353233 KMKJHZOOQSTHOS-UHFFFAOYSA-N 476.876 5.716 5 20 JKBD CC(C)(C)OC(=O)NCCNC(=O)c1ccccc1Sc1ccc(C(F)(F)F)cc1[N+](=O)[O-] 742462612 IYFMJHLDSPAWDV-UHFFFAOYSA-N 485.484 5.019 5 20 JKBD NC(=O)c1ccc(COC(=O)c2oc3ccccc3c2CSc2cccs2)c([N+](=O)[O-])c1 742975278 ZBODOVDURSFKHK-UHFFFAOYSA-N 468.512 5.151 5 20 JKBD Cc1c(C(=O)O[C@@H](C)c2nc(-c3cccc(C(F)(F)F)c3)no2)cc([N+](=O)[O-])c(C)c1[N+](=O)[O-] 748946372 HGCHHWNYZSVPAL-NSHDSACASA-N 480.355 5.107 5 20 JKBD O=C(CC12C[C@H]3C[C@@H](CC(O)(C3)C1)C2)O[C@@H](C(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1)c1ccccc1 750508446 YAJMJAWGOKOMCV-JOTUPZIKSA-N 498.963 5.193 5 20 JKBD C[C@H](Sc1nc2ccc([N+](=O)[O-])cc2s1)c1nc(O)c2c(-c3ccccc3)csc2n1 788009346 MTXQKNIZZXHKIP-NSHDSACASA-N 466.569 6.435 5 20 JKBD O=[N+]([O-])c1ccc(F)cc1CSc1nnc(Cc2cccs2)n1CCc1ccccc1 915789820 OEZDOPGNNFBAGH-UHFFFAOYSA-N 454.552 5.513 5 20 JKBD CCOc1cc(Br)c(NC(=O)c2ccc(Br)c([N+](=O)[O-])c2)cc1OCC 920012969 LYWGKHLSJDXNMM-UHFFFAOYSA-N 488.132 5.170 5 20 JKBD CN(C(=O)C(C)(C)C)c1ccc(OC(=O)CSc2ccc(C(F)(F)F)cc2[N+](=O)[O-])cc1 929085436 UXAFGHWTXVQENF-UHFFFAOYSA-N 470.469 5.320 5 20 JKBD O=C(Cc1cccc([N+](=O)[O-])c1)NC1(c2ccc(NC(=O)c3cccc4cccnc34)cc2)CCC1 1788909538 RVDKKGIBUWDXLA-UHFFFAOYSA-N 480.524 5.133 5 20 JKBD CCc1ncsc1C(=O)Nc1ccc(C2(NC(=O)Cc3ccc(Cl)cc3[N+](=O)[O-])CCC2)cc1 1790197577 KIDWTUCTYAGYDA-UHFFFAOYSA-N 498.992 5.258 5 20 JKBD COc1ccc(CC(=O)Nc2ccc(C3(NC(=O)/C=C/c4ccsc4)CCC3)cc2)c([N+](=O)[O-])c1 1790571107 ZHIMRJHWNYRJFD-XCVCLJGOSA-N 491.569 5.055 5 20 JKBD Cc1ccc(C(=O)N2CCCC3(CCN(C(=O)c4cc(Cl)cc([N+](=O)[O-])c4C)CC3)C2)s1 1808096328 CAAPLBZSIKHZRD-UHFFFAOYSA-N 475.998 5.085 5 20 JKBD O=C(CCC1CCCC1)N1CCC([C@@H]2CCCCN2C(=O)CSc2ccccc2[N+](=O)[O-])CC1 1831776214 LDUUIZLTTAYCFM-QFIPXVFZSA-N 487.666 5.277 5 20 JKBD O=C(CCNc1ccc(C(F)(F)F)cc1[N+](=O)[O-])N1CCC[C@@H]1c1nc2ccccc2s1 15603506 XJVCJSRSELHUIU-MRXNPFEDSA-N 464.469 5.389 5 20 JKBD Cc1csc(Sc2ccc(C(=O)O[C@H](C)C(=O)Nc3c(C)cccc3C)cc2[N+](=O)[O-])n1 16903637 VKVSBVYGGXKFAW-OAHLLOKOSA-N 471.560 5.312 5 20 JKBD C[C@@H](OC(=O)c1ccccc1C(=O)c1ccc(Cl)cc1)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 17483757 OLNXPSPBXWFLNK-CQSZACIVSA-N 477.860 5.447 5 20 JKBD CCOc1ccc(NC(=O)CSc2nnc(-c3ccc(C(C)(C)C)cc3)o2)c([N+](=O)[O-])c1 22249567 VHAQUMMGTZAGLS-UHFFFAOYSA-N 456.524 5.072 5 20 JKBD O=C(Nc1ccc2oc(=O)[nH]c2c1)c1ccc(Sc2nc3ccccc3s2)c([N+](=O)[O-])c1 29836589 CJCJCLLAIVILCQ-UHFFFAOYSA-N 464.484 5.043 5 20 JKBD COCCN(Cc1cccs1)C(=O)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])c(OC)c1 39535715 SBSPGVZOVODYPY-UHFFFAOYSA-N 476.938 5.399 5 20 JKBD O=[N+]([O-])c1cccc(F)c1CSc1nnc(COc2ccccc2F)n1-c1ccccc1 78412156 PTGQGBUMTYRSGU-UHFFFAOYSA-N 454.458 5.325 5 20 JKBD COc1cc(C(=O)N2C[C@H](C)O[C@H](c3ccccc3)C2)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 109045924 XOKQXPMZBKDCIU-FYSMJZIKSA-N 482.920 5.651 5 20 JKBD CCN(Cc1ccc(OCc2cccs2)c(OC)c1)C(=O)c1c[nH]c2ccc([N+](=O)[O-])cc12 109935635 UIOBTEYYOXGSHZ-UHFFFAOYSA-N 465.531 5.388 5 20 JKBD C[C@H](Nc1ccc(C(=O)NCc2ccccc2OCC(F)(F)F)cc1[N+](=O)[O-])c1ccccn1 410092357 ZCXSGTMPFVDVGO-HNNXBMFYSA-N 474.439 5.034 5 20 JKBD O=C(N[C@@H]1CCN2CCCC[C@H]12)c1ccccc1Sc1ccc(C(F)(F)F)cc1[N+](=O)[O-] 481415615 PAPBQUMPMOMLNJ-IAGOWNOFSA-N 465.497 5.121 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)NCc2ccc(OC(C)C)cc2C(F)(F)F)cc1SC 483644030 QAHVAFABBRNTPQ-UHFFFAOYSA-N 458.458 5.061 5 20 JKBD Cc1cccn2cc(-c3ccc(NC(=O)c4cc(OCC(F)(F)F)ccc4[N+](=O)[O-])cc3)nc12 485147822 HXJWHPUTMFNKRA-UHFFFAOYSA-N 470.407 5.411 5 20 JKBD Cc1nn(Cc2ccc(C(=O)Nc3ccccc3-c3n[nH]c(-c4ccccc4)n3)cc2)c(C)c1[N+](=O)[O-] 489065956 GYFLMHQQPVXVST-UHFFFAOYSA-N 493.527 5.161 5 20 JKBD O=C(c1ccc(NCc2ccccc2Cl)c([N+](=O)[O-])c1)N1CCC(OC2CCCCC2)CC1 495666912 GAWCNMOALMXMSG-UHFFFAOYSA-N 471.985 5.814 5 20 JKBD CC[C@@H](C)Sc1ccc(NC(=O)Cn2c3ccccc3c(=O)c3ccccc32)c(C(F)(F)F)c1 499582611 SBPBAVRUSUOEDH-MRXNPFEDSA-N 484.543 6.703 5 20 JKBD C[C@@H](Nc1ccc(C(=O)N2CCC[C@@H]2c2nc3ccccc3n2C)cc1[N+](=O)[O-])c1ccccn1 503153292 DKKFYQVBIOZKOT-UZUQRXQVSA-N 470.533 5.027 5 20 JKBD Cc1nn(Cc2ccc(C(=O)Nc3ccc(Oc4ccncc4)c(Cl)c3)cc2)c(C)c1[N+](=O)[O-] 505829434 FQPRBNWNEVEGDT-UHFFFAOYSA-N 477.908 5.549 5 20 JKBD COc1cc(C(=O)Nc2ccc3c(c2)Cc2ccccc2-3)c([N+](=O)[O-])cc1OCc1cscn1 509866835 DLAVBCKEJIBYKL-UHFFFAOYSA-N 473.510 5.462 5 20 JKBD CCOc1ccc(C(=O)Nc2ccc(Cl)cc2C(=O)N2[C@@H](C)CCC[C@H]2C)cc1[N+](=O)[O-] 512352359 MSSNPLJXLZQZHU-GASCZTMLSA-N 459.930 5.302 5 20 JKBD COc1cc(CN[C@H](C)c2cccc([N+](=O)[O-])c2)cc(Br)c1OCc1ccccc1 513110762 SUGNSIDZAGNHAT-MRXNPFEDSA-N 471.351 5.796 5 20 JKBD Cn1c(SCc2nnc(-c3ccc(Cl)cc3Cl)o2)nc2cc3ccccc3cc2c1=O 513270746 HAVQEAXVHXUTOH-UHFFFAOYSA-N 469.353 5.736 5 20 JKBD O=C(Nc1cc(-c2nnc3n2CCCCC3)ccc1Cl)c1ccc(NC2CC2)c([N+](=O)[O-])c1 514926770 ORJAVERDQBNTQZ-UHFFFAOYSA-N 466.929 5.060 5 20 JKBD CC(C)N(Cc1ccc(-c2cccc(F)c2)s1)C(=O)c1ccc(-n2cncn2)c([N+](=O)[O-])c1 516374013 BYYQFBMBTBJKFC-UHFFFAOYSA-N 465.510 5.094 5 20 JKBD O=C(Nc1ccc(-c2nnc3n2CCCC3)cc1)c1cc([N+](=O)[O-])ccc1Sc1ccccc1 518727028 GNKYSWPKDZDTAG-UHFFFAOYSA-N 471.542 5.593 5 20 JKBD CCCC(CCC)SCC(=O)Nc1c(Br)cc([N+](=O)[O-])cc1Br 520165504 GNZFCVOMGKBMCL-UHFFFAOYSA-N 468.211 5.760 5 20 JKBD CC(C)C[C@H](NC(=O)c1ccc(N[C@H](C)c2ccccn2)c([N+](=O)[O-])c1)c1nc2ccccc2[nH]1 520614517 QSKMSBCLLWMCOK-HXOBKFHXSA-N 472.549 5.556 5 20 JKBD CCCN(C(=O)NCCc1cc(OC)c(OC)cc1[N+](=O)[O-])[C@@H](C)c1cc2ccccc2o1 521062409 JUWGOIPLGRLTCZ-INIZCTEOSA-N 455.511 5.084 5 20 JKBD Cc1ccc(C(=O)N(C[C@H]2CCCO2)c2nc(-c3cccc(C(F)(F)F)c3)cs2)cc1[N+](=O)[O-] 592950478 PKAKFQXPVKLWIC-GOSISDBHSA-N 491.491 5.871 5 20 JKBD CCCOc1cc(NC(=O)N(C)Cc2ccc(Br)o2)c([N+](=O)[O-])cc1OCCC 603652584 ILNFGTUQBAKHTH-UHFFFAOYSA-N 470.320 5.192 5 20 JKBD CC1CCN(c2ccc(C(=O)Nc3cccc(NC(=O)c4ccccc4)c3)cc2[N+](=O)[O-])CC1 603913538 FZFFRAHCNZOKTQ-UHFFFAOYSA-N 458.518 5.336 5 20 JKBD O=[N+]([O-])c1ccc(-c2noc(CNC(c3ccc(Cl)cc3)c3ccc(Cl)cc3)n2)cc1 604008852 UNCZNIPEUMZSTD-UHFFFAOYSA-N 455.301 5.831 5 20 JKBD O=C(Nc1ccccc1)[C@H]1CCc2ccccc2N1C(=O)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-] 608871255 AMNGYYUHSUOULU-JOCHJYFZSA-N 499.445 5.136 5 20 JKBD Cc1c(NC(=O)c2ccc(Br)c([N+](=O)[O-])c2)cccc1C(=O)Nc1ccccc1 748198622 CMJSSRIYPYSLDS-UHFFFAOYSA-N 454.280 5.170 5 20 JKBD Cc1onc(-c2ccccc2Cl)c1C(=O)O[C@@H](C)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl 763060704 XDKVDSKBVDGFBE-NSHDSACASA-N 464.261 5.049 5 20 JKBD COc1ccc(-c2cc3[nH]c(/C(Cl)=C\c4ccc(O)c([N+](=O)[O-])c4)nc(=O)c3s2)cc1 797250645 ZODSIGAWSBZRLH-RIYZIHGNSA-N 455.879 5.011 5 20 JKBD Cc1ccc(-c2cnc(CCC(=O)Oc3ccc(NC(=O)c4cccc([N+](=O)[O-])c4)cc3)o2)cc1 821795173 VFMOLRGWOMGXAR-UHFFFAOYSA-N 471.469 5.349 5 20 JKBD CC(=O)Nc1cc(NC(=O)c2cc([N+](=O)[O-])ccc2N2CCC(Cc3ccccc3)CC2)ccc1F 875191451 ZDRQBRZNTXZHDN-UHFFFAOYSA-N 490.535 5.404 5 20 JKBD Cc1cc(C(N)=O)ccc1NC(=O)c1c2c(nc3ccccc13)/C(=C/c1ccc([N+](=O)[O-])cc1)CCC2 915177405 SUSADHNKFUCCLV-KNTRCKAVSA-N 492.535 5.680 5 20 JKBD O=C(Nc1cccc(CN2CCOC2=O)c1)c1cc([N+](=O)[O-])ccc1Sc1ccc(Cl)cc1 916077712 JCYZUUJZZHHPSD-UHFFFAOYSA-N 483.933 5.604 5 20 JKBD O=C(COc1ccccc1C(=O)Nc1cc([N+](=O)[O-])ccc1F)Nc1cccc(C(F)(F)F)c1 916667049 HPVQVQQGPUPADX-UHFFFAOYSA-N 477.370 5.023 5 20 JKBD C[C@H](OC(=O)CCn1c2ccccc2c2ccccc21)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 919301144 ZAZKXGRGCLVWCZ-INIZCTEOSA-N 456.458 5.447 5 20 JKBD O=C(Cc1cccc([N+](=O)[O-])c1)Nc1ccc(C2(NC(=O)CCCC(F)(F)F)CCC2)cc1 1785792347 XIPIJHZQYQQWKR-UHFFFAOYSA-N 463.456 5.004 5 20 JKBD O=C(CCC1CCCC1)Nc1ccc(C2(NC(=O)c3cc(O)cc([N+](=O)[O-])c3)CCC2)cc1 1787619647 UQDOUZKTUSBUSN-UHFFFAOYSA-N 451.523 5.019 5 20 JKBD O=C(Cc1ccc([N+](=O)[O-])cc1F)NC1(c2ccc(NC(=O)c3cc4sccn4c3)cc2)CCC1 1788413826 KXMJSHVOZJWEQV-UHFFFAOYSA-N 492.532 5.039 5 20 JKBD COc1cc(C(=O)NC2(c3ccc(NC(=O)c4ccccc4Cl)cc3)CCC2)c([N+](=O)[O-])cc1O 1790225213 XSPSFNAEJWPOKL-UHFFFAOYSA-N 495.919 5.024 5 20 JKBD CCC1(C(=O)NC[C@H]2CCN(C(=O)c3cc4cc([N+](=O)[O-])ccc4s3)[C@@H]2c2cccnc2)CCC1 1809648507 AVQAVFHHANNMHQ-WZONZLPQSA-N 492.601 5.104 5 20 JKBD O=C(/C=C/c1ccoc1)Nc1cc([C@H]2CCCCN2C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)[nH]n1 1815751555 BOEVTVVUIZXZJL-ZLHKHBAESA-N 491.529 5.145 5 20 JKBD COc1cc(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)[C@H]3CC[C@H](C(C)C)CC3)n[nH]2)ccc1[N+](=O)[O-] 1822105227 VAKHWORTCFVMKG-DBXWQHBBSA-N 497.596 5.095 5 20 JKBD CC(C)c1ccc(C(=O)N2CCC([C@H]3CCCCN3C(=O)/C=C/c3ccc([N+](=O)[O-])o3)CC2)cc1 1824276516 VIWVDKZUVJUAIY-IYNHSRRRSA-N 479.577 5.258 5 20 JKBD O=C(c1csc2c1CCCC2)N1CCC([C@@H]2CCCCN2C(=O)/C=C/c2ccc([N+](=O)[O-])o2)CC1 1824277546 RRJXVBZXUGXMBN-RCHCNPRSSA-N 497.617 5.075 5 20 JKBD Cc1csc(CCC(=O)N2CCC([C@H]3CCCCN3C(=O)CCc3cccc([N+](=O)[O-])c3)CC2)c1 1824838675 OCLHHRMHPLLMQX-RUZDIDTESA-N 497.661 5.150 5 20 JKBD Cc1c(C(=O)N2CCC([C@H]3CCCCN3C(=O)c3cccc(F)c3)CC2)cc(Cl)cc1[N+](=O)[O-] 1829963253 ZFXLBTRPCGMTER-JOCHJYFZSA-N 487.959 5.243 5 20 JKBD CC(C)=CCCC(=O)N1CCC([C@@H]2CCCCN2C(=O)C2(c3cccc([N+](=O)[O-])c3)CCC2)CC1 1830293190 VGOUBCDTYFTQJE-VWLOTQADSA-N 481.637 5.383 5 20 JKBD C[C@@H](CC(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cc(F)cc([N+](=O)[O-])c2)CC1)c1ccccc1 1830615469 GVZJGTPKWHTIKI-DFBJGRDBSA-N 481.568 5.161 5 20 JKBD Cc1ccc(-c2cc(C(=O)O[C@H](C)C(=O)Nc3ccccc3[N+](=O)[O-])c3cnn(C(C)C)c3n2)s1 11261273 INLLFHFDTOQKJC-OAHLLOKOSA-N 493.545 5.141 5 20 JKBD O=C(c1ccccc1)C1CCN([C@@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2ccccc2)CC1 14320293 PJABMMYTBVFTEX-XMMPIXPASA-N 477.948 5.523 5 20 JKBD Cc1sc2ncnc(S[C@@H](C)C(=O)Nc3ccc([N+](=O)[O-])cc3C(F)(F)F)c2c1C 21359271 PSTMJLXTZSKCOA-JTQLQIEISA-N 456.471 5.354 5 20 JKBD COc1ccc(NC(=O)[C@H](C)Sc2nc3ccccc3c3nc4ccccc4n23)c(OC)c1 21767912 ANBGKDCUPNYZCW-HNNXBMFYSA-N 458.543 5.172 5 20 JKBD CCn1c(SCC(=O)Nc2ccc(C)cc2Br)nc2cc3ccccc3cc2c1=O 22177893 WNMRUTLDRUZRTI-UHFFFAOYSA-N 482.403 5.371 5 20 JKBD CC(=O)N(c1ccccc1)c1nc(CSc2nc3cc4ccccc4cc3c(=O)n2C)cs1 22254425 PBYRJJUGMVRFAP-UHFFFAOYSA-N 472.595 5.520 5 20 JKBD COc1ccc([C@H]2CCCCCN2C(=O)c2ccc(Cn3nc(C)c([N+](=O)[O-])c3C)cc2)cc1 24393058 FIGIIYQHJFPMNJ-XMMPIXPASA-N 462.550 5.223 5 20 JKBD COc1cc([N+](=O)[O-])ccc1NC(=O)CCSc1nnc(-c2cccs2)n1-c1ccccc1 26363024 QJTXAKZIIPMPMB-UHFFFAOYSA-N 481.559 5.034 5 20 JKBD CCS(=O)(=O)c1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2Sc2ccc(Cl)cc2)cc1 32618798 GVPIHVUJFQTVTQ-UHFFFAOYSA-N 476.963 5.445 5 20 JKBD CCn1c(S[C@H](C(=O)Nc2ccc(C)cc2[N+](=O)[O-])c2ccccc2)nnc1-c1cccs1 36184236 PKWSMXUJYSBXCL-FQEVSTJZSA-N 479.587 5.715 5 20 JKBD CC(C)n1c(Sc2nc3sccn3c2[N+](=O)[O-])nnc1-c1ccc(Cl)cc1Cl 105329605 NZNJXGPEYHWOQG-UHFFFAOYSA-N 455.352 5.601 5 20 JKBD COc1ccc([C@H](C)N(C)C(=O)Cc2cn(-c3ccccc3)nc2-c2ccc([N+](=O)[O-])cc2)cc1 105776867 KDMSFRVBZVEAJH-IBGZPJMESA-N 470.529 5.218 5 20 JKBD Cc1ccc(-c2csc(NC(=O)CSCc3coc(-c4ccccc4)n3)n2)cc1[N+](=O)[O-] 107846848 YOEZQFWKZHHCIO-UHFFFAOYSA-N 466.544 5.554 5 20 JKBD O=C(C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1)N(Cc1ccccc1)C[C@H]1CCCO1 115758430 YBGRSDPQHQXEAC-OAQYLSRUSA-N 491.510 5.038 5 20 JKBD O=C(Nc1ccccc1C(=O)N[C@H]1CCSc2ccc(F)cc21)c1ccc([N+](=O)[O-])cc1Cl 247304805 GHTCTULHFMQBKD-FQEVSTJZSA-N 485.924 5.607 5 20 JKBD CCOc1cc(NC(=O)c2cnn(-c3ccc(C)cc3)c2C(C)C)c([N+](=O)[O-])cc1OCC 302926610 BVLJHBWOOLHPLI-UHFFFAOYSA-N 452.511 5.262 5 20 JKBD C[C@H](Nc1ccc(C(=O)NCCCc2nc(-c3ccncc3)cs2)cc1[N+](=O)[O-])c1ccccn1 303183742 IPMGGLGLNRJPGG-KRWDZBQOSA-N 488.573 5.044 5 20 JKBD COc1ccc(CSCC(=O)N2CCC(c3nc4cc(Cl)ccc4o3)CC2)cc1[N+](=O)[O-] 485481742 QNFZXRHYIUCWQP-UHFFFAOYSA-N 475.954 5.037 5 20 JKBD Cc1nc([N+](=O)[O-])cn1CCC(=O)NC[C@@H](c1ccccc1)c1c(-c2ccccc2)[nH]c2ccccc12 488387621 UYHSLCBBXBLVKV-DEOSSOPVSA-N 493.567 5.586 5 20 JKBD COc1cc(C(=O)N[C@H](Cc2cccc(F)c2)c2cccc(F)c2)c([N+](=O)[O-])cc1OC(F)F 489939031 AOEYRRMCKDIQJR-GOSISDBHSA-N 478.398 5.197 5 20 JKBD CCOc1cc(C(=O)Nc2cc(Cl)ccc2Oc2cccc(C)c2)c([N+](=O)[O-])cc1OC 502871252 WYOHQSGAOOMVNZ-UHFFFAOYSA-N 456.882 6.009 5 20 JKBD COc1ccc(C(=O)Nc2cccc(NC(=O)Nc3cccc(C(F)(F)F)c3)c2)cc1[N+](=O)[O-] 510300647 VDYSPOPWWAPDOY-UHFFFAOYSA-N 474.395 5.519 5 20 JKBD COc1cc(C(=O)N[C@@H](c2ccc(Cl)cc2)C(C)C)c([N+](=O)[O-])cc1OCc1cscn1 512293453 LIBUSSOECHPRKY-OAQYLSRUSA-N 475.954 5.419 5 20 JKBD CCOc1ccccc1CN[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Br)c1ccccc1 513184073 QADQJUSTUCCAPK-QFIPXVFZSA-N 484.350 5.226 5 20 JKBD C[C@@H](Nc1ccc(C(=O)Nc2n[nH]c(-c3cccc4ccccc34)n2)cc1[N+](=O)[O-])c1ccccn1 513728353 HGFJSLCQJUEYMY-MRXNPFEDSA-N 479.500 5.354 5 20 JKBD O=C(CCc1ncc(-c2ccc(Cl)cc2Cl)o1)Nc1cc2c(cc1[N+](=O)[O-])OCCCO2 514489344 CJCCYEJABAQBMM-UHFFFAOYSA-N 478.288 5.289 5 20 JKBD O=C(NC(Cc1ccccc1)Cc1ccccc1)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-] 517359007 JBJJOPLEMNSZHA-UHFFFAOYSA-N 458.436 5.120 5 20 JKBD C[C@@H](NC(=O)CSc1nnc(-c2ccc(F)cc2)n1-c1ccc(F)cc1)c1cccc([N+](=O)[O-])c1 517413371 RZRVHZGLGUQAQJ-OAHLLOKOSA-N 495.511 5.090 5 20 JKBD O=C(Nc1ccc(Cl)cc1)Nc1ccc(NC(=O)c2ccc(-n3ccnc3)c([N+](=O)[O-])c2)cc1 517936109 AUASRHLFJMIAPM-UHFFFAOYSA-N 476.880 5.330 5 20 JKBD C[C@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)Nc1ccccc1-c1nc2ccccc2s1 520438233 NEUQYCMIHRJCJC-ZDUSSCGKSA-N 453.907 5.931 5 20 JKBD Cc1cc(C(=O)NC2CCCC2)ccc1NC(=O)CSc1ccc(C(F)(F)F)cc1[N+](=O)[O-] 520465113 OFDKDVZQWMMRNS-UHFFFAOYSA-N 481.496 5.325 5 20 JKBD CC(C)N(Cc1ccco1)C(=O)C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1 521745817 VNGVVWSVGPCEFC-XMHGGMMESA-N 461.543 6.165 5 20 JKBD O=C(C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)Nc1cccc2c1OCCO2 551203212 JUBJKGYIPNBYTK-SAPNQHFASA-N 473.510 5.545 5 20 JKBD CC(C)C(=O)Nc1ccc(CNCc2ccc(Oc3ccccc3Cl)c([N+](=O)[O-])c2)cc1 591659416 GRYSJGPLQHHCBR-UHFFFAOYSA-N 453.926 5.925 5 20 JKBD Cc1csc(Sc2ccc(C(=O)Nc3ccc(N4CCCC4)cc3C)cc2[N+](=O)[O-])n1 602094495 ZXPJFFYREKONIV-UHFFFAOYSA-N 454.577 5.672 5 20 JKBD Cc1[nH]nc(C(=O)Nc2ccc(Oc3ccccc3Br)c(Cl)c2)c1[N+](=O)[O-] 609381459 LCSXTRZXTNITDK-UHFFFAOYSA-N 451.664 5.087 5 20 JKBD COc1ccc(-c2nnc(Sc3nc4sccn4c3[N+](=O)[O-])n2C2CCCCC2)cc1OC 619672834 KYETVRSQYFTHQK-UHFFFAOYSA-N 486.579 5.236 5 20 JKBD C[C@H](OC(=O)c1ccc(-c2ccc(Br)cc2)n1C)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 726020729 ADQHVNWRKWUKLZ-ZDUSSCGKSA-N 497.305 5.331 5 20 JKBD C[C@@H](OC(=O)c1ccc(Oc2ccc(Cl)cc2)c(N)c1)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 727529422 NWNWOXIVMUODEH-CYBMUJFWSA-N 480.864 5.591 5 20 JKBD Cc1noc(C)c1CN1CCN(C(=O)CCC(=O)c2ccc3ccc4cccc5ccc2c3c45)CC1 727756218 VEKBNXRULPLGGV-UHFFFAOYSA-N 479.580 5.496 5 20 JKBD COc1cc(CNCC(=O)Nc2cc(Cl)ccc2Cl)ccc1OCc1ccc([N+](=O)[O-])cc1 743636602 DBQFETGBVLTLHN-UHFFFAOYSA-N 490.343 5.218 5 20 JKBD Cc1cccc(-c2nnc(S[C@H](C(=O)Nc3ccc(Cl)c([N+](=O)[O-])c3)c3ccccc3)o2)c1 780126332 QNHPXJDHVXMNPK-FQEVSTJZSA-N 480.933 6.079 5 20 JKBD Cc1ccc(S(=O)(=O)Nc2ccc(C(=O)N(C)c3ccc4ccccc4c3)cc2)cc1[N+](=O)[O-] 877522672 RUGOTNOWYHVZAV-UHFFFAOYSA-N 475.526 5.134 5 20 JKBD C[C@H](OC(=O)c1ccccc1SC(F)(F)F)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 914946409 FHGBLJPYTLOCLJ-VIFPVBQESA-N 482.358 5.410 5 20 JKBD CCCOc1cc(NC(=O)N2CCC([C@@H](O)c3ccccc3)CC2)c([N+](=O)[O-])cc1OCCC 915334022 AIQCPLPCAWWOFL-DEOSSOPVSA-N 471.554 5.150 5 20 JKBD O=C(Nc1ccccc1SC[C@H]1CC1(Cl)Cl)[C@@H]1CC(=O)N(c2ccc(F)c([N+](=O)[O-])c2)C1 917751766 OUTZOOKFNMLZIP-CHWSQXEVSA-N 498.363 5.011 5 20 JKBD Cc1ccc2ncccc2c1S(=O)(=O)Oc1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2Cl)cc1 917868395 MHBUKDCKVPBAOR-UHFFFAOYSA-N 497.916 5.125 5 20 JKBD Cc1nccn1-c1ccc(CNC(=O)c2cc([N+](=O)[O-])ccc2Sc2ccc(Cl)cc2)cn1 918660435 JCBZXEDUTMYPDU-UHFFFAOYSA-N 479.949 5.219 5 20 JKBD C[C@H](OC(=O)c1ccccc1N(C)C(=O)c1ccc(Br)o1)c1cccc([N+](=O)[O-])c1 920158774 PPYIOQGKLMIOFX-ZDUSSCGKSA-N 473.279 5.145 5 20 JKBD COc1ccc(C2(C(=O)NC3(c4ccc(NC(=O)c5ccc([N+](=O)[O-])o5)cc4)CCC3)CCC2)cc1 1785750143 VIQPAVBUHLMDTN-UHFFFAOYSA-N 489.528 5.066 5 20 JKBD O=C(Cn1ccc2ccc([N+](=O)[O-])cc21)Nc1ccc(C2(NC(=O)c3ccccc3F)CCC2)cc1 1786277890 XKCAXUVHLYYKPR-UHFFFAOYSA-N 486.503 5.137 5 20 JKBD O=C(C[C@H]1CCCCO1)Nc1ccc(C2(NC(=O)C3(c4cccc([N+](=O)[O-])c4)CCC3)CCC2)cc1 1786646231 FHRYIACOAXKHKA-XMMPIXPASA-N 491.588 5.110 5 20 JKBD CC(C)=CCCC(=O)NC1(c2ccc(NC(=O)c3cc([N+](=O)[O-])cc4c3OCC4)cc2)CCC1 1790045597 YDQMCIXESHEFAQ-UHFFFAOYSA-N 463.534 5.024 5 20 JKBD O=C(CCCC(F)(F)F)NC1(c2ccc(NC(=O)c3cccc(F)c3[N+](=O)[O-])cc2)CCC1 1790699927 UYIGIRPOWNDEFJ-UHFFFAOYSA-N 467.419 5.214 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)C34CCC(CC3)CC4)CCC2)cc1)c1cc(O)cc([N+](=O)[O-])c1 1790757326 AMDAJZYSHFOUQZ-UHFFFAOYSA-N 463.534 5.019 5 20 JKBD O=C(NC1(c2ccc(NC(=O)c3c(Cl)ccc(Cl)c3O)cc2)CCC1)c1ccc([N+](=O)[O-])o1 1790757568 UTJFVPLNGPJEBS-UHFFFAOYSA-N 490.299 5.262 5 20 JKBD C/C(=C\c1cccs1)C(=O)N1CCCC2(CCN(C(=O)CSc3ccccc3[N+](=O)[O-])CC2)C1 1804812666 NYKQOAJEQMLORX-KNTRCKAVSA-N 499.658 5.083 5 20 JKBD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2cccc(F)c2[N+](=O)[O-])[nH]n1)[C@@H]1CCC[C@@H]2CCCC[C@@H]21 1818931175 JSMCLWKYQSXSSV-AYMMHLMVSA-N 497.571 5.369 5 20 JKBD Cc1c(C(=O)N2CCC([C@@H]3CCCCN3C(=O)c3ccc([N+](=O)[O-])o3)CC2)cccc1C(F)(F)F 1823615310 FWFKVRDRCCUTSC-IBGZPJMESA-N 493.482 5.062 5 20 JKBD Cc1ccc(CC(=O)N2CCC([C@@H]3CCCCN3C(=O)c3c[nH]c(C(C)(C)C)c3)CC2)cc1[N+](=O)[O-] 1825439527 QNFKWCXHEJSYGG-QHCPKHFHSA-N 494.636 5.005 5 20 JKBD CC1(C)CCC(CC(=O)N2CCC([C@@H]3CCCCN3C(=O)c3ccc(O)c([N+](=O)[O-])c3)CC2)CC1 1830490191 BNKZDJKSVRXKGE-QFIPXVFZSA-N 485.625 5.140 5 20 JKBD Cc1nc(C(=O)N2CCC([C@H]3CCCCN3C(=O)c3cc4cc([N+](=O)[O-])ccc4s3)CC2)cs1 1831060549 ZEXSOLXXDBIBNQ-HXUWFJFHSA-N 498.630 5.122 5 20 JKBD Cc1ccc([C@H](C)C(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3cccc(F)c3[N+](=O)[O-])CC2)cc1 1831530675 VIAOTJJONSZORB-YADARESESA-N 481.568 5.079 5 20 JKBD O=C(CSc1nnc(-c2ccco2)n1C1CCCCC1)Nc1ccc(Cl)cc1[N+](=O)[O-] 10015311 SYCKDNARTIPNPW-UHFFFAOYSA-N 461.931 5.336 5 20 JKBD Cc1nn(Cc2ccc(C(=O)Nc3ccc(-c4cn5ccccc5n4)cc3)cc2)c(C)c1[N+](=O)[O-] 10322129 WSNRQETYZSHBLZ-UHFFFAOYSA-N 466.501 5.023 5 20 JKBD C[C@@H](OC(=O)c1cccc(Cl)c1Cl)C(=O)Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1 11029619 IICPNKLLWFKONL-SNVBAGLBSA-N 466.302 5.209 5 20 JKBD Cc1c(NC(=O)[C@H](C)Sc2nnc(-c3ccc(Cl)cc3)n2Cc2ccco2)cccc1[N+](=O)[O-] 23610055 JMRWQCJUVDBLQV-HNNXBMFYSA-N 497.964 5.576 5 20 JKBD O=C(O[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1)c1ccc(NC(=O)C2CC2)cc1 24973489 SYNZKLFERZGNOP-QFIPXVFZSA-N 493.903 5.134 5 20 JKBD COc1ccc(Cl)cc1CN(C)C(=O)c1ccccc1NC(=O)c1ccc([N+](=O)[O-])cc1Cl 25895828 DXNOYLADCPTLMM-UHFFFAOYSA-N 488.327 5.435 5 20 JKBD CSc1ccc(C(=O)Nc2cccc(C(=O)N3CCc4sccc4C3)c2C)cc1[N+](=O)[O-] 26052660 BWCJOIXLGHHKOL-UHFFFAOYSA-N 467.572 5.137 5 20 JKBD COc1cccc(-c2nnc(SCc3nc(-c4cccc([N+](=O)[O-])c4)no3)n2-c2ccccc2)c1 31843924 UEUVJCSFGKHDGM-UHFFFAOYSA-N 486.513 5.193 5 20 JKBD Cn1cc(C(=O)NCc2ccc(Oc3ccc([N+](=O)[O-])cc3Cl)c(F)c2)c(C(C)(C)C)n1 426284789 ARUNSPAMGGMJER-UHFFFAOYSA-N 460.893 5.141 5 20 JKBD COc1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2Sc2ccccc2)cc1OCC(F)(F)F 478042165 RNXVIDYEYCWBJX-UHFFFAOYSA-N 478.448 5.948 5 20 JKBD CCNC(=O)c1ccc(CNC(=O)c2cc([N+](=O)[O-])ccc2Sc2ccc(Cl)cc2)cc1 479916933 HTZYUSGEUGIFRC-UHFFFAOYSA-N 469.950 5.079 5 20 JKBD Cc1ccccc1N(C(=O)c1ccc(-n2cncn2)c([N+](=O)[O-])c1)c1nc2ccccc2s1 496847290 SBKJYJWHRZTMPF-UHFFFAOYSA-N 456.487 5.072 5 20 JKBD CC(C)OC(=O)C[C@H](NC(=O)Nc1ccccc1N1CCCCCC1)c1ccccc1[N+](=O)[O-] 503968070 DEIZSOQUSUPVAU-NRFANRHFSA-N 468.554 5.180 5 20 JKBD CN(C[C@H]1OCCc2ccccc21)C(=O)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1 506255965 VGIBVOINKQXMMJ-HSZRJFAPSA-N 452.894 5.427 5 20 JKBD C[C@@H](Nc1cccc(NC(=O)c2cccc(C(F)(F)F)c2)c1)C(=O)Nc1ccc([N+](=O)[O-])cc1 507549208 JPNJTGZDJUIQAJ-CQSZACIVSA-N 472.423 5.305 5 20 JKBD Cc1ccc(NC(=O)CS[C@@H](C)C(=O)Nc2nc(-c3ccc(C)c([N+](=O)[O-])c3)cs2)cc1 515164174 PHKBNBPMYOGVOS-HNNXBMFYSA-N 470.576 5.034 5 20 JKBD CCOc1cc([N+](=O)[O-])c(C(=O)N[C@@H](Cc2ccc(Cl)cc2)c2ccccc2)cc1OC 515868503 GBZMCJOMOLLCSE-FQEVSTJZSA-N 454.910 5.369 5 20 JKBD CCOc1ccc(Oc2ccc(Cl)cc2NC(=O)C(=O)N(C)Cc2ccccc2[N+](=O)[O-])cc1 516054792 GDDDVIGYBUMIQR-UHFFFAOYSA-N 483.908 5.036 5 20 JKBD O=c1ccccn1Cc1ccc(CNCc2ccc(-c3ccc([N+](=O)[O-])cc3Br)o2)cc1 518263568 YCYIDGZWMSLUKA-UHFFFAOYSA-N 494.345 5.117 5 20 JKBD COc1ccc([C@H](Cc2ccc(F)cc2)N[C@@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)cc1 520627536 RKIAXECUYFKXCH-WNSKOXEYSA-N 471.916 5.297 5 20 JKBD CN(C(=O)c1ccc(Cl)cc1)c1ccc(NC(=O)Cn2ccc3cc([N+](=O)[O-])ccc32)cc1 521550302 ICCXFWIGMXRPLN-UHFFFAOYSA-N 462.893 5.118 5 20 JKBD CC[C@H](C)Sc1ccc(NC(=O)N2CCN(c3ccc([N+](=O)[O-])nc3)CC2)c(C(F)(F)F)c1 522183001 XWVYXBUJYKUVNK-AWEZNQCLSA-N 483.516 5.253 5 20 JKBD CC(C)N1CC[C@@H](CNC(=O)c2ccccc2Sc2ccc(C(F)(F)F)cc2[N+](=O)[O-])C1 522902177 UVQNBXUGPYKYBB-HNNXBMFYSA-N 467.513 5.225 5 20 JKBD C[C@@H]1CCC[C@@H](C)N1C(=O)c1cc(Cl)ccc1NCc1nc(-c2ccc([N+](=O)[O-])cc2)no1 604010254 XZWSFPVTVSGXBS-HUUCEWRRSA-N 469.929 5.313 5 20 JKBD COc1cccc(Oc2ccc(NC(=O)c3cc(OCC(F)(F)F)ccc3[N+](=O)[O-])cc2)c1 604016394 YPTBJRUWKCUAFO-UHFFFAOYSA-N 462.380 5.589 5 20 JKBD O=C(c1ccccc1)c1ccc(NCc2ccccc2NS(=O)(=O)c2ccccc2)c([N+](=O)[O-])c1 608831786 UHORDZKFFWZZTA-UHFFFAOYSA-N 487.537 5.239 5 20 JKBD COc1ccc(CC(=O)Nc2ccc(NC(=O)Nc3ccc(Cl)cc3)cc2)cc1[N+](=O)[O-] 609016472 DDUBERCSKCDGJE-UHFFFAOYSA-N 454.870 5.082 5 20 JKBD O=C(Cn1c2ccccc2c(=O)c2ccccc21)Nc1nc2cc(C(F)(F)F)ccc2s1 641872321 LHUACMMXXZTCOE-UHFFFAOYSA-N 453.445 5.422 5 20 JKBD CC(C)[C@@H](OC(=O)c1cc([N+](=O)[O-])ccc1Br)C(=O)Nc1ccccc1C(F)(F)F 725985434 JHUOZQVOSGTYMQ-MRXNPFEDSA-N 489.244 5.196 5 20 JKBD CN(Cc1ccccc1NC(=O)c1csc(-c2ccc([N+](=O)[O-])cc2)n1)C(=O)OC(C)(C)C 747720713 CEWMRXVGANFPIH-UHFFFAOYSA-N 468.535 5.338 5 20 JKBD O=C(OCC(=O)N1c2ccccc2CCc2ccccc21)c1csc(-c2cccc([N+](=O)[O-])c2)n1 747961643 HQJYFUUMSZYCLQ-UHFFFAOYSA-N 485.521 5.339 5 20 JKBD O=C(COC(=O)/C(=C/c1ccc(F)cc1)c1cccs1)Nc1ccc([N+](=O)[O-])cc1Cl 772012586 AJTBMLWVYFDHQY-MHWRWJLKSA-N 460.870 5.171 5 20 JKBD C[C@H](OC(=O)c1ccc(N[C@H](C)c2ccccn2)c([N+](=O)[O-])c1)c1nnc(-c2ccccc2)o1 920545471 RQSGIESUAVCMQO-CVEARBPZSA-N 459.462 5.131 5 20 JKBD O=C(Cc1ccc([N+](=O)[O-])cc1F)NC1(c2ccc(NC(=O)[C@H](F)c3ccccc3)cc2)CCC1 1786613754 VOCXDPJPPQDHFE-XMMPIXPASA-N 479.483 5.121 5 20 JKBD O=C(Cc1cc([N+](=O)[O-])ccc1F)NC1(c2ccc(NC(=O)c3scnc3C3CC3)cc2)CCC1 1787183594 DWZRMJWUBDRBDA-UHFFFAOYSA-N 494.548 5.058 5 20 JKBD Cc1cc(C(=O)Nc2ccc(C3(NC(=O)c4ccc([N+](=O)[O-])o4)CCC3)cc2)nc2ccccc12 1789019205 GEPWHFKJUIVPLH-UHFFFAOYSA-N 470.485 5.106 5 20 JKBD O=C(NC1(c2ccc(NC(=O)c3ccccc3Cl)cc2)CCC1)c1nc2cc([N+](=O)[O-])ccc2[nH]1 1790225589 DRKHTMUKFCMPPQ-UHFFFAOYSA-N 489.919 5.186 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)c3cc4cc(F)ccc4[nH]3)CCC2)cc1)c1cc(F)cc([N+](=O)[O-])c1 1790697919 ZFLZDOUGCYEXLU-UHFFFAOYSA-N 490.466 5.416 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)[C@@H]3CCC(F)(F)C3)CCC2)cc1)c1cc2cc([N+](=O)[O-])ccc2s1 1791008618 OWOLULVJQKDESV-OAHLLOKOSA-N 499.539 5.993 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)C3(F)CC3)CCC2)cc1)c1cc2cc([N+](=O)[O-])ccc2s1 1791010354 JLXYEOXZRDPWGT-UHFFFAOYSA-N 453.495 5.059 5 20 JKBD CNc1ccc(C(=O)NC2(c3ccc(NC(=O)CSc4ccccc4[N+](=O)[O-])cc3)CCC2)cc1 1791522234 KBACWUFFKLIQKE-UHFFFAOYSA-N 490.585 5.177 5 20 JKBD COc1cc(C(=O)Nc2ccc(C3(NC(=O)c4cccc5ccncc45)CCC3)cc2)ccc1[N+](=O)[O-] 1792165283 DILRBFAHKCOAHR-UHFFFAOYSA-N 496.523 5.213 5 20 JKBD O=C(/C=C/c1ccc([N+](=O)[O-])o1)Nc1cc([C@@H]2CCCCN2C(=O)c2cccc3ccccc23)[nH]n1 1814967574 LPDUKIJXPMLQBE-SDNYCIMKSA-N 485.500 5.083 5 20 JKBD CC(C)c1ccc(C(=O)Nc2cc([C@H]3CCCCN3C(=O)c3ccc([N+](=O)[O-])cc3F)[nH]n2)cc1 1820591792 LYJAYCBFIGOBKM-JOCHJYFZSA-N 479.512 5.200 5 20 JKBD O=C(Nc1cc([C@H]2CCCCN2C(=O)CCc2cccc([N+](=O)[O-])c2)[nH]n1)c1ccccc1C1CC1 1823130314 OCQUAQKUAJDXSR-XMMPIXPASA-N 487.560 5.134 5 20 JKBD CC(C)[C@H](C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2ccc([N+](=O)[O-])o2)CC1)c1ccc(F)cc1 1823617106 FBWVSBQIBXIHSX-URXFXBBRSA-N 485.556 5.000 5 20 JKBD O=C(/C=C/c1ccc([N+](=O)[O-])o1)N1CCC([C@@H]2CCCCN2C(=O)[C@@H]2CCC[C@@H]3CCCC[C@H]32)CC1 1828456723 VTNMGEKHERNSLF-QUONSSANSA-N 497.636 5.427 5 20 JKBD CC(=O)N(c1nc(COC(=O)c2cccc(C)c2[N+](=O)[O-])cs1)c1c(C)cc(C)cc1Cl 9022298 XJSQTWKPFGTHIM-UHFFFAOYSA-N 473.938 5.672 5 20 JKBD C[C@H](OC(=O)Cc1csc(-c2ccc(Cl)cc2)n1)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 16665247 KJKJOEHAAXYCHB-LBPRGKRZSA-N 470.894 5.269 5 20 JKBD Cc1ccc(-c2nc(C(=O)O[C@@H](C)C(=O)Nc3ccc([N+](=O)[O-])cc3C(F)(F)F)cs2)cc1 17939896 BWJWIHXGMSKZPG-LBPRGKRZSA-N 479.436 5.230 5 20 JKBD O=C(OCc1nnc(-c2ccc([N+](=O)[O-])cc2)o1)c1ccccc1-c1ncc(-c2ccccc2)o1 19164929 CEPNNMZGEKRSRX-UHFFFAOYSA-N 468.425 5.324 5 20 JKBD CCn1c(SCC(=O)OCc2ccccc2[N+](=O)[O-])nnc1-c1ccc(Cl)cc1Cl 24163074 NIQSKFGQWOIVSQ-UHFFFAOYSA-N 467.334 5.016 5 20 JKBD Cc1ccc(-n2c(S[C@H](C)C(=O)Nc3ccc(F)c([N+](=O)[O-])c3)nnc2-c2ccncc2)cc1C 24298782 UIZVIPJCXFJKPW-MRXNPFEDSA-N 492.536 5.113 5 20 JKBD CCOc1ccc(OCC)c(NC(=O)Cc2cn(-c3ccccc3)nc2-c2ccc([N+](=O)[O-])cc2)c1 28344792 KBAOJVNETDZZMZ-UHFFFAOYSA-N 486.528 5.426 5 20 JKBD O=C(Nc1ccc(N2CCOCC2)c(F)c1)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1 110867185 CRDHBIHMOXHVNL-UHFFFAOYSA-N 471.872 5.269 5 20 JKBD CC[C@H](C)Sc1ccc(NC(=O)c2ccc(N3CCCC3)c([N+](=O)[O-])c2)c(C(F)(F)F)c1 303047891 UPZSQFOUWINGQX-AWEZNQCLSA-N 467.513 6.357 5 20 JKBD Cc1nn(Cc2ccc(Cl)cc2)c2sc(C(=O)N3CCc4cc([N+](=O)[O-])ccc43)cc12 478114879 WTLQXHVBMLEMIM-UHFFFAOYSA-N 452.923 5.219 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)Nc2nc(C3CC3)c(Cc3ccccc3Cl)s2)cc1SC 483643494 OKLYRYXDRMHFGK-UHFFFAOYSA-N 490.006 6.156 5 20 JKBD COCCN(C(=O)c1csc(-c2ccc([N+](=O)[O-])cc2)n1)[C@H](C)c1cccc(C(F)(F)F)c1 500297721 CSLXIMSGJWHOJU-CQSZACIVSA-N 479.480 5.587 5 20 JKBD C[C@H](Nc1ccc(C(=O)Nc2nc(-c3ccc(F)cc3)cs2)cc1[N+](=O)[O-])c1ccccn1 506245568 LOUQUBKRTCOOKS-AWEZNQCLSA-N 463.494 5.678 5 20 JKBD O=C1CCCN1C[C@@H](NCc1ccc(Oc2ccccc2Cl)c([N+](=O)[O-])c1)c1ccccc1 509568772 JZKMFWAGSBNWSJ-OAQYLSRUSA-N 465.937 5.494 5 20 JKBD COc1cc(C(=O)Nc2cc(C(=O)Nc3ccccc3)ccc2Cl)c([N+](=O)[O-])cc1OC(F)F 512321427 FLTRXTJGHSFLCC-UHFFFAOYSA-N 491.834 5.363 5 20 JKBD O=C(Cc1csc(-c2cc(Br)cs2)n1)Nc1cc([N+](=O)[O-])ccc1OC(F)F 515705326 MSYKTQUHAVBJAI-UHFFFAOYSA-N 490.307 5.325 5 20 JKBD COc1ccc(CSCC(=O)Nc2cccc(NC(=O)c3ccccc3)c2C)cc1[N+](=O)[O-] 515739792 RVZCSZAGGCGXCE-UHFFFAOYSA-N 465.531 5.036 5 20 JKBD Cc1cccc2c1CC[C@H]2N[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Br)c1ccccc1 517934324 PDBZJHJANVSARV-GGAORHGYSA-N 480.362 5.623 5 20 JKBD COc1cc2c(cc1OC)[C@@H](c1ccccc1)N(C(=O)[C@@H](C)Oc1ccc(Cl)cc1[N+](=O)[O-])CC2 520436408 UZFSTNWWSKNNDS-PUAOIOHZSA-N 496.947 5.207 5 20 JKBD CN(C[C@H]1CCCOC1)C(=O)c1c2c(nc3ccccc13)/C(=C/c1ccc([N+](=O)[O-])cc1)CCC2 521683994 LVTNCSWZIPNTSD-DXAMHKDYSA-N 471.557 5.519 5 20 JKBD Cc1cnn([C@@H]2CCCc3ccccc32)c1NC(=O)c1ccc(N[C@H](C)c2ccccn2)c([N+](=O)[O-])c1 524378348 PEGIFPUZQBUFAU-KBMIEXCESA-N 496.571 5.846 5 20 JKBD CN(C)[C@@H](CNC(=O)C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)c1cccs1 600838713 NQNFIENLXRTOGJ-NUVSWBFWSA-N 492.626 5.616 5 20 JKBD O=C(c1csc([N+](=O)[O-])c1)N(C[C@H]1CCCO1)c1nc(-c2cccc(C(F)(F)F)c2)cs1 603754457 TYVZWOCXPKTHRO-OAHLLOKOSA-N 483.493 5.624 5 20 JKBD CCNC(=O)c1ccc(NC(=O)c2ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])c(OC)c2)c(C)c1 603993064 HFFOQWRAWOVTLC-UHFFFAOYSA-N 483.908 5.360 5 20 JKBD COc1ccc(CNCC2(c3ccc(F)cc3)CCOCC2)cc1OCc1ccc([N+](=O)[O-])cc1 604417907 NIHAQGZBNWPFHY-UHFFFAOYSA-N 480.536 5.160 5 20 JKBD Cc1csc(Sc2ccc(C(=O)N3CCO[C@H](c4ccc(F)c(F)c4)C3)cc2[N+](=O)[O-])n1 608965509 YPRFALMXXMNJAH-SFHVURJKSA-N 477.514 5.003 5 20 JKBD Cc1ccc(NC(=O)c2ccc(N[C@H](c3ccc(F)cc3)c3nccn3C)c([N+](=O)[O-])c2)cc1 608971125 AYFRNXHGFYQEAB-HSZRJFAPSA-N 459.481 5.230 5 20 JKBD C[C@@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccc(CC(=O)Nc2ccccc2F)cc1 609065148 AHWVLMNPIHCHIY-OAHLLOKOSA-N 453.495 5.034 5 20 JKBD CSc1ccc(C(=O)c2ccccc2C(=O)N2CCC(OC3CCC(C)CC3)CC2)cc1[N+](=O)[O-] 609374239 LNPSEZAYKKACSA-UHFFFAOYSA-N 496.629 5.748 5 20 JKBD COc1ccc([N+](=O)[O-])cc1NC(=O)[C@@H](C)SCc1nc(O)c2c(-c3ccccc3)csc2n1 610834738 HNYJGNILXOVQGA-CYBMUJFWSA-N 496.570 5.241 5 20 JKBD O=C(C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)N(Cc1ccccn1)C1CC1 619218325 VYHIXKPQHNFYNL-CYVLTUHYSA-N 470.554 5.721 5 20 JKBD Cc1ccc([C@@H](OC[C@H](O)Cn2cnc3cc4ccccc4cc3c2=O)c2ccccc2)cc1 636934061 DVNVHCMOYIKHDZ-NAKRPHOHSA-N 450.538 5.025 5 20 JKBD CC[C@@H](C)c1ccccc1NC(=O)[C@H](C)OC(=O)c1csc(-c2cccc([N+](=O)[O-])c2)n1 747961085 FYONJXNQRXPWAZ-CABCVRRESA-N 453.520 5.416 5 20 JKBD C[C@@H](OC(=O)c1cccnc1Nc1ccccc1F)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 769466523 LKFHRWSVSJXLDV-GFCCVEGCSA-N 492.385 5.075 5 20 JKBD CC1CCN(c2ccc([N+](=O)[O-])cc2C(=O)Nc2ccc(SCc3cccnc3)cc2)CC1 799918078 CXRSORRCEAICHC-UHFFFAOYSA-N 462.575 5.771 5 20 JKBD Cc1nc(-c2cccs2)c(CC(=O)N(Cc2nnc(-c3cccc([N+](=O)[O-])c3)o2)C(C)C)s1 864240763 BGEVTWYHJMRDSA-UHFFFAOYSA-N 483.575 5.118 5 20 JKBD CC(=O)Nc1ccc(NC(=O)c2ccc(Sc3nc4ccccc4s3)c([N+](=O)[O-])c2)cc1C 893526884 NCYMSDSGUUKZQQ-UHFFFAOYSA-N 478.555 5.875 5 20 JKBD O=C(COC(=O)c1cc(-c2nc3ccccc3s2)nc2ccccc12)Nc1ccccc1[N+](=O)[O-] 899901322 INYPDXZKRRPRBF-UHFFFAOYSA-N 484.493 5.215 5 20 JKBD CCOc1cc([N+](=O)[O-])c(-c2nc(-c3ccc(Oc4ccc(F)cc4)nc3)no2)cc1OC 904506412 LMZYVHFFEQKRCK-UHFFFAOYSA-N 452.398 5.046 5 20 JKBD C[C@@H](NC(=O)c1cc([N+](=O)[O-])ccc1N1CCC(Cc2ccccc2)CC1)c1ccc2c(c1)CC(=O)N2 918634881 UDPKVKHTKVRXCK-LJQANCHMSA-N 498.583 5.040 5 20 JKBD O=C(Nc1ccccc1C(=O)NCCc1ccccc1C(F)(F)F)c1ccc([N+](=O)[O-])cc1Cl 919856469 XXBVNZUSYOZCHF-UHFFFAOYSA-N 491.853 5.492 5 20 JKBD C[C@@H](Nc1ccc(C(=O)O[C@@H](C(=O)Nc2ccccc2)c2ccccc2)cc1[N+](=O)[O-])c1ccccn1 920544526 CELVUIBZPLQXQS-NIYFSFCBSA-N 496.523 5.700 5 20 JKBD C[C@H](OC(=O)c1ccc(N[C@H](C)c2ccccn2)c([N+](=O)[O-])c1)C(=O)N[C@@H](C)c1ccc(Cl)cc1 920548887 UUFFRMVDHOJOCK-BBWFWOEESA-N 496.951 5.239 5 20 JKBD Cc1ccc([N+](=O)[O-])cc1NC(=O)COC(=O)[C@@H](C)SCc1ncc(-c2ccc(Cl)cc2)o1 920669920 BLBFIQZMXFBXGT-CQSZACIVSA-N 489.937 5.015 5 20 JKBD O=C(OCc1nc(O)c2c(-c3ccccc3)csc2n1)c1cc([N+](=O)[O-])ccc1N1CCCCC1 1263471857 PAUAIEBDNLDRKJ-UHFFFAOYSA-N 490.541 5.319 5 20 JKBD O=C(Cc1cccc([N+](=O)[O-])c1)Nc1ccc(C2(NC(=O)[C@]3(F)CCCCC3(F)F)CCC2)cc1 1785791678 KGRAVEKSTLHKRZ-XMMPIXPASA-N 489.494 5.189 5 20 JKBD CC(C)[C@H](C(=O)Nc1ccc(C2(NC(=O)c3ccc([N+](=O)[O-])[nH]3)CCC2)cc1)c1ccccc1 1786184524 YPSMXGTVNBOMBK-QHCPKHFHSA-N 460.534 5.110 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)C34CC(C(F)(F)F)(C3)C4)CCC2)cc1)c1ccc([N+](=O)[O-])cc1F 1790622702 QQSVLDPFLMXVOW-UHFFFAOYSA-N 491.441 5.214 5 20 JKBD O=C(CSc1ccccc1[N+](=O)[O-])Nc1ccc(C2(NC(=O)[C@@H](F)c3ccccc3)CCC2)cc1 1791521286 HUTLXHZDBFEFLT-DEOSSOPVSA-N 493.560 5.532 5 20 JKBD Cc1cccc(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)c3ccc([N+](=O)[O-])cc3F)n[nH]2)c1Cl 1821050005 BGTZXGTXRUDXBG-LJQANCHMSA-N 485.903 5.039 5 20 JKBD Cc1c(C(=O)Nc2cc([C@H]3CCCCN3C(=O)/C=C/c3ccsc3)[nH]n2)cc(Cl)cc1[N+](=O)[O-] 1821290402 ACJSOAOWLOPEQO-ZMBJWTFHSA-N 499.980 5.361 5 20 JKBD C/C(=C\c1cccs1)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)CCc2cccc([N+](=O)[O-])c2)CC1 1823714998 PNXLDIIOTLFXIB-MHOQICJOSA-N 495.645 5.312 5 20 JKBD Cc1cccc(Cl)c1C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2ccc([N+](=O)[O-])cc2F)CC1 1830498785 JQHLDEOGQZPIRP-QFIPXVFZSA-N 487.959 5.243 5 20 JKBD CCOc1ccsc1C(=O)N1CCC([C@H]2CCCCN2C(=O)/C=C/c2ccccc2[N+](=O)[O-])CC1 1832899606 DDACEKHRZLWXPS-RQWLHQTBSA-N 497.617 5.002 5 20 JKBD COc1ccc(C)cc1NC(=O)[C@H](OC(=O)c1ccc(SC)c([N+](=O)[O-])c1)c1ccccc1 9620550 GXQKLISGAPUASN-JOCHJYFZSA-N 466.515 5.171 5 20 JKBD COc1cc(C(=O)Nc2ccc(NC(C)=O)cc2)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 16019468 VBLBJSPEURBEJK-UHFFFAOYSA-N 455.854 5.260 5 20 JKBD COc1ccc([N+](=O)[O-])cc1NC(=O)CCSc1nnc(-c2cccs2)n1-c1ccccc1 26363006 FTNAJIMUOVGAJZ-UHFFFAOYSA-N 481.559 5.034 5 20 JKBD Cc1nn(-c2ccccc2)c(C)c1NC(=O)CSc1nc2ccccc2c2nc3ccccc3n12 36807013 FUSIZKSVRRPQNM-UHFFFAOYSA-N 478.581 5.569 5 20 JKBD CCc1ccccc1N(C(C)=O)c1nc(COc2ccc([N+](=O)[O-])cc2C(F)(F)F)cs1 72033584 BGQYIZFTVDLJHO-UHFFFAOYSA-N 465.453 5.896 5 20 JKBD Cc1cnn([C@H]2CCCc3ccccc32)c1NC(=O)c1ccc(Cn2nc(C)c([N+](=O)[O-])c2C)cc1 110764599 SFZCNXWIJQMNEG-DEOSSOPVSA-N 484.560 5.139 5 20 JKBD Cn1cnnc1Sc1ccc(C(=O)N2CCCC[C@H]2c2ccc(C(F)(F)F)cc2)cc1[N+](=O)[O-] 116682100 UMXVTNWKBJUDOR-KRWDZBQOSA-N 491.495 5.261 5 20 JKBD O=C(CCOc1ccc(Cl)cc1Br)Nc1cc([N+](=O)[O-])ccc1OC(F)F 195715098 ZAFJDVYPFQWHFZ-UHFFFAOYSA-N 465.634 5.020 5 20 JKBD O=C(Cn1c2ccccc2c(=O)c2ccccc21)Nc1ccccc1C(=O)Nc1ccc(Cl)cc1 302931354 FMXCNGWKGAYVNX-UHFFFAOYSA-N 481.939 5.699 5 20 JKBD CCNC(=O)c1ccc(C)c(NC(=O)c2ccc(NCc3ccccc3Cl)c([N+](=O)[O-])c2)c1 482966729 VXPWTFLFRZXEJA-UHFFFAOYSA-N 466.925 5.171 5 20 JKBD O=C(Nc1cccc(-c2nccs2)c1)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 489647351 IYCAVKFIFGEIQS-UHFFFAOYSA-N 476.480 5.592 5 20 JKBD O=C(Cn1c2ccccc2c(=O)c2ccccc21)N[C@H](c1ccc(F)cc1)c1ccccc1Cl 502371841 XVWOWBSZZBVCQY-HHHXNRCGSA-N 470.931 5.853 5 20 JKBD O=C(Nc1ccc(-c2nc3ccccc3[nH]2)cc1)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-] 508286147 OFBJSGWUQJFXOQ-UHFFFAOYSA-N 456.380 5.332 5 20 JKBD CC(C)[C@H](NCc1ccc(-c2ccc([N+](=O)[O-])cc2Br)o1)c1nnc2ccccn12 518783662 QUZXMWYZYUXYKM-FQEVSTJZSA-N 470.327 5.147 5 20 JKBD Cc1csc(Sc2ccc(C(=O)Nc3ccc(-c4nnc5n4CCCC5)cc3)cc2[N+](=O)[O-])n1 521312706 DQWXTMOCBHQMOT-UHFFFAOYSA-N 492.586 5.358 5 20 JKBD Cc1nc(NC(=O)C/C(=C\c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)sc1C 521330792 FXGAGKRUZBTRJG-LFIBNONCSA-N 450.545 5.847 5 20 JKBD CC(=O)N1CCc2c(sc3nc(-c4ccc(C)c([N+](=O)[O-])c4)cc(-c4ccc(C)cc4)c23)C1 542514855 RLDGDGZFVYRBRQ-UHFFFAOYSA-N 457.555 6.060 5 20 JKBD Cc1ccc2nc([C@H]3CCCN(C(=O)c4ccc(N5CCC[C@H](C)C5)c([N+](=O)[O-])c4)C3)[nH]c2c1 551051765 ZPLJFFNLNWYZOZ-ICSRJNTNSA-N 461.566 5.036 5 20 JKBD Cc1nn(Cc2ccc(C(=O)NC(C)(C)c3cccc(C(F)(F)F)c3)cc2)c(C)c1[N+](=O)[O-] 571944399 ZXEJZMGTTGWQAA-UHFFFAOYSA-N 460.456 5.140 5 20 JKBD O=C(C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1)N(Cc1ccco1)c1ccccn1 603658740 WXBMPIGBIQJEEC-UHFFFAOYSA-N 474.439 5.051 5 20 JKBD O=[N+]([O-])c1ccccc1OCCSc1nnc(-c2cccnc2)n1-c1ccc(Br)cc1 603905052 HMFRATUZISOVTN-UHFFFAOYSA-N 498.362 5.171 5 20 JKBD CC[C@H](C)NC(=O)c1ccc(NC(=O)c2ccccc2C(=O)c2ccc(SC)c([N+](=O)[O-])c2)cc1 604312015 BOBWDNWTGMCEHM-INIZCTEOSA-N 491.569 5.328 5 20 JKBD Cc1nc(CNC(=O)C/C(=C/c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)nc2ccccc12 608809169 WLYCRIGLSWTIAM-RGEXLXHISA-N 495.564 5.703 5 20 JKBD O=[N+]([O-])c1ccccc1S(=O)(=O)Nc1nc2nc(-c3ccccc3)cc(C(F)(F)F)c2s1 608929285 UECVTHNWYVWZPZ-UHFFFAOYSA-N 480.449 5.086 5 20 JKBD C[C@@H]1CCCN(c2ccc(C(=O)Nc3cc(Cl)ccc3C(=O)N3CCCCC3)cc2[N+](=O)[O-])C1 609057017 IILVWDYFPORKSI-QGZVFWFLSA-N 484.984 5.363 5 20 JKBD CC(C)(C)OC(=O)N[C@H](C(=O)Oc1ccc(NC(=O)c2cccc([N+](=O)[O-])c2)cc1)c1ccccc1 727121719 MPZDSFRRJPRGPF-QFIPXVFZSA-N 491.500 5.019 5 20 JKBD Cc1c(C(=O)Nc2ccc(Oc3cccc(F)c3)c3ccncc23)cc([N+](=O)[O-])cc1[N+](=O)[O-] 728183701 OSCFTQMHFXBRRA-UHFFFAOYSA-N 462.393 5.543 5 20 JKBD COc1cccc(-c2nnc(Sc3nc4ccc([N+](=O)[O-])cc4s3)n2Cc2ccco2)c1 731208348 CDQMKVDENXBVOB-UHFFFAOYSA-N 465.516 5.264 5 20 JKBD O=C(Nc1ccccc1C(=O)NCCc1c[nH]c2cc(Cl)ccc12)c1ccc([N+](=O)[O-])cc1Cl 745146675 NOAAVQYKYQAVSX-UHFFFAOYSA-N 497.338 5.608 5 20 JKBD C[C@@H](Nc1ccc(C(=O)O[C@H](c2cccc(F)c2)c2ccccn2)cc1[N+](=O)[O-])c1ccccn1 750629866 AVZHRDGMVMFDMW-CRICUBBOSA-N 472.476 5.643 5 20 JKBD O=C(Oc1ccc(-c2nnco2)cc1)c1ccc(Sc2nc3ccccc3s2)c([N+](=O)[O-])c1 904680754 DNDZNEUNXZSRAL-UHFFFAOYSA-N 476.495 5.625 5 20 JKBD C[C@H](Nc1ccc(-c2nc([C@@H]3CCCN3C(=O)OC(C)(C)C)no2)cc1[N+](=O)[O-])c1ccccn1 904702389 XWDWRYJWNODIKN-KXBFYZLASA-N 480.525 5.285 5 20 JKBD O=[N+]([O-])c1ccc2nc(O)cc(-c3nc(-c4cc(Br)cc(Br)c4)no3)c2c1 904913935 LFGGQSQBUJUHIH-UHFFFAOYSA-N 492.083 5.091 5 20 JKBD O=C(OCc1nc(-c2cccc([N+](=O)[O-])c2)no1)/C(=C\c1ccc(F)cc1)c1cccs1 914796859 LMUXWMIGGCOPGD-WQRHYEAKSA-N 451.435 5.129 5 20 JKBD CCCN(CC(=O)Nc1ccc(Cl)cc1Cl)[C@@H](C)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl 916147192 BVKKGPYRVVBPOC-LBPRGKRZSA-N 487.771 5.233 5 20 JKBD Cc1cc(C(=O)O[C@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2ccccc2)nn1-c1ccccc1 919303256 XFBGFGFGNXDVRO-QHCPKHFHSA-N 490.903 5.279 5 20 JKBD C[C@H](OC(=O)CCOc1ccc(Cl)cc1Cl)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 919490757 SWVMLGWYOUMWKQ-JTQLQIEISA-N 495.237 5.260 5 20 JKBD O=C(Cc1cc(F)ccc1[N+](=O)[O-])NC1(c2ccc(NC(=O)[C@H](F)c3ccccc3)cc2)CCC1 1786617023 XSTPXPRTZJTMCS-XMMPIXPASA-N 479.483 5.121 5 20 JKBD Cc1c(C(=O)Nc2ccc(C3(NC(=O)c4cncs4)CCC3)cc2)cc(Cl)cc1[N+](=O)[O-] 1790773547 BGSGQPLIHAFTQM-UHFFFAOYSA-N 470.938 5.075 5 20 JKBD O=C(Cc1cc(F)ccc1[N+](=O)[O-])Nc1ccc(C2(NC(=O)CCc3ccsc3)CCC2)cc1 1792311187 YHYBRGIGOOYZBD-UHFFFAOYSA-N 481.549 5.105 5 20 JKBD C[C@H]1CC[C@H](C(=O)N2CCCC[C@@H]2c2cc(NC(=O)Cc3ccc(Cl)cc3[N+](=O)[O-])n[nH]2)CC1 1814846802 WPAXDQFIYOSGAY-JXXFODFXSA-N 487.988 5.032 5 20 JKBD Cc1c(C(=O)Nc2cc([C@H]3CCCCN3C(=O)CC(C)(C)C)[nH]n2)cc(Cl)cc1[N+](=O)[O-] 1821290659 LVMQKGJZVGVCHJ-QGZVFWFLSA-N 461.950 5.022 5 20 JKBD CC(C)[C@H](C(=O)N1CCC([C@@H]2CCCCN2C(=O)/C=C/c2ccc([N+](=O)[O-])o2)CC1)c1ccccc1 1824275532 CZBAVNYKMYAGBS-JSWUZGHSSA-N 493.604 5.261 5 20 JKBD O=C(/C=C/c1ccccc1[N+](=O)[O-])N1CCC([C@@H]2CCCCN2C(=O)c2cccc3ccoc23)CC1 1830992139 JPUCKIHZFCRADB-LCJITAHGSA-N 487.556 5.288 5 20 JKBD O=C(COC(=O)/C=C/c1ccc(-c2ccc(F)cc2)s1)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 11372725 QESUQJQGHVONSV-JXMROGBWSA-N 494.422 5.676 5 20 JKBD COc1cc(CSc2nc3sc(C)c(C)c3c(=O)n2C(C)C)c([N+](=O)[O-])cc1OC(F)F 12724152 XCFBCKWGYWRWSP-UHFFFAOYSA-N 485.534 5.466 5 20 JKBD Cc1ccccc1NC(=O)c1ccccc1Sc1ccc(S(=O)(=O)N2CCCC2)cc1[N+](=O)[O-] 16028821 KHBYVPHKQKKDKV-UHFFFAOYSA-N 497.598 5.091 5 20 JKBD C[C@H](OC(=O)c1cc([N+](=O)[O-])ccc1NCc1ccccc1)c1nnc(-c2cccs2)o1 17892513 IHPSEGBDZWSGFK-AWEZNQCLSA-N 450.476 5.236 5 20 JKBD C[C@H](NC(=O)Cn1c2ccccc2c(=O)c2ccccc21)c1ccc(NC(=O)c2ccc(F)cc2)cc1 68737311 QDMYZXKEMLGREO-IBGZPJMESA-N 493.538 5.424 5 20 JKBD Cc1cc(CN2CCSCC2)ccc1NC(=O)c1ccc(NCc2ccccc2)c([N+](=O)[O-])c1 116437502 JMXHTSHOTWTGIW-UHFFFAOYSA-N 476.602 5.316 5 20 JKBD O=C(C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)Nc1nnc(C(F)F)s1 409457443 SHFFRUTUELNPMC-FMIVXFBMSA-N 473.486 5.563 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)Nc2ccc(OCc3cccc(C(F)(F)F)c3)cc2)cc1SC 484390293 ZPGUREKHEIEOAP-UHFFFAOYSA-N 492.475 6.175 5 20 JKBD O=C(Nc1nc2c(C(F)(F)F)cccc2s1)C1CCN(c2ccccc2[N+](=O)[O-])CC1 489330374 NUDUVYHGAMPNPV-UHFFFAOYSA-N 450.442 5.078 5 20 JKBD CCOc1cc(CNCc2cc3ccccc3[nH]2)ccc1OCc1cc([N+](=O)[O-])cc2c1OCOC2 507934059 UHSHWOSAJBQFSD-UHFFFAOYSA-N 489.528 5.210 5 20 JKBD C[C@H]1CN(c2ccc(CNCc3ccc(Oc4ccccc4Cl)c([N+](=O)[O-])c3)cn2)C[C@H](C)O1 509598621 CLOODRFBQPLPHP-ROUUACIJSA-N 482.968 5.339 5 20 JKBD COCCN(Cc1ccccn1)C(=O)C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1 512082098 GTPDWFPUJCDLPF-SILNSSARSA-N 488.569 5.205 5 20 JKBD COCCOc1cc([N+](=O)[O-])c(C(=O)Nc2ccc(Sc3ccccc3)cc2C)cc1OC 512856276 MFDXHTVZKCBTFX-UHFFFAOYSA-N 468.531 5.341 5 20 JKBD O=C(Nc1cc(Cl)cc(Cl)c1)[C@@H]1CCCN1C(=O)Nc1ccc([N+](=O)[O-])cc1Cl 516715899 OFBBYZQPNMNGDV-INIZCTEOSA-N 457.701 5.190 5 20 JKBD C[C@@H]1C[C@@H](C)CN(c2ccc(C(=O)N3CCC[C@H](c4nc5ccccc5o4)C3)cc2[N+](=O)[O-])C1 603609378 MIRGWPKAVRIWJY-GGPKGHCWSA-N 462.550 5.238 5 20 JKBD O=C(c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-])N1CCC(c2nc3cc(Cl)ccc3o2)CC1 603921982 QTJKFJBGZDOHLC-UHFFFAOYSA-N 483.830 5.350 5 20 JKBD Cc1ccc(NC(=O)c2cccc(C(F)(F)F)c2)cc1NC(=O)c1c[nH]c2cc([N+](=O)[O-])ccc12 604451059 FQZBXYAFEZVIAA-UHFFFAOYSA-N 482.418 5.908 5 20 JKBD CCOc1cccc2cc([C@H](C)Nc3cnn(-c4ccc([N+](=O)[O-])cc4)c(=O)c3Cl)oc12 608830371 LHIHUNBXAXNGOD-ZDUSSCGKSA-N 454.870 5.112 5 20 JKBD CC(C)(CCc1ccccc1)NC(=O)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 608952757 FTHFFYNWDDBJIV-UHFFFAOYSA-N 463.500 5.358 5 20 JKBD CCN(Cc1ccc(CN(C)C)cc1)C(=O)Cc1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1 608966076 SNGRPGYTDHCDMK-UHFFFAOYSA-N 497.599 5.100 5 20 JKBD CSCc1ccc(N[C@@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Br)c2ccccc2)cc1 608980533 CXOWGEWUPUZAAJ-OAQYLSRUSA-N 486.391 6.012 5 20 JKBD CC(C)(C)c1ccc(C(=O)OCc2nnc(-c3c(Cl)cccc3Cl)o2)cc1[N+](=O)[O-] 726636173 RPOAONHJWGKISG-UHFFFAOYSA-N 450.278 5.606 5 20 JKBD CC(C)Oc1ccc([N+](=O)[O-])cc1COC(=O)CSc1nnc(-c2ccc3ccccc3c2)o1 729117788 LSCCRFRBOJFGHW-UHFFFAOYSA-N 479.514 5.421 5 20 JKBD Cc1cccc(C(C)C)c1NC(=O)[C@@H](C)OC(=O)c1ccc(Cn2nc(C)c([N+](=O)[O-])c2C)cc1 742409807 LGQFNHWMSVUNAK-LJQANCHMSA-N 478.549 5.072 5 20 JKBD O=C(COC(=O)c1csc(-c2cccc([N+](=O)[O-])c2)n1)Nc1cccc(Oc2ccccc2)c1 747963132 YTIKDOYZCXOEHD-UHFFFAOYSA-N 475.482 5.306 5 20 JKBD Cc1c(C(=O)Nc2ccc(C(=O)N3CCCC[C@@H]3C)c(Cl)c2)cc([N+](=O)[O-])c(C)c1[N+](=O)[O-] 748624584 UATNPBKBXJXUHL-LBPRGKRZSA-N 474.901 5.040 5 20 JKBD CN(C(=O)c1ccccc1NC(=O)c1cc([N+](=O)[O-])ccc1Br)C1CCCCC1 751098279 CWFDWOMTMPUEPK-UHFFFAOYSA-N 460.328 5.014 5 20 JKBD O=C(OCc1nnc(-c2ccccc2Cl)o1)c1ccccc1C(=O)c1ccc(Cl)c([N+](=O)[O-])c1 790593846 MSICYPMDHIQROW-UHFFFAOYSA-N 498.278 5.540 5 20 JKBD O=C(COC(=O)c1cccc(OCc2cccs2)c1)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 915464494 CWKDQFGAEMHTQT-UHFFFAOYSA-N 480.420 5.050 5 20 JKBD Cc1c([N+](=O)[O-])cc(C(=O)N2CC[C@@H](C)Sc3ccc(C(F)(F)F)cc32)cc1[N+](=O)[O-] 917680092 BYHKIPNDSUUFCQ-SNVBAGLBSA-N 455.414 5.361 5 20 JKBD C[C@@H](c1ccccc1)N1CC[C@H](NC(=O)c2ccccc2NC(=O)c2ccc([N+](=O)[O-])cc2Cl)C1 919857429 PWONIAHFIZYGDQ-HKUYNNGSSA-N 492.963 5.066 5 20 JKBD Cc1ccc(Sc2ccc(C(=O)N3CCC[C@H](CNC(=O)OC(C)(C)C)C3)cc2[N+](=O)[O-])cc1 920469979 UBIMQQFXNRVUJR-GOSISDBHSA-N 485.606 5.431 5 20 JKBD O=C(Nc1ccc(N2CCCCCC2)cc1)c1ccc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)cc1 921184328 LGDYLMPDSWKZDG-UHFFFAOYSA-N 494.573 5.028 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)c3cc4cc([N+](=O)[O-])ccc4s3)CCC2)cc1)c1cscn1 1787420403 BENIRQFLBKRUEB-UHFFFAOYSA-N 478.555 5.328 5 20 JKBD CN(C)c1ccc([N+](=O)[O-])c(C(=O)Nc2ccc(C3(NC(=O)[C@@]4(F)CCCC=C4F)CCC3)cc2)c1 1790056044 BOOWYMDNGFKAID-AREMUKBSSA-N 498.530 5.154 5 20 JKBD CCc1cc(C(=O)NC2(c3ccc(NC(=O)Cc4ccc(C)c([N+](=O)[O-])c4)cc3)CCC2)cc(C)n1 1790524172 HUSQZGLAVCJXSQ-UHFFFAOYSA-N 486.572 5.159 5 20 JKBD O=C(CCc1ccco1)NC1(c2ccc(NC(=O)c3cc4cc([N+](=O)[O-])ccc4s3)cc2)CCC1 1791011214 QMKSMFYBESULFK-UHFFFAOYSA-N 489.553 5.783 5 20 JKBD CC[C@H]1CC[C@H](C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cc(Cl)cc([N+](=O)[O-])c2C)C3)CC1 1802024726 PUWDJXCJUQDJLC-FWIIZBITSA-N 461.990 5.025 5 20 JKBD O=C(Cc1ccc(Cl)cc1[N+](=O)[O-])N1CCC([C@@H]2CCCCN2C(=O)CCC2CCCC2)CC1 1826265158 TXBXQPJJNITCDG-QHCPKHFHSA-N 490.044 5.381 5 20 JKBD O=C(Cc1ccc(Cl)cc1[N+](=O)[O-])N1CCC([C@@H]2CCCCN2C(=O)CCc2ccccc2)CC1 1826366005 INWXGXJYMQVISU-DEOSSOPVSA-N 498.023 5.043 5 20 JKBD CC(C)CCC(=O)N1CCC([C@H]2CCCCN2C(=O)C2(c3cccc([N+](=O)[O-])c3)CCC2)CC1 1830295296 NSXRKQXEPUJIHG-XMMPIXPASA-N 469.626 5.072 5 20 JKBD Cc1ccc2cc(C(=O)N3CCCC[C@@H]3C3CCN(C(=O)c4ccc([N+](=O)[O-])o4)CC3)sc2c1 1830978112 NUUAZWHDOAVYNG-LJQANCHMSA-N 481.574 5.258 5 20 JKBD CC(C)(C)CC(=O)N1CCC([C@H]2CCCCN2C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)CC1 1831061688 XJGSUBABCAIUON-HXUWFJFHSA-N 471.623 5.479 5 20 JKBD O=C(c1cc(F)cc([N+](=O)[O-])c1)N1CCC([C@H]2CCCCN2C(=O)c2ccccc2C2CC2)CC1 1832556077 NYANWASJRJPKMF-RUZDIDTESA-N 479.552 5.158 5 20 JKBD C[C@@H](C(=O)N1CCCC[C@@H]1C1CCN(C(=O)/C=C/c2ccccc2[N+](=O)[O-])CC1)c1ccccc1 1832900552 OLVAZRFLGJESLR-INGXWZIVSA-N 475.589 5.031 5 20 JKBD Cc1ccccc1NC(=O)Cc1nc(CSc2nc3ccccc3c3nc4ccccc4n23)cs1 8760744 YVYMKTRAFBWGLN-UHFFFAOYSA-N 495.633 6.274 5 20 JKBD COCCN(C(=O)c1ccc(COc2ccccc2)cc1)c1nc(-c2ccc([N+](=O)[O-])cc2)cs1 14790436 JNRJESPZNSSJTD-UHFFFAOYSA-N 489.553 5.591 5 20 JKBD O=C(C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)Nc1ccccc1C(=O)NC1CC1 16015499 XIARDOOOJCEPOB-SDXDJHTJSA-N 498.564 5.666 5 20 JKBD COCCN(C(=O)c1sc(-c2cccs2)nc1C)c1nc(-c2ccc([N+](=O)[O-])cc2)cs1 17346238 IEVZQFZNXJQBKY-UHFFFAOYSA-N 486.600 5.505 5 20 JKBD C[C@H](Sc1ncnc2scc(-c3ccc(F)cc3)c12)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 17709927 GIUGLABYERLUSG-LBPRGKRZSA-N 479.518 6.309 5 20 JKBD COc1cc(C(=O)Nc2ccc3c(c2)CCN3C(C)=O)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 26901947 JYNAQEIDJURBAI-UHFFFAOYSA-N 481.892 5.210 5 20 JKBD CCOc1cc([N+](=O)[O-])c(C(=O)Nc2ncc(Cc3cc(Cl)ccc3Cl)s2)cc1OC 28250039 NLGDQMXBEIQCEX-UHFFFAOYSA-N 482.345 5.609 5 20 JKBD Cc1cc(=O)c(C(=O)N(c2ccc3[nH]ccc3c2)[C@H](C)CC(C)C)nn1-c1ccccc1[N+](=O)[O-] 72066702 GCPDXMRZFMQODA-QGZVFWFLSA-N 473.533 5.012 5 20 JKBD COc1cccc([C@H](CNC(=O)c2c[nH]c3ccc([N+](=O)[O-])cc23)c2c[nH]c3ccccc23)c1OC 109889542 XRPKIXMBMSLVQY-NRFANRHFSA-N 484.512 5.137 5 20 JKBD Cn1c(-c2cccc(NC(=O)Cn3c4ccccc4c(=O)c4ccccc43)c2)nc2ccccc21 117477764 ZGQBKVJNMWGWRD-UHFFFAOYSA-N 458.521 5.347 5 20 JKBD O=C(c1ccc(Cl)cc1)C1CCN(C(=O)c2cc([N+](=O)[O-])ccc2Oc2ccccc2)CC1 302994654 SPHMGQOHYOHYMY-UHFFFAOYSA-N 464.905 5.776 5 20 JKBD O=C(NCc1ccccc1[N+](=O)[O-])Nc1ccc(NC(=O)c2ccccc2)cc1C(F)(F)F 410147104 HOHPPHQLIJOPLN-UHFFFAOYSA-N 458.396 5.188 5 20 JKBD O=C(C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)NC1CCN(c2ccccn2)CC1 478774504 RDBVMJMPTXEGNO-JZJYNLBNSA-N 499.596 5.315 5 20 JKBD C[C@H](NC(=O)C1CCN(c2ccccc2[N+](=O)[O-])CC1)c1ccc(OCc2ccc(F)cc2)cc1 485591259 LIOUPYQPMYTQTG-IBGZPJMESA-N 477.536 5.407 5 20 JKBD COc1cc(C(=O)N[C@H](C)c2sc(-c3ccc(C)cc3)nc2C)c([N+](=O)[O-])cc1OC(F)F 502469659 CZANVOPAZJYLPA-GFCCVEGCSA-N 477.489 5.436 5 20 JKBD Cc1ccc(-c2nc(C)c([C@@H](C)NC(=O)c3cc(OCC(F)(F)F)ccc3[N+](=O)[O-])s2)cc1 502561157 BIGHUVSJSZEMEV-CYBMUJFWSA-N 479.480 5.767 5 20 JKBD Cc1c(-c2ccccc2)sc(NC(=O)c2csc([N+](=O)[O-])c2)c1C(=O)N1CCCCC1 515296674 GSPALPUCNUDENB-UHFFFAOYSA-N 455.561 5.572 5 20 JKBD CCOc1ccc(Oc2ccc(Cl)cc2NC(=O)Cn2cc(Br)c([N+](=O)[O-])n2)cc1 515604785 OENZNAAECXELFY-UHFFFAOYSA-N 495.717 5.037 5 20 JKBD COc1ccc(Sc2ccc(NC(=O)C(=O)N[C@H](C)c3cccc([N+](=O)[O-])c3)cc2Cl)cc1 520003541 HEVIKZMAZGGNQA-CQSZACIVSA-N 485.949 5.224 5 20 JKBD CCN(C(=O)[C@H](C)Sc1ccc([N+](=O)[O-])cc1)[C@H](c1cccnc1)c1ccc(F)c(F)c1 520502820 WRGAVIUPZFEBQU-NYHFZMIOSA-N 457.502 5.387 5 20 JKBD O=C(Nc1nnc(C2CC2)s1)c1ccc(Sc2nc3ccccc3s2)c([N+](=O)[O-])c1 571624009 YCLVALOJHQBCIA-UHFFFAOYSA-N 455.546 5.337 5 20 JKBD CN(CC(=O)NC(C)(C)C)C(=O)c1c2c(nc3ccccc13)/C(=C\c1cccc([N+](=O)[O-])c1)CCC2 600840397 KMTQGJNEJGZMFW-CYVLTUHYSA-N 486.572 5.007 5 20 JKBD COc1cc(C(=O)Nc2cc(Cl)cc3cccnc23)c([N+](=O)[O-])cc1OCc1cscn1 604385607 SPAICXOZIXSXFS-UHFFFAOYSA-N 470.894 5.093 5 20 JKBD C[C@@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)Nc1cc(-c2nnc3n2CCCCC3)ccc1Cl 604446801 VHWPELIOFKSBBB-CYBMUJFWSA-N 490.347 5.293 5 20 JKBD CC(C)OC(=O)C[C@@H](NC(=O)Cc1csc(-c2ccc(Cl)cc2)n1)c1ccccc1[N+](=O)[O-] 610925535 YEFBONHDUDKZQN-LJQANCHMSA-N 487.965 5.113 5 20 JKBD C[C@@H](c1nc2ccccc2s1)N1CCN(C(=O)c2cc3ccccc3c3cccnc23)CC1 643126368 XXZAUJFGNOJRFW-SFHVURJKSA-N 452.583 5.517 5 20 JKBD COc1cc(C(=O)OCc2nc(-c3ccsc3)oc2C)c([N+](=O)[O-])cc1OCc1cscn1 726814086 UQCUWJHHUVYGBS-UHFFFAOYSA-N 487.515 5.021 5 20 JKBD COc1ccc(/C=C2\N=C(SCc3c(F)cccc3[N+](=O)[O-])N(c3cccc(OC)c3)C2=O)cc1 728787759 WSXCZBGQAVJVEF-XKZIYDEJSA-N 493.516 5.428 5 20 JKBD O=C(Nc1cccc(NC(=S)Nc2ccc([N+](=O)[O-])cc2)c1)c1cccc(C(F)(F)F)c1 728791449 DFDPATAWOPDNDF-UHFFFAOYSA-N 460.437 5.675 5 20 JKBD O=C(Nc1ccc(OCc2ccccn2)c(Cl)c1)c1cc([N+](=O)[O-])ccc1N1CCCCC1 743695591 KTVUYTGDMRQMMT-UHFFFAOYSA-N 466.925 5.465 5 20 JKBD COc1ccc(-c2cnc(CCC(=O)Oc3ccc(NC(=O)c4cccc([N+](=O)[O-])c4)cc3)o2)cc1 746357571 RZTKQNJTJZTDAV-UHFFFAOYSA-N 487.468 5.049 5 20 JKBD CC(=O)N(c1ccc(Cl)cc1)c1nc(COC(=O)c2c[nH]c3ccc([N+](=O)[O-])cc23)cs1 749316311 XNCMLTQUKYHSRQ-UHFFFAOYSA-N 470.894 5.228 5 20 JKBD Cn1c(SCC(=O)Nc2ccc(N3CCCCCC3)cc2)nc2cc3ccccc3cc2c1=O 749941113 FORIAYWKYNSWFM-UHFFFAOYSA-N 472.614 5.198 5 20 JKBD CN(Cc1cc([N+](=O)[O-])ccc1Cl)Cn1nc(N2CCCCC2)n(-c2ccccc2)c1=S 813202869 QLVZYRYUVRSFDC-UHFFFAOYSA-N 473.002 5.045 5 20 JKBD COc1cc(C(=O)OCc2nc(-c3ccco3)no2)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 897248593 SMMQGQDCGRQWMM-UHFFFAOYSA-N 471.809 5.049 5 20 JKBD Cc1nc(-c2cccs2)c(CC(=O)Oc2ccc(NC(=O)c3cccc([N+](=O)[O-])c3)cc2)s1 909833145 WYJXSGULDBVTBZ-UHFFFAOYSA-N 479.539 5.489 5 20 JKBD Cc1ccc2cc(C(=O)NC3(c4ccc(NC(=O)c5ccc(O)c([N+](=O)[O-])c5)cc4)CCC3)ccc2n1 1790619999 QJLAOABCJQTPPA-UHFFFAOYSA-N 496.523 5.219 5 20 JKBD CC1=CC[C@@H](C(=O)NC2(c3ccc(NC(=O)c4cc([N+](=O)[O-])ccc4N(C)C)cc3)CCC2)CC1 1790794190 JELDBBNYCJEWJZ-LJQANCHMSA-N 476.577 5.155 5 20 JKBD O=C(CSc1ccccc1[N+](=O)[O-])Nc1ccc(C2(NC(=O)Cc3ccsc3)CCC2)cc1 1791522159 HJURXXXZBDJARA-UHFFFAOYSA-N 481.599 5.125 5 20 JKBD Cc1c(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)[C@@H](C)Sc2cccs2)cc(Cl)cc1[N+](=O)[O-] 1798285095 NOWBMIPEIKHQGP-MXASKKJJSA-N 494.038 5.051 5 20 JKBD O=C(Cc1ccc(Cl)s1)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc2cc([N+](=O)[O-])ccc2s1 1801205912 GVKXMLKSQJALFL-QDMKHBRRSA-N 490.006 5.019 5 20 JKBD Cc1c(C(=O)N2CCC3(CCCN(C(=O)CCc4ccccc4)C3)CC2)cc(Cl)cc1[N+](=O)[O-] 1809087106 NIPVHFJIEJQKEA-UHFFFAOYSA-N 483.996 5.034 5 20 JKBD Cc1c(C(=O)NC[C@H]2CCN(C(=O)C3(C(C)C)CCC3)[C@@H]2c2cccnc2)cc(Cl)cc1[N+](=O)[O-] 1811796230 FPXQKALOCOJXEA-AUSIDOKSSA-N 499.011 5.098 5 20 JKBD Cc1c(C(=O)Nc2cc([C@H]3CCCCN3C(=O)[C@H](C)Cc3ccco3)[nH]n2)cc(Cl)cc1[N+](=O)[O-] 1821294950 YACUTYJXGRCZOY-JLTOFOAXSA-N 499.955 5.057 5 20 JKBD Cc1c(Cl)cccc1C(=O)N1CCCC[C@@H]1C1CCN(C(=O)/C=C/c2ccc([N+](=O)[O-])o2)CC1 1823914264 LANCBUUFYFRZIT-DQACCSDVSA-N 485.968 5.096 5 20 JKBD C[C@@H](C(=O)N1CCCC[C@H]1C1CCN(C(=O)/C=C/c2ccc([N+](=O)[O-])o2)CC1)c1ccc(Cl)cc1 1823972483 ZYXULBQOUGLVEE-YQNRKWKVSA-N 499.995 5.278 5 20 JKBD O=C(c1ccccc1C1CC1)N1CCC([C@H]2CCCCN2C(=O)/C=C/c2ccc([N+](=O)[O-])o2)CC1 1824279167 QFCNODFTTOQFBC-IYNHSRRRSA-N 477.561 5.012 5 20 JKBD O=C(c1cc(F)cc([N+](=O)[O-])c1)N1CCC([C@H]2CCCCN2C(=O)c2ccc(Cl)c(F)c2)CC1 1830486156 IKBOJXZEHPNFBB-JOCHJYFZSA-N 491.922 5.074 5 20 JKBD CCCOc1ccc(C(=O)N2CCC([C@@H]3CCCCN3C(=O)c3cc(F)cc([N+](=O)[O-])c3)CC2)cc1 1830618226 OQKYENLQSGXXMO-VWLOTQADSA-N 497.567 5.070 5 20 JKBD CC(=O)Nc1cccc(NC(=O)COC(=O)c2cc([N+](=O)[O-])ccc2Sc2ccc(Cl)cc2)c1 9032250 GULMSLHCKKNRJM-UHFFFAOYSA-N 499.932 5.153 5 20 JKBD CCNc1ccc(C(=O)OCC(=O)Nc2c(Cl)c(Cl)cc(Cl)c2Cl)cc1[N+](=O)[O-] 10530771 FKSSMSRYNZDWLH-UHFFFAOYSA-N 481.119 5.436 5 20 JKBD CC(C)n1ncc2c(C(=O)O[C@@H](C)c3nnc(-c4ccc([N+](=O)[O-])cc4)o3)cc(-c3ccco3)nc21 11046281 VWFQRBCZVRSFIZ-AWEZNQCLSA-N 488.460 5.148 5 20 JKBD O=C(Cn1c2ccccc2c(=O)c2ccccc21)O[C@@H](C(=O)Nc1ccc(F)cc1)c1ccccc1 11277135 LIIHLPWASPQUMD-MUUNZHRXSA-N 480.495 5.217 5 20 JKBD COc1cc2c(cc1OC)[C@@H](c1cccs1)N(C(=O)c1ccc([N+](=O)[O-])cc1Cl)CC2 16002523 WCQJUBMDWQRXPN-NRFANRHFSA-N 458.923 5.115 5 20 JKBD CC[C@@H]1CCc2sc(-c3nnc(S[C@@H](C)c4nnc(-c5ccc([N+](=O)[O-])cc5)o4)n3C)cc2C1 17717207 YGCQYWPHBYMQIP-UONOGXRCSA-N 496.618 5.870 5 20 JKBD C[C@H](OC(=O)c1csc(-c2cccc(Cl)c2)n1)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl 17980712 VRMHFXZRDFXZSP-JTQLQIEISA-N 466.302 5.209 5 20 JKBD CC(C)c1cccc(C(C)C)c1NC(=O)CSc1nc2cc3ccccc3cc2c(=O)n1C 22253253 LUDXDLJCPKKDEU-UHFFFAOYSA-N 459.615 6.064 5 20 JKBD CCOc1ccc(Oc2ccc(Cl)cc2NC(=O)c2cc(OCC)c(OC)cc2[N+](=O)[O-])cc1 26770218 XKFZVESELSBFAI-UHFFFAOYSA-N 486.908 6.099 5 20 JKBD CCCOc1ccc(NC(=O)C2CCN(c3ccc(C(F)(F)F)cc3[N+](=O)[O-])CC2)c(C)c1 59825867 VDIJQKWVJPCJNN-UHFFFAOYSA-N 465.472 5.566 5 20 JKBD C[C@@H](Cc1nnc(S[C@H](C)C(=O)Nc2nc(-c3cccc([N+](=O)[O-])c3)cs2)o1)c1ccccc1 255939849 VJCRELCAJYUOHL-LSDHHAIUSA-N 495.586 5.567 5 20 JKBD O=C(Cn1c2ccccc2c(=O)c2ccccc21)N(Cc1cc(Br)ccc1F)C1CC1 498326158 TXBCATCDXREUFK-UHFFFAOYSA-N 479.349 5.248 5 20 JKBD C[C@@H](c1ccco1)N(C(=O)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1)C1CC1 509825038 DIKOZFDCVWNKNM-AWEZNQCLSA-N 451.445 5.175 5 20 JKBD CCc1ccc(Cl)c(CC)c1NC(=O)c1cc(OC)c(OCc2cscn2)cc1[N+](=O)[O-] 512395006 NHZKOOJHHRDNCT-UHFFFAOYSA-N 475.954 5.669 5 20 JKBD Cc1cc(C(=O)NC2CCCCC2)ccc1NC(=O)[C@H](C)Oc1ccc(Cl)cc1[N+](=O)[O-] 520409936 GHTNYBLGINEJKV-HNNXBMFYSA-N 459.930 5.025 5 20 JKBD O=C(Nc1ccc(NC(=O)c2ccc(NC3CC3)c([N+](=O)[O-])c2)c(C(F)(F)F)c1)c1ccccc1 603742898 JXFUTMLEKIHFBO-UHFFFAOYSA-N 484.434 5.693 5 20 JKBD CC(C)NC(=O)c1ccc(NC(=O)c2ccc(NCc3ccccc3Cl)c([N+](=O)[O-])c2)cc1 603993369 RRILQLGPJWBVAC-UHFFFAOYSA-N 466.925 5.251 5 20 JKBD O=C(Nc1ccc(-c2noc(C(F)(F)F)n2)cc1)c1csc(-c2cccc([N+](=O)[O-])c2)n1 608874503 DHURMWIZDDKYBD-UHFFFAOYSA-N 461.381 5.039 5 20 JKBD COc1ccc(CC(=O)C(c2nc3ccccc3s2)c2nc3ccccc3s2)cc1[N+](=O)[O-] 609053885 SWTIWQSWCITQRE-UHFFFAOYSA-N 475.551 5.767 5 20 JKBD O=[N+]([O-])c1cccc(/C(O)=C(/C(=S)Nc2ccccc2-c2ccccc2)[n+]2cccc(O)c2)c1 725764572 ZNPUHXDSFTZEFQ-UHFFFAOYSA-O 470.530 5.578 5 20 JKBD Cc1cc(=O)oc2cc(OCc3ccc(C(=O)N4c5ccc([N+](=O)[O-])cc5C[C@@H]4C)cc3)ccc12 728812030 VOLCEPSHHFOBMT-KRWDZBQOSA-N 470.481 5.180 5 20 JKBD Cc1ccc(-c2ncc(C(=O)O[C@@H](C)C(=O)Nc3ccc([N+](=O)[O-])cc3C(F)(F)F)s2)c(C)c1 747264306 PIANBZBHYPSJTE-ZDUSSCGKSA-N 493.463 5.538 5 20 JKBD COc1ccc(Nc2nc(COC(=O)c3csc(-c4ccc([N+](=O)[O-])cc4)n3)cs2)cc1 747955697 WGQMIJXMGMBWNC-UHFFFAOYSA-N 468.516 5.284 5 20 JKBD CC[C@H](C)Sc1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2I)c(C)c1 748194815 KWJNWYHKNODSRZ-LBPRGKRZSA-N 470.332 5.651 5 20 JKBD O=C(OCC1CCN(c2ccc([N+](=O)[O-])cn2)CC1)[C@@H](Sc1ccccc1)c1ccccc1 750425381 BODOHBWNISNGAN-DEOSSOPVSA-N 463.559 5.283 5 20 JKBD COc1ccc([N+](=O)[O-])cc1NC(=O)[C@H](C)Sc1nc2cc(C(F)(F)F)ccc2s1 753854914 RLTZXYNSSUJTKR-VIFPVBQESA-N 457.455 5.351 5 20 JKBD Cc1ccc(-c2cc(C(=O)Nc3cc([N+](=O)[O-])c(F)cc3F)c3cnn(C(C)C)c3n2)cc1 897594178 SBBFYMOEOYMAEQ-UHFFFAOYSA-N 451.433 5.426 5 20 JKBD CC(C)c1ccc(-c2nc(C(=O)O[C@@H](C)C(=O)Nc3ccc(F)c([N+](=O)[O-])c3)cs2)cc1 900234701 HWHUZCWYGISGTH-ZDUSSCGKSA-N 457.483 5.165 5 20 JKBD COc1ccc(NC(=O)c2ccc(Cn3nc(C)c([N+](=O)[O-])c3C)cc2)cc1NC(=O)OC(C)(C)C 915078824 FPUSMGPWYWAHEI-UHFFFAOYSA-N 495.536 5.064 5 20 JKBD O=C(Nc1cc(Cl)c([N+](=O)[O-])cc1OCc1ccccc1)c1ccc(CN2CCCCC2=O)cc1 915139192 SWMIJBZURCBHQN-UHFFFAOYSA-N 493.947 5.592 5 20 JKBD CC(C)[C@@H](OC(=O)c1ccc(Br)c([N+](=O)[O-])c1)C(=O)Nc1ccccc1C(F)(F)F 915365815 IBMCUISEXQXDJE-MRXNPFEDSA-N 489.244 5.196 5 20 JKBD CCOC(=O)/C(=C/c1ccc(-c2ccc(OC)cc2[N+](=O)[O-])o1)c1nc(O)c2c(C)c(C)sc2n1 916126669 IXIZVBGBWZQKQD-LICLKQGHSA-N 495.513 5.294 5 20 JKBD Cc1csc(Sc2ccc(C(=O)Nc3cc(N4CCCC4=O)ccc3F)cc2[N+](=O)[O-])n1 917797406 PQAACWQGALMQAA-UHFFFAOYSA-N 472.523 5.029 5 20 JKBD C[C@@H](OC(=O)c1cc([N+](=O)[O-])ccc1Oc1ccccc1)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl 919192988 RXYDFTBDKMRSRP-CYBMUJFWSA-N 485.836 5.133 5 20 JKBD C[C@H](OC(=O)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-])C(=O)Nc1cc(Cl)ccc1Cl 919195171 CZPNOJZXJQZVGU-VIFPVBQESA-N 481.210 5.027 5 20 JKBD O=C(CC12C[C@@H]3C[C@H](C1)CC(C(=O)Nc1cccc([N+](=O)[O-])c1)(C3)C2)Nc1cccc([N+](=O)[O-])c1 919880775 QCBYLCFJFFULAB-PHBHNISSSA-N 478.505 5.057 5 20 JKBD C[C@@H](OC(=O)c1csc(-c2ccc(Cl)s2)n1)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl 920675450 JVGOYFPXZJOZGO-MRVPVSSYSA-N 472.331 5.271 5 20 JKBD C[C@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)Nc1ccc(-c2nnc3n2CCCCCC3)cc1 920766185 SBGSVUOYSDWNGD-HNNXBMFYSA-N 469.929 5.029 5 20 JKBD Cc1nc(-c2ccc(Cl)s2)sc1C(=O)OCc1nc(-c2ccc([N+](=O)[O-])cc2)no1 921105911 VEHSFDGTSVFJQG-UHFFFAOYSA-N 462.896 5.149 5 20 JKBD COc1cscc1C(=O)Nc1ccc(C2(NC(=O)c3c(F)ccc([N+](=O)[O-])c3C)CCC2)cc1 1788830183 RVTBJGLALDYBEP-UHFFFAOYSA-N 483.521 5.174 5 20 JKBD CC1=CC[C@H](C(=O)NC2(c3ccc(NC(=O)c4cc([N+](=O)[O-])c(O)cc4C)cc3)CCC2)CC1 1790809029 AYJYGQKPQGVZLD-SFHVURJKSA-N 463.534 5.103 5 20 JKBD COc1cc(C(=O)N2CCC([C@H]3CCCCN3C(=O)c3ccc(C)c(Cl)c3)CC2)ccc1[N+](=O)[O-] 1823908502 YCVBFFOZMHUZLF-JOCHJYFZSA-N 499.995 5.112 5 20 JKBD Cc1ccsc1C(=O)N1CCCC[C@H]1C1CCN(C(=O)Cc2ccc(Cl)cc2[N+](=O)[O-])CC1 1825781237 UXAXYJUDLKLMAO-FQEVSTJZSA-N 490.025 5.094 5 20 JKBD Cc1ccc(SCC(=O)N2CCC([C@H]3CCCCN3C(=O)c3cc(F)cc([N+](=O)[O-])c3)CC2)cc1 1830617459 PWYDGDLUERFJKA-XMMPIXPASA-N 499.608 5.068 5 20 JKBD CC(C)CCC(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cc(Br)ccc2[N+](=O)[O-])CC1 1831381738 HKZARHZKOYAWDR-FQEVSTJZSA-N 494.430 5.027 5 20 JKBD O=C(CSc1nc2ccccc2c2nc3ccccc3n12)Nc1ccccc1OC(F)F 20861137 ULPYAPSGQNAOCR-UHFFFAOYSA-N 450.470 5.368 5 20 JKBD CCOc1cc(C(=O)Nc2nc(-c3ccc(Br)s3)cs2)c([N+](=O)[O-])cc1OC 26795292 ZAUISVCMRBKHSU-UHFFFAOYSA-N 484.353 5.202 5 20 JKBD C[C@@H](Nc1ccc(C(=O)NCc2ccc(Br)cc2Cl)cc1[N+](=O)[O-])c1ccccn1 109254037 DBDCTCSYJPXDFF-CYBMUJFWSA-N 489.757 5.509 5 20 JKBD Cc1cc(N2CCSCC2)ccc1NC(=O)c1ccc(N[C@H](C)c2ccccn2)c([N+](=O)[O-])c1 215767396 HVBFYJUMAXAFIB-GOSISDBHSA-N 477.590 5.277 5 20 JKBD COc1ccc2[nH]cc(C3CCN(C(=O)c4csc(-c5cccc([N+](=O)[O-])c5)n4)CC3)c2c1 215803765 JGPBYGUOXICYRD-UHFFFAOYSA-N 462.531 5.228 5 20 JKBD Cc1cc(NC(=O)C2CCN(c3ccc(C(F)(F)F)cc3[N+](=O)[O-])CC2)n(-c2ccccc2F)n1 302939390 JMRKKHGKLRWYMA-UHFFFAOYSA-N 491.445 5.102 5 20 JKBD Cc1ccc(NC(=O)[C@H](Sc2ccc(Br)cn2)c2ccccc2)c([N+](=O)[O-])c1 302960438 GIVPLOZKRNMCMA-LJQANCHMSA-N 458.337 5.533 5 20 JKBD COc1cc(OCC(=O)Nc2ccc(N[C@@H](C)c3ccccc3)c(Cl)c2)ccc1[N+](=O)[O-] 303029178 NSRSBZSWCGCRBN-HNNXBMFYSA-N 455.898 5.447 5 20 JKBD C[C@@H](Nc1ccc(NC(=O)CNC(=O)c2c(Cl)cccc2[N+](=O)[O-])cc1Cl)c1ccccc1 303409034 UGJYXSRVPLXVOW-CQSZACIVSA-N 487.343 5.443 5 20 JKBD O=C(N[C@@H](c1ccccc1)c1cc2ccccc2o1)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-] 478150441 VPPHMGCTOJSULW-QFIPXVFZSA-N 470.403 5.802 5 20 JKBD Cc1cccc(NC(=O)N2CCN(C(=O)c3cc([N+](=O)[O-])ccc3Sc3ccccc3)CC2)c1 486208319 SDPNJHNNURFCFB-UHFFFAOYSA-N 476.558 5.044 5 20 JKBD Cc1cc(C(=O)N2CCC(C)CC2)ccc1NC(=O)c1csc(-c2cccc([N+](=O)[O-])c2)n1 496613611 VZQISQUJESUCND-UHFFFAOYSA-N 464.547 5.151 5 20 JKBD COc1cccc([C@H](CNC(=O)Nc2ccc(C)c([N+](=O)[O-])c2)c2c[nH]c3ccccc23)c1OC 503694726 HZURCZCJYPTAQA-NRFANRHFSA-N 474.517 5.355 5 20 JKBD C[C@@H](Cc1ccc(Cl)cc1Cl)NC(=O)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-] 504913164 BXEDQGJEXAIFOO-JTQLQIEISA-N 451.228 5.204 5 20 JKBD CC(C)OC(=O)C[C@@H](NC(=O)Nc1ccc(C(=O)Nc2ccccc2)cc1)c1ccccc1[N+](=O)[O-] 506657198 PXSPGCXKATXTOU-JOCHJYFZSA-N 490.516 5.052 5 20 JKBD Cc1cc(C(=O)N(Cc2ccccc2[N+](=O)[O-])CC(F)(F)F)c2cc(Br)ccc2n1 508924031 QCSSUGNTZBOBDG-UHFFFAOYSA-N 482.256 5.419 5 20 JKBD C[C@@H](SCC(=O)Nc1cc2c(cc1[N+](=O)[O-])OCCCO2)c1ccc(OC(F)(F)F)cc1 518915354 PCTWXNCZYIVUJN-GFCCVEGCSA-N 472.441 5.088 5 20 JKBD Cc1ncc([N+](=O)[O-])cc1C(=O)Nc1nc(C2CC2)c(Cc2cccc(C(F)(F)F)c2)s1 523175583 DDOHOJFZYRIETO-UHFFFAOYSA-N 462.453 5.494 5 20 JKBD C[C@@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)N1CCC[C@H](c2nc(-c3ccc(Cl)cc3)no2)C1 523281328 LDPNMPZVQUERCO-HIFRSBDPSA-N 491.331 5.125 5 20 JKBD O=C(NCc1ccco1)Nc1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2Oc2ccccc2)cc1 603787804 MRTNDWNVOJAOTR-UHFFFAOYSA-N 472.457 5.554 5 20 JKBD CCOC(=O)C[C@H](c1ccccc1)C1CCN(C(=O)[C@H](C)Sc2ccc([N+](=O)[O-])cc2)CC1 603928130 LXXKNOVJGJDOAQ-FDDCHVKYSA-N 470.591 5.051 5 20 JKBD CC(=O)Nc1ccc(C)c(N[C@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Br)c2ccccc2)c1 604043927 HIBVKJKKTVMIGI-QFIPXVFZSA-N 497.349 5.416 5 20 JKBD Cc1sc(NC(=O)c2ccc(N[C@@H](C)c3ccccn3)c([N+](=O)[O-])c2)nc1-c1ccccc1 604295352 MVUOYHJMAWBXRV-HNNXBMFYSA-N 459.531 5.847 5 20 JKBD CC(=O)Nc1cccc([C@@H](C)NCc2ccc(-c3ccc([N+](=O)[O-])cc3Br)o2)c1 608835758 QKINMFLDCBNKDV-CYBMUJFWSA-N 458.312 5.427 5 20 JKBD Cc1cc(Br)cc2c1N(C(=O)c1csc(-c3ccc([N+](=O)[O-])cc3)n1)CCC2 609102209 GKZDBSMKWXAGFB-UHFFFAOYSA-N 458.337 5.382 5 20 JKBD COc1ccccc1[C@@H](C)CC(=O)O[C@H](C(=O)Nc1ccc(C)cc1[N+](=O)[O-])c1ccccc1 728658690 NIIPQLFALCDASE-BVZFJXPGSA-N 462.502 5.329 5 20 JKBD O=C(Oc1ccc2c(-c3ccc([N+](=O)[O-])cc3)cc(=O)oc2c1)c1csc(-c2ccoc2)n1 730959111 BINBQPISLYHBTQ-UHFFFAOYSA-N 460.423 5.304 5 20 JKBD C[C@H](OC(=O)CCSc1ccc(Cl)cc1)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 788986793 PUYZEGRNZVFYJV-NSHDSACASA-N 476.860 5.320 5 20 JKBD CCOc1ccc(-c2nc(C)c(C(=O)O[C@@H](C)c3nnc(-c4ccc([N+](=O)[O-])cc4)o3)s2)cc1 914909274 YVTSLZGEQAMZIC-AWEZNQCLSA-N 480.502 5.393 5 20 JKBD CC(C)c1cccc(O[C@H](C)C(=O)O[C@@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2C(F)(F)F)c1 919450905 PTCICFBKGCQEMD-UONOGXRCSA-N 468.428 5.075 5 20 JKBD COc1cc(C(=O)Nc2cccc(COc3ccccc3)c2)c([N+](=O)[O-])cc1OCc1cscn1 919887711 PNKQWHBMSQZULS-UHFFFAOYSA-N 491.525 5.470 5 20 JKBD O=C(NC1(c2ccc(NC(=O)c3cc(Br)cs3)cc2)CCC1)c1ccc([N+](=O)[O-])o1 1788675696 PYODZBQHTZRZQQ-UHFFFAOYSA-N 490.335 5.073 5 20 JKBD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)Cc1ccc(Cl)cc1[N+](=O)[O-])[C@@H]1CCC[C@@H]2CCCC[C@@H]21 1793079297 PUHWQSBIPAPHLT-WABZUUDDSA-N 488.028 5.035 5 20 JKBD Cc1cc(C(=O)NC[C@@H]2CCN(C(=O)CCCCCC(C)(C)C)[C@H]2c2cccnc2)ncc1[N+](=O)[O-] 1808669181 YFCLQMYZSYGUEG-OFVILXPXSA-N 495.624 5.009 5 20 JKBD O=C(Nc1cc([C@@H]2CCCCN2C(=O)CCc2cccc([N+](=O)[O-])c2)[nH]n1)c1ccc(Cl)cc1F 1814579872 OMNHSGDXWMJVPX-NRFANRHFSA-N 499.930 5.049 5 20 JKBD C[C@H](C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cccc(F)c2[N+](=O)[O-])[nH]n1)c1ccc(Cl)cc1 1814662161 ZKBZNMMYDLEWLK-XOBRGWDASA-N 499.930 5.220 5 20 JKBD Cc1c(C(=O)N2CCCC[C@H]2c2cc(NC(=O)CC3CCCC3)n[nH]2)cc(Cl)cc1[N+](=O)[O-] 1816689527 LYHKCDCAJKFEQA-IBGZPJMESA-N 473.961 5.166 5 20 JKBD Cc1oc(C(C)(C)C)cc1C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2ccc(O)c([N+](=O)[O-])c2)CC1 1825951472 RHLLKJIDCZPSJG-OAQYLSRUSA-N 497.592 5.046 5 20 JKBD CC[C@H](C(=O)N1CCCC[C@@H]1C1CCN(C(=O)Cc2cc(F)ccc2[N+](=O)[O-])CC1)c1ccccc1 1826317023 OQYGNXCAJDHOGK-LOSJGSFVSA-N 495.595 5.090 5 20 JKBD O=C(c1ccccc1C1CC1)N1CCC([C@@H]2CCCCN2C(=O)c2cc(F)cc([N+](=O)[O-])c2)CC1 1830615551 KPTDSJLHGAEQJW-VWLOTQADSA-N 479.552 5.158 5 20 JKBD O=C(c1cccc(F)c1[N+](=O)[O-])N1CCCC[C@H]1C1CCN(C(=O)C2(c3ccccc3)CCC2)CC1 1830622818 OBLXHLVCRBQDIQ-DEOSSOPVSA-N 493.579 5.089 5 20 JKBD CCOc1ccc([C@@H](C)N[C@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2ccccc2)cc1 11708070 GIEKIMWQFJMADS-MWTRTKDXSA-N 453.926 5.678 5 20 JKBD O=C(c1ccc(NCc2ccccc2Cl)c([N+](=O)[O-])c1)N1CCO[C@@H](c2ccccc2)C1 27908835 DEUXNHHQRDTOIF-HSZRJFAPSA-N 451.910 5.074 5 20 JKBD O=[N+]([O-])c1ccc(OCc2nnc(-c3ccc(Br)o3)o2)c(Cc2ccccc2)c1 31767620 ITVQWQXALXGWIY-UHFFFAOYSA-N 456.252 5.170 5 20 JKBD CSc1nc(-c2ccco2)nc(C)c1C(=O)Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1 71838849 LKFRXXQFGZPHIK-UHFFFAOYSA-N 453.505 5.051 5 20 JKBD COc1ccc(CSCC(=O)Nc2ccccc2CN(C)C2CCCCC2)cc1[N+](=O)[O-] 105981807 GVBPHSDREGBVSC-UHFFFAOYSA-N 457.596 5.240 5 20 JKBD O=C(Cn1c2ccccc2c(=O)c2ccccc21)Nc1ccccc1Oc1ncc(Cl)cc1Cl 107810593 RELZFKGQNTVNNZ-UHFFFAOYSA-N 490.346 6.288 5 20 JKBD C[C@@H](N[C@@H](Cc1ccccc1)c1ccccc1)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 248235149 DGGDGEGTEDPXMH-ZHRRBRCNSA-N 457.452 5.514 5 20 JKBD COc1ccccc1N1CC[C@@H](CNC(=O)c2ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])cc2)C1 303111366 NXDPWJNKWRCMBK-KRWDZBQOSA-N 481.936 5.305 5 20 JKBD O=C(CSc1nnc(-c2cccs2)n1-c1ccc(Cl)cc1)Nc1ccccc1[N+](=O)[O-] 479717732 KCCZJDOUXNOBNE-UHFFFAOYSA-N 471.951 5.288 5 20 JKBD CCOCc1ccccc1CNC(=O)C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1 503040131 UCNWLPXUAJAYHH-PXLXIMEGSA-N 487.581 5.988 5 20 JKBD C[C@@H](Nc1ccc2c(c1)CCC(=O)N2Cc1ccc(Cl)cc1)C(=O)Nc1cccc([N+](=O)[O-])c1 521046121 KDAAYTHBJVPVNU-MRXNPFEDSA-N 478.936 5.167 5 20 JKBD COCc1cccc2sc(NC(=O)CSc3ccc(C(F)(F)F)cc3[N+](=O)[O-])nc12 521527100 BGTUEBFWXIYJMD-UHFFFAOYSA-N 457.455 5.101 5 20 JKBD Cc1cc([N+](=O)[O-])ccc1NC(=O)CCSc1nnc(-c2ccco2)n1C1CCCCC1 592995790 JWCNJRKRYHTLQA-UHFFFAOYSA-N 455.540 5.381 5 20 JKBD Cc1cccc(-c2nnc(SCc3nc(-c4cccc([N+](=O)[O-])c4)no3)n2Cc2ccco2)c1 603562885 VRJKGJXTXRTZQA-UHFFFAOYSA-N 474.502 5.145 5 20 JKBD Cc1sc(NC(=O)COc2ccc(Oc3ccccn3)cc2)nc1-c1cccc([N+](=O)[O-])c1 603997503 LUACPTWHAJZBOG-UHFFFAOYSA-N 462.487 5.232 5 20 JKBD COc1cc(C(=O)Nc2ccc(-c3nc(C)c(C)o3)cc2)c([N+](=O)[O-])cc1OCc1cscn1 604354386 CAGYJJHUEJNWJD-UHFFFAOYSA-N 480.502 5.163 5 20 JKBD Cc1ccc(NC(=O)c2cccc(C(F)(F)F)c2)cc1NC(=O)NCCc1ccc([N+](=O)[O-])cc1 604453203 XMPPVAYVPMHPTR-UHFFFAOYSA-N 486.450 5.539 5 20 JKBD O=C(Nc1ccc2ccccc2n1)c1ccc(C(=O)Nc2ccc3ccccc3n2)c([N+](=O)[O-])c1 609043608 BGUFGPSPYCTOJM-UHFFFAOYSA-N 463.453 5.196 5 20 JKBD COc1ccc(NC(=O)c2ccc(SC)c([N+](=O)[O-])c2)cc1OCc1ccc2ccccc2n1 609066175 LIBWJTFGXNNAED-UHFFFAOYSA-N 475.526 5.705 5 20 JKBD Cc1c(C(=O)Nc2nc(C3CC3)c(Cc3ccc(F)cc3)s2)cc([N+](=O)[O-])cc1[N+](=O)[O-] 727097224 LXDONCUVHGRYGJ-UHFFFAOYSA-N 456.455 5.128 5 20 JKBD CC(C)(C)OC(=O)Nc1ccc(NCc2nc(-c3ccc([N+](=O)[O-])cc3)no2)c(C(F)(F)F)c1 729675502 LHYJBMVGFOXYAN-UHFFFAOYSA-N 479.415 5.623 5 20 JKBD Cc1cc(C)c(NC(=S)/C(=C(/O)c2ccc(C)c([N+](=O)[O-])c2)[n+]2cccc(CO)c2)c(Cl)c1 747891935 QMRLNWCUWOYYLB-UHFFFAOYSA-O 484.985 5.277 5 20 JKBD COCCN(C(=O)/C=C\c1nc2ccccc2s1)c1nc(-c2ccc([N+](=O)[O-])cc2)cs1 900791820 GAXYAUFDTAKTAA-KHPPLWFESA-N 466.544 5.021 5 20 JKBD COc1cccc([C@H](CNC(=O)c2ccc(Cl)c([N+](=O)[O-])c2)c2c[nH]c3ccccc23)c1OC 912663978 GQZSEXSYFVKBJX-IBGZPJMESA-N 479.920 5.309 5 20 JKBD Cc1c(C(=O)O[C@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)sc2nc(C(F)(F)F)ccc12 914679972 VOPODXOWMZVNLK-SNVBAGLBSA-N 478.408 5.500 5 20 JKBD COc1ccc(CN(C)C(=O)C/C(=C\c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)cc1F 917353916 YLNNLUXOGJTPBP-CPNJWEJPSA-N 491.544 5.942 5 20 JKBD CC(=O)N(c1cccc(Cl)c1)c1nc(COC(=O)c2cc3cc([N+](=O)[O-])ccc3[nH]2)cs1 919513900 JMOYLVNALMONNM-UHFFFAOYSA-N 470.894 5.228 5 20 JKBD Cc1c(C(=O)COC(=O)c2ccc(N[C@H](C)c3ccccn3)c([N+](=O)[O-])c2)oc2ccccc12 920548790 SSMGYHHYZRVVMY-MRXNPFEDSA-N 459.458 5.257 5 20 JKBD COc1ccc2oc(C(=O)NC3(c4ccc(NC(=O)Cc5cccc([N+](=O)[O-])c5)cc4)CCC3)cc2c1 1785791904 OBOQZMZBNRSHFL-UHFFFAOYSA-N 499.523 5.340 5 20 JKBD O=C(/C=C/c1ccc([N+](=O)[O-])o1)Nc1ccc(C2(NC(=O)[C@@H]3CCCCC3(F)F)CCC2)cc1 1786205935 VEHFDXGJGFWRON-JARZOMNASA-N 473.476 5.161 5 20 JKBD Cc1cc(C(=O)NC2(c3ccc(NC(=O)Cc4ccc(Cl)s4)cc3)CCC2)ncc1[N+](=O)[O-] 1786733293 YMTWFFQBIKCEQA-UHFFFAOYSA-N 484.965 5.004 5 20 JKBD O=C(Cc1cccc([N+](=O)[O-])c1)NC1(c2ccc(NC(=O)c3cc4cc[nH]c4cc3F)cc2)CCC1 1790069090 OGSNEPFPLYJKTC-UHFFFAOYSA-N 486.503 5.206 5 20 JKBD C[C@H](CC(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cccc(F)c2[N+](=O)[O-])CC1)c1ccccc1 1831508733 DZIVXPKMXUKPST-NTKDMRAZSA-N 481.568 5.161 5 20 JKBD Cc1cc(F)cc(C(=O)N2CCC([C@H]3CCCCN3C(=O)CSc3ccccc3[N+](=O)[O-])CC2)c1 1831777208 IZUSFUMVGWUKJN-JOCHJYFZSA-N 499.608 5.068 5 20 JKBD C[C@@H](OC(=O)c1cc([N+](=O)[O-])ccc1Cl)C(=O)N(Cc1ccccc1)Cc1ccccc1 10666698 LZOLCTBXLGLMSU-QGZVFWFLSA-N 452.894 5.023 5 20 JKBD COc1cc(C(=O)Nc2ccc(OC(F)F)c(Cc3ccccc3)c2)c([N+](=O)[O-])cc1OC 11322960 FBMCASGUADTLOB-UHFFFAOYSA-N 458.417 5.057 5 20 JKBD C[C@@H](OC(=O)c1c2c(nc3ccccc13)CCCCC2)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 17661352 GOHKKXVPHOOTKC-OAHLLOKOSA-N 458.474 5.380 5 20 JKBD CCOc1ccccc1NC(=O)[C@@H](OC(=O)c1cc(Cl)ccc1[N+](=O)[O-])c1ccccc1 23515095 WYISKTXDLYEINP-NRFANRHFSA-N 454.866 5.184 5 20 JKBD Cc1cc([N+](=O)[O-])ccc1NC(=O)CCSc1nnc(-c2c[nH]c3ccccc23)n1C1CC1 26411995 ARDIRAWGKCDMNB-UHFFFAOYSA-N 462.535 5.099 5 20 JKBD O=C(C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1)N(Cc1ccco1)Cc1ccco1 30471541 GPOCZLAPIYQEEU-UHFFFAOYSA-N 477.439 5.245 5 20 JKBD CN(Cc1ccccc1[N+](=O)[O-])C(=O)c1cccnc1SCc1cccc(Br)c1 31756934 ONZOEOJMKXXUPG-UHFFFAOYSA-N 472.364 5.317 5 20 JKBD O=C(CCSc1nnc(-c2ccccc2Cl)n1C1CCCC1)Nc1ccccc1[N+](=O)[O-] 45800259 LCXSDKIFYDZMNZ-UHFFFAOYSA-N 471.970 5.743 5 20 JKBD O=C(NCc1ccccc1CN1CCCC1=O)c1cc([N+](=O)[O-])ccc1Sc1ccc(Cl)cc1 481986622 UTOZYRODCZYBHW-UHFFFAOYSA-N 495.988 5.452 5 20 JKBD CCOC(=O)c1cc(C(=O)Nc2ccc(S[C@H](C)CC)cc2C(F)(F)F)cc([N+](=O)[O-])c1 499559222 NLFPOHACUXCZMA-GFCCVEGCSA-N 470.469 5.933 5 20 JKBD C[C@@H](Nc1ccc(C(=O)Nc2cnccc2Oc2ccccc2)cc1[N+](=O)[O-])c1ccccn1 499622761 SCSIIZJIIFIMGB-QGZVFWFLSA-N 455.474 5.603 5 20 JKBD C[C@@H](NC(=O)c1ccc(NCc2ccccc2Cl)c([N+](=O)[O-])c1)c1ccc2c(c1)CCC(=O)N2 500059183 ZMBDBYBLRFNNMD-OAHLLOKOSA-N 478.936 5.236 5 20 JKBD COc1cc([C@@H](C)NCc2ccc(N(C)c3ccccc3)c([N+](=O)[O-])c2)cc(OC)c1OC 508102758 MJTDUCCYANDNGK-QGZVFWFLSA-N 451.523 5.239 5 20 JKBD COc1cc(C(=O)NC2(Cc3ccc(Br)cc3)CCCCC2)c([N+](=O)[O-])cc1OC 509666727 PUQXHTUBZCPRFN-UHFFFAOYSA-N 477.355 5.050 5 20 JKBD O=C(Nc1ccccc1OC[C@@H]1CCCCO1)c1cc([N+](=O)[O-])ccc1Sc1ccccc1 511397367 LWXQLHDCOJUDQK-IBGZPJMESA-N 464.543 5.946 5 20 JKBD COc1cc(C(=O)N(Cc2ccco2)Cc2cccs2)c([N+](=O)[O-])cc1OCc1cscn1 512604821 QRIOSOJQYSSNHY-UHFFFAOYSA-N 485.543 5.136 5 20 JKBD O=[N+]([O-])c1cccc(-c2noc(CSc3nnc(-c4ccncc4)n3-c3ccc(Cl)cc3)n2)c1 514487585 OGXNRODPGPIBII-UHFFFAOYSA-N 491.920 5.233 5 20 JKBD Cc1noc(-c2ccc(C)c(NC(=O)CSc3ccc(C(F)(F)F)cc3[N+](=O)[O-])c2)n1 515451857 QTGYHCFPGCPDSB-UHFFFAOYSA-N 452.414 5.011 5 20 JKBD CC[C@@H](C)NC(=O)c1cccc(CN[C@@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2ccccc2)c1 515759729 WNJVQIOPNLDLPH-MZNJEOGPSA-N 494.979 5.246 5 20 JKBD O=C(COc1ccc(-c2ccccc2)cc1[N+](=O)[O-])Nc1cc2c(cc1Cl)OCCCO2 516786578 RKFGJYWQKOLMMV-UHFFFAOYSA-N 454.866 5.094 5 20 JKBD C[C@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)Nc1ccc(=O)n(Cc2ccc(Cl)c(Cl)c2)c1 520097749 SEBXGZGSQRANAU-LBPRGKRZSA-N 496.734 5.171 5 20 JKBD CN(Cc1ccncc1)C(=O)c1c2c(nc3ccccc13)/C(=C/c1ccc([N+](=O)[O-])cc1)CCC2 601966425 DRRXCPLDZPEOSN-HEHNFIMWSA-N 464.525 5.687 5 20 JKBD CN(C(=O)c1ccc(Sc2nc3ccccc3s2)c([N+](=O)[O-])c1)c1nc2ccccc2o1 602217516 JQVIXIQBFRYWJD-UHFFFAOYSA-N 462.512 5.774 5 20 JKBD Cc1ccc(CN(C(=O)C/C(=C/c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)C2CC2)o1 603814033 ATOGDGOVQDDRTR-RGEXLXHISA-N 473.554 6.228 5 20 JKBD CC(=O)N(c1ccc(C)c(C)c1)c1nc(CN(Cc2ccc([N+](=O)[O-])cc2)C(C)C)cs1 608788700 OLHXNFRCOFRAEV-UHFFFAOYSA-N 452.580 5.763 5 20 JKBD O=C(C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)N1CCC[C@H]1CN1CCCCC1 609023903 AJYACKBPSBQGKE-RVQWUSFHSA-N 490.629 5.612 5 20 JKBD O=C(c1c2c(nc3ccccc13)/C(=C\c1ccc([N+](=O)[O-])cc1)CCC2)N1CCC[C@H](c2ncc[nH]2)C1 609025654 WNPHIPMXCDHJIK-ZOECDYFQSA-N 493.567 5.763 5 20 JKBD O=C(CCC(=O)c1ccc2ccc3cccc4ccc1c2c34)Nc1cccc(N2CCOCC2)c1 728152110 PTALIBBIHZPJOJ-UHFFFAOYSA-N 462.549 6.022 5 20 JKBD Cc1cccc(C(C)C)c1NC(=O)COC(=O)c1ccc(N2CCC[C@@H](C)C2)c([N+](=O)[O-])c1 783521224 GJRZKPQFHRNNQQ-QGZVFWFLSA-N 453.539 5.058 5 20 JKBD Cc1ccc(NC(=O)Cc2nc(CSc3nc4ccc([N+](=O)[O-])cc4s3)cs2)cc1 788008902 IIFMPYWVCIZEEF-UHFFFAOYSA-N 456.574 5.443 5 20 JKBD Cc1cc(C)c(NC(=O)[C@H](C)OC(=O)c2cc([N+](=O)[O-])ccc2Sc2nc(C)cs2)c(C)c1 849132676 NOYQIAXPZYNGLY-INIZCTEOSA-N 485.587 5.620 5 20 JKBD Cc1ccc(F)cc1NC(=O)[C@@H](C)Oc1ccc2c(-c3ccc([N+](=O)[O-])cc3)cc(=O)oc2c1 851958942 LYMXGKDOENSEKS-OAHLLOKOSA-N 462.433 5.222 5 20 JKBD Cc1cc(NC(=O)c2ccccc2Cl)sc1C(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1 917610694 QQRWETLYKSTAAL-UHFFFAOYSA-N 450.303 5.776 5 20 JKBD Cc1ccc[n+](/C(C(=S)Nc2c(C(C)C)cccc2C(C)C)=C(/O)c2ccc(C)c([N+](=O)[O-])c2)c1 917611285 YSZDSXKGQAFILX-UHFFFAOYSA-O 490.649 7.069 5 20 JKBD Cc1nc(NC(=O)c2cc(Cl)ccc2[N+](=O)[O-])sc1Cc1cccc(Br)c1 917736993 AQCQRDPBXQYMTC-UHFFFAOYSA-N 466.744 5.619 5 20 JKBD O=C(Nc1ccccc1CN1CCc2ccccc21)c1cc([N+](=O)[O-])ccc1I 917739239 WQIGSVFIVXQTME-UHFFFAOYSA-N 499.308 5.014 5 20 JKBD CCOc1ccccc1Oc1ccc(CNC(=O)c2cc([N+](=O)[O-])ccc2N2CCCCC2)cn1 918095601 CXKQZUSBYMZZBT-UHFFFAOYSA-N 476.533 5.101 5 20 JKBD CN(Cc1cc([N+](=O)[O-])ccc1Cl)C(=O)c1csc(-c2cc(Br)cs2)n1 918320433 LPZXUXZFMITPCR-UHFFFAOYSA-N 472.773 5.468 5 20 JKBD CSCC[C@@H](NC(=O)c1ccccc1Cl)C(=O)Oc1ccc(-c2ccccc2)cc1[N+](=O)[O-] 920330808 OGDTYANOCCRXGZ-HXUWFJFHSA-N 484.961 5.372 5 20 JKBD Cc1cc(-c2noc([C@@H](C)OC(=O)c3ccc(N[C@@H](C)c4ccccn4)c([N+](=O)[O-])c3)n2)ccc1F 920546315 YAGSUTPEUPZDSZ-JKSUJKDBSA-N 491.479 5.578 5 20 JKBD C[C@H](OC(=O)c1csc(-c2ccccc2F)n1)C(=O)Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1 920728827 ACSLGSZBGKTQTE-LBPRGKRZSA-N 498.517 5.165 5 20 JKBD COc1cc2c(cc1NC(=O)COC(=O)[C@@H](C)Oc1ccc(Cl)cc1[N+](=O)[O-])oc1ccccc12 920778552 TYHLLONEZHJXOG-CYBMUJFWSA-N 498.875 5.105 5 20 JKBD O=C(/C=C/c1ccc([N+](=O)[O-])o1)Nc1ccc(C2(NC(=O)c3sccc3Cl)CCC2)cc1 1786207461 OPLQHEVGLMIPEV-SOFGYWHQSA-N 471.922 5.364 5 20 JKBD Cc1cccc2[nH]c(C(=O)Nc3ccc(C4(NC(=O)c5ccc([N+](=O)[O-])o5)CCC4)cc3)cc12 1789270737 ZXHLSXOGNJJYKS-UHFFFAOYSA-N 458.474 5.039 5 20 JKBD O=C(Cc1cc(F)ccc1[N+](=O)[O-])NC1(c2ccc(NC(=O)c3cccc4ccoc34)cc2)CCC1 1790954378 HVDDMQYJKUCWDK-UHFFFAOYSA-N 487.487 5.471 5 20 JKBD Cc1nc(C(=O)NC2(c3ccc(NC(=O)CSc4ccccc4[N+](=O)[O-])cc3)CCC2)sc1C 1791522475 XCFPAMTVGKKYLX-UHFFFAOYSA-N 496.614 5.208 5 20 JKBD Cc1cc(CCCC(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2ccc(C4CC4)cc2)C3)c([N+](=O)[O-])cc1F 1793405340 NYROXJJIUMQEFG-BKFWDETESA-N 493.579 5.194 5 20 JKBD O=C(Nc1cc([C@@H]2CCCCN2C(=O)/C=C/c2ccc([N+](=O)[O-])o2)[nH]n1)c1cc2sccc2s1 1819026635 MOAVTMZLVKUMRF-DRDHIDPGSA-N 497.558 5.206 5 20 JKBD CC1(C(=O)N2CCC([C@@H]3CCCCN3C(=O)Cn3ccc4ccc([N+](=O)[O-])cc43)CC2)CCCCC1 1824372404 HTSINHJOPXCRBD-DEOSSOPVSA-N 494.636 5.140 5 20 JKBD O=C(c1cccc(F)c1[N+](=O)[O-])N1CCC([C@@H]2CCCCN2C(=O)c2cc(F)ccc2Cl)CC1 1830578036 DRAKQWKOECSMDU-NRFANRHFSA-N 491.922 5.074 5 20 JKBD CC[C@H]1CC[C@H](C(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3cccc(F)c3[N+](=O)[O-])CC2)CC1 1831696237 MLXHHHNLEOYLSN-KKLQWCBXSA-N 473.589 5.184 5 20 JKBD CC(=O)N(c1nc(COC(=O)CSc2ccc([N+](=O)[O-])cc2)cs1)c1cccc(C)c1C 9352158 FPDGCTWYTPTZKZ-UHFFFAOYSA-N 471.560 5.188 5 20 JKBD O=C(Nc1ccc(NC(=O)c2ccco2)cc1)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1 11208004 KORFFSYCNUTZRY-UHFFFAOYSA-N 477.860 6.138 5 20 JKBD CCOc1cc(C(=O)Nc2cc(C(F)(F)F)cc(C(F)(F)F)c2)c([N+](=O)[O-])cc1OC 15632636 QDBUTDKNASRZOT-UHFFFAOYSA-N 452.307 5.292 5 20 JKBD CC(C)c1cc(C(=O)OCC(=O)Nc2ccc([N+](=O)[O-])cc2C(F)(F)F)c2ccccc2n1 18023839 ZJCHHSFWCKPEHZ-UHFFFAOYSA-N 461.396 5.081 5 20 JKBD O=C(Nc1ccc(OC(=O)c2ccccc2C(=O)c2cccs2)cc1)c1cccc([N+](=O)[O-])c1 25710069 QATLYQPXBQVBBM-UHFFFAOYSA-N 472.478 5.359 5 20 JKBD Cc1cc(C)c2sc(N(Cc3ccccc3)C(=O)c3cc([N+](=O)[O-])cc(S(C)(=O)=O)c3)nc2c1 109026055 NWGIVLILGUWHGU-UHFFFAOYSA-N 495.582 5.072 5 20 JKBD O=C(Cc1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1)NCCc1ccc(Cl)s1 117273761 YTILEZHDTVIKRS-UHFFFAOYSA-N 466.950 5.064 5 20 JKBD O=C(Nc1ccc(Cl)c(C(=O)NCc2ccccc2F)c1)c1cc2cc([N+](=O)[O-])ccc2o1 484294986 XGEQTZYGSUNCQD-UHFFFAOYSA-N 467.840 5.316 5 20 JKBD CC(=O)Nc1ccc(F)c(NC(=O)c2cc([N+](=O)[O-])ccc2Sc2ccc(Cl)cc2)c1 484369505 HJINSJDVCNEIPO-UHFFFAOYSA-N 459.886 5.749 5 20 JKBD C[C@@H]1Cc2cc([N+](=O)[O-])ccc2N1C(=O)Cc1csc(-c2cccc(Br)c2)n1 504318349 LYCWXJWENFZLKQ-GFCCVEGCSA-N 458.337 5.001 5 20 JKBD COc1ccc(Oc2ccc([N+](=O)[O-])cc2C(=O)N(C)Cc2ccc(Br)o2)cc1 509453352 SSIKHHQTBIQAPO-UHFFFAOYSA-N 461.268 5.023 5 20 JKBD Cc1cc([N+](=O)[O-])ccc1NC(=O)CNc1ccc(NC(=O)c2ccccc2)cc1C(F)(F)F 518699382 KRMLBGDIZBUYCD-UHFFFAOYSA-N 472.423 5.225 5 20 JKBD CC(C)N(C)CC1CCN(C(=O)C/C(=C/c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)CC1 519920927 JGBFXYWREFMEPW-JWGURIENSA-N 492.645 5.714 5 20 JKBD Cc1ncsc1CN(C)C(=O)C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1 520892895 OVWFRGMABXOUHN-BOPFTXTBSA-N 464.572 5.559 5 20 JKBD Cc1sc(NC(=O)c2ccc(Sc3nncn3C)c([N+](=O)[O-])c2)nc1-c1cccc(Cl)c1 559540245 BXIYKYYZSJNLBB-UHFFFAOYSA-N 486.966 5.212 5 20 JKBD O=C(CSc1nnc(-c2ccc(Cl)cc2)o1)Nc1ccc([N+](=O)[O-])cc1C(=O)c1ccccc1 589251357 KZOJTYKZUCVSTG-UHFFFAOYSA-N 494.916 5.260 5 20 JKBD O=C(CN1CCC(NCc2ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])cc2)CC1)Nc1ccccc1 603633472 NSCRQDHBFBGDFI-UHFFFAOYSA-N 494.979 5.233 5 20 JKBD CCNC(=O)c1ccc(C)c(NC(=O)c2cc([N+](=O)[O-])ccc2Sc2ccc(Cl)cc2)c1 603771687 AYSNAZBQYJNSSF-UHFFFAOYSA-N 469.950 5.710 5 20 JKBD C[C@@H](NC(=O)c1cccc(NC(=O)c2ccc(Br)cc2)c1)c1cccc([N+](=O)[O-])c1 603966908 LIXIDWXVABFHSD-CQSZACIVSA-N 468.307 5.101 5 20 JKBD COc1ccc(NC(=O)c2ccc(SC)c([N+](=O)[O-])c2)cc1NC(=O)c1ccc(Cl)cc1F 603997644 ACUUFKVQUXYKAA-UHFFFAOYSA-N 489.912 5.622 5 20 JKBD O=C(N[C@@H](c1ccccc1)c1ccc2nc(C(F)(F)F)[nH]c2c1)c1c[nH]c2ccc([N+](=O)[O-])cc12 608853175 QOBCYLCFVYYXLP-NRFANRHFSA-N 479.418 5.491 5 20 JKBD O=C(c1cc([N+](=O)[O-])ccc1Sc1ccccc1)N1CCO[C@H](c2ccc(F)c(F)c2)C1 608965177 SWILWJWSNXKTFQ-NRFANRHFSA-N 456.470 5.238 5 20 JKBD COc1ccc2cc(/C=C/C(=O)N(Cc3nnc(-c4cccc([N+](=O)[O-])c4)o3)C(C)C)ccc2c1 744001486 POXFMILLOPNXHM-XYOKQWHBSA-N 472.501 5.257 5 20 JKBD Cc1ccc(NC(=O)[C@H](OC(=O)c2csc(-c3cccc([N+](=O)[O-])c3)n2)c2ccccc2)cc1 747963766 REDGBXWVBMNSIQ-JOCHJYFZSA-N 473.510 5.564 5 20 JKBD COc1cc(C(=O)OCc2nnc(-c3ccco3)o2)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 786226269 FSFBGXSXYBAWQY-UHFFFAOYSA-N 471.809 5.049 5 20 JKBD O=C(OCCCc1nc(-c2ccncc2)no1)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1 913228177 AUSDTHRNOLSVKK-UHFFFAOYSA-N 480.864 5.275 5 20 JKBD COc1ccc(-n2c(-c3cccc(OC)c3)nn(CN(C)Cc3ccccc3[N+](=O)[O-])c2=S)cc1 914783565 VJBBJSHKJAGXTA-UHFFFAOYSA-N 491.573 5.085 5 20 JKBD Cc1ccc(-c2nnc(-c3ccc(C(=O)OCc4nc(-c5cccc([N+](=O)[O-])c5)no4)cc3)o2)cc1 914887907 OLVFDLVASAYKBP-UHFFFAOYSA-N 483.440 5.027 5 20 JKBD CCCc1cc[n+](/C(C(=S)Nc2ccccc2C(F)(F)F)=C(/O)c2ccc([N+](=O)[O-])cc2)cc1 916202321 SXINHHOGRDVQGI-UHFFFAOYSA-O 488.511 6.177 5 20 JKBD Cc1ccc(-n2c(SCC(=O)Nc3cc(Cl)ccc3[N+](=O)[O-])nnc2-c2ccco2)cc1 916664821 KOYQXWWFQILVCN-UHFFFAOYSA-N 469.910 5.128 5 20 JKBD CC(C)N(Cc1ccc([N+](=O)[O-])cc1)Cn1nc(-c2ccncc2)n(Cc2ccccc2)c1=S 919950842 USXFQLIYJLWNQD-UHFFFAOYSA-N 474.590 5.301 5 20 JKBD Cc1sc2nc([C@@H](C)OC(=O)c3ccc(N[C@H](C)c4ccccn4)c([N+](=O)[O-])c3)nc(O)c2c1C 920543359 BYLFHIRKZYHITC-ZIAGYGMSSA-N 493.545 5.408 5 20 JKBD COc1ccccc1C(=O)NC1(c2ccc(NC(=O)Cn3ccc4ccc([N+](=O)[O-])cc43)cc2)CCC1 1786277786 UQZCZVYOHLOPOX-UHFFFAOYSA-N 498.539 5.006 5 20 JKBD CC1=CC[C@@H](C(=O)Nc2ccc(C3(NC(=O)c4cccc(F)c4[N+](=O)[O-])CCC3)cc2)CC1 1789114772 KANWUXBFNGBMSZ-QGZVFWFLSA-N 451.498 5.228 5 20 JKBD Cc1ccccc1NCC(=O)NC1(c2ccc(NC(=O)Cc3ccc(C)c([N+](=O)[O-])c3)cc2)CCC1 1790526013 IAMDCCWIPHXQAE-UHFFFAOYSA-N 486.572 5.000 5 20 JKBD CN(C)c1ccc([N+](=O)[O-])cc1C(=O)Nc1ccc(C2(NC(=O)[C@@H](F)c3ccccc3)CCC2)cc1 1790791501 FODADFQITAMTAG-DEOSSOPVSA-N 490.535 5.119 5 20 JKBD O=C(/C=C/C1CCCCC1)Nc1cc([C@H]2CCCCN2C(=O)CSc2ccccc2[N+](=O)[O-])[nH]n1 1820907753 IZZPUBHZSKHAHO-FBRRREGBSA-N 497.621 5.239 5 20 JKBD O=C(Nc1cc([C@@H]2CCCCN2C(=O)/C=C/c2ccccc2[N+](=O)[O-])[nH]n1)c1ccc(Cl)c(F)c1 1821042700 PGNAAZMNBDDPJW-ZUURVNMSSA-N 497.914 5.130 5 20 JKBD CC[C@H](C)CC(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cc3cc([N+](=O)[O-])ccc3s2)n[nH]1 1821611005 LFZWRVDKGLOAMZ-KSSFIOAISA-N 469.567 5.275 5 20 JKBD Cc1ccc(CC(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3ccccc3C3CC3)CC2)cc1[N+](=O)[O-] 1830365008 YCIKKROLTYZSGG-AREMUKBSSA-N 489.616 5.257 5 20 JKBD CC[C@H](C)CC(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cc(Cl)cc([N+](=O)[O-])c2C)CC1 1830734814 RWWRURWLZQDKMD-KKSFZXQISA-N 464.006 5.226 5 20 JKBD O=C([C@@H](F)c1ccccc1)N1CCC([C@@H]2CCCCN2C(=O)CSc2ccccc2[N+](=O)[O-])CC1 1831774851 FAGWITZYOQAGQL-OFVILXPXSA-N 499.608 5.017 5 20 JKBD Cc1ccc(CC(=O)N2CCCC[C@H]2C2CCN(C(=O)c3cc4cc([N+](=O)[O-])ccc4s3)CC2)o1 1832333540 YPQMYXZIBIULBA-QFIPXVFZSA-N 495.601 5.187 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)N1CC2(CCCN2C(=O)c2cc3c(Cl)cccc3s2)C1 1843804566 FETXYBUGSKRQSA-UHFFFAOYSA-N 487.940 5.041 5 20 JKBD C[C@@H](OC(=O)c1ccc(N2CCCC2)c([N+](=O)[O-])c1)C(=O)Nc1ccc(Cl)cc1C(F)(F)F 15683307 UMLXDKHHSIGOHQ-GFCCVEGCSA-N 485.846 5.051 5 20 JKBD C[C@@H](OC(=O)c1csc(-c2cccc(Cl)c2)n1)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 17981333 HMPICSBAMHQDDR-LLVKDONJSA-N 456.867 5.340 5 20 JKBD CCOc1cc([N+](=O)[O-])c(C(=O)N(Cc2ccccc2)[C@H](C)c2cccc(NC(C)=O)c2)cc1OC 23193524 AQYMEZJTUSKXBL-GOSISDBHSA-N 491.544 5.364 5 20 JKBD Cc1c(NC(=O)[C@H](C)OC(=O)/C(=C/c2ccc(F)cc2)c2cccs2)cccc1[N+](=O)[O-] 23196742 VWVJGRIMALVXPO-VUODPORTSA-N 454.479 5.215 5 20 JKBD COc1cc(C(=O)N(C[C@@H]2CCCO2)[C@@H]2CCSC2)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 106000821 SSDGGHHCFRQYFU-MSOLQXFVSA-N 492.981 5.176 5 20 JKBD Cc1cccc(CN[C@@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Br)c2ccccc2)c1 493487057 ZBUMGLBVYDJSKK-OAQYLSRUSA-N 454.324 5.135 5 20 JKBD CCC[C@@H](C)NC(=O)[C@@H]1CCCN(C(=O)c2ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])cc2)C1 497472543 CBPAJMMDTCEAJH-SJLPKXTDSA-N 473.957 5.198 5 20 JKBD O=[N+]([O-])c1cc(Cl)ccc1S(=O)(=O)N(Cc1ccc(Cl)c(Cl)c1)Cc1ccccn1 500614741 YQGHGKQIJQWKGX-UHFFFAOYSA-N 486.764 5.341 5 20 JKBD CSc1ccc(C(=O)N(CC(=O)Nc2ccc(Cl)cc2C(F)(F)F)C(C)C)cc1[N+](=O)[O-] 504814158 PWKYUBKLSLMXHR-UHFFFAOYSA-N 489.903 5.478 5 20 JKBD COCc1c(Br)cccc1NC(=O)c1ccc(NCc2ccccc2)c([N+](=O)[O-])c1 505369945 GFALOVFIKJQHDF-UHFFFAOYSA-N 470.323 5.368 5 20 JKBD COc1ccc(OC)c([C@H]2CCCN2C(=O)c2ccc(N[C@H](C)c3ccccn3)c([N+](=O)[O-])c2)c1 506088045 TWSJOLYOTRYSQU-UZUQRXQVSA-N 476.533 5.157 5 20 JKBD Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)c1cc(-c2ccc3c(c2)OCCO3)nc2c1cnn2C(C)C 515871139 IXSCZLMFTNENIU-UHFFFAOYSA-N 487.516 5.228 5 20 JKBD COc1cc(/C=C(\CCC(=O)O)c2nc3ccccc3s2)c([N+](=O)[O-])cc1OCC(F)(F)F 557517310 IWJJJBRIZBVEIT-XYOKQWHBSA-N 482.436 5.560 5 20 JKBD CCOc1cc([N+](=O)[O-])c(C(=O)N(Cc2ccccn2)c2ccc(Br)cc2)cc1OC 603994336 SQQKRFBSVDTYGV-UHFFFAOYSA-N 486.322 5.007 5 20 JKBD COc1cc(C(=O)Nc2ccc3nc(NC(=O)c4ccc(C)s4)sc3c2)c([N+](=O)[O-])cc1OC 608817740 ACRRJFRBJYNBML-UHFFFAOYSA-N 498.542 5.096 5 20 JKBD COc1ccccc1N1CC[C@@H](CNCc2cn(-c3ccccc3)nc2-c2ccc([N+](=O)[O-])cc2)C1 608837071 YFVRNRQJFLPLJT-NRFANRHFSA-N 483.572 5.072 5 20 JKBD O=C(Nc1nc(-c2cc(Cl)sc2Cl)cs1)c1cc([N+](=O)[O-])cc2c1OCCO2 608934438 ZRVYDPCYHVPBAX-UHFFFAOYSA-N 458.304 5.110 5 20 JKBD Cc1cc(CSc2ccccc2C(=O)Oc2ccc(NC(=O)c3cccc([N+](=O)[O-])c3)cc2)on1 746103287 KGQXVQGTYXKOAO-UHFFFAOYSA-N 489.509 5.655 5 20 JKBD C[C@@H](NC(=O)COC(=O)c1csc(-c2cccc([N+](=O)[O-])c2)n1)c1ccc(Cl)c(Cl)c1 747961108 GHPFWUDRJPAHIJ-LLVKDONJSA-N 480.329 5.059 5 20 JKBD O=C(Nc1ccc(N2CCCCC2)cc1)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 912648098 GBXUPRVMTVBKRK-UHFFFAOYSA-N 476.499 5.459 5 20 JKBD Cc1ccc(NC(=O)CSc2ccccc2C(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)cc1 916694692 IQKBYISQFWPYNA-UHFFFAOYSA-N 455.923 5.540 5 20 JKBD O=C(Cc1csc(-c2cc(Br)cs2)n1)Nc1ccc(Cl)c([N+](=O)[O-])c1 917609923 CWIFTWPTJQELIG-UHFFFAOYSA-N 458.746 5.377 5 20 JKBD CN(C(=O)c1ccc(Sc2nc3ccccc3s2)c([N+](=O)[O-])c1)c1ccc([N+](=O)[O-])cc1 918559034 RXMJLXNTUUULPQ-UHFFFAOYSA-N 466.500 5.541 5 20 JKBD O=C(Cn1c2ccccc2c(=O)c2ccccc21)OCc1cccc(C(=O)Nc2ccccc2)c1 919054286 WSGNNNMXVKMFAZ-UHFFFAOYSA-N 462.505 5.150 5 20 JKBD CC(=O)N(c1nc(COC(=O)c2cc3cc([N+](=O)[O-])ccc3o2)cs1)c1ccc(C)cc1C 919212760 WRMNEJLEYITGQC-UHFFFAOYSA-N 465.487 5.456 5 20 JKBD COc1cc(COC(=O)[C@H](C)Oc2ccc(Cl)cc2[N+](=O)[O-])cc(Cl)c1OC(F)F 920791459 ZTMHAVUAMLMENO-VIFPVBQESA-N 466.220 5.022 5 20 JKBD CCOc1ccsc1C(=O)NC1(c2ccc(NC(=O)Cc3cccc([N+](=O)[O-])c3)cc2)CCC1 1785792160 RJVHOQVJZULKGI-UHFFFAOYSA-N 479.558 5.045 5 20 JKBD CC1=CC[C@@H](C(=O)Nc2ccc(C3(NC(=O)c4cc([N+](=O)[O-])ccc4N(C)C)CCC3)cc2)CC1 1789115177 OOLBACOHJROUAM-LJQANCHMSA-N 476.577 5.155 5 20 JKBD COc1cc(C(=O)Nc2ccc(C3(NC(=O)c4cccc5cc(C)[nH]c45)CCC3)cc2)ccc1[N+](=O)[O-] 1792164489 IXNJEIDRGGTEBM-UHFFFAOYSA-N 498.539 5.455 5 20 JKBD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc2cc([N+](=O)[O-])ccc2s1)c1cccc(F)c1Cl 1801206677 DYHQGSILYUBOEM-QDMKHBRRSA-N 487.940 5.168 5 20 JKBD Cc1c(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cc(F)c(F)c(Cl)c2)cc(Cl)cc1[N+](=O)[O-] 1803807886 FODXYXWBRGSGFY-QDMKHBRRSA-N 498.313 5.054 5 20 JKBD CC1=CC[C@@H](C(=O)N2CCC3(CCCN(C(=O)CCCc4cc(C)c(F)cc4[N+](=O)[O-])C3)CC2)CC1 1805821092 HOJRGCGRILYGMQ-JOCHJYFZSA-N 499.627 5.343 5 20 JKBD O=C(c1ccsc1)N1CCCC2(CCN(C(=O)c3cc4cc([N+](=O)[O-])ccc4s3)CC2)C1 1808108751 XWUCNJSKZRNHIQ-UHFFFAOYSA-N 469.588 5.030 5 20 JKBD CCC[C@H]1CC[C@H](C(=O)N2CC[C@@H](CNC(=O)c3cccc(F)c3[N+](=O)[O-])[C@H]2c2cccnc2)CC1 1811322506 FOSXPTDPAXHTJU-OEEHMVQOSA-N 496.583 5.055 5 20 JKBD CC(C)(C)CCCCCC(=O)N1CC[C@H](CNC(=O)c2cccc(F)c2[N+](=O)[O-])[C@@H]1c1cccnc1 1811323506 PKTJXSCYFATDQP-YKSBVNFPSA-N 498.599 5.445 5 20 JKBD Cc1oc(C(C)(C)C)cc1C(=O)Nc1cc([C@H]2CCCCN2C(=O)/C=C/c2ccc([N+](=O)[O-])o2)[nH]n1 1816462406 TZFSTXWMVGDAFY-LHUXKHBRSA-N 495.536 5.129 5 20 JKBD Cc1ccc(C(=O)N2CCCC[C@H]2C2CCN(C(=O)c3ccc([N+](=O)[O-])cc3F)CC2)cc1Cl 1823909919 GINXEUCVNZLDNR-QHCPKHFHSA-N 487.959 5.243 5 20 JKBD Cc1cc2cccc(C(=O)N3CCCC[C@H]3C3CCN(C(=O)c4ccc([N+](=O)[O-])cc4F)CC3)c2[nH]1 1828215706 XPILEOUYOLWNKL-DEOSSOPVSA-N 492.551 5.071 5 20 JKBD C[C@@H](Sc1ncc(-c2ccc(Cl)cc2)o1)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 11300324 XNFYMFCDVXTYMD-SNVBAGLBSA-N 471.844 6.041 5 20 JKBD COc1cc2c(cc1OC)[C@@H](c1ccccc1)N(C(=O)c1ccc(Cl)c([N+](=O)[O-])c1)CC2 16002231 SPVKLUFEZQXENH-HSZRJFAPSA-N 452.894 5.053 5 20 JKBD C[C@H](c1nnc(Sc2ccc(C(=O)c3ccccc3)cc2[N+](=O)[O-])n1-c1ccc(F)cc1)N(C)C 29001511 BEUXFOLWBAFIHD-MRXNPFEDSA-N 491.548 5.319 5 20 JKBD O=C(Cn1c2ccccc2c(=O)c2ccccc21)Nc1ccccc1C(=O)Nc1ccc(Cl)cn1 72046942 PGLRWSLLQXYLIK-UHFFFAOYSA-N 482.927 5.094 5 20 JKBD Cc1nnc(COC(=O)c2c3c(nc4ccccc24)/C(=C\c2cccc([N+](=O)[O-])c2)CCC3)o1 207146620 SRXAFYQRNHKLRE-ATVHPVEESA-N 456.458 5.068 5 20 JKBD C[C@@H](SC1=N/C(=C/c2ccccc2)C(=O)N1c1ccc(F)cc1)C(=O)Nc1cccc([N+](=O)[O-])c1 207429773 SHQJXMBCHAMQNB-CAUNFOBBSA-N 490.516 5.238 5 20 JKBD COc1ccc(Oc2ccc([N+](=O)[O-])cc2C(=O)N2CCC(OC3CCCCC3)CC2)cc1 495655307 JBJGQPZJRQHWCL-UHFFFAOYSA-N 454.523 5.350 5 20 JKBD COc1ccc(N(C(=O)c2cc(OC)c(OCc3cscn3)cc2[N+](=O)[O-])[C@H](C)C2CC2)cc1 499585724 JNERYWZVKOWCEV-OAHLLOKOSA-N 483.546 5.093 5 20 JKBD CN(Cc1cn(-c2ccccc2)nc1-c1ccccc1)C(=O)c1cn(C)nc1-c1ccc([N+](=O)[O-])cc1 505981242 ISEFHOKSVPLJGY-UHFFFAOYSA-N 492.539 5.120 5 20 JKBD CNC(=O)c1ccc(Sc2nnc(-c3ccc(Cl)cc3)n2Cc2ccccc2)c([N+](=O)[O-])c1 507110208 JMYBLFQWVBNBMS-UHFFFAOYSA-N 479.949 5.066 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Br)[C@H](NCc1ccc(F)c(Cl)c1)c1ccccc1 507887129 QCZPJCYGBCAYQQ-HXUWFJFHSA-N 492.732 5.619 5 20 JKBD COc1cc(C(=O)Nc2ccccc2SC2CCCC2)c([N+](=O)[O-])cc1OCc1cscn1 512338463 MPKLQSQKDPQITM-UHFFFAOYSA-N 485.587 5.926 5 20 JKBD CC[C@@H](c1ccccc1)N(CC)C(=O)c1cc(OC)c(OCc2cscn2)cc1[N+](=O)[O-] 512411326 XPGODMHEDPNELV-IBGZPJMESA-N 455.536 5.252 5 20 JKBD CCOc1cc(NC(=O)N(C)Cc2ccc3cc(OC)ccc3c2)c([N+](=O)[O-])cc1OCC 514504482 LXGWLESYJMAHEL-UHFFFAOYSA-N 453.495 5.218 5 20 JKBD CO[C@@H](C)C(=O)Nc1cccc(NC(=O)c2ccc(NCc3ccccc3Cl)c([N+](=O)[O-])c2)c1 518889375 BPCACOOIZSFOSV-HNNXBMFYSA-N 482.924 5.086 5 20 JKBD CCC(C)(C)NC(=O)c1ccc(NC(=O)[C@H](C)Oc2ccc(Cl)cc2[N+](=O)[O-])cc1Cl 521249123 MVKJFSGKKNQEIO-LBPRGKRZSA-N 468.337 5.226 5 20 JKBD COc1ccc(NC(=O)Cn2ccc3cc([N+](=O)[O-])ccc32)cc1OCc1ccc2ccccc2n1 524388471 FRTMUIXIEWLAIC-UHFFFAOYSA-N 482.496 5.324 5 20 JKBD CCn1c(SCc2nc(-c3ccc([N+](=O)[O-])cc3)no2)nc2scc(-c3cccs3)c2c1=O 603748136 BUSOAAGDNYLLNB-UHFFFAOYSA-N 497.583 5.457 5 20 JKBD O=C(CSc1ccc(C(F)(F)F)cc1[N+](=O)[O-])NCc1nc2cc(Cl)ccc2s1 604436627 CJKJMCUGGFTQJC-UHFFFAOYSA-N 461.874 5.285 5 20 JKBD CCCN(C(=O)c1cc(OC)c(OCc2cscn2)cc1[N+](=O)[O-])c1cccc2ccccc12 604497737 UUPRWSJCGZFCCS-UHFFFAOYSA-N 477.542 5.849 5 20 JKBD COc1cc(C(=O)Nc2ccc([N+](=O)[O-])cc2F)ccc1OCc1ccc(Br)cc1 608870584 IMFUFZSFVVSVCS-UHFFFAOYSA-N 475.270 5.336 5 20 JKBD Cc1cc([C@H](C)NC(=O)c2ccc(C(=O)N[C@H](C)c3cc(C)sc3C)cc2[N+](=O)[O-])c(C)s1 609043950 JUMMIELIPHVERG-CABCVRRESA-N 485.631 5.933 5 20 JKBD COc1cc(C(=O)Nc2scnc2-c2ccccc2)c([N+](=O)[O-])cc1OCc1cscn1 609059115 BFXOCSLSLTWIQA-UHFFFAOYSA-N 468.516 5.015 5 20 JKBD CC(C)c1ccc(OC2CCN(C(=O)Cn3c4ccccc4c(=O)c4ccccc43)CC2)cc1 612575151 KAOSXCFRYMQFJJ-UHFFFAOYSA-N 454.570 5.348 5 20 JKBD Cc1ccc(C(C)C)c(Oc2ccc(CN[C@@H](C)c3cccc(NS(C)(=O)=O)c3)cc2[N+](=O)[O-])c1 725849832 YMLNNKREQJBTBL-IBGZPJMESA-N 497.617 6.041 5 20 JKBD COc1ccc(NC(=O)[C@@H](OC(=O)c2cc(F)c(F)cc2[N+](=O)[O-])c2ccccc2)cc1Cl 725936406 BAVVSNAJDFTNJP-FQEVSTJZSA-N 476.819 5.072 5 20 JKBD CC1CCN(c2ccc([N+](=O)[O-])cc2C(=O)N2CCC([C@H]3C(=O)Nc4cc(Cl)ccc43)CC2)CC1 727413281 LGYPPXGWBJXQLO-XMMPIXPASA-N 496.995 5.073 5 20 JKBD COc1ccc(NC(=O)N(Cc2ccc([N+](=O)[O-])cc2)C(C)C)cc1NC(=O)OC(C)(C)C 729037795 QWKZSBJVEDGEKQ-UHFFFAOYSA-N 458.515 5.393 5 20 JKBD C[C@H](OC(=O)c1csc(-c2ccc([N+](=O)[O-])cc2)n1)C(=O)Nc1ccc(Cl)cc1Cl 747954766 FPJHEYNSSCRRKH-JTQLQIEISA-N 466.302 5.209 5 20 JKBD C[C@@H](OC(=O)c1csc(-c2cccc([N+](=O)[O-])c2)n1)C(=O)Nc1nc(-c2ccccc2)cs1 747961613 GIQOBQGZWBXEGM-CYBMUJFWSA-N 480.527 5.026 5 20 JKBD O=C(CSc1nc2scc(C3CC3)c2c(=O)n1-c1ccccc1)Nc1cc([N+](=O)[O-])ccc1F 810244109 PBNNQPKCLPNZTG-UHFFFAOYSA-N 496.545 5.103 5 20 JKBD O=C(Nc1ccc(NCc2c(Br)cccc2[N+](=O)[O-])cc1F)c1cccc(Cl)c1 864033796 HRCAVCXUUTVKAC-UHFFFAOYSA-N 478.705 6.014 5 20 JKBD O=c1c2ccccc2n(Cc2nc(-c3ccc(OCc4cccnc4)cc3)no2)c2ccccc12 904467096 YQRUEKMJMGDYKK-UHFFFAOYSA-N 460.493 5.227 5 20 JKBD C[C@H](OC(=O)c1ccc(N[C@@H](C)c2ccccn2)c([N+](=O)[O-])c1)C(=O)Nc1ccc2ccccc2c1 920546485 YLNVQIRIWRMGFE-ROUUACIJSA-N 484.512 5.500 5 20 JKBD Cc1cccc2cc(C(=O)Nc3ccc(C4(NC(=O)/C=C/c5ccc([N+](=O)[O-])o5)CCC4)cc3)[nH]c12 1789253679 HGXIBNCSYKZPKC-ZRDIBKRKSA-N 484.512 5.439 5 20 JKBD COc1cc(C(=O)Nc2ccc(C3(NC(=O)/C=C/C4CCCC4)CCC3)cc2)cc([N+](=O)[O-])c1OC 1790815166 POTJXHLYLFGJAB-MDWZMJQESA-N 493.560 5.106 5 20 JKBD O=C(NC1(c2ccc(NC(=O)C3(c4ccc(Cl)cc4)CC3)cc2)CCC1)c1ccc([N+](=O)[O-])[nH]1 1791182709 ZFAKVHUMAQPGHI-UHFFFAOYSA-N 478.936 5.056 5 20 JKBD CC(C)=CCCC(=O)NC[C@@H]1CCN(C(=O)c2cc(Cl)cc([N+](=O)[O-])c2C)[C@@H]1c1cccnc1 1807987128 FJRUMVVOONXTPV-YADARESESA-N 484.984 5.018 5 20 JKBD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2ccc([N+](=O)[O-])o2)[nH]n1)c1sc2ccccc2c1Cl 1818605379 DQYLWUNPWIUVSI-AWEZNQCLSA-N 499.936 5.399 5 20 JKBD O=C(Nc1cc([C@H]2CCCCN2C(=O)c2cc(F)cc([N+](=O)[O-])c2)[nH]n1)c1cc2sccc2s1 1819029379 OCNJMFKWXINWSE-MRXNPFEDSA-N 499.549 5.353 5 20 JKBD Cc1c(C(=O)N2CCC([C@H]3CCCCN3C(=O)C3CC4(CCC4)C3)CC2)cc(Cl)cc1[N+](=O)[O-] 1832477398 WONGVGRDEPYXPB-JOCHJYFZSA-N 488.028 5.370 5 20 JKBD O=C(CSc1nnc(-c2ccccc2Cl)n1C1CCCC1)Nc1ccc([N+](=O)[O-])cc1Cl 8988460 BXOIMFBWXAJKTK-UHFFFAOYSA-N 492.388 6.006 5 20 JKBD CCCn1c(S[C@@H](C)C(=O)Nc2cc([N+](=O)[O-])ccc2OC)nnc1-c1ccc(Cl)cc1 9138774 MROMCBIWOCTKEA-ZDUSSCGKSA-N 475.958 5.045 5 20 JKBD O=C(Cc1c[nH]c2ccccc12)O[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1 10632578 PQANZCOGNXSGFX-HSZRJFAPSA-N 463.877 5.195 5 20 JKBD C[C@@H](OC(=O)/C=C/c1ccc(-c2ccc(F)cc2)s1)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 11374127 JRGMHMNASYYBKT-YPDDLIOESA-N 465.462 5.830 5 20 JKBD C[C@@H](OC(=O)CCc1ncc(-c2ccc(Cl)cc2)o1)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 12260288 NKTABLDXFBPSFJ-CYBMUJFWSA-N 468.853 5.190 5 20 JKBD O=C(Nc1ccccc1I)c1ccc(NCc2ccccc2)c([N+](=O)[O-])c1 15418679 IUFPMJWXFZSYKU-UHFFFAOYSA-N 473.270 5.064 5 20 JKBD CCCOc1ccc(-c2csc(NC(=O)c3cc(OCC)c(OC)cc3[N+](=O)[O-])n2)cc1 18082477 ZPHVHQVFMSPQPI-UHFFFAOYSA-N 457.508 5.167 5 20 JKBD Cc1ccc(NC(=O)[C@H](OC(=O)c2ccccc2OC(F)F)c2ccccc2)c([N+](=O)[O-])c1 21123021 ZPFYKKPSILAWCU-HXUWFJFHSA-N 456.401 5.041 5 20 JKBD C[C@H](Sc1nnc(-c2ccccc2)n1Cc1ccco1)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl 21684921 DVBGSDBINQCMJJ-AWEZNQCLSA-N 483.937 5.267 5 20 JKBD O=[N+]([O-])c1ccc(-c2nnc(CN3CCC(c4nc5cc(Cl)ccc5s4)CC3)o2)cc1 25033959 VIUQGZDOICHRRU-UHFFFAOYSA-N 455.927 5.288 5 20 JKBD CCCc1nc(COC(=O)c2ccccc2C(=O)c2ccc(SC)c([N+](=O)[O-])c2)cs1 25055164 ZYHRLQDRLLPTGW-UHFFFAOYSA-N 456.545 5.314 5 20 JKBD O=C(Cc1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1)NCc1ccc(Br)s1 25473956 WSHSXCOIASPRPI-UHFFFAOYSA-N 497.374 5.130 5 20 JKBD CN(C)C(=O)COc1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2Sc2ccc(Cl)cc2)cc1 25654492 VAIYHMBUWWNWAS-UHFFFAOYSA-N 485.949 5.119 5 20 JKBD Cc1csc(N2CCN(C(=O)c3ccc(Sc4nc5ccccc5s4)c([N+](=O)[O-])c3)CC2)n1 27819571 JVGUPJQFIDATAD-UHFFFAOYSA-N 497.627 5.083 5 20 JKBD O=C(Nc1ccc(Cl)c([N+](=O)[O-])c1)[C@@H](Sc1nnc(N2CCCC2)s1)c1ccccc1 72016319 TUMRUMSILXRIOU-KRWDZBQOSA-N 475.983 5.172 5 20 JKBD C[C@@H](Nc1ccc(NC(=O)c2ccc(Cl)cc2)cc1)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl 72030800 MODXKNHNNPEEQS-CYBMUJFWSA-N 473.316 5.593 5 20 JKBD CCOC(=O)[C@@](F)(c1c(F)cc2c(ccc3c(Br)cccc32)c1F)C(F)(F)F 98178045 ORTKGQBVLXUNMH-SFHVURJKSA-N 465.187 6.324 5 20 JKBD CC(=O)Nc1ccc(F)c(NC(=O)c2ccc(NCc3ccccc3Cl)c([N+](=O)[O-])c2)c1 484399228 DDWPOGRZJKJWAM-UHFFFAOYSA-N 456.861 5.210 5 20 JKBD C[C@@H](Nc1ccc(C(=O)Nc2ccc(F)cc2-c2ccc(F)cc2)cc1[N+](=O)[O-])c1ccccn1 485731828 HHYKULIWZQAUNE-MRXNPFEDSA-N 474.467 6.360 5 20 JKBD NC(=O)Cc1ccc(NC(=O)c2c3c(nc4ccccc24)/C(=C\c2cccc([N+](=O)[O-])c2)CCC3)cc1 497385117 GGIVOUWRQVELEH-HKWRFOASSA-N 492.535 5.300 5 20 JKBD C[C@@H](NC(=O)c1csc(-c2ccc([N+](=O)[O-])cc2)n1)c1cccc(OCc2ccccn2)c1 498745036 PYQIZQWPTGDBQJ-MRXNPFEDSA-N 460.515 5.183 5 20 JKBD CCN(CCc1cccs1)C(=O)Cc1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1 499626901 PIBWWMLKNOWQJB-UHFFFAOYSA-N 460.559 5.143 5 20 JKBD COc1cc(C(=O)N(Cc2ccccc2)[C@H](C)c2cccs2)c([N+](=O)[O-])cc1OC(F)F 500612234 UYRSHXCRWDRVPL-CQSZACIVSA-N 462.474 5.670 5 20 JKBD CCN(C(=O)c1csc(-c2ccc([N+](=O)[O-])cc2)n1)[C@H]1CCN([C@@H](C)c2ccccc2)C1 501948592 PZLWZXAQOZVMLD-UWJYYQICSA-N 450.564 5.016 5 20 JKBD CCOc1cc(C(=O)N(CCc2ccccc2)c2nc3ccccc3s2)c([N+](=O)[O-])cc1OC 502816680 DKAOHAFJYLBSKA-UHFFFAOYSA-N 477.542 5.501 5 20 JKBD COc1ccc(CC2CCN(C(=O)c3ccc(N[C@@H](C)c4ccccn4)c([N+](=O)[O-])c3)CC2)cc1 504939940 WEXJLPKVXVRJNS-IBGZPJMESA-N 474.561 5.266 5 20 JKBD C[C@@H](Nc1ccc(C(=O)Nc2ccccc2Sc2nccn2C)cc1[N+](=O)[O-])c1ccccn1 509127816 ZSJQNINQHIZKSU-MRXNPFEDSA-N 474.546 5.300 5 20 JKBD COc1cc(C(=O)Nc2ccccc2OCCc2ccccc2)c([N+](=O)[O-])cc1OC(F)F 512520209 XQABQACCWFKAON-UHFFFAOYSA-N 458.417 5.079 5 20 JKBD CCC(=O)Nc1cccc(CNC(=O)c2cc([N+](=O)[O-])ccc2Sc2ccc(Cl)cc2)c1 515563921 AHNGAGYTTKBISF-UHFFFAOYSA-N 469.950 5.678 5 20 JKBD Cc1cc(C(=O)N2CCC(C)CC2)ccc1NC(=O)c1ccc(N2CCC(C)CC2)c([N+](=O)[O-])c1 515691259 YSYTZRPVDNLCTA-UHFFFAOYSA-N 478.593 5.264 5 20 JKBD Cc1ccc(C)c(Oc2ccc(CNC(=O)c3ccc(Cn4nc(C)c([N+](=O)[O-])c4C)cc3)cn2)c1 518245956 NDHDHDSFCXPXEK-UHFFFAOYSA-N 485.544 5.191 5 20 JKBD COC(=O)CCc1ccc(NC(=O)c2ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])c(OC)c2)cc1 520544463 DVSSICWLGABDBO-UHFFFAOYSA-N 484.892 5.407 5 20 JKBD CCN(C(=O)c1ccc(N[C@@H](C)c2ccccn2)c([N+](=O)[O-])c1)[C@H](C)Cc1ccc(OC)cc1 520914365 KUVCVPQOAASFNG-MOPGFXCFSA-N 462.550 5.265 5 20 JKBD CC[C@@H](NC(=O)c1ccc(Sc2ccc(C)cc2)c([N+](=O)[O-])c1)c1nnc2n1CCCCC2 521716625 IWRTYZGSBWGRLN-LJQANCHMSA-N 465.579 5.253 5 20 JKBD CC(C)c1noc(-c2ccc(NC(=O)c3ccc(N[C@@H](C)c4ccccn4)c([N+](=O)[O-])c3)cc2)n1 524375225 DXNMLCKBLSNJEP-INIZCTEOSA-N 472.505 5.589 5 20 JKBD CCNC(=O)c1cccc(NC(=O)C/C(=C/c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)c1 603390379 YWRXLBXAZCTMMK-RGEXLXHISA-N 486.553 5.524 5 20 JKBD Cc1nn(Cc2ccc(C(=O)Nc3ccnn3Cc3cccc4ccccc34)cc2)c(C)c1[N+](=O)[O-] 603759643 LYTOAYIZEHIFKI-UHFFFAOYSA-N 480.528 5.107 5 20 JKBD CN(C(=O)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1)[C@@H](c1cccc(F)c1)c1cnn(C)c1 608799920 RGRUNLRRPSZNJF-DEOSSOPVSA-N 494.910 5.775 5 20 JKBD Cc1nc(-c2ccc(F)cc2)sc1[C@H](C)NC(=O)[C@@H](C)Oc1ccc(Cl)cc1[N+](=O)[O-] 609186359 JIFLOZPKTBOAPU-WCQYABFASA-N 463.918 5.464 5 20 JKBD CN(CCCCCc1cc(-c2ccccc2)no1)C(=O)c1cc([N+](=O)[O-])ccc1N1CCCC1 725738120 UJJJMULIPZGTBU-UHFFFAOYSA-N 462.550 5.335 5 20 JKBD O=C(OCc1coc(-c2ccc(Br)cc2)n1)c1cc([N+](=O)[O-])ccc1Br 725986027 RHFAKFFFRISUNS-UHFFFAOYSA-N 482.084 5.132 5 20 JKBD C[C@@H](OC(=O)[C@@H](OC1CCCC1)c1ccccc1)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 727017385 PETPAUQWAIIUFO-VLIAUNLRSA-N 480.439 5.184 5 20 JKBD CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccccc1SC[C@H]1CC1(Cl)Cl 729035445 JRWKWJIHWHPJQA-MRXNPFEDSA-N 468.406 6.323 5 20 JKBD C[C@H](OC(=O)Cc1csc(-c2ccc(Cl)cc2Cl)n1)C(=O)Nc1ccc(F)c([N+](=O)[O-])c1 747257679 FLBROJYRLBOMNL-JTQLQIEISA-N 498.319 5.277 5 20 JKBD C[C@H](OC(=O)c1csc(-c2cccc([N+](=O)[O-])c2)n1)c1cccc(NC(=O)c2ccccc2)c1 747955903 OLODUFRJOKXHEH-INIZCTEOSA-N 473.510 5.889 5 20 JKBD C[C@@H](Nc1ccc(-c2nc(-c3ccc(OCc4cccnc4)cc3)no2)cc1[N+](=O)[O-])c1ccccn1 904464743 HVZBYOXFMYPSRW-GOSISDBHSA-N 494.511 5.854 5 20 JKBD Cc1ccc(NC(=O)Nc2ccccc2)cc1NS(=O)(=O)c1ccc([N+](=O)[O-])cc1Cl 917740745 VIEKZISYEJJPRO-UHFFFAOYSA-N 460.899 5.001 5 20 JKBD CSCC[C@H](NC(=O)c1ccc(Cl)c([N+](=O)[O-])c1)C(=O)O[C@H](C)c1cccc(Cl)c1 918765730 XOHUZQBJKODVOD-PXAZEXFGSA-N 471.362 5.058 5 20 JKBD COc1cccc(C(=O)Nc2ccc(C3(NC(=O)Cn4ccc5ccc([N+](=O)[O-])cc54)CCC3)cc2)c1 1790272177 QNMCRWNPAFXOMC-UHFFFAOYSA-N 498.539 5.006 5 20 JKBD Cc1ccoc1C(=O)NC1(c2ccc(NC(=O)c3cc(Br)ccc3[N+](=O)[O-])cc2)CCC1 1790664110 SZYZVEVVZXURAV-UHFFFAOYSA-N 498.333 5.320 5 20 JKBD Cc1ccc(C(=O)N2CCCC[C@H]2c2cc(NC(=O)c3cc(F)cc([N+](=O)[O-])c3)n[nH]2)c(Cl)c1 1821166798 FACPRTBRAFMCEE-FQEVSTJZSA-N 485.903 5.039 5 20 JKBD Cc1cc(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)CCCCCC(C)(C)C)n[nH]2)ncc1[N+](=O)[O-] 1822114301 ALTWRBRUNUFZTK-HXUWFJFHSA-N 484.601 5.324 5 20 JKBD Cc1c(C(=O)N2CCC([C@H]3CCCCN3C(=O)C(C)(C)C(C)(F)F)CC2)cc(Cl)cc1[N+](=O)[O-] 1824632484 YYKYDBNWSWNWNW-LJQANCHMSA-N 499.986 5.471 5 20 JKBD O=C(Cc1ccc(Cl)cc1[N+](=O)[O-])N1CCC([C@H]2CCCCN2C(=O)C2(F)CCCCC2)CC1 1828407991 ANGCVKDMIXWRFR-OAQYLSRUSA-N 494.007 5.083 5 20 JKBD CCCOc1ccc(C(=O)N2CCC([C@H]3CCCCN3C(=O)c3cc(F)cc([N+](=O)[O-])c3)CC2)cc1 1830618225 OQKYENLQSGXXMO-RUZDIDTESA-N 497.567 5.070 5 20 JKBD CC[C@H]1CC[C@H](C(=O)N2CCCC[C@H]2C2CCN(C(=O)c3cc([N+](=O)[O-])c(O)cc3C)CC2)CC1 1831694652 JBJGTYVHZWWYDS-RRPUWOKSSA-N 485.625 5.059 5 20 JKBD O=C(c1cccc2ccccc12)N1CC2(CCCN2C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)C1 1845738936 SDCMQZBATVBXMD-UHFFFAOYSA-N 471.538 5.094 5 20 JKBD COc1ccc(/C=C2\N=C(SCc3cccc([N+](=O)[O-])c3)N(c3cccc(OC)c3)C2=O)cc1 9640602 JPKYIGSNFFROCF-UCQKPKSFSA-N 475.526 5.289 5 20 JKBD C[C@@H](OC(=O)[C@@H](C)Sc1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccc(Cl)cc1C(F)(F)F 17048799 AIJNLFRUORNYLL-GHMZBOCLSA-N 476.860 5.318 5 20 JKBD C[C@@H](Nc1ccc(C(=O)Nc2cc(C(F)(F)F)ccc2N2CCCC2)cc1[N+](=O)[O-])c1ccccn1 108790335 HZYSXGQVGTYRPI-MRXNPFEDSA-N 499.493 6.034 5 20 JKBD Cc1ccc(C(=O)NC2CCN(C(=O)c3ccc(SCCC(C)C)c([N+](=O)[O-])c3)CC2)s1 116235727 ACIBCYLSPBVPDG-UHFFFAOYSA-N 475.636 5.138 5 20 JKBD COc1cc(C(=O)Nc2ccc(Sc3nc(C)cs3)cc2C)c([N+](=O)[O-])cc1OC(F)F 116681626 SJVKELMDORLZBM-UHFFFAOYSA-N 481.502 5.682 5 20 JKBD C[C@H](Nc1ccc(NC(=O)CCCn2c(=O)oc3cc([N+](=O)[O-])ccc32)cc1Cl)c1ccccc1 302969600 CYWDWZYKYQZINX-INIZCTEOSA-N 494.935 5.748 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)Nc2cccc(Cl)c2Sc2nc(C)cs2)cc1SC 483703698 YMZQSRNBKTVIBJ-UHFFFAOYSA-N 482.008 6.147 5 20 JKBD O=C(c1csc(-c2cccc([N+](=O)[O-])c2)n1)N(Cc1nnc(-c2ccc(Cl)cc2)o1)C1CC1 496449318 QURJOJHRXBMLGR-UHFFFAOYSA-N 481.921 5.227 5 20 JKBD O=C(N[C@H](Cc1ccccc1)C(=O)N1CCCC1)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1 501744443 SVJYNJCLKIFCBI-JOCHJYFZSA-N 493.947 5.004 5 20 JKBD O=C(CNC(=O)c1cc([N+](=O)[O-])ccc1Sc1ccc(Cl)cc1)Nc1cccc2cccnc12 505703756 VMMNJMIJBZTREB-UHFFFAOYSA-N 492.944 5.316 5 20 JKBD CN1CCC(CN(C)C(=O)c2c3c(nc4ccccc24)/C(=C/c2cccc([N+](=O)[O-])c2)CCC3)CC1 505721754 XFCOIEUVZPMUKF-OQKWZONESA-N 484.600 5.434 5 20 JKBD O=C(C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)Nc1cccc(C(F)F)c1 505978465 DBRCNFHTKPYVAJ-ATVHPVEESA-N 465.481 6.712 5 20 JKBD CCCOc1ncccc1CN[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Br)c1ccccc1 516837743 FZMJEKFPPSZWBB-NRFANRHFSA-N 499.365 5.011 5 20 JKBD CC(C)[C@@H](NCc1ccc(Oc2ccccc2Cl)c([N+](=O)[O-])c1)c1nnc2ccccn12 520963618 UIBKVRZUSLZQHB-JOCHJYFZSA-N 451.914 5.570 5 20 JKBD O=C(CSc1ccc(C(F)(F)F)cc1[N+](=O)[O-])Nc1ccc(NC(=O)c2cccs2)cc1 522832801 LWCLZQJPFIJXOI-UHFFFAOYSA-N 481.477 5.658 5 20 JKBD O=C(Nc1ncc(Cc2cccc(Cl)c2)s1)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-] 603734722 KBUQGCMKABNTPG-UHFFFAOYSA-N 471.844 5.489 5 20 JKBD C[C@H](c1nnc(SCCCOc2ccc([N+](=O)[O-])cc2)n1-c1ccc(Cl)cc1)N(C)C 603945529 CWCABHFJLLSNFT-OAHLLOKOSA-N 461.975 5.013 5 20 JKBD C[C@@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)Nc1ccccc1Oc1ncc(Cl)cc1Cl 604448236 XQJGXAKGXNTMSL-LLVKDONJSA-N 482.707 6.148 5 20 JKBD Cc1nn(Cc2ccc(C(=O)Nc3ccc(-c4nc5ccccc5n4C)cc3)cc2)c(C)c1[N+](=O)[O-] 608954363 KRRQDMFMQQZWKL-UHFFFAOYSA-N 480.528 5.262 5 20 JKBD C[N+](C)=c1ccn(/C(C(=S)Nc2ccccc2-c2ccccc2)=C(/O)c2cccc([N+](=O)[O-])c2)cc1 725762586 CDEBASFGXXWKDN-UHFFFAOYSA-O 497.600 5.418 5 20 JKBD Cc1ccc2c(CC(=O)Oc3ccc(NC(=O)c4cc([N+](=O)[O-])ccc4Cl)cc3)c[nH]c2c1 726133992 OYQQYPSKPSQMTK-UHFFFAOYSA-N 463.877 5.438 5 20 JKBD COc1ccc(Br)cc1-c1nc(COC(=O)c2c(Cl)cccc2[N+](=O)[O-])cs1 730644050 HONMAPLJQRZJQB-UHFFFAOYSA-N 483.727 5.500 5 20 JKBD Cc1ccc(-c2nc(C)c(C(=O)O[C@H](C)C(=O)Nc3cccc([N+](=O)[O-])c3C)s2)c(C)c1 746597635 RQHYWQVUHREAGF-MRXNPFEDSA-N 453.520 5.136 5 20 JKBD COc1ccc(-c2nc(COC(=O)c3csc(-c4cccc([N+](=O)[O-])c4)n3)cs2)cc1OC 747955624 JITXNQHFCZYNGD-UHFFFAOYSA-N 483.527 5.216 5 20 JKBD CCOc1ccccc1NC(=O)[C@@H](OC(=O)c1cc([N+](=O)[O-])c(C)c([N+](=O)[O-])c1C)c1ccccc1 748954032 CMNHYGYJWABMKS-QHCPKHFHSA-N 493.472 5.055 5 20 JKBD COCCn1c(S[C@H](C(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)c2ccccc2)nc(C)c1C 817747919 VXUXHSWIJLHKPI-FQEVSTJZSA-N 474.970 5.180 5 20 JKBD CCOc1cc(/C=C(\C(=O)O[C@@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2C)c2ccccc2)ccc1O 852996725 CZDZCLBSNQJOQG-IGCAKMCNSA-N 490.512 5.119 5 20 JKBD COc1ccc(-c2noc(C/C(=C/c3ccc([N+](=O)[O-])cc3)c3nc4ccccc4s3)n2)cn1 904529856 HPMXNLNCURNTGM-ATVHPVEESA-N 471.498 5.441 5 20 JKBD C[C@H](OC(=O)CCOc1ccccc1-c1ccccc1)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 914999767 COPXHPPARKPOPI-KRWDZBQOSA-N 459.458 5.385 5 20 JKBD Cc1ccccc1NC(=O)c1cc2ccccc2cc1OS(=O)(=O)c1cccc(F)c1[N+](=O)[O-] 918194767 VONZIDUPBXOXBU-UHFFFAOYSA-N 480.473 5.216 5 20 JKBD CCOC(=O)Nc1ccc(NC(=O)c2ccccc2NC(=O)c2ccc([N+](=O)[O-])cc2Cl)cc1 918586010 RCBKIKSLVIGNGG-UHFFFAOYSA-N 482.880 5.321 5 20 JKBD Cc1cc(-c2noc([C@@H](C)OC(=O)c3ccc(N[C@H](C)c4ccccn4)c([N+](=O)[O-])c3)n2)ccc1F 920546312 YAGSUTPEUPZDSZ-HZPDHXFCSA-N 491.479 5.578 5 20 JKBD O=C(Cc1cccc([N+](=O)[O-])c1)Nc1ccc(C2(NC(=O)[C@@]3(F)CCCCC3(F)F)CCC2)cc1 1785791675 KGRAVEKSTLHKRZ-DEOSSOPVSA-N 489.494 5.189 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)c3ccc(O)c([N+](=O)[O-])c3)CCC2)cc1)c1ccc(Cl)cc1 1790295904 MHLBMHJQTQFXAT-UHFFFAOYSA-N 465.893 5.015 5 20 JKBD C/C(=C\c1ccc(C)o1)C(=O)NC1(c2ccc(NC(=O)c3ccc([N+](=O)[O-])cc3F)cc2)CCC1 1790621606 AXVGHZWVMFUAQQ-JQIJEIRASA-N 477.492 5.487 5 20 JKBD O=C(NC1(c2ccc(NC(=O)c3ccc([N+](=O)[O-])cc3F)cc2)CCC1)c1ccc2scnc2c1 1790621795 HGURSSSJAWAGJU-UHFFFAOYSA-N 490.516 5.405 5 20 JKBD O=C(Cc1cc(F)ccc1[N+](=O)[O-])Nc1ccc(C2(NC(=O)c3ccc4cc[nH]c4c3)CCC2)cc1 1792308685 ADGDZXIIJZGPSU-UHFFFAOYSA-N 486.503 5.206 5 20 JKBD CC[C@H](C)[C@@H](C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)/C=C/c1ccccc1[N+](=O)[O-])c1ccccc1 1804338122 CFQAEBKAFCMULJ-WFCXNERKSA-N 475.589 5.076 5 20 JKBD Cc1occc1C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)CC1 1825911112 GPBASNFDDFWVPF-OAQYLSRUSA-N 481.574 5.258 5 20 JKBD O=C(c1cccc2ccccc12)N1CCC([C@@H]2CCCCN2C(=O)c2cccc(F)c2[N+](=O)[O-])CC1 1830622266 WBMGRWPFUODKSM-VWLOTQADSA-N 489.547 5.434 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)N1CCCC[C@H]1C1CCN(C(=O)CSc2ccccc2)CC1 1830730073 WRWMMMGLZIANOZ-QHCPKHFHSA-N 499.608 5.068 5 20 JKBD Cc1cccc(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)Cc3cccc([N+](=O)[O-])c3)CC2)c1Cl 1832604162 IXHWVLXJOUDODL-HSZRJFAPSA-N 483.996 5.033 5 20 JKBD Cc1ccc(NC(=O)c2ccc(Cl)cc2[N+](=O)[O-])cc1S(=O)(=O)Nc1ccccc1Cl 15706150 XIVUVKZIDLWRPA-UHFFFAOYSA-N 480.329 5.263 5 20 JKBD Cc1ccccc1[C@H](C)NC(=O)[C@@H](C)OC(=O)c1ccccc1C(=O)c1ccc(Cl)c([N+](=O)[O-])c1 22669894 BMZBILYZIOVXIJ-DLBZAZTESA-N 494.931 5.210 5 20 JKBD Cn1c(SCC(=O)Nc2cc([N+](=O)[O-])ccc2Cl)nc2scc(-c3cccs3)c2c1=O 28607653 WZDBGWRBAYXVNX-UHFFFAOYSA-N 492.991 5.016 5 20 JKBD CCN(CC(=O)Nc1c(Cl)cccc1Cl)C(=O)c1cc([N+](=O)[O-])ccc1Oc1ccccc1 69643141 VBMKSEIBNOKWCJ-UHFFFAOYSA-N 488.327 5.795 5 20 JKBD CC1CCN(Cc2cccc(CNC(=O)c3ccc(N[C@H](C)c4ccccn4)c([N+](=O)[O-])c3)c2)CC1 116692361 QXJQRATWIWVELE-OAQYLSRUSA-N 487.604 5.325 5 20 JKBD C[C@@H](Nc1ccc(C(=O)NCCc2cc(Br)ccc2F)cc1[N+](=O)[O-])c1ccccn1 303074037 YIARWHXBVOYRLH-CQSZACIVSA-N 487.329 5.037 5 20 JKBD Cc1ccccc1-c1nnc(S[C@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)n1Cc1ccco1 479829708 IVBKHLRAEAHUIA-OAHLLOKOSA-N 497.964 5.576 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)N2CCCC[C@H]2C(=O)Nc2ccc(Cl)cc2Cl)cc1SC 482990025 RMGMMXUCVZRXJA-INIZCTEOSA-N 498.388 5.266 5 20 JKBD COc1ccc(COCc2cccc(NC(=O)c3cc(SC)c(OC)cc3[N+](=O)[O-])c2)cc1 483468538 KIKFIXAMEFYNNF-UHFFFAOYSA-N 468.531 5.303 5 20 JKBD O=C(Nc1ccc(Cl)cc1NC(=O)c1ccco1)c1csc(-c2ccc([N+](=O)[O-])cc2)n1 496245174 LUTDBDCKKJJOIZ-UHFFFAOYSA-N 468.878 5.469 5 20 JKBD C[C@H]1C[C@H](C)CN(C(=O)c2ccccc2NC(=O)c2csc(-c3cccc([N+](=O)[O-])c3)n2)C1 496355235 CSSIUXAKOXANBY-HOTGVXAUSA-N 464.547 5.089 5 20 JKBD Cc1ccc(NS(=O)(=O)c2ccc(N[C@@H](c3ccccc3)c3nccs3)c([N+](=O)[O-])c2)c(C)c1 505570924 RHWNDAFMTAIZNO-QHCPKHFHSA-N 494.598 5.670 5 20 JKBD CN(Cc1csc(Br)c1)C(=O)c1cc([N+](=O)[O-])ccc1NCc1ccccc1 512745193 WJIMHGSYQPAPKU-UHFFFAOYSA-N 460.353 5.303 5 20 JKBD C[C@H](Sc1nnc(-c2ccc(OC(F)F)cc2)o1)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl 515311060 FTSZWVBXBXAPKG-VIFPVBQESA-N 470.841 5.019 5 20 JKBD O=C(C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)N1CC[C@H](N2CCCCC2)C1 518086819 DYIRKJTWNUGMMP-YEMUAQJGSA-N 476.602 5.222 5 20 JKBD COc1ccc(NC(=O)c2ccc(N3CCC[C@H](C)C3)c([N+](=O)[O-])c2)cc1OCC(F)(F)F 518227982 FSGBQKAZVSKKTI-AWEZNQCLSA-N 467.444 5.033 5 20 JKBD C[C@H](NC(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccc(NC(=O)c2ccc(F)cc2)cc1 518522542 DMUZWELHDJCNSV-ZDUSSCGKSA-N 456.861 5.522 5 20 JKBD Cc1nnnn1-c1ccc(F)c(NC(=O)c2cc([N+](=O)[O-])ccc2Sc2ccc(Cl)cc2)c1 518651894 PHCUTNZRGRTORO-UHFFFAOYSA-N 484.900 5.075 5 20 JKBD COc1cc(CNCc2nc3cc(Cl)ccc3s2)ccc1OCc1ccc([N+](=O)[O-])cc1 520215906 BBHBGITWQUZHMP-UHFFFAOYSA-N 469.950 5.735 5 20 JKBD Cc1c(-c2ccccc2)sc(NC(=O)c2cc3cc([N+](=O)[O-])ccc3o2)c1C(=O)N1CCOCC1 603730535 LZSCDZGGYXRBHK-UHFFFAOYSA-N 491.525 5.103 5 20 JKBD O=C(Nc1ccc(NC(=O)c2ccc([N+](=O)[O-])cc2Cl)c(C(F)(F)F)c1)c1ccccc1 603742855 HGLNESDYLKXSMQ-UHFFFAOYSA-N 463.799 5.772 5 20 JKBD O=C(Cc1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1)NCc1cc2ccccc2o1 603761249 DFTPXTDUURWAHZ-UHFFFAOYSA-N 452.470 5.053 5 20 JKBD C[C@@H](NC(=O)c1cc([N+](=O)[O-])ccc1Sc1ccc(Cl)cc1)c1ccc(-n2cncn2)cc1 604467562 KJWZBQUIJSQEMR-OAHLLOKOSA-N 479.949 5.471 5 20 JKBD C[C@H](Nc1ccc(C(=O)N[C@H]2C[C@@H]2c2cccc(Br)c2)cc1[N+](=O)[O-])c1ccccn1 608809387 FBGAVOCWJYKGCV-HLLQZAQXSA-N 481.350 5.211 5 20 JKBD CC(C)c1noc2nc(-c3ccco3)cc(C(=O)N(Cc3ccccc3[N+](=O)[O-])CC(F)(F)F)c12 609020530 PLGCENKGDTZDNP-UHFFFAOYSA-N 488.422 5.719 5 20 JKBD O=C(CSCC(=O)c1ccccc1)Oc1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2Cl)cc1 726933243 HGYDOSYVOAJRKF-UHFFFAOYSA-N 484.917 5.022 5 20 JKBD CCOc1ccc([C@@H](CNC(=O)c2cc(F)c(F)cc2[N+](=O)[O-])c2c[nH]c3ccccc23)cc1OC 727707321 GJMOGOKCYBHQFT-GOSISDBHSA-N 495.482 5.324 5 20 JKBD Cc1sc(=O)n(CC(=O)N(CC2CC2)c2ccc(Cl)c([N+](=O)[O-])c2)c1-c1ccc(F)cc1 728165417 JSNPILVEPLAUKF-UHFFFAOYSA-N 475.929 5.029 5 20 JKBD C[C@@H](Cc1ccc(Cl)cc1Cl)C(=O)OCC(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 730634905 GKCZOGDZQOLEGE-JTQLQIEISA-N 479.238 5.281 5 20 JKBD CSc1ccc(C(=O)c2ccccc2C(=O)OCc2ncc(-c3ccc(F)cc3)o2)cc1[N+](=O)[O-] 746143487 INGGZPQIZGAQFR-UHFFFAOYSA-N 492.484 5.699 5 20 JKBD Cc1cc(C(=O)COC(=O)c2csc(-c3ccc([N+](=O)[O-])cc3)n2)c(C)n1Cc1ccc(F)cc1 747958392 JJWCISGXILKANI-UHFFFAOYSA-N 493.516 5.364 5 20 JKBD O=C(Nc1ccccc1C(=O)Nc1ccc(OC(F)F)c(F)c1)c1ccc([N+](=O)[O-])cc1Cl 918633297 LQHKKSYHPHDAJF-UHFFFAOYSA-N 479.798 5.493 5 20 JKBD Cc1oc(-c2ccccc2)nc1COC(=O)c1ccc(N[C@@H](C)c2ccccn2)c([N+](=O)[O-])c1 920546634 LTDCKIDOMLGPBJ-INIZCTEOSA-N 458.474 5.483 5 20 JKBD Cc1nc([N+](=O)[O-])c(Br)n1CC(=O)Nc1ccccc1Sc1ccc(Cl)cc1 920750766 BKOFVQRCCRHXOF-UHFFFAOYSA-N 481.759 5.306 5 20 JKBD O=C(Cc1cccc([N+](=O)[O-])c1)Nc1ccc(C2(NC(=O)Cc3ccc4ncccc4c3)CCC2)cc1 1785791555 BNDDIQJUMXCBRX-UHFFFAOYSA-N 494.551 5.062 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)c3cccc(F)c3[N+](=O)[O-])CCC2)cc1)c1cc2cccnc2s1 1788971373 OJFUMJBVWMNODV-UHFFFAOYSA-N 490.516 5.405 5 20 JKBD C/C(=C\c1ccc(C)o1)C(=O)Nc1ccc(C2(NC(=O)/C=C/c3ccc([N+](=O)[O-])o3)CCC2)cc1 1789581717 QKPIFQIQKVKYSR-XFMAJURKSA-N 475.501 5.340 5 20 JKBD Cc1cc[nH]c1C(=O)NC1(c2ccc(NC(=O)c3cccc([N+](=O)[O-])c3Br)cc2)CCC1 1790636921 YVGDASLLEYDRLH-UHFFFAOYSA-N 497.349 5.055 5 20 JKBD Cc1cc(C(=O)NC2(c3ccc(NC(=O)c4cc(F)cc([N+](=O)[O-])c4)cc3)CCC2)c(C)o1 1790696532 GGSOTUHGDCMLRH-UHFFFAOYSA-N 451.454 5.005 5 20 JKBD O=C(c1cc2cc([N+](=O)[O-])ccc2s1)N1CCC([C@@H]2CCCCN2C(=O)[C@H]2CC=CCC2)CC1 1830280548 OJORTQFNLVNFDI-UGKGYDQZSA-N 481.618 5.399 5 20 JKBD O=C(CSc1nnc(-c2cccs2)n1-c1ccccc1)Nc1ccc([N+](=O)[O-])cc1Cl 11208780 PBJBJORGWPOKOJ-UHFFFAOYSA-N 471.951 5.288 5 20 JKBD CC(=O)N(c1nc(COC(=O)c2cccc([N+](=O)[O-])c2C)cs1)c1c(C)cc(C)cc1C 11397476 ZTIZZIRFVWBLIV-UHFFFAOYSA-N 453.520 5.327 5 20 JKBD Cc1nc(CSc2ccc(C(=O)O[C@@H](C)C(=O)Nc3ccc([N+](=O)[O-])cc3Cl)cc2)cs1 11698577 HMFGMAFSUOUWAQ-LBPRGKRZSA-N 491.978 5.489 5 20 JKBD COc1ccc(CN(C)C(=O)c2ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])c(OC)c2)c(OC)c1 17919285 NFBPNJODZAOIJR-UHFFFAOYSA-N 486.908 5.339 5 20 JKBD CCOc1ccc(-c2nc(NC(=O)c3cc(OCC)c(OC)cc3[N+](=O)[O-])sc2C)cc1 18081236 KWAVBVWJRWCZJA-UHFFFAOYSA-N 457.508 5.085 5 20 JKBD Cc1cc([N+](=O)[O-])ccc1NC(=O)COC(=O)c1ccccc1-c1ncc(-c2ccccc2)o1 19164877 QCEUIDDZKLNFGC-UHFFFAOYSA-N 457.442 5.021 5 20 JKBD CC(C)C(=O)Nc1ccc(N[C@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2ccccc2)cc1 25426436 ZAOUYELSFPWGAL-QFIPXVFZSA-N 466.925 5.635 5 20 JKBD C[C@H](OC(=O)Cn1c2ccccc2c(=O)c2ccccc21)C(=O)N[C@H](C)c1cccc2ccccc12 28775148 SFKVUEKOKZNWPO-UXHICEINSA-N 478.548 5.117 5 20 JKBD COc1cc(C(=O)N[C@H](C)c2ccc(-c3csc(C)n3)cc2)c([N+](=O)[O-])cc1OC(F)F 30892662 SANLRDJDPBMZFJ-LLVKDONJSA-N 463.462 5.128 5 20 JKBD COc1cc(C(=O)Nc2nc3ccc(OCC(F)(F)F)cc3s2)c([N+](=O)[O-])cc1OC(F)F 31826156 BTTHQNKGHFONEG-UHFFFAOYSA-N 493.366 5.008 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Cl)[C@H](Nc1ccc(N2CCCC2=O)cc1)c1ccccc1 32815134 MHXGUEKSQZLMOJ-HSZRJFAPSA-N 464.909 5.167 5 20 JKBD Nc1c(Cl)cc(NC(=O)c2ccccc2NC(=O)c2ccc([N+](=O)[O-])cc2Cl)cc1Cl 105596743 FATIPCULJZPAMF-UHFFFAOYSA-N 479.707 5.642 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)Nc2nc3c(s2)C[C@@H](c2ccccc2)CC3)cc1SC 303196855 NIUWHWIPVBRXST-AWEZNQCLSA-N 455.561 5.307 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)N[C@H](Cc2ccccc2Cl)c2ccccc2)cc1SC 483641126 IQCQQATUUJDQJG-LJQANCHMSA-N 456.951 5.693 5 20 JKBD CN(C(=O)c1csc(-c2cccc([N+](=O)[O-])c2)n1)[C@H]1CCSc2ccc(Br)cc21 504614146 NFKDGZXWHCEMME-KRWDZBQOSA-N 490.404 5.790 5 20 JKBD C[C@@H](Nc1ccc(C(=O)NCC2(N3CCCCC3)CCCCC2)cc1[N+](=O)[O-])c1ccccn1 506018076 XVWVCLJNCVTRDT-HXUWFJFHSA-N 465.598 5.082 5 20 JKBD Cc1ncc([N+](=O)[O-])cc1C(=O)N(C[C@H]1CCCO1)c1nc(-c2ccc(Cl)cc2Cl)cs1 506848079 VBMHPYNTMQDSKX-OAHLLOKOSA-N 493.372 5.554 5 20 JKBD C[C@H](Nc1ccc(C(=O)N2CCCc3cc(OC(F)F)ccc32)cc1[N+](=O)[O-])c1ccccn1 509653323 ACABRUNSOOLKGM-HNNXBMFYSA-N 468.460 5.357 5 20 JKBD Cc1ccc(-c2csc3ncn(CCC(=O)N(Cc4ccc([N+](=O)[O-])cc4)C(C)C)c(=O)c23)cc1 509699652 RPTDCFMSYBJBLQ-UHFFFAOYSA-N 490.585 5.169 5 20 JKBD COc1ccc([C@@H](NC(=O)Cn2c3ccccc3c(=O)c3ccccc32)c2ccc(C)cc2)cc1 512874788 TUGVSEXTQKWIAQ-LJAQVGFWSA-N 462.549 5.378 5 20 JKBD O=[N+]([O-])c1cccc(-c2noc(CSc3nnc(-c4ccccc4)c(-c4ccccc4)n3)n2)c1 514903495 OWTDXFAADBYXFM-UHFFFAOYSA-N 468.498 5.456 5 20 JKBD O=[N+]([O-])c1cc(Cl)ccc1Oc1ccc(CNCc2ccc(CN3CCC(O)CC3)cc2)cc1 520215865 WCLKEIRQKURRBC-UHFFFAOYSA-N 481.980 5.287 5 20 JKBD COc1cc(C(=O)Nc2cc(Cl)c(C)c(Cl)c2)c([N+](=O)[O-])cc1OCc1cscn1 520618398 VBMNEEWFWWMJLS-UHFFFAOYSA-N 468.318 5.506 5 20 JKBD Cc1ccc(Cl)cc1N1CC[C@@H](CNC(=O)c2ccc(N[C@@H](C)c3ccccn3)c([N+](=O)[O-])c2)C1 523267220 NKXJPXGQBJRNTH-OALUTQOASA-N 493.995 5.381 5 20 JKBD O=C(Nc1cccnc1)c1ccc(NC(=O)c2cc3ccccc3c3cccnc23)cc1Cl 588829090 ODJATBOXJIQVQV-UHFFFAOYSA-N 452.901 5.941 5 20 JKBD O=C1c2ccccc2N[C@H](c2csc(-c3cccc([N+](=O)[O-])c3)n2)N1Cc1ccc2c(c1)OCO2 602756677 DHCBKHVZULVPPC-QHCPKHFHSA-N 486.509 5.214 5 20 JKBD COCCN(C(=O)c1csc2c1CC[C@H](C)C2)c1nc(-c2ccc([N+](=O)[O-])cc2)cs1 603461404 NHHHGNNEAQQCMU-AWEZNQCLSA-N 457.577 5.198 5 20 JKBD Cc1ccc(NS(=O)(=O)c2ccc(N[C@H](c3ccccc3)c3ccccn3)c([N+](=O)[O-])c2)c(C)c1 603473091 JWROXWHWMQEMDX-AREMUKBSSA-N 488.569 5.609 5 20 JKBD C[C@H](NC(=O)Cc1ccc(NC(=O)c2cccc(Br)c2)cc1)c1cccc([N+](=O)[O-])c1 603966910 MBKTZMRQYQSUMR-HNNXBMFYSA-N 482.334 5.030 5 20 JKBD O=C(Nc1nc(C2CC2)c(Cc2ccc(F)cc2)s1)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-] 608902624 SGESPDDOHCHFHI-UHFFFAOYSA-N 495.454 5.852 5 20 JKBD Cc1csc(Sc2ccc(C(=O)N(Cc3ccc(O)cc3)Cc3ccco3)cc2[N+](=O)[O-])n1 609030322 FKUIXTLRKUDNTH-UHFFFAOYSA-N 481.555 5.652 5 20 JKBD COc1ccc(Cl)c2c1N(C(=O)c1ccc(N[C@@H](C)c3ccccn3)c([N+](=O)[O-])c1)CCC2 609065184 DOMBVMVXQNGIAY-HNNXBMFYSA-N 466.925 5.418 5 20 JKBD Cc1ccc(Sc2ccc(CNC3CCN(C(=O)CC(F)(F)F)CC3)cc2[N+](=O)[O-])cc1 609223775 ZFXINFLMSMEZQD-UHFFFAOYSA-N 467.513 5.087 5 20 JKBD O=C(OCc1nnc(-c2ccc([N+](=O)[O-])cc2)o1)c1csc(-c2cccc(C(F)(F)F)c2)n1 725995335 BXJYSLUQFRJRQB-UHFFFAOYSA-N 476.392 5.144 5 20 JKBD Cc1ccc(/C(O)=C(/C(=S)NCCc2cccs2)[n+]2ccc3c(c2)CCCC3)cc1[N+](=O)[O-] 727812335 MJQCQTPWPLMETG-UHFFFAOYSA-O 480.635 5.175 5 20 JKBD CC(C)c1noc2nc(-c3ccco3)cc(C(=O)O[C@@H](C)c3nnc(-c4ccc([N+](=O)[O-])cc4)o3)c12 727920790 ZRKHCEGLSMPURW-ZDUSSCGKSA-N 489.444 5.482 5 20 JKBD O=C(CSc1ccc(C(F)(F)F)cc1[N+](=O)[O-])Oc1ccc(-c2noc([C@H]3CCCO3)n2)cc1 729246004 WIBOVBMCOGHQND-MRXNPFEDSA-N 495.435 5.213 5 20 JKBD C[C@@H](Nc1ccc(C(=O)Nc2ccc(SC(=O)N(C)C)cc2)cc1[N+](=O)[O-])c1ccccn1 729248471 RWLFSQSODNFMRY-OAHLLOKOSA-N 465.535 5.189 5 20 JKBD O=C(Nc1ccc(OC(=O)C2(c3ccccc3Cl)CCOCC2)cc1)c1cccc([N+](=O)[O-])c1 730469871 SZNJFADHINEDEX-UHFFFAOYSA-N 480.904 5.154 5 20 JKBD O=C(OCc1nnc(-c2ccc([N+](=O)[O-])cc2)o1)c1csc(-c2ccc(Cl)c(Cl)c2)n1 744605087 QWYLXKNMBREHCT-UHFFFAOYSA-N 477.285 5.432 5 20 JKBD Cc1ccc(C(=O)Nc2ccccc2)cc1NC(=O)c1cc([N+](=O)[O-])ccc1Br 751086210 GSSTZNCEDDLJSG-UHFFFAOYSA-N 454.280 5.170 5 20 JKBD CC(C)N(Cc1nnc(-c2cccc([N+](=O)[O-])c2)o1)C(=O)c1ccc(Oc2ccc(F)cc2)cc1 772251150 VBXQJOYLRMFCBZ-UHFFFAOYSA-N 476.464 5.627 5 20 JKBD COc1ccccc1N(Cc1nc2ccccc2s1)S(=O)(=O)c1cc([N+](=O)[O-])ccc1Cl 849212382 AHXABTRUBUCZTE-UHFFFAOYSA-N 489.962 5.262 5 20 JKBD O=C(Oc1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2Cl)cc1)c1cc2c(F)cccc2[nH]1 909228362 CEVAIBCHTRRNSM-UHFFFAOYSA-N 453.813 5.340 5 20 JKBD C[C@@H](OC(=O)c1csc(-c2ccc(Cl)cc2Cl)n1)C(=O)Nc1ccccc1[N+](=O)[O-] 921223017 KCUYLYWOBVWPAX-SNVBAGLBSA-N 466.302 5.209 5 20 JKBD O=C(/C=C/c1ccc([N+](=O)[O-])o1)NC1(c2ccc(NC(=O)[C@H]3C[C@@H]3c3ccc(F)cc3)cc2)CCC1 1786028297 DTHROLALASKNPC-VGJPLKPLSA-N 489.503 5.278 5 20 JKBD COc1cscc1C(=O)NC1(c2ccc(NC(=O)CCc3cccc([N+](=O)[O-])c3)cc2)CCC1 1786600612 YHPMKJUBEPNJTP-UHFFFAOYSA-N 479.558 5.045 5 20 JKBD COc1cc(C(=O)NC2(c3ccc(NC(=O)/C=C/C4CCCC4)cc3)CCC2)cc([N+](=O)[O-])c1OC 1790515052 BLXVGSIVPXNSHJ-MDWZMJQESA-N 493.560 5.106 5 20 JKBD COc1cc(C(=O)Nc2ccc(C3(NC(=O)c4ccc5[nH]c(C)cc5c4)CCC3)cc2)ccc1[N+](=O)[O-] 1792165388 JBHKFPRZBFMORN-UHFFFAOYSA-N 498.539 5.455 5 20 JKBD COc1cc(C(=O)NC2(c3ccc(NC(=O)[C@@]4(F)CCCC=C4F)cc3)CCC2)ccc1[N+](=O)[O-] 1792378162 OIGVBCPFHQQDSE-RUZDIDTESA-N 485.487 5.097 5 20 JKBD O=C(c1cc2sccc2s1)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)C1(c3cccc([N+](=O)[O-])c3)CCC1)C2 1798032632 FKYVOMYDCOILLW-BCDXTJNWSA-N 495.626 5.245 5 20 JKBD O=C(Cc1ccc(Cl)cc1[N+](=O)[O-])N1CCCC2(CCN(C(=O)c3ccccc3C3CC3)CC2)C1 1805487685 IYDOSCNVUHOXNG-UHFFFAOYSA-N 496.007 5.213 5 20 JKBD O=C(/C=C/c1ccc([N+](=O)[O-])o1)Nc1cc([C@@H]2CCCCN2C(=O)[C@@H]2CCC[C@H]3CCCC[C@@H]32)[nH]n1 1814967787 MXVVFNVFNAJTOT-CXAVYJEYSA-N 495.580 5.223 5 20 JKBD CC1=CC[C@@H](C(=O)Nc2cc([C@H]3CCCCN3C(=O)c3cc(Cl)cc([N+](=O)[O-])c3C)[nH]n2)CC1 1818808444 YLOLCDLWYQMDMU-OXQOHEQNSA-N 485.972 5.332 5 20 JKBD O=C(c1cccs1)N1CCCC[C@H]1C1CCN(C(=O)C2(c3cccc([N+](=O)[O-])c3)CCC2)CC1 1825778406 WXOLBLIPUOIDAX-QFIPXVFZSA-N 481.618 5.012 5 20 JKBD O=C([C@@H]1CCC[C@@H]2CCCC[C@@H]21)N1CCC([C@H]2CCCCN2C(=O)c2ccc(O)c([N+](=O)[O-])c2)CC1 1830487859 GLOFVZNBGAGGBC-ZMUKGBGYSA-N 497.636 5.140 5 20 JKBD Cc1cccc2cc(C(=O)N3CCC([C@@H]4CCCCN4C(=O)c4ccc([N+](=O)[O-])cc4F)CC3)[nH]c12 1830497061 XEKILJQTEKBXSL-DEOSSOPVSA-N 492.551 5.071 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)N1CCCC[C@@H]1C1CCN(C(=O)[C@]2(C)CC=CCC2)CC1 1830729736 VTORSHKSMCGJFZ-ATIYNZHBSA-N 471.573 5.022 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)N1CCCC[C@H]1C1CCN(C(=O)/C=C/c2cccs2)CC1 1830730012 SKELDSKWZPDMBM-FNNXTJRKSA-N 485.581 5.051 5 20 JKBD O=C(COC(=O)c1ccccc1Oc1ccccc1)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 11481210 FMYWDQXERWXLIL-UHFFFAOYSA-N 460.364 5.201 5 20 JKBD Cc1ccc(-n2c(S[C@H](C)c3nnc(-c4ccc([N+](=O)[O-])cc4)o3)nnc2N2CCCCC2)cc1 19420906 QBFOGQGSKOGTQZ-QGZVFWFLSA-N 491.577 5.378 5 20 JKBD CCCC(=O)Nc1ccc(C(=O)[C@H](C)Sc2nc3cc4ccccc4cc3c(=O)n2C)cc1 22254298 KDXLMEIYKSINLJ-INIZCTEOSA-N 459.571 5.189 5 20 JKBD COc1cc(C(=O)NC[C@H](c2ccsc2)N(C)C)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 25811410 YFNMWJZLFFGXSM-GOSISDBHSA-N 475.954 5.143 5 20 JKBD O=C(CCN1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1)Nc1c(Cl)cccc1Cl 28877163 SOLAJEBQZRNCAK-UHFFFAOYSA-N 491.297 5.071 5 20 JKBD COc1ccc(CSc2nnc(S[C@H](C)C(=O)Nc3ccc([N+](=O)[O-])cc3Cl)s2)cc1 36866208 SUYAVAYPKCTPBI-LLVKDONJSA-N 497.023 5.520 5 20 JKBD Cc1cc(N2CCOCC2)ccc1NC(=O)c1cc([N+](=O)[O-])ccc1Sc1ccc(Cl)cc1 43773052 WYGZVJIMQOOJKE-UHFFFAOYSA-N 483.977 5.797 5 20 JKBD O=C(Nc1ccc(Cl)c([N+](=O)[O-])c1)[C@@H](Sc1nccc(C(F)(F)F)n1)c1ccccc1 45800620 IEGREJHERBSXAK-INIZCTEOSA-N 468.844 5.529 5 20 JKBD CC(C)(C)OC(=O)NC1CCN(C(=O)c2ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])cc2)CC1 108648676 RZPAFTQJKPEOPH-UHFFFAOYSA-N 475.929 5.170 5 20 JKBD O=C(CCOc1cccc(Cl)c1Cl)N(Cc1ccccc1[N+](=O)[O-])CC(F)(F)F 486080442 ZHVPPCNBEBLCRF-UHFFFAOYSA-N 451.228 5.262 5 20 JKBD O=C(C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)NCc1ccn(-c2ccccc2)n1 490565698 KRIQQAXJOINZQX-SILNSSARSA-N 495.564 5.637 5 20 JKBD COc1ccc(CCC2CCN(C(=O)c3csc(-c4ccc([N+](=O)[O-])cc4)n3)CC2)cc1 502549261 UEZUUKGURSWMGU-UHFFFAOYSA-N 451.548 5.212 5 20 JKBD COc1cc(C(=O)Nc2nc(-c3ccc(OCc4ccccc4)cc3)cs2)c([N+](=O)[O-])cc1OC 505083799 NIRKHDGOUFRNGX-UHFFFAOYSA-N 491.525 5.567 5 20 JKBD Cc1ccc(NC(=O)[C@H](Sc2nc3cc(Br)cnc3[nH]2)c2ccccc2)c([N+](=O)[O-])c1 511881387 IFFVAUIHGRDWKD-GOSISDBHSA-N 498.362 5.409 5 20 JKBD CCOc1cc(NC(=O)N2CCC(c3c(C)[nH]c4ccccc34)CC2)c([N+](=O)[O-])cc1OCC 515768936 NCSZDUINRGLKQY-UHFFFAOYSA-N 466.538 5.593 5 20 JKBD C[C@@H](NC(=O)c1ccc(NC(=O)c2cccc(Br)c2)cc1)c1cccc([N+](=O)[O-])c1 517099348 NGZQAUYYLXYGSD-CQSZACIVSA-N 468.307 5.101 5 20 JKBD O=C(Nc1ccccc1CN1C(=O)CCC1=O)c1cc([N+](=O)[O-])ccc1Sc1ccc(Cl)cc1 517986343 DTENLWJDTUDWNI-UHFFFAOYSA-N 495.944 5.301 5 20 JKBD Cc1cc(COc2ccc(C(=O)N(Cc3ccc([N+](=O)[O-])cc3)C(C)C)cc2Br)on1 519157908 OKVVHAXDTLFNNP-UHFFFAOYSA-N 488.338 5.284 5 20 JKBD O=C(Nc1ccc(NC(=O)c2cc3cc([N+](=O)[O-])ccc3s2)c(C(F)(F)F)c1)c1ccoc1 603761975 NRXKKZKMSRURQR-UHFFFAOYSA-N 475.404 5.926 5 20 JKBD O=C(Nc1cccc(/C=C2\CCn3c2nc2ccc([N+](=O)[O-])cc2c3=O)c1)c1ccc(Cl)cc1 603781438 WSTDNIJMPIAWJB-SFQUDFHCSA-N 472.888 5.155 5 20 JKBD COc1ccc(Oc2ccc([N+](=O)[O-])cc2C(=O)N2C[C@@H](C(F)(F)F)C[C@@H](C(F)(F)F)C2)cc1 604257685 LLAGLIWDKORCEZ-BETUJISGSA-N 492.372 5.599 5 20 JKBD O=[N+]([O-])c1cc2c(c(CS(=O)(=O)C(c3ccc(Cl)cc3)c3ccc(Cl)cc3)c1)OCOC2 608784465 TYKANNRSKXKLFB-UHFFFAOYSA-N 494.352 5.473 5 20 JKBD CCc1nc(CCNC(=O)c2ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])c(OC)c2)cs1 608819963 LLMUCTXLYFACSL-UHFFFAOYSA-N 461.927 5.041 5 20 JKBD O=c1c(Cl)c(NC2C[C@@H](C(F)(F)F)C[C@H](C(F)(F)F)C2)cnn1-c1ccc([N+](=O)[O-])cc1 608830585 GNAZAMGZBPCPNK-UWVGGRQHSA-N 484.784 5.116 5 20 JKBD O=C(c1cc([N+](=O)[O-])ccc1N1CCOCC1)N(Cc1ccccc1C(F)(F)F)C1CCCC1 729182335 IMKUMMXFFVLOLB-UHFFFAOYSA-N 477.483 5.035 5 20 JKBD CN(C)C(=O)Sc1ccc(NC(=O)c2ccccc2NC(=O)c2ccc([N+](=O)[O-])cc2Cl)cc1 729248525 WIUISEYMPVMKRC-UHFFFAOYSA-N 498.948 5.527 5 20 JKBD Cc1ccc([C@@H](NC(=O)C(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)c2ccc(F)cc2Cl)cc1 731128582 BNIAQOCDZPQPKV-HXUWFJFHSA-N 476.291 5.193 5 20 JKBD C[C@@H](c1nnc(Sc2nc3ccc([N+](=O)[O-])cc3s2)n1-c1ccc(Cl)cc1)N(C)C 731208443 GKYUPUFHSGKBAQ-NSHDSACASA-N 460.972 5.212 5 20 JKBD C[C@H](SC1=N/C(=C/c2ccccc2)C(=O)N1c1ccc(F)cc1)C(=O)Nc1ccccc1[N+](=O)[O-] 849191743 RQQDVHCUBLCNMF-WASCAKKMSA-N 490.516 5.238 5 20 JKBD Cc1c(NC(=O)C(=O)N[C@H](c2ccc(CC(C)C)cc2)c2cccs2)cccc1[N+](=O)[O-] 915740858 NZWSNLRSHDHDBC-JOCHJYFZSA-N 451.548 5.008 5 20 JKBD O=C(Nc1ccc(=O)n(Cc2ccccc2)c1)c1cc([N+](=O)[O-])ccc1Sc1ccc(Cl)cc1 916461908 ZXFKJKJXFBUCAA-UHFFFAOYSA-N 491.956 5.862 5 20 JKBD CC(C)[C@@H](OC(=O)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-])C(=O)Nc1ccccc1Cl 919195443 HJYMIMYPPJQVKW-QGZVFWFLSA-N 474.819 5.009 5 20 JKBD O=C(OCc1nc(-c2ccc([N+](=O)[O-])cc2)no1)c1csc(-c2ccc(Cl)cc2Cl)n1 921220115 WGBPQADVRMVSJB-UHFFFAOYSA-N 477.285 5.432 5 20 JKBD Cc1cc[nH]c1C(=O)Nc1ccc(C2(NC(=O)c3cccc([N+](=O)[O-])c3Br)CCC2)cc1 1787102890 IFHYIWKTPDSRMJ-UHFFFAOYSA-N 497.349 5.055 5 20 JKBD COc1cc(CC(=O)NC2(c3ccc(NC(=O)c4cc5ccccc5o4)cc3)CCC2)ccc1[N+](=O)[O-] 1789004456 KKARVKPFWXHEPW-UHFFFAOYSA-N 499.523 5.340 5 20 JKBD COc1ccc(CC(=O)NC2(c3ccc(NC(=O)[C@H]4CC=C(C)CC4)cc3)CCC2)c([N+](=O)[O-])c1 1789115194 PGBQFJSBTGVXNA-IBGZPJMESA-N 477.561 5.026 5 20 JKBD O=C(CC1CCC1)Nc1ccc(C2(NC(=O)CSc3ccccc3[N+](=O)[O-])CCC2)cc1 1792270937 BXHUJCPSCLCCOW-UHFFFAOYSA-N 453.564 5.011 5 20 JKBD O=C(Cc1ccc(Cl)cc1[N+](=O)[O-])N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc2sccc2s1 1798029713 YJKSUTXFMONLOH-MUJYYYPQSA-N 490.006 5.019 5 20 JKBD CC(C)[C@H](C(=O)N1CCCC[C@@H]1c1cc(NC(=O)/C=C/c2ccc([N+](=O)[O-])o2)n[nH]1)c1ccccc1 1814965525 MFQIHTUTYVCFAP-RODRTBBPSA-N 491.548 5.056 5 20 JKBD C[C@H](Sc1ccccc1)C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cc(F)cc([N+](=O)[O-])c2)CC1 1830612323 ANLDBDCLERQIGQ-MHECFPHRSA-N 499.608 5.148 5 20 JKBD Cc1cc2[nH]c(C(=O)N3CCC([C@@H]4CCCCN4C(=O)c4cc(F)cc([N+](=O)[O-])c4)CC3)cc2s1 1830618065 JWFJGELLHUZZTB-QFIPXVFZSA-N 498.580 5.132 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)N1CCCC[C@@H]1C1CCN(C(=O)/C=C/c2ccsc2)CC1 1830728276 HRUZTLHLFYKMPA-QNBZTBGESA-N 485.581 5.051 5 20 JKBD O=C(c1cc2cc([N+](=O)[O-])ccc2s1)N1CC2(CCCN2C(=O)c2cc3cc[nH]c3cc2Cl)C1 1843790095 QSCADADSFKCASI-UHFFFAOYSA-N 494.960 5.075 5 20 JKBD C[C@H](OC(=O)c1ccc(NC2CC2)c([N+](=O)[O-])c1)C(=O)Nc1c(Cl)cc(Cl)cc1Cl 9868531 XUVXPGLUYODCHB-VIFPVBQESA-N 472.712 5.313 5 20 JKBD Cn1c(S[C@H](C(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)c2ccccc2)nnc1-c1cccs1 10709421 ODMCPUSWWSJYBJ-SFHVURJKSA-N 485.978 5.577 5 20 JKBD C[C@H](OC(=O)c1ccc(NCc2ccccc2)c([N+](=O)[O-])c1)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 17656706 QMGFCWPMPFPKFV-HNNXBMFYSA-N 489.444 5.083 5 20 JKBD Cc1ccc(NC(=O)[C@@H](OC(=O)Cc2csc(-c3cccs3)n2)c2ccccc2)c([N+](=O)[O-])c1 17935254 KVFUQUJEMZJPII-QFIPXVFZSA-N 493.566 5.554 5 20 JKBD Cc1c(NC(=O)[C@@H](C)Sc2nnc(-c3ccccc3F)n2CC(C)C)cccc1[N+](=O)[O-] 21581657 ZNIANZOCWVHWFR-OAHLLOKOSA-N 457.531 5.076 5 20 JKBD Cc1c(NC(=O)c2ccc(-n3nc(SCc4ccccc4)sc3=S)cc2)cccc1[N+](=O)[O-] 22408678 HOMPVMVIYCUZAD-UHFFFAOYSA-N 494.623 6.425 5 20 JKBD NC(=O)Nc1ccc(NC(=O)c2ccc(Sc3nc4ccccc4s3)c([N+](=O)[O-])c2)cc1 26353108 GCFAPTCMRQVBAG-UHFFFAOYSA-N 465.516 5.099 5 20 JKBD O=C(CCSc1nnc(Nc2cccc(Br)c2)s1)Nc1ccccc1[N+](=O)[O-] 26416988 IDKDIDIVFMDHIX-UHFFFAOYSA-N 480.369 5.073 5 20 JKBD C[C@@H](Sc1nnc(-c2ccccc2)c(-c2ccccc2)n1)C(=O)Nc1ccc([N+](=O)[O-])cc1 36801990 KYVRPULOIFJOMR-MRXNPFEDSA-N 457.515 5.233 5 20 JKBD COc1ccc(C2(CNC(=O)Cn3c4ccccc4c(=O)c4ccccc43)CCCCC2)cc1 72036605 SQWZVPVZXNEQIA-UHFFFAOYSA-N 454.570 5.182 5 20 JKBD CC(C)OC(=O)C[C@H](NC(=O)Cc1csc(-c2ccc(Cl)s2)n1)c1ccccc1[N+](=O)[O-] 108955180 ONFOJNCUFWSQEF-HNNXBMFYSA-N 493.994 5.175 5 20 JKBD CCNC(=O)c1ccc(C)c(NC(=O)c2ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])c(OC)c2)c1 482978881 AISZEQXHFUIICD-UHFFFAOYSA-N 483.908 5.360 5 20 JKBD CCc1cccc(Oc2ccc(NC(=O)c3cc(OC)c(OC(F)F)cc3[N+](=O)[O-])cn2)c1 484162573 SBXWXXCLVVSHEO-UHFFFAOYSA-N 459.405 5.207 5 20 JKBD Cc1nc(CCNC(=O)C/C(=C/c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)cs1 485405009 BUWCMSXFSHKVFZ-ATVHPVEESA-N 464.572 5.259 5 20 JKBD Cc1cc(NC(=O)c2ccc(Cn3nc(C)c([N+](=O)[O-])c3C)cc2)n(-c2cccc(C(F)(F)F)c2)n1 486270447 MJGHFCWZSCBWMD-UHFFFAOYSA-N 498.465 5.222 5 20 JKBD O=C(CNC(=O)c1ccccc1Sc1ccc(C(F)(F)F)cc1[N+](=O)[O-])Nc1ccc(F)cc1 493997685 XOQVOCWQNAWARZ-UHFFFAOYSA-N 493.438 5.272 5 20 JKBD CCC[C@H](C)NC(=O)[C@@H]1CCCN(C(=O)c2ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])cc2)C1 497472542 CBPAJMMDTCEAJH-FUHWJXTLSA-N 473.957 5.198 5 20 JKBD COc1c(Cl)cc(NC(=O)c2ccc(N[C@@H](C)c3ccccn3)c([N+](=O)[O-])c2)cc1Cl 506323428 RXYUXDRAMWCCKX-LBPRGKRZSA-N 461.305 5.731 5 20 JKBD CN(C[C@@H]1OCCc2ccccc21)[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1 507258576 CQXNCBLLEPPJPL-BJKOFHAPSA-N 465.937 5.174 5 20 JKBD O=[N+]([O-])c1cc(S(=O)(=O)Nc2ccccc2)ccc1NCc1ccc(COCC(F)(F)F)cc1 509036161 ACGQKCZYVDDVFC-UHFFFAOYSA-N 495.479 5.087 5 20 JKBD COc1cc(C(=O)N[C@@H](CC(C)(C)C)c2ccc(F)cc2)c([N+](=O)[O-])cc1OCc1cscn1 512178791 KKIWGCGCQJVCRX-IBGZPJMESA-N 487.553 5.685 5 20 JKBD COc1cc(C(=O)N(Cc2ccco2)c2cccc(Cl)c2)c([N+](=O)[O-])cc1OCc1cscn1 512245938 UBEQMIJOSLUCPZ-UHFFFAOYSA-N 499.932 5.732 5 20 JKBD COc1ccc([C@H](NC(=O)c2cc(OCC(F)(F)F)ccc2[N+](=O)[O-])c2ccc(F)cc2)cc1 512754371 QQVKHTSPQWZVJU-OAQYLSRUSA-N 478.398 5.203 5 20 JKBD C[C@H](Sc1nnc(-c2ccncc2)n1-c1ccc(Cl)cc1)C(=O)Nc1ccccc1[N+](=O)[O-] 513844362 TYQULADTTUPIJI-AWEZNQCLSA-N 480.937 5.010 5 20 JKBD O=C(c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-])N(Cc1cccs1)Cc1cccs1 516102887 JLTXENWQJDQKDO-UHFFFAOYSA-N 456.467 5.502 5 20 JKBD CNS(=O)(=O)c1cccc([C@H](C)NCc2ccc(Oc3cc(C)ccc3C(C)C)c([N+](=O)[O-])c2)c1 518783613 PHDAXEHCAQPTLH-IBGZPJMESA-N 497.617 5.578 5 20 JKBD O=C(CNC(=O)c1c(Cl)cccc1[N+](=O)[O-])Nc1nc2ccc(Oc3ccccc3)cc2s1 521724100 UXCKERDTPLUWMS-UHFFFAOYSA-N 482.905 5.019 5 20 JKBD O=C(Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1)c1cnn(-c2ccc(F)cc2)c1C(F)(F)F 603440530 VMBVGOZKCSPXFA-UHFFFAOYSA-N 477.399 5.314 5 20 JKBD Cc1nc(CSc2ccc(C(=O)N(Cc3ccccc3[N+](=O)[O-])CC(F)(F)F)cc2)cs1 603741250 NVJUWKQDYQMSFP-UHFFFAOYSA-N 481.521 5.857 5 20 JKBD O=C(NC[C@@H]1CCCOC1)c1c2c(nc3ccccc13)/C(=C/c1ccc([N+](=O)[O-])cc1)CCC2 604013755 VRFGXWDYKHGTTO-AZGFIHASSA-N 457.530 5.176 5 20 JKBD CC1CCN(c2ccc(C(=O)N(C)CCCc3cc(-c4cccc(F)c4)n[nH]3)cc2[N+](=O)[O-])CC1 604191564 HNCQZJYFPXOAAA-UHFFFAOYSA-N 479.556 5.065 5 20 JKBD O=C(NCCSCc1ccccc1F)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 604466885 RFIQXDFGOFBTJB-UHFFFAOYSA-N 485.503 5.019 5 20 JKBD Cc1c(NC(=O)c2ccc(NCc3ccccc3Cl)c([N+](=O)[O-])c2)n[nH]c1C(F)(F)F 604498241 UOYYVFSESFWGEJ-UHFFFAOYSA-N 453.808 5.163 5 20 JKBD COc1cc2nc(C)sc2cc1NC(=O)c1ccc(N[C@H](C)c2ccccn2)c([N+](=O)[O-])c1 608850611 VYECAWNOLKZXCY-CYBMUJFWSA-N 463.519 5.342 5 20 JKBD O=C(Nc1nc2c(s1)C(=O)CCC2)c1cc([N+](=O)[O-])ccc1Sc1ccc(Cl)cc1 609021162 IXPWROJZKSSYTA-UHFFFAOYSA-N 459.936 5.627 5 20 JKBD O=C(Nc1ccc(OCc2cccc(C(F)(F)F)c2)cc1)c1cc2c(cc1[N+](=O)[O-])OCO2 609066146 KFIWIPOLZDISGF-UHFFFAOYSA-N 460.364 5.174 5 20 JKBD COc1ccc(NC(=S)/C(=C(/O)c2cccc([N+](=O)[O-])c2)[n+]2ccc(C)cc2)cc1Cl 726961804 LDSFYZPWTLVRCS-UHFFFAOYSA-O 456.931 5.176 5 20 JKBD O=C(Nc1cccc(-c2nccs2)c1)N1CCN(c2ccc([N+](=O)[O-])cc2C(F)(F)F)CC1 727591344 WBQAJNLJAJEVNR-UHFFFAOYSA-N 477.468 5.091 5 20 JKBD CC(=O)N(c1nc(COC(=O)c2cc([N+](=O)[O-])c(C)c([N+](=O)[O-])c2C)cs1)c1cccc(C)c1C 728340238 JQODTYZJJPHTQX-UHFFFAOYSA-N 498.517 5.235 5 20 JKBD O=C(O[C@@H](c1ccc(Br)cc1)C(F)(F)F)c1csc(-c2ccc([N+](=O)[O-])cc2)n1 731146600 JHGNWIYCPPAXBE-HNNXBMFYSA-N 487.253 5.941 5 20 JKBD O=C(Cn1c2ccccc2c(=O)c2ccccc21)O[C@@H](c1ccc(Br)cc1)C(F)(F)F 731147118 IUHAXOHFIKHYLG-QFIPXVFZSA-N 490.275 5.764 5 20 JKBD Cc1ccc(-c2nnc([C@H](C)OC(=O)c3ccc(N4CCC[C@H](C)C4)c([N+](=O)[O-])c3)o2)cc1 745930546 OWUVQECCHKOCQG-IRXDYDNUSA-N 450.495 5.108 5 20 JKBD C[C@@H](OC(=O)c1csc(-c2ccc([N+](=O)[O-])cc2)n1)C(=O)c1ccc(NC(=O)C(C)(C)C)cc1 747958869 YYVBYBBNSQWIQV-CQSZACIVSA-N 481.530 5.131 5 20 JKBD CC[C@@H](C)Sc1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2Br)c(C(F)(F)F)c1 751126454 ZAQPOIYYLQYRIV-SNVBAGLBSA-N 477.302 6.519 5 20 JKBD C[C@H](OC(=O)Cc1csc(-c2ccccc2Cl)n1)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 762248246 YFYMFRUVGWCZLU-LBPRGKRZSA-N 470.894 5.269 5 20 JKBD C[C@H](OC(=O)C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)C(=O)N1CCCCC1 804860877 REWOHKUXRGTBRB-STZPCZCHSA-N 479.558 5.079 5 20 JKBD Cc1cc(C(=O)O[C@@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)c(C)n1[C@@H](C)c1ccccc1 914662687 KXJMERTULMABSK-WMZOPIPTSA-N 460.490 5.590 5 20 JKBD O=[N+]([O-])c1cccc(-c2ccc(/C=C(/c3nc4ccccc4[nH]3)S(=O)(=O)c3ccccc3)o2)c1 915852429 YREZOUGXTYEZIA-JLPGSUDCSA-N 471.494 5.703 5 20 JKBD Cc1cc(C(=O)NC2(c3ccc(NC(=O)c4cc(-c5ccccc5)on4)cc3)CCC2)ncc1[N+](=O)[O-] 1785786127 ZUPIBQLEDDQZRI-UHFFFAOYSA-N 497.511 5.015 5 20 JKBD Cc1ccc(CC(=O)NC2(c3ccc(NC(=O)c4cnc5ccoc5c4)cc3)CCC2)cc1[N+](=O)[O-] 1788485552 LDBJXILJRIHOQO-UHFFFAOYSA-N 484.512 5.035 5 20 JKBD COc1cc(CC(=O)NC2(c3ccc(NC(=O)[C@@]4(F)CCCC=C4F)cc3)CCC2)ccc1[N+](=O)[O-] 1792379268 IFIKVRNZTUMGLB-AREMUKBSSA-N 499.514 5.026 5 20 JKBD CC(C)=CCCC(=O)N1CCC2(CCCN(C(=O)CCCc3cc(C)c(F)cc3[N+](=O)[O-])C2)CC1 1805821449 PUHLXYYDURGOJU-UHFFFAOYSA-N 487.616 5.343 5 20 JKBD O=C(Nc1cc([C@H]2CCCCN2C(=O)CCc2cccc([N+](=O)[O-])c2)[nH]n1)c1ccc2ccoc2c1 1821456124 DOEUZYMVHHISJL-JOCHJYFZSA-N 487.516 5.003 5 20 JKBD CCC(C)(C)C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cc3cc([N+](=O)[O-])ccc3s2)n[nH]1 1821610070 ARSUGKGZKHLWNS-KRWDZBQOSA-N 469.567 5.275 5 20 JKBD O=C(/C=C/c1ccccc1[N+](=O)[O-])N1CCC([C@@H]2CCCCN2C(=O)c2ccc(Cl)s2)CC1 1825856306 AWCLMAMDZIZYMR-BLRBJFNZSA-N 488.009 5.256 5 20 JKBD Cc1c(C(=O)N2CCCC[C@H]2C2CCN(C(=O)C3CC4(CCC4)C3)CC2)cc(Cl)cc1[N+](=O)[O-] 1830736339 BJINKRMDZCZSTN-QFIPXVFZSA-N 488.028 5.370 5 20 JKBD COC1(CC(=O)N2CCC([C@@H]3CCCCN3C(=O)c3cc4cc([N+](=O)[O-])ccc4s3)CC2)CCC1 1831061254 CRSIONFJTKEHIR-NRFANRHFSA-N 499.633 5.002 5 20 JKBD O=C(Cc1ccc([N+](=O)[O-])cc1F)N1CCC([C@H]2CCCCN2C(=O)c2ccccc2C2CC2)CC1 1832555747 GGWBKWASAFIGBR-AREMUKBSSA-N 493.579 5.087 5 20 JKBD Cc1nc(S[C@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2C(F)(F)F)[nH]c1Cc1ccccc1 9946704 ZWXLLRLXZAKFCN-CYBMUJFWSA-N 464.469 5.355 5 20 JKBD C[C@H](OC(=O)c1ccc(N2CCCC2)c([N+](=O)[O-])c1)C(=O)Nc1c(Cl)cc(Cl)cc1Cl 10733813 XJAUMTOQVUUXKE-NSHDSACASA-N 486.739 5.339 5 20 JKBD CC(C)n1ncc2c(C(=O)OCC(=O)Nc3cc(Cl)ccc3[N+](=O)[O-])cc(-c3cccs3)nc21 11049736 AQECSVVMNWSFOY-UHFFFAOYSA-N 499.936 5.098 5 20 JKBD C[C@@H](OC(=O)c1ccccc1Oc1ccccc1)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 11481163 CLHJDLGXGGLNME-CQSZACIVSA-N 474.391 5.590 5 20 JKBD Cc1ccc(NC(=O)[C@@H](C)OC(=O)c2ccc(Sc3nc(C)cs3)c([N+](=O)[O-])c2)c(C)c1 16903570 JBPMKLMGUSHKPK-OAHLLOKOSA-N 471.560 5.312 5 20 JKBD C[C@@H](OC(=O)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1)c1nnc(-c2cccs2)o1 17716542 QEJXVJGODKOSLD-GFCCVEGCSA-N 471.878 6.070 5 20 JKBD CC[C@@H](C)c1ccccc1NC(=O)[C@H](C)OC(=O)c1ccc(Cn2nc(C)c([N+](=O)[O-])c2C)cc1 26160856 ASUXKWUCCMTFIN-APWZRJJASA-N 478.549 5.154 5 20 JKBD O=C(Cn1c2ccccc2c(=O)c2ccccc21)N[C@@H](c1ccc(Br)cc1)C1CCC1 108425403 DIYMPEOHPOTJSQ-RUZDIDTESA-N 475.386 5.575 5 20 JKBD CCC(=O)Nc1ccc(C)c(NC(=O)c2ccccc2C(=O)c2ccc(SC)c([N+](=O)[O-])c2)c1 117134462 ZJNOYPBISWEQAB-UHFFFAOYSA-N 477.542 5.457 5 20 JKBD O=C(Cc1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1)N1CCC[C@@H]1c1ccc2c(c1)OCO2 303193462 MOJLBEUVUIEWTK-XMMPIXPASA-N 496.523 5.082 5 20 JKBD C[C@H](Nc1ccc(C(=O)Nc2ccc(CS(=O)(=O)C(C)(C)C)cc2)cc1[N+](=O)[O-])c1ccccn1 497782749 MHRLHSCWTUYHMN-KRWDZBQOSA-N 496.589 5.129 5 20 JKBD O=C([C@@H]1C[C@@H]1c1ccc(Br)cc1)N(Cc1ccccc1[N+](=O)[O-])CC(F)(F)F 499379735 VEVXWNNMXIHWKF-HZPDHXFCSA-N 457.246 5.052 5 20 JKBD O=[N+]([O-])c1cc(Cl)ccc1Oc1ccc(CNCc2ccccc2N2CCOCC2)cc1 507947253 XSJJCQKPCQKRBV-UHFFFAOYSA-N 453.926 5.167 5 20 JKBD COc1ccc([C@@H]2Nc3ccc(Cl)cc3C(=O)N2C)cc1OCc1ccc([N+](=O)[O-])cc1 515592080 COGIQLBKCAJKLQ-JOCHJYFZSA-N 453.882 5.032 5 20 JKBD O=C1CCCN1c1cccc(CNCc2ccc(-c3ccc([N+](=O)[O-])cc3Br)o2)c1 518762368 VDMMMAWKPMRHRD-UHFFFAOYSA-N 470.323 5.034 5 20 JKBD CSc1ccc([N+](=O)[O-])c(C(=O)Nc2ccc(NC(=O)[C@@H](C)n3nc(C)cc3C)c(Cl)c2)c1 518823518 REGJSEOLAJGHCH-CQSZACIVSA-N 487.969 5.235 5 20 JKBD C[C@@H](NCc1ccc(-c2ccc([N+](=O)[O-])cc2)o1)c1cccc(NC(=O)Cc2ccccc2F)c1 520951198 VTUAZICWKKPZGF-GOSISDBHSA-N 473.504 6.026 5 20 JKBD CCN(Cc1ccc(OC)c(OC)c1)C(=O)c1ccccc1C(=O)c1ccc(SC)c([N+](=O)[O-])c1 521541635 CRPKLYOLGIQKIG-UHFFFAOYSA-N 494.569 5.227 5 20 JKBD O=C(C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)NC1(c2ccccc2)CC1 522559750 YUIIGABCGOGEPE-KNTRCKAVSA-N 455.539 5.941 5 20 JKBD CN(Cc1cn(-c2ccccc2)nc1-c1cccs1)C(=O)c1cc2cc([N+](=O)[O-])ccc2o1 603732173 ADSGTZQIFSSSNM-UHFFFAOYSA-N 458.499 5.527 5 20 JKBD COCCN(C(=O)c1ccc(SC(C)C)cc1)c1nc(-c2ccc([N+](=O)[O-])cc2)cs1 603946607 NRWSDJVTCSATKX-UHFFFAOYSA-N 457.577 5.512 5 20 JKBD COc1cc(C(=O)Nc2cccnc2Oc2ccccc2)c([N+](=O)[O-])cc1OCc1cscn1 604387678 NDSXDGHRUMCUSI-UHFFFAOYSA-N 478.486 5.079 5 20 JKBD Cc1ccc(Sc2ccc(C(=O)N3CCCc4ccc(S(C)(=O)=O)cc43)cc2[N+](=O)[O-])cc1 604570101 ULCRGSNGFPHQBL-UHFFFAOYSA-N 482.583 5.051 5 20 JKBD C[C@@H](Nc1ccc(C(=O)N[C@@H](CN2CCCCC2)c2ccccc2)cc1[N+](=O)[O-])c1ccccn1 609018439 ZMWKDIAUTINCMD-NLFFAJNJSA-N 473.577 5.120 5 20 JKBD COc1ccc(NC(C)=O)cc1NC(=O)[C@@H](C)Sc1nc2ccccc2c2nc3ccccc3n12 662251588 FWYOKFWFQKCXSR-OAHLLOKOSA-N 485.569 5.122 5 20 JKBD CCc1cccc[n+]1/C(C(=S)N[C@@H](C)c1cccs1)=C(/O)c1ccc(C)c([N+](=O)[O-])c1 726579499 MFMQOEMDJYVWOZ-INIZCTEOSA-O 454.597 5.377 5 20 JKBD CC1=C(C(=O)Nc2cccc(C)c2)[C@@H](c2ccc([N+](=O)[O-])cc2)NC(=O)N1Cc1cccs1 732031670 FUPSXQQEXOCMQC-JOCHJYFZSA-N 462.531 5.144 5 20 JKBD CC(C)N(Cc1ccc(-c2ccccc2F)s1)Cn1nc(-c2cccc([N+](=O)[O-])c2)ccc1=O 747073790 HPLLPHNIIYFSGP-UHFFFAOYSA-N 478.549 5.554 5 20 JKBD CCN(CC)Cc1ccc(C(=O)Nc2cc(Cl)c([N+](=O)[O-])cc2OCc2ccccc2)o1 843037165 AEQOANGLOXOJGS-UHFFFAOYSA-N 457.914 5.514 5 20 JKBD C[C@@H](OC(=O)c1cc2cc([N+](=O)[O-])ccc2s1)C(=O)c1ccc(NC(=O)C(C)(C)C)cc1 916540684 DOGHOKSVLMXJGP-CYBMUJFWSA-N 454.504 5.222 5 20 JKBD COc1ccc(-c2nn(CN(Cc3ccc([N+](=O)[O-])cc3)C(C)C)c(=S)n2C[C@@H]2CCCO2)cc1 919950038 DKZXSQRNLGOZFC-QHCPKHFHSA-N 497.621 5.045 5 20 JKBD COc1ccc([N+](=O)[O-])cc1NC(=O)[C@@H](C)OC(=O)c1csc(-c2ccc(Cl)cc2Cl)n1 921224853 SVASXYVITUIVIR-SNVBAGLBSA-N 496.328 5.218 5 20 JKBD CC(C)c1cc(C(=O)Nc2ccc(C3(NC(=O)CSc4ccccc4[N+](=O)[O-])CCC3)cc2)no1 1787547461 CCBOSZVCCXYLMH-UHFFFAOYSA-N 494.573 5.246 5 20 JKBD COc1ccccc1C(=O)Nc1ccc(C2(NC(=O)/C=C/c3ccccc3[N+](=O)[O-])CCC2)cc1 1790232937 INOGIVHTGVHOMR-LFIBNONCSA-N 471.513 5.065 5 20 JKBD Cc1ccc(CC(=O)Nc2ccc(C3(NC(=O)c4cnc5ccoc5c4)CCC3)cc2)cc1[N+](=O)[O-] 1790526053 KBIQWTBWOCFGJD-UHFFFAOYSA-N 484.512 5.035 5 20 JKBD Cc1cc[nH]c1C(=O)NC1(c2ccc(NC(=O)c3cccc(Br)c3[N+](=O)[O-])cc2)CCC1 1790751434 FHOJRRZRTPURBH-UHFFFAOYSA-N 497.349 5.055 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)[C@H]3CC[C@H](O)CC3)CCC2)cc1)c1cc2cc([N+](=O)[O-])ccc2s1 1791010349 JGLHZDPTUBOJOJ-OQIWPSSASA-N 493.585 5.108 5 20 JKBD O=C(NC1(c2ccc(NC(=O)c3c(F)ccc(Cl)c3F)cc2)CCC1)c1ccc([N+](=O)[O-])o1 1792156052 KPURQBUDYQSFOV-UHFFFAOYSA-N 475.835 5.181 5 20 JKBD O=C(CCc1cccc([N+](=O)[O-])c1)Nc1cc([C@H]2CCCCN2C(=O)c2cc3ccccc3o2)[nH]n1 1815537279 UPGMWESOFNNWHC-OAQYLSRUSA-N 487.516 5.003 5 20 JKBD CC1=CC[C@@H](C(=O)N2CCCC[C@@H]2c2cc(NC(=O)C3(c4cccc([N+](=O)[O-])c4)CCC3)n[nH]2)CC1 1820841167 PXUMOMPYZXGUTG-AUSIDOKSSA-N 491.592 5.178 5 20 JKBD O=C(/C=C/c1ccccc1[N+](=O)[O-])Nc1cc([C@@H]2CCCCN2C(=O)c2cc3ccoc3s2)[nH]n1 1823501194 PFBLSYLTGXIAAY-SGQUHAKNSA-N 491.529 5.145 5 20 JKBD Cc1c(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)[C@H]3CCC[C@@H]3C)CC2)cc(Cl)cc1[N+](=O)[O-] 1830736110 QQGOQACHPOYIBG-XUEUYAKLSA-N 476.017 5.226 5 20 JKBD CCC[C@H]1CC[C@H](C(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3ccc([N+](=O)[O-])c(OC)c3)CC2)CC1 1831562557 UWCIHUHDPWAXSY-KIFXHHALSA-N 499.652 5.443 5 20 JKBD CC(=O)N(c1nc(COC(=O)c2c(C)cccc2[N+](=O)[O-])cs1)c1c(C)cc(C)cc1Cl 26119247 CIEXMEOYLBCIIR-UHFFFAOYSA-N 473.938 5.672 5 20 JKBD COc1cc([N+](=O)[O-])ccc1NC(=O)CCSc1nnc(-c2cccs2)n1Cc1ccccc1 26220896 KFTRDPOURJASCA-UHFFFAOYSA-N 495.586 5.093 5 20 JKBD COc1ccc2[nH]cc(C3CCN(C(=O)c4ccc(N[C@@H](C)c5ccccn5)c([N+](=O)[O-])c4)CC3)c2c1 108866965 DZKASYXHKPIVCP-SFHVURJKSA-N 499.571 5.673 5 20 JKBD Cc1ccc(-c2csc(N(C(=O)Cn3cc([N+](=O)[O-])nc3C)c3cc(C)ccc3C)n2)cc1 116042884 UQJJVZNBGZYSBA-UHFFFAOYSA-N 461.547 5.513 5 20 JKBD C[C@H]1CCCCN1Cc1ccccc1CNC(=O)c1ccc(N[C@H](C)c2ccccn2)c([N+](=O)[O-])c1 227409667 KXSDHFHINYTUPS-LEWJYISDSA-N 487.604 5.467 5 20 JKBD C[C@H]1CCC[C@H](C)N1C(=O)c1cc(Cl)ccc1NC(=O)c1ccc(N2CCCC2)c([N+](=O)[O-])c1 302948223 LXDFXVLZHNQZMD-IRXDYDNUSA-N 484.984 5.504 5 20 JKBD O=C(N[C@@H]1CCN2CCC[C@@H]2C1)c1c2c(nc3ccccc13)/C(=C/c1ccc([N+](=O)[O-])cc1)CCC2 485014283 OGIAHCLCNJPCAE-DMEXQZDASA-N 482.584 5.377 5 20 JKBD COc1cc(C(=O)N(C)[C@H](c2ccccc2)C(F)(F)F)c([N+](=O)[O-])cc1OCc1cscn1 485253203 CZHUJUSDBPJPRX-LJQANCHMSA-N 481.452 5.015 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Cl)[C@H](c1ccccc1)N1CCO[C@H](c2ccccc2)C1 492512453 DAQWKRKUAAEULT-GOTSBHOMSA-N 451.910 5.002 5 20 JKBD O=C(c1csc(-c2ccc([N+](=O)[O-])cc2)n1)N(Cc1ccccn1)c1ccc(Cl)cc1 496614732 ZUABMZIDQGKFNT-UHFFFAOYSA-N 450.907 5.614 5 20 JKBD C[C@@H]1C[C@@H](C)CN(c2ccc(C(=O)Nc3ccc(CS(=O)(=O)C(C)(C)C)cc3)cc2[N+](=O)[O-])C1 497781511 GWJNLZYKVZPUIQ-QZTJIDSGSA-N 487.622 5.043 5 20 JKBD COC(=O)c1ccccc1C(=O)c1ccc(NCCC(=O)Nc2cccc(Cl)c2C)c([N+](=O)[O-])c1 507019762 ANOSAPDTBPFYCU-UHFFFAOYSA-N 495.919 5.015 5 20 JKBD CCN(C(=O)NCc1ccccc1[N+](=O)[O-])[C@H]1CCSc2ccc(Br)cc21 508108772 GHHDRIOEGYRCKH-KRWDZBQOSA-N 450.358 5.126 5 20 JKBD O=[N+]([O-])c1cc(CNCc2cccc(CN3CCOCC3)c2)ccc1Oc1ccccc1Cl 509617585 JSMKRAUNSDRBCF-UHFFFAOYSA-N 467.953 5.163 5 20 JKBD COc1ccc(NC(=O)c2ccc([N+](=O)[O-])cc2I)cc1Cc1ccccc1 511456195 LABWAQSMAIDGKC-UHFFFAOYSA-N 488.281 5.051 5 20 JKBD O=C(c1cc(NCC2(c3ccc(Cl)cc3Cl)CCOCC2)ccc1[N+](=O)[O-])N1CCCC1 511700502 MBQAIPLXMITYIO-UHFFFAOYSA-N 478.376 5.298 5 20 JKBD CC(C)N(C(=O)c1ccc(N2C[C@H](C)C[C@@H](C)C2)c([N+](=O)[O-])c1)c1ccc(Br)cn1 515624506 FWHXOLMFEDKVRD-HZPDHXFCSA-N 475.387 5.290 5 20 JKBD COc1ccc(Oc2ccc([N+](=O)[O-])cc2C(=O)Nc2cccc(NC(=O)c3ccccc3)c2C)cc1 515658090 VAFXQWFZEDLWAL-UHFFFAOYSA-N 497.507 6.209 5 20 JKBD Cc1onc(-c2ccccc2)c1-c1nnc(COc2ccc(-c3ccccc3)cc2[N+](=O)[O-])o1 518657100 CCPQMESGFYYDCQ-UHFFFAOYSA-N 454.442 5.854 5 20 JKBD CN(C[C@@H]1CCCOC1)C(=O)c1ccccc1Sc1ccc(C(F)(F)F)cc1[N+](=O)[O-] 520771450 JGOFSEZJNPAFSF-AWEZNQCLSA-N 454.470 5.263 5 20 JKBD CCCOc1cc(NC(=O)c2cnn(-c3ccccc3F)c2C)c([N+](=O)[O-])cc1OCCC 593141528 IEUAFHJMNYYLPZ-UHFFFAOYSA-N 456.474 5.058 5 20 JKBD O=C(C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)N[C@H]1CCCc2nc(O)ccc21 603461311 SZIILQGPXJKVLA-JIHAQRTOSA-N 486.553 5.430 5 20 JKBD COc1cc(CN(C)C(=O)c2ccc(N3CCCC3)c([N+](=O)[O-])c2)ccc1OCc1ccccc1 603926459 QMLSVERJLBBDMX-UHFFFAOYSA-N 475.545 5.055 5 20 JKBD O=C(c1cc([N+](=O)[O-])ccc1NCc1ccccc1)N1C[C@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1 604258311 YFXIYRVKDSXGSC-HUUCEWRRSA-N 475.389 5.410 5 20 JKBD O=C(c1cc2cc([N+](=O)[O-])ccc2s1)N1CCC[C@@H](c2nc(-c3cccc(F)c3)no2)C1 608817278 KOCRLAHXQQNSOU-CQSZACIVSA-N 452.467 5.018 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Cl)[C@@H](NCc1cccc(OCC(F)F)c1)c1ccccc1 608834907 ZXOVIWUGHJAJMZ-QFIPXVFZSA-N 475.879 5.362 5 20 JKBD CC[C@@H](NCc1ccc(-c2ccc([N+](=O)[O-])cc2Br)o1)c1nnc2n1CCCCC2 609006791 WZSQCXKWFZVOLS-GOSISDBHSA-N 474.359 5.176 5 20 JKBD CCOc1cc(NC(=O)Cc2csc(-c3ccccc3Cl)n2)c([N+](=O)[O-])cc1OCC 619213032 ASBFPYVSKHMYIT-UHFFFAOYSA-N 461.927 5.350 5 20 JKBD O=C(Cn1c2ccccc2c(=O)c2ccccc21)Nc1cc(-c2nnc3n2CCCCC3)ccc1Cl 644689003 ZNSXMPMHAGAPLD-UHFFFAOYSA-N 497.986 5.432 5 20 JKBD CC(=O)N1C=Cc2ccccc2[C@@H]1CC(=O)Oc1ccc2c(-c3ccc([N+](=O)[O-])cc3)cc(=O)oc2c1 728022096 LYNIYCNQRRHQSR-VWLOTQADSA-N 496.475 5.238 5 20 JKBD C[C@H](Nc1ccc(C(=O)N2CCC[C@H]2c2ccccc2C(F)(F)F)cc1[N+](=O)[O-])c1ccccn1 728033403 LMNOBMDGOYQAHP-AOMKIAJQSA-N 484.478 6.159 5 20 JKBD COc1ccc(-c2cc3[nH]c(/C(Cl)=C\c4cc(OC)c(O)c([N+](=O)[O-])c4)nc(=O)c3s2)cc1 797250558 YFNAZRJZERDMPS-VGOFMYFVSA-N 485.905 5.020 5 20 JKBD COc1cc(-c2nc(CC(=O)Nc3ccc(C)cc3)no2)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 904254034 WGWFWSQSEATIHW-UHFFFAOYSA-N 494.891 5.589 5 20 JKBD COc1ccc(Oc2ccc([N+](=O)[O-])cc2C(=O)OCC(=O)Nc2ccccc2C(C)C)cc1 915250208 RCHUXNWUDNTEFZ-UHFFFAOYSA-N 464.474 5.315 5 20 JKBD O=C(Oc1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2Cl)cc1)c1ccc(N2CCCCCC2)nc1 916950873 DNBDAMONNIRORR-UHFFFAOYSA-N 494.935 5.495 5 20 JKBD Cc1csc(SCc2c(C(=O)N[C@@H](C)c3cccc([N+](=O)[O-])c3)oc3ccccc23)n1 917701010 POZSHJJBBATEGT-AWEZNQCLSA-N 453.545 5.889 5 20 JKBD C[C@H](NC(=O)c1cc(S(=O)(=O)Nc2ccc(Cl)cc2)ccc1Cl)c1cccc([N+](=O)[O-])c1 918135447 HBSYHYLUCAAIKC-ZDUSSCGKSA-N 494.356 5.193 5 20 JKBD CCc1noc2ncc(C(=O)Nc3cc(Cl)c([N+](=O)[O-])cc3OCc3ccccc3)cc12 918399492 KISUTTZNNHFLRO-UHFFFAOYSA-N 452.854 5.178 5 20 JKBD COc1ccc(-c2nc(COC(=O)c3ccc(N[C@H](C)c4ccccn4)c([N+](=O)[O-])c3)cs2)cc1 920548224 ROOTXKUPIDPZEB-MRXNPFEDSA-N 490.541 5.652 5 20 JKBD O=C(NC1(c2ccc(NC(=O)c3ccncc3-c3ccccc3)cc2)CCC1)c1ccc([N+](=O)[O-])o1 1789932368 KUXWDCQUNMBPPV-UHFFFAOYSA-N 482.496 5.311 5 20 JKBD Cc1ccc(CC(=O)Nc2ccc(C3(NC(=O)c4nc5ccccc5o4)CCC3)cc2)cc1[N+](=O)[O-] 1790525240 IUVALOSQDVLWFK-UHFFFAOYSA-N 484.512 5.035 5 20 JKBD CC(C)[C@H](C(=O)N1CCC2(CCCN(C(=O)CCc3cccc([N+](=O)[O-])c3)C2)CC1)c1ccccc1 1806486719 VRRWPOOJGBRHLR-MHZLTWQESA-N 491.632 5.198 5 20 JKBD O=C(Nc1cc([C@@H]2CCCCN2C(=O)CCC(F)(F)F)[nH]n1)c1cc2cc([N+](=O)[O-])ccc2s1 1821609953 QDQZYLARANDXHD-HNNXBMFYSA-N 495.483 5.181 5 20 JKBD O=C(CCc1cccc([N+](=O)[O-])c1)N1CCC([C@@H]2CCCCN2C(=O)c2cc3sccc3[nH]2)CC1 1828708581 GFJABPXMEYCYIG-QHCPKHFHSA-N 494.617 5.004 5 20 JKBD COc1cc(C(=O)N2CCC([C@H]3CCCCN3C(=O)c3ccccc3C3CC3)CC2)ccc1[N+](=O)[O-] 1832556720 ACYAOGMYWIXQNI-XMMPIXPASA-N 491.588 5.028 5 20 JKBD O=C(O[C@H](C(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1)c1ccccc1)c1nc(Cl)ccc1Cl 9644984 ZLGQCOBMYVEWQH-SFHVURJKSA-N 480.691 5.487 5 20 JKBD Cc1cc(CN[C@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Br)c2ccccc2)ccc1F 11715543 IVGYEPVMVJGADK-NRFANRHFSA-N 472.314 5.274 5 20 JKBD CCCCc1ccc2nc(NC(=O)c3cc(OC)c(OC(F)F)cc3[N+](=O)[O-])sc2c1 11916152 MDUOJSIJCSPWEL-UHFFFAOYSA-N 451.451 5.409 5 20 JKBD O=C(Nc1cccc(C(=O)NC2CC2)c1)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1 16173093 LWHLZVIIINGEOW-UHFFFAOYSA-N 451.866 5.185 5 20 JKBD COc1cc(/C=C(\Cl)c2nc3scc(-c4ccc(C)s4)c3c(=O)[nH]2)cc([N+](=O)[O-])c1O 18065276 LCPWZCPZHHQVBD-XGICHPGQSA-N 475.935 5.381 5 20 JKBD O=C(CCSc1nnc(-c2cccs2)n1Cc1ccccc1)Nc1ccc([N+](=O)[O-])cc1 26220884 JERHWCQQNIIMLD-UHFFFAOYSA-N 465.560 5.084 5 20 JKBD O=C(C[C@@H](NC(=O)c1ccccc1)c1ccccc1)Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1 104673213 SIPZCMUGTBZOJU-OAQYLSRUSA-N 472.526 5.218 5 20 JKBD CCOc1ccc(C(=O)NC[C@H](c2ccc(OC)cc2)c2c[nH]c3ccccc23)cc1[N+](=O)[O-] 104794992 YJXMUQMBFKDFPX-OAQYLSRUSA-N 459.502 5.045 5 20 JKBD CN(Cc1ccccc1[N+](=O)[O-])C(=O)c1nn(-c2cc(C(F)(F)F)ccc2Cl)c2c1CCC2 216155620 XUSCVTUHTRQAER-UHFFFAOYSA-N 478.858 5.214 5 20 JKBD CCOc1cc(CN[C@H](C)c2ccccc2)ccc1OCc1cc([N+](=O)[O-])cc2c1OCOC2 409611464 IYXJWMNIEXEGHD-GOSISDBHSA-N 464.518 5.290 5 20 JKBD C[C@H](Nc1ccc(C(=O)N[C@H](CC(F)(F)F)c2ccccc2)cc1[N+](=O)[O-])c1ccccn1 409893496 WDVCWHOTNWFPKQ-MGPUTAFESA-N 458.440 5.586 5 20 JKBD O=C(Nc1ccc(F)cc1)NC1CCN(C(=O)c2cc([N+](=O)[O-])ccc2Sc2ccccc2)CC1 484944055 IKTHSPPFIUPUEQ-UHFFFAOYSA-N 494.548 5.311 5 20 JKBD O=C(Nc1cc(Cl)cc(Cl)c1)[C@H]1CCCN1C(=O)c1csc(-c2ccc([N+](=O)[O-])cc2)n1 495485074 SIMVZHBHEKZXAY-GOSISDBHSA-N 491.356 5.268 5 20 JKBD Cc1nn(Cc2ccc(C(=O)NC(C)(c3ccccc3)c3ccccc3)cc2)c(C)c1[N+](=O)[O-] 504649707 HRGOAMAIYODKLI-UHFFFAOYSA-N 454.530 5.150 5 20 JKBD O=[N+]([O-])c1cccc(F)c1CN(Cc1ccccc1)S(=O)(=O)c1ccccc1C(F)(F)F 505589825 HXATVPZBVJFUOU-UHFFFAOYSA-N 468.428 5.144 5 20 JKBD COCCOc1cc(NC(=O)c2cc([N+](=O)[O-])ccc2Sc2ccccc2)ccc1OC 505982995 VBBFHISSEKQFLL-UHFFFAOYSA-N 454.504 5.032 5 20 JKBD CN(c1ccccc1)c1ccc(CNCc2ccc(NC(=O)c3ccncc3)cc2)cc1[N+](=O)[O-] 507928311 DCVQLWPWMTVNTE-UHFFFAOYSA-N 467.529 5.300 5 20 JKBD Cc1noc(C2CCN(C(=O)C/C(=C\c3ccc([N+](=O)[O-])cc3)c3nc4ccccc4s3)CC2)n1 509141061 RYHCBSZXPQPBQK-XMHGGMMESA-N 489.557 5.233 5 20 JKBD CC(C)OCc1ccc(NC(=O)Cc2cn(-c3ccccc3)nc2-c2ccc([N+](=O)[O-])cc2)cc1 512166393 STYKVMBXYOSBTL-UHFFFAOYSA-N 470.529 5.554 5 20 JKBD CCCOc1cc(NC(=O)N2CCC[C@@H]2c2ccc3c(c2)OCCO3)c([N+](=O)[O-])cc1OCCC 514503941 WIXFRPPJUKRXJN-LJQANCHMSA-N 485.537 5.313 5 20 JKBD COc1cc(C(=O)N2CCC[C@@H]2c2ccccn2)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 516619904 IOGBPLSLUXMHPY-GOSISDBHSA-N 453.882 5.421 5 20 JKBD Cc1cc(C(=O)N2CCC[C@H](C)C2)ccc1NC(=O)c1cc([N+](=O)[O-])ccc1Sc1ccccc1 519986477 PGJCYNJTXFKPHK-SFHVURJKSA-N 489.597 6.179 5 20 JKBD O=C(C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)N(Cc1ccncc1)C1CC1 520063387 KVXJDQQMLLWGTD-HKWRFOASSA-N 470.554 5.721 5 20 JKBD O=C(c1cnn(-c2ccc([N+](=O)[O-])cc2)c1)N(Cc1ccc(Cl)c(Cl)c1)Cc1ccccn1 520634036 KERAVQULESCURO-UHFFFAOYSA-N 482.327 5.325 5 20 JKBD COCCOc1ccc(NC(=O)c2ccc(Sc3nc(C)cs3)c([N+](=O)[O-])c2)c(C)c1 521186237 CJFUJMYCAIWYGO-UHFFFAOYSA-N 459.549 5.097 5 20 JKBD Cc1ccc(NC(=O)Nc2ccccc2)cc1NC(=O)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-] 603743078 UDUMMLVMLJOAGI-UHFFFAOYSA-N 488.422 5.741 5 20 JKBD O=C(CSc1ccc(C(F)(F)F)cc1[N+](=O)[O-])NCc1ccc(Oc2ccc(F)cc2)nc1 603813862 BIYSKXBLHRCSIE-UHFFFAOYSA-N 481.427 5.349 5 20 JKBD Cc1ccc(OCCCCNC(=O)C2CCN(c3ccc(C(F)(F)F)cc3[N+](=O)[O-])CC2)cc1 603915945 SBTBKPKKKUNSMN-UHFFFAOYSA-N 479.499 5.114 5 20 JKBD CC1CCN(c2ccc(CN[C@H](C(=O)Nc3ccc([N+](=O)[O-])cc3Cl)c3ccccc3)cn2)CC1 604045234 KHGKBLZWBVWVRV-VWLOTQADSA-N 493.995 5.349 5 20 JKBD COC(=O)c1ccc2c(O)nc(/C=C\c3ccc(Oc4ccc(F)cc4)c([N+](=O)[O-])c3)nc2c1 608801203 OOOGCKRTYBFPGA-JYOAFUTRSA-N 461.405 5.132 5 20 JKBD O=C(Nc1ccc(Sc2nncs2)c(Cl)c1)C1CCN(c2ccccc2[N+](=O)[O-])CC1 609107713 TVJSRZNAVZDVET-UHFFFAOYSA-N 475.983 5.106 5 20 JKBD COc1cc(C(=O)Nc2ccc(Oc3ccc(F)cc3)cn2)c([N+](=O)[O-])cc1OCc1cscn1 729379679 WDJWWSVINXOIPA-UHFFFAOYSA-N 496.476 5.218 5 20 JKBD CCN(Cc1ccc(C)cc1)C(=O)c1ccccc1NC(=O)c1ccc([N+](=O)[O-])cc1Cl 745843582 HKXVJSUFZORJSR-UHFFFAOYSA-N 451.910 5.471 5 20 JKBD O=C(Oc1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2Cl)cc1)c1ccnc(Oc2ccccc2)c1 749162332 OKYYRLHIFVLCJS-UHFFFAOYSA-N 489.871 5.907 5 20 JKBD Cc1cccc(C(C)C)c1NC(=O)COC(=O)c1ccc(N2CCC(C)CC2)c([N+](=O)[O-])c1 783341972 VCTVSVZTFQAJPZ-UHFFFAOYSA-N 453.539 5.058 5 20 JKBD Cc1ccc(NC(=O)C2=S=C(/C(Cl)=C\c3ccc(-c4ccccc4[N+](=O)[O-])o3)N=N2)cc1 844255837 NOFPBXIMOLEQQN-SFQUDFHCSA-N 466.906 5.840 5 20 JKBD CSc1ccc(C(=O)c2ccccc2C(=O)Nc2ccc(=O)n(Cc3ccccc3)c2)cc1[N+](=O)[O-] 916464480 WRUPPKAGKWDZAX-UHFFFAOYSA-N 499.548 5.010 5 20 JKBD CC(C)N(Cc1nnc(-c2cccc([N+](=O)[O-])c2)o1)C(=O)[C@H](C)Sc1ccccc1Cl 917591170 VZRCZFJDRDFNHN-AWEZNQCLSA-N 460.943 5.216 5 20 JKBD CCc1cc[n+](/C(C(=S)Nc2ccc3ccccc3c2)=C(/O)c2ccc(C)c([N+](=O)[O-])c2)cc1 917610923 ZIAGZSQVYFBSQQ-UHFFFAOYSA-O 470.574 6.230 5 20 JKBD O=C1/C(=C\c2ccc(-c3cccc([N+](=O)[O-])c3)o2)NC(=S)N1c1ccc(OC(F)(F)F)cc1 917612393 JDKAYVZZIYSEOH-GZTJUZNOSA-N 475.404 5.016 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)c3ccc(O)c([N+](=O)[O-])c3)CCC2)cc1)c1cccc(Cl)c1 1790265652 VVWMEDPUDICLBX-UHFFFAOYSA-N 465.893 5.015 5 20 JKBD C/C(=C\c1cccnc1)C(=O)NC1(c2ccc(NC(=O)c3c(F)ccc([N+](=O)[O-])c3C)cc2)CCC1 1790772553 QWYCEANRLDRPRG-BMRADRMJSA-N 488.519 5.289 5 20 JKBD Cc1cc(O)c([N+](=O)[O-])cc1C(=O)Nc1ccc(C2(NC(=O)C[C@@H]3C[C@@H]4CC[C@H]3C4)CCC2)cc1 1790808006 OEOLFQYSTZOGGI-QYZOEREBSA-N 477.561 5.183 5 20 JKBD O=C(Cc1cc(F)ccc1[N+](=O)[O-])NC1(c2ccc(NC(=O)[C@@]3(F)CCCC=C3F)cc2)CCC1 1792378568 UVWCMDSVBMJZEV-RUZDIDTESA-N 487.478 5.156 5 20 JKBD O=C(Nc1cc([C@@H]2CCCCN2C(=O)/C=C/c2ccccc2[N+](=O)[O-])[nH]n1)c1cc2ccoc2s1 1817828276 RTXOJEPPXIJEGY-SGQUHAKNSA-N 491.529 5.145 5 20 JKBD Cc1cc([N+](=O)[O-])ccc1NC(=O)CSc1nnc(-c2ccccc2)n1-c1ccc(F)cc1 10212544 KTFNISUDNZNBIK-UHFFFAOYSA-N 463.494 5.021 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Cl)[C@H](NCc1ccc(OC(F)(F)F)cc1)c1ccccc1 11722498 VGRZHMAQHASLCX-HXUWFJFHSA-N 479.842 5.616 5 20 JKBD C[C@@H](Oc1ccc2c(-c3ccc([N+](=O)[O-])cc3)cc(=O)oc2c1)C(=O)Nc1cc(F)ccc1F 15370855 IJHXUPLFUPVNRB-CYBMUJFWSA-N 466.396 5.052 5 20 JKBD Cc1ccc(-c2nnc(-c3ccc(C(=O)OCC(=O)Nc4ccc(Cl)c([N+](=O)[O-])c4)cc3)o2)cc1 16287796 ZSEGTZGUMPBVQB-UHFFFAOYSA-N 492.875 5.069 5 20 JKBD CCn1c(SCC(=O)N[C@H](C)c2ccc(Cl)cc2)nc2cc3ccccc3cc2c1=O 22178746 BSWOBBBNQSNNDI-OAHLLOKOSA-N 451.979 5.193 5 20 JKBD C[C@@H](OC(=O)Cn1c2ccccc2c(=O)c2ccccc21)C(=O)Nc1ccccc1Oc1ccccc1 28775136 CNONOYLPQXXXOD-HXUWFJFHSA-N 492.531 5.517 5 20 JKBD C[C@@H](Nc1ccc(C(=O)Nc2ccc(-n3ccnc3)c(Cl)c2)cc1[N+](=O)[O-])c1ccccn1 116614900 CQANNMMCSWVALH-OAHLLOKOSA-N 462.897 5.254 5 20 JKBD O=C(c1csc(-c2cccc([N+](=O)[O-])c2)n1)N(C[C@H]1CCCO1)c1ccc(Br)cc1 215729343 DRZPWQGVPWDDTA-GOSISDBHSA-N 488.363 5.307 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)N(Cc2ccco2)C23CC4CC(CC(C4)C2)C3)cc1SC 482517863 DLCADJTUBZAMHE-UHFFFAOYSA-N 456.564 5.530 5 20 JKBD Cc1ncc(NC(=O)c2c3c(nc4ccccc24)/C(=C\c2ccc([N+](=O)[O-])cc2)CCC3)cn1 484422839 DGAYRBMGCJCVBB-AQTBWJFISA-N 451.486 5.371 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Cl)[C@H](c1ccccc1)N1CCO[C@H](c2ccc(F)cc2)C1 492483725 AHXIMDJPWGBEAI-GOTSBHOMSA-N 469.900 5.141 5 20 JKBD Cc1ccc(C(=O)NC2CCN(C(=O)c3cc([N+](=O)[O-])ccc3Sc3ccccc3)CC2)s1 497346934 IZTLVYQCKYNUAC-UHFFFAOYSA-N 481.599 5.151 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)Nc2nc(-c3c(F)cc(F)cc3F)c(C)s2)cc1SC 504712398 PCHUNOCVSPFIOO-UHFFFAOYSA-N 469.466 5.427 5 20 JKBD CN1CCN(C(=O)C/C(=C/c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)c2ccccc2C1 504825338 IQVXQRLMVKWJFR-PGMHBOJBSA-N 484.581 5.614 5 20 JKBD C[C@@H](Nc1ccc(C(=O)N(C)[C@H](C)c2ccc(Cl)c(Cl)c2)cc1[N+](=O)[O-])c1ccccn1 506176761 BFFJVCUQJSRLNE-HUUCEWRRSA-N 473.360 6.303 5 20 JKBD Cc1ccc([C@@H](CNC(=O)c2cc([N+](=O)[O-])ccc2Sc2ccccc2)N2CCCC2)o1 506357671 JCQUWJLUVMLSCY-OAQYLSRUSA-N 451.548 5.214 5 20 JKBD O=C(C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)NCCc1c[nH]c2ccccc12 514993751 DAQIWUOXALNCPY-HMMYKYKNSA-N 482.565 5.975 5 20 JKBD CC(C)NC(=O)c1ccc(Cl)c(NC(=O)c2ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])cc2)c1 515633419 GWXWMAMPCWMJOF-UHFFFAOYSA-N 488.327 6.084 5 20 JKBD CC1CCN(CCCNC(=O)C/C(=C\c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)CC1 516379017 PVZBEQQAVVHSFX-HEHNFIMWSA-N 478.618 5.373 5 20 JKBD O=[N+]([O-])c1ccc(-c2nn(-c3ccccc3)cc2CNCc2ccc(OC(F)F)cc2)cc1 517542687 CFLPNNSEPRYNGR-UHFFFAOYSA-N 450.445 5.339 5 20 JKBD CCN(C(=O)CCCNc1ccc([N+](=O)[O-])cc1)[C@H](c1cccnc1)c1ccc(F)c(C)c1 517805290 BSFFRJMKELWOQG-VWLOTQADSA-N 450.514 5.268 5 20 JKBD Cn1cnnc1Sc1ccc(C(=O)N[C@H](c2ccc(Cl)cc2)C2CCCC2)cc1[N+](=O)[O-] 517858896 GUQQQOBIVVAPIS-FQEVSTJZSA-N 471.970 5.189 5 20 JKBD CCOc1cc(NC(=O)c2cc([N+](=O)[O-])ccc2C)c(OCC)cc1NC(=O)c1ccccc1 520692083 PPZUTELDRRKCMF-UHFFFAOYSA-N 463.490 5.205 5 20 JKBD COc1ccc([C@H](NCc2ccc(-c3ccc([N+](=O)[O-])cc3Br)o2)c2nccn2C)cc1 520954307 SPVDWLHOFNOBRP-QFIPXVFZSA-N 497.349 5.239 5 20 JKBD O=C(N[C@@H](c1ccc(F)cc1)[C@H]1CCCO1)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 521388187 SILTYUXAFUVNAC-YADHBBJMSA-N 495.473 5.006 5 20 JKBD COc1cc(C(=O)N(c2ccccc2)C2CCCC2)c([N+](=O)[O-])cc1OCc1cscn1 553455419 SOBCZJUVLKOCEL-UHFFFAOYSA-N 453.520 5.228 5 20 JKBD Cc1ccc(NC(=O)c2ccc(NCc3ccc(C(=O)N4CCCCC4)cc3)c([N+](=O)[O-])c2)cc1 608971798 QVMNYCZCPLZDIA-UHFFFAOYSA-N 472.545 5.394 5 20 JKBD CCOc1cc([N+](=O)[O-])c(C(=O)Nc2ccc(NCc3ccccc3)c(Cl)c2)cc1OC 609153348 WQVVICUUFVVBBK-UHFFFAOYSA-N 455.898 5.520 5 20 JKBD CCC(CC)c1cc[n+](/C(C(=S)Nc2ccc(OC)nc2)=C(/O)c2ccc([N+](=O)[O-])cc2)cc1 726962101 HSYQJGDWPGOESJ-UHFFFAOYSA-O 479.582 5.513 5 20 JKBD Cc1c(C(=O)Nc2cccc(NC(=O)c3cccc(C(F)(F)F)c3)c2)cc([N+](=O)[O-])cc1[N+](=O)[O-] 728849024 XYRLGRVNNXLIDO-UHFFFAOYSA-N 488.378 5.335 5 20 JKBD C[C@H]1CN(c2ccc(NC(=O)CNc3cc([N+](=O)[O-])ccc3Nc3ccccc3)cc2)C[C@@H](C)O1 747449843 MBEAKIQGXNWSRT-KDURUIRLSA-N 475.549 5.003 5 20 JKBD O=C(O[C@@H](C(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1)c1ccccc1)c1csc(-c2ccccn2)n1 749410918 FBXYCHTXTQUKLL-HXUWFJFHSA-N 494.916 5.304 5 20 JKBD COc1cc(C(=O)OCc2sc(-c3ccccc3)nc2C)c([N+](=O)[O-])cc1OCc1cscn1 750886787 DXXCRVREPRFVGI-UHFFFAOYSA-N 497.554 5.428 5 20 JKBD COc1ccc(CSCc2nc(-c3cccc(CN4CCCCC4)c3)no2)cc1[N+](=O)[O-] 904434021 WRBUEIRBZWLWDX-UHFFFAOYSA-N 454.552 5.073 5 20 JKBD O=[N+]([O-])c1ccc(-c2nc(-c3ccc(Cn4cnc5ccccc54)cc3)no2)c(Br)c1 904472879 KPBNOGXVOZCDQP-UHFFFAOYSA-N 476.290 5.472 5 20 JKBD Cc1csc(Sc2ccc(-c3nc(-c4ccc(CN5CCOCC5)cc4)no3)cc2[N+](=O)[O-])n1 904517359 XNSARPUTPDWAOW-UHFFFAOYSA-N 495.586 5.060 5 20 JKBD CC[C@@H](C)c1ccc([C@@H](NC(=O)C(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)c2cccs2)cc1 915743849 WQKKLACLMQODES-SPLOXXLWSA-N 471.966 5.668 5 20 JKBD CC(C)N(Cc1nnc(-c2cccc([N+](=O)[O-])c2)o1)C(=O)[C@@H](C)Sc1ccccc1Cl 917591171 VZRCZFJDRDFNHN-CQSZACIVSA-N 460.943 5.216 5 20 JKBD O=C(COC(=O)c1cc([N+](=O)[O-])ccc1F)Nc1c(Cl)c(Cl)cc(Cl)c1Cl 919251349 AXHUTJVFCYKECZ-UHFFFAOYSA-N 456.040 5.143 5 20 JKBD O=[N+]([O-])c1ccc(/C(O)=C(/C(=S)NCC2CCC2)[n+]2ccc(Cc3ccccc3)cc2)cc1 1318398346 CKUJJNXHIQGQIW-UHFFFAOYSA-O 460.579 5.074 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)Nc1ccc(C2(NC(=O)c3cnn(C(C)(C)C)c3)CCC2)cc1 1790771409 ZRZTXBFJCQJUFT-UHFFFAOYSA-N 493.539 5.055 5 20 JKBD Cc1c(C(=O)Nc2ccc(C3(NC(=O)[C@@H]4[C@H]5C=CS[C@@H]54)CCC3)cc2)cc(Cl)cc1[N+](=O)[O-] 1790774679 OIBRDYGNLPMZQP-UIFIKXQLSA-N 483.977 5.179 5 20 JKBD CC1=CC[C@H](C(=O)Nc2cc([C@@H]3CCCCN3C(=O)c3cc(Cl)cc([N+](=O)[O-])c3C)[nH]n2)CC1 1818808440 YLOLCDLWYQMDMU-JXFKEZNVSA-N 485.972 5.332 5 20 JKBD O=C(Nc1cc([C@@H]2CCCCN2C(=O)CSc2ccccc2[N+](=O)[O-])[nH]n1)c1ccccc1Cl 1820427646 IYAYMQRHMFQEHD-SFHVURJKSA-N 499.980 5.070 5 20 JKBD Cc1cccc(Cl)c1C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cc(F)cc([N+](=O)[O-])c2)n[nH]1 1821167312 NWTGPEVBBBLXJR-LJQANCHMSA-N 485.903 5.039 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2ccc3occc3c2)[nH]n1 1821283525 LAXBIKXBPIQHDS-HXUWFJFHSA-N 491.479 5.131 5 20 JKBD Cc1cc(CCCC(=O)N2CCC([C@@H]3CCCCN3C(=O)C3=CCCC3)CC2)c([N+](=O)[O-])cc1F 1826270126 CGSGCNKEXRZNQF-DEOSSOPVSA-N 485.600 5.095 5 20 JKBD O=C([C@@H](F)c1ccccc1)N1CCC([C@H]2CCCCN2C(=O)CSc2ccccc2[N+](=O)[O-])CC1 1831774845 FAGWITZYOQAGQL-BWKNWUBXSA-N 499.608 5.017 5 20 JKBD O=C(c1ccc([N+](=O)[O-])cc1F)N1CCC([C@H]2CCCCN2C(=O)C2(c3ccccc3)CCC2)CC1 1831782801 XFYJLJUXTJOYQY-RUZDIDTESA-N 493.579 5.089 5 20 JKBD C[C@@H](OC(=O)c1ccc([N+](=O)[O-])cc1Cl)C(=O)Nc1ccc(OCc2ccccc2)cc1 11028883 JDWINNWGBPODHQ-OAHLLOKOSA-N 454.866 5.011 5 20 JKBD Cc1ccc(NC(=O)[C@@H](Sc2nc(Cc3cccs3)n[nH]2)c2ccccc2)c([N+](=O)[O-])c1 11600618 GXXRBDPLLYWKKA-FQEVSTJZSA-N 465.560 5.146 5 20 JKBD COc1cc(NC(=O)c2ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])c(OC)c2)c(OC)cc1Cl 15970287 SQEHRWIHWRRZNW-UHFFFAOYSA-N 493.299 5.972 5 20 JKBD CSc1ccc([N+](=O)[O-])c(C(=O)Nc2cccc(S(=O)(=O)Nc3ccc(Cl)cc3)c2)c1 16200698 BAVTUNUAQNVUSH-UHFFFAOYSA-N 477.951 5.023 5 20 JKBD CC(C)C(=O)Nc1ccc(CNC(=O)c2ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])cc2)cc1 33091485 MXHLMJADRXMQGK-UHFFFAOYSA-N 467.909 5.565 5 20 JKBD O=C(Cn1ccc2cc([N+](=O)[O-])ccc21)Nc1ccc(NC(=O)c2ccco2)cc1C(F)(F)F 109318180 WNRGSTWLQSZDCQ-UHFFFAOYSA-N 472.379 5.052 5 20 JKBD CN(CCCc1cc(-c2ccccc2)no1)C(=O)c1cc([N+](=O)[O-])ccc1Oc1ccccc1 110095258 NSCJFJVHLVSUPZ-UHFFFAOYSA-N 457.486 5.747 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)N(C)Cc2cn(-c3ccccc3)nc2-c2ccccc2)cc1SC 481924063 UUYODKFOCFIPBX-UHFFFAOYSA-N 488.569 5.450 5 20 JKBD O=C(Nc1ccc(F)cc1-c1ccc(Cl)cc1)c1ccc([N+](=O)[O-])cc1I 485723215 OKGSIRCOVKEQPM-UHFFFAOYSA-N 496.663 5.911 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Cl)[C@@H](NCCc1c[nH]c2cc(F)ccc12)c1ccccc1 497509353 PGIYDLFNSCPOMA-QHCPKHFHSA-N 466.900 5.381 5 20 JKBD O=C(C1CCN(c2ccccc2[N+](=O)[O-])CC1)N(Cc1ccc(Cl)c(Cl)c1)Cc1ccccn1 499637017 PWTQWCVHCWSVCK-UHFFFAOYSA-N 499.398 5.742 5 20 JKBD Cc1csc(Sc2ccc(C(=O)Nc3cccc(C(=O)NC(C)(C)C)c3)cc2[N+](=O)[O-])n1 502219788 NMDWSLLZTLOXRN-UHFFFAOYSA-N 470.576 5.292 5 20 JKBD CC(C)(C)c1ccc(Oc2ccc(CNC3CCN(C(=O)C4CC4)CC3)cc2[N+](=O)[O-])cc1 504112604 UIIIWOYFGYYQHG-UHFFFAOYSA-N 451.567 5.175 5 20 JKBD C[C@H](Nc1ccc(C(=O)N(C)CCCc2cc(-c3ccccc3)no2)cc1[N+](=O)[O-])c1ccccn1 505391897 MBQNUFMRKBNNRB-IBGZPJMESA-N 485.544 5.523 5 20 JKBD CCOc1cc([N+](=O)[O-])c(C(=O)Nc2ccc(Sc3nc4ccccc4[nH]3)cc2)cc1OC 506927152 HXSBMDMYQVDTHX-UHFFFAOYSA-N 464.503 5.282 5 20 JKBD COc1cc(C(=O)N[C@H](CC(C)C)c2ccccc2)c([N+](=O)[O-])cc1OCc1cscn1 512583348 SAZCYBNLKOYWAC-LJQANCHMSA-N 455.536 5.156 5 20 JKBD CCOc1cc([N+](=O)[O-])c(C(=O)N[C@H](c2ccc3c(c2)CCCC3)c2cccs2)cc1OC 514317320 URPWYXAFOVPNKC-XMMPIXPASA-N 466.559 5.462 5 20 JKBD Cc1ccc(-c2csc(NC(=O)c3ccc(Br)cc3Cl)n2)cc1[N+](=O)[O-] 515602544 ICUYKSWYWFWKDH-UHFFFAOYSA-N 452.717 5.695 5 20 JKBD O=C(CCNc1ccc(C(F)(F)F)cc1[N+](=O)[O-])N(Cc1cscn1)c1ccccc1 517484789 MFXUPMSZMWVZFR-UHFFFAOYSA-N 450.442 5.106 5 20 JKBD O=C1CCCN1Cc1cccc(CNCc2ccc(-c3ccc([N+](=O)[O-])cc3Br)o2)c1 518287066 XZBUUIDMKUTWPH-UHFFFAOYSA-N 484.350 5.030 5 20 JKBD Cc1cc(C(=O)N2CCC[C@@H](C)C2)ccc1NC(=O)c1ccc(NCc2ccccc2)c([N+](=O)[O-])c1 520558907 WXZYVNXKXUITBQ-LJQANCHMSA-N 486.572 5.640 5 20 JKBD COC(=O)CC1CCN(C(=O)c2c3c(nc4ccccc24)/C(=C/c2ccc([N+](=O)[O-])cc2)CCC3)CC1 568375194 XSHULLYJLWFQBT-HEHNFIMWSA-N 499.567 5.435 5 20 JKBD COCCN(C(=O)Cc1coc2c(C)c(C)ccc12)c1nc(-c2ccc([N+](=O)[O-])cc2)cs1 603461029 HKVMEEHTVCULGR-UHFFFAOYSA-N 465.531 5.303 5 20 JKBD Cc1csc(Sc2ccc(C(=O)NCc3cc(-c4ccccc4)no3)cc2[N+](=O)[O-])n1 603890062 NKIOGUBXBJLLNF-UHFFFAOYSA-N 452.517 5.096 5 20 JKBD CCOc1ccc(-c2nc(COC(=O)c3cc([N+](=O)[O-])ccc3Br)cs2)cc1OC 725986195 RWICNVJZJAKYAC-UHFFFAOYSA-N 493.335 5.245 5 20 JKBD COC1CCN(c2ccc(NC(=O)c3cc(Cl)ccc3[N+](=O)[O-])cc2C(F)(F)F)CC1 728013000 QIDLBNWSYZKNLI-UHFFFAOYSA-N 457.836 5.135 5 20 JKBD O=[N+]([O-])c1ccc(-c2ccc(CNC[C@@H](O)c3cccc(C(F)(F)F)c3)o2)c(Br)c1 730817395 RPFMDMVASXYFNY-GOSISDBHSA-N 485.256 5.459 5 20 JKBD CCOc1cc(Br)c(NC(=O)c2cc([N+](=O)[O-])ccc2Br)cc1OCC 751108576 REFJUXBUQVIRPX-UHFFFAOYSA-N 488.132 5.170 5 20 JKBD C[C@H](OC(=O)c1occc1CSc1ccccc1)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl 792737892 ZKHXHYRSGKSEEL-ZDUSSCGKSA-N 460.895 5.318 5 20 JKBD O=C1CC[C@H](c2noc(-c3ccc(Oc4ccc(Cl)cc4[N+](=O)[O-])cc3)n2)CN1CC1CCCC1 856582820 WCQZLQZKYDCCPH-SFHVURJKSA-N 496.951 5.987 5 20 JKBD Cc1ccc(NC(=O)CSc2ccccc2C(=O)Nc2cc([N+](=O)[O-])c(F)cc2F)cc1 897470659 ASYJJFLMZPYTEW-UHFFFAOYSA-N 457.458 5.165 5 20 JKBD Cc1ccc([N+](=O)[O-])c(OCCC(=O)O[C@H](C)c2nc(-c3cccc(C(F)(F)F)c3)no2)c1 915439922 IWIWOZRGJLGJGB-CYBMUJFWSA-N 465.384 5.045 5 20 JKBD O=C(Nc1cccc(CN2CCOC2=O)c1)c1ccc(NCc2ccccc2Cl)c([N+](=O)[O-])c1 916078281 USQUEGHTSOPRLY-UHFFFAOYSA-N 480.908 5.065 5 20 JKBD COc1ccc(N[C@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2)cc1NC(=O)c1ccc(Cl)cc1F 917937119 CURCBABUGJOMQL-CYBMUJFWSA-N 486.887 5.087 5 20 JKBD CC(C)NC(=O)c1ccc(Cl)cc1NC(=O)c1ccc(N[C@@H](C)c2ccccn2)c([N+](=O)[O-])c1 919845979 IULVDCREBXTFLQ-HNNXBMFYSA-N 481.940 5.207 5 20 JKBD O=C(Nc1ccccc1C(=O)N[C@H]1CCc2c(Cl)cccc21)c1ccc([N+](=O)[O-])cc1Cl 919873365 OTWVKNVDXQJVGP-NRFANRHFSA-N 470.312 5.571 5 20 JKBD O=C(Nc1cc(Cl)c([N+](=O)[O-])cc1OCc1ccccc1)c1csc(-c2ccccn2)n1 921001063 NUPGSROYMGPHML-UHFFFAOYSA-N 466.906 5.598 5 20 JKBD O=C(/C=C/c1ccc([N+](=O)[O-])o1)NC1(c2ccc(NC(=O)[C@H](F)c3ccccc3)cc2)CCC1 1786609880 LWFAHGBVJHUDKS-ABSORMQESA-N 463.465 5.046 5 20 JKBD COc1cc(CC(=O)NC2(c3ccc(NC(=O)CCCC(F)(F)F)cc3)CCC2)ccc1[N+](=O)[O-] 1786621618 MEVOXMPCEZLEEF-UHFFFAOYSA-N 493.482 5.013 5 20 JKBD Cc1oncc1C(=O)Nc1ccc(C2(NC(=O)c3cc4cc([N+](=O)[O-])ccc4s3)CCC2)cc1 1787450822 RSKMYKGGDNXGEF-UHFFFAOYSA-N 476.514 5.167 5 20 JKBD O=C(NC1(c2ccc(NC(=O)c3cc([N+](=O)[O-])cc4c3OCC4)cc2)CCC1)c1ccc2ccoc2c1 1790045123 HBRSZMQIXHGUIZ-UHFFFAOYSA-N 497.507 5.337 5 20 JKBD Cc1c(C(=O)Nc2ccc(C3(NC(=O)[C@@H]4C[C@]4(F)Cl)CCC3)cc2)cc(Cl)cc1[N+](=O)[O-] 1790774751 QSYPQSXLMJKBQU-HTAPYJJXSA-N 480.323 5.229 5 20 JKBD COc1cc(C(=O)Nc2ccc(C3(NC(=O)c4cc5sccc5[nH]4)CCC3)cc2)ccc1[N+](=O)[O-] 1792165551 LNZWJIPZVPMMSL-UHFFFAOYSA-N 490.541 5.208 5 20 JKBD COc1cc(C(=O)Nc2ccc(C3(NC(=O)c4cccc5cnccc45)CCC3)cc2)ccc1[N+](=O)[O-] 1792165866 SAFKGKDTKAVFLU-UHFFFAOYSA-N 496.523 5.213 5 20 JKBD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(Oc2ccccc2)cc1)c1cc(F)cc([N+](=O)[O-])c1 1800348256 BUXRWAJMTUTVNN-KOUNCHBCSA-N 489.503 5.092 5 20 JKBD Cc1cc2[nH]c(C(=O)N3[C@H]4CC[C@@H]3C[C@H](NC(=O)c3cc5cc([N+](=O)[O-])ccc5s3)C4)cc2s1 1800960521 YNDCUYJCNBLCKS-MUJYYYPQSA-N 494.598 5.226 5 20 JKBD C[C@@H](C(=O)N1CCCC[C@@H]1c1cc(NC(=O)Cc2ccc(Cl)cc2[N+](=O)[O-])n[nH]1)c1ccccc1 1814846353 OHWQKCKRQXVCBO-IIBYNOLFSA-N 495.967 5.010 5 20 JKBD O=C(/C=C/c1ccco1)Nc1cc([C@H]2CCCCN2C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)[nH]n1 1815950000 BAHDZKWHEDRSEE-QRBZPYHOSA-N 491.529 5.145 5 20 JKBD CC(C)(C)c1ccc(C(=O)N2CCC([C@H]3CCCCN3C(=O)c3ccc([N+](=O)[O-])o3)CC2)s1 1823613047 YLHOWQMMJFMJOK-QGZVFWFLSA-N 473.595 5.094 5 20 JKBD CC[C@H](C)[C@@H](C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2ccc([N+](=O)[O-])o2)CC1)c1ccccc1 1826419309 REXAOGKRZLYJJQ-UWUFEASWSA-N 481.593 5.251 5 20 JKBD O=C(CCc1cccc([N+](=O)[O-])c1)N1CCC([C@H]2CCCCN2C(=O)c2cc3[nH]ccc3s2)CC1 1828332415 SMLKHTRFZLTAFG-JOCHJYFZSA-N 494.617 5.004 5 20 JKBD CC(C)CCC(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cccc([N+](=O)[O-])c2Br)CC1 1830516785 IOBIAQHKQPMGCL-IBGZPJMESA-N 494.430 5.027 5 20 JKBD O=C(c1cccc2cc[nH]c12)N1CCC([C@@H]2CCCCN2C(=O)/C=C/c2ccccc2[N+](=O)[O-])CC1 1832907163 NPTQUXNCTRXRJU-LCJITAHGSA-N 486.572 5.023 5 20 JKBD CCn1c(S[C@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)nnc1-c1cccc(Cl)c1 9821211 QADMWKKCSHHIMO-LLVKDONJSA-N 466.350 5.299 5 20 JKBD Cc1cc(/C=C/C(=O)O[C@@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)c(C)n1C1CCCCC1 17892673 XGBKBBHMLJPASD-BJRSVTDJSA-N 464.522 5.886 5 20 JKBD C[C@H](OC(=O)c1ccc2c(c1)C[C@H](c1ccccc1)OC2=O)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 17899405 TWPWDMLZHMUXBK-OYHNWAKOSA-N 485.452 5.017 5 20 JKBD Cn1ccnc1[C@H](NC(=O)c1ccc(NCc2ccccc2Cl)c([N+](=O)[O-])c1)c1cccc(F)c1 24015990 PQVGYYNMDUMXKQ-HSZRJFAPSA-N 493.926 5.252 5 20 JKBD O=C(Nc1cccc(OC[C@@H]2CCCO2)c1)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 45328437 ORDZIFLASYZEMZ-FQEVSTJZSA-N 493.482 5.027 5 20 JKBD COc1ccc(CSCC(=O)NCc2cn(-c3ccccc3)nc2-c2ccccc2)cc1[N+](=O)[O-] 105976843 CFXHFMFWLAFJJZ-UHFFFAOYSA-N 488.569 5.006 5 20 JKBD Cc1nn(C)c2sc(C(=O)O[C@@H](C(=O)Nc3ccc(Cl)c([N+](=O)[O-])c3)c3ccccc3)cc12 106923711 FCUROMUIYIGOFW-LJQANCHMSA-N 484.921 5.042 5 20 JKBD Cc1cc(CNC(=O)c2c3c(nc4ccccc24)/C(=C\c2ccc([N+](=O)[O-])cc2)CCC3)on1 496613864 WTFWEVLORIBAEK-JXAWBTAJSA-N 454.486 5.246 5 20 JKBD O=C(C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)NCc1cccc(OC(F)F)c1 497017956 NYUNYMVCXKSFSS-LDADJPATSA-N 495.507 6.053 5 20 JKBD O=C(Nc1nnc(SCc2cccs2)s1)c1csc(-c2ccc([N+](=O)[O-])cc2)n1 497571624 RBMBASUHASMLMU-UHFFFAOYSA-N 461.575 5.176 5 20 JKBD Cc1nn(Cc2ccc(C(=O)Nc3ccccc3COCc3ccccc3)cc2)c(C)c1[N+](=O)[O-] 500020030 PFOHYMFHHJYDTM-UHFFFAOYSA-N 470.529 5.426 5 20 JKBD CCn1c(S[C@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2C(F)(F)F)nnc1-c1cccc(C)c1 515302409 VSDGOOYDCMDVID-CYBMUJFWSA-N 479.484 5.320 5 20 JKBD CCOc1ccc(C(F)(F)F)cc1NC(=O)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-] 516780873 VRDWWVAJKGBJDC-UHFFFAOYSA-N 452.307 5.206 5 20 JKBD C[C@H]1C[C@@H](C)CN(c2ccc(C(=O)Nc3cc4c(cc3Cl)OCCCO4)cc2[N+](=O)[O-])C1 518124639 VWXRHXORAQAHJO-GASCZTMLSA-N 459.930 5.144 5 20 JKBD O=C(c1ccc(NCc2ccccc2Cl)c([N+](=O)[O-])c1)N(Cc1ccncc1)C[C@@H]1CCCO1 521272164 YMQGDCGWKUPOOV-NRFANRHFSA-N 480.952 5.077 5 20 JKBD CC[C@@H](NC(=O)c1ccccc1Sc1ccc(C(F)(F)F)cc1[N+](=O)[O-])c1nc(C)cs1 521490536 UGPKNIBSMYZQBY-OAHLLOKOSA-N 481.521 6.411 5 20 JKBD CSc1ccc(C(=O)Nc2nc(C)c(-c3nc4ccccc4n3C(F)F)s2)cc1[N+](=O)[O-] 521788885 VSBLGOBYZXKUTE-UHFFFAOYSA-N 475.502 5.746 5 20 JKBD Cc1ccc(-c2ccncc2)cc1NC(=O)c1ccc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)cc1 522388743 VEOXJARFWYGCKZ-UHFFFAOYSA-N 488.525 5.018 5 20 JKBD O=C(Cn1c2ccccc2c(=O)c2ccccc21)Nc1ccc(C(=O)Nc2cccnc2)c(Cl)c1 588829091 RLPDLTIFFYIKAY-UHFFFAOYSA-N 482.927 5.094 5 20 JKBD COc1cc2c(cc1OC)[C@H](c1cccs1)N(C(=O)Nc1ccc(C)c([N+](=O)[O-])c1)CC2 603643415 HRCFYDZYIBJULU-JOCHJYFZSA-N 453.520 5.162 5 20 JKBD C[C@H](Nc1ccc(C(=O)Nc2ncc(Cc3cc(F)cc(F)c3)s2)cc1[N+](=O)[O-])c1ccccn1 604308269 ZAIJFBNARPCXKR-AWEZNQCLSA-N 495.511 5.741 5 20 JKBD Cc1nn(Cc2ccc(C(=O)Nc3cc(Cl)ccc3N3CCCCC3)cc2)c(C)c1[N+](=O)[O-] 604469060 UINCNSFQHPRVOO-UHFFFAOYSA-N 467.957 5.352 5 20 JKBD CCOc1cc(C(=O)Nc2ccc(OCc3cccc(F)c3)cc2C)c([N+](=O)[O-])cc1OC 609064775 OFOYEGFOGBKHOD-UHFFFAOYSA-N 454.454 5.281 5 20 JKBD C[C@@H](c1nnc(SCc2nc3ccccc3c3ccccc23)n1-c1ccc(F)cc1)N(C)C 620677417 ZXEXTQWUVULBSI-KRWDZBQOSA-N 457.578 6.023 5 20 JKBD CC(C)(C)OC(=O)Nc1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2Sc2ccccc2)cn1 727339381 AYGVWNUYILYYLT-UHFFFAOYSA-N 466.519 5.740 5 20 JKBD Cc1cccc2[nH]cc(CC(=O)O[C@@H](C(=O)Nc3ccc([N+](=O)[O-])cc3Cl)c3ccccc3)c12 729011045 CGNZQGUSZLUURY-XMMPIXPASA-N 477.904 5.504 5 20 JKBD O=C(Oc1ccc(-c2noc([C@@H]3CCCO3)n2)cc1)c1ccc(NCc2ccccc2)c([N+](=O)[O-])c1 729110739 FMQHVTDZFSBQNR-QHCPKHFHSA-N 486.484 5.328 5 20 JKBD O=C(OCC(=O)N(Cc1ccc(F)cc1)c1nc(-c2ccccc2)cs1)c1ccccc1[N+](=O)[O-] 747775032 SMVKNJYCGMPZQU-UHFFFAOYSA-N 491.500 5.248 5 20 JKBD C[C@@H](Sc1nc2cc(C(F)(F)F)ccc2s1)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 753854986 UHWAOPMPTPVIGD-MRVPVSSYSA-N 495.426 6.361 5 20 JKBD CC1=C(C(=O)Nc2ccc(C)cc2C)[C@H](c2ccc(-c3ccc([N+](=O)[O-])cc3)s2)NC(=S)N1 818329408 WUVKXPSZVZAWDW-QFIPXVFZSA-N 478.599 5.372 5 20 JKBD O=C(c1ccc(Cl)cc1[N+](=O)[O-])N1CCC(C(O)(c2ccccc2)c2ccccc2)CC1 856853962 ZHGYLPFXJLNMRV-UHFFFAOYSA-N 450.922 5.037 5 20 JKBD CCOc1ccc(-c2nc(C)c(C(=O)O[C@@H](C)C(=O)Nc3cc([N+](=O)[O-])ccc3Cl)s2)cc1 914909742 KMGHQLANUKMTTQ-ZDUSSCGKSA-N 489.937 5.263 5 20 JKBD C[C@H](OC(=O)c1nc(-c2ccccc2)n2c1CCCCC2)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl 914915881 FWQJLPPHZNTUFJ-HNNXBMFYSA-N 482.924 5.022 5 20 JKBD CCOc1cc(N[C@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2ccccc2)ccc1OC 917937761 IUPSUSGESCSTEQ-QFIPXVFZSA-N 455.898 5.447 5 20 JKBD COc1ccc(NC(=O)[C@@H](OC(=O)c2cc([N+](=O)[O-])cc([N+](=O)[O-])c2C)c2ccccc2)cc1Cl 919226125 ZRLWKAMMZYUQCS-NRFANRHFSA-N 499.863 5.010 5 20 JKBD CC(C)[C@@H](OC(=O)c1ccc(N[C@@H](C)c2ccccn2)c([N+](=O)[O-])c1)C(=O)Nc1ccccc1F 920545611 UHMJLODPTRNTKR-QMHKHESXSA-N 480.496 5.122 5 20 JKBD C[C@@H](OC(=O)c1cn(C)nc1-c1ccc([N+](=O)[O-])cc1)C(=O)Nc1c(Cl)cc(Cl)cc1Cl 920551130 UQPSZVSAXRFIJX-SNVBAGLBSA-N 497.722 5.140 5 20 JKBD Cc1ccc(SCC(=O)NC2(c3ccc(NC(=O)c4ccc([N+](=O)[O-])o4)cc3)CCC2)cc1 1785750828 VBPXMHZIGXNADY-UHFFFAOYSA-N 465.531 5.036 5 20 JKBD CC(F)(F)C(C)(C)C(=O)Nc1ccc(C2(NC(=O)/C=C/c3ccc([N+](=O)[O-])o3)CCC2)cc1 1786450688 OLRROECBNVNUCP-PKNBQFBNSA-N 461.465 5.017 5 20 JKBD COc1ccc(CC(=O)NC2(c3ccc(NC(=O)[C@@H]4CC=C(C)CC4)cc3)CCC2)c([N+](=O)[O-])c1 1789115195 PGBQFJSBTGVXNA-LJQANCHMSA-N 477.561 5.026 5 20 JKBD Cc1ccc(CC(=O)Nc2ccc(C3(NC(=O)[C@@H](C)Nc4ccccc4)CCC3)cc2)cc1[N+](=O)[O-] 1790523915 BBJXRHCYWRHDHG-HXUWFJFHSA-N 486.572 5.080 5 20 JKBD COc1ccc(CC(=O)NC2(c3ccc(NC(=O)[C@H]4C[C@H]4c4ccccc4)cc3)CCC2)c([N+](=O)[O-])c1 1791534696 VFZQBFIXAKIKSO-DQEYMECFSA-N 499.567 5.084 5 20 JKBD CC(C)/C=C/C(=O)Nc1ccc(C2(NC(=O)CSc3ccccc3[N+](=O)[O-])CCC2)cc1 1792060935 JGZMFVGEAQLNDQ-MDWZMJQESA-N 453.564 5.033 5 20 JKBD CC(C)(C)CCCCCC(=O)N1CC[C@H](CNC(=O)c2ccc([N+](=O)[O-])cc2F)[C@@H]1c1cccnc1 1810745937 JEOUGPCMKVXYPP-NLFFAJNJSA-N 498.599 5.445 5 20 JKBD Cc1c(C(=O)N2CCCC[C@H]2c2cc(NC(=O)/C=C/c3ccsc3)n[nH]2)cc(Cl)cc1[N+](=O)[O-] 1815984046 OFNBFGAUAZODMB-UEKDZROGSA-N 499.980 5.361 5 20 JKBD CC(C)c1ccc(CC(=O)N2CCCC[C@@H]2C2CCN(C(=O)/C=C/c3ccc([N+](=O)[O-])o3)CC2)cc1 1831595085 YBHMMHKUIAQTLK-MYHFBWBUSA-N 493.604 5.187 5 20 JKBD CC[C@H]1CC[C@H](C(=O)N2CCCC[C@H]2C2CCN(C(=O)c3cccc(F)c3[N+](=O)[O-])CC2)CC1 1831696238 MLXHHHNLEOYLSN-LEDOBFOHSA-N 473.589 5.184 5 20 JKBD CCn1c(S[C@@H](C)C(=O)Nc2cc([N+](=O)[O-])ccc2Cl)nnc1-c1ccc(Cl)cc1 9071423 VXDOBXXMRVBXMH-NSHDSACASA-N 466.350 5.299 5 20 JKBD CC(C)n1c(S[C@H](C)C(=O)Nc2ccccc2[N+](=O)[O-])nnc1-c1ccc(Cl)cc1Cl 9826580 OGEMINAAYFXUPX-GFCCVEGCSA-N 480.377 5.860 5 20 JKBD COCCN(C(=O)c1ccc(-c2ccccc2Cl)o1)c1nc(-c2ccc([N+](=O)[O-])cc2)cs1 19628669 VHYXFOCYSCCYQV-UHFFFAOYSA-N 483.933 5.925 5 20 JKBD C[C@@H](N[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Br)c1ccccc1)c1ccc2c(c1)OCO2 30500875 ZLGHDGIKWHTPBB-PEBXRYMYSA-N 498.333 5.117 5 20 JKBD CCn1c(S[C@@H](C(=O)Nc2ccc(C)cc2[N+](=O)[O-])c2ccccc2)nnc1-c1ccncc1 31641756 JIRWGKMJFRUYOL-OAQYLSRUSA-N 474.546 5.049 5 20 JKBD CCOc1ccc([C@H](C)NC(=O)C2CCN(c3ccc(C(F)(F)F)cc3[N+](=O)[O-])CC2)cc1OC 46623795 DUGCXNWPCDXOBL-HNNXBMFYSA-N 495.498 5.115 5 20 JKBD CC(C)n1c(Sc2ccc(S(C)(=O)=O)cc2[N+](=O)[O-])nnc1-c1ccc(Cl)cc1Cl 71814755 YKAQUEUCEWGATG-UHFFFAOYSA-N 487.390 5.296 5 20 JKBD C[C@H]1CCCN(c2ccc(C(=O)N(C)CCCc3cc(-c4ccc(F)cc4)n[nH]3)cc2[N+](=O)[O-])C1 117226690 RHWBJGZPAQDQOD-SFHVURJKSA-N 479.556 5.065 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)Nc2ncc(Cc3cccc(C(F)(F)F)c3)s2)cc1SC 303141313 CXQRRYWFIDTDDY-UHFFFAOYSA-N 483.493 5.644 5 20 JKBD O=C(C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)N[C@@H]1CCCc2occc21 493325723 YZPZHUCPNSGKBJ-NMIWIPSGSA-N 459.527 5.922 5 20 JKBD Cn1cnnc1Sc1ccc(NC(=O)c2ccc(NCc3ccccc3Cl)c([N+](=O)[O-])c2)cc1 494710979 YVCBVOHZAPGOQI-UHFFFAOYSA-N 494.964 5.392 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)N[C@@H](C)c2sc(-c3ccc(C)cc3)nc2C)cc1SC 502485997 PVWCRAYHXPKBAF-ZDUSSCGKSA-N 457.577 5.557 5 20 JKBD CN(C[C@@H]1OCCc2ccccc21)C(=O)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1 506255966 VGIBVOINKQXMMJ-QHCPKHFHSA-N 452.894 5.427 5 20 JKBD C[C@H](COc1ccccc1C(F)(F)F)NC(=O)c1ccc(N[C@H](C)c2ccccn2)c([N+](=O)[O-])c1 507980567 SKJOOEQDMLPVMR-HZPDHXFCSA-N 488.466 5.379 5 20 JKBD CCCOc1ccc(Cl)cc1NC(=O)c1ccc(N[C@@H](C)c2ccccn2)c([N+](=O)[O-])c1 512565371 NPECTAIFGDUBKB-HNNXBMFYSA-N 454.914 5.857 5 20 JKBD CC(=O)Nc1cc(NC(=O)c2ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])cc2)ccc1Cl 516829203 BDJBWCAGBMRBQE-UHFFFAOYSA-N 460.273 5.905 5 20 JKBD C[C@@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)NCc1cccc(COCc2ccccc2)c1 520387929 VRNPCDFRFSHLRY-QGZVFWFLSA-N 454.910 5.049 5 20 JKBD CCOc1ccc(NC(=O)c2ccc(N[C@@H](C)c3ccccn3)c([N+](=O)[O-])c2)c(C(F)(F)F)c1 520401001 DIKWRDSLCPZSFX-AWEZNQCLSA-N 474.439 5.833 5 20 JKBD O=C(C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)NCc1cccc2cccnc12 521740769 GUPYKZHFICTZHZ-RCCKNPSSSA-N 480.549 6.000 5 20 JKBD Cc1ccc2nc([C@@H]3CCCN3C(=O)c3ccc(N[C@@H](C)c4ccccn4)c([N+](=O)[O-])c3)[nH]c2c1 522040627 MCRUFBRDZKKXJK-SBUREZEXSA-N 470.533 5.325 5 20 JKBD Cc1cccc(NC(=O)N2CCN(C(=O)c3ccc(Oc4ccc(Cl)cc4[N+](=O)[O-])cc3)CC2)c1 524215934 RUFGJVUTKSBIFE-UHFFFAOYSA-N 494.935 5.339 5 20 JKBD O=C(Nc1ccc(NC(=O)C2CC2)cc1C(F)(F)F)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-] 603734650 FNAOSIYYJWGHRB-UHFFFAOYSA-N 491.344 5.156 5 20 JKBD O=C(Nc1cccc(/C=C2/CCn3c2nc2ccc([N+](=O)[O-])cc2c3=O)c1)c1ccc(Cl)cc1 603781436 WSTDNIJMPIAWJB-ATVHPVEESA-N 472.888 5.155 5 20 JKBD Cc1nc(NC(=O)c2cc(OCC(F)(F)F)ccc2[N+](=O)[O-])sc1Cc1ccccc1Cl 603974985 WTALECIJGKJRGR-UHFFFAOYSA-N 485.871 5.797 5 20 JKBD CCCOc1ccc(Oc2ncccc2CNC(=O)N[C@H](C)c2cccc([N+](=O)[O-])c2)cc1 604127170 DLWNMRRNTPDSGO-QGZVFWFLSA-N 450.495 5.131 5 20 JKBD CN(c1ccccc1)c1ccc(CNCc2cccc(OCc3ccccn3)c2)cc1[N+](=O)[O-] 608781961 OKMQTPBJSHSAHM-UHFFFAOYSA-N 454.530 5.627 5 20 JKBD COc1ccc(CNC(=O)c2ccc(N[C@H](C)c3ccccn3)c([N+](=O)[O-])c2)c(C(F)(F)F)c1 608807531 OLVIWLFSDGKHRK-CQSZACIVSA-N 474.439 5.120 5 20 JKBD C[C@@H](CC(=O)Nc1cccc(N2CCCC2)c1)NCc1ccc(-c2ccccc2[N+](=O)[O-])s1 608837261 QNDMHUBYNPJJAN-SFHVURJKSA-N 464.591 5.430 5 20 JKBD C[C@H]1C[C@H](C)CN(c2ccc(C(=O)Nc3cc(C(=O)N4CCCCC4)ccc3Cl)cc2[N+](=O)[O-])C1 608872499 HALBCNRETMEOCE-ROUUACIJSA-N 499.011 5.609 5 20 JKBD COc1cc(C(=O)Nc2cc(-c3ccccc3C)nn2Cc2ccccc2)c([N+](=O)[O-])cc1OC 608944047 ZZVUILAFGOIRTH-UHFFFAOYSA-N 472.501 5.085 5 20 JKBD CC(C)N(Cc1nnc(-c2cccc([N+](=O)[O-])c2)o1)C(=S)NCCc1ccc(Cl)cc1Cl 726450154 SJUQEKVQMJNPHU-UHFFFAOYSA-N 494.404 5.279 5 20 JKBD CC(C)(C)OC(=O)N1CCc2cc(NC(=O)c3csc(-c4ccc([N+](=O)[O-])cc4)n3)ccc21 726509672 SMQBAYQJNJDJOH-UHFFFAOYSA-N 466.519 5.268 5 20 JKBD Cc1ccccc1C1(CNC(=O)c2ccccc2NC(=O)c2ccc([N+](=O)[O-])cc2Cl)CC1 726564891 VGQXCCUUABMSMY-UHFFFAOYSA-N 463.921 5.271 5 20 JKBD Cc1ccc(/C(O)=C(/C(=S)NCCc2ccc(Cl)cc2Cl)[n+]2ccccc2)cc1[N+](=O)[O-] 726573358 YECUKUSRTDRXCW-UHFFFAOYSA-O 489.404 5.541 5 20 JKBD C[C@@H](NCc1ccc(-c2ccccc2[N+](=O)[O-])s1)C(=O)Nc1cccc(N2CCCC2)c1 726605968 NJEDEWOVGAXPAE-QGZVFWFLSA-N 450.564 5.040 5 20 JKBD CN(CC1CCN(C(=O)c2cc([N+](=O)[O-])ccc2Oc2ccccc2)CC1)C(=O)OC(C)(C)C 728894301 DAYXFVABAFWIQJ-UHFFFAOYSA-N 469.538 5.106 5 20 JKBD Cc1onc(-c2ccccc2)c1-c1nnc(COC(=O)c2csc(-c3cccc([N+](=O)[O-])c3)n2)o1 747962217 MZJQNELZNOJKOT-UHFFFAOYSA-N 489.469 5.089 5 20 JKBD CC(=O)N(c1nc(COC(=O)c2c[nH]c3ccc([N+](=O)[O-])cc23)cs1)c1ccc(C)cc1C 749315766 TYXAHPDGFNFKAO-UHFFFAOYSA-N 464.503 5.191 5 20 JKBD O=[N+]([O-])c1ccc2c(c1)n(CN1CCC[C@H]1c1ncon1)c(=S)n2-c1cccc(C(F)(F)F)c1 750020231 XTSGBACRHSVSGV-KRWDZBQOSA-N 490.467 5.266 5 20 JKBD CCN(Cc1ccccc1)C(=O)[C@@H](C)OC(=O)c1ccccc1C(=O)c1ccc(Cl)c([N+](=O)[O-])c1 790606618 JNMJPHNMHRMZTD-QGZVFWFLSA-N 494.931 5.073 5 20 JKBD Cc1cc(C)n(-c2ccc(NC(=O)C3CCN(c4ccc(C(F)(F)F)cc4[N+](=O)[O-])CC3)cc2)n1 905444942 TXKFGMHGTASHLL-UHFFFAOYSA-N 487.482 5.271 5 20 JKBD CCC(CC)c1cc[n+](/C(C(=S)Nc2ccc(Cl)cc2)=C(/O)c2cccc([N+](=O)[O-])c2)cc1 916204080 HBADAFFNJBRZNO-UHFFFAOYSA-O 483.013 6.763 5 20 JKBD COC(=O)/C=C\c1ccc(Sc2nnc(-c3c[nH]c4ccccc34)n2C2CC2)c([N+](=O)[O-])c1 931439221 MTSWQKFBDZMSOH-XFFZJAGNSA-N 461.503 5.007 5 20 JKBD O=C(Cc1ccc2ncccc2c1)Nc1ccc(C2(NC(=O)Cc3cccc([N+](=O)[O-])c3)CCC2)cc1 1786557001 PRTUPWAGOPDSDC-UHFFFAOYSA-N 494.551 5.062 5 20 JKBD O=C(/C=C/c1ccc([N+](=O)[O-])o1)NC1(c2ccc(NC(=O)c3cc4ccccc4o3)cc2)CCC1 1789004121 WBVLCEIHLYWUBQ-ZRDIBKRKSA-N 471.469 5.395 5 20 JKBD O=C(CC[C@@H]1CCOC1)NC1(c2ccc(NC(=O)c3cc4cc([N+](=O)[O-])ccc4s3)cc2)CCC1 1791010009 HGUANVPYZGMYNH-QGZVFWFLSA-N 493.585 5.374 5 20 JKBD COc1cc(C(=O)NC2(c3ccc(NC(=O)[C@H]4C[C@@H]4c4ccccc4)cc3)CCC2)ccc1[N+](=O)[O-] 1791531607 HVWJIZLKWZKAAT-PKTZIBPZSA-N 485.540 5.155 5 20 JKBD Cc1cnc(Cl)c(C(=O)NC2(c3ccc(NC(=O)Cc4cc(F)ccc4[N+](=O)[O-])cc3)CCC2)c1 1792308299 KPNKJEDDOJLWHD-UHFFFAOYSA-N 496.926 5.081 5 20 JKBD CC1(C)CCC(CC(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)C2(c4cccc([N+](=O)[O-])c4)CCC2)C3)CC1 1800234589 YMAAJOPFBHDFMB-NUNAXRQHSA-N 481.637 5.261 5 20 JKBD C[C@H](CC(=O)N1CCC2(CCCN(C(=O)Cc3ccc(Cl)cc3[N+](=O)[O-])C2)CC1)c1ccccc1 1805484809 JEEWVUYYPQCLHX-HXUWFJFHSA-N 498.023 5.216 5 20 JKBD CC[C@@H](C)[C@H](C(=O)N1CCC2(CCCN(C(=O)/C=C/c3ccc([N+](=O)[O-])o3)C2)CC1)c1ccccc1 1805681934 BGVJKVTUZKMEAV-FOVHPINOSA-N 493.604 5.262 5 20 JKBD O=C(Nc1cc([C@H]2CCCCN2C(=O)c2cc3sccc3s2)[nH]n1)c1cc(F)cc([N+](=O)[O-])c1 1821166191 NLWXHYPBZRFGQW-MRXNPFEDSA-N 499.549 5.353 5 20 JKBD O=C(c1cc(Cl)sc1Cl)N1CCC([C@@H]2CCCCN2C(=O)c2ccc([N+](=O)[O-])o2)CC1 1823613978 OVUMKCJDIXOWGG-AWEZNQCLSA-N 486.377 5.103 5 20 JKBD CC(C)[C@@H](C(=O)N1CCC([C@@H]2CCCCN2C(=O)Cc2cccc([N+](=O)[O-])c2)CC1)c1ccccc1 1823677288 SUJGFXBBAHFPLN-XTEPFMGCSA-N 491.632 5.197 5 20 JKBD O=C(c1cccc2c1CCCC2)N1CCC([C@H]2CCCCN2C(=O)/C=C/c2ccc([N+](=O)[O-])o2)CC1 1824278270 CVWJMYFAIMCNPS-CVJKAFSHSA-N 491.588 5.013 5 20 JKBD O=C(c1cc(F)cc([N+](=O)[O-])c1)N1CCC([C@H]2CCCCN2C(=O)c2cc3ccoc3s2)CC1 1827413026 DLFVRYKBMMBODC-HXUWFJFHSA-N 485.537 5.089 5 20 JKBD CC(C)(C)CC(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cccc([N+](=O)[O-])c2Br)CC1 1830516471 CXAZUTNAAORQFW-SFHVURJKSA-N 494.430 5.027 5 20 JKBD O=C(/C=C/c1ccccc1[N+](=O)[O-])N1CCC([C@H]2CCCCN2C(=O)c2cccc3ccoc23)CC1 1830992141 JPUCKIHZFCRADB-UWHSVAFCSA-N 487.556 5.288 5 20 JKBD C[C@@H](OC(=O)C1c2ccccc2Oc2ccccc21)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl 10797895 WZRJYOFYDUQHGZ-CYBMUJFWSA-N 452.850 5.056 5 20 JKBD Cc1ccc(NC(=O)[C@@H](Sc2nnc(NCc3ccco3)s2)c2ccccc2)c([N+](=O)[O-])c1 11541387 KFLJYZFOPPWVJV-IBGZPJMESA-N 481.559 5.432 5 20 JKBD COc1cc(C2SCCS2)ccc1OC(=O)Cn1c2ccccc2c(=O)c2ccccc21 14729744 AEEBDPDQXKZNPZ-UHFFFAOYSA-N 463.580 5.248 5 20 JKBD O=[N+]([O-])c1cc(C(F)(F)F)ccc1Sc1nnc(-c2cccs2)n1C[C@@H]1CCCO1 15130877 MLXIKKJVRGXKPZ-LBPRGKRZSA-N 456.471 5.264 5 20 JKBD CC(=O)Nc1cccc(NC(=O)c2ccc(Sc3nc4ccccc4s3)c([N+](=O)[O-])c2)c1 15421408 KTGLNWSHTAYLFT-UHFFFAOYSA-N 464.528 5.566 5 20 JKBD O=C(Oc1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2Cl)cc1)c1csc(-c2cccs2)n1 15516107 JSJQCZPCKULWRW-UHFFFAOYSA-N 485.930 5.905 5 20 JKBD COc1ccc([N+](=O)[O-])cc1NC(=O)[C@H](C)Sc1nnc(-c2ccc(F)cc2)c2ccccc12 20854407 VMSBVQIWLJOFML-AWEZNQCLSA-N 478.505 5.472 5 20 JKBD Cc1ccc(NC(=O)[C@@H](OC(=O)CSc2nc3ccccc3o2)c2ccccc2)c([N+](=O)[O-])c1 21138446 YZXVMDIBOYJSDY-QFIPXVFZSA-N 477.498 5.060 5 20 JKBD CC(C)CC(=O)Nc1ccc(N[C@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2ccccc2)cc1 25495050 BVWZZPIWNTXPCE-DEOSSOPVSA-N 480.952 6.025 5 20 JKBD CN(C)[C@@H](CNC(=O)C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)c1ccsc1 25816039 HQMKIXVDGIDQQX-QUYTYNJFSA-N 492.626 5.616 5 20 JKBD O=C(CCSc1nnc(-c2ccc(Cl)cc2)n1Cc1ccco1)Nc1ccccc1[N+](=O)[O-] 26369741 HQBCGHUIXVMQDK-UHFFFAOYSA-N 483.937 5.269 5 20 JKBD Cc1cc([N+](=O)[O-])ccc1NC(=O)CCSc1nnc(-c2ccoc2C)n1-c1ccccc1 26372148 BZCFMIFEHRIAAR-UHFFFAOYSA-N 463.519 5.173 5 20 JKBD Cn1ccnc1[C@@H](NC(=O)c1ccc(NCc2ccccc2Cl)c([N+](=O)[O-])c1)c1ccccc1F 29999983 ZSENGSUQFYCKIE-QHCPKHFHSA-N 493.926 5.252 5 20 JKBD Cc1ncc2c(n1)CC[C@@H](NC(=O)c1ccccc1Sc1ccc(C(F)(F)F)cc1[N+](=O)[O-])C2 30385328 SKGVVPBXBNQPCB-MRXNPFEDSA-N 488.491 5.151 5 20 JKBD CC(C)OCCCn1c(SCc2csc([N+](=O)[O-])c2)nc2cc(Cl)ccc2c1=O 71937545 IIXYLYMVUKUOQI-UHFFFAOYSA-N 453.973 5.127 5 20 JKBD C[C@H](NC(=O)[C@@H](C)Sc1ccc([N+](=O)[O-])cc1)c1ccc(NC(=O)Nc2ccccc2)cc1 480747240 ZWXMRHZIVMNNHW-DLBZAZTESA-N 464.547 5.597 5 20 JKBD Cc1nc([N+](=O)[O-])cn1CCC(=O)Nc1ccc(Oc2ccc(Cl)cc2Cl)c(F)c1 488575976 BIAVAAXDFOYKLS-UHFFFAOYSA-N 453.257 5.367 5 20 JKBD CC(C)Oc1ccc(-c2csc(NC(=O)c3cn(C)nc3-c3ccc([N+](=O)[O-])cc3)n2)cc1 490128798 AEURTXOAEBCMHJ-UHFFFAOYSA-N 463.519 5.158 5 20 JKBD C[C@H](Nc1ccc(C(=O)NCc2csc(-c3ccccc3)n2)cc1[N+](=O)[O-])c1ccccn1 503182573 RBOZYKVUZOGQJP-INIZCTEOSA-N 459.531 5.216 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Br)[C@H](Nc1ccc2scnc2c1)c1ccccc1 507890494 CLQGWVOZBQWURC-HXUWFJFHSA-N 483.347 5.759 5 20 JKBD C[C@H](Nc1ccc(C(=O)Nc2ccccc2CN2CCc3ccccc32)cc1[N+](=O)[O-])c1ccccn1 509495703 ZNPKIHXAJKQOEP-FQEVSTJZSA-N 493.567 5.978 5 20 JKBD O=[N+]([O-])c1cc(CNCc2ccc(N3CCCCCC3)nc2)ccc1Oc1ccc(F)cc1 509563505 HOLFUROYZJHVAU-UHFFFAOYSA-N 450.514 5.591 5 20 JKBD CC(=O)Nc1cc(NC(=O)c2ccc(Sc3nc(C)cs3)c([N+](=O)[O-])c2)ccc1Cl 517980290 RCJAVXZKLWBVEZ-UHFFFAOYSA-N 462.940 5.375 5 20 JKBD Cc1cc(C(=O)N2CCCC[C@H]2C)ccc1NC(=O)Cn1c2ccccc2c(=O)c2ccccc21 519093647 LMFGTIYJNPHGDO-HXUWFJFHSA-N 467.569 5.116 5 20 JKBD C[C@H](NC(=O)C(=O)Nc1ccc(Sc2ccccc2Cl)cc1)c1cccc([N+](=O)[O-])c1 519956614 QRFZYEQNYDIIPQ-AWEZNQCLSA-N 455.923 5.215 5 20 JKBD CC(=O)Nc1ccc(C(F)(F)F)cc1NC(=O)CCNc1ccc(C(F)(F)F)cc1[N+](=O)[O-] 521240983 VJCBEWZESNAPHC-UHFFFAOYSA-N 478.349 5.032 5 20 JKBD COc1cccc(CN(C)C(=O)C/C(=C\c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)c1 603466682 MSLNYXMCVIDLAD-XSFVSMFZSA-N 473.554 5.802 5 20 JKBD Cc1ccc(C(C)C)c(Oc2ccc(CN[C@@H](c3ccccc3)c3nccn3C)cc2[N+](=O)[O-])c1 603633618 YWTIMTXGWBVGHC-MHZLTWQESA-N 470.573 6.432 5 20 JKBD CCOc1ccc(NC(=O)c2ccc(Sc3nc(C)cs3)c([N+](=O)[O-])c2)c(C(F)(F)F)c1 604448409 LNKGEBAMKUWXRK-UHFFFAOYSA-N 483.493 6.181 5 20 JKBD Cc1ccc(NC(=O)c2ccc(Sc3nnc(-c4cccs4)n3C)c([N+](=O)[O-])c2)cc1 608972386 FEGKUAPBKRPQPS-UHFFFAOYSA-N 451.533 5.164 5 20 JKBD COc1ccc([N+](=O)[O-])cc1NC(=O)[C@@H](Oc1ccc(Br)cc1F)c1ccccc1 609326588 UHPQSAWWVZWUGW-FQEVSTJZSA-N 475.270 5.264 5 20 JKBD O=C(COC(=O)Cc1csc(-c2cccc(C(F)(F)F)c2)n1)Nc1ccc(Cl)c([N+](=O)[O-])c1 725970196 VYRNRJKMKYJYIW-UHFFFAOYSA-N 499.854 5.115 5 20 JKBD COc1ccc(C(=O)O[C@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2ccccc2)c(Cl)c1 731089562 SMMFXEGQUSOZRH-FQEVSTJZSA-N 475.284 5.447 5 20 JKBD CC1CCN(c2ccc([N+](=O)[O-])cc2C(=O)Nc2ccc(NC(=O)c3cccs3)cc2)CC1 749129936 DCMSNPOZXGFAQX-UHFFFAOYSA-N 464.547 5.397 5 20 JKBD O=C(Nc1ncc(Cc2ccccc2Cl)s1)c1cc([N+](=O)[O-])ccc1Br 751074880 LYIVDBHGHRAMBK-UHFFFAOYSA-N 452.717 5.310 5 20 JKBD Cc1nn(C)c2nc(C3CC3)cc(C(=O)Oc3ccc4c(-c5ccc([N+](=O)[O-])cc5)cc(=O)oc4c3)c12 844265329 OXNHWSWJPJPJBZ-UHFFFAOYSA-N 496.479 5.055 5 20 JKBD C[C@@H](Nc1ccc(-c2nc(-c3cccc(Br)c3)no2)cc1[N+](=O)[O-])c1ccccn1 904296507 FYHWXXZUKVCCGY-CYBMUJFWSA-N 466.295 5.642 5 20 JKBD O=C(Nc1ccc(OC[C@H](O)c2ccccc2C(F)(F)F)cc1)c1cc([N+](=O)[O-])ccc1Cl 918750095 IMRNTXNFMHDNBC-FQEVSTJZSA-N 480.826 5.632 5 20 JKBD COc1cc(C(=O)Oc2ccc(Br)cc2Cl)c([N+](=O)[O-])cc1OCc1cscn1 919976660 SPXMDMKVFNMITP-UHFFFAOYSA-N 499.726 5.274 5 20 JKBD COc1cc(C)ccc1Oc1ccc(NC(=O)c2cc([N+](=O)[O-])cc([N+](=O)[O-])c2C)cc1F 920019115 ZHTIQNIQAZCAOG-UHFFFAOYSA-N 455.398 5.312 5 20 JKBD COC(=O)/C=C/c1ccc(Sc2nnc(COc3ccccc3Cl)n2C2CC2)c([N+](=O)[O-])c1 931419354 FILOUEXGPWMCKI-YRNVUSSQSA-N 486.937 5.091 5 20 JKBD Cc1nc(C(=O)NC2(c3ccc(NC(=O)c4cc5cc([N+](=O)[O-])ccc5s4)cc3)CCC2)co1 1791011331 XHNSGPSGLZMWNZ-UHFFFAOYSA-N 476.514 5.167 5 20 JKBD Cc1ccc(CCC(=O)Nc2ccc(C3(NC(=O)c4cccc(F)c4[N+](=O)[O-])CCC3)cc2)c(C)n1 1791771652 DXUGWKYVHCODNX-UHFFFAOYSA-N 490.535 5.126 5 20 JKBD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)Cc1ccc(Cl)cc1[N+](=O)[O-])c1ccc(Cl)c(Cl)c1 1793078955 IWGYQSBAPNFBRK-BJWYYQGGSA-N 496.778 5.050 5 20 JKBD Cc1c(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)c3ccc([N+](=O)[O-])cc3F)[nH]n2)oc2ccccc12 1818569605 ADWDEUWRQQUGKO-FQEVSTJZSA-N 491.479 5.131 5 20 JKBD C[C@H]1CC[C@H](C(=O)Nc2cc([C@H]3CCCCN3C(=O)Cc3ccc(Cl)cc3[N+](=O)[O-])[nH]n2)CC1 1822939995 LXAXNSATINTZAQ-JXXFODFXSA-N 487.988 5.032 5 20 JKBD C[C@@H]1CCC[C@@H]1C(=O)N1CCCC[C@H]1C1CCN(C(=O)C2(c3cccc([N+](=O)[O-])c3)CCC2)CC1 1828487426 TXIAARFFYHFVLS-YNJKOYDBSA-N 481.637 5.072 5 20 JKBD COc1ccc(NC(=O)[C@@H](OC(=O)c2ccc([N+](=O)[O-])cc2Cl)c2ccccc2)cc1Cl 11028655 SDYIQNBFHODUKL-FQEVSTJZSA-N 475.284 5.447 5 20 JKBD Cc1cc(C(=O)COC(=O)Cn2c3ccccc3c(=O)c3ccccc32)c(C)n1Cc1cccs1 11277186 FPKJBMIGKXIDOD-UHFFFAOYSA-N 484.577 5.109 5 20 JKBD COc1c(Br)cc(Cl)cc1NC(=O)c1ccc(Cn2nc(C)c([N+](=O)[O-])c2C)cc1 14555789 LVLLBWMEUSGXMR-UHFFFAOYSA-N 493.745 5.133 5 20 JKBD Cc1ccc(Cn2c(S[C@@H](C)c3nnc(-c4ccc([N+](=O)[O-])cc4)o3)nc3ccccc3c2=O)cc1 17671676 PHXTZJKRSCBSLS-KRWDZBQOSA-N 499.552 5.565 5 20 JKBD O=[N+]([O-])c1cc2c(c(CSc3nnc(-c4ccc(Cl)cc4)n3Cc3ccccc3)c1)OCOC2 28626056 FNAZGPRBYZTUEI-UHFFFAOYSA-N 494.960 5.714 5 20 JKBD Cc1cc(=O)c(C(=O)Nc2ccccc2NC23CC4CC(CC(C4)C2)C3)nn1-c1ccccc1[N+](=O)[O-] 72039156 KCCRQZSGNAOHFU-UHFFFAOYSA-N 499.571 5.082 5 20 JKBD O=C(Nc1ccccc1C(=O)Nc1ccc(-c2nccs2)cc1)c1ccc([N+](=O)[O-])cc1Cl 104685912 IYJMPWWYBXJFCL-UHFFFAOYSA-N 478.917 5.876 5 20 JKBD CCOc1cc(NC(=O)c2cc3cccc([N+](=O)[O-])c3[nH]2)c(OCC)cc1NC(=O)c1ccccc1 108407352 WVOBURKUWBUQJE-UHFFFAOYSA-N 488.500 5.378 5 20 JKBD CCCN(Cc1nnc(-c2ccccc2Cl)o1)C(=O)Cn1c2ccccc2c(=O)c2ccccc21 302925854 BPKKVJLRGGDOHE-UHFFFAOYSA-N 486.959 5.297 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)Nc2ncc(Cc3cc(Cl)ccc3Cl)s2)cc1SC 481932514 RBLAWFRNCZAIBH-UHFFFAOYSA-N 484.386 5.932 5 20 JKBD COc1cc([C@H](C)NC(=O)c2ccc(NCc3ccccc3Cl)c([N+](=O)[O-])c2)cc(OC)c1OC 482544572 RMGBNNKTLPILDR-HNNXBMFYSA-N 499.951 5.377 5 20 JKBD COc1ccccc1NC(=O)c1ccc(NC(=O)c2csc(-c3cccc([N+](=O)[O-])c3)n2)cc1 496589330 CSLMFGRDLSKUOU-UHFFFAOYSA-N 474.498 5.232 5 20 JKBD O=C(Cc1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1)Nc1ccc(Oc2ccncc2)cc1 497350784 YAHMLRPEAFXNOU-UHFFFAOYSA-N 491.507 5.816 5 20 JKBD O=C(C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)N(CCO)Cc1ccccc1 501922820 YHMOFGHYXMPTPT-LTGZKZEYSA-N 473.554 5.156 5 20 JKBD Cc1nc(-c2ccccc2)sc1[C@@H](C)NC(=O)c1ccc(Cn2nc(C)c([N+](=O)[O-])c2C)cc1 507537731 QKDUARPPTLTZKV-MRXNPFEDSA-N 475.574 5.379 5 20 JKBD CN(c1ccccc1)c1ccc(CNC2CCN(C(=O)CCc3ccccc3)CC2)cc1[N+](=O)[O-] 507922064 JWHTXPMRCFEKNA-UHFFFAOYSA-N 472.589 5.076 5 20 JKBD COc1ccc(CSCC(=O)Nc2cc(Cl)ccc2Sc2nccn2C)cc1[N+](=O)[O-] 509200632 PXDKCPGOHZAVKO-UHFFFAOYSA-N 478.983 5.013 5 20 JKBD COc1cc(CNCc2nn(-c3ccccc3)c3c2CCC3)ccc1OCc1ccc([N+](=O)[O-])cc1 513644237 VVJRPLYMFCLBAX-UHFFFAOYSA-N 484.556 5.147 5 20 JKBD Cc1ccc(C(=O)N(C)Cc2ccccc2[N+](=O)[O-])cc1NC(=O)c1ccc(Br)cc1 515215387 XHXODTRBVNPLBP-UHFFFAOYSA-N 482.334 5.190 5 20 JKBD C[C@H](NCc1ccc(-c2ccc([N+](=O)[O-])cc2Br)o1)c1ccc(OC(F)F)cc1 521807221 QHNLLZXLJRLXPI-LBPRGKRZSA-N 467.266 6.070 5 20 JKBD COc1cccc(/C=C(\CC(=O)N(C)c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)c1 590645647 OMNFBGBVHVQMMF-NBVRZTHBSA-N 459.527 5.807 5 20 JKBD O=C(NC1CCCC1)c1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2Sc2ccccc2)cc1 603975855 JLWPIBUHVKWLOF-UHFFFAOYSA-N 461.543 5.671 5 20 JKBD COc1cc(C(=O)N[C@@H](c2ccc(Br)cc2)C2CCC2)c([N+](=O)[O-])cc1OC(F)F 604017603 OPKVDGREYAWFDQ-GOSISDBHSA-N 485.281 5.239 5 20 JKBD CC(C)NC(=O)Nc1ccc(CN[C@@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2ccccc2)cc1 604044218 CZOKPLQSANNNBW-HSZRJFAPSA-N 495.967 5.248 5 20 JKBD C[C@@H](Nc1ccc(C(=O)N2CCC[C@H](c3cc4ccccc4[nH]3)C2)cc1[N+](=O)[O-])c1ccccn1 604336879 KBQNKAXPEQTRNZ-NQIIRXRSSA-N 469.545 5.664 5 20 JKBD O=C(C1CCN(c2ccccc2[N+](=O)[O-])CC1)N1CCCC[C@H]1c1ccc(C(F)(F)F)cc1 608850570 ASNUAJPLNLRBTA-FQEVSTJZSA-N 461.484 5.584 5 20 JKBD CO[C@H](C)c1cccc(NC(=O)c2ccccc2C(=O)c2ccc(SC)c([N+](=O)[O-])c2)c1 608874549 FZQNHNSTVAJIAW-OAHLLOKOSA-N 450.516 5.507 5 20 JKBD Cn1nc(C(F)(F)F)c(-c2ccc(Cl)cc2)c1NC(=O)c1ccc(N2CCCC2)c([N+](=O)[O-])c1 609026508 JJXREKFAIYPKOM-UHFFFAOYSA-N 493.873 5.520 5 20 JKBD C[C@@H](Nc1ccc(C(=O)OCc2coc(-c3ccc(F)c(F)c3)n2)cc1[N+](=O)[O-])c1ccccn1 728624726 JYVKPIIDJLCIDZ-CQSZACIVSA-N 480.427 5.453 5 20 JKBD C[C@@H](Nc1ccc(C(=O)Nc2ccc(NC(=O)OC(C)(C)C)cc2)cc1[N+](=O)[O-])c1ccccn1 729403206 PYMMPCZOGZSXOB-MRXNPFEDSA-N 477.521 5.762 5 20 JKBD O=C(O[C@H](C(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1)c1ccccc1)c1csc(C2CC2)n1 747506949 OBBWKOORFAUTDO-SFHVURJKSA-N 457.895 5.119 5 20 JKBD C[C@H](OC(=O)c1csc(-c2ccc([N+](=O)[O-])cc2)n1)C(=O)N(c1nccs1)C1CCCCC1 747957203 LESGAGKLEXXMJM-AWEZNQCLSA-N 486.575 5.086 5 20 JKBD Cc1ccc2nc([C@@H]3CCCN(C(=O)c4cc([N+](=O)[O-])ccc4N4CCC(C)CC4)C3)[nH]c2c1 749399992 UNZGTBQFEZMSTA-LJQANCHMSA-N 461.566 5.036 5 20 JKBD Cc1ccc(NC(=O)c2cccc(C(F)(F)F)c2)cc1NC(=O)c1cc(F)ccc1[N+](=O)[O-] 751109781 ZQOYPPJRGBQSPY-UHFFFAOYSA-N 461.371 5.566 5 20 JKBD O=C(Nc1ccc(Cn2cnc3ccccc32)cc1)c1cc([N+](=O)[O-])ccc1Br 751111856 GFCWUYQXRUGZRC-UHFFFAOYSA-N 451.280 5.008 5 20 JKBD CCn1c(NC(=O)c2ccccc2NC(=O)c2ccc([N+](=O)[O-])cc2Cl)nc2ccccc21 766332619 VNOWZYJTKRMFCC-UHFFFAOYSA-N 463.881 5.122 5 20 JKBD CN(C)c1ccc([C@H](CNC(=O)c2c[nH]c3cc([N+](=O)[O-])ccc23)c2c[nH]c3ccccc23)cc1 769046715 LAKSLLBIBYQTJO-QFIPXVFZSA-N 467.529 5.185 5 20 JKBD C[C@H]1C[C@@H]1c1ccc(CCC(=O)Oc2ccc(NC(=O)c3cc([N+](=O)[O-])ccc3Cl)cc2)o1 783505107 DWJIAZNMZFXGNY-LIRRHRJNSA-N 468.893 5.755 5 20 JKBD O=[N+]([O-])c1ccc(OCc2nnc(-c3ccc(Br)s3)o2)c(-c2cccs2)c1 824533671 JMZLUXSQPHSTJB-UHFFFAOYSA-N 464.322 5.776 5 20 JKBD O=C(/C=C/c1nc2ccccc2s1)O[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1 849189635 CDGACOZRNBUYEW-OTOIZHKDSA-N 493.928 5.794 5 20 JKBD C[C@@H](Sc1ccc([N+](=O)[O-])cc1)c1nc(-c2ccc(CNC(=O)OC(C)(C)C)cc2)no1 904715312 GMNRBGKHECBEHK-CQSZACIVSA-N 456.524 5.523 5 20 JKBD C[C@H](OC(=O)c1nc(-c2ccccc2)n2c1CCCCC2)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 914915219 DEGUSNVLPUOYOS-INIZCTEOSA-N 473.489 5.153 5 20 JKBD C[C@@H]1Sc2ccc(C(=O)Nc3cc(Cl)c([N+](=O)[O-])cc3OCc3ccccc3)cc2NC1=O 916827740 VQCPGYGSRHSNTM-ZDUSSCGKSA-N 483.933 5.512 5 20 JKBD O=C(Nc1ccc(F)c(NC(=O)C2CCCCC2)c1)c1cc([N+](=O)[O-])ccc1N1CCCC1 918578447 HXBMYSRPQXUJEN-UHFFFAOYSA-N 454.502 5.105 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)[C@@H]3C[C@@H]3c3ccccc3)CCC2)cc1)c1cc([N+](=O)[O-])cc2c1OCC2 1790045594 YCYNGHQUQWTDOF-DNQXCXABSA-N 497.551 5.081 5 20 JKBD O=C(NC1(c2ccc(NC(=O)c3ccc([N+](=O)[O-])[nH]3)cc2)CCC1)c1cccc(C(F)(F)F)c1 1790187322 USATWSSUMLMNIA-UHFFFAOYSA-N 472.423 5.003 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)c3ccc(O)c([N+](=O)[O-])c3)CCC2)cc1)c1cccc(-c2cnco2)c1 1790710860 VOJXSLPZHMEHAV-UHFFFAOYSA-N 498.495 5.017 5 20 JKBD Cc1c(C(=O)Nc2ccc(C3(NC(=O)c4ccco4)CCC3)cc2)cc(Br)cc1[N+](=O)[O-] 1790713069 HSGDXFMJBQDMBD-UHFFFAOYSA-N 498.333 5.320 5 20 JKBD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc2c(Cl)cccc2s1)c1ccc([N+](=O)[O-])cc1F 1797649753 IOFDZHXZEXQLJQ-BTTYYORXSA-N 487.940 5.168 5 20 JKBD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H]1CCC[C@@H]2CCCC[C@H]21)c1cc2cc([N+](=O)[O-])ccc2s1 1797878840 WJDSUXQHJMHKHH-ORIMILDESA-N 495.645 5.668 5 20 JKBD Cc1ccc(-c2ccccc2C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cc([N+](=O)[O-])c(O)cc2C)cc1 1800803033 IVGGQKRVIJSTJY-KOUNCHBCSA-N 499.567 5.150 5 20 JKBD CCCCC[C@H](C)C(=O)N1CC[C@@H](CNC(=O)CSc2ccccc2[N+](=O)[O-])[C@H]1c1cccnc1 1812985166 HTLYDQKYXYGYFY-QYXIYQDXSA-N 498.649 5.004 5 20 JKBD Cc1ccc(CSCCC(=O)N2CCC([C@@H]3CCCCN3C(=O)c3ccc([N+](=O)[O-])o3)CC2)cc1 1823618005 LPNHLIRPGAPLPE-QFIPXVFZSA-N 499.633 5.053 5 20 JKBD O=C(c1cccc(F)c1[N+](=O)[O-])N1CCC([C@@H]2CCCCN2C(=O)c2cc(Cl)ccc2F)CC1 1823938841 LCIYXVRXJOJVHK-NRFANRHFSA-N 491.922 5.074 5 20 JKBD O=C(c1cc(F)cc([N+](=O)[O-])c1)N1CCC([C@@H]2CCCCN2C(=O)CCCc2ccccc2F)CC1 1824167073 PYDFFLJZSJJTQQ-VWLOTQADSA-N 499.558 5.129 5 20 JKBD O=C(Cc1ccccc1[N+](=O)[O-])OCC(=O)N1c2ccccc2Sc2ccc(Cl)cc21 11467297 NWRUEAMCXIHVEE-UHFFFAOYSA-N 454.891 5.163 5 20 JKBD C[C@H](Sc1nc2ccccc2c(=O)n1-c1ccc(F)cc1)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 17533006 SDAVZZVCBOAEHI-AWEZNQCLSA-N 489.488 5.336 5 20 JKBD C[C@H](Sc1ncc(-c2ccccc2)n1C[C@@H]1CCCO1)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl 29072033 FQUHECQNZUNQKD-YJBOKZPZSA-N 486.981 5.410 5 20 JKBD O=C(COc1ccc(Cl)cc1[N+](=O)[O-])c1cc(Br)sc1Br 48132575 VOPSFLLBNADXHH-UHFFFAOYSA-N 455.511 5.096 5 20 JKBD CN(C)c1ccc([C@@H](CNC(=O)c2cc([N+](=O)[O-])ccc2Cl)c2c[nH]c3ccccc23)cc1 104711260 JLQCUEACNBHGHY-OAQYLSRUSA-N 462.937 5.357 5 20 JKBD COc1ccc(OC)c(-c2nn(-c3ccccc3)cc2C(=O)Nc2cccc([N+](=O)[O-])c2C)c1 247994067 OJVYYDIHMCHDTO-UHFFFAOYSA-N 458.474 5.025 5 20 JKBD CC(C)(C)c1ccc(C(=O)N(Cc2ccc(C(=O)NC3CC3)cc2)Cc2ccco2)cc1[N+](=O)[O-] 302952156 MYLQYXPUPPXWCD-UHFFFAOYSA-N 475.545 5.220 5 20 JKBD O=C(Cc1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1)NC[C@@H]1CCCO[C@@H]1c1ccccc1 409559845 XVTPOKNVNISDML-MUAVYFROSA-N 496.567 5.274 5 20 JKBD O=C(CSc1ccc(C(F)(F)F)cc1[N+](=O)[O-])Nc1ccc(-c2ncc3n2CCCC3)cc1 481550402 ADTUQVMYLIMTQX-UHFFFAOYSA-N 476.480 5.544 5 20 JKBD O=C(C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)NCCCOC1CCCC1 489599992 SKWISCMUCXBTNO-MNDPQUGUSA-N 465.575 5.601 5 20 JKBD COCCOc1ccc(NC(=O)CSc2ccc(C(F)(F)F)cc2[N+](=O)[O-])cc1Cl 490743856 FVFPJRFSOZREJJ-UHFFFAOYSA-N 464.849 5.023 5 20 JKBD C[C@H](Nc1ccc(C(=O)N[C@@H](c2ccc(Cl)cc2)C2CC2)cc1[N+](=O)[O-])c1ccccn1 505996340 NRHBSQBAUBOVCR-NPMXOYFQSA-N 450.926 5.697 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Cl)[C@@H](c1ccccc1)N1CCCN(c2ccccc2)CC1 515550220 GNVNXRYQIXLEHS-XMMPIXPASA-N 464.953 5.140 5 20 JKBD COCCN(C(=O)CCCc1ccc(Cl)cc1)c1nc(-c2ccc([N+](=O)[O-])cc2)cs1 516071412 GGZDXFPXIHCFKD-UHFFFAOYSA-N 459.955 5.374 5 20 JKBD O=C(NCc1ccccc1[N+](=O)[O-])C(=O)Nc1ccc(Oc2ccc(Cl)cc2Cl)c(F)c1 516305477 MOLLPXVZICDVCS-UHFFFAOYSA-N 478.263 5.088 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Cl)[C@H](NC[C@H]1CCCO[C@@H]1c1ccccc1)c1ccccc1 518002899 JWCILCHCWZTIAV-NIJXNBFTSA-N 479.964 5.686 5 20 JKBD Cc1cnn([C@H]2CCCc3ccccc32)c1NC(=O)c1ccc(N[C@@H](C)c2ccccn2)c([N+](=O)[O-])c1 524378347 PEGIFPUZQBUFAU-DFBJGRDBSA-N 496.571 5.846 5 20 JKBD C[C@@H]([C@H]1C[C@H]2CC[C@H]1C2)n1c(SCC(=O)Nc2ccccc2[N+](=O)[O-])nnc1-c1ccco1 594533791 CQSOGTKEJIRIIC-LUKYLMHMSA-N 467.551 5.174 5 20 JKBD Cc1cc(C)c(NC(=O)N2CCN(c3ccc(C(F)(F)F)cc3[N+](=O)[O-])CC2)c(Cl)c1 603647366 QESZCEDOQQHTFX-UHFFFAOYSA-N 456.852 5.238 5 20 JKBD O=C(CCCCc1nc2ccccc2s1)N(Cc1ccccc1[N+](=O)[O-])CC(F)(F)F 603742471 XPPSPJFBFSQDRN-UHFFFAOYSA-N 451.470 5.508 5 20 JKBD CC(C)(C)c1ccc(C(=O)Nc2ccccc2NCc2nc(-c3cccc([N+](=O)[O-])c3)no2)cc1 604007360 PPBRKKNTVZFNAV-UHFFFAOYSA-N 471.517 5.807 5 20 JKBD COc1cc(CNCc2ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])cc2)cc(OC)c1OC 604478724 IPGUDNCCRFUWKC-UHFFFAOYSA-N 458.898 5.356 5 20 JKBD CC1CCN(c2ccc(C(=O)N(C)CCCc3cc(-c4ccc(F)cc4)no3)cc2[N+](=O)[O-])CC1 604570190 AAMJNFMPPTXMBV-UHFFFAOYSA-N 480.540 5.330 5 20 JKBD COC(=O)c1sc2ccccc2c1CNC(=O)c1ccc(N[C@H](C)c2ccccn2)c([N+](=O)[O-])c1 609119558 VLFFGHVUYBCGGX-OAHLLOKOSA-N 490.541 5.094 5 20 JKBD CCCc1cc[n+](/C(C(=S)Nc2ccccc2-c2ccccc2)=C(/O)c2ccc([N+](=O)[O-])cc2)cc1 725764495 XISWAJYDDBFNLE-UHFFFAOYSA-O 496.612 6.825 5 20 JKBD COc1ccc(NC(=S)/C(=C(/O)c2cccc([N+](=O)[O-])c2)[n+]2ccc(C(C)(C)C)cc2)cc1Cl 726962692 TZGKIXNQIUGASZ-UHFFFAOYSA-O 499.012 6.165 5 20 JKBD O=C(Nc1cc([N+](=O)[O-])c(F)cc1F)c1ccccc1-c1nc(-c2cccc(Cl)c2)no1 727707117 GCBHAAFXFMVYRC-UHFFFAOYSA-N 456.792 5.496 5 20 JKBD C[C@@H](Nc1ccc(C(=O)N2CCC[C@@H]2c2ccccc2C(F)(F)F)cc1[N+](=O)[O-])c1ccccn1 728033405 LMNOBMDGOYQAHP-OPAMFIHVSA-N 484.478 6.159 5 20 JKBD Cc1ccc(Cl)c(NC(=S)/C(=C(/O)c2cccc([N+](=O)[O-])c2)[n+]2cc(O)ccc2C)c1Cl 728558250 IWGSKMJTLJNFAR-UHFFFAOYSA-O 491.376 5.835 5 20 JKBD CCCOc1cc(NC(=O)N2CCC([C@H](O)c3ccc(F)cc3)CC2)c([N+](=O)[O-])cc1OCCC 731106505 WNFYMBUSSDNRCO-XMMPIXPASA-N 489.544 5.289 5 20 JKBD CC(=O)N(c1nc(COC(=O)c2csc(-c3ccc([N+](=O)[O-])cc3)n2)cs1)c1ccccc1F 747957971 IJVFUWDYCADEQV-UHFFFAOYSA-N 498.517 5.356 5 20 JKBD Cc1noc(C)c1COc1cc2ccccc2cc1C(=O)O[C@@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1 775389978 VDJMKBHTNWSIAH-KRWDZBQOSA-N 489.484 5.116 5 20 JKBD Cc1cc(-c2cc(C(=O)O[C@H](C)C(=O)Nc3cc([N+](=O)[O-])ccc3Cl)c3c(C)noc3n2)c(C)o1 813320080 UNJPVAAYJZGGIU-CYBMUJFWSA-N 498.879 5.154 5 20 JKBD O=[N+]([O-])c1cccc(/C(O)=C(/C(=S)N[C@@H]2C[C@H]3CC[C@H]2C3)[n+]2ccc(Cc3ccccc3)cc2)c1 912845599 VYIWELDNOHYNJX-WRALFONMSA-O 486.617 5.463 5 20 JKBD Cc1nccn1-c1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2Sc2ccc(Cl)cc2)cn1 917190350 SHBSJVXKSJYLFB-UHFFFAOYSA-N 465.922 5.541 5 20 JKBD COc1ccc(NC(=S)Nc2ccc([N+](=O)[O-])cc2)cc1NC(=O)c1ccc(Cl)cc1F 917590367 XFBVTNCLCKITAA-UHFFFAOYSA-N 474.901 5.457 5 20 JKBD CCOc1cc(Br)c(NC(=O)c2cc([N+](=O)[O-])ccc2N2CCCCC2)cc1OCC 920012193 BWKKLYFROFWSHN-UHFFFAOYSA-N 492.370 5.397 5 20 JKBD Cc1ccc([N+](=O)[O-])cc1NC(=O)COC(=O)c1cccnc1Oc1ccc(Cl)cc1Cl 920908974 DOHJCJRDENRJME-UHFFFAOYSA-N 476.272 5.193 5 20 JKBD O=C(CCCC(F)(F)F)Nc1ccc(C2(NC(=O)Cc3cc(F)ccc3[N+](=O)[O-])CCC2)cc1 1786621145 KEFRMYISELYTFD-UHFFFAOYSA-N 481.446 5.143 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)c3nc[nH]c3[N+](=O)[O-])CCC2)cc1)c1ccc(Oc2ccccc2)cc1 1790620933 CRMKONVORTYLNI-UHFFFAOYSA-N 497.511 5.172 5 20 JKBD CCOc1ccsc1C(=O)NC1(c2ccc(NC(=O)c3ccc([N+](=O)[O-])cc3F)cc2)CCC1 1790621033 GXISMIQQZYWVJG-UHFFFAOYSA-N 483.521 5.256 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)c3ccccc3Cl)CCC2)cc1)c1cc(O)cc([N+](=O)[O-])c1 1790756973 OBCMJOUHXUHSRZ-UHFFFAOYSA-N 465.893 5.015 5 20 JKBD O=C(C[C@H]1CCCCO1)NC1(c2ccc(NC(=O)c3cc4cc([N+](=O)[O-])ccc4s3)cc2)CCC1 1791011178 MTNAIUSUTZMEOK-OAQYLSRUSA-N 493.585 5.516 5 20 JKBD Cc1cc(CCCC(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2ccc3ccoc3c2)c([N+](=O)[O-])cc1F 1800983504 NOZLISHHMSTXMQ-KOUNCHBCSA-N 493.535 5.063 5 20 JKBD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc2ccoc2c1)c1cc2cc([N+](=O)[O-])ccc2s1 1800991172 HYPCSBKUVHZZAQ-REPLKXPHSA-N 475.526 5.121 5 20 JKBD CC(C)(C)CCCCCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CSc1ccccc1[N+](=O)[O-] 1802185857 QXXSUDSVJVMMHH-ACDBMABISA-N 475.655 5.322 5 20 JKBD O=C([C@@H]1CCC[C@@H]2CCCC[C@H]21)N1CCC([C@H]2CCCCN2C(=O)c2ccc([N+](=O)[O-])o2)CC1 1823614497 LUXNLZISMZENPO-BDKRGJGYSA-N 471.598 5.028 5 20 JKBD O=C(c1cc2ccoc2s1)N1CCC([C@@H]2CCCCN2C(=O)c2ccc([N+](=O)[O-])cc2F)CC1 1830494997 LUJRKXGBKVTWDZ-FQEVSTJZSA-N 485.537 5.089 5 20 JKBD C[C@H](C(=O)N1CCCC[C@@H]1C1CCN(C(=O)/C=C/c2ccccc2[N+](=O)[O-])CC1)c1ccccc1 1832900565 OLVAZRFLGJESLR-UDSUQADKSA-N 475.589 5.031 5 20 JKBD CCCn1c(S[C@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)nnc1-c1ccc(Cl)cc1 9138788 QTLOTBRRTXCTMH-GFCCVEGCSA-N 480.377 5.689 5 20 JKBD CCCn1c(S[C@@H](C)C(=O)Nc2ccc(F)c([N+](=O)[O-])c2)nnc1-c1ccc(Cl)cc1 9139283 QSYKWVJIEOPVDA-LBPRGKRZSA-N 463.922 5.175 5 20 JKBD Cc1csc2nc(CNc3cc([N+](=O)[O-])ccc3Nc3cccc(C(F)(F)F)c3)cc(=O)n12 11725351 RSKVLHXSQRSMES-UHFFFAOYSA-N 475.452 5.347 5 20 JKBD COc1cc(CCC(=O)Oc2ccc(NC(=O)c3cc([N+](=O)[O-])ccc3Cl)cc2)cc(OC)c1 15603164 BNQYZNUUDOWCQE-UHFFFAOYSA-N 484.892 5.056 5 20 JKBD Cc1occc1-c1nnc(SCC(=O)Nc2cc(Cl)ccc2[N+](=O)[O-])n1-c1ccccc1 21996127 OJFSMTCDICOACU-UHFFFAOYSA-N 469.910 5.128 5 20 JKBD CCOc1cc(C(=O)Nc2ncc(Cc3ccc(Br)cc3)s2)c([N+](=O)[O-])cc1OC 22191453 FQPNEYSMDPIHPY-UHFFFAOYSA-N 492.351 5.064 5 20 JKBD CCOc1cc(C(=O)NC[C@@H](c2ccccc2)c2c[nH]c3ccccc23)c([N+](=O)[O-])cc1OC 45863795 HHVKHURMHHMTFB-FQEVSTJZSA-N 459.502 5.045 5 20 JKBD O=C(Nc1ccc(Cl)c([N+](=O)[O-])c1)c1cccc(NC(=O)c2ccc(Br)o2)c1 107850935 AQAFBYYXHNWYOJ-UHFFFAOYSA-N 464.659 5.108 5 20 JKBD COc1cc(/C=C\c2ccc3c([N+](=O)[O-])cccc3n2)ccc1OCC(=O)Nc1ccccc1Cl 208131154 DUBJPHMEAWBYMB-LUAWRHEFSA-N 489.915 5.993 5 20 JKBD Cc1csc(Sc2ccc(C(=O)NCCc3coc(-c4ccc(F)cc4)n3)cc2[N+](=O)[O-])n1 303131634 OLBGDUDZVRRXIJ-UHFFFAOYSA-N 484.534 5.278 5 20 JKBD C[C@@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)N[C@@H]1CCCc2nc(-c3ccc(F)cc3)sc21 303258184 OSYZCSJOFBWMEF-FZKQIMNGSA-N 457.552 5.532 5 20 JKBD O=C(NCc1ccc(-n2cncn2)cc1)c1ccccc1Sc1ccc(C(F)(F)F)cc1[N+](=O)[O-] 410392633 ZIFXVALZSBJVEV-UHFFFAOYSA-N 499.474 5.276 5 20 JKBD Cc1ccc(NC(=O)c2cc3ccccc3c3cccnc23)cc1NS(=O)(=O)c1ccccc1 478532432 BARKHQBJAWUUJL-UHFFFAOYSA-N 467.550 5.750 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)Nc2cc(-c3ccccc3)nn2-c2ccccc2C)cc1SC 482902144 VBDFWDYDRMYPJD-UHFFFAOYSA-N 474.542 5.739 5 20 JKBD C[C@@H](NC(=O)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1)c1ccc2c(c1)CC(=O)N2 501052214 ODEBAIOPCDHBBC-CYBMUJFWSA-N 451.866 5.026 5 20 JKBD CN(C(=O)C1CCN(c2ccccc2[N+](=O)[O-])CC1)[C@H]1CCSc2ccc(Br)cc21 504565484 GPIBXULSAZETFU-SFHVURJKSA-N 490.423 5.269 5 20 JKBD O=C(CCN1CCCCC1)Nc1ccc(NC(=O)c2cc3ccccc3c3cccnc23)cc1 505807778 SZARMWGPJFVYDA-UHFFFAOYSA-N 452.558 5.455 5 20 JKBD O=C1CCCN1Cc1cccc(CNCc2ccc(Oc3ccccc3Cl)c([N+](=O)[O-])c2)c1 509620641 SADLXCYCQDOOBD-UHFFFAOYSA-N 465.937 5.453 5 20 JKBD COc1cc(C(=O)N2CCC(=Cc3cccc(F)c3)CC2)c([N+](=O)[O-])cc1OCc1cscn1 509981981 KCUDPLLZJPNORJ-UHFFFAOYSA-N 483.521 5.098 5 20 JKBD CCOc1cc(Br)c(NC(=O)c2cc(SC)ccc2[N+](=O)[O-])cc1OCC 511583701 FKENVCYAXJTPJS-UHFFFAOYSA-N 455.330 5.129 5 20 JKBD COc1ccccc1-c1csc(NC(=O)c2cc([N+](=O)[O-])ccc2Sc2ccccc2)n1 512543158 ACLUBIOHFHZFRZ-UHFFFAOYSA-N 463.540 6.130 5 20 JKBD COc1ccc([N+](=O)[O-])c(C(=O)Nc2nnc(SCc3c(Cl)cccc3Cl)s2)c1 516335880 BAMRNKKZNHOPKW-UHFFFAOYSA-N 471.347 5.306 5 20 JKBD COc1cc(C(=O)N[C@@H]2CCCc3nc(-c4ccc(F)cc4)sc32)c([N+](=O)[O-])cc1OC(F)F 517854887 PPHDPQODYJJHIQ-CQSZACIVSA-N 493.463 5.275 5 20 JKBD O=C(Nc1ccc(-c2nnc3n2CCCC3)cc1)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1 518743355 ZLTSHGSNYFHRAE-UHFFFAOYSA-N 489.919 5.888 5 20 JKBD CSc1ccc([N+](=O)[O-])c(C(=O)Nc2cc(NC(=O)c3cccc(C(F)(F)F)c3)ccc2C)c1 519957536 AYXHRXDSQHERST-UHFFFAOYSA-N 489.475 6.149 5 20 JKBD O=C(C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)N(C[C@@H]1CCOC1)C1CC1 520406104 AEMFYABUFPUHEQ-DYGKOUCMSA-N 463.559 5.163 5 20 JKBD Cc1ccc(C(=O)Nc2cccc(C(F)(F)F)c2)cc1NC(=O)c1cc([N+](=O)[O-])c(C)s1 520447300 VISZGASWOXSGTD-UHFFFAOYSA-N 463.437 5.797 5 20 JKBD CCOc1ccc(C(=O)N2CCC(NC(=O)c3ccc(SCCC(C)C)c([N+](=O)[O-])c3)CC2)cc1 520694085 WYVJZEGYODIAAR-UHFFFAOYSA-N 499.633 5.166 5 20 JKBD COCCN(C(=O)c1sc2nccc(C)c2c1C)c1nc(-c2ccc([N+](=O)[O-])cc2)cs1 603563534 QSBRVBZUCMCNRC-UHFFFAOYSA-N 468.560 5.238 5 20 JKBD CC1CCN(c2ccc(C(=O)Nc3ccccc3COCc3ccccc3)cc2[N+](=O)[O-])CC1 603912016 JBCOXJOLBQEPLA-UHFFFAOYSA-N 459.546 5.800 5 20 JKBD O=C(Nc1nc(-c2cc3ccccc3o2)cs1)c1ccc([N+](=O)[O-])cc1I 604565505 SEJPSUHRTLTGCC-UHFFFAOYSA-N 491.266 5.321 5 20 JKBD Cc1cc(C(=O)N2CCC[C@@H]2C(=O)N2CCC(c3cccc4ccccc34)CC2)ccc1[N+](=O)[O-] 608806643 ARBZTMKVVDWPOB-AREMUKBSSA-N 471.557 5.067 5 20 JKBD Cc1cc(NC(=O)c2ccc(N[C@@H](C)c3ccccn3)c([N+](=O)[O-])c2)n(-c2ccc(F)cc2)n1 608817223 GIPLQTVJRDYPJK-INIZCTEOSA-N 460.469 5.048 5 20 JKBD CCOc1ccc([C@@H](C)NCc2ccc(-c3ccc([N+](=O)[O-])cc3Br)o2)cc1OC 608836559 SDFVFZFKLXWNQU-CQSZACIVSA-N 475.339 5.875 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)Nc2nc(-c3ccco3)c(-c3ccco3)s2)cc1SC 609125423 IZFQCKFAGYZTBR-UHFFFAOYSA-N 457.489 5.554 5 20 JKBD O=C(Nc1cc(Cl)ccc1Cl)[C@H]1CCCCN1C(=O)c1c[nH]c2cc([N+](=O)[O-])ccc12 609169450 DGTLRJISAMDBEK-LJQANCHMSA-N 461.305 5.016 5 20 JKBD Cc1ccc[n+](/C(C(=S)Nc2ccc(OC(C)C)cc2)=C(/O)c2ccc(C)c([N+](=O)[O-])c2)c1 726575891 XYPLMOXUXNYENR-UHFFFAOYSA-O 464.567 5.610 5 20 JKBD NC(=O)CCOc1ccc(NC(=O)CCC(=O)c2ccc3ccc4cccc5ccc2c3c45)cc1 727756188 SQSSAMCMJNXIKB-UHFFFAOYSA-N 464.521 5.440 5 20 JKBD O=C(COC(=O)[C@H]1C[C@@H]1c1cccc2ccccc12)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 730876523 POOSKQQGMRSOTP-MSOLQXFVSA-N 458.392 5.052 5 20 JKBD C[C@H](NC(=O)c1cc([N+](=O)[O-])ccc1Br)c1cccc(NC(=O)c2ccccc2)c1 751089047 RNLPHAJAVWFCAX-AWEZNQCLSA-N 468.307 5.101 5 20 JKBD Cc1ccc(Cl)cc1NC(=O)CN(c1ccccc1)S(=O)(=O)c1ccc(Cl)c([N+](=O)[O-])c1 849346295 SCHWMPLLOAHXAO-UHFFFAOYSA-N 494.356 5.044 5 20 JKBD O=[N+]([O-])c1cc(S(=O)(=O)C(F)F)ccc1N1CCC[C@@H]1c1ccc(F)c(C(F)(F)F)c1 864023650 XEIDQURZDPWYGP-CQSZACIVSA-N 468.375 5.091 5 20 JKBD C[C@@H]1CCC[C@@H](C)N1NC(=O)C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1 864846221 LOXOEFQAKQTOFA-GORXNEINSA-N 450.564 5.429 5 20 JKBD COc1cccc(-c2nn(Cc3ccccc3)cc2C(=O)Nc2cc([N+](=O)[O-])c(F)cc2F)c1 897520403 GWLRJXNRQXVCBC-UHFFFAOYSA-N 464.428 5.046 5 20 JKBD COc1ccc([N+](=O)[O-])cc1NC(=O)[C@@H](C)OC(=O)c1sc2cccc(Cl)c2c1Cl 913326794 FDCAURCCYOQEGU-SECBINFHSA-N 469.302 5.309 5 20 JKBD O=C(Nc1ccc(OC(=O)c2cccnc2N2CCCCC2)cc1)c1cc([N+](=O)[O-])ccc1Cl 915811004 NXEQEDORGHFFDM-UHFFFAOYSA-N 480.908 5.105 5 20 JKBD CN(C(=O)c1cc(Cl)ccc1[N+](=O)[O-])c1cccc(NC(=O)c2cc(Cl)ccc2[N+](=O)[O-])c1 917698355 FZTACXUQHMAYQW-UHFFFAOYSA-N 489.271 5.339 5 20 JKBD O=C(Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1)c1ccc2c(c1)C[C@H](c1ccccc1)OC2=O 919655845 YKYBBQGNVDZZHI-JOCHJYFZSA-N 471.494 5.425 5 20 JKBD CC(=O)N(c1ccc(C(F)(F)F)cc1)c1nc(COc2ccc([N+](=O)[O-])cc2C=O)cs1 919676381 VBVCOFDIALSALU-UHFFFAOYSA-N 465.409 5.146 5 20 JKBD C[C@@H](Nc1ccc(C(=O)OCC(=O)Nc2ccc(Cl)cc2Cl)cc1[N+](=O)[O-])c1ccccn1 920545754 IZYPZDBNPYUEDE-CYBMUJFWSA-N 489.315 5.265 5 20 JKBD Cc1ccc(C)c(NC(=O)[C@@H](OC(=O)c2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)c2ccccc2)c1 920550832 MZNYUWVCQLULCV-VWLOTQADSA-N 484.512 5.149 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)c3cc(F)ccc3Cl)CCC2)cc1)c1ccc([N+](=O)[O-])o1 1785750995 BSYXBNKHDVRUOT-UHFFFAOYSA-N 457.845 5.042 5 20 JKBD O=C(NC1(c2ccc(NC(=O)c3ccc([N+](=O)[O-])cc3F)cc2)CCC1)c1cc(-c2ccco2)no1 1790623767 NMODBXOSCFBFKM-UHFFFAOYSA-N 490.447 5.043 5 20 JKBD CC[C@@H](C)[C@@H](C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CSc1ccccc1[N+](=O)[O-])C2)c1ccccc1 1795572703 MBBXKSMOAFOZIP-RCCQWWGCSA-N 495.645 5.155 5 20 JKBD Cc1cc(CCCC(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cc3ccccc3o2)c([N+](=O)[O-])cc1F 1797484586 FHOMUGVKJFCEJD-WKCHPHFGSA-N 493.535 5.063 5 20 JKBD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc2cc([N+](=O)[O-])ccc2s1)[C@@H]1CCC[C@H]2CCCC[C@H]21 1801207374 MECSINWLJLZJTL-MYVDZQPHSA-N 495.645 5.668 5 20 JKBD O=C(N1CCCC[C@H]1c1cc(NC(=O)C2(c3cccc([N+](=O)[O-])c3)CCC2)n[nH]1)C1(F)CCCCC1 1820840827 NHRFDKGMKDKUKB-NRFANRHFSA-N 497.571 5.104 5 20 JKBD Cc1oc(C(C)(C)C)cc1C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2ccc([N+](=O)[O-])cc2F)n[nH]1 1821051492 LQSVTWBEAYGMGR-HXUWFJFHSA-N 497.527 5.276 5 20 JKBD COc1cc(C(=O)N2CCC([C@H]3CCCCN3C(=O)/C(C)=C/c3cccs3)CC2)ccc1[N+](=O)[O-] 1823719693 NKLMBGDKVSLQPU-WTYVIMSDSA-N 497.617 5.002 5 20 JKBD O=C(c1cc2cc([N+](=O)[O-])ccc2s1)N1CCC([C@H]2CCCCN2C(=O)[C@@H]2CC=CCC2)CC1 1824104274 OJORTQFNLVNFDI-DENIHFKCSA-N 481.618 5.399 5 20 JKBD O=C(c1ccc(Cl)o1)N1CCC([C@H]2CCCCN2C(=O)C2(c3cccc([N+](=O)[O-])c3)CCC2)CC1 1830292816 GTNIYOKLGOFTCM-OAQYLSRUSA-N 499.995 5.196 5 20 JKBD C[C@@]1(C(=O)N2CCCC[C@H]2C2CCN(C(=O)Cc3ccc(Cl)cc3[N+](=O)[O-])CC2)CC=CCC1 1832402000 KNUPYMWWFFVYBH-BKMJKUGQSA-N 488.028 5.157 5 20 JKBD O=C(c1ccc(Cl)cc1F)N1CCC([C@@H]2CCCCN2C(=O)/C=C/c2ccccc2[N+](=O)[O-])CC1 1832899946 FXMAFUSUEGXWPB-HDFUYHJRSA-N 499.970 5.334 5 20 JKBD COc1ccc(-c2csc(NC(=O)Cn3c4ccccc4c(=O)c4ccccc43)n2)cc1F 11250874 PBNYZNWBAKGCHD-UHFFFAOYSA-N 459.502 5.065 5 20 JKBD Cc1c(C(=O)O[C@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)oc2ccc(Br)cc12 17662632 YTNQHWVXGQMBHN-LLVKDONJSA-N 472.251 5.380 5 20 JKBD COc1cc(CN(C)C(=O)c2ccc(Sc3nc(C)cs3)c([N+](=O)[O-])c2)ccc1OC(F)F 17957992 QWNVHVVETLXRQG-UHFFFAOYSA-N 495.529 5.393 5 20 JKBD Cc1csc(Sc2ccc(C(=O)Nc3cc4c(cc3Cl)OCCCO4)cc2[N+](=O)[O-])n1 26982320 SVOVQVRNCGAQSB-UHFFFAOYSA-N 477.951 5.578 5 20 JKBD O=C(CSc1ccc(C(F)(F)F)cc1[N+](=O)[O-])N[C@@H](C(=O)Nc1ccccc1)c1ccccc1 107644709 UAQZDVIFOYHOMW-OAQYLSRUSA-N 489.475 5.202 5 20 JKBD C[C@H]1C[C@H](C)CN(c2ccc(C(=O)N3CCC(Oc4ccc(F)cc4F)CC3)cc2[N+](=O)[O-])C1 195640725 PYNKBVIVBDUORU-IRXDYDNUSA-N 473.520 5.039 5 20 JKBD Cc1ccc(-c2csc(NC(=O)c3ccc(CNC(=O)c4cccs4)cc3)n2)cc1[N+](=O)[O-] 302925282 CILXLNYVJSAVTH-UHFFFAOYSA-N 478.555 5.271 5 20 JKBD O=C(CCNc1ccc(C(F)(F)F)cc1[N+](=O)[O-])Nc1ccccc1NC(=O)C[C@H]1C=CCC1 409976269 ATGHUCWOBQDZMK-HNNXBMFYSA-N 476.455 5.349 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Cl)[C@H](c1ccccc1)N1CC=C(c2ccc(O)cc2)CC1 477027156 JVOAVEBKCSUKKE-DEOSSOPVSA-N 463.921 5.423 5 20 JKBD COc1cc(C(=O)N(Cc2ccc(F)cc2)c2nc3ccccc3s2)c([N+](=O)[O-])cc1OC 501773511 DLQZWQRORCYTEC-UHFFFAOYSA-N 467.478 5.208 5 20 JKBD CCN(C(=O)c1csc(-c2cccc([N+](=O)[O-])c2)n1)[C@H]1CCN([C@H](C)c2ccccc2)C1 501942157 BKQCNXLNRGCLKC-UTKZUKDTSA-N 450.564 5.016 5 20 JKBD O=C(Nc1cnn(Cc2ccncc2)c1)c1ccc(Sc2nc3ccccc3s2)c([N+](=O)[O-])c1 503932134 TYSUTDHRQRYPJI-UHFFFAOYSA-N 488.554 5.248 5 20 JKBD C[C@H](Nc1ccc(C(=O)Nc2ccc(Sc3nccn3C)cc2)cc1[N+](=O)[O-])c1ccccn1 504114288 ZJFFXZPECRLCKO-INIZCTEOSA-N 474.546 5.300 5 20 JKBD O=C(CC1CCCC1)NC1CCN(C(=O)c2ccc(NCc3ccccc3Cl)c([N+](=O)[O-])c2)CC1 517513515 FXPNOHGXVHPYFA-UHFFFAOYSA-N 499.011 5.161 5 20 JKBD COc1cc(C(=O)Nc2cccc(NC(=O)Nc3cccc4c3CCCC4)c2)c([N+](=O)[O-])cc1OC 519506181 PRELDEMJONMXKN-UHFFFAOYSA-N 490.516 5.387 5 20 JKBD COc1ccc(CC[C@@H]2CCCCN2C(=O)Cn2c3ccccc3c(=O)c3ccccc32)cc1OC 522371329 JBALPYNTKBQFJY-QFIPXVFZSA-N 484.596 5.186 5 20 JKBD COCCN(C(=O)c1ccc(Cl)cc1Cl)c1nc(-c2ccc([N+](=O)[O-])cc2)cs1 603461200 DLRYIYFKSSIJIT-UHFFFAOYSA-N 452.319 5.318 5 20 JKBD CCN(c1ccccc1)S(=O)(=O)c1ccc(NCc2ncc(-c3ccccc3)o2)c([N+](=O)[O-])c1 603627796 SVFCYWJCASYJAP-UHFFFAOYSA-N 478.530 5.077 5 20 JKBD Cc1cccc(C(C)C)c1NC(=O)N1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 603645153 UNKLBPGRRCDZDV-UHFFFAOYSA-N 450.461 5.400 5 20 JKBD Cc1ccc(CN(C(=O)C/C(=C\c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)C2CC2)o1 603814034 ATOGDGOVQDDRTR-XMHGGMMESA-N 473.554 6.228 5 20 JKBD Cc1cc([N+](=O)[O-])ccc1NC(=O)CCSc1nnc(-c2ccccc2)n1[C@H](C)c1ccccc1 603917445 RDNUHGNXDHQTED-LJQANCHMSA-N 487.585 5.892 5 20 JKBD CCOc1cc(C(=O)Nc2cc(C(F)(F)F)ccc2NC(=O)OC(C)(C)C)c([N+](=O)[O-])cc1OC 727790794 SIZNAPCHNQFSTC-UHFFFAOYSA-N 499.442 5.620 5 20 JKBD CCOc1ccccc1NC(=O)[C@@H](OC(=O)c1c[nH]c2ccc([N+](=O)[O-])cc12)c1ccccc1 749318603 WDHWUGQTZUSPBY-QHCPKHFHSA-N 459.458 5.012 5 20 JKBD O=C(Nc1ccc(Cl)c([N+](=O)[O-])c1)[C@@H](Sc1nnc2n1CCCCC2)c1ccccc1 809338446 VODRARUEMWDXJH-IBGZPJMESA-N 457.943 5.038 5 20 JKBD COc1ccc(-c2ccc(/C=C(/Cl)c3nnc(C(=O)Nc4ccccc4)s3)o2)c([N+](=O)[O-])c1 844254363 NCCIIYRINRMTTF-GZTJUZNOSA-N 482.905 5.704 5 20 JKBD Cc1cc([N+](=O)[O-])nn1Cc1cccc(-c2nc(-c3ccc(Oc4ccccc4)nc3)no2)c1 904448949 JXSHHOKBVXGZQX-UHFFFAOYSA-N 454.446 5.052 5 20 JKBD C[C@@H](OC(=O)c1ccc(OC2CCCC2)cc1)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 914953577 YGHDZBUJODYYGC-CYBMUJFWSA-N 466.412 5.119 5 20 JKBD COc1ccc(Cl)cc1NC(=O)[C@H](C)OC(=O)c1ccc(N[C@H](C)c2ccccn2)c([N+](=O)[O-])c1 920543936 BCPQOBCTNTXVHT-CABCVRRESA-N 498.923 5.009 5 20 JKBD COc1ccc(Cl)cc1NC(=O)[C@@H](C)OC(=O)c1ccc(N[C@H](C)c2ccccn2)c([N+](=O)[O-])c1 920543943 BCPQOBCTNTXVHT-HUUCEWRRSA-N 498.923 5.009 5 20 JKBD CN(C)c1ccc([N+](=O)[O-])cc1C(=O)Nc1ccc(C2(NC(=O)c3ccc4ccoc4c3)CCC2)cc1 1790793174 GDQWUWVJDAEGOM-UHFFFAOYSA-N 498.539 5.469 5 20 JKBD Cc1cc(O)c([N+](=O)[O-])cc1C(=O)Nc1ccc(C2(NC(=O)c3ccc4cnccc4c3)CCC2)cc1 1790809049 BFWSCVCSWFYCSP-UHFFFAOYSA-N 496.523 5.219 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)NC1(c2ccc(NC(=O)c3ccnc4ncccc34)cc2)CCC1 1790902501 UDWVGBXZFSKKLI-UHFFFAOYSA-N 499.502 5.047 5 20 JKBD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc(F)c1[N+](=O)[O-])c1cc2c(Cl)cccc2s1 1800529253 RIWYVVUEEDBFQY-BTTYYORXSA-N 487.940 5.168 5 20 JKBD Cc1ccc(-c2ccccc2C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2ccc([N+](=O)[O-])cc2F)C3)cc1 1800604752 KTVXRZHOTBTMDF-WKCHPHFGSA-N 487.531 5.275 5 20 JKBD CC1=CC[C@H](C(=O)Nc2cc([C@H]3CCCCN3C(=O)c3cc(Cl)cc([N+](=O)[O-])c3C)[nH]n2)CC1 1818808442 YLOLCDLWYQMDMU-OXJNMPFZSA-N 485.972 5.332 5 20 JKBD O=C(CCc1ccoc1)Nc1cc([C@@H]2CCCCN2C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)[nH]n1 1822924224 JKNKACFRIIGZQG-IBGZPJMESA-N 493.545 5.064 5 20 JKBD Cc1ccc(C(=O)N2CCC([C@H]3CCCCN3C(=O)Cc3cccc([N+](=O)[O-])c3)CC2)c(Cl)c1 1823683995 PSAYSEHYWNRANA-XMMPIXPASA-N 483.996 5.033 5 20 JKBD O=C(Cc1cc([N+](=O)[O-])ccc1F)N1CCC([C@@H]2CCCCN2C(=O)/C=C/C2CCCCC2)CC1 1830355049 LMTYOPFXSQEOMV-OPATVPMHSA-N 485.600 5.033 5 20 JKBD Cc1cccc(C(=O)N2CCC([C@@H]3CCCCN3C(=O)c3cc(F)cc([N+](=O)[O-])c3)CC2)c1Cl 1830615523 JOKCUJSPKXWUKJ-QFIPXVFZSA-N 487.959 5.243 5 20 JKBD C[C@@H](Sc1nnc(-c2ccccc2Cl)n1Cc1ccccc1)C(=O)Nc1ccccc1[N+](=O)[O-] 8989161 NXYLTIVPXSZRMV-MRXNPFEDSA-N 493.976 5.674 5 20 JKBD O=C(O[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1)c1ccccc1Br 11026298 NGCBCTISIBXMTE-IBGZPJMESA-N 489.709 5.548 5 20 JKBD C[C@H](OC(=O)c1ccc([N+](=O)[O-])cc1Cl)C(=O)Nc1c(Cl)cc(Cl)cc1Cl 11028835 WVLMAQOVRVZEGA-ZETCQYMHSA-N 452.077 5.392 5 20 JKBD O=C(CSc1ccc(C(F)(F)F)cc1[N+](=O)[O-])Nc1ccc(NC(=O)c2ccco2)cc1 11205358 ZLHVCRKLCMFFMX-UHFFFAOYSA-N 465.409 5.190 5 20 JKBD Cc1ccc(C(=O)CCC(=O)Oc2ccc(NC(=O)c3cc([N+](=O)[O-])ccc3Cl)cc2)cc1C 15604088 NNZCPXINVRHJMA-UHFFFAOYSA-N 480.904 5.686 5 20 JKBD CCOc1cc([N+](=O)[O-])c(C(=O)Nc2cc(C(F)(F)F)cc(C(F)(F)F)c2)cc1OC 15632637 MMKNRRIWACNAAZ-UHFFFAOYSA-N 452.307 5.292 5 20 JKBD COc1ccc(NC(=O)[C@H](C)OC(=O)[C@@H](Sc2ccccc2)c2ccccc2)c([N+](=O)[O-])c1 15815206 UGEAYTBWKFVOSR-AOMKIAJQSA-N 466.515 5.007 5 20 JKBD Cc1c(C(=O)OCC(=O)Nc2ccc([N+](=O)[O-])cc2C(F)(F)F)sc2cccc(F)c12 17150437 YBQXXGGXAAQHBN-UHFFFAOYSA-N 456.373 5.071 5 20 JKBD CCCn1c(S[C@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)nc2sc3c(c2c1=O)CCC3 20789693 NWUQXUYKYBXUAL-LLVKDONJSA-N 493.010 5.038 5 20 JKBD CCn1c(SCC(=O)Nc2ccccc2[N+](=O)[O-])nc2sc(C)c(-c3ccc(F)cc3)c2c1=O 25626834 CQLSAROTNYHXEH-UHFFFAOYSA-N 498.561 5.231 5 20 JKBD CN(Cc1ccc(C(F)(F)F)cc1)C(=O)c1ccccc1NC(=O)c1ccc([N+](=O)[O-])cc1Cl 104654123 UIIUAZCWQPULDE-UHFFFAOYSA-N 491.853 5.792 5 20 JKBD COc1cc(C(=O)N(C)Cc2ccc3ccccc3c2)c([N+](=O)[O-])cc1OCc1cscn1 115769227 ZRUOLHLAOKCKPK-UHFFFAOYSA-N 463.515 5.064 5 20 JKBD Cc1cc(NC(=O)c2ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])cc2)ccc1NC(=O)c1ccco1 490110596 DAMLJQJAZKUICE-UHFFFAOYSA-N 491.887 6.447 5 20 JKBD Cc1ccc(-c2nnc3n2CCCCC3)cc1NC(=O)c1csc(-c2ccc([N+](=O)[O-])cc2)n1 496307549 JRYIDSXJDBRGEI-UHFFFAOYSA-N 474.546 5.264 5 20 JKBD CCn1c(S[C@@H](C)C(=O)Nc2c(C)nn(-c3ccccc3)c2C)nc2cc3ccccc3cc2c1=O 498098443 OHRFXLHFWXMTQZ-IBGZPJMESA-N 497.624 5.491 5 20 JKBD COc1cc(C(=O)N(Cc2ccc(F)cc2F)C2CCCC2)c([N+](=O)[O-])cc1OC(F)F 500578414 PPXFQQKEZFNIQZ-UHFFFAOYSA-N 456.392 5.068 5 20 JKBD COCCN(C(=O)[C@@H]1C[C@@H]1c1cccc2ccccc12)c1nc(-c2ccc([N+](=O)[O-])cc2)cs1 503087459 RWNBQZNKSJLJLJ-DHIUTWEWSA-N 473.554 5.655 5 20 JKBD CCN(C(=O)CCOc1ccccc1[N+](=O)[O-])[C@@H]1CCSc2ccc(Br)cc21 504642831 UCHHIHMGNGZPCL-MRXNPFEDSA-N 465.369 5.212 5 20 JKBD CC(C)(C)c1ccc(C(=O)N2CCC(C(=O)Nc3cccc(Br)c3)CC2)cc1[N+](=O)[O-] 505202592 DMIOVMWSFULDHJ-UHFFFAOYSA-N 488.382 5.146 5 20 JKBD COc1c(C)cc(CN(C)C(=O)C2CCN(c3ccc(C(F)(F)F)cc3[N+](=O)[O-])CC2)cc1C 506119638 OWAXXYTVBNASPL-UHFFFAOYSA-N 479.499 5.114 5 20 JKBD COc1cc(CN[C@@H]2CCCOc3ccc(F)cc32)ccc1OCc1ccc([N+](=O)[O-])cc1 507894667 IYGLTDDCBSVDSV-JOCHJYFZSA-N 452.482 5.325 5 20 JKBD COc1cc(CNCc2cn(-c3ccc(F)cc3)nc2C)c([N+](=O)[O-])cc1OCc1ccccc1 509588655 XRRUKQDZKCTVDJ-UHFFFAOYSA-N 476.508 5.105 5 20 JKBD CC(C)Oc1ccc([N+](=O)[O-])cc1CSc1nnc(-c2ccc(F)cc2)n1C[C@H]1CCCO1 511111524 VBRFETHSALTWLP-HXUWFJFHSA-N 472.542 5.251 5 20 JKBD Cc1cccc(-c2nnc(-c3ccc(C(=O)Nc4cc(C)nn4-c4ccc([N+](=O)[O-])cc4)cc3)o2)c1 514983371 LBVHDNUGSRMEDB-UHFFFAOYSA-N 480.484 5.367 5 20 JKBD COc1cc([C@H](C)NCc2ccc(-c3ccccc3[N+](=O)[O-])s2)ccc1OCc1ccncc1 518272575 BLFRAOMMZFRVBN-SFHVURJKSA-N 475.570 6.157 5 20 JKBD Cc1cc(NC(=O)c2ccc(NCc3ccccc3Cl)c([N+](=O)[O-])c2)ccc1C(=O)NC(C)C 521757736 NZGNKDKAVIPZAO-UHFFFAOYSA-N 480.952 5.559 5 20 JKBD Cc1ccc(NC(=O)CSc2ccccc2C(=O)Nc2cc([N+](=O)[O-])ccc2OC(F)F)cc1 603638283 ASBVEOXACNEXSF-UHFFFAOYSA-N 487.484 5.488 5 20 JKBD Cc1ccc(C(=O)N2C[C@H](C)C[C@@H](C)C2)cc1NC(=O)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-] 603977131 SFIAJSMOXMEBIT-HUUCEWRRSA-N 493.482 5.215 5 20 JKBD O=C(c1c2c(nc3ccccc13)/C(=C\c1cccc([N+](=O)[O-])c1)CCC2)N1CCC[C@H](c2cc[nH]n2)C1 608813474 XEMVNURNRNJHBW-LDETYFQJSA-N 493.567 5.763 5 20 JKBD COc1cc(C(=O)N2CCCO[C@@H](c3ccccc3)C2)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 609231345 YMRCQUWLPQPJPR-XMMPIXPASA-N 482.920 5.653 5 20 JKBD Cn1cnnc1Sc1ccc(C(=O)Nc2cccc(Sc3ccccc3)c2)cc1[N+](=O)[O-] 609375233 OJSSFYFJCUJTLS-UHFFFAOYSA-N 463.544 5.278 5 20 JKBD C[C@H](NCc1ccc(-c2ccc([N+](=O)[O-])cc2Br)o1)c1ccc(N2CCCC2=O)cc1 726606138 ACNAMWFISNSXDQ-HNNXBMFYSA-N 484.350 5.595 5 20 JKBD Cc1cccc(C)c1NC(=O)CNC(=O)CCC(=O)c1ccc2ccc3cccc4ccc1c2c34 727754326 NXZVENKBXAFDBD-UHFFFAOYSA-N 462.549 5.919 5 20 JKBD C[C@H]1CN(c2ccc(NC(=O)c3ccc(Cl)cc3[N+](=O)[O-])cc2C(F)(F)F)C[C@@H](C)O1 728038514 KADSSEMKZIDFCU-TXEJJXNPSA-N 457.836 5.133 5 20 JKBD C[C@H](Nc1ccc(N2CCCCCC2)cc1)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 747515841 UQIRAGHJSFYNDN-HNNXBMFYSA-N 450.461 5.433 5 20 JKBD Cc1c(C(=O)OCC(=O)N2c3ccccc3Sc3ccccc32)cc([N+](=O)[O-])c(C)c1[N+](=O)[O-] 748950707 MSHBWSJCIBZQAF-UHFFFAOYSA-N 479.470 5.106 5 20 JKBD O=C(Nc1ccc(Cl)c([N+](=O)[O-])c1)[C@H](Sc1nnc2n1CCCCC2)c1ccccc1 809338449 VODRARUEMWDXJH-LJQANCHMSA-N 457.943 5.038 5 20 JKBD O=[N+]([O-])c1cccc(/C(O)=C(/C(=S)Nc2ccc(Cl)cc2)[n+]2ccc3c(c2)CCCC3)c1 916204525 XWCTVFNVXPIQOC-UHFFFAOYSA-O 466.970 5.738 5 20 JKBD O=C(Nc1cc(Cl)c([N+](=O)[O-])cc1OCc1ccccc1)c1ccc(N2CCCC2=O)cc1 916827219 BMCUOVCAYGOZEZ-UHFFFAOYSA-N 465.893 5.206 5 20 JKBD Cc1c(C(=O)O[C@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2ccccc2)cnn1C(C)(C)C 919190139 VKGSEACYFYREQT-FQEVSTJZSA-N 470.913 5.045 5 20 JKBD C[C@@H](Nc1ccc(C(=O)Nc2ccc(N3CCCC3=O)c(Cl)c2)cc1[N+](=O)[O-])c1ccccn1 919698379 HSRGLSJJVAFGHA-OAHLLOKOSA-N 479.924 5.195 5 20 JKBD C[C@@H](Nc1ccc(C(=O)OC2C[C@@H]3CC[C@H](C2)N3C(=O)OC(C)(C)C)cc1[N+](=O)[O-])c1ccccn1 920138509 QYBBEKWFHASKBP-BLMTVLTRSA-N 496.564 5.250 5 20 JKBD CC1(C)CC(C(=O)NC2(c3ccc(NC(=O)Cn4ccc5ccc([N+](=O)[O-])cc54)cc3)CCC2)C1 1786276887 NZCHBBBYEXRDGW-UHFFFAOYSA-N 474.561 5.120 5 20 JKBD Cc1cc(O)c([N+](=O)[O-])cc1C(=O)NC1(c2ccc(NC(=O)CSC3CCCC3)cc2)CCC1 1786348576 UFCLHABUDRHEEP-UHFFFAOYSA-N 483.590 5.032 5 20 JKBD O=C(/C=C/c1ccoc1)Nc1ccc(C2(NC(=O)Cc3ccc(Cl)cc3[N+](=O)[O-])CCC2)cc1 1786746929 BTBWPTVGIVUQGQ-XNWCZRBMSA-N 479.920 5.231 5 20 JKBD O=C(Cc1ccc(Cl)cc1[N+](=O)[O-])NC1(c2ccc(NC(=O)c3ccncc3Cl)cc2)CCC1 1789726846 RSSVXKWZSQVSCG-UHFFFAOYSA-N 499.354 5.287 5 20 JKBD Cc1ccc(CC(=O)NC2(c3ccc(NC(=O)c4cccc5ccncc45)cc3)CCC2)cc1[N+](=O)[O-] 1790859959 QSNQHXIXIJFJII-UHFFFAOYSA-N 494.551 5.442 5 20 JKBD C[C@H]1CC[C@H](C(=O)Nc2ccc(C3(NC(=O)c4nc5cc([N+](=O)[O-])ccc5[nH]4)CCC3)cc2)CC1 1791971067 KACGCNDYENFRGM-QAQDUYKDSA-N 475.549 5.045 5 20 JKBD COc1ccc(Cl)c(C(=O)Nc2ccc(C3(NC(=O)c4cc(C)c([N+](=O)[O-])cn4)CCC3)cc2)c1 1792084592 NCTXEGMPUJBRGI-UHFFFAOYSA-N 494.935 5.022 5 20 JKBD COc1cc(C(=O)N2CCCC[C@H]2c2cc(NC(=O)[C@H]3CC[C@H](C(C)C)CC3)n[nH]2)ccc1[N+](=O)[O-] 1822105228 VAKHWORTCFVMKG-WFXMLNOXSA-N 497.596 5.095 5 20 JKBD CC(C)=CCCC(=O)N1CCC([C@@H]2CCCCN2C(=O)Cc2ccc(Cl)cc2[N+](=O)[O-])CC1 1824162103 HXAZOUZNCQTUHP-QFIPXVFZSA-N 476.017 5.157 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)N1CCC([C@@H]2CCCCN2C(=O)[C@@H]2C[C@@H]2c2ccccc2)CC1 1831785619 BPLXPNMNSIMOTM-RQTOMXEWSA-N 493.579 5.079 5 20 JKBD COc1cc(C(=O)N2CCCC[C@H]2C2CCN(C(=O)c3cccc(Cl)c3C)CC2)ccc1[N+](=O)[O-] 1832694840 UYNKVFMZBILBST-QFIPXVFZSA-N 499.995 5.112 5 20 JKBD O=C(CSc1ncc(C(F)(F)F)cc1Cl)Nc1ccc([N+](=O)[O-])cc1Br 9160496 SWZAULOFKYOLPX-UHFFFAOYSA-N 470.654 5.155 5 20 JKBD O=C(O[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1)c1nc(Cl)ccc1Cl 9645031 NFHIHJYWZTYLTG-GOSISDBHSA-N 480.691 5.487 5 20 JKBD O=C(OCC(=O)N1N=C(c2ccc(Cl)cc2)C[C@@H]1c1ccco1)c1cc([N+](=O)[O-])ccc1Cl 10667993 UXAIHVBAIXCFMK-LJQANCHMSA-N 488.283 5.029 5 20 JKBD O=C(COC(=O)c1ccc(Cl)c([N+](=O)[O-])c1)Nc1c(Cl)c(Cl)cc(Cl)c1Cl 11025183 SLJHYUDGGJRMFQ-UHFFFAOYSA-N 472.495 5.657 5 20 JKBD O=C(C[C@@H](C(=O)O)c1ccccc1)Nc1cc(Cl)c([N+](=O)[O-])cc1OCc1ccccc1 13467817 UJPBLERTNHKEQX-QGZVFWFLSA-N 454.866 5.024 5 20 JKBD C[C@@H](Sc1nc2ccccc2c(=O)n1-c1ccc(F)cc1)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 17533005 SDAVZZVCBOAEHI-CQSZACIVSA-N 489.488 5.336 5 20 JKBD COc1ccc(C)cc1NC(=O)[C@@H](Sc1nc2cc3ccccc3cc2c(=O)n1C)c1ccccc1 22253197 QTIVLBJLBDWYTN-SANMLTNESA-N 495.604 5.876 5 20 JKBD C[C@H](c1ccc(Cl)cc1Cl)N(C)C(=O)c1ccc(Sc2nncn2C)c([N+](=O)[O-])c1 24456813 SAPUXKJDTOVXEV-LLVKDONJSA-N 466.350 5.015 5 20 JKBD COc1ccc(Oc2ccc([N+](=O)[O-])cc2C(=O)N(C)Cc2ccc(OC)c(OC(F)F)c2)cc1 25147132 HEJYFHIZAPNSBS-UHFFFAOYSA-N 488.443 5.278 5 20 JKBD O=C(Nc1ccc(N[C@@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2ccccc2)cc1)[C@H]1CCCO1 27000704 YGZGJRCQDLPBFZ-DHIUTWEWSA-N 494.935 5.158 5 20 JKBD O=C(Nc1cc(Cl)cc(Cl)c1)[C@@H]1CCCN1C(=O)Cn1c2ccccc2c(=O)c2ccccc21 33097504 QPFRGGAQNXNJGU-QHCPKHFHSA-N 494.378 5.091 5 20 JKBD O=C(Nc1cc(Br)ccc1Br)c1cc([N+](=O)[O-])ccc1Br 45626354 GJQLAGSDHOPMQH-UHFFFAOYSA-N 478.922 5.135 5 20 JKBD O=C(c1ccc(NCc2ccccc2Cl)c([N+](=O)[O-])c1)N1CCC(c2c[nH]c3ncccc23)CC1 108830210 ITOMPVMSRUAEGF-UHFFFAOYSA-N 489.963 5.756 5 20 JKBD Cc1c(CN2CCSCC2)cccc1NC(=O)c1ccc(N[C@H](C)c2ccccn2)c([N+](=O)[O-])c1 109499008 WGDHWDYVDIHREB-LJQANCHMSA-N 491.617 5.272 5 20 JKBD O=C(C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1)N(Cc1ccco1)CC(F)(F)F 301944501 GUFLCBDTRZWJSI-UHFFFAOYSA-N 479.377 5.014 5 20 JKBD COc1ccc(NC(=O)c2ccc(Nc3ccccc3)c([N+](=O)[O-])c2)cc1OCc1cccnc1 409584299 JUAGZNXGRBNYEV-UHFFFAOYSA-N 470.485 5.573 5 20 JKBD Cc1nn(Cc2ccc(C(=O)N[C@H](C)c3nc(-c4ccccc4)cs3)cc2)c(C)c1[N+](=O)[O-] 410287486 KJNXHHWQGPNPQI-MRXNPFEDSA-N 461.547 5.071 5 20 JKBD COc1ccc(C(=O)N2CCCCCC2)cc1NC(=O)c1cc([N+](=O)[O-])ccc1Oc1ccccc1 501704789 YUYYULVLGOIPOX-UHFFFAOYSA-N 489.528 5.664 5 20 JKBD CCOc1cc(F)ccc1NC(=O)c1ccccc1C(=O)c1ccc(SC)c([N+](=O)[O-])c1 502041435 LEUMWVDXEHLEIB-UHFFFAOYSA-N 454.479 5.338 5 20 JKBD C[C@@H]1Cc2cc([N+](=O)[O-])ccc2N1C(=O)Cc1ccc(NC(=O)c2cccc(Br)c2)cc1 504303886 JZIQBQXEYOPTMV-OAHLLOKOSA-N 494.345 5.130 5 20 JKBD O=C(Nc1ncc(Cc2cccc(Br)c2)s1)c1c[nH]c2cc([N+](=O)[O-])ccc12 505422260 VKSUYSIDUXUFDH-UHFFFAOYSA-N 457.309 5.138 5 20 JKBD C[C@@H](Nc1ccc(C(=O)N[C@H]2CCSc3c(F)cccc32)cc1[N+](=O)[O-])c1ccccn1 506087629 SBNAEPPYDIEXJJ-KUHUBIRLSA-N 452.511 5.269 5 20 JKBD Cc1noc(C2CCN(C(=O)c3cc([N+](=O)[O-])ccc3Sc3ccc(Cl)cc3)CC2)n1 509120374 DZCZPGBTUMYAGJ-UHFFFAOYSA-N 458.927 5.111 5 20 JKBD COC(=O)Cc1ccc(NC(=O)C/C(=C\c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)cc1 521251285 ABYMEWHHFNMVJN-XMHGGMMESA-N 487.537 5.489 5 20 JKBD COCc1cccc2sc(NC(=O)c3ccc(N[C@@H](C)c4ccccn4)c([N+](=O)[O-])c3)nc12 521505594 VRNWNLBCRLVWLZ-AWEZNQCLSA-N 463.519 5.171 5 20 JKBD CC[C@H](NCc1ccc(OCc2ccc([N+](=O)[O-])cc2)c(OC)c1)c1ccc2c(c1)OCCO2 521818293 FZTIXVHCVWHBLX-QFIPXVFZSA-N 464.518 5.195 5 20 JKBD C[C@H](Nc1ccc(C(=O)NC(C)(C)c2cccc(C(F)(F)F)c2)cc1[N+](=O)[O-])c1ccccn1 550496055 ZUYJNHUHSHNOCR-HNNXBMFYSA-N 472.467 5.847 5 20 JKBD COc1cc(CNc2ccnn2Cc2ccc(C)s2)ccc1OCc1ccc([N+](=O)[O-])cc1 559739172 ABMWWZKMAXBPFY-UHFFFAOYSA-N 464.547 5.409 5 20 JKBD C[C@@H](Sc1nnc(-c2ccccc2)n1[C@H](C)c1ccccc1)C(=O)Nc1cccc([N+](=O)[O-])c1 603917404 PPRZFSJKCVJYHC-QZTJIDSGSA-N 473.558 5.582 5 20 JKBD C[C@@H](c1ccccc1)n1c(SCc2nc(-c3cccc([N+](=O)[O-])c3)no2)nnc1-c1ccccc1 603917467 SBKGATNDMOSXHB-KRWDZBQOSA-N 484.541 5.805 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Cl)[C@H](NCCCc1nc2c(s1)CCCC2)c1ccccc1 608910301 NHQGEAYAFJMZES-HSZRJFAPSA-N 485.009 5.486 5 20 JKBD CC(C)(C)OC(=O)N1CCCc2cc(NC(=O)Cn3c4ccccc4c(=O)c4ccccc43)ccc21 729409840 CXMICQXCKURPBZ-UHFFFAOYSA-N 483.568 5.481 5 20 JKBD COc1ccc([C@@H](OC(=O)c2csc(-c3cccc([N+](=O)[O-])c3)n2)[C@@H](C)n2cccn2)cc1 729803355 NHTMGZMDIACYCK-VFNWGFHPSA-N 464.503 5.083 5 20 JKBD O=C(Oc1ccc2c(-c3ccc([N+](=O)[O-])cc3)cc(=O)oc2c1)c1cnc(-c2ccccc2)nc1 743608767 QEOKQKIYKFQRMW-UHFFFAOYSA-N 465.421 5.044 5 20 JKBD CC(C)(C(=O)Oc1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2Cl)cc1)c1ccc2c(c1)OCCO2 746762114 LOFYKPLAZORQTK-UHFFFAOYSA-N 496.903 5.155 5 20 JKBD C[C@H](OC(=O)c1ccc(Sc2nncn2C)c([N+](=O)[O-])c1)c1ccccc1-c1ccccc1 748038330 XXDDEWOTACKUOZ-INIZCTEOSA-N 460.515 5.460 5 20 JKBD CC(=O)[C@@H](OC(=O)C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)c1ccccc1 748579056 JTMGYSUAFBXUEU-JIPFHLNWSA-N 472.522 6.009 5 20 JKBD O=C(O[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1)c1ccnc2ccccc12 750041833 NIZGKNKIQCEFJF-JOCHJYFZSA-N 461.861 5.333 5 20 JKBD Cc1cc(-c2cc(C(=O)O[C@H](C)C(=O)Nc3ccc([N+](=O)[O-])cc3Cl)c3c(C)noc3n2)c(C)o1 813318777 DRDLQAGXJZKVTL-CYBMUJFWSA-N 498.879 5.154 5 20 JKBD O=C(OCC(=O)N1CCC[C@@H]1c1ccc(Cl)c(Cl)c1)c1cc(Cl)ccc1[N+](=O)[O-] 918863398 MPIRJFJHUHNYHG-MRXNPFEDSA-N 457.697 5.076 5 20 JKBD CSc1ccc([N+](=O)[O-])c(C(=O)OCC(=O)N2CCC[C@H]2c2ccc(Cl)c(Cl)c2)c1 918921551 QNXGRDOSWVBAPF-KRWDZBQOSA-N 469.346 5.144 5 20 JKBD Cc1ccc2nc(-c3ccc(NC(=O)COC(=O)c4csc([N+](=O)[O-])c4)cc3)sc2c1 919368142 IHMQADUKCFNLIE-UHFFFAOYSA-N 453.501 5.037 5 20 JKBD C[C@@H](Nc1ccc(C(=O)OCc2csc(-c3ccsc3)n2)cc1[N+](=O)[O-])c1ccccn1 920548235 RYWRCZNZUMIINL-CQSZACIVSA-N 466.544 5.705 5 20 JKBD Cc1cc([N+](=O)[O-])ccc1NC(=O)COC(=O)[C@@H](C)SCc1ncc(-c2ccc(Cl)cc2)o1 920672768 IZGNIAALAUZCJG-CQSZACIVSA-N 489.937 5.015 5 20 JKBD Cc1ccc(NC(=O)c2cccc(C(F)(F)F)c2)cc1NC(=O)c1cc([N+](=O)[O-])ccc1N(C)C 920845816 ZQYRVRDWVXCPRC-UHFFFAOYSA-N 486.450 5.493 5 20 JKBD O=C(Cc1ccc(Cl)cc1[N+](=O)[O-])NC1(c2ccc(NC(=O)c3cccnc3Cl)cc2)CCC1 1785752588 KHVZBNXAGASOKL-UHFFFAOYSA-N 499.354 5.287 5 20 JKBD O=C(NC1(c2ccc(NC(=O)c3cc4cc([N+](=O)[O-])ccc4s3)cc2)CCC1)c1ccc[nH]1 1791009940 DZWSSKIYXPJGHX-UHFFFAOYSA-N 460.515 5.199 5 20 JKBD O=C(Cc1cc(F)ccc1[N+](=O)[O-])Nc1ccc(C2(NC(=O)[C@]3(F)CCCC=C3F)CCC2)cc1 1792309123 AESKFHPMVFBREU-VWLOTQADSA-N 487.478 5.156 5 20 JKBD COc1cc(CC(=O)NC2(c3ccc(NC(=O)[C@H](C)c4ccccc4)cc3)CCC2)ccc1[N+](=O)[O-] 1792313292 PCVIMJDYUOFAFD-LJQANCHMSA-N 487.556 5.084 5 20 JKBD CC(C)(C)n1cc(C(=O)NC2(c3ccc(NC(=O)/C=C/c4ccccc4[N+](=O)[O-])cc3)CCC2)cn1 1792315750 YOXQZEYNXXHGHT-NTEUORMPSA-N 487.560 5.007 5 20 JKBD CC(C)(C)CCCCCC(=O)N1CC[C@H](CNC(=O)c2cc(O)cc([N+](=O)[O-])c2)[C@H]1c1cccnc1 1811689782 YMZFOCRENCITAQ-CJFMBICVSA-N 496.608 5.012 5 20 JKBD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2cccc3c2oc2ccccc23)[nH]n1)c1ccc([N+](=O)[O-])o1 1814312846 PZPYWKUTHFWPDA-IBGZPJMESA-N 499.483 5.430 5 20 JKBD Cc1cc(Cl)cc(C(=O)N2CCC([C@@H]3CCCCN3C(=O)c3ccc([N+](=O)[O-])cc3F)CC2)c1 1830497280 CRTDEUDGGLGODI-QHCPKHFHSA-N 487.959 5.243 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cc3ccsc3[nH]2)CC1 1830890222 LQSOCPKHLSNJSB-OAQYLSRUSA-N 498.580 5.132 5 20 JKBD Cc1c(F)cccc1C(=O)N1CCC([C@H]2CCCCN2C(=O)CSc2ccccc2[N+](=O)[O-])CC1 1831775285 KRRQWUVEYVMLQL-JOCHJYFZSA-N 499.608 5.068 5 20 JKBD O=C(/C=C/c1ccccc1[N+](=O)[O-])N1CC2(CCCN2C(=O)c2cc(Cl)c(Cl)c(Cl)c2)C1 1846898835 ODULLFIFSSBPSR-VOTSOKGWSA-N 494.762 5.085 5 20 JKBD O=C(c1ccc(-c2ccc(Cl)cc2)o1)N1CC2(CCCN2C(=O)/C=C/c2ccccc2[N+](=O)[O-])C1 1847057249 ADVWWQYQRKZJGO-MDWZMJQESA-N 491.931 5.039 5 20 JKBD COc1ccc(NC(=O)[C@H](OC(=O)c2ccc([N+](=O)[O-])cc2Cl)c2ccccc2)cc1Cl 11028654 SDYIQNBFHODUKL-HXUWFJFHSA-N 475.284 5.447 5 20 JKBD C[C@H](OC(=O)c1cc(Br)ccc1Cl)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 11481524 ABBQMJGIXPUGMF-QMMMGPOBSA-N 495.635 5.214 5 20 JKBD C[C@H](OC(=O)Cn1c2ccccc2c(=O)c2ccccc21)C(=O)Nc1cc(Cl)ccc1Cl 14846530 FQXKGQXBKNSSJI-AWEZNQCLSA-N 469.324 5.032 5 20 JKBD COc1cc(NC(=O)c2ccc(Sc3nc4ccccc4s3)c([N+](=O)[O-])c2)cc(OC)c1OC 15542602 YKALDRNLKNXSNA-UHFFFAOYSA-N 497.554 5.634 5 20 JKBD CCN(CC)C(=O)c1ccc(CNC(=O)c2ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])cc2)cc1 27465038 XRPJTPIHQRLBIO-UHFFFAOYSA-N 481.936 5.453 5 20 JKBD O=C(Cn1c2ccccc2c(=O)c2ccccc21)NCc1ccccc1-c1ccc(Cn2cccn2)cc1 72089808 IVNBWLXGBJDBRX-UHFFFAOYSA-N 498.586 5.383 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)Nc2ccc(-c3nc4ccc(C)cc4s3)cc2)cc1SC 97546213 OSGPJBHZXCPPNQ-UHFFFAOYSA-N 465.556 6.163 5 20 JKBD C[C@@H](Nc1ccc(C(=O)N[C@H](CC(F)(F)F)c2ccccc2)cc1[N+](=O)[O-])c1ccccn1 409893494 WDVCWHOTNWFPKQ-FOIQADDNSA-N 458.440 5.586 5 20 JKBD NC(=O)c1ccc(F)c(NC(=O)C/C(=C\c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)c1 483152009 CWNFEZXZBADXRK-LFIBNONCSA-N 476.489 5.012 5 20 JKBD Cc1nn(-c2ccc(Cl)cc2Cl)c(C)c1CC(=O)Nc1cc([N+](=O)[O-])ccc1OC(F)F 485874512 XUNUQHNIWVOCML-UHFFFAOYSA-N 485.274 5.487 5 20 JKBD COc1ccc([C@@H](Nc2cc3c(cc2[N+](=O)[O-])CCC(=O)N3)c2ccccc2)cc1Br 488047411 YZAJUZXKCUQFEP-QHCPKHFHSA-N 482.334 5.452 5 20 JKBD Cc1ccc(S(=O)(=O)N(C)C(C)C)cc1NC(=O)c1cc([N+](=O)[O-])ccc1Sc1ccccc1 501653735 FSWAEYSRMDGASY-UHFFFAOYSA-N 499.614 5.336 5 20 JKBD CCCc1ccc([C@H](NC(=O)c2cc(OCC)c(OC)cc2[N+](=O)[O-])c2cccs2)cc1 503241755 BWBUOSOSOCMJQZ-QHCPKHFHSA-N 454.548 5.536 5 20 JKBD CCOc1ccc(Br)cc1CN(C(=O)N[C@@H](C)c1cccc([N+](=O)[O-])c1)C1CC1 509471734 PXDHPLQLIBLUNV-AWEZNQCLSA-N 462.344 5.191 5 20 JKBD C[C@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)NCC1(c2ccc(Cl)cc2Cl)CCOCC1 510108365 KJGIBHPVLNJCEA-AWEZNQCLSA-N 469.390 5.247 5 20 JKBD Cc1nnnn1-c1cccc(NC(=O)C/C(=C/c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)c1 512553758 IPHHUBHKILPXKW-AQTBWJFISA-N 497.540 5.058 5 20 JKBD Cc1cccc(NC(=O)c2ccc(NCc3ccccc3)c([N+](=O)[O-])c2)c1C(=O)N1CCCC1 517306281 OXNQPKUFHHXSKR-UHFFFAOYSA-N 458.518 5.004 5 20 JKBD O=C(CCCc1cccs1)Nc1cccc(C(=O)Nc2cc(-c3cccc([N+](=O)[O-])c3)[nH]n2)c1 523162815 XCFXYZZTNUWRNT-UHFFFAOYSA-N 475.530 5.260 5 20 JKBD Cc1ccc(-c2csc(NC(=O)c3cnc(Sc4nccn4C)c(Cl)c3)n2)cc1[N+](=O)[O-] 524245085 IBOXSTOWSHRLDQ-UHFFFAOYSA-N 486.966 5.212 5 20 JKBD CC1CCN(c2ccc(C(=O)N3CCC[C@@H](c4nc5ccccc5s4)C3)cc2[N+](=O)[O-])CC1 603437324 DYIJPYDQBMGAOV-LJQANCHMSA-N 464.591 5.461 5 20 JKBD Cc1ccc(Sc2ccc(CN[C@@H](c3cccc(F)c3)c3nccn3C)cc2[N+](=O)[O-])cc1 603633422 FPYULCOUMALYMK-DEOSSOPVSA-N 462.550 5.806 5 20 JKBD O=[N+]([O-])c1cc(S(=O)(=O)Nc2ccccc2)ccc1NCc1ccnc(Oc2ccccc2)c1 603859892 CMEGNENNNMHNEB-UHFFFAOYSA-N 476.514 5.195 5 20 JKBD COc1ccccc1N(C)C(=O)C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1 603992134 DMROIBMCMMPOOM-OBGWFSINSA-N 459.527 5.807 5 20 JKBD Cc1ccccc1NC(=O)[C@@H]1CCc2ccccc2N1C(=O)c1cc2cc([N+](=O)[O-])ccc2s1 608872779 QIEGBBMWGJVEFD-QFIPXVFZSA-N 471.538 5.718 5 20 JKBD O=C(Nc1ccccc1OC(F)(F)F)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 612041529 NYXCOSUJLDVVSS-UHFFFAOYSA-N 477.361 5.367 5 20 JKBD C[C@H](NC(=S)/C(=C(/O)c1ccc([N+](=O)[O-])cc1)[n+]1ccccc1)c1ccc(Cl)cc1Cl 726570054 IWVQYPVUBSQOLO-AWEZNQCLSA-O 475.377 5.751 5 20 JKBD CC(C)N(Cc1nnc(-c2cccc([N+](=O)[O-])c2)o1)C(=O)CCc1cccc(OC2CCCC2)c1 729169142 OIMBGYZRDAHMRF-UHFFFAOYSA-N 478.549 5.336 5 20 JKBD O=C(Oc1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2Cl)cc1)c1cnc(-c2ccccc2)nc1 743606939 AIDHJDZYYBDREH-UHFFFAOYSA-N 474.860 5.177 5 20 JKBD Cc1ccc(NC(=O)c2cccc(C(F)(F)F)c2)cc1NC(=O)COc1ccc([N+](=O)[O-])c(F)c1 745775926 QWAPKEPZXZVWIX-UHFFFAOYSA-N 491.397 5.331 5 20 JKBD O=C(C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)OCC(=O)N1CCCCCC1 748578979 CXKBBSPAPOOYCG-XDJHFCHBSA-N 479.558 5.081 5 20 JKBD O=C(Nc1cc(Cl)c([N+](=O)[O-])cc1OCc1ccccc1)C1CCC(NC(=O)C2CCCC2)CC1 751064978 QIMDUVNJASDLEF-UHFFFAOYSA-N 499.995 5.631 5 20 JKBD CC1=C(C(=O)Nc2ccc(F)cc2)[C@H](c2ccc([N+](=O)[O-])o2)NC(=S)N1c1ccc(C)c(F)c1 812990142 YCCHJJBXVNWNGC-NRFANRHFSA-N 484.484 5.123 5 20 JKBD O=[N+]([O-])c1cccc(-c2nc(-c3nc(-c4ccc(OCc5cccnc5)cc4)no3)cs2)c1 904467083 YGNAFROVTOGYFX-UHFFFAOYSA-N 457.471 5.409 5 20 JKBD C[C@@H](OC(=O)c1[nH]c2ccc(Cl)cc2c1Cl)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 915417370 YSDRYPFQQJGNIK-MRVPVSSYSA-N 490.221 5.586 5 20 JKBD COc1ccc(-n2c(SCc3cc(F)ccc3[N+](=O)[O-])nnc2-c2ccccc2OC)cc1 915792139 PIYYZLNXDFNHRU-UHFFFAOYSA-N 466.494 5.291 5 20 JKBD CCOc1ccsc1C(=O)NC1(c2ccc(NC(=O)/C=C/c3ccc([N+](=O)[O-])o3)cc2)CCC1 1786206640 XTVSFIMQLQFHRA-CSKARUKUSA-N 481.530 5.109 5 20 JKBD O=C(Cn1ccc2ccc([N+](=O)[O-])cc21)Nc1ccc(C2(NC(=O)c3ccc(Cl)o3)CCC2)cc1 1786277096 KNXAVWCHCMJQIP-UHFFFAOYSA-N 492.919 5.244 5 20 JKBD Cc1cccnc1CCC(=O)Nc1ccc(C2(NC(=O)c3c(F)ccc([N+](=O)[O-])c3C)CCC2)cc1 1786798440 JXFPOTAMKZTCOG-UHFFFAOYSA-N 490.535 5.126 5 20 JKBD CC1=CC[C@H](C(=O)N2CC[C@@H](CNC(=O)c3cc(Cl)cc([N+](=O)[O-])c3C)[C@H]2c2cccnc2)CC1 1811794814 UQQZYTISZJEKEJ-VAXXYWNWSA-N 496.995 5.018 5 20 JKBD CC(C)(C)CCCCCC(=O)NC[C@H]1CCN(C(=O)/C=C/c2ccc([N+](=O)[O-])o2)[C@@H]1c1cccnc1 1812804565 OXAXNDWNVPBPIL-AAPLMEDBSA-N 496.608 5.299 5 20 JKBD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2cccc3ccccc23)[nH]n1)c1ccc([N+](=O)[O-])cc1F 1821051811 KMBYKKKYVRGEDC-QHCPKHFHSA-N 487.491 5.230 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)N1CCC([C@H]2CCCCN2C(=O)/C=C/C2CCCC2)CC1 1830350376 NDKOEJXLYLVUOG-JYLQPTBZSA-N 471.573 5.022 5 20 JKBD Cc1ccc(/C=C/C(=O)N2CCC([C@@H]3CCCCN3C(=O)c3ccc([N+](=O)[O-])cc3F)CC2)s1 1830497711 LDDVOXKNFASTJF-LBQODKDLSA-N 485.581 5.051 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)N1CCCC[C@@H]1C1CCN(C(=O)C[C@H]2C[C@@H]3CC[C@H]2C3)CC1 1830729037 IVARUTZDQGOQTR-LOCCHRAXSA-N 485.600 5.102 5 20 JKBD Cc1ccc(CSCCC(=O)N2CCCC[C@H]2C2CCN(C(=O)c3ccc([N+](=O)[O-])o3)CC2)cc1 1831747047 NSCHRHQLMOHYRP-QFIPXVFZSA-N 499.633 5.053 5 20 JKBD O=C(Cc1ccccc1Cl)N1CCC([C@H]2CCCCN2C(=O)/C=C/c2ccccc2[N+](=O)[O-])CC1 1832903296 YWRGMDITMZZRHL-JHUUHBRDSA-N 496.007 5.124 5 20 JKBD COc1cc(C(=O)OCC(=O)Nc2c(Cl)c(Cl)cc(Cl)c2Cl)c([N+](=O)[O-])cc1OC 9487305 IZJMLDYWZOCBPR-UHFFFAOYSA-N 498.102 5.021 5 20 JKBD O=C(OCC(=O)N1N=C(c2cc3ccccc3o2)C[C@@H]1c1ccco1)c1ccc([N+](=O)[O-])cc1Cl 24460123 BHCMCANCNXEOFZ-LJQANCHMSA-N 493.859 5.122 5 20 JKBD O=C(COc1ccc2c(-c3ccc([N+](=O)[O-])cc3)cc(=O)oc2c1)Nc1ccc(Cl)cc1 28609973 AWZLHMDUPCFNNF-UHFFFAOYSA-N 450.834 5.039 5 20 JKBD COc1cc([C@H](C)N[C@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2ccccc2)ccc1OC(C)C 30454848 NCOFBYUBEVYILZ-GKVSMKOHSA-N 497.979 6.075 5 20 JKBD O=[N+]([O-])c1cccc(-c2noc(CSc3nnc(-c4ccccc4Cl)n3C3CCCC3)n2)c1 31838260 JEJADFVTNBCERD-UHFFFAOYSA-N 482.953 5.964 5 20 JKBD Cc1ccc(-c2nn(CN(Cc3ccccc3[N+](=O)[O-])CC(F)(F)F)c(=O)c3ccccc23)cc1 71966627 DLBYIQBBBYLWKQ-UHFFFAOYSA-N 482.462 5.302 5 20 JKBD CCOc1cccc2cc([C@H](C)NC(=O)c3cc(OC)c(OCc4cscn4)cc3[N+](=O)[O-])oc12 108910063 MRMZXLFZKRQVIS-AWEZNQCLSA-N 497.529 5.275 5 20 JKBD Cc1nc(C2(NC(=O)C/C(=C/c3ccc([N+](=O)[O-])cc3)c3nc4ccccc4s3)CCCC2)no1 410134919 CBMWOPDNTZXGRZ-JXAWBTAJSA-N 489.557 5.412 5 20 JKBD O=C(C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)Nc1cccc2c[nH]nc12 477043046 ACOXWVZRJOZALT-ATVHPVEESA-N 455.499 5.650 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)Nc2nc(-c3sccc3Br)cs2)cc1SC 482785840 FQXORUAISPFGGS-UHFFFAOYSA-N 486.394 5.525 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)Nc2nc(C3CC3)c(Cc3ccccc3F)s2)cc1SC 483640302 FVPKXOGUSOWDEB-UHFFFAOYSA-N 473.551 5.641 5 20 JKBD O=C(c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-])N1CCCc2cc(OC(F)(F)F)ccc21 485357023 VMQRZNUTXOXALW-UHFFFAOYSA-N 464.318 5.028 5 20 JKBD O=C(Nc1nc2ccccc2n1CCCn1ccnc1)c1ccc(NCc2ccccc2)c([N+](=O)[O-])c1 487351854 JYBTUCBYWJFLGM-UHFFFAOYSA-N 495.543 5.096 5 20 JKBD Cc1ccc(Sc2ccc(C(=O)Nc3ccc(CS(=O)(=O)C(C)C)cc3)cc2[N+](=O)[O-])cc1 497775068 FOKZNWYFQGHYAZ-UHFFFAOYSA-N 484.599 5.630 5 20 JKBD Cc1ccc(C(=O)N2C[C@@H](C)C[C@@H](C)C2)cc1NC(=O)c1csc(-c2cccc([N+](=O)[O-])c2)n1 498777447 BPOAWJCIZBHDNP-IYBDPMFKSA-N 478.574 5.397 5 20 JKBD CCn1c(S[C@@H](C)c2nnc(-c3cccc(Cl)c3)o2)nc2cc3ccccc3cc2c1=O 501423848 OLCZTRRJXAIOQY-AWEZNQCLSA-N 462.962 6.126 5 20 JKBD O=C(NCCNc1ccc([N+](=O)[O-])cc1)Nc1ccc(NC(=O)c2ccccc2)cc1C(F)(F)F 505071300 LLCSRZMTLXFJBB-UHFFFAOYSA-N 487.438 5.100 5 20 JKBD CCn1c([C@H]2CCCN2C(=O)c2ccc(N[C@@H](C)c3ccccn3)c([N+](=O)[O-])c2)nc2ccccc21 506137353 DSHOZNFHVQPJCB-MHECFPHRSA-N 484.560 5.510 5 20 JKBD COCCN(C(=O)c1sc2ccc(F)cc2c1C)c1nc(-c2ccc([N+](=O)[O-])cc2)cs1 506216905 DFYDBSCYCNCHEJ-UHFFFAOYSA-N 471.535 5.674 5 20 JKBD Cc1nn(Cc2ccc(C(=O)Nc3c(-c4cccs4)nc4ccccn34)cc2)c(C)c1[N+](=O)[O-] 509813638 WYPMRGCRPVFABV-UHFFFAOYSA-N 472.530 5.085 5 20 JKBD Cc1ccc(NC(=O)c2cc(OCC(F)(F)F)ccc2[N+](=O)[O-])c(OCC(F)(F)F)c1 511606363 UTILXPHHECFPPO-UHFFFAOYSA-N 452.307 5.038 5 20 JKBD COc1cc(C(=O)N(C)c2ccc(Br)cn2)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 515449974 IOTAJVUARLCWAQ-UHFFFAOYSA-N 492.713 5.483 5 20 JKBD CC(C)CNC(=O)c1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2Sc2ccccc2)cc1Cl 515742755 VXXLZPIRVFHOAV-UHFFFAOYSA-N 483.977 6.038 5 20 JKBD C[C@@H](Nc1ccc(C(=O)N2CCCC[C@H]2c2nc3ccccc3n2C)cc1[N+](=O)[O-])c1ccccn1 517751471 JOFCSGPLDCZWMZ-KOSHJBKYSA-N 484.560 5.417 5 20 JKBD C[C@H](CC(=O)Nc1cccc(N2CCCC2)c1)NCc1ccc(-c2ccc([N+](=O)[O-])cc2)s1 518278458 BXLNUJOLCYPKGV-GOSISDBHSA-N 464.591 5.430 5 20 JKBD O=C(Nc1ccc(OCc2ccccn2)c(Cl)c1)c1ccc(N2CCCC2)c([N+](=O)[O-])c1 520106283 RQFKMAGGDYYKOT-UHFFFAOYSA-N 452.898 5.075 5 20 JKBD O=C(CSc1ccc(C(F)(F)F)cc1[N+](=O)[O-])Nc1ccc(C(=O)Nc2ccccc2)cc1 520918304 RNMGKKIYZMPZCW-UHFFFAOYSA-N 475.448 5.597 5 20 JKBD CC(C)(C)c1ccc(Oc2ccc(CNCc3cccnc3N3CCOCC3)cc2[N+](=O)[O-])cc1 521819377 BXLNBNVBTYNYAH-UHFFFAOYSA-N 476.577 5.206 5 20 JKBD C[C@@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)N1CCC[C@@H](c2nc(-c3ccc(Cl)cc3)no2)C1 523281329 LDPNMPZVQUERCO-UKRRQHHQSA-N 491.331 5.125 5 20 JKBD O=C(Nc1ccc(-c2n[nH]c(C3CC3)n2)cc1)c1cc([N+](=O)[O-])ccc1Sc1ccccc1 523565608 JFYRXQYIROFZHL-UHFFFAOYSA-N 457.515 5.661 5 20 JKBD Cc1ccc(NC(=O)[C@H]2CCc3ccccc3N2C(=O)c2cc3cc([N+](=O)[O-])ccc3o2)cc1 524034599 NWTUZUQGZJIURV-JOCHJYFZSA-N 455.470 5.250 5 20 JKBD COc1cc(OCC(=O)Nc2ccc(OCc3cccc(Cl)c3)cc2C)ccc1[N+](=O)[O-] 524114564 HROLAFRAECJSCF-UHFFFAOYSA-N 456.882 5.162 5 20 JKBD C[C@H]1CCC[C@H](C)N1C(=O)c1cc(Cl)ccc1NC(=O)c1cnn(-c2ccc([N+](=O)[O-])cc2)c1 603738205 GLKJILVWPMAKEZ-HOTGVXAUSA-N 481.940 5.089 5 20 JKBD O=C(c1ccc(Nc2ccccc2)c([N+](=O)[O-])c1)N1C[C@@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1 604262456 JNOJCQOLKOVXIA-OKILXGFUSA-N 461.362 5.541 5 20 JKBD CC[C@@H](NC(=O)C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)c1nc2ccccc2[nH]1 608950324 QMVNYEPZOODVML-PHKMIBKXSA-N 497.580 6.279 5 20 JKBD Cc1ccc2nc([C@H]3CCCN(C(=O)c4ccc(N5CCC(C)CC5)c([N+](=O)[O-])c4)C3)[nH]c2c1 608986693 JZVBXSXFWCZNDS-FQEVSTJZSA-N 461.566 5.036 5 20 JKBD COc1ccc(Sc2ccc(NC(=O)CCCn3c(=O)oc4cc([N+](=O)[O-])ccc43)cc2)cc1 609103514 HEMMNWWTUTYUDX-UHFFFAOYSA-N 479.514 5.081 5 20 JKBD O=C(Nc1cc2c(cc1[N+](=O)[O-])OCCCO2)c1ccc(COc2ccc3ccccc3c2)o1 619214232 MWCXHOMQKMFHGV-UHFFFAOYSA-N 460.442 5.334 5 20 JKBD C[C@@H](OC(=O)c1ccccc1OCc1cccs1)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 730618149 NHXKWASXRXVIGS-CQSZACIVSA-N 451.460 5.203 5 20 JKBD CN(C)c1ccc(C(=O)c2ccccc2C(=O)OCc2ncc(-c3ccc(F)cc3)o2)cc1[N+](=O)[O-] 746144577 CJPDZRPWVIBHKC-UHFFFAOYSA-N 489.459 5.043 5 20 JKBD C[C@@H](OC(=O)c1cc(-c2cccc(Cl)c2)no1)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 748925005 KRWANHOTMGIMEO-SNVBAGLBSA-N 483.786 5.106 5 20 JKBD CSc1ccc([C@@H](CNC(=O)c2cc(F)ccc2[N+](=O)[O-])N2CCc3sccc3C2)cc1 751085795 FDINQHAHLMIJST-OAQYLSRUSA-N 471.579 5.047 5 20 JKBD Cc1cc(C)n(Cc2cccc(-c3noc([C@H](C)Oc4ccc(Cl)cc4[N+](=O)[O-])n3)c2)n1 904531482 XEVANLPCZOAAIS-HNNXBMFYSA-N 453.886 5.300 5 20 JKBD Cc1c([N+](=O)[O-])cc(C(=O)Nc2nc(-c3cccc(C(F)(F)F)c3)cs2)cc1[N+](=O)[O-] 913008847 NUHHGICFKQZSNF-UHFFFAOYSA-N 452.370 5.206 5 20 JKBD O=C(Nc1ccc(NC(=O)c2cc(Cl)ccc2[N+](=O)[O-])c(C(F)(F)F)c1)c1ccccc1F 915871066 VRXDHDITOVMFCM-UHFFFAOYSA-N 481.789 5.911 5 20 JKBD Cc1ccc(C(C)C)c(O[C@H](C)C(=O)O[C@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2C(F)(F)F)c1 919446680 HIZSQMXXSYLDEK-HUUCEWRRSA-N 482.455 5.383 5 20 JKBD CC1(C)CCc2cccc(C(=O)Nc3ccc(C4(NC(=O)c5ccc([N+](=O)[O-])[nH]5)CCC4)cc3)c2O1 1788496336 BELAJBZXSLFNQK-UHFFFAOYSA-N 488.544 5.088 5 20 JKBD O=C(Cc1cccc2ncccc12)NC1(c2ccc(NC(=O)c3cccc(F)c3[N+](=O)[O-])cc2)CCC1 1790699807 NDXGASRDXREISE-UHFFFAOYSA-N 498.514 5.273 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)c3cccc4ccoc34)CCC2)cc1)c1cc(O)cc([N+](=O)[O-])c1 1790757902 LIUCJBPLMCOZER-UHFFFAOYSA-N 471.469 5.108 5 20 JKBD C/C(=C\c1ccc(C)o1)C(=O)NC1(c2ccc(NC(=O)Cc3cc(F)ccc3[N+](=O)[O-])cc2)CCC1 1792308861 UQIMSEOEEBGENT-SAPNQHFASA-N 491.519 5.415 5 20 JKBD O=C(/C=C/c1ccccc1[N+](=O)[O-])Nc1ccc(C2(NC(=O)C(F)(F)c3ccco3)CCC2)cc1 1792317584 XBJUETUXGANOOD-MDWZMJQESA-N 481.455 5.127 5 20 JKBD O=C(/C=C/c1ccc([N+](=O)[O-])o1)Nc1cc([C@@H]2CCCCN2C(=O)[C@@H]2CCC[C@@H]3CCCC[C@@H]32)[nH]n1 1814967796 MXVVFNVFNAJTOT-UXKDAGANSA-N 495.580 5.223 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)Nc1cc([C@@H]2CCCCN2C(=O)CCC2CCCC2)[nH]n1 1821283205 LRJWOLXEHLEFLB-FQEVSTJZSA-N 471.533 5.042 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)N1CCC([C@H]2CCCCN2C(=O)c2c[nH]c(C(C)(C)C)c2)CC1 1825439013 MHVHFEFJWUUKNC-JOCHJYFZSA-N 498.599 5.215 5 20 JKBD COc1cc(C(=O)Nc2nc(-c3ccc4c(c3)CCC4)cs2)c([N+](=O)[O-])cc1OC(F)F 10966480 ZOGCURUJHLEYNW-UHFFFAOYSA-N 461.446 5.069 5 20 JKBD COCCN(C(=O)Cc1csc(-c2ccccc2)n1)c1nc(-c2ccc([N+](=O)[O-])cc2)cs1 14790443 IIDCPOZFMXEJCF-UHFFFAOYSA-N 480.571 5.064 5 20 JKBD CSc1ccc(C(=O)Nc2cccc(S(=O)(=O)Nc3ccc(Cl)cc3)c2)cc1[N+](=O)[O-] 15436944 PRTDNAPRAZDKHB-UHFFFAOYSA-N 477.951 5.023 5 20 JKBD Cc1ccc(NC(=O)[C@H](Sc2nnc(C3CC3)n2Cc2ccco2)c2ccccc2)c([N+](=O)[O-])c1 21623251 FSZSRVPZRPOZPR-JOCHJYFZSA-N 489.557 5.486 5 20 JKBD C[C@H](Sc1nnc(-c2ccc(Cl)cc2)n1Cc1ccco1)C(=O)Nc1ccccc1[N+](=O)[O-] 21743929 OYMINGZGQBMTQJ-AWEZNQCLSA-N 483.937 5.267 5 20 JKBD C[C@@H](N[C@@H]1CCSc2ccc(Cl)cc21)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 25216102 STNMSVVMBAYKHZ-MEBBXXQBSA-N 459.877 5.421 5 20 JKBD NC(=O)c1cc(NC(=O)c2ccc(Sc3nc4ccccc4s3)c([N+](=O)[O-])c2)ccc1Cl 29017812 ZYEMZOLBHADABJ-UHFFFAOYSA-N 484.946 5.360 5 20 JKBD COCCOc1ccc(NC(=O)C/C(=C/c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)cc1 29214047 MFATZBIVTMIHHW-MNDPQUGUSA-N 489.553 5.799 5 20 JKBD C[C@H](Nc1ccc(C(=O)N2CCC[C@@H]2c2cccc(Br)c2)cc1[N+](=O)[O-])c1ccccn1 410088392 PDJVBJZTMVGLFX-KSFYIVLOSA-N 495.377 5.903 5 20 JKBD CCn1ncc2c(C(=O)N(Cc3ccccc3[N+](=O)[O-])CC(F)(F)F)cc(-c3ccccc3)nc21 486072932 YEAPZHYWGZNPRA-UHFFFAOYSA-N 483.450 5.231 5 20 JKBD O=C(C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)Nc1cccc(NC(=O)C2CC2)c1 490672786 QNLAQOULYVIWEC-XMHGGMMESA-N 498.564 6.122 5 20 JKBD CC(C)CCOC1CCN(C(=O)C/C(=C/c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)CC1 500563977 KPQOTLKEHGWQMW-FXBPSFAMSA-N 493.629 6.189 5 20 JKBD O=C(C[C@@H]1C=CCC1)Nc1ccccc1NC(=O)c1ccc(NCc2ccccc2)c([N+](=O)[O-])c1 500901885 GTRSIMQZLNNUCU-LJQANCHMSA-N 470.529 5.754 5 20 JKBD O=C(Nc1cc([N+](=O)[O-])ccc1OC(F)F)[C@@H]1C[C@H]2CCCC[C@@H]2N1C(=O)c1ccc(Cl)cc1 508927858 OVLUKKDLHMXAPU-CCKFTAQKSA-N 493.894 5.262 5 20 JKBD CC(C)OCc1ccc(N[C@@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2ccccc2)cc1 513209404 IOIJYJLGCVVKHY-HSZRJFAPSA-N 453.926 5.965 5 20 JKBD C[C@H](NCc1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1)c1ccc(S(=O)(=O)N(C)C)cc1 513632105 NAQAGKMNASEDHE-INIZCTEOSA-N 489.981 5.142 5 20 JKBD CCOc1cc([N+](=O)[O-])c(C(=O)N[C@H](C)c2ccc(OCc3cccc(C)c3)cc2)cc1OC 524097036 XADQYHGDWIJOKM-GOSISDBHSA-N 464.518 5.381 5 20 JKBD Cc1c(NC(=O)[C@H](C)Sc2nnc(-c3ccccc3)n2-c2ccccc2)cccc1[N+](=O)[O-] 597217861 IYNMZVRFLCCIGV-KRWDZBQOSA-N 459.531 5.270 5 20 JKBD Cc1ccccc1-c1nnc(S[C@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2C)n1Cc1ccco1 598612517 VXVSBGUSAOLEJY-QGZVFWFLSA-N 477.546 5.231 5 20 JKBD O=C(CC1CCN([C@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2ccccc2)CC1)NC1CCCC1 604415775 DEXQNDRLYRNJJQ-VWLOTQADSA-N 499.011 5.089 5 20 JKBD COc1ccc(CC(=O)Nc2cccc(C(=O)Nc3cccc(C(F)(F)F)c3)c2)cc1[N+](=O)[O-] 609009071 AKOAVRBTIHSAAV-UHFFFAOYSA-N 473.407 5.056 5 20 JKBD CC(C)c1nc(C(=O)O[C@H](C(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)c2ccccc2)cs1 726689324 JXLDHCORLNYFQS-SFHVURJKSA-N 459.911 5.365 5 20 JKBD O=C(Nc1ncc(Cc2ccc(Br)cc2)s1)c1cc([N+](=O)[O-])ccc1Br 751073615 JLHOBLRNBYOGAJ-UHFFFAOYSA-N 497.168 5.419 5 20 JKBD O=C(Nc1cc([N+](=O)[O-])c(F)cc1F)[C@@H]1C[C@H]2CCCC[C@H]2N1C(=O)c1ccc2ccccc2c1 751073763 UECDSKIPOGLARC-BSDZUQITSA-N 479.483 5.438 5 20 JKBD O=[N+]([O-])c1ccc(Sc2nnc(-c3ccccc3F)n2Cc2ccccc2)c([N+](=O)[O-])c1 799949963 AIFFGBBTWGFONL-UHFFFAOYSA-N 451.439 5.100 5 20 JKBD O=[N+]([O-])c1cccc(-c2nc(-c3nc(-c4cccc(OCc5cccnc5)c4)no3)cs2)c1 904499168 AHFXFSPFGLQFDY-UHFFFAOYSA-N 457.471 5.409 5 20 JKBD Cc1onc(-c2c(Cl)cccc2Cl)c1C(=O)OCC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-] 913350423 NSRTUCCCAUGYSA-UHFFFAOYSA-N 484.679 5.314 5 20 JKBD COc1ccc([C@H]2[C@@H](C(=O)Nc3cc([N+](=O)[O-])ccc3OC)CCC(=O)N2c2ccc(C)cc2)cc1 916665260 QHLBIZHGUIMXSC-NVQXNPDNSA-N 489.528 5.043 5 20 JKBD C[C@H](Nc1ccc(C(=O)OCc2csc(-c3ccccn3)n2)cc1[N+](=O)[O-])c1ccccn1 920548815 UFJMLDRHNQSADA-HNNXBMFYSA-N 461.503 5.038 5 20 JKBD Cc1ccc2[nH]cc(CC(=O)Nc3ccc(C4(NC(=O)/C=C/c5ccc([N+](=O)[O-])o5)CCC4)cc3)c2c1 1786781779 FJPJFZSVQIMETJ-DHZHZOJOSA-N 498.539 5.368 5 20 JKBD COc1ccc(CC(=O)Nc2ccc(C3(NC(=O)c4ccc5ccoc5c4)CCC3)cc2)c([N+](=O)[O-])c1 1790572171 PLFOJXLZGMTXSE-UHFFFAOYSA-N 499.523 5.340 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)C3(c4cccc([N+](=O)[O-])c4)CCC3)CCC2)cc1)[C@@H]1C[C@@]1(F)Cl 1791675146 QBMZLYRVSGMJOB-CPJSRVTESA-N 485.943 5.075 5 20 JKBD Cc1ccsc1C(=O)N1CCCC2(CCN(C(=O)c3cc(Cl)cc([N+](=O)[O-])c3C)CC2)C1 1808082565 UJYISIHEJBABHD-UHFFFAOYSA-N 475.998 5.085 5 20 JKBD CC1(C)CCC(CC(=O)N2CC[C@H](CNC(=O)c3ccc([N+](=O)[O-])cc3F)[C@H]2c2cccnc2)CC1 1810749581 KOQMMFNHPBBVFE-CJFMBICVSA-N 496.583 5.055 5 20 JKBD CC1(C)CCC(CC(=O)Nc2cc([C@H]3CCCCN3C(=O)Cc3cc([N+](=O)[O-])ccc3F)[nH]n2)CC1 1820974949 IXXVFVYMQICKJJ-JOCHJYFZSA-N 499.587 5.298 5 20 JKBD C[C@H](C(=O)Nc1cc([C@@H]2CCCCN2C(=O)Cc2ccc(Cl)cc2[N+](=O)[O-])[nH]n1)c1ccccc1 1823492495 XLLHWQCEPLWTGB-KKSFZXQISA-N 495.967 5.010 5 20 JKBD O=C(CCC1CCCC1)N1CCC([C@H]2CCCCN2C(=O)Cc2ccc(Cl)cc2[N+](=O)[O-])CC1 1824160286 BJTHEBSFEJZQQX-HSZRJFAPSA-N 490.044 5.381 5 20 JKBD O=C(c1cc2cc([N+](=O)[O-])ccc2s1)N1CCC([C@H]2CCCCN2C(=O)C[C@@H]2CCCCO2)CC1 1824913451 NCLPUUREQRUBST-FCHUYYIVSA-N 499.633 5.002 5 20 JKBD Cc1ccc(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3cc(Cl)cc([N+](=O)[O-])c3C)CC2)nc1C 1825621253 YELUNDCYKCUFJV-HSZRJFAPSA-N 499.011 5.116 5 20 JKBD O=C(CCc1cccc([N+](=O)[O-])c1)N1CCC([C@@H]2CCCCN2C(=O)c2sccc2Cl)CC1 1829443351 MQPHRXCJHLLEAP-NRFANRHFSA-N 490.025 5.176 5 20 JKBD O=C(c1sccc1F)N1CCC([C@H]2CCCCN2C(=O)C2(c3cccc([N+](=O)[O-])c3)CCC2)CC1 1830291529 PAXIKBDQANMUIG-JOCHJYFZSA-N 499.608 5.151 5 20 JKBD Cc1ccoc1C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cc(Cl)cc([N+](=O)[O-])c2C)CC1 1830735335 JFMACSMVNNPOHG-FQEVSTJZSA-N 473.957 5.005 5 20 JKBD C[C@@H](C(=O)N1CCC([C@@H]2CCCCN2C(=O)/C=C/c2ccccc2[N+](=O)[O-])CC1)c1cccs1 1832903416 BWBSFMRDSALGIS-FYYCGKGUSA-N 481.618 5.093 5 20 JKBD CC(C)Cn1c(S[C@@H](C)C(=O)Nc2cc([N+](=O)[O-])ccc2Cl)nnc1-c1ccccc1F 3457657 AJQOMBOQIKLQHZ-ZDUSSCGKSA-N 477.949 5.421 5 20 JKBD Cc1ccc(CN(CCc2ccccc2)C(=O)c2ccc(Sc3nncn3C)c([N+](=O)[O-])c2)s1 19296285 PJUNTZMCIQQAMM-UHFFFAOYSA-N 493.614 5.130 5 20 JKBD Cc1c(NC(=O)[C@@H](C)Sc2ncc(-c3ccccc3)n2C[C@H]2CCCO2)cccc1[N+](=O)[O-] 28752009 MMTIRXRNOJFRJR-IEBWSBKVSA-N 466.563 5.065 5 20 JKBD O=C(c1ccccc1Sc1ccc(C(F)(F)F)cc1[N+](=O)[O-])N1CCN(c2nccs2)CC1 29986899 DXDXYWHQTPDRPS-UHFFFAOYSA-N 494.520 5.184 5 20 JKBD Cc1sc(C(=O)N[C@@H](c2ccccc2)c2ccc3nc(C(F)(F)F)[nH]c3c2)cc1[N+](=O)[O-] 32451689 LYQLIWCGSSFCRQ-SFHVURJKSA-N 460.437 5.379 5 20 JKBD CC1CCN(Cc2csc(NC(=O)c3ccc(N[C@H](C)c4ccccn4)c([N+](=O)[O-])c3)n2)CC1 72016713 FUARGQSBTCQIGM-QGZVFWFLSA-N 480.594 5.104 5 20 JKBD O=[N+]([O-])c1ccc(Oc2ccc([N+](=O)[O-])cc2-c2cccc(Cl)c2)c(-c2cccc(Cl)c2)c1 95935335 UVYWMLHNIHMHNY-UHFFFAOYSA-N 481.291 7.936 5 20 JKBD Cc1cc(C(=O)N2CCC[C@@H](C)C2)ccc1NC(=O)CCNc1ccc(C(F)(F)F)cc1[N+](=O)[O-] 195703813 YAACKOJPBQSMLA-OAHLLOKOSA-N 492.498 5.235 5 20 JKBD O=C(N[C@H](c1ccccc1)c1ccc(Br)cc1)C1CCN(c2ccccc2[N+](=O)[O-])CC1 303047726 QZSNDHLJQWWMFD-XMMPIXPASA-N 494.389 5.480 5 20 JKBD C[C@@H](c1cccc(C(F)(F)F)c1)N(C)C(=O)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-] 481194677 AFFNKFHOFNKHMK-NSHDSACASA-N 450.335 5.388 5 20 JKBD O=C(NC1CCN(C(=O)CCc2ccccc2)CC1)c1cc([N+](=O)[O-])ccc1Sc1ccccc1 482748630 DDIMFDQPJCOWGE-UHFFFAOYSA-N 489.597 5.100 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)N[C@H]2CCOc3c(-c4ccccc4)cccc32)cc1SC 483580703 RPZOAXDGMUZRQT-IBGZPJMESA-N 450.516 5.246 5 20 JKBD COc1ccc(CN[C@H](c2ccc3c(c2)OCCO3)C2CC2)cc1OCc1ccc([N+](=O)[O-])cc1 507939841 JHYKCPPMYCBAGA-MHZLTWQESA-N 476.529 5.195 5 20 JKBD Cc1nn(Cc2ccc(C(=O)N(C3CC3)[C@H](C)c3ccccc3Cl)cc2)c(C)c1[N+](=O)[O-] 512081362 BCAKEZHEBQKPQG-MRXNPFEDSA-N 452.942 5.476 5 20 JKBD O=C(CCc1nc(-c2ccccn2)no1)Nc1cc([N+](=O)[O-])ccc1Nc1cccc(C(F)(F)F)c1 512197197 ALIMFXPRUJGYDJ-UHFFFAOYSA-N 498.421 5.374 5 20 JKBD Cc1ccc(NS(=O)(=O)c2ccc(NCc3ccc(N4CCCCC4)nc3)c([N+](=O)[O-])c2)c(C)c1 515550092 BVNNNSKVTPCBLM-UHFFFAOYSA-N 495.605 5.010 5 20 JKBD C[C@H]1CCCN(Cc2ccc(NC(=O)c3ccc(N[C@@H](C)c4ccccn4)c([N+](=O)[O-])c3)cc2)C1 516172872 DSKJIGYXKSWQHQ-PMACEKPBSA-N 473.577 5.647 5 20 JKBD C[C@@H](NC(=O)CSc1ccc(C(F)(F)F)cc1[N+](=O)[O-])c1cccc(OCc2ccccn2)c1 517723081 NHBLNSDFIIARQJ-OAHLLOKOSA-N 491.491 5.557 5 20 JKBD Cc1c(NC(=O)c2ccc(Nc3ccccc3)c([N+](=O)[O-])c2)cccc1C(=O)N1CCSCC1 523326828 HXRDPZNACWOXMA-UHFFFAOYSA-N 476.558 5.088 5 20 JKBD CCOc1cc(NC(=O)N2CCC[C@H]2c2nc3ccccc3s2)c([N+](=O)[O-])cc1OCC 603651439 PPSNLBDASBQUEM-INIZCTEOSA-N 456.524 5.371 5 20 JKBD O=C(c1c2c(nc3ccccc13)/C(=C\c1cccc([N+](=O)[O-])c1)CCC2)N1CC[C@H](N2CCCC2)C1 608905713 IDFWCFOCYKADRC-RVQWUSFHSA-N 482.584 5.330 5 20 JKBD Cc1ccc(-c2nsc(NC(=O)c3ccc(N[C@@H](C)c4ccccn4)c([N+](=O)[O-])c3)n2)s1 608944853 JOVTXMLVTHSYMV-ZDUSSCGKSA-N 466.548 5.304 5 20 JKBD COc1cc(C(=O)N2C[C@H](c3ccccc3)OC[C@H]2C)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 608966343 IXMKDHFJUQAVDD-VOIUYBSRSA-N 482.920 5.651 5 20 JKBD CSc1ccc([N+](=O)[O-])c(C(=O)Nc2c(-c3ccc(Cl)cc3)c(C(F)(F)F)nn2C)c1 609026660 XUVHUPJNJWPWDZ-UHFFFAOYSA-N 470.860 5.642 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)N[C@H]2c3cc(Br)ccc3SC[C@H]2C)cc1SC 609218991 BAQRKUBPBVEPCW-MLCYQJTMSA-N 483.409 5.301 5 20 JKBD Cc1c(NC(=O)Cn2c3ccccc3c(=O)c3ccccc32)cccc1-c1nnc2n1CCCCC2 614672972 CJKFYAUEAVDNBZ-UHFFFAOYSA-N 477.568 5.087 5 20 JKBD Cc1cc(C(=O)O[C@@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)c2cc(Br)ccc2n1 725975951 VZPUGOHNEQKJOL-LBPRGKRZSA-N 483.278 5.182 5 20 JKBD CCN(C(=O)c1ccc(Br)c([N+](=O)[O-])c1)[C@H](c1cccnc1)c1ccc(F)c(F)c1 729244770 HJOABNRKJRRXNF-FQEVSTJZSA-N 476.277 5.282 5 20 JKBD CSc1ccc(C(=O)c2ccccc2C(=O)N2CCC(c3cc4ccccc4[nH]3)CC2)cc1[N+](=O)[O-] 744045880 NXFQJBLADHYJNZ-UHFFFAOYSA-N 499.592 6.049 5 20 JKBD C[C@H](OC(=O)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-])c1ccccc1NC(=O)c1ccccc1 748018082 DHSWHTSDFYPYDB-HNNXBMFYSA-N 488.418 5.706 5 20 JKBD Cc1c(NC(=O)c2cc([N+](=O)[O-])ccc2N2CCC(C)CC2)cccc1C(=O)Nc1ccccc1 748198665 FBAYQLSZQXJXIG-UHFFFAOYSA-N 472.545 5.644 5 20 JKBD CC(C)(C)OC(=O)N1CCC[C@@H]1[C@H]1CCCN(C(=O)c2ccc(C(C)(C)C)c([N+](=O)[O-])c2)C1 749644098 BETQVMKYYPRKSU-AZUAARDMSA-N 459.587 5.144 5 20 JKBD CCOC(=O)/C(=C\c1ccc(-c2ccccc2[N+](=O)[O-])s1)c1nc(O)c2c(C)c(C)sc2n1 810225373 BYMCSJDVLHQMBA-WJDWOHSUSA-N 481.555 5.754 5 20 JKBD Cc1c(Br)cc(-c2nc(-c3ccc(-n4cnc5ccccc54)nc3)no2)cc1[N+](=O)[O-] 904487660 KTCPOAWAKIIVPZ-UHFFFAOYSA-N 477.278 5.117 5 20 JKBD Cc1ccc(-c2nc(C)c(C(=O)N(Cc3nnc(-c4cccc([N+](=O)[O-])c4)o3)C(C)C)s2)o1 915135429 JMURFPYJWXSDOR-UHFFFAOYSA-N 467.507 5.029 5 20 JKBD C[C@H](NC(=O)c1ccccc1NC(=O)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-])c1ccccc1 915812694 LIOYPADZPNZDPO-HNNXBMFYSA-N 487.434 5.279 5 20 JKBD C[C@H](OC(=O)c1nc(-c2ccccc2)cs1)C(=O)Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1 919122740 KVFINACNZPLBGC-ZDUSSCGKSA-N 480.527 5.026 5 20 JKBD COC(=O)N(C)c1ccc(NC(=O)c2ccccc2C(=O)c2ccc(SC)c([N+](=O)[O-])c2)cc1 919894154 ZOTPSYORVZVJBN-UHFFFAOYSA-N 479.514 5.003 5 20 JKBD CCO[C@@H](C(=O)O[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1)c1ccccc1 920690134 ZFQBEUCMCNOMIP-FGZHOGPDSA-N 468.893 5.249 5 20 JKBD C[C@H](NC(=O)c1cc([N+](=O)[O-])ccc1Sc1ccccc1)c1ccc(N2CCCC2=O)cc1 920944821 FOSNWGDHIVJSJF-KRWDZBQOSA-N 461.543 5.364 5 20 JKBD O=C(OCc1nc2ccccc2c2ccccc12)[C@H]1CS[C@]2(c3ccc(F)cc3)CCC(=O)N12 921265330 WPJFIDVNKALFQW-SQHAQQRYSA-N 472.541 5.161 5 20 JKBD Cc1nc(C(=O)Nc2ccc(C3(NC(=O)Cc4ccc(Cl)cc4[N+](=O)[O-])CCC3)cc2)ccc1F 1787073504 CEJFMJXGBRFHDS-UHFFFAOYSA-N 496.926 5.081 5 20 JKBD Cc1ncsc1C(=O)Nc1ccc(C2(NC(=O)c3cc(Cl)cc([N+](=O)[O-])c3C)CCC2)cc1 1787424137 REBBBYSGTLWJQC-UHFFFAOYSA-N 484.965 5.383 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)c3ccc([N+](=O)[O-])cc3F)CCC2)cc1)c1cc2sccn2c1 1788411963 BHVNCWWLFJUTIE-UHFFFAOYSA-N 478.505 5.110 5 20 JKBD Cc1c(Br)cc(C(=O)NC2(c3ccc(NC(=O)c4ccc[nH]4)cc3)CCC2)cc1[N+](=O)[O-] 1789685165 NMBSCLUSASXKJT-UHFFFAOYSA-N 497.349 5.055 5 20 JKBD Cc1ccc(CC(=O)Nc2ccc(C3(NC(=O)c4cc5sccn5c4)CCC3)cc2)cc1[N+](=O)[O-] 1790526409 XLUFSVJWOLPOGU-UHFFFAOYSA-N 488.569 5.208 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)Nc1ccc(C2(NC(=O)/C=C/c3ccoc3)CCC2)cc1 1790771177 VFJYGTZLBIYXEF-XCVCLJGOSA-N 463.465 5.096 5 20 JKBD Cc1ncc(CC(=O)Nc2ccc(C3(NC(=O)c4cc(Cl)cc([N+](=O)[O-])c4C)CCC3)cc2)s1 1791839589 XSCZPAKFOZZSML-UHFFFAOYSA-N 498.992 5.312 5 20 JKBD CCCCC[C@@H](C)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)CSc2ccccc2[N+](=O)[O-])n[nH]1 1822313048 KAWZMDOYUHAFEZ-IEBWSBKVSA-N 487.626 5.319 5 20 JKBD CCC(C)(C)C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cccc(Br)c2[N+](=O)[O-])CC1 1830697538 HDURHWCPMNFPAQ-LJQANCHMSA-N 494.430 5.027 5 20 JKBD CC(C)C1(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)Cc3ccc(Cl)cc3[N+](=O)[O-])CC2)CCC1 1832489072 OVCXTRJGRHCNBW-JOCHJYFZSA-N 490.044 5.237 5 20 JKBD C[C@@H](OC(=O)Cn1c2ccccc2c(=O)c2ccccc21)c1nc(-c2cccc(C(F)(F)F)c2)no1 10723573 ANMUOWQVAJGKRV-OAHLLOKOSA-N 493.441 5.528 5 20 JKBD Cc1nn(-c2ccc(C(=O)O[C@@H](C)c3nnc(-c4ccc([N+](=O)[O-])cc4)o3)cc2)c(C)c1Cl 17534222 AAABRBSNZYIMEO-AWEZNQCLSA-N 467.869 5.019 5 20 JKBD Cc1ccc(NC(=O)[C@@H](Sc2nnc(NCC(C)C)s2)c2ccccc2)c([N+](=O)[O-])c1 18663723 NGSDOVUEAKBHCX-SFHVURJKSA-N 457.581 5.295 5 20 JKBD C[C@H](N[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1)c1ccc2c(c1)OCO2 30500784 LPVGRRRVCMYFHJ-FPTDNZKUSA-N 453.882 5.008 5 20 JKBD O=C(CSc1nc(-c2ccco2)nc2ccccc12)Nc1ccc([N+](=O)[O-])cc1Br 45670858 ROUANXPZTRGRHQ-UHFFFAOYSA-N 485.319 5.291 5 20 JKBD COc1ccc(C(=O)N(C)C)cc1NC(=O)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1 59800799 DNRYXYGMYKJHLZ-UHFFFAOYSA-N 469.881 5.003 5 20 JKBD O=C(CSc1ccc(C(F)(F)F)cc1[N+](=O)[O-])Nc1cccc(NC(=O)Nc2ccccc2)c1 105562013 CZIBOJVHCHPEOZ-UHFFFAOYSA-N 490.463 5.988 5 20 JKBD Cc1cc(C(=O)N2CCCC2)ccc1NC(=O)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1 216195344 MOOVANQQUJHISM-UHFFFAOYSA-N 479.920 5.837 5 20 JKBD COc1ccc2ccccc2c1CNC(=O)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 219547285 SKJZUNVKLFOFBC-UHFFFAOYSA-N 487.478 5.308 5 20 JKBD Cc1nn(Cc2ccc(C(=O)Nc3ccc(F)c(NC(=O)c4ccoc4C)c3)cc2)c(C)c1[N+](=O)[O-] 479827542 CIIBPOSXHWZDAZ-UHFFFAOYSA-N 491.479 5.002 5 20 JKBD COc1ccc(NC(=O)Cn2c3ccccc3c(=O)c3ccccc32)cc1NC(=O)c1cccc(F)c1 482469292 ZYQBTUTUZTVVES-UHFFFAOYSA-N 495.510 5.193 5 20 JKBD CCC(=O)Nc1ccc(Cl)c(NC(=O)c2cc([N+](=O)[O-])ccc2Sc2ccccc2)c1 500911538 RGQUTBBPYGQQAA-UHFFFAOYSA-N 455.923 6.000 5 20 JKBD Cc1cccc(-c2nc(C(C)C)no2)c1NC(=O)c1ccc(N2C[C@@H](C)C[C@H](C)C2)c([N+](=O)[O-])c1 508754773 AHRDHGDCXUMIAJ-IRXDYDNUSA-N 477.565 5.811 5 20 JKBD CCC(=O)Nc1ccc(Cl)c(NC(=O)c2ccc(NCc3ccccc3)c([N+](=O)[O-])c2)c1 509406533 GYVFKAQTTULPBE-UHFFFAOYSA-N 452.898 5.461 5 20 JKBD Cc1sc2nc(S[C@H](C)c3cccc([N+](=O)[O-])c3)n(Cc3ccccn3)c(=O)c2c1C 515840219 JFJHRFIQKPKGER-OAHLLOKOSA-N 452.561 5.280 5 20 JKBD O=C(C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)N1CCC[C@H]1c1ccccn1 516667712 QGPIHKLISLJBOF-BBIZSYTBSA-N 470.554 5.894 5 20 JKBD COc1ccc([N+](=O)[O-])c(C(=O)Nc2cc(NC(=O)c3cccc(C(F)(F)F)c3)ccc2C)c1 519954211 XASPFNUYCIIBKQ-UHFFFAOYSA-N 473.407 5.435 5 20 JKBD CCOC(=O)c1csc(NC(=O)c2ccccc2Sc2ccc(C(F)(F)F)cc2[N+](=O)[O-])n1 600843587 KUSFQVFMTSCRBL-UHFFFAOYSA-N 497.476 5.650 5 20 JKBD CCCn1c(C)cc(-c2csc(NC(=O)[C@H]3CCCN3C(=O)c3ccc([N+](=O)[O-])c(C)c3)n2)c1C 608802216 ZVFYJTNMKXHBAY-JOCHJYFZSA-N 495.605 5.098 5 20 JKBD COc1ccc(Oc2ccc([N+](=O)[O-])cc2C(=O)Nc2cc(C(=O)NC(C)C)ccc2Cl)cc1 608938932 YIHZMNMNHHCZSY-UHFFFAOYSA-N 483.908 5.440 5 20 JKBD CCC[C@@H](NC(=O)N1CCN(Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)CC1)c1ccccn1 609150577 BHUUAQZQAHDIOP-JOCHJYFZSA-N 479.606 5.087 5 20 JKBD O=[N+]([O-])c1cc(C(F)(F)F)ccc1Sc1nnc(-c2ccc(F)cc2)n1C[C@H]1CCCO1 619714556 FEUCRNKMPCMDOC-OAHLLOKOSA-N 468.432 5.341 5 20 JKBD COc1ccc([N+](=O)[O-])cc1C(=O)Nc1cc(C(F)(F)F)ccc1NC(=O)OC(C)(C)C 727790645 NYPVTLCVAGSOFY-UHFFFAOYSA-N 455.389 5.222 5 20 JKBD C[C@@H](OC(=O)c1cnc(-c2ccccc2Cl)s1)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 747953987 VLNXIRWJOAPIJK-LLVKDONJSA-N 456.867 5.340 5 20 JKBD C[C@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)Nc1ccc(N2CCc3sccc3C2)cc1 748648168 AOZMOYUOHJVYQM-AWEZNQCLSA-N 457.939 5.278 5 20 JKBD CC(=O)N1CCc2cc(C(=O)[C@H](C)Sc3nc4ccccc4c4nc5ccccc5n34)ccc21 752757999 NCZGZDGHBVHEJY-INIZCTEOSA-N 466.566 5.308 5 20 JKBD CC(C)N(Cc1nnc(-c2cccc([N+](=O)[O-])c2)o1)C(=O)CSc1ccc2ccccc2c1 754775854 VXCURZNBNATKJO-UHFFFAOYSA-N 462.531 5.327 5 20 JKBD COc1cc(COC(=O)c2cc(-c3ccccc3)nc3onc(C)c23)c([N+](=O)[O-])cc1OC(F)F 813300941 QUFGUFYRGLUYAK-UHFFFAOYSA-N 485.399 5.073 5 20 JKBD Cc1cc(-c2cc(C(=O)OCC(=O)Nc3ccccc3[N+](=O)[O-])c3cnn(C(C)C)c3n2)c(C)s1 836609392 NKAOOWBEJWTXIW-UHFFFAOYSA-N 493.545 5.061 5 20 JKBD C[C@@H](OC(=O)CCOc1ccccc1-c1ccccc1)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl 914998953 CIIDSPJPKGNUST-MRXNPFEDSA-N 468.893 5.255 5 20 JKBD O=C(NCc1ccccc1[N+](=O)[O-])c1ccccc1Sc1ccc(C(F)(F)F)cc1[N+](=O)[O-] 916423481 UKQRSCQWAIQDTP-UHFFFAOYSA-N 477.420 5.603 5 20 JKBD Cc1ccc(/C(O)=C(/C(=S)Nc2cccc(C(C)C)c2)n2ccc(=[N+](C)C)cc2)cc1[N+](=O)[O-] 917613853 SEBMEXIKSCPSJG-UHFFFAOYSA-O 477.610 5.183 5 20 JKBD O=C(OCc1cc([N+](=O)[O-])cc2c1OCOC2)c1csc(-c2ccc(Cl)cc2Cl)n1 921224510 QCHZUPPYINBBCL-UHFFFAOYSA-N 467.286 5.249 5 20 JKBD COc1ccc(NC(=O)c2c(NC(=O)c3cc(Cl)ccc3[N+](=O)[O-])sc3c2CCCC3)cc1 929065724 WSCIPTXRPLNROW-UHFFFAOYSA-N 485.949 5.702 5 20 JKBD Cc1[nH]ccc1C(=O)Nc1ccc(C2(NC(=O)c3cc4cc([N+](=O)[O-])ccc4s3)CCC2)cc1 1788809456 PREFENLCLCDKRI-UHFFFAOYSA-N 474.542 5.508 5 20 JKBD CC[C@@H](C)[C@@H](C(=O)N1CCCC2(CCN(C(=O)/C=C/c3ccc([N+](=O)[O-])o3)CC2)C1)c1ccccc1 1809152814 GXFKNYHIGDKNQY-AAPLMEDBSA-N 493.604 5.262 5 20 JKBD CC1(C)CCC(CC(=O)N2CC[C@H](CNC(=O)c3cccc(F)c3[N+](=O)[O-])[C@H]2c2cccnc2)CC1 1811320012 GGAMLKCDBKIZCF-HYBUGGRVSA-N 496.583 5.055 5 20 JKBD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)[nH]n1)c1ccc(F)cc1 1820556995 HBWJYEUPPIHUSI-IBGZPJMESA-N 493.520 5.291 5 20 JKBD O=C(Nc1cc([C@@H]2CCCCN2C(=O)CCc2cccc([N+](=O)[O-])c2)[nH]n1)c1cc(F)cc(Cl)c1 1823207664 ABYOJEQNKDTGLI-NRFANRHFSA-N 499.930 5.049 5 20 JKBD O=C(/C=C/C1CCCCC1)N1CCC([C@@H]2CCCCN2C(=O)Cc2cc([N+](=O)[O-])ccc2F)CC1 1824949495 NVPYKACBQUDLSD-OPATVPMHSA-N 485.600 5.033 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2ccc3ccoc3c2)CC1 1830912118 NQJZCJWHONFSDP-QHCPKHFHSA-N 493.535 5.336 5 20 JKBD C[C@H]1CC[C@H](C(=O)N2CCC([C@H]3CCCCN3C(=O)/C=C/c3ccccc3[N+](=O)[O-])CC2)CC1 1832903437 CEJYZPUYIXQMPO-ZBEUAWRESA-N 467.610 5.054 5 20 JKBD Cc1ccc(NC(=O)[C@@H](Sc2nnc(-c3c[nH]c4ccccc34)o2)c2ccccc2)c([N+](=O)[O-])c1 11346835 SGXBGTKCRNCCFH-QFIPXVFZSA-N 485.525 5.907 5 20 JKBD COc1ccc(NC(=O)[C@@H](C)OC(=O)[C@H](Sc2ccccc2)c2ccccc2)c([N+](=O)[O-])c1 15815208 UGEAYTBWKFVOSR-OPAMFIHVSA-N 466.515 5.007 5 20 JKBD CC(=O)Nc1ccc(NC(=O)c2ccc(Sc3nc4ccccc4s3)c([N+](=O)[O-])c2)cc1 16019641 DASBGMHPBTXZQP-UHFFFAOYSA-N 464.528 5.566 5 20 JKBD Cc1nc(S[C@@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)c2cc(-c3ccccc3)sc2n1 17661176 PKBVECXORZAYEN-ZDUSSCGKSA-N 475.555 6.478 5 20 JKBD Cc1oc(-c2ccccc2)nc1CN(c1ccccc1)S(=O)(=O)c1ccc(Cl)c([N+](=O)[O-])c1 25150132 BNXXJWBPIBBSKX-UHFFFAOYSA-N 483.933 5.607 5 20 JKBD COCCN(Cc1ccco1)C(=O)C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1 25725557 CCNXJKATLGZEAR-CYVLTUHYSA-N 477.542 5.403 5 20 JKBD O=[N+]([O-])c1ccc(-c2nnc(CN3CCN(Cc4ccc(-c5cccc(Cl)c5)s4)CC3)o2)cc1 26201515 NBODXKLFPQXLTL-UHFFFAOYSA-N 495.992 5.345 5 20 JKBD CCn1c(S[C@H](C)C(=O)Nc2ncc(Cl)cc2Cl)nc2cc3ccccc3cc2c1=O 31747249 HCCOPMOQZAVUDY-GFCCVEGCSA-N 473.385 5.391 5 20 JKBD COc1ccccc1Oc1ccc(N[C@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)cc1F 72030939 SQWYOFVHNQSBLI-CYBMUJFWSA-N 459.861 5.627 5 20 JKBD Cc1sc(NC(=O)CSc2nnc(-c3ccc(Cl)cc3)o2)nc1-c1cccc([N+](=O)[O-])c1 195703781 QOFVWCWFKKSSDB-UHFFFAOYSA-N 487.950 5.461 5 20 JKBD O=C(Nc1ccccc1N1CCC(O)CC1)c1ccc(NCc2ccccc2Cl)c([N+](=O)[O-])c1 195707612 DGPAWIKXUURHBW-UHFFFAOYSA-N 480.952 5.074 5 20 JKBD COc1ccc(/C=C\C(=O)O[C@@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2ccccc2)cc1 214746571 DOWTWKVFMYNRAV-MGSLXVHVSA-N 466.877 5.193 5 20 JKBD CCOc1cc(/C=C(/c2ccncc2)c2ccc([N+](=O)[O-])cc2)ccc1OCC(=O)Nc1ccccc1 215738107 HYSZZRMZZROTPV-NLRVBDNBSA-N 495.535 5.995 5 20 JKBD O=C(Cc1ccccc1)Nc1cc(NC(=O)c2csc(-c3cccc([N+](=O)[O-])c3)n2)ccc1F 303013023 JZGBDFWVUXQFGP-UHFFFAOYSA-N 476.489 5.291 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)Nc2cccc(C(=O)N3CCc4sccc4C3)c2C)cc1SC 482412973 HSWURONLVYDAAB-UHFFFAOYSA-N 497.598 5.146 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)N[C@H](c2ccc(Br)cc2)C2CCC2)cc1SC 483433042 AWUNJXABDLCZHN-IBGZPJMESA-N 465.369 5.359 5 20 JKBD COc1ccc([C@@H](NC(=O)c2ccc(Cl)cc2[N+](=O)[O-])c2ccccc2)cc1Br 487360304 ZQOMMKPYCQMCQV-FQEVSTJZSA-N 475.726 5.539 5 20 JKBD O=C(NCCCNC(=O)c1cc([N+](=O)[O-])ccc1Sc1ccc(Cl)cc1)c1cccs1 499566963 POWYHQYVUVZAJL-UHFFFAOYSA-N 475.979 5.011 5 20 JKBD C[C@H](Nc1ccc(C(=O)Nc2ccc(Oc3ccncc3)c(Cl)c2)cc1[N+](=O)[O-])c1ccccn1 504842201 JDOKTKVIHCSFQW-INIZCTEOSA-N 489.919 6.256 5 20 JKBD COc1ccc(Br)cc1[C@H]1CCCN1C(=O)[C@H](C)Oc1ccc(Cl)cc1[N+](=O)[O-] 504877105 RTPAOJLKTAWFBA-BLLLJJGKSA-N 483.746 5.150 5 20 JKBD O=C(CSc1ccc(C(F)(F)F)cc1[N+](=O)[O-])NC1(c2ccc(Cl)cc2)CCOCC1 505108664 PUDQPYZLYVTNKR-UHFFFAOYSA-N 474.888 5.181 5 20 JKBD C[C@H](Nc1ccc(C(=O)N2CCc3sccc3[C@@H]2c2cccs2)cc1[N+](=O)[O-])c1ccccn1 506054869 DLTRKQMNJXCSTK-UPCLLVRISA-N 490.610 6.074 5 20 JKBD COc1ccc(CN(C)C(=O)c2ccc(N[C@@H](C)c3ccccn3)c([N+](=O)[O-])c2)cc1OC(F)F 506181012 YJVOIHOQJUCRJN-HNNXBMFYSA-N 486.475 5.045 5 20 JKBD C[C@@H](NC(=O)NCc1ccccc1-c1ccc(Cn2ccnc2)cc1)c1cccc([N+](=O)[O-])c1 507333309 KVSJKOYYHSNSPL-LJQANCHMSA-N 455.518 5.067 5 20 JKBD C[C@@H](Nc1ccc(C(=O)N2CCC[C@H]2c2cccc(Cl)c2)cc1[N+](=O)[O-])c1ccccn1 507407293 VAVWFSUTBLSGSQ-ZHRRBRCNSA-N 450.926 5.794 5 20 JKBD COc1cc(CN[C@@H]2CCCc3cc(OC(F)F)ccc32)c([N+](=O)[O-])cc1OCC(F)(F)F 517552963 JVOXTNYEGBKJOA-MRXNPFEDSA-N 476.398 5.313 5 20 JKBD O=C(N[C@H](c1ccccc1)c1ccc2nc(C(F)(F)F)[nH]c2c1)c1ccc(Cl)cc1[N+](=O)[O-] 592948553 CAZCWSMHNUPVTP-LJQANCHMSA-N 474.826 5.663 5 20 JKBD Cc1csc(Sc2ccc(C(=O)Nc3ccc(NC(=O)NC4CC4)cc3)cc2[N+](=O)[O-])n1 601973590 QRBCNEMUOUWDCV-UHFFFAOYSA-N 469.548 5.047 5 20 JKBD Cc1cccc(-c2nnc(-c3ccc(C(=O)Nc4cc([N+](=O)[O-])ccc4OC(F)F)cc3)o2)c1 603638884 YKAVOXWGVPSNJR-UHFFFAOYSA-N 466.400 5.474 5 20 JKBD CCn1c(SCC(=O)c2cccc([N+](=O)[O-])c2)nc2scc(-c3cccs3)c2c1=O 612379755 MJALCIMMFIRLNN-UHFFFAOYSA-N 457.558 5.090 5 20 JKBD CSc1ccc([C@@H](CNC(=O)c2cc(F)c(F)cc2[N+](=O)[O-])N2CCc3sccc3C2)cc1 727708838 MCOFBQAVZZFCHW-OAQYLSRUSA-N 489.569 5.186 5 20 JKBD CCNC(=O)COc1ccc(NC(=O)CCC(=O)c2ccc3ccc4cccc5ccc2c3c45)cc1 727753917 AOPNUVGNUZUNLK-UHFFFAOYSA-N 478.548 5.701 5 20 JKBD O=C(COC(=O)[C@H]1C[C@@H]1c1ccc(Cl)c(Cl)c1)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 727929611 SIULWNSPTAAYJX-NEPJUHHUSA-N 477.222 5.206 5 20 JKBD CCOc1ccc(-c2noc(CCC(=O)N(CC3CC3)c3ccc(Cl)c([N+](=O)[O-])c3)n2)cc1 728164872 AQKPFUNLDFWPIJ-UHFFFAOYSA-N 470.913 5.073 5 20 JKBD CC(C)[C@H](OC(=O)Cc1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1)c1ccccn1 750635385 NAOMHAOJTXZEIB-SANMLTNESA-N 456.502 5.326 5 20 JKBD C[C@@H](OC(=O)COc1ccc(-c2ccccc2)cc1)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 789750015 YJSGJGLGXCRXFR-OAHLLOKOSA-N 488.418 5.230 5 20 JKBD CC1=C(C(=O)Nc2ccc(C)cc2C)[C@@H](c2ccc(-c3ccccc3[N+](=O)[O-])s2)NC(=S)N1 812920122 USTSOQASXNZXFT-JOCHJYFZSA-N 478.599 5.372 5 20 JKBD Cc1nc([N+](=O)[O-])cn1Cc1nc(-c2ccc(Oc3ncc(C(F)(F)F)cc3Cl)cc2)no1 904667479 ATCJDPIVBOTIQR-UHFFFAOYSA-N 480.790 5.058 5 20 JKBD Cc1c(C(=O)Nc2ccc(Cl)cc2C(=O)N2[C@@H](C)CCC[C@@H]2C)cc([N+](=O)[O-])cc1[N+](=O)[O-] 915153840 CFEQKTTXSUOYOX-STQMWFEESA-N 474.901 5.120 5 20 JKBD COC(=O)Nc1ccc(N[C@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Br)c2ccccc2)cc1 917939000 SXCXBZHYOOBKCT-FQEVSTJZSA-N 499.321 5.328 5 20 JKBD CCOc1ccc([C@H](CNC(=O)c2cc([N+](=O)[O-])ccc2F)c2c[nH]c3ccccc23)cc1OC 919701652 OKUUMUSSMYYRGO-FQEVSTJZSA-N 477.492 5.184 5 20 JKBD Cc1cccc(N2C(=O)/C(=C\c3cn(C)nc3-c3ccc([N+](=O)[O-])cc3)c3ccccc3C2=O)c1 920064832 LREARCLUZNMNDP-IWIPYMOSSA-N 464.481 5.031 5 20 JKBD O=C(NC1(c2ccc(NC(=O)[C@H]3CCCCO3)cc2)CCC1)c1cc2cc([N+](=O)[O-])ccc2s1 1785890522 XSTMTHOSANNOQF-HXUWFJFHSA-N 479.558 5.126 5 20 JKBD Cc1c[nH]c(C)c1CCC(=O)NC1(c2ccc(NC(=O)c3ccc([N+](=O)[O-])cc3F)cc2)CCC1 1790620925 CHXVTWVDXBYQGX-UHFFFAOYSA-N 478.524 5.059 5 20 JKBD Cc1cc(C(=O)NC2(c3ccc(NC(=O)CSc4ccccc4[N+](=O)[O-])cc3)CCC2)cnc1C 1791521279 HJDGBCCLERZNDH-UHFFFAOYSA-N 490.585 5.147 5 20 JKBD O=C(CSc1ccccc1[N+](=O)[O-])Nc1ccc(C2(NC(=O)CSC3CCCC3)CCC2)cc1 1791521480 LTZRLZNOGSNNOU-UHFFFAOYSA-N 499.658 5.497 5 20 JKBD CCc1ncsc1C(=O)NC1(c2ccc(NC(=O)CSc3ccccc3[N+](=O)[O-])cc2)CCC1 1791522943 KEWSQSMCUCBMRX-UHFFFAOYSA-N 496.614 5.154 5 20 JKBD O=C(Nc1cc([C@@H]2CCCCN2C(=O)CCc2ccccc2Cl)[nH]n1)c1ccc([N+](=O)[O-])cc1F 1821052036 SGTAHCGTNXPGKF-NRFANRHFSA-N 499.930 5.049 5 20 JKBD CC(C)[C@H]1CC[C@H](C(=O)N2CCCC[C@@H]2c2cc(NC(=O)Cc3ccc([N+](=O)[O-])cc3F)n[nH]2)CC1 1821844280 QPGLWZQEGOSHJD-PMAPCBKXSA-N 499.587 5.154 5 20 JKBD O=C(c1cc2cc([N+](=O)[O-])ccc2s1)N1CCC([C@@H]2CCCCN2C(=O)/C=C/c2ccco2)CC1 1825266972 AFZSZTLRPKSDCA-GLJAUCNMSA-N 493.585 5.349 5 20 JKBD CCc1ccc(C(=O)N2CCC([C@@H]3CCCCN3C(=O)c3cc(Cl)cc([N+](=O)[O-])c3C)CC2)cn1 1830735169 ZXVKVVHXLLUEFR-QHCPKHFHSA-N 499.011 5.061 5 20 JKBD O=C(c1ccc([N+](=O)[O-])o1)N1CCC([C@@H]2CCCCN2C(=O)c2ccc(-c3ccccc3)cc2)CC1 1832697218 JTYDBIGUPNMIBM-DEOSSOPVSA-N 487.556 5.402 5 20 JKBD O=C(Cn1c2ccccc2c(=O)c2ccccc21)Nc1ncc(Cc2cccc(Cl)c2)s1 14370717 RDGFYAMTFHOQNE-UHFFFAOYSA-N 459.958 5.494 5 20 JKBD COc1cc(/C=C2\CCn3c2nc2sc(C)c(C)c2c3=O)ccc1OCc1ccc([N+](=O)[O-])cc1 16386140 MWOHLAOVRGNHOF-XDHOZWIPSA-N 489.553 5.515 5 20 JKBD CCCn1c(S[C@H](C)C(=O)Nc2ccc(OC)cc2[N+](=O)[O-])nnc1-c1ccc(Cl)cc1 16748046 ORINWGPODBJCGR-CYBMUJFWSA-N 475.958 5.045 5 20 JKBD O=C(COC(=O)c1ccc(CSc2ccccc2)cc1)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 23499672 CCZOOMCNECJUNM-UHFFFAOYSA-N 490.459 5.701 5 20 JKBD CSc1ccc(C(=O)c2ccccc2C(=O)Nc2ccc(NC(=O)C3CC3)cc2)cc1[N+](=O)[O-] 26709696 GPPNHBYSIOXOFU-UHFFFAOYSA-N 475.526 5.149 5 20 JKBD O=[N+]([O-])c1ccc(-c2nnc(CSc3nnc(-c4ccc(Cl)cc4)n3Cc3ccco3)o2)cc1 29828763 POQPLSLTALDUAD-UHFFFAOYSA-N 494.920 5.490 5 20 JKBD Cc1ccc(CN(C(=O)c2ccc(Sc3nncn3C)c([N+](=O)[O-])c2)[C@@H]2CCc3ccccc32)cc1 302934462 IGSQGPJYKHUVIM-HSZRJFAPSA-N 499.596 5.513 5 20 JKBD CC1CCN(c2ccc(C(=O)Nc3cc(C(=O)Nc4ccccc4)ccc3Cl)cc2[N+](=O)[O-])CC1 483412206 MUMXXHPWPFDEPV-UHFFFAOYSA-N 492.963 5.989 5 20 JKBD Cc1ccc(NC(=O)Cc2nc(CSc3nc4cc5ccccc5cc4c(=O)n3C)cs2)cc1 495383438 FYOYCZBPYRZGFY-UHFFFAOYSA-N 486.622 5.325 5 20 JKBD Cc1c(NC(=O)c2cc([N+](=O)[O-])ccc2NCc2ccccc2)cccc1C(=O)N1CCCC1 499555312 QKRHASBHEDZPPQ-UHFFFAOYSA-N 458.518 5.004 5 20 JKBD O=C(CSc1ccc(C(F)(F)F)cc1[N+](=O)[O-])Nc1ccccc1COCc1ccccc1 499983066 XKMOSPCTWTXFSY-UHFFFAOYSA-N 476.476 6.061 5 20 JKBD O=C(Nc1ccccc1C(=O)N1CC2(CCCC2)c2c(F)cccc21)c1ccc([N+](=O)[O-])cc1Cl 502153293 KCQGJWGICNGDPU-UHFFFAOYSA-N 493.922 6.112 5 20 JKBD C[C@H]1Cc2cc([N+](=O)[O-])ccc2N1C(=O)c1ccc(Oc2cccc(Br)c2)nc1 504328338 GGCYFIWCMJNOKL-ZDUSSCGKSA-N 454.280 5.136 5 20 JKBD C[C@@H](Nc1ccc(C(=O)N[C@H](C(=O)Nc2ccccc2)c2ccccc2)cc1[N+](=O)[O-])c1ccccn1 508854892 IBRDRLJSWUQKBW-BCHFMIIMSA-N 495.539 5.273 5 20 JKBD COc1cc(CCNC(=O)N2CCC[C@H]2c2ccc(Cl)c(Cl)c2)c([N+](=O)[O-])cc1OC 515459654 NVWRGNNGAGIZFA-KRWDZBQOSA-N 468.337 5.008 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Cl)[C@H](NCc1cc(Br)cs1)c1ccccc1 515521163 ICTPKOLMVPVEIU-GOSISDBHSA-N 480.771 5.542 5 20 JKBD O=C(NCc1ccccc1OCc1ccccc1)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-] 515579829 VUALSVYQVVUABT-UHFFFAOYSA-N 460.408 5.045 5 20 JKBD COc1cc(C(=O)Nc2nc(C)c(Cc3ccc(C)cc3)s2)c([N+](=O)[O-])cc1OC(F)F 516008290 GZWRAKUNWXNCHO-UHFFFAOYSA-N 463.462 5.121 5 20 JKBD Cc1ccc(Sc2ccc(CNCc3cccc(C(=O)NC[C@H]4CCCO4)c3)cc2[N+](=O)[O-])cc1 517549398 OICYUIRWMNMNKO-HSZRJFAPSA-N 491.613 5.253 5 20 JKBD CS(=O)(=O)c1cc(C(=O)Nc2nc(-c3ccc(-c4ccccc4)cc3)cs2)cc([N+](=O)[O-])c1 518648175 IGJNCHMRMRXHGG-UHFFFAOYSA-N 479.539 5.041 5 20 JKBD Cc1ccc2nc([C@@H]3CCCN(C(=O)c4ccc(N5CCC[C@@H](C)C5)c([N+](=O)[O-])c4)C3)[nH]c2c1 551051767 ZPLJFFNLNWYZOZ-UYAOXDASSA-N 461.566 5.036 5 20 JKBD CCCSc1ccc([N+](=O)[O-])cc1C(=O)N1C[C@H]2CC[C@H]1[C@@H]1CN(Cc3ccccc3)C[C@H]21 594660114 JBNXLEWWQOTYJU-CDIGIKMISA-N 465.619 5.080 5 20 JKBD COc1cc(C(=O)NC2(c3ccc(Br)cc3)CCCC2)c([N+](=O)[O-])cc1OC(F)F 603964575 WYYOPLKCUYDXLO-UHFFFAOYSA-N 485.281 5.167 5 20 JKBD O=[N+]([O-])c1cc(C(F)(F)F)ccc1NCc1ccccc1NS(=O)(=O)c1ccccc1 608831676 AMUIUOPHJMMIDV-UHFFFAOYSA-N 451.426 5.027 5 20 JKBD Cc1ccc(C(=O)N2CCC(NCc3ccc(Oc4ccc(F)cc4)c([N+](=O)[O-])c3)CC2)cc1 608983089 FXGIJNUBEPPEKT-UHFFFAOYSA-N 463.509 5.229 5 20 JKBD COc1cc(C(=O)Nc2ccc(Oc3ccc(C(F)(F)F)cc3)nc2)c([N+](=O)[O-])cc1OC(F)F 609177669 IYWYHOCFTSIBPS-UHFFFAOYSA-N 499.348 5.663 5 20 JKBD O=C(Nc1nc2cc(C(F)(F)F)ccc2n1Cc1ccco1)c1cc(F)c(F)cc1[N+](=O)[O-] 727708441 XMRLRRYKEYYGLC-UHFFFAOYSA-N 466.322 5.135 5 20 JKBD O=C(OCc1ncc(-c2ccc(F)cc2)o1)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 746165191 VTKGYCYBXYYKII-UHFFFAOYSA-N 493.413 5.368 5 20 JKBD C[C@H](OC(=O)c1ccnc(Oc2ccccc2)c1)C(=O)Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1 749294098 VXHGICRUVJSHOE-HNNXBMFYSA-N 490.497 5.090 5 20 JKBD Cc1cccc(C(C)C)c1NC(=O)[C@@H](C)OC(=O)c1cc([N+](=O)[O-])ccc1N1CCC(C)CC1 772450928 DLPHFVWEMGVGQI-LJQANCHMSA-N 467.566 5.447 5 20 JKBD O=C(Nc1ccc(-c2nnc3n2CCCCCC3)cc1)c1cc([N+](=O)[O-])ccc1N1CCCCC1 812307627 HOBAJVZXFMUFTL-UHFFFAOYSA-N 474.565 5.212 5 20 JKBD O=C1CC[C@H](c2noc(-c3ccc(Sc4ccc([N+](=O)[O-])cc4)cc3)n2)CN1CC1CCC1 856553208 KCKZLYGPQAEGFE-SFHVURJKSA-N 464.547 5.302 5 20 JKBD O=[N+]([O-])c1cccc(Br)c1CNc1cccc(CS(=O)(=O)c2ccc(F)cc2F)c1 864006392 JSIQJLJXWIXKSK-UHFFFAOYSA-N 497.317 5.222 5 20 JKBD O=[N+]([O-])c1ccc(I)c(-c2nc(-c3c(Cl)cccc3Cl)no2)c1 904310258 QBVZNRGBUUJTJD-UHFFFAOYSA-N 462.030 5.223 5 20 JKBD COc1cccc(CO[C@@H](C)C(=O)Oc2ccc(NC(=O)c3cc([N+](=O)[O-])ccc3Cl)cc2)c1 915274996 QLYUHSMTZSJZPI-HNNXBMFYSA-N 484.892 5.020 5 20 JKBD CC(=O)N(c1cccc(Cl)c1)c1nc(COC(=O)CCOc2cc(C)ccc2[N+](=O)[O-])cs1 915440248 RYZZODNIVVZCAS-UHFFFAOYSA-N 489.937 5.210 5 20 JKBD Cc1cc(-c2nnc(COC(=O)c3ccc(Oc4ccc(Cl)cc4[N+](=O)[O-])cc3)o2)c(C)o1 916508618 BMZCAPTZAUNUSM-UHFFFAOYSA-N 469.837 5.657 5 20 JKBD COc1ccc(NC(=O)c2ccc(NCc3ccccc3Cl)c([N+](=O)[O-])c2)c([N+](=O)[O-])c1 916665212 IPCQVXNYQHVASE-UHFFFAOYSA-N 456.842 5.029 5 20 JKBD C[C@@H](OC(=O)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-])C(=O)Nc1ccc(Cl)cc1Cl 919195391 GCNQIXCRYWONNI-SECBINFHSA-N 481.210 5.027 5 20 JKBD C[C@@H](CC(=O)NC1(c2ccc(NC(=O)Cc3cccc([N+](=O)[O-])c3)cc2)CCC1)Oc1ccccc1 1785795481 QIJNULBEGVDWOA-FQEVSTJZSA-N 487.556 5.129 5 20 JKBD COc1ccc(CC(=O)NC2(c3ccc(NC(=O)c4ccc5occc5c4)cc3)CCC2)c([N+](=O)[O-])c1 1789049558 MFLLOCYUSJFNIH-UHFFFAOYSA-N 499.523 5.340 5 20 JKBD O=C(NC1(c2ccc(NC(=O)c3cccc4ncsc34)cc2)CCC1)c1ccc([N+](=O)[O-])cc1F 1789344421 OTBYYSFNPRJEDG-UHFFFAOYSA-N 490.516 5.405 5 20 JKBD Cc1c(C(=O)NC2(c3ccc(NC(=O)c4ccc([N+](=O)[O-])[nH]4)cc3)CCC2)[nH]c2c(Cl)cccc12 1790184978 CFGMHGKCAXKWBI-UHFFFAOYSA-N 491.935 5.428 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)[C@@H]3C[C@@H]3C3CC3)CCC2)cc1)c1cccc(Br)c1[N+](=O)[O-] 1790751407 BVNCYNYDVHCBTL-RTBURBONSA-N 498.377 5.151 5 20 JKBD COc1cc(C(=O)Nc2ccc(C3(NC(=O)/C=C/c4ccccc4)CCC3)cc2)ccc1[N+](=O)[O-] 1792164172 XWRFMGSVCDXFMB-OVCLIPMQSA-N 471.513 5.065 5 20 JKBD O=C(CC1CCC1)Nc1ccc(C2(NC(=O)Cc3ccc(Cl)cc3[N+](=O)[O-])CCC2)cc1 1792267562 NVEXNRAFNISMJU-UHFFFAOYSA-N 455.942 5.115 5 20 JKBD O=C(Cc1cc(F)ccc1[N+](=O)[O-])Nc1ccc(C2(NC(=O)c3ccc4cnccc4c3)CCC2)cc1 1792308847 RRDHCKLATOFETB-UHFFFAOYSA-N 498.514 5.273 5 20 JKBD Cc1c(C(=O)N2CCC([C@H]3CCCCN3C(=O)c3ccccc3F)CC2)cc(Cl)cc1[N+](=O)[O-] 1829879880 VUGTZMXASHPPNM-JOCHJYFZSA-N 487.959 5.243 5 20 JKBD O=C(/C=C/C1CC1)N1CCC([C@H]2CCCCN2C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)CC1 1831059663 JMRNSXAWUZFOSS-VHTFYLNKSA-N 467.591 5.009 5 20 JKBD CC(C)/C=C/C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)CC1 1832512428 BKSMSRYKQAPXTJ-VHTFYLNKSA-N 469.607 5.255 5 20 JKBD COc1ccc(NC(=O)[C@@H](OC(=O)[C@H](C)Sc2ccc([N+](=O)[O-])cc2)c2ccccc2)cc1 16118554 YRERYBFBAZHXEI-AOMKIAJQSA-N 466.515 5.007 5 20 JKBD CCOc1ccc([C@@H](CNC(=O)c2ccc(Cl)cc2[N+](=O)[O-])c2c[nH]c3ccccc23)cc1OC 16176393 FNGQBVHMIKWCMK-HXUWFJFHSA-N 493.947 5.699 5 20 JKBD Cc1ccccc1[C@@H](C)NC(=O)[C@H](C)OC(=O)c1ccccc1C(=O)c1ccc(Cl)c([N+](=O)[O-])c1 22669898 BMZBILYZIOVXIJ-SJORKVTESA-N 494.931 5.210 5 20 JKBD CC(C)CCSc1ccc(C(=O)N[C@@H](c2ccc(F)cc2)c2nccn2C)cc1[N+](=O)[O-] 23776840 KAVUMQGNHGCWOW-NRFANRHFSA-N 456.543 5.125 5 20 JKBD CCOc1ccccc1NC(=O)[C@@H](OC(=O)c1ccc([N+](=O)[O-])cc1Cl)c1ccccc1 28300569 AMBIQWUKSHTZFP-NRFANRHFSA-N 454.866 5.184 5 20 JKBD CCN(Cc1ccc(OCc2cccs2)c(OC)c1)C(=O)c1ccc(-n2ccnc2)c([N+](=O)[O-])c1 32160883 KBQQNNZTOJJBJX-UHFFFAOYSA-N 492.557 5.092 5 20 JKBD C[C@@H](Sc1nnc(-c2ccccc2)c(-c2ccccc2)n1)C(=O)Nc1cccc([N+](=O)[O-])c1 33941080 MAMMOIKRTUPITB-MRXNPFEDSA-N 457.515 5.233 5 20 JKBD Cc1cc(NC(=O)c2cc(-c3cc(C)oc3C)nc3onc(C)c23)n(-c2ccc([N+](=O)[O-])cc2)n1 105585819 SDZHESWVCZDBOR-UHFFFAOYSA-N 472.461 5.063 5 20 JKBD CCCC(=O)Nc1cccc(CNC(=O)c2ccc(Sc3nc(C)cs3)c([N+](=O)[O-])c2)c1 107889363 IVGTYSMTQDFTKB-UHFFFAOYSA-N 470.576 5.180 5 20 JKBD O=C(C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1)N1CCn2cccc2[C@@H]1c1ccccc1 115624001 OFVBFBVRGBNCJP-DEOSSOPVSA-N 498.505 5.263 5 20 JKBD C[C@@H](NC(=O)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-])C(c1ccccc1)c1ccccc1 481098165 CRSUZRQAPOXUGT-MRXNPFEDSA-N 458.436 5.486 5 20 JKBD Cc1nnc(SCc2c(C(=O)Nc3cc([N+](=O)[O-])c(C)cc3C)oc3ccccc23)s1 499300776 HLAIEUJTDKMRMA-UHFFFAOYSA-N 454.533 5.662 5 20 JKBD C[C@H](Nc1ccc(C(=O)N2CCC[C@@H]2c2nc3ccccc3n2C)cc1[N+](=O)[O-])c1ccccn1 503153288 DKKFYQVBIOZKOT-GAJHUEQPSA-N 470.533 5.027 5 20 JKBD COc1ccc([N+](=O)[O-])cc1NC(=O)NC[C@@H](c1cccc(OC)c1OC)c1c[nH]c2ccccc12 503698128 HRIQKYZBIFNZMW-FQEVSTJZSA-N 490.516 5.056 5 20 JKBD Cc1nc(-c2ccc([C@@H](C)NC(=O)c3ccc(Cn4nc(C)c([N+](=O)[O-])c4C)cc3)cc2)cs1 514528134 PZCGHGAEIZWGCH-OAHLLOKOSA-N 475.574 5.379 5 20 JKBD C[C@@H](NC(=O)c1cccc(NC(=O)c2cccc(Br)c2)c1)c1cccc([N+](=O)[O-])c1 515849913 INOBAPQVKAFLAL-CQSZACIVSA-N 468.307 5.101 5 20 JKBD O=C(CSc1ccccc1C(=O)Nc1cc(-c2cccc([N+](=O)[O-])c2)[nH]n1)NCC1CCCCC1 517881387 OJPNAHGLBKRAHH-UHFFFAOYSA-N 493.589 5.026 5 20 JKBD C[C@@H]1CCCCN1CCNC(=O)C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1 518044603 ZOSRSJSOCRHUMA-HWLQVLAGSA-N 464.591 5.126 5 20 JKBD COc1cc(C(=O)Nc2ccc(CCC(C)C)cc2)c([N+](=O)[O-])cc1OCc1cscn1 519874422 NINLZZOCXPOGDV-UHFFFAOYSA-N 455.536 5.480 5 20 JKBD CC[C@H](C)NC(=O)c1cccc(CNCc2ccc(-c3ccc([N+](=O)[O-])cc3Br)o2)c1 521818479 SCGQKYITDNZADW-HNNXBMFYSA-N 486.366 5.435 5 20 JKBD C[C@H](Nc1ccc(NC(=O)c2ccc(-n3cncn3)c([N+](=O)[O-])c2)cc1Cl)c1ccccc1 575144308 TYTKDKUBYLNBIM-HNNXBMFYSA-N 462.897 5.254 5 20 JKBD O=C(C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)Nc1ccc(N2CCCC2)nc1 603475036 BIDHJIFDABZDFJ-XDJHFCHBSA-N 485.569 5.769 5 20 JKBD Cc1nc2ccc(NC(=O)Cc3cn(-c4ccccc4)nc3-c3ccc([N+](=O)[O-])cc3)cc2o1 603492824 FWAVEHKITORHIZ-UHFFFAOYSA-N 453.458 5.078 5 20 JKBD Cc1ccc(C(=O)C2CCN(C(=O)c3ccc(N4CCC[C@H](C)C4)c([N+](=O)[O-])c3)CC2)c(C)c1 603875604 TWXMSODGBFVIJG-IBGZPJMESA-N 463.578 5.183 5 20 JKBD Cc1ccc(S(=O)(=O)Nc2ccc(C(=O)N(C)c3cccc4ccccc34)cc2)cc1[N+](=O)[O-] 604343421 QCGXKRUCNXDTDI-UHFFFAOYSA-N 475.526 5.134 5 20 JKBD CC[C@H](Nc1ccc(S(=O)(=O)N(CC)c2ccccc2)cc1[N+](=O)[O-])c1nc(C)cs1 609193503 NMPBKDRMTZEOPP-SFHVURJKSA-N 460.581 5.138 5 20 JKBD Cc1oc(-c2ccsc2)nc1CC(=O)Nc1cc(Cl)c([N+](=O)[O-])cc1OCc1ccccc1 726911686 NJIUFLJNEYFSBH-UHFFFAOYSA-N 483.933 6.033 5 20 JKBD C[C@H](Nc1ccc(C(=O)O[C@H](c2ccccc2)c2cccnc2)cc1[N+](=O)[O-])c1ccccn1 728419532 UUUQCVVNEZOIHR-AVRWGWEMSA-N 454.486 5.504 5 20 JKBD COc1ccccc1[C@H](C)CC(=O)Oc1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2Cl)cc1 728457310 YKSOUXDETALIPP-OAHLLOKOSA-N 468.893 5.608 5 20 JKBD CCn1c(COC(=O)c2ccccc2NC(=O)c2ccc([N+](=O)[O-])cc2Cl)nc2c(F)cccc21 728622202 UAUISSITWNTETG-UHFFFAOYSA-N 496.882 5.366 5 20 JKBD Cc1ccc(-c2cc(C(=O)N(C)Cc3cc([N+](=O)[O-])ccc3Cl)c3c(C)noc3n2)cc1 836729244 SRXDZNIYVCJSDJ-UHFFFAOYSA-N 450.882 5.340 5 20 JKBD Cc1cc(C(=O)COC(=O)Cn2c3ccccc3c(=O)c3ccccc32)c(C)n1[C@H](C)c1ccccc1 841977469 DZHGWRCWGJOHED-OAQYLSRUSA-N 492.575 5.608 5 20 JKBD O=C(Oc1ccc2c(-c3ccc([N+](=O)[O-])cc3)cc(=O)oc2c1)c1ccc(C(F)(F)F)nc1 844264575 BGAGIIBOJBLJNI-UHFFFAOYSA-N 456.332 5.001 5 20 JKBD Cc1cc([N+](=O)[O-])nn1Cc1cccc(-c2nc(-c3cccc(Cn4cnc5ccccc54)c3)no2)c1 904491147 QBJMVEUZUZWBDL-UHFFFAOYSA-N 491.511 5.263 5 20 JKBD C[C@@H](Sc1nnc(-c2ccccc2)n1[C@H](C)c1ccccc1)C(=O)Nc1ccc(F)c([N+](=O)[O-])c1 917254088 GTSHPHXIXHVAON-IAGOWNOFSA-N 491.548 5.721 5 20 JKBD C[C@H](Sc1nc2cc3ccccc3cc2c(=O)n1C)C(=O)Nc1ccc(N2CCCCC2)cc1 918054282 IEDCGHRANINABE-SFHVURJKSA-N 472.614 5.196 5 20 JKBD Cc1ncc(CN(C)C(=O)c2cc([N+](=O)[O-])ccc2N2CCC(Cc3ccccc3)CC2)s1 918646778 VWTVDTOWJKOZRX-UHFFFAOYSA-N 464.591 5.091 5 20 JKBD CCn1c(SCC(=O)OCc2ccc(OC)c([N+](=O)[O-])c2)nnc1-c1ccc(Cl)cc1Cl 918798662 FQLFPJWJMLSSAN-UHFFFAOYSA-N 497.360 5.024 5 20 JKBD Cc1cc([N+](=O)[O-])ccc1NC(=O)COC(=O)c1c(Cl)cc(C(F)(F)F)cc1Cl 919294816 CLFIFAKXFJWMLQ-UHFFFAOYSA-N 451.184 5.024 5 20 JKBD C[C@H](OC(=O)c1csc(-c2ccccc2F)n1)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 920732445 AXHKLPLXWIXVKY-JTQLQIEISA-N 483.399 5.060 5 20 JKBD O=C(Cc1ccc2ccccc2c1)NC1(c2ccc(NC(=O)c3ccc([N+](=O)[O-])o3)cc2)CCC1 1785747494 AQGHXNOZZNTIGK-UHFFFAOYSA-N 469.497 5.331 5 20 JKBD CCOc1ccccc1C(=O)NC1(c2ccc(NC(=O)c3ccc([N+](=O)[O-])c(OC)c3)cc2)CCC1 1792165471 AHKOOADOFGHMJX-UHFFFAOYSA-N 489.528 5.064 5 20 JKBD Cc1c(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)C2(c3cccc([N+](=O)[O-])c3)CCC2)oc2ccccc12 1800040673 UGQUULGTHFXAOY-WKCHPHFGSA-N 487.556 5.023 5 20 JKBD CC[C@@H](C)[C@@H](C(=O)N1CCC2(CCCN(C(=O)/C=C/c3ccc([N+](=O)[O-])o3)C2)CC1)c1ccccc1 1805681931 BGVJKVTUZKMEAV-AAPLMEDBSA-N 493.604 5.262 5 20 JKBD Cc1cc(Cl)ccc1C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2ccc([N+](=O)[O-])cc2F)[nH]n1 1814593562 SEUUJZJDZGHERC-FQEVSTJZSA-N 485.903 5.039 5 20 JKBD O=C(Nc1cc([C@H]2CCCCN2C(=O)C2CCCCC2)[nH]n1)c1cc2cc([N+](=O)[O-])ccc2s1 1821610442 ZEPWKDBLJWFAFL-LJQANCHMSA-N 481.578 5.419 5 20 JKBD Cc1ccc(C(=O)N2CCCC[C@H]2C2CCN(C(=O)/C=C/c3ccc([N+](=O)[O-])o3)CC2)cc1Cl 1823904632 LGDCPPZMDQGIPW-GLJAUCNMSA-N 485.968 5.096 5 20 JKBD O=C(c1cc2c(s1)CCCC2)N1CCC([C@H]2CCCCN2C(=O)/C=C/c2ccc([N+](=O)[O-])o2)CC1 1824276420 INQUCYKFGWHGBI-ZQAUEJBPSA-N 497.617 5.075 5 20 JKBD CC1=CC[C@@H](C(=O)N2CCCC[C@H]2C2CCN(C(=O)c3cc(Cl)cc([N+](=O)[O-])c3C)CC2)CC1 1828350910 DAAXACIBSZUNRG-OFNKIYASSA-N 488.028 5.536 5 20 JKBD O=C(c1cc2cc([N+](=O)[O-])ccc2s1)N1CC2(CCCN2C(=O)[C@@H]2CCc3cccc(Cl)c32)C1 1845867203 NOAJBGWZMFIVME-GOSISDBHSA-N 495.988 5.010 5 20 JKBD CC(C)c1ccc([C@@H](NC(=O)CCCn2c(=O)oc3cc([N+](=O)[O-])ccc32)c2cccs2)cc1 9984201 NHZYZWJEBRBBFP-XMMPIXPASA-N 479.558 5.374 5 20 JKBD CCCOc1cc(NC(=O)C2CCN(c3nc4ccccc4o3)CC2)c([N+](=O)[O-])cc1OCCC 10318583 ZUVUBHJHCBPXOY-UHFFFAOYSA-N 482.537 5.169 5 20 JKBD Cc1occc1-c1nnc(S[C@@H](C(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)c2ccccc2)n1C 21121815 NNRLDDALJLUNTI-LJQANCHMSA-N 483.937 5.417 5 20 JKBD Cc1csc(SCc2ccccc2C(=O)OCc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)n1 22523487 OKXAXIOZTOJDHK-UHFFFAOYSA-N 468.516 5.059 5 20 JKBD O=C(Nc1ccccc1C(=O)N1CCc2[nH]c3ccccc3c2C1)c1ccc([N+](=O)[O-])cc1Cl 25610530 HQULYRGZAYKFHM-UHFFFAOYSA-N 474.904 5.180 5 20 JKBD Cc1sc(NC(=O)c2ccn(-c3ccc([N+](=O)[O-])cc3)n2)nc1-c1ccc(OC(F)F)cc1 302939302 AHUKFEOFPUSROL-UHFFFAOYSA-N 471.445 5.066 5 20 JKBD O=C(CSCC1CCCCC1)Nc1c(Br)cc([N+](=O)[O-])cc1Br 477080055 ACHDLNIFBSYZHT-UHFFFAOYSA-N 466.195 5.372 5 20 JKBD CC(C)NC(=O)Nc1ccc(CNC(=O)c2cc([N+](=O)[O-])ccc2Sc2ccccc2)cc1 480345512 ABUSWMWFOIVYLH-UHFFFAOYSA-N 464.547 5.206 5 20 JKBD O=C(C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)Nc1ccc(Cn2cccn2)cc1 486579219 KDZOWMNJETXIKV-PGMHBOJBSA-N 495.564 6.019 5 20 JKBD O=C1CCc2cc(-c3csc(NC(=O)c4ccc(NCc5ccccc5)c([N+](=O)[O-])c4)n3)ccc2N1 490931222 WQXILHDSDNEYID-UHFFFAOYSA-N 499.552 5.467 5 20 JKBD COc1cc(C(=O)NCC2(c3cccc(Cl)c3)CCCC2)c([N+](=O)[O-])cc1OC(F)F 500942593 ZRZHLFAOYWCGJJ-UHFFFAOYSA-N 454.857 5.100 5 20 JKBD C[C@H](Sc1nnc(-c2ccccc2Br)o1)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 501173106 HGQJHMSGOGOAAG-JTQLQIEISA-N 474.296 5.311 5 20 JKBD CCOc1ccc(C2(CNC(=O)c3ccc(NCc4ccccc4)c([N+](=O)[O-])c3)CCOCC2)cc1 508774640 NKMGGCXVLDSYBG-UHFFFAOYSA-N 489.572 5.084 5 20 JKBD COc1cc(C(=O)N(C)Cc2cccc3ccccc23)c([N+](=O)[O-])cc1OCc1cscn1 509936780 AUNSNYCMYMWXCV-UHFFFAOYSA-N 463.515 5.064 5 20 JKBD CC(C)Oc1ccc([N+](=O)[O-])cc1CSc1nnc(N2CCC[C@@H](C)C2)n1Cc1ccco1 511092008 QYWDUJOUKIJCJS-QGZVFWFLSA-N 471.583 5.143 5 20 JKBD COc1ccccc1Oc1ccc(NC(=O)c2ccc([N+](=O)[O-])cc2I)cc1 511495545 BVGJDVQINDNCIY-UHFFFAOYSA-N 490.253 5.253 5 20 JKBD CSc1ccc(C(=O)c2ccccc2C(=O)N2CC=C(c3ccc(O)cc3)CC2)cc1[N+](=O)[O-] 512436127 NDGIIPTZAVBAGL-UHFFFAOYSA-N 474.538 5.183 5 20 JKBD C[C@@H](c1nnc(-c2cccs2)o1)N1CCN(Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)CC1 515479764 LMLJHWNGYZQWQF-INIZCTEOSA-N 481.603 5.314 5 20 JKBD COc1ccc(-c2ccc(CNC3CCN(c4ccc(C(F)(F)F)cn4)CC3)o2)c([N+](=O)[O-])c1 518264492 DVSFKVATVWBKSQ-UHFFFAOYSA-N 476.455 5.036 5 20 JKBD O=C(Cc1ccccc1[N+](=O)[O-])NCCc1cn(-c2ccccc2)nc1-c1ccc(Cl)cc1 519174635 SIXYEPBXFDANIW-UHFFFAOYSA-N 460.921 5.002 5 20 JKBD O=C(COc1ccc2ccccc2c1Br)Nc1cc([N+](=O)[O-])ccc1OC(F)F 603638319 KUQOEAWOWLXALY-UHFFFAOYSA-N 467.222 5.129 5 20 JKBD CSc1ccc([C@H](CNC(=O)c2cc(SC)ccc2[N+](=O)[O-])N2CCc3sccc3C2)cc1 603669425 IRGBQYPZWZUPJC-QFIPXVFZSA-N 499.683 5.630 5 20 JKBD O=C(NC1C[C@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1)c1cc([N+](=O)[O-])ccc1Oc1ccccc1 603738251 PCIUUFPJORSZSX-CHWSQXEVSA-N 476.373 6.026 5 20 JKBD CCc1nc2cc(N[C@@H](C(=O)Nc3ccc([N+](=O)[O-])cc3Cl)c3ccccc3)ccc2o1 604046870 BACKYWHPGQIEDQ-JOCHJYFZSA-N 450.882 5.744 5 20 JKBD O=C(c1c2c(nc3ccccc13)/C(=C/c1ccc([N+](=O)[O-])cc1)CCC2)N1CCCSCC1 604383257 NOSVBNZZTFBAFN-HTXNQAPBSA-N 459.571 5.599 5 20 JKBD COc1cccc(CC(=O)N2CCc3ccc(Nc4ccc([N+](=O)[O-])c5cnccc45)cc32)c1 608973335 IWGJMZJVEKMMCX-UHFFFAOYSA-N 454.486 5.027 5 20 JKBD C[C@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)Nc1c(-c2ccc(Cl)cc2)c(C(F)(F)F)nn1C 609026501 IBOPPQVBWKOMKE-NSHDSACASA-N 484.887 5.787 5 20 JKBD COc1ccccc1-c1nnc(S[C@@H](C(=O)Nc2ccc(C)cc2[N+](=O)[O-])c2ccccc2)n1C 619619712 PIGDGDDZLSQWRI-JOCHJYFZSA-N 489.557 5.179 5 20 JKBD CCc1cccc[n+]1/C(C(=S)Nc1ccc(OC(C)C)cc1)=C(/O)c1ccc(C)c([N+](=O)[O-])c1 726574233 OVWASJXTSUCIAR-UHFFFAOYSA-O 478.594 5.864 5 20 JKBD Cc1ccccc1-c1nc(C(=O)O[C@@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2C(F)(F)F)cs1 727559840 OXIWXOGQOLJLDJ-LBPRGKRZSA-N 479.436 5.230 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])c(Cl)c1)c1cccc(NC(=O)c2ccc(Br)o2)c1 727710270 LVYOIAPTRTXFSX-UHFFFAOYSA-N 464.659 5.108 5 20 JKBD COc1cc(-c2cc(C(=O)N3c4ccc([N+](=O)[O-])cc4C[C@@H]3C)c3ccccc3n2)cc(OC)c1OC 728812249 ZTOHKPDKCNDMAR-INIZCTEOSA-N 499.523 5.427 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)Oc2ccc(NC(=O)c3sccc3C)cc2)cc1SC 729218508 WWAPUZGUHGDGCL-UHFFFAOYSA-N 458.517 5.167 5 20 JKBD Cc1sc(NC(=O)c2cc([N+](=O)[O-])c(C)c([N+](=O)[O-])c2C)nc1-c1ccc(OC(F)F)cc1 748612655 AJPCEMUHGOUKDC-UHFFFAOYSA-N 478.433 5.405 5 20 JKBD O=C(Nc1ccc(=O)n(Cc2ccc(Cl)c(Cl)c2)c1)c1cc([N+](=O)[O-])ccc1Br 751113604 MEADRVOZDLBFEU-UHFFFAOYSA-N 497.132 5.126 5 20 JKBD Cc1nnc(S[C@@H](C(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)c2ccccc2)n1-c1ccccc1 824289048 NYEYVJLJFPKFRL-OAQYLSRUSA-N 479.949 5.609 5 20 JKBD C[C@@H](NC(=O)COC(=O)c1ccc(N[C@H](C)c2ccccn2)c([N+](=O)[O-])c1)c1ccc2ccccc2c1 920543898 AYGBVYOMXKXTKF-RTBURBONSA-N 498.539 5.350 5 20 JKBD O=C(Cn1ccc2ccc([N+](=O)[O-])cc21)NC1(c2ccc(NC(=O)[C@H]3CC=CCC3)cc2)CCC1 1790465423 YGZYPHSGKRRMTB-FQEVSTJZSA-N 472.545 5.040 5 20 JKBD C[C@H](Sc1cccs1)C(=O)NC1(c2ccc(NC(=O)c3ccc(O)c([N+](=O)[O-])c3)cc2)CCC1 1790620011 RARLBQNOHVXRBJ-HNNXBMFYSA-N 497.598 5.290 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)Nc1ccc(C2(NC(=O)c3nccc4occc34)CCC2)cc1 1790770440 CDBPYIDMCZSFSO-UHFFFAOYSA-N 488.475 5.245 5 20 JKBD O=C(C[C@H]1C[C@@H]2CC[C@H]1C2)Nc1ccc(C2(NC(=O)Cc3ccc([N+](=O)[O-])cc3F)CCC2)cc1 1791324910 CMBUZVCSQRLGSU-WSTZPKSXSA-N 479.552 5.237 5 20 JKBD Cc1c(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)[C@H](C)c2ccc(Cl)cc2)cc(Cl)cc1[N+](=O)[O-] 1792821125 LVZQFQGOXAASJB-NWTFUFRBSA-N 490.387 5.266 5 20 JKBD CC(C)=CCCC(=O)N1CC[C@@H](CNC(=O)c2cc(Cl)cc([N+](=O)[O-])c2C)[C@@H]1c1cccnc1 1811794580 PFBJVJOPHKQMHA-CYFREDJKSA-N 484.984 5.018 5 20 JKBD O=C(Nc1cc([C@@H]2CCCCN2C(=O)CCc2cccc([N+](=O)[O-])c2)[nH]n1)c1ccc2occc2c1 1818703510 LBJMRCWTVJFGJM-QFIPXVFZSA-N 487.516 5.003 5 20 JKBD C/C(=C\c1cccs1)C(=O)N1CCC([C@H]2CCCCN2C(=O)CCc2cccc([N+](=O)[O-])c2)CC1 1824838466 ZWWJBJRVMRKGQV-MHOQICJOSA-N 495.645 5.312 5 20 JKBD Cc1cccc2[nH]c(C(=O)N3CCC([C@H]4CCCCN4C(=O)c4cccc(F)c4[N+](=O)[O-])CC3)cc12 1830622309 WUZPHGMWMXPJBR-XMMPIXPASA-N 492.551 5.071 5 20 JKBD C[C@H](CC(=O)N1CCC([C@@H]2CCCCN2C(=O)Cc2ccc([N+](=O)[O-])cc2F)CC1)c1ccccc1 1831294803 RAJPKHWCDKISKJ-IBVKSMDESA-N 495.595 5.090 5 20 JKBD CCCn1c(S[C@H](C)C(=O)Nc2cc([N+](=O)[O-])ccc2OC)nnc1-c1ccc(Cl)cc1 9138776 MROMCBIWOCTKEA-CYBMUJFWSA-N 475.958 5.045 5 20 JKBD COc1ccc(/C=C2\N=C(SCc3ccccc3[N+](=O)[O-])N(c3cccc(OC)c3)C2=O)cc1 9639883 FSQNNVRGBZEDQH-HMAPJEAMSA-N 475.526 5.289 5 20 JKBD COc1ccc([N+](=O)[O-])cc1CSc1nnc([C@H](C)N2CCCCC2)n1-c1ccccc1 11212521 VKGUQRCQFLJDNN-KRWDZBQOSA-N 453.568 5.023 5 20 JKBD Cc1ccc(C)c(C(=O)CCC(=O)Oc2ccc(NC(=O)c3cc([N+](=O)[O-])ccc3Cl)cc2)c1 15567415 LUFAGUNQYALNLX-UHFFFAOYSA-N 480.904 5.686 5 20 JKBD CCCn1c(S[C@@H](C)C(=O)Nc2ccc(OC)cc2[N+](=O)[O-])nnc1-c1ccc(Cl)cc1 16748044 ORINWGPODBJCGR-ZDUSSCGKSA-N 475.958 5.045 5 20 JKBD C[C@@H](SC1=N/C(=C\c2ccccc2)C(=O)N1c1ccc(F)cc1)C(=O)Nc1ccc([N+](=O)[O-])cc1 23647058 HADLEJIRUAYYFJ-GRVPHDJPSA-N 490.516 5.238 5 20 JKBD CCOCc1ccc(CN[C@@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2ccccc2)cc1 28386455 TVRBHNUHWSZZJN-HSZRJFAPSA-N 453.926 5.254 5 20 JKBD C[C@@H](Nc1ccc(C(=O)N(C)Cc2ccc(OC(F)(F)F)cc2)cc1[N+](=O)[O-])c1ccccn1 108781077 KZVZNGCIIHYSDX-OAHLLOKOSA-N 474.439 5.334 5 20 JKBD CCCOc1ccc(NC(=O)c2ccc(N[C@@H](C)c3ccccn3)c([N+](=O)[O-])c2)cc1Cl 410089191 RVWASDKYUAAIDY-HNNXBMFYSA-N 454.914 5.857 5 20 JKBD CCCCCN(C(=O)c1cc2cc([N+](=O)[O-])ccc2s1)c1nc(C)c(C(=O)OCC)s1 478083147 QZPQLLAGGOACPU-UHFFFAOYSA-N 461.565 5.588 5 20 JKBD Cc1ncc(NC(=O)c2c3c(nc4ccccc24)/C(=C\c2cccc([N+](=O)[O-])c2)CCC3)cn1 484424720 LNPHCMDAQCQPPM-PDGQHHTCSA-N 451.486 5.371 5 20 JKBD CCOc1cc([N+](=O)[O-])c(C(=O)Nc2ccc(OCc3ccccc3Cl)cc2)cc1OC 490647245 JCEGFHUSAZFWRV-UHFFFAOYSA-N 456.882 5.487 5 20 JKBD O=C(Nc1nc(-c2ccc(-c3ccccc3)cc2)cs1)c1ccc(-n2cncn2)c([N+](=O)[O-])c1 496769855 NFTRZILTTFOLJW-UHFFFAOYSA-N 468.498 5.218 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Cl)[C@H](NCc1ccc(Oc2ccccc2)nc1)c1ccccc1 504427128 PKIBLGOYRIHLIE-RUZDIDTESA-N 488.931 5.905 5 20 JKBD CC(=O)N(c1ccc(C(F)(F)F)cc1)c1nc(COc2cc(C)ccc2[N+](=O)[O-])cs1 505871559 FFZYIJBQPDNCIK-UHFFFAOYSA-N 451.426 5.642 5 20 JKBD COc1ccc(CN(C)C(=O)c2ccc(N[C@H](C)c3ccccn3)c([N+](=O)[O-])c2)cc1OC(F)F 506181013 YJVOIHOQJUCRJN-OAHLLOKOSA-N 486.475 5.045 5 20 JKBD COc1cc(C(=O)Nc2ccccc2N2CCCCCC2)c([N+](=O)[O-])cc1OCc1cscn1 512667584 DZBMJTLCFTTYLW-UHFFFAOYSA-N 482.562 5.272 5 20 JKBD C[C@H](Nc1ccc(C(=O)Nc2ccc(CN3CCC[C@@H](C)C3)cc2)cc1[N+](=O)[O-])c1ccccn1 516172873 DSKJIGYXKSWQHQ-UXHICEINSA-N 473.577 5.647 5 20 JKBD CN(Cc1ccccc1[N+](=O)[O-])C(=O)Nc1ccc(CNC(=O)c2ccc(C(F)(F)F)cc2)cc1 518626914 BSDHTWXNDMOCRN-UHFFFAOYSA-N 486.450 5.208 5 20 JKBD O=C1CCCN1C[C@@H](NCc1ccc(-c2ccc([N+](=O)[O-])cc2)o1)c1cccc(C(F)(F)F)c1 518764669 YNODUHNNOSNLOH-OAQYLSRUSA-N 473.451 5.327 5 20 JKBD O=[N+]([O-])c1ccccc1-c1ccc(CNC2CCN(c3ccc(C(F)(F)F)cn3)CC2)s1 520203158 LWWVDLBMAVNQFJ-UHFFFAOYSA-N 462.497 5.496 5 20 JKBD CCC[C@H](NC(=O)c1ccc(Sc2nncn2C)c([N+](=O)[O-])c1)c1cccc(C(F)(F)F)c1 524016905 UAHOLRDVJHSAOG-INIZCTEOSA-N 479.484 5.165 5 20 JKBD O=C(Cn1c2ccccc2c(=O)c2ccccc21)NCC1(c2cccc(C(F)(F)F)c2)CC1 589405347 PKGYOEUDDJGAQT-UHFFFAOYSA-N 450.460 5.022 5 20 JKBD C[C@H]1CCCN(c2ccc(C(=O)Nc3cccc(-c4nnc5n4CCCCC5)c3)cc2[N+](=O)[O-])C1 603467103 LPAIKBMSKRJQMD-SFHVURJKSA-N 474.565 5.068 5 20 JKBD O=C(c1c2c(nc3ccccc13)/C(=C\c1ccc([N+](=O)[O-])cc1)CCC2)N1CCC[C@H](c2cc[nH]n2)C1 608813492 YEJUBKLOWPQTCY-ZOECDYFQSA-N 493.567 5.763 5 20 JKBD CC(C)c1nnc(COC(=O)C/C(=C/c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)o1 726996434 ZNYCLROMPJYNNU-WJDWOHSUSA-N 464.503 5.385 5 20 JKBD CCOc1ccc([C@H](CNC(=O)c2cc(F)c(F)cc2[N+](=O)[O-])c2c[nH]c3ccccc23)cc1OC 727707322 GJMOGOKCYBHQFT-SFHVURJKSA-N 495.482 5.324 5 20 JKBD O=C(CCC(=O)c1ccc2ccc3cccc4ccc1c2c34)Nc1ccc(N2CCOCC2)cn1 727754036 BSQSLBCAZZFFTK-UHFFFAOYSA-N 463.537 5.417 5 20 JKBD O=C(O[C@H](C(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1)c1ccccc1)[C@H]1CCOc2ccccc21 728358993 NIEOTLXYBVEMMN-AVRDEDQJSA-N 466.877 5.038 5 20 JKBD C[C@@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccc(NC(=O)OC(C)(C)C)cc1C(F)(F)F 729655562 ROJQHQNZZHKHBY-GFCCVEGCSA-N 485.484 6.080 5 20 JKBD O=C(COC(=O)c1ccccc1C(=O)c1ccc(Cl)c(Cl)c1)Nc1cc([N+](=O)[O-])ccc1F 729726803 KAQSGESRBSYAEH-UHFFFAOYSA-N 491.258 5.067 5 20 JKBD O=C(OCc1cc([N+](=O)[O-])cc2c1OCOC2)[C@@H](Oc1ccc(F)cc1Cl)c1ccccc1 730611921 UOKSPYIQABNCKP-QFIPXVFZSA-N 473.840 5.117 5 20 JKBD Cc1ccc(N(Cc2cnc(C)s2)S(=O)(=O)c2ccc(Cl)c([N+](=O)[O-])c2)c(C)c1 744180639 WRBYOYRAFKHDEH-UHFFFAOYSA-N 451.957 5.025 5 20 JKBD O=C(CCCOCc1ccccc1)Oc1ccc2c(-c3ccc([N+](=O)[O-])cc3)cc(=O)oc2c1 747622333 AUJGGIBVZPACII-UHFFFAOYSA-N 459.454 5.271 5 20 JKBD C[C@H](SCc1nc(O)c2c(-c3ccccc3)csc2n1)C(=O)O[C@H](C)c1ccccc1[N+](=O)[O-] 749053888 HOKKDLZPNFJARV-CABCVRRESA-N 495.582 5.898 5 20 JKBD COC(=O)c1ccc2c(=O)nc(/C(Cl)=C\c3ccc(-c4cccc([N+](=O)[O-])c4)s3)[nH]c2c1 912859455 VCZPTPRHPAWALT-GZTJUZNOSA-N 467.890 5.083 5 20 JKBD COc1cc(-c2ccccc2)sc1C(=O)O[C@@H](C)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 919459350 SEPXFEMUUJXOPD-ZDUSSCGKSA-N 451.460 5.300 5 20 JKBD C[C@@H](Nc1ccc(C(=O)Oc2ccccc2C(=O)NCc2ccccc2)cc1[N+](=O)[O-])c1ccccn1 919679588 WPTQLDFRMLFTCL-LJQANCHMSA-N 496.523 5.312 5 20 JKBD CN(c1ccc(NC(=O)c2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)cc1F)C1CCCCC1 919851400 SAHNBOWPOOAYAJ-UHFFFAOYSA-N 451.502 5.156 5 20 JKBD COc1cc(/C=C/C(=O)O[C@H](C)c2ccccc2[N+](=O)[O-])ccc1OCc1c(C)noc1C 920268052 MGIXXKUPAPVPTG-YBHKSSGVSA-N 452.463 5.105 5 20 JKBD O=C(OCC[C@H]1CCCCN1C(=O)c1ccc(Oc2cccnc2)cc1)c1cccc([N+](=O)[O-])c1 920342665 GXBIPMULXLJNIX-OAQYLSRUSA-N 475.501 5.024 5 20 JKBD Cc1[nH]ccc1C(=O)Nc1ccc(C2(NC(=O)c3ccc(Br)c([N+](=O)[O-])c3)CCC2)cc1 1788806407 PKJZDLHCPZSIIW-UHFFFAOYSA-N 497.349 5.055 5 20 JKBD COc1cc(C(=O)NC2(c3ccc(NC(=O)c4cc5ccccc5n4C)cc3)CCC2)ccc1[N+](=O)[O-] 1788887214 TWSZTWSEMCTOBC-UHFFFAOYSA-N 498.539 5.157 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)[C@@H]3CCC[C@@H]4CCCC[C@@H]43)CCC2)cc1)c1ccc([N+](=O)[O-])[nH]1 1790185424 AAVQKWXEGPNFPJ-DZFGPLHGSA-N 464.566 5.277 5 20 JKBD O=C(/C=C/c1ccc([N+](=O)[O-])o1)NC1(c2ccc(NC(=O)c3ccc4occc4c3O)cc2)CCC1 1790930239 YDBUFEKOLOKICF-UXBLZVDNSA-N 487.468 5.101 5 20 JKBD COc1cc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cc3c(Cl)cccc3s2)ccc1[N+](=O)[O-] 1797651713 IXKIABGWBQBYBM-MUJYYYPQSA-N 499.976 5.037 5 20 JKBD Cc1cc(C(=O)N2CCCC3(CCN(C(=O)c4cc5cc([N+](=O)[O-])ccc5s4)CC3)C2)c(C)o1 1808258301 VZMYQIVZIVRXEL-UHFFFAOYSA-N 481.574 5.178 5 20 JKBD Cc1oc(C(C)(C)C)cc1C(=O)N1CCCC2(CCN(C(=O)/C=C/c3ccccc3[N+](=O)[O-])CC2)C1 1808388290 BKWLTSXCUHWSLL-ZHACJKMWSA-N 493.604 5.352 5 20 JKBD CC[C@@H](C(=O)N1CCCC2(CCN(C(=O)Cc3ccc(Cl)cc3[N+](=O)[O-])CC2)C1)c1ccccc1 1809006074 JAVOOVZSECLYDL-HSZRJFAPSA-N 498.023 5.216 5 20 JKBD C[C@H](C(=O)N1CCCC[C@@H]1c1cc(NC(=O)Cc2ccc(Cl)cc2[N+](=O)[O-])n[nH]1)c1ccccc1 1814846349 OHWQKCKRQXVCBO-HRAATJIYSA-N 495.967 5.010 5 20 JKBD O=C(Nc1cc([C@@H]2CCCCN2C(=O)[C@@H]2CCC[C@H]3CCCC[C@@H]32)[nH]n1)c1cc(F)cc([N+](=O)[O-])c1 1821166454 WRIUUHHFVZZTMN-QSABTFIQSA-N 497.571 5.369 5 20 JKBD CC[C@H](C)CC(=O)N1CCCC[C@@H]1C1CCN(C(=O)C2(c3cccc([N+](=O)[O-])c3)CCC2)CC1 1824347497 ZSHSTQQOZILYCE-GBXCKJPGSA-N 469.626 5.072 5 20 JKBD CC[C@@H](C(=O)N1CCCC[C@H]1C1CCN(C(=O)Cc2cc(F)ccc2[N+](=O)[O-])CC1)c1ccccc1 1826317025 OQYGNXCAJDHOGK-RPBOFIJWSA-N 495.595 5.090 5 20 JKBD Cc1c(Cl)cccc1C(=O)N1CCC([C@H]2CCCCN2C(=O)c2ccc([N+](=O)[O-])cc2F)CC1 1830492429 GDAAIXQQFOZLLT-HSZRJFAPSA-N 487.959 5.243 5 20 JKBD O=C(CC1CCC1)N1CCC([C@@H]2CCCCN2C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)CC1 1831061656 HUYOZVNVUAUYEZ-NRFANRHFSA-N 469.607 5.233 5 20 JKBD Cc1cccc(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3cccc(F)c3[N+](=O)[O-])CC2)c1Cl 1832603952 XIZAPTXHBPQABD-OAQYLSRUSA-N 487.959 5.243 5 20 JKBD CC(=O)N(c1cccc(C(F)(F)F)c1)c1nc(COC(=O)c2ccc([N+](=O)[O-])cc2)cs1 10646828 PXFNCQYKDXCSQL-UHFFFAOYSA-N 465.409 5.112 5 20 JKBD CCc1ccc(N(C(C)=O)c2nc(COC(=O)c3ccc([N+](=O)[O-])cc3Cl)cs2)cc1 11028691 HFDPSGJEKLSGAN-UHFFFAOYSA-N 459.911 5.309 5 20 JKBD CSc1ccc([N+](=O)[O-])c(C(=O)Nc2nc(-c3ccc(Br)cc3)c(C)s2)c1 18229889 DWYAJIKBMAFCOB-UHFFFAOYSA-N 464.366 5.763 5 20 JKBD CCn1c(SCC(=O)N[C@@H](c2ccccc2)c2cccs2)nc2cc3ccccc3cc2c1=O 19241454 CUUUBWURPQKPML-VWLOTQADSA-N 485.634 5.629 5 20 JKBD COc1cc(C(=O)N[C@H](c2ccccc2)c2ccccn2)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 36836118 TYTLOUUKFCALRY-RUZDIDTESA-N 489.915 5.964 5 20 JKBD O=C(C[C@H](NC(=O)c1ccccc1)c1ccccc1)Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1 104673218 SIPZCMUGTBZOJU-NRFANRHFSA-N 472.526 5.218 5 20 JKBD C[C@@H](Nc1ccc(C(=O)Nc2ccc(Nc3ccccc3)cc2)cc1[N+](=O)[O-])c1ccccn1 108770978 XTZGOBSHJZPKIF-GOSISDBHSA-N 453.502 6.159 5 20 JKBD Cc1c(NC(=O)c2ccccc2)cccc1NC(=O)c1ccc(N2CCC[C@@H](C)C2)c([N+](=O)[O-])c1 117559919 CMQWDEVQEJXQCO-GOSISDBHSA-N 472.545 5.644 5 20 JKBD Cc1nn(Cc2ccc(C(=O)NCc3cccc(COCc4ccccc4)c3)cc2)c(C)c1[N+](=O)[O-] 480373390 CYXFQNQQDFJQOM-UHFFFAOYSA-N 484.556 5.103 5 20 JKBD COc1ccc(-c2csc(NC(=O)c3cc(SC)c(OC)cc3[N+](=O)[O-])n2)cc1Cl 481922900 RHOWCOWYVHKSMC-UHFFFAOYSA-N 465.940 5.363 5 20 JKBD C[C@H](c1cccs1)N(C)C(=O)C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1 485632017 YJZZQZACQJKGOF-WDMNMGCXSA-N 463.584 6.416 5 20 JKBD Cc1cc(Oc2ccc(N(C)S(=O)(=O)c3ccccc3F)cc2)nc(-c2ccc([N+](=O)[O-])cc2)n1 489209092 WWYSUELQJOHSDQ-UHFFFAOYSA-N 494.504 5.117 5 20 JKBD Cc1cc(C(=O)N2CCCC[C@@H]2C)ccc1NC(=O)c1csc(-c2ccc([N+](=O)[O-])cc2)n1 495495074 LZIGSQVDEPCTQS-INIZCTEOSA-N 464.547 5.294 5 20 JKBD Cc1occc1C(=O)Nc1cc(NC(=O)c2csc(-c3cccc([N+](=O)[O-])c3)n2)ccc1F 498418088 BJTPNKBDUDIDPB-UHFFFAOYSA-N 466.450 5.263 5 20 JKBD O=C(C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)Nc1nc(C2CC2)cs1 509408154 OVFPANBFELYOJW-WJDWOHSUSA-N 462.556 6.108 5 20 JKBD Cc1csc(Sc2ccc(C(=O)Nc3ccc(-c4cn5cccnc5n4)cc3)cc2[N+](=O)[O-])n1 511889191 UWTWFAKBCQQLTH-UHFFFAOYSA-N 488.554 5.473 5 20 JKBD O=C(Nc1ccc(F)c(-c2nnc3n2CCCCC3)c1)c1cc2ccccc2c2cccnc12 514512349 KDUQJYWGAJMFOM-UHFFFAOYSA-N 451.505 5.764 5 20 JKBD COC(=O)c1sc(-c2ccccc2Cl)cc1NC(=O)c1cc(OC)c(OC)cc1[N+](=O)[O-] 515444857 FDMKCYICFOHRQO-UHFFFAOYSA-N 476.894 5.033 5 20 JKBD Cc1ccc(-c2csc(NC(=O)c3cccc(C(=O)N(C)c4ccccc4)c3)n2)cc1[N+](=O)[O-] 520628571 KYFOCLONUASBOV-UHFFFAOYSA-N 472.526 5.556 5 20 JKBD COc1cc(CNCc2c(OC)ccc3ccccc23)ccc1OCc1ccc([N+](=O)[O-])cc1 520952152 GPHKQNAOLZQWBS-UHFFFAOYSA-N 458.514 5.634 5 20 JKBD O=C(c1ccc(NCc2ccccc2)c([N+](=O)[O-])c1)N(C[C@H]1CCCO1)c1nc2ccccc2s1 602758536 QARAOAHMNGSLFE-HXUWFJFHSA-N 488.569 5.642 5 20 JKBD O=C(C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)Nc1ccc2c(c1)NC(=O)CO2 603452776 ARRKQUNKPBZJQD-WJDWOHSUSA-N 486.509 5.105 5 20 JKBD CN(C)[C@@H](CNC(=O)C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)c1ccccc1 603454113 WNNXURFUAADYAJ-VGBYGFDOSA-N 486.597 5.554 5 20 JKBD C[C@@H](Cc1cccs1)NC(=O)C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1 603573574 OYFQYLPDKUQUGE-KXGFGANYSA-N 463.584 5.944 5 20 JKBD Cc1cccc(Cc2cnc(NC(=O)c3cc(OCC(F)(F)F)ccc3[N+](=O)[O-])s2)c1Cl 603861177 QTUCHUDPUUFYGS-UHFFFAOYSA-N 485.871 5.797 5 20 JKBD COc1cccc(C[C@@H]2CCCN2C(=O)C2CCN(c3ccc(C(F)(F)F)cc3[N+](=O)[O-])CC2)c1 604010213 SOJZIABEOOIATA-FQEVSTJZSA-N 491.510 5.072 5 20 JKBD CCN(C(=O)Cc1ccc(NC(=O)[C@@H](C)Oc2ccc(Cl)cc2[N+](=O)[O-])cc1)c1ccccc1 604448068 IDTISMTZYMDLTL-QGZVFWFLSA-N 481.936 5.250 5 20 JKBD O=C(Nc1c(-c2ccccc2)ncn1C1CC1)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 604537342 DCNHTPALHCIEOW-UHFFFAOYSA-N 499.493 5.667 5 20 JKBD CCCOc1cc(NC(=O)N2CCCO[C@H](c3ccccc3)C2)c([N+](=O)[O-])cc1OCCC 609252270 NTQCBZCUZLCGOB-QHCPKHFHSA-N 457.527 5.168 5 20 JKBD C[C@@H](C(=O)OCC(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F)c1c(Cl)cccc1Cl 726029110 OEUWVBPRWMHQAJ-SECBINFHSA-N 465.211 5.206 5 20 JKBD Cc1ccc2oc(C(=O)O[C@H](C(=O)Nc3ccc([N+](=O)[O-])cc3Cl)c3ccccc3)cc2n1 729725208 FNIXZZCXAPKTFZ-NRFANRHFSA-N 465.849 5.235 5 20 JKBD O=C(C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)NC[C@@H]1COc2ccccc2C1 747585698 HVPPEMTTZLBKRI-DBRLUCFCSA-N 485.565 5.503 5 20 JKBD CC(C)Cn1ncc2cc(C(=O)Oc3ccc(NC(=O)c4cc([N+](=O)[O-])ccc4Cl)cc3)cnc21 748160512 HYPTVFDBOBGRFE-UHFFFAOYSA-N 493.907 5.120 5 20 JKBD CC(=O)CCc1ccc(OC(=O)Cc2cn(-c3ccccc3)nc2-c2ccc([N+](=O)[O-])cc2)cc1 750665667 FPVYKJJBCFHMAM-UHFFFAOYSA-N 469.497 5.117 5 20 JKBD COc1ccc([N+](=O)[O-])cc1OC(=O)c1cc(-c2cc(C)oc2C)nc2c1cnn2C(C)C 822098756 VMCBYMMPMZKTGP-UHFFFAOYSA-N 450.451 5.025 5 20 JKBD O=C(Nc1ccc(Cl)c([N+](=O)[O-])c1)[C@H](Sc1nnc(-c2ccccc2F)o1)c1ccccc1 844130849 GTXAQOGAKVZQET-LJQANCHMSA-N 484.896 5.909 5 20 JKBD C[C@@H](CC(=O)OCC(=O)Nc1c(Br)cc([N+](=O)[O-])cc1Br)CC(C)(C)C 866536795 VOHFVQLPRQYUEY-JTQLQIEISA-N 494.180 5.064 5 20 JKBD CC1=C(C(=O)Nc2ccc(F)cc2)[C@@H](c2ccc([N+](=O)[O-])o2)NC(=S)N1c1ccccc1Cl 887570862 JILUDZKUOFIPLW-HXUWFJFHSA-N 486.912 5.329 5 20 JKBD O=C(Nc1cc([N+](=O)[O-])c(F)cc1F)[C@@H](Oc1ccc(Br)cc1)c1ccccc1 916043470 ZGJQOJLPTSMTSP-IBGZPJMESA-N 463.234 5.394 5 20 JKBD CC(=O)N(c1ccc(F)cc1)c1nc(COC(=O)c2cc([N+](=O)[O-])ccc2N2CCCCC2)cs1 918959437 LJIQCYFPMYGGLR-UHFFFAOYSA-N 498.536 5.222 5 20 JKBD COc1cc(C(=O)OCc2ccc(Cl)c3cccnc23)c([N+](=O)[O-])cc1OCc1cscn1 920652935 NZPOZQJUYXZSPX-UHFFFAOYSA-N 485.905 5.198 5 20 JKBD O=C(O[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1)c1ccn(-c2cccc(F)c2)n1 920704092 WFCPYHOFCORSHM-QFIPXVFZSA-N 494.866 5.110 5 20 JKBD Cc1c(C(=O)NC2(c3ccc(NC(=O)c4cncc(F)c4)cc3)CCC2)cc(Cl)cc1[N+](=O)[O-] 1787474067 PDWNNPFGYVCPFF-UHFFFAOYSA-N 482.899 5.152 5 20 JKBD C[C@@H]1CCC[C@H]1C(=O)Nc1ccc(C2(NC(=O)Cn3ccc4ccc([N+](=O)[O-])cc43)CCC2)cc1 1789205345 HXZDDYIROJLAMZ-WZONZLPQSA-N 474.561 5.120 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)c3ccco3)CCC2)cc1)c1ccc(Br)c([N+](=O)[O-])c1 1790642368 RNKFPBPRFAMJHA-UHFFFAOYSA-N 484.306 5.012 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)c3ccc([N+](=O)[O-])o3)CCC2)cc1)c1ccc2c(Cl)ccnc2c1 1790837434 SHNSAOGYXFXARZ-UHFFFAOYSA-N 490.903 5.451 5 20 JKBD O=C(CSc1ccccc1[N+](=O)[O-])Nc1ccc(C2(NC(=O)CCc3ccco3)CCC2)cc1 1791521496 NAIUARONEQGNLF-UHFFFAOYSA-N 479.558 5.047 5 20 JKBD CC(C)c1ccc(C(=O)N2CC[C@@H](CNC(=O)/C=C/c3ccccc3[N+](=O)[O-])[C@H]2c2cccnc2)cc1 1814194137 LNNSALBZMVBJOX-FAWGBHEOSA-N 498.583 5.146 5 20 JKBD Cc1c(C(=O)N2CCCC[C@H]2c2cc(NC(=O)c3sccc3F)n[nH]2)cc(Cl)cc1[N+](=O)[O-] 1815429716 MJDKWKYOTLXSCT-INIZCTEOSA-N 491.932 5.100 5 20 JKBD Cc1c(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)C3CC(C)(C)C3)n[nH]2)cc(Cl)cc1[N+](=O)[O-] 1822475334 KGKJDFFXYBGSTQ-GOSISDBHSA-N 473.961 5.022 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)N1CCCC[C@@H]1C1CCN(C(=O)[C@@]2(F)CCCC=C2F)CC1 1830731477 WKQANLWKIVFRJB-CJFMBICVSA-N 493.526 5.021 5 20 JKBD CC[C@H](C)CC(=O)N1CCC([C@H]2CCCCN2C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)CC1 1831059933 LOAPNHHMUMQVHC-LAUBAEHRSA-N 471.623 5.479 5 20 JKBD Cc1csc(Sc2ccc(C(=O)N(C)Cc3nc4ccccc4s3)cc2[N+](=O)[O-])n1 10285712 WOCHZMCOXICFCT-UHFFFAOYSA-N 456.574 5.393 5 20 JKBD O=C(CSc1nnc(-c2ccccc2)c2ccccc12)Nc1cc2c(cc1[N+](=O)[O-])OCCCO2 11386370 RNRVULBHYPRCNV-UHFFFAOYSA-N 488.525 5.097 5 20 JKBD O=C(COC(=O)c1nc(Cl)c(Cl)c(Cl)c1Cl)Nc1ccc([N+](=O)[O-])cc1Cl 12681876 HOVRGBAVNXNDPV-UHFFFAOYSA-N 473.483 5.052 5 20 JKBD Cc1cccc(C)c1NC(=O)[C@H](C)OC(=O)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 17109901 QFGJJZDZJOLURR-INIZCTEOSA-N 493.482 5.017 5 20 JKBD Cc1nc(-c2ccccc2)sc1C(=O)O[C@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 17828518 RLXRCPFXTNVTFR-GFCCVEGCSA-N 479.436 5.230 5 20 JKBD O=C(CSc1ccc(C(F)(F)F)cc1[N+](=O)[O-])Nc1ccc(SCc2cccnc2)cc1 27120652 PUKWYOUSDXNWFJ-UHFFFAOYSA-N 479.505 6.032 5 20 JKBD O=C(Cn1c2ccccc2c(=O)c2ccccc21)N[C@@H](COc1ccccc1F)c1ccccc1 59020312 NXBKYDWEMYYAEI-DEOSSOPVSA-N 466.512 5.230 5 20 JKBD CCOc1cc(/C=C\C(=O)O[C@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)cc(Cl)c1OC 96888126 ROWYSOBVSFJTND-OMPYUXFZSA-N 473.869 5.023 5 20 JKBD O=C(Nc1ccc(-c2csnn2)cc1)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1 108937952 ASNKJYUGMHMPBI-UHFFFAOYSA-N 452.879 5.811 5 20 JKBD O=C(COc1ccccc1[N+](=O)[O-])Nc1ccc(NC(=O)c2ccccc2F)cc1C(F)(F)F 302942549 LOJXIEBHCCMQDI-UHFFFAOYSA-N 477.370 5.023 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)Nc2nc(-c3cccc(Br)c3)cs2)cc1SC 482152518 LMKDHWXQUMZFFU-UHFFFAOYSA-N 480.365 5.464 5 20 JKBD O=C(NCc1ccccc1F)c1cc(NC(=O)c2ccc([N+](=O)[O-])cc2Cl)ccc1Cl 484251048 GOXGGMVVOHRQSX-UHFFFAOYSA-N 462.264 5.223 5 20 JKBD COc1ccc(NS(=O)(=O)Cc2ccc(NC(=O)c3cc4ccccc4c4cccnc34)cc2)cc1 485164140 JHOJKTRBFXHWOW-UHFFFAOYSA-N 497.576 5.591 5 20 JKBD CCn1ncc2ccc(NC(=O)c3ccccc3C(=O)c3ccc(SC)c([N+](=O)[O-])c3)cc21 488658283 UNXKEHVOJDZKTP-UHFFFAOYSA-N 460.515 5.170 5 20 JKBD C[C@@H](Sc1nnc(-c2ccccc2)c2ccccc12)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 501181214 YDBPEOAATLURIJ-OAHLLOKOSA-N 455.499 6.108 5 20 JKBD O=C(NCCc1cn2c(n1)CCCC2)c1ccccc1Sc1ccc(C(F)(F)F)cc1[N+](=O)[O-] 506842530 KFQODUCZXPCMSY-UHFFFAOYSA-N 490.507 5.270 5 20 JKBD CCOc1cc(CN[C@@H]2CCc3c(Cl)cccc32)ccc1OCCn1c([N+](=O)[O-])cnc1C 507934102 UQOKSGRBVJYGOB-OAQYLSRUSA-N 470.957 5.008 5 20 JKBD COc1cc(C)ccc1Oc1ccc(F)cc1NC(=O)c1cnn(-c2ccc([N+](=O)[O-])cc2)c1 512817845 NTMLNUXYFLDOOU-UHFFFAOYSA-N 462.437 5.281 5 20 JKBD O=C(Cn1c2ccccc2c(=O)c2ccccc21)Nc1ccc(NC(=O)Nc2ccc(Cl)cc2)cc1 512959221 WKAGMCPDHOBLAF-UHFFFAOYSA-N 496.954 6.091 5 20 JKBD C[C@@H](NC(=O)CSc1ccc(C(F)(F)F)cc1[N+](=O)[O-])c1nc2ccccc2n1C(F)F 514768917 ODULAVGHODBGBX-SNVBAGLBSA-N 474.411 5.328 5 20 JKBD COc1ccc([N+](=O)[O-])cc1NC(=O)[C@@H](C)Nc1ccc(Oc2ncc(Cl)cc2Cl)cc1 515762714 MUHUNNMYZQTYCX-GFCCVEGCSA-N 477.304 5.537 5 20 JKBD COc1cc(C(=O)N[C@H]2CCC(C)(C)c3ccccc32)c([N+](=O)[O-])cc1OCc1cscn1 520953984 JCRQOBNIMDIWJB-IBGZPJMESA-N 467.547 5.181 5 20 JKBD Cc1ccc(NC(=O)CN[C@@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2ccccc2)c(Cl)c1 521767898 XGHFDGOEBWRIRN-JOCHJYFZSA-N 487.343 5.118 5 20 JKBD COc1ccc2c(c1)CCN2C(=O)C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1 521844502 QGSNCGUXNAPBEX-RGEXLXHISA-N 471.538 5.733 5 20 JKBD O=C(Cn1c2ccccc2c(=O)c2ccccc21)N1CCO[C@H](c2ccc(Cl)c(Cl)c2)C1 589539084 SEGXIKTYYFQSTG-QHCPKHFHSA-N 467.352 5.062 5 20 JKBD O=C(NCCCn1ccnc1)c1c2c(nc3ccccc13)/C(=C/c1cccc([N+](=O)[O-])c1)CCC2 590781138 RYRLVCVHDPIRQD-CAPFRKAQSA-N 467.529 5.037 5 20 JKBD O=C(Nc1cc([N+](=O)[O-])ccc1OC(F)F)c1cnn(-c2ccc(Cl)cc2)c1C(F)(F)F 603639103 OXZHJFNBQUVXMH-UHFFFAOYSA-N 476.745 5.306 5 20 JKBD CCCOc1c(Cl)cc(/C=C2/CCn3c2nc2ccc([N+](=O)[O-])cc2c3=O)cc1OCC 603781252 FXOMQTPEUXXOPI-GDNBJRDFSA-N 455.898 5.090 5 20 JKBD C[C@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)Nc1ccc(C(=O)N2CCCC[C@H]2C)c(Cl)c1 604443646 GQNWDTRMATYBDR-KGLIPLIRSA-N 480.348 5.322 5 20 JKBD C[C@H]1C[C@@H](C)CN(c2ccc(C(=O)Nc3c(-c4ccccc4)ncn3C3CC3)cc2[N+](=O)[O-])C1 604544158 QMJFYSGIKRNQRB-HDICACEKSA-N 459.550 5.528 5 20 JKBD Cc1csc([C@@H](C)NC(=O)c2ccccc2Sc2ccc(C(F)(F)F)cc2[N+](=O)[O-])n1 609015623 VWRQYYLBKFIBGV-GFCCVEGCSA-N 467.494 6.021 5 20 JKBD COc1ccc(CN(Cc2ccc(OC)cc2)C(=O)c2csc(-c3cccc([N+](=O)[O-])c3)n2)cc1 609129951 XUUYMWPDWBQNOT-UHFFFAOYSA-N 489.553 5.578 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)OCc2nnc(-c3ccc(Cl)cc3Cl)o2)cc1SC 728651292 SHLPHTCSOOFBCW-UHFFFAOYSA-N 470.290 5.039 5 20 JKBD O=C(O[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1)c1nccc2ccccc12 743200173 XYEVJAQGIYZTNJ-JOCHJYFZSA-N 461.861 5.333 5 20 JKBD Cc1ccccc1NC(=O)c1cc2ccccc2cc1OS(=O)(=O)c1c(F)cccc1[N+](=O)[O-] 746177612 POZIPKZYJCKKAJ-UHFFFAOYSA-N 480.473 5.216 5 20 JKBD Cc1oc2cc(OS(=O)(=O)c3c(F)cccc3[N+](=O)[O-])ccc2c(=O)c1-c1ccccc1Cl 746177884 UYUQHAZJZDIVOC-UHFFFAOYSA-N 489.864 5.237 5 20 JKBD COc1ccc([C@H]2CCCCCN2C(=O)COC(=O)c2csc(-c3ccc([N+](=O)[O-])cc3)n2)cc1 747954969 QGULQXCXLRIYIA-JOCHJYFZSA-N 495.557 5.028 5 20 JKBD COc1ccc(CNc2cc(C(=O)N(C)C)ccc2Cl)cc1OCc1ccc([N+](=O)[O-])cc1 863996159 RMOVTOODYQAEHO-UHFFFAOYSA-N 469.925 5.150 5 20 JKBD CC(C)N(Cc1nnc(-c2cccc([N+](=O)[O-])c2)o1)C(=O)c1cc2c(s1)CCCCCC2 864240049 UVSXXDVZGOOPSW-UHFFFAOYSA-N 454.552 5.416 5 20 JKBD COc1ccc(N[C@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2C(F)(F)F)cc1NC(=O)OC(C)(C)C 915224094 FJQBNJFQUZXVJU-GFCCVEGCSA-N 498.458 5.408 5 20 JKBD O=[N+]([O-])c1ccc(F)cc1CSc1nnc(CN2CCCCC2)n1-c1ccc(OC(F)F)cc1 915789973 PXBQETVKLRWNGW-UHFFFAOYSA-N 493.511 5.194 5 20 JKBD O=C1CSc2ccc(C(=O)Nc3cc(Cl)c([N+](=O)[O-])cc3OCc3ccccc3)cc2N1 916827784 YHPAUDWCOIHDSA-UHFFFAOYSA-N 469.906 5.124 5 20 JKBD CCOc1ccc(CN(C(=S)Nc2ccc([N+](=O)[O-])cc2)c2ccc(OC)c(Cl)c2)cc1 917047550 MRLYOUDCRYOHBY-UHFFFAOYSA-N 471.966 6.059 5 20 JKBD CSc1ccccc1NC(=O)[C@H](C)OC(=O)c1cc([N+](=O)[O-])ccc1Oc1ccccc1 919192771 NLOFFAWSGIFBIL-HNNXBMFYSA-N 452.488 5.293 5 20 JKBD COc1ccc2cc(C(=O)NC3(c4ccc(NC(=O)Cc5cccc([N+](=O)[O-])c5)cc4)CCC3)[nH]c2c1 1785791593 HDUKXCCMMPDTHN-UHFFFAOYSA-N 498.539 5.075 5 20 JKBD Cc1c(C(=O)NC2(c3ccc(NC(=O)c4ccco4)cc3)CCC2)cc(Br)cc1[N+](=O)[O-] 1787271546 ZJGMLLXRTJJCJR-UHFFFAOYSA-N 498.333 5.320 5 20 JKBD O=C(NC1(c2ccc(NC(=O)[C@@H]3CCC=CO3)cc2)CCC1)c1cc2cc([N+](=O)[O-])ccc2s1 1789503529 SWLQYVKUOBZDKX-FQEVSTJZSA-N 477.542 5.250 5 20 JKBD O=C(c1cccc(Cl)c1)N1CCC([C@H]2CCCCN2C(=O)CCc2cccc([N+](=O)[O-])c2)CC1 1824841242 FUGCXAHIJZAVNJ-XMMPIXPASA-N 483.996 5.114 5 20 JKBD Cc1c(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)/C=C/c3ccc([N+](=O)[O-])o3)CC2)oc2ccccc12 1828125588 VDVBWIWSDYOKBG-XBFAEUMISA-N 491.544 5.189 5 20 JKBD CC(C)CCC(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)CC1 1831061367 RHFJTPMQCMZMIV-NRFANRHFSA-N 471.623 5.479 5 20 JKBD Cc1oc(C(C)(C)C)cc1C(=O)N1CCCC12CN(C(=O)c1cc3cc([N+](=O)[O-])ccc3s1)C2 1842453712 ANOSWSBMLNQQPO-UHFFFAOYSA-N 481.574 5.139 5 20 JKBD C[C@@H](NC(=O)CCNc1ccc(C(F)(F)F)cc1[N+](=O)[O-])c1nc2ccccc2n1C(F)F 9855586 XGAQBWYJBAQWJV-LLVKDONJSA-N 471.386 5.038 5 20 JKBD C[C@@H](OC(=O)CCc1ncc(-c2ccccc2Cl)o1)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 12255521 LERIDGJHUMCKPL-CYBMUJFWSA-N 468.853 5.190 5 20 JKBD C[C@H](OC(=O)COc1ccc(C2SCCCS2)cc1)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl 17267964 XURGKXHKLQOJNJ-ZDUSSCGKSA-N 496.994 5.066 5 20 JKBD CCOc1ccc(-c2nc(NC(=O)c3cc(OC)c(OCC)cc3[N+](=O)[O-])sc2C)cc1 19201093 KOKFNRLTVJQMGK-UHFFFAOYSA-N 457.508 5.085 5 20 JKBD COc1ccc(-c2cc(C(=O)OCc3nnc(-c4ccc([N+](=O)[O-])cc4)o3)sc2C)cc1 23583033 FXVIITQOVIJXEV-UHFFFAOYSA-N 451.460 5.047 5 20 JKBD C[C@H](Sc1nnc(C[C@H](C)c2ccccc2)o1)C(=O)Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1 255939846 VJCRELCAJYUOHL-GJZGRUSLSA-N 495.586 5.567 5 20 JKBD C[C@H](NC(=O)c1csc(-c2cccc([N+](=O)[O-])c2)n1)c1cccc(NC(=O)c2ccccc2)c1 303018578 LDGWKCYMSVQUGJ-INIZCTEOSA-N 472.526 5.462 5 20 JKBD Cc1sc2ncnc(Sc3ccccc3C(=O)Nc3cccc([N+](=O)[O-])c3C)c2c1C 481335363 AEBZRVACPIYUSE-UHFFFAOYSA-N 450.545 5.928 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)NCc2ccccc2-c2ccc(CN3CCCC3)cc2)cc1SC 490217548 OUVCXVSSQVHYGG-UHFFFAOYSA-N 491.613 5.518 5 20 JKBD CC(=O)N(C)C1CCN(C(=O)c2c3c(nc4ccccc24)/C(=C/c2cccc([N+](=O)[O-])c2)CCC3)CC1 500031409 SBPGSSGOORSZGY-HEHNFIMWSA-N 498.583 5.103 5 20 JKBD O=C([C@H]1CCC[C@@H](C(F)(F)F)C1)N1CCN(Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)CC1 500725792 PAVNRQAPPJUCIL-DLBZAZTESA-N 481.540 5.336 5 20 JKBD O=C(Nc1ccc(OC[C@@H]2CCCO2)cc1)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 502051609 UEGPZTSIOMZEAG-FQEVSTJZSA-N 493.482 5.027 5 20 JKBD C[C@@H](Nc1ccc(C(=O)Nc2ccc(-c3nc4ccccc4[nH]3)cc2)cc1[N+](=O)[O-])c1ccccn1 506086167 OVVCYRXREQWEOX-QGZVFWFLSA-N 478.512 5.959 5 20 JKBD O=C(N[C@H]1CCCc2nc(-c3ccc(F)cc3)sc21)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-] 520566190 NUDNIPZTBPPWJC-INIZCTEOSA-N 495.454 5.606 5 20 JKBD C[C@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)NC1CCN(Cc2ccc(Cl)c(Cl)c2)CC1 521329006 LPRUAPWNOJVEET-ZDUSSCGKSA-N 486.783 5.103 5 20 JKBD COc1ccc(CSc2nnc(-c3ccccc3F)n2Cc2ccccc2)cc1[N+](=O)[O-] 603721945 HAZQYMOYDBYMQO-UHFFFAOYSA-N 450.495 5.342 5 20 JKBD CCOc1cc(C(=O)Nc2ccccc2Oc2ncc(Cl)cc2Cl)c([N+](=O)[O-])cc1OC 603744682 ZIGRYXKKXGRTEM-UHFFFAOYSA-N 478.288 5.749 5 20 JKBD CC(C)C[C@@H](NC(=O)CCCn1c(=O)oc2cc([N+](=O)[O-])ccc21)c1cccc(C(F)(F)F)c1 608851484 WQUIYGGLCWNKAP-GOSISDBHSA-N 479.455 5.205 5 20 JKBD CC[C@@H](C)Sc1ccc(NC(=O)c2cc([N+](=O)[O-])cc3c2OCCO3)c(C(F)(F)F)c1 608942601 LHGZWVFTUMGPBX-LLVKDONJSA-N 456.442 5.528 5 20 JKBD Cn1nc(C(F)(F)F)c(-c2ccc(Cl)cc2)c1NC(=O)c1ccc(NC2CC2)c([N+](=O)[O-])c1 609090339 GPZPFEIAFMFAPQ-UHFFFAOYSA-N 479.846 5.494 5 20 JKBD Cn1cnnc1Sc1ccc(Br)cc1NC(=O)c1ccc(C(C)(C)C)c([N+](=O)[O-])c1 609170375 PHMOKPGIHCOOSD-UHFFFAOYSA-N 490.383 5.187 5 20 JKBD Cc1nc(-c2ccc([C@H](C)N[C@H](C)C(=O)Nc3ccc([N+](=O)[O-])cc3C(F)(F)F)cc2)cs1 619556408 GZAASBPLRCNJAP-QWHCGFSZSA-N 478.496 5.723 5 20 JKBD CCCc1cc[n+](/C(C(=S)NC23CC4CC(CC(C4)C2)C3)=C(/O)c2ccc(C)c([N+](=O)[O-])c2)cc1 725762480 UCNGFFGKBWMIOO-UHFFFAOYSA-O 492.665 5.913 5 20 JKBD Cc1cc[n+](/C(C(=S)NCc2cccc(C(F)(F)F)c2)=C(/O)c2ccc(C)c([N+](=O)[O-])c2)cc1 726570352 NCBOKIUMXKCVIM-UHFFFAOYSA-O 488.511 5.519 5 20 JKBD CC(C)(C)n1cc(C(=O)OCc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)c(-c2ccccc2Cl)n1 731084929 JITYQGFVPNAFNT-UHFFFAOYSA-N 481.896 5.274 5 20 JKBD C[C@H](OC(=O)c1csc(-c2cccc([N+](=O)[O-])c2)n1)C(=O)Nc1ccccc1Cc1ccccc1 747962793 UIQADOAJHYZCBI-KRWDZBQOSA-N 487.537 5.493 5 20 JKBD CC[C@@H](C)Sc1ccc(NC(=O)Cn2ncc3ccc([N+](=O)[O-])cc32)c(C(F)(F)F)c1 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Cc1nn(Cc2ccc(C(=O)N3CCC[C@H]3Cc3ccc(Br)cc3)cc2)c(C)c1[N+](=O)[O-] 920810692 ZZUFPYYEWNFFOR-QFIPXVFZSA-N 497.393 5.066 5 20 JKBD CCc1cc(C(=O)NC2(c3ccc(NC(=O)c4ccc([N+](=O)[O-])cc4F)cc3)CCC2)cc(C)n1 1790621817 JKRNTCLATFUUSI-UHFFFAOYSA-N 476.508 5.061 5 20 JKBD O=C(/C=C/c1ccccc1[N+](=O)[O-])N1CCC([C@@H]2CCCCN2C(=O)C2CCC(F)(F)CC2)CC1 1824329199 SFVMMWSHSMRCAL-UVIRAJKCSA-N 489.563 5.053 5 20 JKBD O=C(c1ccc(F)cc1)N1CCC([C@@H]2CCCCN2C(=O)C2(c3cccc([N+](=O)[O-])c3)CCC2)CC1 1830292892 KWFHFLMWCHTVJZ-VWLOTQADSA-N 493.579 5.089 5 20 JKBD Cc1cc(F)c(C(=O)N2CCC([C@@H]3CCCCN3C(=O)/C=C/c3ccccc3[N+](=O)[O-])CC2)cc1F 1832903477 DVZULNAWADPTNQ-GTCGAKFVSA-N 497.542 5.128 5 20 JKBD C[C@@H](OC(=O)c1ccccc1SCc1ccco1)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl 18410451 BZTZFJOLMBONOY-CYBMUJFWSA-N 460.895 5.318 5 20 JKBD O=c1c2ccccc2nc(SCc2nc3ccccc3c3ccccc23)n1C[C@@H]1CCCO1 20057390 AEVWNNASUDEZIT-SFHVURJKSA-N 453.567 5.569 5 20 JKBD Cc1nc(SCC(=O)Nc2ccc([N+](=O)[O-])cc2C(F)(F)F)n(C2CCCCC2)c1C 22216008 CBEDMMUVYVMMCZ-UHFFFAOYSA-N 456.490 5.663 5 20 JKBD Cc1ccc(-n2c(SCC(=O)Nc3ccc(Cl)c([N+](=O)[O-])c3)nnc2-c2ccncc2)cc1C 24298722 RXYMFFZXEGRPHX-UHFFFAOYSA-N 494.964 5.239 5 20 JKBD C[C@@H](N[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1)c1ccc(NC(=O)C2CC2)cc1 28346968 FMIAZXGNFMKWAY-GYCJOSAFSA-N 492.963 5.627 5 20 JKBD Cc1cc(NC(=O)Cc2csc(-c3ccccc3Cl)n2)n(-c2ccc([N+](=O)[O-])cc2)n1 105531259 AHOGIBYWYDHEKU-UHFFFAOYSA-N 453.911 5.047 5 20 JKBD COC(=O)CSCc1cccc(NC(=O)c2ccc(Sc3nc(C)cs3)c([N+](=O)[O-])c2)c1 485189497 GYDGOCMQPVWZMO-UHFFFAOYSA-N 489.600 5.169 5 20 JKBD CCC(CC)C(=O)N1CCC(NCc2ccc(Oc3ccccc3Cl)c([N+](=O)[O-])c2)CC1 509611174 ZOOQRVHRWVPRAS-UHFFFAOYSA-N 459.974 5.557 5 20 JKBD COCCN(C(=O)C[C@H]1CCCc2cc(OC)ccc21)c1nc(-c2ccc([N+](=O)[O-])cc2)cs1 512383960 IJZIYIBHXCTIKE-LJQANCHMSA-N 481.574 5.217 5 20 JKBD COc1ccc(Oc2ccc([N+](=O)[O-])cc2C(=O)N2CCC(C(=O)c3ccc(Cl)cc3)CC2)cc1 515988997 XNPWANBPMYZXRG-UHFFFAOYSA-N 494.931 5.784 5 20 JKBD O=C(CC(F)(F)F)N1CCC(NCc2ccc(Oc3ccccc3Cl)c([N+](=O)[O-])c2)CC1 518777332 AZQAXSOUJWHVHS-UHFFFAOYSA-N 471.863 5.074 5 20 JKBD CCCCN(C(=O)CCn1cc([N+](=O)[O-])cn1)c1nc(-c2ccc(Cl)cc2Cl)cs1 520080750 SCLWRFPTNKJWOW-UHFFFAOYSA-N 468.366 5.445 5 20 JKBD O=[N+]([O-])c1cc(CNCCc2cc(F)cc3c2OCOC3)ccc1Oc1ccccc1Cl 521829566 KLDFPJGMHUISAP-UHFFFAOYSA-N 458.873 5.378 5 20 JKBD COc1ccc(CSCC(=O)N(Cc2ccccc2C(F)(F)F)C2CC2)cc1[N+](=O)[O-] 603566947 LXPXHMDGUBHFBW-UHFFFAOYSA-N 454.470 5.047 5 20 JKBD COc1cc([C@H](C)Nc2ccc([N+](=O)[O-])c(C(=O)N3CCCC3)c2)ccc1OCc1ccccc1 603944006 YBBLOKCZWHEEHC-IBGZPJMESA-N 475.545 5.592 5 20 JKBD Cc1noc(-c2ccc(C)c(NC(=O)Cc3cn(-c4ccccc4)nc3-c3ccc([N+](=O)[O-])cc3)c2)n1 603987551 PDQDWZAOQBVSCT-UHFFFAOYSA-N 494.511 5.296 5 20 JKBD COC(=O)COc1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2Sc2ccc(Cl)cc2)c(C)c1 604013632 XWSOJMOMXJMXPK-UHFFFAOYSA-N 486.933 5.512 5 20 JKBD Cc1ccc(C(C)C)c(Oc2ccc(CN[C@H]3CCCc4c3cnn4CCO)cc2[N+](=O)[O-])c1 608782042 KHEZWONVABNJFI-QFIPXVFZSA-N 464.566 5.175 5 20 JKBD Cc1csc(Sc2ccc(C(=O)N(Cc3ccsc3)c3cccnc3)cc2[N+](=O)[O-])n1 608799077 HGRRZHWAGZDHNJ-UHFFFAOYSA-N 468.585 5.814 5 20 JKBD Cc1csc(Sc2ccc(C(=O)N3CCO[C@H](c4ccc(F)c(Cl)c4)C3)cc2[N+](=O)[O-])n1 608962188 ALCFJCDVAVSURR-SFHVURJKSA-N 493.969 5.517 5 20 JKBD COc1ccccc1[C@H]1CCCN1C(=O)C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1 609036416 FLKYLLUBBJYDOJ-BKWQBPKISA-N 499.592 6.508 5 20 JKBD O=C(c1ccccc1C(F)(F)F)N1CCN(C(=O)c2cc3ccccc3c3cccnc23)CC1 613623754 GVVFJGZJLXKMSO-UHFFFAOYSA-N 463.459 5.005 5 20 JKBD C[C@@H](OC(=O)c1sccc1SC(F)F)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 730661093 RRDSRCFENYWLOL-SSDOTTSWSA-N 470.397 5.174 5 20 JKBD CC(=O)N(c1ccc(C)cc1)c1nc(/C=C2/N=C(c3c(Cl)cccc3[N+](=O)[O-])OC2=O)cs1 730958632 YCKBVNMMCXITAU-LICLKQGHSA-N 482.905 5.042 5 20 JKBD C[C@@H](OC(=O)c1cnc(-c2ccccc2Cl)s1)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl 747954985 RERGBYMLELPOCH-SNVBAGLBSA-N 466.302 5.209 5 20 JKBD O=C(N[C@H](c1ccc(Cl)cc1)c1ccsc1)c1cc([N+](=O)[O-])ccc1Br 751106584 AJOJVSQGKLTEQD-QGZVFWFLSA-N 451.729 5.592 5 20 JKBD O=C(Cc1ccc(NCc2c(Br)cccc2[N+](=O)[O-])cc1)N1CCc2ccccc21 864027018 BTUBLAQSUUPOFJ-UHFFFAOYSA-N 466.335 5.101 5 20 JKBD CCOC(=O)c1c(-c2ccccc2Cl)csc1NC(=O)c1cc(OC)c(OC)cc1[N+](=O)[O-] 912623422 YZOFWMMWXWHNGT-UHFFFAOYSA-N 490.921 5.423 5 20 JKBD C[C@@H](OC(=O)c1nc(-c2ccccc2)n2c1CCCCC2)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 914915220 DEGUSNVLPUOYOS-MRXNPFEDSA-N 473.489 5.153 5 20 JKBD CSc1ccc([N+](=O)[O-])c(C(=O)O[C@H](C(=O)Nc2ccccc2C(F)(F)F)C(C)C)c1 915374415 IMHMSRNKLOZHJE-KRWDZBQOSA-N 456.442 5.156 5 20 JKBD Cc1ccc(/C(O)=C(/C(=S)Nc2c(C(C)C)cccc2C(C)C)[n+]2ccccc2)cc1[N+](=O)[O-] 917611159 UTJRPVNYRXBGGX-UHFFFAOYSA-O 476.622 6.761 5 20 JKBD CC1=C(C(=O)Nc2ccccc2C(F)(F)F)[C@H](c2csc([N+](=O)[O-])c2)NC(=O)N1CC1CC1 918076895 USOBPPRKVGGSAG-SFHVURJKSA-N 480.468 5.064 5 20 JKBD CC(=O)N(c1ccc(Cl)cc1)c1nc(COC(=O)c2cc3cc([N+](=O)[O-])ccc3o2)cs1 919212432 ARAUZBMXYIDHIR-UHFFFAOYSA-N 471.878 5.493 5 20 JKBD CC(C)c1cccc(O[C@@H](C)C(=O)O[C@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2C(F)(F)F)c1 919450904 PTCICFBKGCQEMD-KGLIPLIRSA-N 468.428 5.075 5 20 JKBD CN(C)c1ccc([N+](=O)[O-])c(C(=O)Nc2ccc(C3(NC(=O)C[C@@H]4C[C@@H]5CC[C@H]4C5)CCC3)cc2)c1 1790056091 DSHIGWYFXUNECQ-AABGKKOBSA-N 490.604 5.235 5 20 JKBD Cc1ccc(C(=O)NC2(c3ccc(NC(=O)CSc4ccccc4[N+](=O)[O-])cc3)CCC2)nc1C 1791521252 CXJMBWBKIFMIKS-UHFFFAOYSA-N 490.585 5.147 5 20 JKBD O=C(NC1(c2ccc(NC(=O)[C@H]3CC[C@H](C(F)(F)F)CC3)cc2)CCC1)c1ccc([N+](=O)[O-])o1 1792240588 JJOPXDSSIWXBKF-KOMQPUFPSA-N 479.455 5.304 5 20 JKBD CCC[C@H]1CC[C@H](C(=O)N2CCCC[C@@H]2c2cc(NC(=O)/C=C/c3ccc([N+](=O)[O-])o3)n[nH]2)CC1 1814970007 NBVILVARVQNXES-LGPFQHAYSA-N 483.569 5.223 5 20 JKBD CC[C@H](C)[C@H](C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2ccc([N+](=O)[O-])o2)[nH]n1)c1ccccc1 1816848406 VAOJCPPYCNXFRU-NVVBAYIOSA-N 479.537 5.047 5 20 JKBD Cc1c(C(=O)N2CCC([C@H]3CCCCN3C(=O)c3ccc([N+](=O)[O-])o3)CC2)cccc1C(F)(F)F 1823615321 FWFKVRDRCCUTSC-LJQANCHMSA-N 493.482 5.062 5 20 JKBD Cc1c(C(=O)N2CCC([C@H]3CCCCN3C(=O)CCc3ccco3)CC2)cc(Cl)cc1[N+](=O)[O-] 1825248928 IQHNABWZMDIIQD-JOCHJYFZSA-N 487.984 5.016 5 20 JKBD O=C(c1ccc2cnccc2c1)N1CCC([C@@H]2CCCCN2C(=O)/C=C/c2ccccc2[N+](=O)[O-])CC1 1832907035 MNKMROHESYBIGF-BKRCECSGSA-N 498.583 5.090 5 20 JKBD O=[N+]([O-])c1ccc(C23CC4CC(c5ccc([N+](=O)[O-])cc5)(C2)CC(c2ccc([N+](=O)[O-])cc2)(C4)C3)cc1 2048532888 JIOGYTVWYIZINK-UHFFFAOYSA-N 499.523 6.523 5 20 JKBD O=C(Cn1c2ccccc2c(=O)c2ccccc21)Nc1cc(C(F)(F)F)ccc1N1CCCCC1 14729660 PEDPVSMRIZNPIX-UHFFFAOYSA-N 479.502 5.803 5 20 JKBD O=C(N[C@H](c1ccccc1)c1ccccn1)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 23685371 GQLXNGCVRLGAEL-HSZRJFAPSA-N 484.478 5.131 5 20 JKBD Cc1ccc(Nc2nnc(S[C@@H](C)c3nnc(-c4ccc([N+](=O)[O-])cc4)o3)s2)cc1Cl 24506656 FTPDOYZMEPIJPI-NSHDSACASA-N 474.955 6.055 5 20 JKBD CCn1c(SCc2nnc(-c3c(-c4ccccc4)noc3C)o2)nc2cc3ccccc3cc2c1=O 24892286 HMTGUBDCEQJXAF-UHFFFAOYSA-N 495.564 5.875 5 20 JKBD CC(=O)Nc1nc(COC(=O)c2ccc(Sc3nc4ccccc4s3)c([N+](=O)[O-])c2)cs1 26426741 VTGYFCRLHVBPPI-UHFFFAOYSA-N 486.556 5.128 5 20 JKBD C[C@H](Sc1nn(-c2ccccc2)c(=S)s1)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl 36796594 NRPMJPPFEUVJMR-JTQLQIEISA-N 452.970 5.344 5 20 JKBD O=C(N[C@@H]1CCN2CCC[C@H]2C1)c1ccccc1Sc1ccc(C(F)(F)F)cc1[N+](=O)[O-] 484934071 LQNAVVSUNMQEER-CVEARBPZSA-N 465.497 5.121 5 20 JKBD O=C(Cc1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1)N[C@H](c1ccccc1)c1cccnc1 485476967 GEBRFTFCZLELDD-MUUNZHRXSA-N 489.535 5.291 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)N2CCC[C@H](c3nc(-c4ccc(Cl)cc4)no3)C2)cc1SC 486655497 UKXZEWHRMCRQQX-AWEZNQCLSA-N 488.953 5.049 5 20 JKBD COc1cc(C(=O)N2CCC(OC3CCCC3)CC2)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 503323415 DDHJXYWGTFLVME-UHFFFAOYSA-N 474.941 5.613 5 20 JKBD COc1cc(C(=O)N[C@H](C)c2ccc(SC(C)C)cc2)c([N+](=O)[O-])cc1OCc1cscn1 504713752 YORBAMBRNAIGAM-OAHLLOKOSA-N 487.603 5.630 5 20 JKBD C[C@@H](Nc1ccc(C(=O)NCc2cccnc2Oc2cccc(F)c2)cc1[N+](=O)[O-])c1ccccn1 507048078 NPMFTZKKXSWUMC-QGZVFWFLSA-N 487.491 5.419 5 20 JKBD C[C@H](Nc1ccc(C(=O)Nc2ccccc2OCCc2ccccc2)cc1[N+](=O)[O-])c1ccccn1 507052742 OQCFLGCDIMRRDG-FQEVSTJZSA-N 482.540 6.037 5 20 JKBD CCN(C(=O)NCc1ccc([N+](=O)[O-])cc1)[C@H]1CCSc2ccc(Br)cc21 508109582 LOGKUXWMENMVBL-KRWDZBQOSA-N 450.358 5.126 5 20 JKBD Cc1cccc(-c2nc(C(C)C)no2)c1NC(=O)c1ccc(Nc2ccccc2)c([N+](=O)[O-])c1 509348788 UBWCNKQLWVQHKD-UHFFFAOYSA-N 457.490 6.073 5 20 JKBD CSc1ccc([N+](=O)[O-])c(C(=O)N(Cc2ccccn2)c2ccc(Br)cc2)c1 511067194 YUBZUODTBBASIE-UHFFFAOYSA-N 458.337 5.321 5 20 JKBD CCc1ccc(OCc2nnc(Sc3ccc([N+](=O)[O-])cn3)n2[C@@H](C)c2ccccc2)cc1 512742643 AYAADFWPFOGPFB-KRWDZBQOSA-N 461.547 5.483 5 20 JKBD CC(C)C(=O)Nc1ccc(CNCc2cn(-c3ccccc3)nc2-c2ccc([N+](=O)[O-])cc2)cc1 518766218 LHJKEIFJWNMNSS-UHFFFAOYSA-N 469.545 5.332 5 20 JKBD COc1ccccc1Oc1ccc(NC(=O)[C@@H]2CCCN2C(=O)c2ccc([N+](=O)[O-])c(C)c2)cc1F 523258023 TVFVJSUUWIDRIC-NRFANRHFSA-N 493.491 5.087 5 20 JKBD CCOC(=O)c1cc(C(=O)Nc2c(-c3ccc(Cl)cc3)c(C(F)(F)F)nn2C)cc([N+](=O)[O-])c1 609026509 JSNDRTKMOREAFD-UHFFFAOYSA-N 496.829 5.097 5 20 JKBD O=C(C1CCN(c2ccccc2[N+](=O)[O-])CC1)N(Cc1ccccc1F)c1ccccc1F 609228381 BOYISBSDUYMOMH-UHFFFAOYSA-N 451.473 5.323 5 20 JKBD COc1ccc(NC(=O)/C=C\c2ccc([N+](=O)[O-])cc2)cc1OCc1ccc2ccccc2n1 728009201 UJKSDWPVKYZOEU-NVNXTCNLSA-N 455.470 5.383 5 20 JKBD Cc1ccc2nc(-c3ccc(NC(=O)[C@H](C)OC(=O)c4cc([N+](=O)[O-])cnc4C)cc3)sc2c1 730011842 DJRMCWFPSKRYSD-HNNXBMFYSA-N 476.514 5.067 5 20 JKBD Cc1c(C(=O)Nc2ccc(CN3C(=O)Cc4ccc(Cl)cc43)cc2)cc([N+](=O)[O-])c(C)c1[N+](=O)[O-] 748638323 HBFFVXRWQQUSQM-UHFFFAOYSA-N 494.891 5.115 5 20 JKBD O=C(Nc1ccc(Oc2ncc(Cl)cc2Cl)cc1)c1cc([N+](=O)[O-])ccc1Br 751089311 MCMFOQRUKTYZMB-UHFFFAOYSA-N 483.105 6.104 5 20 JKBD CCOC(=O)/C=C/c1ccc(NC(=O)c2ccccc2NC(=O)c2ccc([N+](=O)[O-])cc2Cl)cc1 759309033 RAMAPVRWDAOODO-NTEUORMPSA-N 493.903 5.329 5 20 JKBD CC1CCN(c2ccc([N+](=O)[O-])cc2C(=O)OCC(=O)Nc2ccc(Cl)cc2C(F)(F)F)CC1 772475743 RJKWUBRRVMYHSL-UHFFFAOYSA-N 499.873 5.299 5 20 JKBD O=C(COc1ccc2c(-c3ccc([N+](=O)[O-])cc3)cc(=O)oc2c1)N[C@H](c1ccccc1)C1CC1 851958377 BZDNIOSULQVRJQ-HHHXNRCGSA-N 470.481 5.015 5 20 JKBD COc1ccc(Oc2ccc([N+](=O)[O-])cc2C(=O)O[C@@H](C)C(=O)Nc2ccc(C)cc2C)cc1 915442714 PXEVEEWHGROAIN-KRWDZBQOSA-N 464.474 5.197 5 20 JKBD COc1ccc([C@H]2[C@H](C(=O)Nc3cc([N+](=O)[O-])ccc3OC)CCC(=O)N2c2ccc(C)cc2)cc1 916665259 QHLBIZHGUIMXSC-GJZUVCINSA-N 489.528 5.043 5 20 JKBD CCC(C)(C)NC(=O)c1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2N2CCC(C)CC2)cc1Cl 917761197 JHOOTIVKAWVVLN-UHFFFAOYSA-N 487.000 5.655 5 20 JKBD C[C@H](OC(=O)c1ccc(N[C@H](C)c2ccccn2)c([N+](=O)[O-])c1)C(=O)N1c2ccccc2CC[C@H]1C 920546472 YLDTWYSIISYCPT-QRVBRYPASA-N 488.544 5.076 5 20 JKBD CC(C)c1cccc(C(C)C)c1NC(=O)COC(=O)[C@H](C)Oc1ccc(Cl)cc1[N+](=O)[O-] 920776978 FYFBPUZBHRTKTF-HNNXBMFYSA-N 462.930 5.444 5 20 JKBD Cc1c(NC(=O)[C@H](C)OC(=O)c2csc(-c3ccc(Cl)cc3Cl)n2)cccc1[N+](=O)[O-] 921223355 JFXYCVUFEYGSIT-NSHDSACASA-N 480.329 5.518 5 20 JKBD CC(F)(F)C(C)(C)C(=O)NC1(c2ccc(NC(=O)Cc3cc([N+](=O)[O-])ccc3F)cc2)CCC1 1786669914 LYMJDURXEIEJOY-UHFFFAOYSA-N 477.483 5.092 5 20 JKBD O=C(/C=C/c1ccc([N+](=O)[O-])o1)NC1(c2ccc(NC(=O)c3ccc4occc4c3)cc2)CCC1 1789048124 YYNRKXONEGHCLM-JXMROGBWSA-N 471.469 5.395 5 20 JKBD O=C(c1ccc(Oc2ccccc2)cc1)N1CCC2(CCCN(C(=O)c3ccc([N+](=O)[O-])o3)C2)CC1 1804651161 LWWGJAQBRVQXAK-UHFFFAOYSA-N 489.528 5.139 5 20 JKBD CC1(C(=O)N2CCCC[C@H]2c2cc(NC(=O)Cc3ccc(Cl)cc3[N+](=O)[O-])n[nH]2)CCCCC1 1814845556 BDQSCVNQWFZJRH-IBGZPJMESA-N 487.988 5.177 5 20 JKBD O=C(Nc1nc2c(s1)C[C@@H](NC(=O)C1CC3(CCC3)C1)CC2)c1cc2cc([N+](=O)[O-])ccc2s1 1824427560 NYWKSMQOOMMWFN-HNNXBMFYSA-N 496.614 5.072 5 20 JKBD Cc1ccc([C@H](C)C(=O)N2CCC([C@@H]3CCCCN3C(=O)c3cccc(F)c3[N+](=O)[O-])CC2)cc1 1830623632 XGJLPVOYPGWXJW-CYFREDJKSA-N 481.568 5.079 5 20 JKBD CC(=O)Nc1ccc(N[C@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2ccccc2)cc1Cl 10942796 IFDZNPZEPDVBLZ-NRFANRHFSA-N 473.316 5.652 5 20 JKBD CC(=O)Nc1ccc(N[C@@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2ccccc2)cc1Cl 10942802 IFDZNPZEPDVBLZ-OAQYLSRUSA-N 473.316 5.652 5 20 JKBD Nc1nc(COC(=O)C/C(=C/c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)nc2ccccc12 18344606 RTUMRIDDBCQMKH-LGMDPLHJSA-N 497.536 5.404 5 20 JKBD O=C(Nc1ccc(NC(=O)c2ccco2)cc1C(F)(F)F)c1ccc(NC2CC2)c([N+](=O)[O-])c1 105502268 RJXJEZYTHDFIJF-UHFFFAOYSA-N 474.395 5.286 5 20 JKBD Cc1nnc(SCc2c(C(=O)N[C@H](C)c3cccc([N+](=O)[O-])c3)oc3ccccc23)s1 109712170 ADKMHPDVEPLIKL-GFCCVEGCSA-N 454.533 5.284 5 20 JKBD Cc1csc(N(CC(F)(F)F)C(=O)c2ccc(N3C[C@@H](C)C[C@H](C)C3)c([N+](=O)[O-])c2)n1 195644752 UOBZXINDVRXTBA-STQMWFEESA-N 456.490 5.051 5 20 JKBD C[C@H](Nc1ccc(C(=O)N[C@H](c2ccccc2)c2cccnc2)cc1[N+](=O)[O-])c1ccccn1 485499112 DBJXRTMZFANFSX-AVRWGWEMSA-N 453.502 5.077 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)NCc2ccccc2CN(C)C2CCCCC2)cc1SC 486983039 HINQILLFUCLGDU-UHFFFAOYSA-N 457.596 5.020 5 20 JKBD COc1cc(C(=O)Nc2ccc(CN3CCCC3=O)cc2)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 500968582 WAUQTECXBXXLPX-UHFFFAOYSA-N 495.919 5.424 5 20 JKBD O=C(CSc1nc(-c2cccs2)c(-c2cccs2)[nH]1)Nc1cc2c(cc1[N+](=O)[O-])OCO2 501339350 ZNSHCXFFSRSAJG-UHFFFAOYSA-N 486.556 5.234 5 20 JKBD O=[N+]([O-])c1ccc(OC(F)F)c(CNCc2ccccc2-c2ccc(Cn3ccnc3)cc2)c1 504163310 RWIUNHXBLUEIHN-UHFFFAOYSA-N 464.472 5.398 5 20 JKBD COc1ccc(C[C@H](NC(=O)N(Cc2ccc([N+](=O)[O-])cc2)C(C)C)c2ccccc2)cc1OC 509697888 MSQHJJVLQWXOBI-DEOSSOPVSA-N 477.561 5.516 5 20 JKBD CCN(c1ccccc1)S(=O)(=O)c1ccc(NC(=O)N(Cc2ccc([N+](=O)[O-])cc2)C(C)C)cc1 510034854 LDNMEUWNGALJLX-UHFFFAOYSA-N 496.589 5.253 5 20 JKBD COc1cc(C(=O)N[C@H](CC(C)(C)C)c2ccc(F)cc2)c([N+](=O)[O-])cc1OCc1cscn1 512178792 KKIWGCGCQJVCRX-LJQANCHMSA-N 487.553 5.685 5 20 JKBD COc1cc(C(=O)N[C@@H]2CCCC[C@@H]2c2ccccc2)c([N+](=O)[O-])cc1OCc1cscn1 512748707 JUMXHPFQACACQR-UYAOXDASSA-N 467.547 5.095 5 20 JKBD COc1ccc(CSCC(=O)N[C@H](C)c2ccc(-c3csc(C)n3)cc2)cc1[N+](=O)[O-] 515341162 CDUVYDBOBFMJDH-CQSZACIVSA-N 457.577 5.146 5 20 JKBD CCOc1ccc(C(=O)Nc2cc(NC(=O)c3cccc(C(F)(F)F)c3)ccc2C)cc1[N+](=O)[O-] 520446949 SJNHMHFJLJHPMI-UHFFFAOYSA-N 487.434 5.825 5 20 JKBD CC[C@H](C)c1ccc([C@@H](NC(=O)CNC(=O)c2c(Cl)cccc2[N+](=O)[O-])c2cccs2)cc1 520816612 ZSGWUWBYCYTYPP-NPMXOYFQSA-N 485.993 5.459 5 20 JKBD Cc1noc(CSc2ccc(C(=O)Nc3ccc([N+](=O)[O-])cc3C(=O)c3ccccc3)cc2)n1 602421755 BSLUUUKBUGUHNX-UHFFFAOYSA-N 474.498 5.062 5 20 JKBD Cc1c(C(=O)Nc2ccc(-c3nc4ccccc4s3)cc2)nnn1-c1cccc([N+](=O)[O-])c1 603564651 SFFLFWHGWBPFPN-UHFFFAOYSA-N 456.487 5.013 5 20 JKBD Cc1oncc1C(=O)Nc1ccc(NC(=O)c2ccc(Nc3ccccc3)c([N+](=O)[O-])c2)cc1 603936937 KFSHOCVFQWKBKM-UHFFFAOYSA-N 457.446 5.139 5 20 JKBD CCCNC(=O)c1ccc(NC(=O)c2ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])c(OC)c2)cc1 604005931 NRTLUIZIMKOPFT-UHFFFAOYSA-N 483.908 5.441 5 20 JKBD Cc1cc(Cl)ccc1Cc1cnc(NC(=O)c2cc(OCC(F)(F)F)ccc2[N+](=O)[O-])s1 604104150 KAYRREOPHLFUPO-UHFFFAOYSA-N 485.871 5.797 5 20 JKBD COc1ccc(CC(=O)N(C)Cc2cn(-c3ccccc3)nc2-c2ccc(Cl)cc2)cc1[N+](=O)[O-] 609017167 SVNBMWWIDINFPD-UHFFFAOYSA-N 490.947 5.311 5 20 JKBD C[C@H](NCc1ccc(Oc2ccccc2Cl)c([N+](=O)[O-])c1)c1ccc2c(c1)CCC(=O)N2 725845636 HKVZNUTYLHMRFK-HNNXBMFYSA-N 451.910 5.776 5 20 JKBD COc1ccc(NC(=S)/C(=C(/O)c2ccc(C)c([N+](=O)[O-])c2)[n+]2ccc(C(C)(C)C)cc2)cc1F 726578801 PTCVTDOOKDLFGU-UHFFFAOYSA-O 496.584 5.959 5 20 JKBD O=C(OCc1nnc(-c2c(Cl)cccc2Cl)o1)c1csc(-c2ccc([N+](=O)[O-])cc2)n1 726641711 WOSKLSYSJAREGT-UHFFFAOYSA-N 477.285 5.432 5 20 JKBD CC(C)N(Cc1nnc(-c2cccc([N+](=O)[O-])c2)o1)C(=O)CCc1ncc(-c2ccc(Cl)cc2)o1 822054127 LACUQAKJPOYPSH-UHFFFAOYSA-N 495.923 5.323 5 20 JKBD O=C(Nc1ccc(N2CCCC2)cc1)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 912655764 ZCRAJOIDIGENPZ-UHFFFAOYSA-N 462.472 5.069 5 20 JKBD COc1cc([C@@H](C)NC(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)ccc1OCc1ccncc1 916668874 HHUNIXTUVNACBO-CQSZACIVSA-N 456.886 5.114 5 20 JKBD Cc1nccn1-c1ccc(NC(=O)C/C(=C/c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)cn1 918588039 OWNBWGLHYQDWDY-RGEXLXHISA-N 496.552 5.663 5 20 JKBD C[C@H](OC(=O)[C@@H](C)Sc1ccccc1Cl)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 919507671 VKPYOMHESHSLDT-WDEREUQCSA-N 476.860 5.318 5 20 JKBD C[C@H](Nc1ccc(C(=O)OCC(=O)N[C@H](C)c2ccc3ccccc3c2)cc1[N+](=O)[O-])c1ccccn1 920543887 AYGBVYOMXKXTKF-MOPGFXCFSA-N 498.539 5.350 5 20 JKBD C[C@@H](Nc1ccc(C(=O)OCC(=O)c2cccc(C(F)(F)F)c2)cc1[N+](=O)[O-])c1ccccn1 920549316 XFOMNPIAFYNRGJ-CQSZACIVSA-N 473.407 5.221 5 20 JKBD O=C(O[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1)c1cnc(-c2ccccc2)nc1 921214721 NFILVKRSDXCUNE-QFIPXVFZSA-N 488.887 5.242 5 20 JKBD O=C(NC1(c2ccc(NC(=O)c3cc(-c4ccco4)no3)cc2)CCC1)c1cc(F)cc([N+](=O)[O-])c1 1788419968 LNYRBBNUTYNTGY-UHFFFAOYSA-N 490.447 5.043 5 20 JKBD CN(C)c1ccc([N+](=O)[O-])c(C(=O)NC2(c3ccc(NC(=O)c4ccc5occc5c4)cc3)CCC2)c1 1789050392 RZOZFNJKMUNOKS-UHFFFAOYSA-N 498.539 5.469 5 20 JKBD C[C@]1(C(=O)Nc2ccc(C3(NC(=O)c4cc5cc([N+](=O)[O-])ccc5s4)CCC3)cc2)CC1(F)F 1792248531 PROQXLCNWOKQEI-JOCHJYFZSA-N 485.512 5.603 5 20 JKBD Cc1cc(C)cc(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)CSc3ccccc3[N+](=O)[O-])[nH]n2)c1 1820545129 SUAPKZNKNTZLQO-FQEVSTJZSA-N 493.589 5.033 5 20 JKBD CC(C)[C@H]1CC[C@H](C(=O)Nc2cc([C@H]3CCCCN3C(=O)c3ccc([N+](=O)[O-])cc3F)[nH]n2)CC1 1822105189 ZNMLFQGCMKZGKJ-DRSNIGMVSA-N 485.560 5.225 5 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NHUXUUXONYBRJI-UHFFFAOYSA-N 487.969 5.183 5 20 JKBD COc1ccc(Oc2ccc([N+](=O)[O-])cc2C(=O)N2CCC[C@@H](c3nc4ccccc4o3)C2)cc1 27383098 OODISGOACPWTHT-QGZVFWFLSA-N 473.485 5.557 5 20 JKBD C[C@H]1CCC[C@@H](OCc2cccc(NC(=O)Cn3c4ccccc4c(=O)c4ccccc43)c2)C1 72046320 DOVKSVGTSUSCSL-NZQKXSOJSA-N 454.570 5.889 5 20 JKBD CC(=O)c1ccc(Sc2nnc(Cc3cccs3)n2CCc2ccccc2)c([N+](=O)[O-])c1 105323246 ADYAIUBOSTVBGB-UHFFFAOYSA-N 464.572 5.435 5 20 JKBD C[C@H](Nc1ccc(C(=O)Nc2ncc(Cc3cccc(F)c3)s2)cc1[N+](=O)[O-])c1ccccn1 108833909 ZXATURUPZWAHQN-HNNXBMFYSA-N 477.521 5.602 5 20 JKBD Cc1sc(NC(=O)Cn2c3ccccc3c(=O)c3ccccc32)nc1-c1cccc([N+](=O)[O-])c1 195704195 IKYDELCXGLDWGO-UHFFFAOYSA-N 470.510 5.134 5 20 JKBD O=C(c1ccccc1)N1CCC(NCc2ccc(Oc3ccccc3Cl)c([N+](=O)[O-])c2)CC1 217023147 XAWIKPMYHOXRBJ-UHFFFAOYSA-N 465.937 5.435 5 20 JKBD CC(C)Cc1ccc(C(=O)C2CCN(C(=O)[C@H](C)Sc3ccc([N+](=O)[O-])cc3)CC2)cc1 479857488 PJJCUXCQCWODEU-SFHVURJKSA-N 454.592 5.395 5 20 JKBD C[C@H](NC(=O)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-])c1cccc(NC(=O)c2ccccc2)c1 480319859 SEGQAMJORAUXOU-HNNXBMFYSA-N 487.434 5.279 5 20 JKBD COc1cccc(/C=C(\CC(=O)Nc2cc([N+](=O)[O-])ccc2OC)c2nc3ccccc3s2)c1 480983122 PXDPYTMQBCVTEF-SFQUDFHCSA-N 475.526 5.791 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)N2c3ccccc3CC[C@@H]2C(=O)Nc2ccc(F)cc2)cc1SC 483672763 QMNBVWHCHKNEOH-HXUWFJFHSA-N 495.532 5.065 5 20 JKBD O=C(Nc1ccc(S(=O)(=O)c2ccc(Br)cc2)cc1)c1ccc([N+](=O)[O-])cc1Cl 501247874 UVPJOMJFFHRGKG-UHFFFAOYSA-N 495.738 5.096 5 20 JKBD C[C@H](Nc1ccc(C(=O)N(Cc2cccs2)Cc2cccs2)cc1[N+](=O)[O-])c1ccccn1 503161782 VUGZTNFXKAVKPU-KRWDZBQOSA-N 478.599 6.129 5 20 JKBD CC[C@H](C)n1c(S[C@@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2C(F)(F)F)nnc1-c1ccccc1 504322767 XQDCZBMQCHYRGJ-KBPBESRZSA-N 493.511 5.962 5 20 JKBD O=[N+]([O-])c1cccc(F)c1CSc1nnc(CN2CCCCC2)n1-c1ccc(OC(F)F)cc1 504537114 ZBRBKGZNECWBBO-UHFFFAOYSA-N 493.511 5.194 5 20 JKBD Cc1sc(NC(=O)c2ccc([N+](=O)[O-])cc2I)nc1-c1ccc(F)cc1 508871242 PEQMVMTYQAQIED-UHFFFAOYSA-N 483.262 5.023 5 20 JKBD CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)NCC1(c2ccc(Cl)cc2Cl)CCOCC1 509767012 NUHMOGDVARXPHX-UHFFFAOYSA-N 480.392 5.570 5 20 JKBD CN(C(=O)c1ccc(NCc2nc(-c3ccc([N+](=O)[O-])cc3)no2)cc1Cl)C1CCCCC1 515658635 GAHMTTBWTJRDRZ-UHFFFAOYSA-N 469.929 5.315 5 20 JKBD CCC(=O)N1CCCN(C(=O)c2c3c(nc4ccccc24)/C(=C/c2ccc([N+](=O)[O-])cc2)CCC3)CC1 517433365 FPTHRKZEEQVFSO-XUTLUUPISA-N 498.583 5.104 5 20 JKBD C[C@H]1CN(C(=O)C/C(=C\c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)CC(C)(C)O1 518929460 UWRIXCMIVUBXOQ-IQFISFIMSA-N 451.548 5.161 5 20 JKBD O=[N+]([O-])c1ccc(-c2ccc(CNC3CCN(c4ccc(C(F)(F)F)cn4)CC3)s2)cc1 520203173 MKLQQHVYRFNCCJ-UHFFFAOYSA-N 462.497 5.496 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Cl)[C@H](NC[C@H]1CCOc2ccccc21)c1ccccc1 521774362 LUHCISREQLSIAS-UZUQRXQVSA-N 451.910 5.084 5 20 JKBD CCCC(=O)NC[C@@H]1CCCN(C(=O)c2cc([N+](=O)[O-])ccc2Sc2ccc(Cl)cc2)C1 523171201 RWVSYNYXFHICBW-INIZCTEOSA-N 475.998 5.168 5 20 JKBD CC1CCN(c2ccc(C(=O)N(c3ccc(Br)cn3)C(C)C)cc2[N+](=O)[O-])CC1 603998613 LMFBBTKHLWIFBM-UHFFFAOYSA-N 461.360 5.044 5 20 JKBD O=C(Nc1ccccc1COc1ccccc1)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 604022874 GZPOLFPWWDCBJP-UHFFFAOYSA-N 499.489 6.048 5 20 JKBD CC(C)CCSc1ccc(C(=O)N2CCC(C(=O)Nc3ccc(Cl)cn3)CC2)cc1[N+](=O)[O-] 604108190 QDSMTSBOAFCNFX-UHFFFAOYSA-N 491.013 5.272 5 20 JKBD O=C(NCC1(c2cccc(Br)c2)CCC1)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-] 604200951 QSADEXFDIVMEEA-UHFFFAOYSA-N 487.272 5.150 5 20 JKBD COC(=O)c1ccc2c(O)nc(/C=C/c3ccc(Oc4ccc(F)cc4)c([N+](=O)[O-])c3)nc2c1 608801204 OOOGCKRTYBFPGA-QDEBKDIKSA-N 461.405 5.132 5 20 JKBD CSc1ccc(C(=O)c2ccccc2C(=O)NCCCCc2nc(C)cs2)cc1[N+](=O)[O-] 608908823 ODJWMGPPUPRRFT-UHFFFAOYSA-N 469.588 5.065 5 20 JKBD O=C(Cc1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1)Nc1scnc1-c1ccccc1 609060053 SEDSOWCSSVXTMM-UHFFFAOYSA-N 481.537 5.752 5 20 JKBD CCOc1cc(NC(=O)CCCc2ccc(Br)s2)c([N+](=O)[O-])cc1OCC 619212850 MBLYXOIBOBFTNK-UHFFFAOYSA-N 457.346 5.178 5 20 JKBD CCC(CC)c1cc[n+](/C(C(=S)Nc2cnn(CC)c2)=C(/O)c2ccc(C)c([N+](=O)[O-])c2)cc1 726180293 ZAEATRKXBSDSPT-UHFFFAOYSA-O 480.614 5.634 5 20 JKBD Cc1ccccc1-c1nc(C(=O)Oc2ccc(NC(=O)c3cc([N+](=O)[O-])ccc3Cl)cc2)cs1 727299231 VXGPNZZDPTXUTB-UHFFFAOYSA-N 493.928 6.152 5 20 JKBD C[C@H](Nc1ccc(C(=O)Nc2cc(NC(=O)OC(C)(C)C)ccc2F)cc1[N+](=O)[O-])c1ccccn1 727390195 XMLOTQDJHCUEDC-HNNXBMFYSA-N 495.511 5.901 5 20 JKBD Cc1nc(CSc2ccccc2C(=O)OC[C@H]2CCCN2C(=O)c2ccccc2[N+](=O)[O-])cs1 730703137 HRHDKHQMZURBNW-GOSISDBHSA-N 497.598 5.114 5 20 JKBD Cc1ccc(-c2nn(-c3ccccc3)cc2C(=O)O[C@@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)o1 746143791 QNNBVNNLFHKCMT-INIZCTEOSA-N 485.456 5.317 5 20 JKBD O=C(c1csc(-c2ccc([N+](=O)[O-])cc2)n1)N1CCC[C@@H]1Cc1ccc(Br)cc1 747716164 XTRBJUZFVHDAQU-GOSISDBHSA-N 472.364 5.328 5 20 JKBD C[C@H](OC(=O)c1csc(-c2ccc([N+](=O)[O-])cc2)n1)C(=O)Nc1ccccc1Oc1ccccc1 747958315 YKTGLSKJNHEFJV-INIZCTEOSA-N 489.509 5.695 5 20 JKBD CC[C@H](C)Sc1ccc(NC(=O)c2cc([N+](=O)[O-])c(C)c([N+](=O)[O-])c2C)c(C(F)(F)F)c1 748659006 YATGUSQKVPRLJO-JTQLQIEISA-N 471.457 6.282 5 20 JKBD COc1cc(C(=O)Oc2ccc(Sc3ccncc3)cc2)c([N+](=O)[O-])cc1OCc1cscn1 749527283 JZRVYBQHWQCMMF-UHFFFAOYSA-N 495.538 5.404 5 20 JKBD CC(C)Cn1cc([C@H]2N(Cc3ccc(-c4ccccc4[N+](=O)[O-])s3)CC23CCOCC3)cn1 849479274 PAIDNVKVRHXHOQ-XMMPIXPASA-N 466.607 5.530 5 20 JKBD O=[N+]([O-])c1ccc(-c2nc(-c3nc(-c4ccc(OCc5cccnc5)cc4)no3)cs2)cc1 904466451 QWUFOOYDYSNBDI-UHFFFAOYSA-N 457.471 5.409 5 20 JKBD C[C@@H](OC(=O)[C@H]1CCCN(C(=O)c2ccc(Cl)c(Cl)c2)C1)c1cccc([N+](=O)[O-])c1 915020430 RJOCIRFQOLIYRO-CJNGLKHVSA-N 451.306 5.058 5 20 JKBD CN(Cc1cc([N+](=O)[O-])ccc1Cl)C(=O)c1cccc(NC(=O)c2ccc(Br)o2)c1 917069611 VYPOKZPRNLPUPB-UHFFFAOYSA-N 492.713 5.128 5 20 JKBD Cc1ccc(C(C)C)c(O[C@@H](C)C(=O)O[C@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2C(F)(F)F)c1 919446678 HIZSQMXXSYLDEK-CABCVRRESA-N 482.455 5.383 5 20 JKBD C[C@@H](OC(=O)CCSc1ccc(Br)cc1)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl 920582517 YFPWYWAVPPLMEM-LLVKDONJSA-N 487.759 5.063 5 20 JKBD C[C@H](CC(=O)O[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Br)c1ccccc1)C1CC1 920721639 GSPLGKCOMJVRSI-ZUOKHONESA-N 461.312 5.017 5 20 JKBD O=C(Nc1cccc(C(F)(F)F)c1)c1ccccc1NC(=O)c1cc(Cl)ccc1[N+](=O)[O-] 920819610 CNZQWRAAPZHJMM-UHFFFAOYSA-N 463.799 5.772 5 20 JKBD Cc1nc(-c2ccc(Cl)s2)sc1C(=O)O[C@H](C)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl 921106264 NDJMLOVOUGDQMR-SECBINFHSA-N 486.358 5.579 5 20 JKBD C[C@H](OC(=O)c1ccc(N2C[C@H](C)C[C@@H](C)C2)c([N+](=O)[O-])c1)c1nnc(-c2ccccc2)o1 921249399 FDINDSBFWRDNRB-ZACQAIPSSA-N 450.495 5.045 5 20 JKBD O=C(C[C@H]1CCCCO1)NC1(c2ccc(NC(=O)C3(c4cccc([N+](=O)[O-])c4)CCC3)cc2)CCC1 1790475913 KQLZHYVUHMJGSD-XMMPIXPASA-N 491.588 5.110 5 20 JKBD Cc1ncc(/C=C/C(=O)NC2(c3ccc(NC(=O)Cc4ccc(C)c([N+](=O)[O-])c4)cc3)CCC2)s1 1790525318 OHABFZFXAFCASK-ZHACJKMWSA-N 490.585 5.058 5 20 JKBD Cc1cc(O)c([N+](=O)[O-])cc1C(=O)Nc1ccc(C2(NC(=O)c3ccc4cc[nH]c4c3)CCC2)cc1 1790806042 VIIBSBDXPYABOH-UHFFFAOYSA-N 484.512 5.152 5 20 JKBD C[C@H](C(=O)NC1(c2ccc(NC(=O)c3nc4cc([N+](=O)[O-])ccc4[nH]3)cc2)CCC1)c1cccs1 1790827219 AMAJGURKILLLSS-HNNXBMFYSA-N 489.557 5.084 5 20 JKBD Cc1c(C(=O)NC2(c3ccc(NC(=O)[C@@H]4C[C@]4(F)Cl)cc3)CCC2)cc(Cl)cc1[N+](=O)[O-] 1791675850 BUWKKBAIQXRGLV-HTAPYJJXSA-N 480.323 5.229 5 20 JKBD O=C(Cc1cc(F)ccc1[N+](=O)[O-])Nc1ccc(C2(NC(=O)[C@@H](F)c3ccccc3)CCC2)cc1 1792308505 WVAKRCVTPKISFO-DEOSSOPVSA-N 479.483 5.121 5 20 JKBD Cc1c(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)[C@@H](C)Sc2cccs2)C3)cc(Cl)cc1[N+](=O)[O-] 1800711714 SIEYTXHYSVBOCK-MXASKKJJSA-N 494.038 5.051 5 20 JKBD CCC[C@H]1CC[C@H](C(=O)NC[C@@H]2CCN(C(=O)c3cc(F)cc([N+](=O)[O-])c3)[C@@H]2c2cccnc2)CC1 1812790072 OTDUGAHCZQYRMX-SHNDDRJUSA-N 496.583 5.055 5 20 JKBD Cc1c(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)C3CC(C)(C)C3)[nH]n2)cc(Cl)cc1[N+](=O)[O-] 1821292146 BAXIWCFQJDMVRE-SFHVURJKSA-N 473.961 5.022 5 20 JKBD CC1=CC[C@H](C(=O)N2CCCC[C@H]2c2cc(NC(=O)c3cc4cc([N+](=O)[O-])ccc4s3)n[nH]2)CC1 1821609767 MNESBUMZGZMUTJ-JXFKEZNVSA-N 493.589 5.585 5 20 JKBD O=C(c1ccc2occc2c1)N1CCC([C@H]2CCCCN2C(=O)CCc2cccc([N+](=O)[O-])c2)CC1 1824839482 HWYBTIPXMHWDHU-RUZDIDTESA-N 489.572 5.207 5 20 JKBD C[C@H](CC(=O)N1CCCC[C@@H]1C1CCN(C(=O)/C=C/c2ccccc2[N+](=O)[O-])CC1)c1ccccc1 1831510424 MRFQHHULILGEFM-BRDULOMRSA-N 489.616 5.422 5 20 JKBD C[C@H](Sc1nnc(-c2c[nH]c3ccccc23)o1)C(=O)Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1 11346957 ONOPZEURBXGVNZ-LBPRGKRZSA-N 492.542 5.369 5 20 JKBD O=C(NC[C@@H](c1ccco1)N1CCCC1)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1 14047954 XEVVHTKQIZOTQB-FQEVSTJZSA-N 455.898 5.200 5 20 JKBD Cc1csc(Sc2ccc(C(=O)O[C@@H](C)C(=O)Nc3cccc(C)c3C)cc2[N+](=O)[O-])n1 23968902 YHNHVCZYZVGLMS-HNNXBMFYSA-N 471.560 5.312 5 20 JKBD CCn1c(S[C@H](C)C(=O)Nc2ccccc2Br)nc2cc3ccccc3cc2c1=O 26581003 FXDJNYFJGYLGIN-CQSZACIVSA-N 482.403 5.451 5 20 JKBD O=C(CCCn1c(=O)oc2cc([N+](=O)[O-])ccc21)Nc1nc(-c2cccc3ccccc23)cs1 26767462 CCLMRMIWXVPVJF-UHFFFAOYSA-N 474.498 5.198 5 20 JKBD O=C(C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)OCC(=O)c1cc(F)ccc1F 27251974 MBGGXGCILIHAAH-WJDWOHSUSA-N 494.475 5.840 5 20 JKBD O=C(CSc1nnc(-c2ccc(Cl)cc2)n1Cc1ccccc1)Nc1ccc(F)c([N+](=O)[O-])c1 28609065 GDPYIZBHTQYDKD-UHFFFAOYSA-N 497.939 5.425 5 20 JKBD O=C(NCCc1nc2ccccc2[nH]1)c1ccccc1Sc1ccc(C(F)(F)F)cc1[N+](=O)[O-] 29933601 OWZKUFDWFVRWQF-UHFFFAOYSA-N 486.475 5.614 5 20 JKBD C[C@@H](Sc1nn(-c2ccccc2)c(=S)s1)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl 36796595 NRPMJPPFEUVJMR-SNVBAGLBSA-N 452.970 5.344 5 20 JKBD O=C(CSc1ccc(C(F)(F)F)cc1[N+](=O)[O-])Nc1ccc(F)c(NC(=O)C2CCCCC2)c1 107624235 JMLYZMWJFPLJGP-UHFFFAOYSA-N 499.486 6.002 5 20 JKBD CCCN(CCC)C(=O)c1ccc(NC(=O)c2csc(-c3ccc([N+](=O)[O-])cc3)n2)cc1 496245018 LMUNXCLSEGGBGX-UHFFFAOYSA-N 452.536 5.233 5 20 JKBD Cc1csc(Sc2ccc(C(=O)Nc3cccc(CN4CCCCC4=O)c3)cc2[N+](=O)[O-])n1 497318774 DYTASYAQIUBWJJ-UHFFFAOYSA-N 482.587 5.276 5 20 JKBD CC[C@@H](C)Sc1ccc(NC(=O)c2cc(C(=O)OC)cc([N+](=O)[O-])c2)c(C(F)(F)F)c1 499535446 WCEDNBPGIKLXEV-LLVKDONJSA-N 456.442 5.543 5 20 JKBD C[C@H]1C[C@@H](C)CN(c2ccc(C(=O)Nc3cc(F)ccc3OC[C@@H]3CCCO3)cc2[N+](=O)[O-])C1 502365689 LKZASZPSDANEPV-QKLQHJQFSA-N 471.529 5.026 5 20 JKBD COc1cc(C(=O)Nc2nc(-c3ccccc3)c(C(=O)c3ccccc3)s2)ccc1[N+](=O)[O-] 508793190 FYGFJGVRHMGVHY-UHFFFAOYSA-N 459.483 5.210 5 20 JKBD COc1cc(C(=O)Nc2cccc(Cl)c2Sc2nc(C)cs2)c([N+](=O)[O-])cc1OC 509203712 RIFGMXWFRVVENR-UHFFFAOYSA-N 465.940 5.434 5 20 JKBD CC(C)(C)[C@H]1CCc2sc(-c3nnc(SCc4nnc(-c5ccc([N+](=O)[O-])cc5)o4)o3)cc2C1 509950194 ZEDPZGNLKDOHAN-HNNXBMFYSA-N 497.602 6.200 5 20 JKBD O=C(CCCc1nc(-c2ccc(Cl)cc2)no1)Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1 512142906 OQQQLIZRDKCHSX-UHFFFAOYSA-N 469.910 5.383 5 20 JKBD COc1cc(C(=O)N2CC[C@@H](C)Sc3ccccc32)c([N+](=O)[O-])cc1OCc1cscn1 512287735 VTKDIEWBXUTZRP-CQSZACIVSA-N 471.560 5.170 5 20 JKBD COc1ccc(-c2[nH]c3ccccc3c2CCC(=O)Nc2cc([N+](=O)[O-])ccc2C)c(OC)c1 512973184 ZTJHJNOCNWKOFG-UHFFFAOYSA-N 459.502 5.640 5 20 JKBD Cc1nc(-c2ncccn2)sc1C(=O)Nc1c2ccccc2n2c(C)nc3ccccc3c12 515609448 COLJHOBYUPTLKU-UHFFFAOYSA-N 450.527 5.423 5 20 JKBD Cc1nn(C)c2ncc(C(=O)Nc3cc([N+](=O)[O-])ccc3Nc3cccc(C(F)(F)F)c3)cc12 516070122 YKAQPQAVFWOEOJ-UHFFFAOYSA-N 470.411 5.200 5 20 JKBD COc1ccc(C(=O)N2CCCCCC2)cc1NCc1ccc(C(F)(F)F)cc1[N+](=O)[O-] 600854419 OWTPYRLZXAVHKW-UHFFFAOYSA-N 451.445 5.251 5 20 JKBD Cc1ccc(Sc2ccc(/C=C3\CN(C)Cc4c3nc3ccccc3c4C(=O)O)cc2[N+](=O)[O-])cc1 603781492 KSJOGPAKJHTQPX-CPNJWEJPSA-N 497.576 6.287 5 20 JKBD Cc1sc2nc(SCc3cccc([N+](=O)[O-])c3C)n(Cc3ccccn3)c(=O)c2c1C 604116730 CIYMBHPHCYXWCX-UHFFFAOYSA-N 452.561 5.027 5 20 JKBD COc1ccc(CNC(=O)CSc2ccc(C(F)(F)F)cc2[N+](=O)[O-])c(C(F)(F)F)c1 608808236 LOWYLPPXBPTASE-UHFFFAOYSA-N 468.375 5.050 5 20 JKBD O=C(c1ccc(NCc2ccccc2)c([N+](=O)[O-])c1)N1CCO[C@@H](c2ccccc2Br)C1 725729177 OJMFYJDZYOQJSD-HSZRJFAPSA-N 496.361 5.183 5 20 JKBD CC1CCN(c2ccc([N+](=O)[O-])cc2C(=O)Nc2ccc(-c3noc(C(F)(F)F)n3)cc2)CC1 726932911 ZVELERSWCACZIU-UHFFFAOYSA-N 475.427 5.152 5 20 JKBD Cc1cccc(COc2ccc(NC(=O)c3cc([N+](=O)[O-])ccc3Br)c(C)c2)c1 729831641 WEEOIDIEEUDPQR-UHFFFAOYSA-N 455.308 5.805 5 20 JKBD C[C@@H](OC(=O)CCc1nc2cc(Cl)ccc2s1)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 730608889 NSNPTKMUQNJTHN-LLVKDONJSA-N 458.883 5.145 5 20 JKBD CCOc1ccc([C@H](CNC(=O)c2cc(F)ccc2[N+](=O)[O-])c2c[nH]c3ccccc23)cc1OC 751062020 IREGREWRDWEJRQ-FQEVSTJZSA-N 477.492 5.184 5 20 JKBD CCCN(Cc1nnc(-c2ccccc2Cl)o1)C(=O)c1cc([N+](=O)[O-])ccc1Br 751072675 PUHWLQRQSLOHNU-UHFFFAOYSA-N 479.718 5.113 5 20 JKBD Cc1nn(-c2ccccc2)c(C)c1NC(=O)[C@@H](C)Sc1nc2ccc([N+](=O)[O-])cc2s1 827004994 BLWOUBOABPSRRO-CQSZACIVSA-N 453.549 5.126 5 20 JKBD CC(C)[C@H](OC(=O)C1CCN(c2ccccc2[N+](=O)[O-])CC1)C(=O)Nc1ccccc1C(F)(F)F 915368546 KZHHNJHQPANBTA-NRFANRHFSA-N 493.482 5.037 5 20 JKBD O=C(C[C@H](NC(=O)c1ccccc1Cl)c1ccccc1)Nc1ccc(Cl)c([N+](=O)[O-])c1 916695488 PULUGVDUYOLHGH-IBGZPJMESA-N 458.301 5.402 5 20 JKBD CC(C)OCc1ccc(NC(=O)c2ccccc2NC(=O)c2ccc([N+](=O)[O-])cc2Cl)cc1 919997955 XAEWATFAMFBJGD-UHFFFAOYSA-N 467.909 5.678 5 20 JKBD Cc1cc(C(=O)Nc2ccc(C3(NC(=O)c4c(F)ccc([N+](=O)[O-])c4C)CCC3)cc2)cnc1C 1787010171 PFIUHAZTMADWBR-UHFFFAOYSA-N 476.508 5.116 5 20 JKBD O=C(NC1(c2ccc(NC(=O)c3ccc([N+](=O)[O-])cc3F)cc2)CCC1)c1cc(C(F)(F)F)c[nH]1 1790621605 AXLCTTWPHPMTSI-UHFFFAOYSA-N 490.413 5.142 5 20 JKBD O=C(Cc1cccc([N+](=O)[O-])c1)NC1(c2ccc(NC(=O)[C@@H]3C[C@H]3c3ccccc3)cc2)CCC1 1791528297 YFXOAXAEVZPXNG-LOSJGSFVSA-N 469.541 5.075 5 20 JKBD Cc1c(C(=O)Nc2cc([C@H]3CCCCN3C(=O)c3ccccc3F)[nH]n2)cc(Cl)cc1[N+](=O)[O-] 1821294681 ULYSPAQWFNBQGG-LJQANCHMSA-N 485.903 5.039 5 20 JKBD Cc1cc(O)c([N+](=O)[O-])cc1C(=O)N1CCCC[C@H]1C1CCN(C(=O)C[C@@H](C)c2ccccc2)CC1 1830789352 GWYXQORIOSOCAY-DVECYGJZSA-N 493.604 5.036 5 20 JKBD CCCCC[C@@H](C)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)Cc2cc(F)ccc2[N+](=O)[O-])CC1 1831468057 IWOTWIGIPAKFGC-AUSIDOKSSA-N 475.605 5.113 5 20 JKBD C[C@H](Sc1nnc(-c2cccs2)n1-c1ccccc1)C(=O)Nc1cccc([N+](=O)[O-])c1 11208817 BWHHQLGFJHVULD-AWEZNQCLSA-N 451.533 5.023 5 20 JKBD CCOc1ccccc1NC(=O)C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1 15657395 FLPQCCZOBZIJHB-SDXDJHTJSA-N 459.527 6.173 5 20 JKBD C[C@H](OC(=O)CSc1ccc2ccccc2c1)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 21347578 UBVDHTLLJZEZFH-ZDUSSCGKSA-N 478.448 5.429 5 20 JKBD CCOc1ccc([C@H](CNC(=O)c2cc([N+](=O)[O-])ccc2OC)c2c[nH]c3ccccc23)cc1OC 24113702 OPXONNZMMWMHEZ-NRFANRHFSA-N 489.528 5.054 5 20 JKBD C[C@H](N[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1)c1ccc(NC(=O)C2CC2)cc1 28346960 FMIAZXGNFMKWAY-UPCLLVRISA-N 492.963 5.627 5 20 JKBD C[C@H](N[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1)c1ccc(C(F)(F)F)cc1 28383921 BEJCDNDFBHYOGO-QKKBWIMNSA-N 477.870 6.298 5 20 JKBD O=C(Cc1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1)N[C@H](c1ccccc1)c1ccccn1 29715281 OUKIQQFRLKTNJG-GDLZYMKVSA-N 489.535 5.291 5 20 JKBD CC(=O)Nc1ccc(Cl)cc1NC(=O)Cc1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1 72048247 FNADMEJTMMWOIK-UHFFFAOYSA-N 489.919 5.241 5 20 JKBD Cc1sc(NC(=O)c2ccc(Br)cc2Cl)nc1-c1cccc([N+](=O)[O-])c1 195704386 KTGLKFIOPWVXIK-UHFFFAOYSA-N 452.717 5.695 5 20 JKBD C[C@H](Nc1ccc(C(=O)N2CCC(C(=O)c3ccc(Cl)cc3)CC2)cc1[N+](=O)[O-])c1ccccn1 302989117 KYUHKHNUZBWTRT-KRWDZBQOSA-N 492.963 5.551 5 20 JKBD NC(=O)Cc1ccc(NC(=O)c2ccccc2Sc2ccc(C(F)(F)F)cc2[N+](=O)[O-])cc1 497387012 JBKKTRRCAKCQNF-UHFFFAOYSA-N 475.448 5.045 5 20 JKBD C[C@H]1C[C@@H](C)CN(c2ccc(C(=O)Nc3ccccc3OCc3cscn3)cc2[N+](=O)[O-])C1 503493702 XGHYEFBIBRBCAM-CALCHBBNSA-N 466.563 5.365 5 20 JKBD O=C(NCC1(c2ccc(Br)cc2)CCOCC1)c1cc2cc([N+](=O)[O-])ccc2s1 507000646 IOKJVPNVOGXEQA-UHFFFAOYSA-N 475.364 5.050 5 20 JKBD COc1ccc(CNCc2csc(-c3ccccc3)n2)cc1OCc1ccc([N+](=O)[O-])cc1 507948759 IVJMYELGBZSSQM-UHFFFAOYSA-N 461.543 5.596 5 20 JKBD CC(C)CCSc1ccc(C(=O)N2CCC(NC(=O)Nc3ccccc3)CC2)cc1[N+](=O)[O-] 509669954 HWDLHQBXSXSKQJ-UHFFFAOYSA-N 470.595 5.159 5 20 JKBD Cc1ccc(NC(=O)[C@@H](Sc2n[nH]c(/C=C\c3ccc(C)o3)n2)c2ccccc2)c([N+](=O)[O-])c1 514338606 QOTJJYKMIZKFFZ-YLQXFRFJSA-N 475.530 5.565 5 20 JKBD C[C@H](Nc1cccc(COCc2ccco2)c1)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 515717830 XHCSGBYFPQMEJD-AWEZNQCLSA-N 463.412 5.363 5 20 JKBD C[C@H]1CCCCN1CCCCNC(=O)C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1 516397508 KELNGFZJRDTICL-XLIXHQMESA-N 492.645 5.906 5 20 JKBD CC(C)(C)c1ccc(C(=O)Nc2ccccc2NC(=O)CCOc2ccccc2[N+](=O)[O-])cc1 517878414 RVFGFMFCLBRJLY-UHFFFAOYSA-N 461.518 5.552 5 20 JKBD COc1cccc(N2CC[C@@H](CNCc3ccc(-c4ccc([N+](=O)[O-])cc4Br)o3)C2)c1 518278856 ISLFIOXFHXDQHG-INIZCTEOSA-N 486.366 5.242 5 20 JKBD C[C@@H](Nc1ccc(C(=O)N2CCCC[C@H]2c2cc3ccccc3[nH]2)cc1[N+](=O)[O-])c1ccccn1 520832858 VPJNJMIJOHZKOL-CJAUYULYSA-N 469.545 6.012 5 20 JKBD COc1cc(NC(=O)c2cc3cc([N+](=O)[O-])ccc3o2)c(C(=O)N2[C@@H](C)CCC[C@H]2C)cc1OC 603738318 VBLANSPRQOISHD-GASCZTMLSA-N 481.505 5.014 5 20 JKBD COc1ccc([N+](=O)[O-])cc1NC(=O)[C@@H](Oc1cccc(Br)c1)c1ccccc1 603750641 VRESULXZLYKWHD-FQEVSTJZSA-N 457.280 5.125 5 20 JKBD O=C(Nc1cc([N+](=O)[O-])ccc1OC(F)F)[C@H]1CCC(=O)N(Cc2ccccc2)[C@@H]1c1ccccc1 603961483 XDGGCVXAFHVDSC-GBXCKJPGSA-N 495.482 5.315 5 20 JKBD O=C(NC1CCCCC1)c1cc(NC(=O)c2cc(OCC(F)(F)F)ccc2[N+](=O)[O-])ccc1Cl 604025898 WFLMHWJNWIPPBG-UHFFFAOYSA-N 499.873 5.504 5 20 JKBD O=C(C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1)N1CCc2cccc(Cl)c21 604249332 BYACNINMZRDHJW-UHFFFAOYSA-N 453.848 5.073 5 20 JKBD COc1ccc(-c2nsc(NC(=O)c3ccc(Sc4nc(C)cs4)c([N+](=O)[O-])c3)n2)cc1 609127578 IVSMTIQNIPBPMK-UHFFFAOYSA-N 485.572 5.290 5 20 JKBD COc1ccc([N+](=O)[O-])cc1NC(=O)[C@H](C)SCc1nc(O)c2c(-c3ccccc3)csc2n1 610834739 HNYJGNILXOVQGA-ZDUSSCGKSA-N 496.570 5.241 5 20 JKBD Cc1ccccc1-c1nc(C(=O)Oc2ccc(NC(=O)c3cccc([N+](=O)[O-])c3)cc2)cs1 727294959 ICNJATQQOVBQDB-UHFFFAOYSA-N 459.483 5.498 5 20 JKBD O=S(=O)(Cc1ccccc1CNCc1c2ccccc2c(Cl)c2ccccc12)N1CCOCC1 727643570 BUFOKXXPSDHWSA-UHFFFAOYSA-N 495.044 5.098 5 20 JKBD C[C@H](OC(=O)c1ccccc1OCc1cccs1)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 730618023 NHXKWASXRXVIGS-AWEZNQCLSA-N 451.460 5.203 5 20 JKBD COc1ccc([N+](=O)[O-])cc1OC(=O)c1oc2ccccc2c1CSc1nnc(C)s1 748611019 VOQZDCXBNJXVHZ-UHFFFAOYSA-N 457.489 5.021 5 20 JKBD COc1cc(/C=C(/Cl)c2nc(=O)c3ccccc3[nH]2)ccc1OCc1ccc([N+](=O)[O-])cc1 916139924 CMUBFBIATUSTEL-XDHOZWIPSA-N 463.877 5.156 5 20 JKBD C[C@@H](NC(=O)C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)c1cccc([N+](=O)[O-])c1 917700447 HULVEULKONPYBP-CXDFQFJYSA-N 488.525 5.921 5 20 JKBD C[C@H](OC(=O)Cn1c2ccccc2c(=O)c2ccccc21)c1cccc(NC(=O)c2ccccc2)c1 919054827 AMQVQAQANBXOBY-FQEVSTJZSA-N 476.532 5.711 5 20 JKBD CC(C)(C)OC(=O)NC[C@H]1CCCN(C(=O)c2cc([N+](=O)[O-])ccc2Sc2ccccc2)C1 920750359 ZKCFTTSFDWMBCB-QGZVFWFLSA-N 471.579 5.123 5 20 JKBD Cc1cc(C(=O)Nc2ccc(C3(NC(=O)c4cc(Cl)cc([N+](=O)[O-])c4C)CCC3)cc2)ccn1 1789751013 DNTIJKMGVYQPMU-UHFFFAOYSA-N 478.936 5.322 5 20 JKBD C[C@H](C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cc(F)cc([N+](=O)[O-])c2)[nH]n1)c1ccc(Cl)cc1 1814662091 YXISGRZJOKMPBV-LHSJRXKWSA-N 499.930 5.220 5 20 JKBD O=C(/C=C/C1CCCCC1)Nc1cc([C@H]2CCCCN2C(=O)CCc2cccc([N+](=O)[O-])c2)[nH]n1 1820905089 JPHZMXJPAUQQFW-HJSOSKBTSA-N 479.581 5.079 5 20 JKBD O=C(c1ccc([N+](=O)[O-])cc1F)N1CCC([C@@H]2CCCCN2C(=O)c2cc3ccccc3o2)CC1 1828190720 NARJYMJFCIXCEM-QFIPXVFZSA-N 479.508 5.027 5 20 JKBD O=C(c1cccc2ccccc12)N1CCC([C@H]2CCCCN2C(=O)c2cccc(F)c2[N+](=O)[O-])CC1 1830622264 WBMGRWPFUODKSM-RUZDIDTESA-N 489.547 5.434 5 20 JKBD CCC(C)(C)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2ccc(Br)c([N+](=O)[O-])c2)CC1 1831386834 DYIKAGIGQLXDAW-LJQANCHMSA-N 494.430 5.027 5 20 JKBD COc1ccc(NC(C)=O)cc1NC(=O)c1ccc(Sc2nc3ccccc3s2)c([N+](=O)[O-])c1 15982198 BDYYTPZIPKTPQC-UHFFFAOYSA-N 494.554 5.575 5 20 JKBD CCn1c(S[C@H](C(=O)Nc2ccccc2OC)C(C)C)nc2cc3ccccc3cc2c1=O 31747583 PROPBRZASHZPLX-QHCPKHFHSA-N 461.587 5.334 5 20 JKBD Cc1noc(C)c1CSCC(=O)Nc1cc([N+](=O)[O-])ccc1Nc1cccc(C(F)(F)F)c1 32531784 KGYCPZOSXAYBRV-UHFFFAOYSA-N 480.468 5.834 5 20 JKBD COc1cc2c(cc1OC)[C@H](c1cccs1)N(C(=O)c1ccc(N3CCCC3)c([N+](=O)[O-])c1)CC2 39203793 AXUJALGJPIMGJR-RUZDIDTESA-N 493.585 5.062 5 20 JKBD Cc1ccc(NC(=O)c2c[nH]c3ccc([N+](=O)[O-])cc23)cc1S(=O)(=O)Nc1ccc(Cl)cc1 109885798 FONGDNGGRQQZOB-UHFFFAOYSA-N 484.921 5.091 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)Nc2ccc(=O)n(Cc3ccc(Cl)c(Cl)c3)c2)cc1SC 483528091 MCIANIZFHDQVJH-UHFFFAOYSA-N 494.356 5.094 5 20 JKBD O=C(C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)Nc1nnc(-c2ccco2)s1 491394302 IJMYLIDZWGFKQR-QINSGFPZSA-N 489.538 5.885 5 20 JKBD O=C(Nc1ccccc1)Nc1ccc(C(=O)Nc2nc(-c3cccc([N+](=O)[O-])c3)cs2)cc1 492246771 VICGCTWFPFEDTM-UHFFFAOYSA-N 459.487 5.615 5 20 JKBD COC(=O)c1sc(NC(=O)c2cc([N+](=O)[O-])ccc2Sc2ccc(Cl)cc2)nc1C 499170389 PQPCXGJMQGWHEV-UHFFFAOYSA-N 463.924 5.203 5 20 JKBD Cc1cc(-c2cc(C(=O)N(Cc3ccc([N+](=O)[O-])cc3)C(C)C)c3cnn(C(C)C)c3n2)c(C)o1 509695799 HKGJOGDHIVGPOU-UHFFFAOYSA-N 475.549 5.848 5 20 JKBD C[C@H]([C@@H]1C[C@H]2CC[C@H]1C2)n1c(SCc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)nnc1-c1ccco1 514298535 PHGCLEVBYBGRMU-YEWFCNIMSA-N 492.561 5.786 5 20 JKBD CSc1ccc(C(=O)c2ccccc2C(=O)Nc2cccc(NC(=O)C(C)C)c2)cc1[N+](=O)[O-] 514323702 JTPVSKJZAPHZGM-UHFFFAOYSA-N 477.542 5.395 5 20 JKBD CNc1ccc(C(=O)N[C@@H](c2ccccc2)c2ccc3nc(C(F)(F)F)[nH]c3c2)cc1[N+](=O)[O-] 514523815 HDDCVQRQXOVMIH-FQEVSTJZSA-N 469.423 5.051 5 20 JKBD CC(C)OCCOCc1cccc(NC(=O)c2ccc(N3CCC[C@H](C)C3)c([N+](=O)[O-])c2)c1 520099784 QIXATSRUAJCNPC-IBGZPJMESA-N 455.555 5.025 5 20 JKBD CCC(C)(C)NC(=O)c1ccc(NC(=O)[C@@H](C)Oc2ccc(Cl)cc2[N+](=O)[O-])cc1Cl 521249122 MVKJFSGKKNQEIO-GFCCVEGCSA-N 468.337 5.226 5 20 JKBD Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)Nc1ccc(NC(=O)Nc2ccccc2C(F)(F)F)cc1 522771922 SSLPDXFOOWWESX-UHFFFAOYSA-N 494.451 5.367 5 20 JKBD C[C@@H]1CCCN(c2ccc(C(=O)N(C[C@H]3CCCO3)c3nc4ccccc4s3)cc2[N+](=O)[O-])C1 602756156 FPEDUDUXSABVJL-IEBWSBKVSA-N 480.590 5.267 5 20 JKBD C[C@@H]1CCCN(c2ccc(C(=O)Nc3cc(-c4nnc5n4CCCCC5)ccc3F)cc2[N+](=O)[O-])C1 603154556 GTSVKSMSAZPTQO-QGZVFWFLSA-N 492.555 5.207 5 20 JKBD CCCN(Cc1ccccc1F)C(=O)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 603519921 QYZUVEYJZONYMD-UHFFFAOYSA-N 467.463 5.408 5 20 JKBD COc1cccc(/C=C2/CCc3c2nc2ccccc2c3C(=O)N(C)c2ccc([N+](=O)[O-])cc2)c1OC 603565953 IBGIIQNWQWMQGY-ZCXUNETKSA-N 495.535 5.924 5 20 JKBD Cc1c(NC(=O)[C@@H](C)Sc2ccc([N+](=O)[O-])cc2)cccc1-c1nnc2n1CCCCC2 603962167 HSHPSFJCRNOTAT-MRXNPFEDSA-N 451.552 5.007 5 20 JKBD O=C(Nc1cc(Cl)ccc1NS(=O)(=O)c1ccccc1F)c1cc2cc([N+](=O)[O-])ccc2o1 604095890 VJTWWVMYCPGPFG-UHFFFAOYSA-N 489.868 5.187 5 20 JKBD COc1ccc(CCCN[C@@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Br)c2ccccc2)cc1 604125329 PDDUIHTULMWNQT-HSZRJFAPSA-N 498.377 5.268 5 20 JKBD C[C@@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)Nc1ccc(NC(=O)C2CC2)cc1C(F)(F)F 604446603 INQCJLAKZUWABX-SNVBAGLBSA-N 471.819 5.022 5 20 JKBD C[C@H](Nc1ccc(C(=O)NC[C@H]2CCN(c3ccc(Cl)cc3)C2)cc1[N+](=O)[O-])c1ccccn1 604466673 VGTOZHXWLAYZOU-ZWKOTPCHSA-N 479.968 5.073 5 20 JKBD O=[N+]([O-])c1ccc(-c2nnc(CN3CCN([C@@H](c4ccccc4)c4ccccc4Cl)CC3)o2)cc1 608856487 LVVOQCKGQUNQBI-VWLOTQADSA-N 489.963 5.205 5 20 JKBD COc1cc(C(=O)N[C@H](C)c2ccc(OCc3cccc(C)c3)cc2)c([N+](=O)[O-])cc1OC(F)F 609032703 CLBXKUNCKGRCJR-MRXNPFEDSA-N 486.471 5.583 5 20 JKBD CC1CCN(c2ccc(C(=O)Nc3cc(Cl)ccc3C(=O)N3CCCCC3)cc2[N+](=O)[O-])CC1 609057079 JDWNOLHJEQTLFW-UHFFFAOYSA-N 484.984 5.363 5 20 JKBD CC1CCC(OC2CCN(C(=O)c3ccccc3C(=O)c3ccc(N(C)C)c([N+](=O)[O-])c3)CC2)CC1 609381364 CVXODLISRBJCDP-UHFFFAOYSA-N 493.604 5.092 5 20 JKBD COc1ccc(CN[C@@H](C)c2ccc(N3CCCC3=O)cc2)cc1OCc1ccc([N+](=O)[O-])cc1 725848331 OSYMXCXQUCPPMJ-IBGZPJMESA-N 475.545 5.160 5 20 JKBD COc1ccc(C[C@@H](NC(=O)c2cc([N+](=O)[O-])ccc2Br)c2ccccc2)cc1OC 727331953 FUGAJEURVAIJCT-HXUWFJFHSA-N 485.334 5.088 5 20 JKBD Cc1ccc(NC(=O)[C@H](OC(=O)c2cc(F)c(Cl)nc2Cl)c2ccccc2)c([N+](=O)[O-])c1 727520422 FNCZTZHRRHYJIU-QGZVFWFLSA-N 478.263 5.281 5 20 JKBD O=C(COC(=O)[C@@H]1C[C@H]1c1ccc(Cl)c(Cl)c1)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 727929615 SIULWNSPTAAYJX-NWDGAFQWSA-N 477.222 5.206 5 20 JKBD O=C(O[C@@H](C(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1)c1ccccc1)[C@@H]1CCOc2ccccc21 728358999 NIEOTLXYBVEMMN-XMSQKQJNSA-N 466.877 5.038 5 20 JKBD C[C@H](OC(=O)CNc1ccc(C(F)(F)F)cc1[N+](=O)[O-])c1nnc(-c2cccc(Cl)c2)o1 746091674 ODZCFXZUOVQYKQ-JTQLQIEISA-N 470.791 5.033 5 20 JKBD Cc1ccc([N+](=O)[O-])cc1NC(=O)COC(=O)Cc1csc(-c2ccc(Cl)cc2Cl)n1 747257401 AQTJKHRYVGGLAL-UHFFFAOYSA-N 480.329 5.058 5 20 JKBD Cc1c(C(=O)Nc2nc(-c3ccc(Br)s3)cs2)cc([N+](=O)[O-])cc1[N+](=O)[O-] 747679246 KOIGRDIMSGQIEA-UHFFFAOYSA-N 469.298 5.011 5 20 JKBD C[C@@H](OC(=O)/C(=C\c1ccc(F)cc1)c1cccs1)C(=O)Nc1ccc(F)c([N+](=O)[O-])c1 772127194 ZKIJOERDBUFHHD-GPLLRDDGSA-N 458.442 5.046 5 20 JKBD O=C(COC(=O)c1c2c(nc3ccccc13)/C(=C\c1ccco1)CC2)c1cccc([N+](=O)[O-])c1 785139008 BPIZSSQBUHHCQU-VKAVYKQESA-N 454.438 5.263 5 20 JKBD CC(C)Cn1cc([C@@H]2N(Cc3ccc(-c4ccc([N+](=O)[O-])cc4)o3)CC23CCOCC3)cn1 849479409 QMHPKESCDAQGTH-DEOSSOPVSA-N 450.539 5.061 5 20 JKBD C[C@H](OC(=O)[C@@H](C)Sc1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccccc1Cc1ccccc1 856620277 IBURIQIHPBXAOS-ZWKOTPCHSA-N 464.543 5.237 5 20 JKBD C[C@H](OC(=O)CCNc1ccccc1[N+](=O)[O-])C(=O)N1c2ccccc2Sc2ccccc21 858085712 CGSHHLFVWHSSQS-INIZCTEOSA-N 463.515 5.158 5 20 JKBD C[C@H](Nc1ccc(-c2nc(-c3cc(Br)cs3)no2)cc1[N+](=O)[O-])c1ccccn1 904394936 WQCICAVXOFRRDG-NSHDSACASA-N 472.324 5.704 5 20 JKBD O=C(Nc1ccc(SC(F)F)cc1)N1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 915301184 WKCLGWXENAAQGS-UHFFFAOYSA-N 476.427 5.282 5 20 JKBD CCOc1cc([N+](=O)[O-])c(C(=O)Nc2ccccc2SC[C@H]2CC2(Cl)Cl)cc1OC 917751344 JWPLKBPLKLWMEB-GFCCVEGCSA-N 471.362 5.540 5 20 JKBD C[C@H](Nc1ccc(C(=O)O[C@H](C)C(=O)Nc2cc(Cl)ccc2F)cc1[N+](=O)[O-])c1ccccn1 920544004 BOVUBACSRJLWFA-UONOGXRCSA-N 486.887 5.139 5 20 JKBD Cc1c(C(=O)NC2(c3ccc(NC(=O)c4ccncc4)cc3)CCC2)cc(Cl)cc1[N+](=O)[O-] 1787313017 HPQDVWIVNAWAIX-UHFFFAOYSA-N 464.909 5.013 5 20 JKBD O=C(Cc1c[nH]c2ccccc12)NC1(c2ccc(NC(=O)c3cccc(F)c3[N+](=O)[O-])cc2)CCC1 1790699201 WVUGVFGFFGJPEY-UHFFFAOYSA-N 486.503 5.206 5 20 JKBD Cc1ccc(-c2ccccc2C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cccc(F)c2[N+](=O)[O-])cc1 1800530754 WJUDGQCYPGJNFZ-WKCHPHFGSA-N 487.531 5.275 5 20 JKBD Cc1ccc2nc(C(=O)N[C@@H]3C[C@@H]4CC[C@H](C3)N4C(=O)c3cc(Cl)cc([N+](=O)[O-])c3C)sc2c1 1800709822 FWTSXAUQMDBZDO-BJWYYQGGSA-N 498.992 5.040 5 20 JKBD Cc1cc(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3cc4cc([N+](=O)[O-])ccc4s3)CC2)c(C)o1 1825879605 KCQAQWDWBJCXHK-JOCHJYFZSA-N 495.601 5.566 5 20 JKBD Cc1ccc([C@H](C)C(=O)N2CCC([C@H]3CCCCN3C(=O)c3ccc([N+](=O)[O-])cc3F)CC2)cc1 1830498492 XIQIHKOBUKCTEI-UQBPGWFLSA-N 481.568 5.079 5 20 JKBD Cc1cc(F)c(F)c(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)/C=C/c3ccccc3[N+](=O)[O-])CC2)c1 1830778349 WTZCWQXMXUIELP-JJNABOQBSA-N 497.542 5.128 5 20 JKBD O=C(Nc1cccc(C2SCCS2)c1)c1ccc(NCc2ccccc2)c([N+](=O)[O-])c1 15036957 LKGNDVTULNNTGM-UHFFFAOYSA-N 451.573 5.938 5 20 JKBD O=C1c2ccccc2N[C@@H](c2cn(-c3ccccc3)nc2-c2ccc([N+](=O)[O-])cc2)N1C[C@H]1CCCO1 15503713 PLCXEUWOIHIJDM-AJTFRIOCSA-N 495.539 5.193 5 20 JKBD Cc1ccc(-c2cc(C(=O)OCC(=O)Nc3ccc([N+](=O)[O-])cc3Cl)c3ccccc3n2)o1 20863031 SDTMEKLHIMZZCJ-UHFFFAOYSA-N 465.849 5.160 5 20 JKBD O=C(Nc1ccc(N[C@@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2ccccc2)cc1)c1ccco1 26986491 SNZLDUZKHKEXQF-HSZRJFAPSA-N 490.903 5.885 5 20 JKBD O=C(CSc1nnc(-c2ccc(F)cc2)n1Cc1ccccc1)Nc1cc(Cl)ccc1[N+](=O)[O-] 28799040 SADLEZCYQGVYPJ-UHFFFAOYSA-N 497.939 5.425 5 20 JKBD Cc1ccc(NC(=O)[C@H](C)SCc2nc(=O)c3c(-c4ccccc4)csc3[nH]2)cc1[N+](=O)[O-] 29486338 XHLFTGPMYVPXSB-AWEZNQCLSA-N 480.571 5.129 5 20 JKBD COc1cc(C(=O)NCC2(c3ccc(F)cc3)CCCC2)c([N+](=O)[O-])cc1OCc1cscn1 72024725 HJRMEKXSFKWHOC-UHFFFAOYSA-N 485.537 5.020 5 20 JKBD C[C@H](Nc1ccc(C(=O)Nc2cccc(NC(=O)c3cccs3)c2)cc1[N+](=O)[O-])c1ccccn1 108786759 GSFGUEYLJGSVPL-INIZCTEOSA-N 487.541 5.729 5 20 JKBD O=C(C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)NC1CCN(CC2CC2)CC1 488378888 WQGCPNFKFBPYOT-HMMYKYKNSA-N 476.602 5.126 5 20 JKBD CN(Cc1ccc(F)c(F)c1)C(=O)C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1 489208730 WDGATUCSWJQEHU-LDADJPATSA-N 479.508 6.072 5 20 JKBD O=C(NCc1cn(-c2ccccc2)nc1-c1ccncc1)c1cc2ccccc2c2cccnc12 489882796 KOUULELLUJJXCN-UHFFFAOYSA-N 455.521 5.566 5 20 JKBD Cc1cc(C(=O)NC(C)C)ccc1NC(=O)c1ccc(NCc2ccccc2Cl)c([N+](=O)[O-])c1 489955276 IJMXSAFFRQYKQM-UHFFFAOYSA-N 480.952 5.559 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Cl)[C@@H](Nc1cc(F)cc(N2CCOCC2)c1)c1ccccc1 498573668 FLRPNWNBMSBSCO-QHCPKHFHSA-N 484.915 5.016 5 20 JKBD O=C(Nc1nc(-c2ccc(F)c(Cl)c2)cs1)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-] 511632732 YYDKIMIEZBICMX-UHFFFAOYSA-N 475.807 5.704 5 20 JKBD COc1cc(C(=O)N2C[C@H]3CCCN3c3ccccc32)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 516129486 OMJRZGPMXSHQIC-GOSISDBHSA-N 479.920 5.678 5 20 JKBD O=C(Cc1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1)N[C@H](c1ccccc1)[C@@H]1CCCO1 523275393 VSGYJOXMLIABTH-LBNVMWSVSA-N 482.540 5.027 5 20 JKBD O=C(Nc1ccc(NC(=O)c2cc3cc([N+](=O)[O-])ccc3o2)c(C(F)(F)F)c1)c1ccco1 603734210 XGKOWRDDCJXUHP-UHFFFAOYSA-N 459.336 5.457 5 20 JKBD COCCN(C(=O)CCc1cc2ccccc2o1)c1nc(-c2ccc([N+](=O)[O-])cc2)cs1 610935236 AXVAMFBEUYRQOI-UHFFFAOYSA-N 451.504 5.077 5 20 JKBD CCn1c(S[C@H](C)C(=O)Nc2cc(Cl)ccc2F)nc2cc3ccccc3cc2c1=O 622146235 MOTDWGRINZJXIS-CYBMUJFWSA-N 455.942 5.481 5 20 JKBD C[C@H](Oc1cc(Cl)cc(Cl)c1)C(=O)O[C@@H](C)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 727216797 DGVPVNUZTSYTLH-QWRGUYRKSA-N 452.250 5.023 5 20 JKBD Cc1occc1C(=O)Nc1cc(Cl)ccc1C(=O)N(C)Cc1cc([N+](=O)[O-])ccc1Cl 728171973 NMIXXBITRJMTAJ-UHFFFAOYSA-N 462.289 5.328 5 20 JKBD Cc1csc(Nc2cccc(NC(=O)c3ccc(N[C@@H](C)c4ccccn4)c([N+](=O)[O-])c3)c2)n1 729336267 GNYBIDJUCXUNNM-INIZCTEOSA-N 474.546 5.924 5 20 JKBD O=C(Nc1ccc2nc(-c3cccc(F)c3)[nH]c2c1)c1cc([N+](=O)[O-])ccc1Br 751092391 FJNURYIVWLFFNC-UHFFFAOYSA-N 455.243 5.292 5 20 JKBD C[C@@H](OC(=O)c1cc2c3ccccc3n(C)c2s1)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl 762196807 SWHHIBWYVBQLCN-LLVKDONJSA-N 457.895 5.139 5 20 JKBD Cn1c(Sc2cc(Cl)c(C(F)(F)F)cc2[N+](=O)[O-])nnc1[C@H]1COc2ccccc2O1 800111656 ZOUSKNSVGQHGTD-CQSZACIVSA-N 472.832 5.059 5 20 JKBD O=C(Nc1cc(Cl)c([N+](=O)[O-])cc1OCc1ccccc1)c1cccc(N2CCOC2=O)c1 915828544 PFKLNVGJJAPYRT-UHFFFAOYSA-N 467.865 5.036 5 20 JKBD CS(=O)(=O)c1cc(C(=O)Nc2cc(Cl)c([N+](=O)[O-])cc2OCc2ccccc2)ccc1Cl 916827220 BQFSQUAMCJCALQ-UHFFFAOYSA-N 495.340 5.136 5 20 JKBD O=C(Nc1ccc(OC(=O)c2cc(Cl)cc3cccnc23)cc1)c1cc([N+](=O)[O-])ccc1Cl 917562521 STPLGLKOFCIZIR-UHFFFAOYSA-N 482.279 5.921 5 20 JKBD Cc1ccc2nc(-c3ccc(NC(=O)COC(=O)c4cc([N+](=O)[O-])ccc4F)cc3)sc2c1 919250812 CDBNDFNDMLKARF-UHFFFAOYSA-N 465.462 5.115 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)c3cc(Br)cs3)CCC2)cc1)c1ccc([N+](=O)[O-])o1 1785748691 AYPYQQDYPFIVHH-UHFFFAOYSA-N 490.335 5.073 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)Nc1ccc(C2(NC(=O)c3ccc(Cl)nc3)CCC2)cc1 1790774878 QQSWXKZFNZMRLD-UHFFFAOYSA-N 482.899 5.152 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)c3nccs3)CCC2)cc1)c1cc2cc([N+](=O)[O-])ccc2s1 1791011344 XVJGHQDSBYUVIH-UHFFFAOYSA-N 478.555 5.328 5 20 JKBD COc1cc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2sc3ccccc3c2Cl)ccc1[N+](=O)[O-] 1797464409 UKJCZENFJLBTNR-MUJYYYPQSA-N 499.976 5.037 5 20 JKBD O=C(CCc1cccc([N+](=O)[O-])c1)Nc1cc([C@@H]2CCCCN2C(=O)c2ccc3ccoc3c2)[nH]n1 1815538850 ZUCNAUYXZFCVTP-QFIPXVFZSA-N 487.516 5.003 5 20 JKBD Cc1c(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)C3CCCCC3)n[nH]2)cc(Cl)cc1[N+](=O)[O-] 1816708906 SPJZCCODHOXRAA-LJQANCHMSA-N 473.961 5.166 5 20 JKBD CC(C)c1ccc(CC(=O)Nc2cc([C@H]3CCCCN3C(=O)c3cccc(F)c3[N+](=O)[O-])[nH]n2)cc1 1822137801 CXWZJPQOSOPKJE-JOCHJYFZSA-N 493.539 5.129 5 20 JKBD C/C(=C\c1ccc(C)o1)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2c(F)ccc([N+](=O)[O-])c2C)CC1 1829009930 QKZOVZWBXRMTAW-GQRCBVMOSA-N 497.567 5.281 5 20 JKBD O=C(c1cccc2ccoc12)N1CCC([C@@H]2CCCCN2C(=O)c2cc(F)cc([N+](=O)[O-])c2)CC1 1830617949 GMECPILUWFEMTI-QHCPKHFHSA-N 479.508 5.027 5 20 JKBD Cc1ccoc1C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)CC1 1831060653 CHVHFCXVBHKHSK-FQEVSTJZSA-N 481.574 5.258 5 20 JKBD COc1ccc([N+](=O)[O-])cc1CSc1nnc([C@@H](C)N2CCCCC2)n1-c1ccccc1 11212533 VKGUQRCQFLJDNN-QGZVFWFLSA-N 453.568 5.023 5 20 JKBD Cc1nc(CSc2ccccc2C(=O)OCC(=O)Nc2cc(Cl)ccc2[N+](=O)[O-])cs1 11596018 CTIBVNSQXAOELU-UHFFFAOYSA-N 477.951 5.101 5 20 JKBD O=C(COC(=O)c1c2c(nc3ccccc13)CCCCC2)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 12461840 ZIBJHZZYQXWQFA-UHFFFAOYSA-N 487.434 5.226 5 20 JKBD COc1cc2c(cc1OC)[C@H](c1cccs1)N(C(=O)c1ccc(SC)c([N+](=O)[O-])c1)CC2 16002380 AAPRIAKUYRMBDL-JOCHJYFZSA-N 470.572 5.183 5 20 JKBD C[C@@H](OC(=O)C1CCN(c2ccccc2[N+](=O)[O-])CC1)C(=O)Nc1ccc(Cl)cc1C(F)(F)F 17045071 HLZCZCTYDYBEHA-CYBMUJFWSA-N 499.873 5.054 5 20 JKBD COc1ccc(NC(=O)[C@H](C)OC(=O)c2ccccc2SCc2cccs2)c([N+](=O)[O-])c1 18529551 VFDJQBZPMVYWQD-AWEZNQCLSA-N 472.544 5.141 5 20 JKBD Cc1cc(C)c(NC(=O)COC(=O)c2ccc(Sc3nc(C)cs3)c([N+](=O)[O-])c2)c(Cl)c1 28870673 LCVAPLPISPOXRK-UHFFFAOYSA-N 491.978 5.577 5 20 JKBD Cc1ccc(C)c(SCc2nc(=O)c3c(C)c(C(=O)Nc4ccc(C)c([N+](=O)[O-])c4)sc3[nH]2)c1 29895792 DPPHWPUTNLZSGV-UHFFFAOYSA-N 494.598 5.671 5 20 JKBD Cc1nn(Cc2ccc(C(=O)Nc3cccc(COCc4ccco4)c3)cc2)c(C)c1[N+](=O)[O-] 107996121 SPORRJIBJHMKOA-UHFFFAOYSA-N 460.490 5.019 5 20 JKBD COc1ccc(C)cc1-c1csc(NC(=O)c2ccc(N[C@@H](C)c3ccccn3)c([N+](=O)[O-])c2)n1 108780512 AKNCVJGOSKFLGS-INIZCTEOSA-N 489.557 5.856 5 20 JKBD COc1cc(CN(C)C(=O)c2ccc(N[C@H](C)c3ccccn3)c([N+](=O)[O-])c2)ccc1SC 477817149 LRPOEMJONSADON-MRXNPFEDSA-N 466.563 5.166 5 20 JKBD C[C@H](NC(=O)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1)c1ccc(NC(N)=O)cc1 480286689 JZECVZONLNXTKL-ZDUSSCGKSA-N 454.870 5.022 5 20 JKBD C[C@H]1CN(c2ccc(NC(=O)c3cc([N+](=O)[O-])ccc3Sc3ccccc3)cn2)C[C@H](C)O1 483433531 BKAZUCXRVCFKJJ-IRXDYDNUSA-N 464.547 5.007 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Cl)[C@@H](NC[C@H]1CCCN(Cc2cccs2)C1)c1ccccc1 493886915 YWGNFASUSDFYPL-KOSHJBKYSA-N 499.036 5.491 5 20 JKBD C[C@@H]1c2[nH]c3ccccc3c2[C@@H](c2ccccc2Cl)CN1C(=O)CCn1cc([N+](=O)[O-])cn1 508804633 BVAUOUMKTVVEBQ-DNVCBOLYSA-N 463.925 5.051 5 20 JKBD C[C@@H]1CCC[C@@H](OCc2cccc(NC(=O)c3ccc(Sc4nncn4C)c([N+](=O)[O-])c3)c2)C1 509024573 XFTRBPDCHIAYKK-OXQOHEQNSA-N 481.578 5.222 5 20 JKBD Cc1ccc(-c2ccc(CN(C(=O)c3cc([N+](=O)[O-])cc(S(C)(=O)=O)c3)C(C)C)s2)cc1 516372305 FINVHTAKWSNOQP-UHFFFAOYSA-N 472.588 5.086 5 20 JKBD CC(C)c1ccc(OC2CCN(C(=O)c3ccc(N[C@@H](C)c4ccccn4)c([N+](=O)[O-])c3)CC2)cc1 518434090 RCZSNRIIHLLCKS-FQEVSTJZSA-N 488.588 5.970 5 20 JKBD CCN(C(=O)[C@H](C)Sc1ccc([N+](=O)[O-])cc1)[C@@H](c1cccnc1)c1ccc(F)c(C)c1 521452050 NYOFKJFFUYWGDF-GAJHUEQPSA-N 453.539 5.556 5 20 JKBD COc1ccc(N2C(=O)c3ccccc3N[C@H]2c2csc(-c3cccc([N+](=O)[O-])c3)n2)c(OC)c1 602761543 SQFCMEYCZQYURM-HSZRJFAPSA-N 488.525 5.507 5 20 JKBD COc1cc([C@H](C)Nc2ccc([N+](=O)[O-])c(C(=O)N3CCCC3)c2)ccc1OCCC(C)C 603943503 KXMJPNSECKWKFW-SFHVURJKSA-N 455.555 5.437 5 20 JKBD O=[N+]([O-])c1ccc(-c2ccc(CNCc3ccccc3OCC(F)(F)F)o2)c(Br)c1 608836114 NOQDWGZJVPTCFV-UHFFFAOYSA-N 485.256 5.848 5 20 JKBD COc1cc(CNCc2cn(-c3ccccc3)nc2-c2ccc([N+](=O)[O-])cc2)ccc1OC(C)C 726606890 GJBDQCRLRDMVTE-UHFFFAOYSA-N 472.545 5.533 5 20 JKBD C[C@H](Nc1ccc(C(=O)N2CCCC[C@H]2[C@@H](C)NC(=O)OC(C)(C)C)cc1[N+](=O)[O-])c1ccccn1 727376861 DKRBVNXAQDUACI-SVMVAKDDSA-N 497.596 5.071 5 20 JKBD O=C(CCC(=O)c1ccc2ccc3cccc4ccc1c2c34)N[C@@H]1CCCN(c2ncccn2)C1 727755001 LHMYFUAWIIWODL-JOCHJYFZSA-N 462.553 5.122 5 20 JKBD Cc1nn(CC(C)C)c(C)c1CCC(=O)Oc1ccc2c(-c3ccc([N+](=O)[O-])cc3)cc(=O)oc2c1 730664058 ZJKKJBZSZYFRQT-UHFFFAOYSA-N 489.528 5.376 5 20 JKBD CC(=O)N(c1cccc(Cl)c1)c1nc(COC(=O)/C=C\c2ccc([N+](=O)[O-])cc2)cs1 798127941 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Cc1cc(C(=O)NC2(c3ccc(NC(=O)Cc4ccc(Cl)cc4[N+](=O)[O-])cc3)CCC2)c(C)o1 1786116553 QNAHWJIBJJTTDW-UHFFFAOYSA-N 481.936 5.448 5 20 JKBD Cc1c(C(=O)NC2(c3ccc(NC(=O)c4ccc(O)c([N+](=O)[O-])c4)cc3)CCC2)oc2ccccc12 1790619592 GVTWZFRCJPSOJB-UHFFFAOYSA-N 485.496 5.417 5 20 JKBD O=C(NC1(c2ccc(NC(=O)c3ccc([N+](=O)[O-])cc3F)cc2)CCC1)c1ccnc(C(F)F)c1 1790622794 SOMZDQLFUYXJRA-UHFFFAOYSA-N 484.434 5.128 5 20 JKBD O=C(CCOc1ccc(F)cc1)NC1(c2ccc(NC(=O)c3cccc(F)c3[N+](=O)[O-])cc2)CCC1 1790699485 JMUXNQKIKQWITN-UHFFFAOYSA-N 495.482 5.090 5 20 JKBD Cc1c(C(=O)N2CCCC[C@H]2C2CCN(C(=O)c3sccc3F)CC2)cc(Cl)cc1[N+](=O)[O-] 1830734722 PVIXMCWKOWSSKC-IBGZPJMESA-N 493.988 5.304 5 20 JKBD C[C@@H](Sc1ncc(C(F)(F)F)cc1Cl)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 9160383 GXTRVMXRUKUXHO-SSDOTTSWSA-N 473.782 5.800 5 20 JKBD C[C@@H](NC(=O)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1)c1ccc(-n2cncn2)cc1 11407286 LUAJXWCAJWZVIE-OAHLLOKOSA-N 463.881 5.112 5 20 JKBD Cc1oc2cc(OS(=O)(=O)c3ccc([N+](=O)[O-])cc3)ccc2c(=O)c1-c1ccccc1Cl 14099882 SHQLRHFDTKSDRR-UHFFFAOYSA-N 471.874 5.098 5 20 JKBD COc1ccc(C)cc1CCN[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1 15506769 CRQYABXDIBFILG-QHCPKHFHSA-N 453.926 5.077 5 20 JKBD C[C@H](OC(=O)CCCOc1ccc(Cl)cc1Cl)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 17838588 ODJJINZKEUUCAB-LBPRGKRZSA-N 466.277 5.415 5 20 JKBD O=C(COC(=O)c1c2c(nc3ccccc13)/C(=C/c1ccco1)CC2)Nc1ccccc1[N+](=O)[O-] 20820136 QWEAZURGGNPPII-JQIJEIRASA-N 469.453 5.018 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Cl)[C@@H](Nc1ccc(NC(=O)[C@H]2CCCO2)cc1)c1ccccc1 27000701 YGZGJRCQDLPBFZ-PKTZIBPZSA-N 494.935 5.158 5 20 JKBD C[C@H](N[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Br)c1ccccc1)c1ccc2c(c1)OCO2 30500870 ZLGHDGIKWHTPBB-RCDICMHDSA-N 498.333 5.117 5 20 JKBD C[C@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)Nc1cc(Br)ccc1Br 31950559 OAURFXBXOFNSMU-VIFPVBQESA-N 460.147 5.239 5 20 JKBD CN(Cc1ccccc1[N+](=O)[O-])C(=O)Cc1cn(-c2ccccc2)nc1-c1ccc(Cl)cc1 43770129 MWFRJCXCQBKYSG-UHFFFAOYSA-N 460.921 5.302 5 20 JKBD O=C(CCNc1ccc(C(F)(F)F)cc1[N+](=O)[O-])Nc1cccc(NC(=O)c2ccccc2)c1 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Cc1[nH]c2ccc(CN[C@H](C(=O)Nc3ccc([N+](=O)[O-])cc3Cl)c3ccccc3)cc2c1C 520467672 AHDZXUBUAQLZNV-DEOSSOPVSA-N 462.937 5.816 5 20 JKBD Cn1cc(C(=O)Nc2ccc(Oc3cccc(F)c3)c3ccncc23)c(-c2ccc([N+](=O)[O-])cc2)n1 524456931 TYMRJRIWEOUCLI-UHFFFAOYSA-N 483.459 5.727 5 20 JKBD COc1cc(C(=O)N[C@H](c2ccc3c(c2)CCCC3)c2cccs2)c([N+](=O)[O-])cc1OC(F)F 585708101 UHKJYKSFSHRUPQ-JOCHJYFZSA-N 488.512 5.665 5 20 JKBD Cc1cc(C(=O)N2CCC(C)CC2)ccc1NC(=O)CSc1ccc(C(F)(F)F)cc1[N+](=O)[O-] 603992657 CANYAOVYOMTZFM-UHFFFAOYSA-N 495.523 5.525 5 20 JKBD Cc1sc(NC(=O)c2cc(C3CC3)nc3c2cnn3C(C)C)nc1-c1cccc([N+](=O)[O-])c1 603996767 CTOTWCHCNHHDLO-UHFFFAOYSA-N 462.535 5.482 5 20 JKBD Cc1cc([N+](=O)[O-])ccc1NC(=O)CN[C@H](c1ccccc1)c1ccc(Br)cc1F 604009792 ZZKBCBDCZVMPBM-JOCHJYFZSA-N 472.314 5.123 5 20 JKBD CSc1ccc([N+](=O)[O-])c(C(=O)N2c3ccccc3CC[C@H]2C(=O)Nc2ccc(F)cc2)c1 608871445 DBWOKUCECHSOEQ-QFIPXVFZSA-N 465.506 5.056 5 20 JKBD CN(CCNC(=O)C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)C1CCCC1 609190123 OCNCMBWOGFGZGY-KNTRCKAVSA-N 464.591 5.126 5 20 JKBD C[C@@H](Nc1ccc(C(=O)NCCCc2cccc(Br)c2)cc1[N+](=O)[O-])c1ccccn1 609410213 BQPOQQWAWFPQRX-MRXNPFEDSA-N 483.366 5.288 5 20 JKBD COc1cc(CCNC(=O)Cc2c(C)nc3ccccc3c2-c2ccccc2)c([N+](=O)[O-])cc1OC 609603720 YYEQJYOUAXBLPN-UHFFFAOYSA-N 485.540 5.037 5 20 JKBD CCOCc1cccc(NC(=O)c2ccccc2NC(=O)c2ccc([N+](=O)[O-])cc2Cl)c1 726544886 ZJTMFARDJXHJLW-UHFFFAOYSA-N 453.882 5.289 5 20 JKBD O=C(NCc1ccnc(-n2ccnc2)c1)c1ccccc1Sc1ccc(C(F)(F)F)cc1[N+](=O)[O-] 743958821 JDRMKRMNCAPKCG-UHFFFAOYSA-N 499.474 5.276 5 20 JKBD C[C@H](OC(=O)COc1ccc(C2SCCCS2)cc1)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 746244725 AGNFSWADSDITMH-AWEZNQCLSA-N 487.559 5.197 5 20 JKBD O=C(COC(=O)c1cnc(-c2ccccc2Cl)s1)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 747952143 KVIZFZPWUUOYAF-UHFFFAOYSA-N 485.827 5.186 5 20 JKBD Cc1ccc(Sc2ccc(C(=O)OCC(=O)Nc3c(F)cccc3F)cc2[N+](=O)[O-])cc1 821041440 IECZZPDRRPXSRF-UHFFFAOYSA-N 458.442 5.128 5 20 JKBD O=C(O[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1)c1ccc(C(F)(F)F)cn1 844261197 NOWCVVZCGGYDKH-SFHVURJKSA-N 479.798 5.199 5 20 JKBD CCN(C)Cc1cc(O[C@H]2CCN(C(=O)c3cc([N+](=O)[O-])ccc3SCC3CCCC3)C2)ccn1 856629135 JAGMMOOUTDUUTO-QHCPKHFHSA-N 498.649 5.017 5 20 JKBD C[C@@H]1CCC[C@@H](C)N1NC(=O)C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1 864846224 LOXOEFQAKQTOFA-HMVXKNIBSA-N 450.564 5.429 5 20 JKBD CC(=O)Nc1cccc(NC(=O)c2cc([N+](=O)[O-])ccc2N2CCC(Cc3ccccc3)CC2)c1C 893360642 DDOFXNCEZKWHIV-UHFFFAOYSA-N 486.572 5.573 5 20 JKBD COc1ccc(N[C@@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2C(F)(F)F)cc1NC(=O)OC(C)(C)C 915224095 FJQBNJFQUZXVJU-LBPRGKRZSA-N 498.458 5.408 5 20 JKBD O=C(Nc1ccc(OC[C@H](O)c2cccc(C(F)(F)F)c2)cc1)c1cc([N+](=O)[O-])ccc1Cl 917004188 ZQBOCDNCUPCWIY-FQEVSTJZSA-N 480.826 5.632 5 20 JKBD C[C@@H](Nc1cc(Cl)c(C(F)(F)F)cc1[N+](=O)[O-])c1ccc(OCC(=O)NC2CC2)cc1 917083499 LZVFPDXZGFMKCJ-LLVKDONJSA-N 457.836 5.098 5 20 JKBD COCCN(C(=O)C(F)(F)c1cccc(Cl)c1)c1nc(-c2ccc([N+](=O)[O-])cc2)cs1 921000133 AVWOVPIYULIANP-UHFFFAOYSA-N 467.881 5.143 5 20 JKBD COC(=O)/C=C/c1ccc(Oc2ccc3c(-c4ccc([N+](=O)[O-])cc4)cc(=O)oc3c2)c([N+](=O)[O-])c1 931294794 LTAGINDCURCELP-QDEBKDIKSA-N 488.408 5.255 5 20 JKBD CC(C)c1cc(C(=O)Nc2ccc(C3(NC(=O)CSc4ccccc4[N+](=O)[O-])CCC3)cc2)on1 1790164272 JMIRIKISADKMHO-UHFFFAOYSA-N 494.573 5.246 5 20 JKBD Cc1ccc2nc(C(=O)N3[C@H]4CC[C@@H]3C[C@H](NC(=O)c3cc(Cl)cc([N+](=O)[O-])c3C)C4)sc2c1 1795355751 KWDFDAYNXVVQMS-BJWYYQGGSA-N 498.992 5.040 5 20 JKBD C[C@@H](C(=O)N1CCC2(CCCN(C(=O)CCc3cccc([N+](=O)[O-])c3)C2)CC1)c1ccc(Cl)cc1 1806486364 JICONTYVVMWDRG-HXUWFJFHSA-N 498.023 5.216 5 20 JKBD O=C(Nc1cc([C@@H]2CCCCN2C(=O)[C@@H]2CCC[C@@H]3CCCC[C@H]32)[nH]n1)c1ccc([N+](=O)[O-])cc1F 1821054581 PNEBDIJECQGCCX-YIKPNSEUSA-N 497.571 5.369 5 20 JKBD CCCOc1cc(NC(=O)c2ccc(Br)cc2F)c([N+](=O)[O-])cc1OCCC 10755099 AMDUZZLIWRCRFP-UHFFFAOYSA-N 455.280 5.326 5 20 JKBD Cc1cccc(C)c1NC(=O)[C@@H](C)OC(=O)c1ccccc1C(=O)c1ccc(Cl)c([N+](=O)[O-])c1 15710298 IWQCCTGNNHOWFV-MRXNPFEDSA-N 480.904 5.280 5 20 JKBD CCOc1cc([N+](=O)[O-])c(C(=O)NC[C@@H](c2ccccc2Cl)c2c[nH]c3ccccc23)cc1OC 15758542 QDOCRGJYWGKGRJ-IBGZPJMESA-N 493.947 5.699 5 20 JKBD C[C@H](Sc1nnc(-c2ccc(OC(F)F)cc2)o1)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 17670925 SPNXDAXSBBLAOU-JTQLQIEISA-N 461.406 5.150 5 20 JKBD CC(C)OCCCn1c(S[C@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)nc2ccccc2c1=O 17723598 ACWQIILUJBWHRC-MRXNPFEDSA-N 495.561 5.023 5 20 JKBD C[C@H](SC1=N/C(=C\c2ccccc2)C(=O)N1c1ccc(F)cc1)C(=O)Nc1cccc([N+](=O)[O-])c1 23646954 SHQJXMBCHAMQNB-VOMLJKFNSA-N 490.516 5.238 5 20 JKBD CC(C)c1ccc(CSc2nnc(SCC(=O)N3CCc4ccc([N+](=O)[O-])cc43)s2)cc1 24161076 FBFAWSHWBOKYMY-UHFFFAOYSA-N 486.644 5.543 5 20 JKBD O=C(Nc1ccccc1)[C@@H]1CCCN(C(=O)c2cc([N+](=O)[O-])ccc2Sc2ccccc2)C1 26639124 YIPFBXAMQBJPQL-GOSISDBHSA-N 461.543 5.237 5 20 JKBD CCOc1ccccc1NC(=O)[C@H](OC(=O)c1ccc([N+](=O)[O-])cc1Cl)c1ccccc1 28300571 AMBIQWUKSHTZFP-OAQYLSRUSA-N 454.866 5.184 5 20 JKBD Cc1ccc(NC(=O)[C@H](Sc2nnc3sc4ccccc4n23)c2ccccc2)c([N+](=O)[O-])c1 28416660 BICGVUHJZLNCAM-HXUWFJFHSA-N 475.555 5.633 5 20 JKBD C[C@@H](OC(=O)Cn1c2ccccc2c(=O)c2ccccc21)C(=O)Nc1ccc(Cl)c(Cl)c1 28774870 RUOFCNDLBWCVBQ-CQSZACIVSA-N 469.324 5.032 5 20 JKBD Cc1ccc(S(=O)(=O)Nc2ccc(C(=O)Nc3ccccc3-c3ccccc3)cc2)cc1[N+](=O)[O-] 30027975 FCBKSLASEXNCOE-UHFFFAOYSA-N 487.537 5.623 5 20 JKBD CS(=O)(=O)c1cccc(C(=O)Nc2cc([N+](=O)[O-])ccc2Nc2cccc(C(F)(F)F)c2)c1 32531792 XPTQBUWRUJGOET-UHFFFAOYSA-N 479.436 5.013 5 20 JKBD COc1ccccc1-c1csc(NC(=O)CSc2ccc(C(F)(F)F)cc2[N+](=O)[O-])n1 32580497 FGPRVRIFTPHYAT-UHFFFAOYSA-N 469.466 5.477 5 20 JKBD CC(C)OC(=O)C[C@H](NC(=O)c1cc2c(s1)-c1ccccc1OC2)c1ccccc1[N+](=O)[O-] 105281590 ZWTAISNUSYSMCB-SFHVURJKSA-N 466.515 5.029 5 20 JKBD O=[N+]([O-])c1cc(Cl)ccc1Oc1ccc(CNC2CCN(Cc3ccncc3)CC2)cc1 195658500 UAZAQWFVESSRNM-UHFFFAOYSA-N 452.942 5.190 5 20 JKBD CCOc1cc(C(=O)Nc2ccc(C(=O)N(C)C3CCCCC3)c(Cl)c2)c([N+](=O)[O-])cc1OC 488647527 TUTFYPKIGBWKEV-UHFFFAOYSA-N 489.956 5.313 5 20 JKBD CSc1ccc(C(=O)N(Cc2ccc(Cl)c(Cl)c2)Cc2ccccn2)cc1[N+](=O)[O-] 499651128 PLGQKIDWHJRWOT-UHFFFAOYSA-N 462.358 5.861 5 20 JKBD COc1ccc([C@H]2CCN(C(=O)c3ccc(Oc4ccc(Cl)cc4[N+](=O)[O-])cc3)C2)cc1 504939174 MOUKFYRPFHKTNK-SFHVURJKSA-N 452.894 5.679 5 20 JKBD C[C@@H](OC[C@H](O)COc1ccc(NC(=O)c2cccc([N+](=O)[O-])c2)cc1)c1ccc(Cl)cc1 506337297 IXCQTWHDUJGKAO-ZHRRBRCNSA-N 470.909 5.018 5 20 JKBD CCc1cc(Sc2nnc(Nc3cccc(NC(C)=O)c3)s2)nc(-c2ccc([N+](=O)[O-])cc2)n1 507092507 CHBOSKUVXGRYBQ-UHFFFAOYSA-N 493.574 5.319 5 20 JKBD Cc1cc([N+](=O)[O-])ccc1C(=O)N(C[C@@H]1CCCO1)c1nc(-c2cccc(C(F)(F)F)c2)cs1 508801118 HBSXJNMBBDCPSJ-SFHVURJKSA-N 491.491 5.871 5 20 JKBD O=C(Nc1cccc(COC2CCCCC2)c1)c1ccc([N+](=O)[O-])cc1I 511769525 QPSFRSHIAZMPKA-UHFFFAOYSA-N 480.302 5.301 5 20 JKBD Cc1nc(-c2ccc([C@H](C)NC(=O)c3ccc(Cn4nc(C)c([N+](=O)[O-])c4C)cc3)cc2)cs1 514528133 PZCGHGAEIZWGCH-HNNXBMFYSA-N 475.574 5.379 5 20 JKBD Cc1nn(Cc2ccc(C(=O)Nc3ccc(OCc4ccccn4)c(Cl)c3)cc2)c(C)c1[N+](=O)[O-] 520098119 JTEAATILAZODKA-UHFFFAOYSA-N 491.935 5.336 5 20 JKBD O=C(NC1CCN(C(=O)c2ccc(NCc3ccccc3Cl)c([N+](=O)[O-])c2)CC1)C1CCCCC1 520098288 AFIDQZXPQIZCKI-UHFFFAOYSA-N 499.011 5.161 5 20 JKBD O=C1CCCN1C[C@@H](NCc1ccc(-c2ccccc2[N+](=O)[O-])o1)c1cccc(C(F)(F)F)c1 520205141 ZDPJPEUTNAXMMB-HXUWFJFHSA-N 473.451 5.327 5 20 JKBD COC1CCN(C(C)(C)CNC(=O)c2cc([N+](=O)[O-])ccc2Sc2ccc(Cl)cc2)CC1 524611300 KFYBYDYOJZTFLF-UHFFFAOYSA-N 478.014 5.019 5 20 JKBD CSc1nc(-c2ccc(F)cc2)nc(C)c1C(=O)Nc1cc([N+](=O)[O-])ccc1OC(F)F 603755710 SNJMHAZXNZGZGJ-UHFFFAOYSA-N 464.425 5.075 5 20 JKBD O=C(Nc1ccccc1)[C@@H]1CCc2ccccc2N1C(=O)c1csc(-c2ccc([N+](=O)[O-])cc2)n1 608871918 GPKGOSMZFKKDCG-QHCPKHFHSA-N 484.537 5.319 5 20 JKBD C[C@H]1CN(C(=O)c2c3c(nc4ccccc24)/C(=C/c2cccc([N+](=O)[O-])c2)CCC3)CCCO1 608946301 IBXJVNMUUVLDHF-XTFSCAMASA-N 457.530 5.271 5 20 JKBD Cc1cc2cc(NC(=O)c3ccc(C(=O)Nc4ccc5[nH]c(C)cc5c4)c([N+](=O)[O-])c3)ccc2[nH]1 609044064 TVBMSRIUSVXUIG-UHFFFAOYSA-N 467.485 5.679 5 20 JKBD CCCS(=O)(=O)Nc1cccc(NC(=O)c2cc([N+](=O)[O-])ccc2Sc2ccccc2)c1C 609097237 CSRACKQRRQXNMN-UHFFFAOYSA-N 485.587 5.458 5 20 JKBD O=C(Nc1cnc(C2CC2)nc1)c1ccccc1Sc1ccc(C(F)(F)F)cc1[N+](=O)[O-] 609127456 PQVOZPHBSBEPJA-UHFFFAOYSA-N 460.437 5.685 5 20 JKBD Cc1ccc(S(=O)(=O)Nc2ccc(NC(=O)c3cc(F)c(Cl)cc3Cl)cc2)cc1[N+](=O)[O-] 610862715 XGTUHCHWGXHTNN-UHFFFAOYSA-N 498.319 5.402 5 20 JKBD COC(=O)Nc1cc(NC(=O)c2ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])cc2)ccc1F 727335468 SSDSKHWWHIMWGC-UHFFFAOYSA-N 459.817 5.610 5 20 JKBD COc1cc(C(=O)OCc2nccn2CC(F)(F)F)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 727771346 KAJRQNZKTJCOMJ-UHFFFAOYSA-N 485.802 5.165 5 20 JKBD Cc1cc(COc2ccc(C(=O)O[C@@H](C)c3cccc([N+](=O)[O-])c3)cc2Br)no1 742960660 NBXSOFPKWJXKDU-ZDUSSCGKSA-N 461.268 5.151 5 20 JKBD O=C(CSCc1cc(-c2cccs2)on1)Oc1ccc(NC(=O)c2cccc([N+](=O)[O-])c2)cc1 747111158 AAXQGZFSUYOIAZ-UHFFFAOYSA-N 495.538 5.402 5 20 JKBD O=C(C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)OCc1nc2ccccc2o1 748579296 NJZYOSOXJLXJAR-GHRIWEEISA-N 471.494 6.020 5 20 JKBD CCN(C(=O)Cc1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2Br)cc1)c1ccccc1 751092330 COQSYZANDQKCAQ-UHFFFAOYSA-N 482.334 5.205 5 20 JKBD COc1ccc([N+](=O)[O-])cc1NC(=O)c1cc(-c2nc3ccccc3s2)nc2ccccc12 885592350 RGBJHZCGLPBXQA-UHFFFAOYSA-N 456.483 5.681 5 20 JKBD Cc1ccc(S(=O)(=O)Nc2ccc(NC(=S)Nc3cccc(C)c3C)cc2)cc1[N+](=O)[O-] 916119937 AYWPOHUIIJTSSW-UHFFFAOYSA-N 470.576 5.130 5 20 JKBD CCC(=O)Nc1cccc(C(=O)Oc2ccc(NC(=O)c3cc([N+](=O)[O-])ccc3Cl)cc2)c1 916952075 PNZABELKXPNYTF-UHFFFAOYSA-N 467.865 5.068 5 20 JKBD CSc1ccc(C(=O)c2ccccc2C(=O)Nc2cc(N3CCCC3=O)ccc2F)cc1[N+](=O)[O-] 917797573 YZDWVPWTJZULDM-UHFFFAOYSA-N 493.516 5.066 5 20 JKBD CCc1ccc(N(C(C)=O)c2nc(COC(=O)c3cc4cc([N+](=O)[O-])ccc4[nH]3)cs2)cc1 919515830 ACVJLTOUYLERON-UHFFFAOYSA-N 464.503 5.137 5 20 JKBD O=C(O[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Br)c1ccccc1)c1cc(F)ccc1F 919902150 YUXVGNVFWROLHO-LJQANCHMSA-N 491.244 5.172 5 20 JKBD CS(=O)(=O)c1cc(C(=O)Nc2cccc(-c3ccc(Cl)c(Cl)c3)c2)cc([N+](=O)[O-])c1 920280680 JGXHKAWJHZXUAX-UHFFFAOYSA-N 465.314 5.224 5 20 JKBD Cc1ccoc1C(=O)NC1(c2ccc(NC(=O)c3cccc([N+](=O)[O-])c3Br)cc2)CCC1 1790636808 SNZCNZLPIONBOT-UHFFFAOYSA-N 498.333 5.320 5 20 JKBD O=C(CCCCn1cccc1)NC1(c2ccc(NC(=O)c3cc(F)cc([N+](=O)[O-])c3)cc2)CCC1 1790697760 QGSRPRRLVLHNHY-UHFFFAOYSA-N 478.524 5.154 5 20 JKBD CCc1cc(C(=O)NC2(c3ccc(NC(=O)c4cccc(F)c4[N+](=O)[O-])cc3)CCC2)cc(C)n1 1790699018 SYCXJFNVOALWAG-UHFFFAOYSA-N 476.508 5.061 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)c3cc4ccccc4o3)CCC2)cc1)c1cc(O)cc([N+](=O)[O-])c1 1790756141 OHCMMUDFTKFDQN-UHFFFAOYSA-N 471.469 5.108 5 20 JKBD O=C(/C=C/c1ccc([N+](=O)[O-])o1)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc2c(Cl)cccc2s1 1797646527 GHIDWKPLBVPLKC-XTPKAHCJSA-N 485.949 5.021 5 20 JKBD Cc1c(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2c(F)ccc(Cl)c2F)cc(Cl)cc1[N+](=O)[O-] 1803800994 MHNXZZJRVYIXJK-BTTYYORXSA-N 498.313 5.054 5 20 JKBD CC(C)(C)CCCCCC(=O)N1CCCC12CN(C(=O)c1ccc(Br)c([N+](=O)[O-])c1)C2 1846086999 IPOKFRXQPYJTTN-UHFFFAOYSA-N 494.430 5.171 5 20 JKBD C[C@@H](OC(=O)c1ccc(Cl)c(Cl)c1)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 10732013 OIMXAVILIVEGSP-MRVPVSSYSA-N 451.184 5.104 5 20 JKBD O=C1c2ccccc2N[C@@H](c2ccc(Oc3ccc(F)cc3)c([N+](=O)[O-])c2)N1C[C@H]1CCCO1 15503688 HXHFMWFSIUEVIB-NTKDMRAZSA-N 463.465 5.272 5 20 JKBD COc1ccc(NC(=O)c2ccccc2Sc2ccc(C(F)(F)F)cc2[N+](=O)[O-])c(OC)c1 15654559 MQYTVVDRHUPDTC-UHFFFAOYSA-N 478.448 6.034 5 20 JKBD O=C(Cc1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1)N[C@@H]1CCSc2ccccc21 18134435 OYJKJBGVSFCVOY-HSZRJFAPSA-N 470.554 5.343 5 20 JKBD Cc1c(NC(=O)[C@H](C)Sc2nnc(-c3ccccc3F)n2Cc2ccccc2)cccc1[N+](=O)[O-] 21750669 WWRAOWXFPDEMGV-KRWDZBQOSA-N 491.548 5.468 5 20 JKBD Cc1c(C(=O)Nc2sc(-c3ccccc3)c(C)c2C(=O)N2CCCCC2)cccc1[N+](=O)[O-] 21900945 ZBPJWFXTXCPCPF-UHFFFAOYSA-N 463.559 5.819 5 20 JKBD Cc1nc(-c2ccc([C@@H](C)NC(=O)C3CCN(c4ccccc4[N+](=O)[O-])CC3)cc2)cs1 30890371 MZXGZIJHAFPZPA-MRXNPFEDSA-N 450.564 5.121 5 20 JKBD O=C(Cn1c2ccccc2c(=O)c2ccccc21)Nc1ccc(OCc2ccccn2)c(Cl)c1 303053716 JVKDUEBDLZXXGP-UHFFFAOYSA-N 469.928 5.421 5 20 JKBD CCOc1ccc(Oc2ccccc2NC(=O)c2cc(SC)c(OC)cc2[N+](=O)[O-])cc1 482294264 LQSOWJIJIXQPFM-UHFFFAOYSA-N 454.504 5.769 5 20 JKBD COc1ccc(Oc2ccc([N+](=O)[O-])cc2C(=O)N(C)CC(=O)Nc2c(C)cc(C)cc2C)cc1 509092841 FBVZMLPOJPNCAJ-UHFFFAOYSA-N 477.517 5.032 5 20 JKBD CC[C@H]1CCc2sc(-c3nnc(SCc4nnc(-c5ccc([N+](=O)[O-])cc5)o4)n3C)cc2C1 509957771 LHWPXAALOACPTK-ZDUSSCGKSA-N 482.591 5.309 5 20 JKBD Cc1nc(C)c(-c2csc(NC(=O)c3cc([N+](=O)[O-])ccc3Sc3ccccc3)n2)s1 514829862 DBAKIQHCKMZBLQ-UHFFFAOYSA-N 468.585 6.195 5 20 JKBD COc1cc(C(=O)N[C@H](C)c2ccc3c(c2)CC(=O)N3)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 517398180 TVSUKAYLHPRGEK-CYBMUJFWSA-N 481.892 5.035 5 20 JKBD Cc1nc(-c2ccc(CNC(=O)c3ccc(N[C@H](C)c4ccccn4)c([N+](=O)[O-])c3)cc2)cs1 520007747 SZWQETRFFVPPRR-MRXNPFEDSA-N 473.558 5.525 5 20 JKBD COc1ccc([C@H](NC(=O)[C@H](C)Oc2ccc(Cl)cc2[N+](=O)[O-])c2ccc(F)cc2)cc1 520408821 SIBROFCVQVTGRU-RCDICMHDSA-N 458.873 5.069 5 20 JKBD O=[N+]([O-])c1ccc(-c2nn(-c3ccccc3)cc2CN[C@H](c2ccccc2)[C@@H]2CCCO2)cc1 520962177 STOMYOIVCVTPHD-AHKZPQOWSA-N 454.530 5.457 5 20 JKBD COc1ccc(N(Cc2ccc(C(C)C)cc2)C(=O)CCn2nc(C)c([N+](=O)[O-])c2C)cc1 522483348 HXJCWXGWTXTNQC-UHFFFAOYSA-N 450.539 5.164 5 20 JKBD CN(Cc1cnn(C)c1)C(=O)c1c2c(nc3ccccc13)/C(=C\c1cccc([N+](=O)[O-])c1)CCC2 554180026 VAJQCMIEAACDDP-MOSHPQCFSA-N 467.529 5.026 5 20 JKBD CC(C)(C)c1ccc(C(=O)Nc2ccccc2NC(=O)c2cc3c(cc2[N+](=O)[O-])OCO3)cc1 603812864 XMCOUVYMMUIVTK-UHFFFAOYSA-N 461.474 5.126 5 20 JKBD O=C(Nc1cccnc1)c1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2Oc2ccccc2)cc1 604096254 SRMWGXNHQRMCEZ-UHFFFAOYSA-N 454.442 5.287 5 20 JKBD O=C(C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)NC[C@H]1Cc2ccccc21 604249162 XFZSZMNJNKCAJC-QRRJMBGHSA-N 455.539 5.591 5 20 JKBD COc1ccccc1N1CC[C@@H](CNCc2ccc(-c3ccc([N+](=O)[O-])cc3Br)o2)C1 608836903 PVAUTFKIWRPKSA-INIZCTEOSA-N 486.366 5.242 5 20 JKBD Cc1ccc(C(=O)Nc2ccc(OC(=O)Cn3c4ccccc4c(=O)c4ccccc43)cc2)cc1 726959077 GBAHBXNQJBFFII-UHFFFAOYSA-N 462.505 5.321 5 20 JKBD CCN(C(=O)c1cc([N+](=O)[O-])c(C)c([N+](=O)[O-])c1)[C@@H]1CCSc2ccc(Br)cc21 728844670 ABNXKTLSHSPWNX-OAHLLOKOSA-N 480.340 5.273 5 20 JKBD O=C(CCCc1ccc2c(c1)-c1ccccc1C2)OCc1nnc(-c2ccc([N+](=O)[O-])cc2)o1 747499633 FNENRKJMBZCTPX-UHFFFAOYSA-N 455.470 5.282 5 20 JKBD C[C@@H](OC(=O)c1csc(-c2cccc([N+](=O)[O-])c2)n1)c1nc(-c2cccc(C(F)(F)F)c2)no1 747961631 HAMVARWIWYWOQG-LLVKDONJSA-N 490.419 5.705 5 20 JKBD CCOc1ccc(Oc2ccc(Cl)cc2NC(=O)COc2cc(C=O)ccc2[N+](=O)[O-])cc1 748151207 SFCNBIGMZNTIPU-UHFFFAOYSA-N 470.865 5.269 5 20 JKBD O=C(COC(=O)c1c2c(nc3ccccc13)/C(=C/c1ccco1)CC2)c1cccc([N+](=O)[O-])c1 785139007 BPIZSSQBUHHCQU-SAPNQHFASA-N 454.438 5.263 5 20 JKBD Cc1c(C(=O)N(C)Cc2cc([N+](=O)[O-])ccc2Cl)cnn1-c1cccc(C(F)(F)F)c1 912731592 XAVOUKZAPGAQFN-UHFFFAOYSA-N 452.820 5.033 5 20 JKBD COc1ccc(Oc2ccc([N+](=O)[O-])cc2C(=O)O[C@H](C)c2nnc(-c3ccc(C)cc3)o2)cc1 915442095 MESFGLGJJZNUSA-MRXNPFEDSA-N 475.457 5.672 5 20 JKBD O=C(Nc1ccc(OC(=O)c2ccc(-c3ccccc3)nc2O)cc1)c1cc([N+](=O)[O-])ccc1Cl 915811473 VKUSSQJTIOSELW-UHFFFAOYSA-N 489.871 5.487 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Cl)[C@H](c1ccccc1)N1CCC([C@@H](O)c2ccccc2)CC1 917023868 MOPGYXRADQOHRW-DQEYMECFSA-N 479.964 5.374 5 20 JKBD CCc1cc[n+](/C(C(=S)Nc2c(C(C)C)cccc2C(C)C)=C(/O)c2ccc([N+](=O)[O-])cc2)cc1 917611210 XIGRLYQHPFEGSW-UHFFFAOYSA-O 490.649 7.015 5 20 JKBD C[C@@H](OC(=O)c1ccc(Sc2nncn2C)c([N+](=O)[O-])c1)c1ccc(Cl)c(Cl)c1 917959045 WZVKRBLBEQNWSL-SNVBAGLBSA-N 453.307 5.099 5 20 JKBD O=C(COC(=O)c1c(Cl)cc(C(F)(F)F)cc1Cl)Nc1cc([N+](=O)[O-])ccc1Cl 919295166 UQYDWJVIYIXOBF-UHFFFAOYSA-N 471.602 5.369 5 20 JKBD C[C@@H](Nc1ccc(C(=O)N2CCC[C@H]2COc2ccc(Cl)cc2)cc1[N+](=O)[O-])c1ccccn1 919711737 YOJFZDKAWRNOQX-XLIONFOSSA-N 480.952 5.500 5 20 JKBD COc1cccc(-n2c(C)nnc2SCC(=O)OCc2nc3ccccc3c3ccccc23)c1 921276947 RSVSEEAQKMLMCR-UHFFFAOYSA-N 470.554 5.121 5 20 JKBD Cc1c(C(=O)NC2(c3ccc(NC(=O)c4ccc([N+](=O)[O-])o4)cc3)CCC2)[nH]c2c(Cl)cccc12 1785748948 PIRCPABJVBOWAT-UHFFFAOYSA-N 492.919 5.692 5 20 JKBD C[C@@H](Sc1ccccc1)C(=O)NC1(c2ccc(NC(=O)/C=C/c3ccc([N+](=O)[O-])o3)cc2)CCC1 1786205784 QEMTXAZIMIKNBH-QIXNEVBVSA-N 491.569 5.516 5 20 JKBD O=C(NC1(c2ccc(NC(=O)[C@H]3CCCCC3(F)F)cc2)CCC1)c1cc([N+](=O)[O-])cc2c1OCC2 1786466090 OWLUBJVKSMLWPF-OAQYLSRUSA-N 499.514 5.103 5 20 JKBD COc1cc(C(=O)NC2(c3ccc(NC(=O)[C@@H]4CC=C(C)CC4)cc3)CCC2)cc([N+](=O)[O-])c1OC 1789115474 UATDNMQZQZSCOI-GOSISDBHSA-N 493.560 5.106 5 20 JKBD O=C(Cc1ccc([N+](=O)[O-])cc1F)Nc1ccc(C2(NC(=O)c3ccc4ncccc4c3)CCC2)cc1 1791184034 MJDVTULXEGKIBF-UHFFFAOYSA-N 498.514 5.273 5 20 JKBD Cc1csc(C(=O)Nc2cc([C@H]3CCCCN3C(=O)c3cc4cc([N+](=O)[O-])ccc4s3)[nH]n2)c1 1815379384 KCDOWQNNRNOYBO-QGZVFWFLSA-N 495.586 5.522 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2ccc(Cl)s2)n[nH]1 1816399407 VZGNCJUDXCJXBH-OAHLLOKOSA-N 491.932 5.100 5 20 JKBD O=C(Nc1cc([C@H]2CCCCN2C(=O)CCc2cccc([N+](=O)[O-])c2)[nH]n1)c1cc2ccccc2o1 1818628623 YQXVIPFEXCAKKH-OAQYLSRUSA-N 487.516 5.003 5 20 JKBD CC(C)[C@H](C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cccc(F)c2[N+](=O)[O-])n[nH]1)c1ccccc1 1821167213 FRCLYXBNQVQWSQ-GMAHTHKFSA-N 493.539 5.203 5 20 JKBD O=C(Cc1ccc(Cl)cc1[N+](=O)[O-])N1CCC([C@H]2CCCCN2C(=O)CCC2CCCC2)CC1 1826265154 TXBXQPJJNITCDG-HSZRJFAPSA-N 490.044 5.381 5 20 JKBD Cc1ccc([C@@H](C)C(=O)N2CCC([C@H]3CCCCN3C(=O)c3cc(F)cc([N+](=O)[O-])c3)CC2)cc1 1830615430 FASARTVUVSYMDJ-KBMIEXCESA-N 481.568 5.079 5 20 JKBD Cc1ccc(C(=O)N2CCC([C@@H]3CCCCN3C(=O)c3cc(Cl)cc([N+](=O)[O-])c3C)CC2)nc1C 1830734156 AAXCWABMCHQNFA-QHCPKHFHSA-N 499.011 5.116 5 20 JKBD CN(C)c1ccc([N+](=O)[O-])cc1C(=O)N1CCCC[C@@H]1C1CCN(C(=O)/C=C/C2CCCCC2)CC1 1830767033 AMLROQLBTFFPFU-IGQYLQMFSA-N 496.652 5.031 5 20 JKBD COc1cc(C(=O)O[C@H](C(=O)Nc2ccc(C)cc2[N+](=O)[O-])c2ccccc2)ccc1OC(F)F 8853971 HOURAJRQLBPZAT-NRFANRHFSA-N 486.427 5.050 5 20 JKBD CC(C)c1cccc(C(C)C)c1NC(=O)COC(=O)c1ccc(N2CCCC2)c([N+](=O)[O-])c1 10733717 PYLYQWVOLLCIDZ-UHFFFAOYSA-N 453.539 5.237 5 20 JKBD CN(C(=O)CSc1nnc(-c2ccc(Cl)cc2)n1Cc1ccccc1)c1ccc([N+](=O)[O-])cc1 12209486 JEBVJFYKCDOBIF-UHFFFAOYSA-N 493.976 5.310 5 20 JKBD C[C@H]1CCc2[nH]c3ccc(C(=O)OCC(=O)Nc4ccc([N+](=O)[O-])cc4C(F)(F)F)cc3c2C1 28811676 WGFNWVTYXXLUBH-LBPRGKRZSA-N 475.423 5.015 5 20 JKBD O=C(Nc1ccccc1C(=O)NC[C@H](c1ccco1)N1CCCCC1)c1ccc([N+](=O)[O-])cc1Cl 29870035 QCZUHJVVNGYGRB-JOCHJYFZSA-N 496.951 5.051 5 20 JKBD Cc1nn(Cc2ccc(C(=O)Nc3ccc(N4CCCCC4)c(Cl)c3)cc2)c(C)c1[N+](=O)[O-] 108318838 NBBDMRVYRXJTGG-UHFFFAOYSA-N 467.957 5.352 5 20 JKBD CCOc1cc(NC(=O)CCc2ncc(-c3ccc(Cl)cc3Cl)o2)c([N+](=O)[O-])cc1OCC 302948926 MATUUXOFAFRERM-UHFFFAOYSA-N 494.331 5.925 5 20 JKBD COc1cc(C(=O)N[C@@H](CCc2ccccc2)c2ccccc2)c([N+](=O)[O-])cc1OC(F)F 503019458 QGMRFUMKNVEIIR-IBGZPJMESA-N 456.445 5.309 5 20 JKBD C[C@@H](c1nc2ccccc2s1)N(C)C(=O)c1ccc(N[C@H](C)c2ccccn2)c([N+](=O)[O-])c1 504280404 PPYSBUIEPGXFOZ-CVEARBPZSA-N 461.547 5.606 5 20 JKBD CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)NCc1ccc(Cn2cnc3ccccc32)cc1 509431669 ODKMGTPYAWGQHH-UHFFFAOYSA-N 457.534 5.113 5 20 JKBD O=C(NCc1ccco1)c1cccc(CNCc2ccc(Oc3ccccc3Cl)c([N+](=O)[O-])c2)c1 509564205 PCGBKSHPSHLATP-UHFFFAOYSA-N 491.931 5.853 5 20 JKBD Cc1csc(Sc2ccc(C(=O)N(C)c3ccc(Br)cc3F)cc2[N+](=O)[O-])n1 509704366 MUCYFVVNEMVKLU-UHFFFAOYSA-N 482.356 5.689 5 20 JKBD Cc1c(CS(=O)(=O)Cc2csc(-c3ccc(C(F)(F)F)cc3)n2)cccc1[N+](=O)[O-] 515264315 MRCXILDIBALSRH-UHFFFAOYSA-N 456.467 5.161 5 20 JKBD C[C@@H]1CCCN(c2ccc(C(=O)Nc3ccc(F)c(NC(=O)Cc4ccccc4)c3)cc2[N+](=O)[O-])C1 515813912 HCQTWCAULHXBBN-GOSISDBHSA-N 490.535 5.404 5 20 JKBD COC(=O)c1cc(-c2cccc(C(F)(F)F)c2)ccc1NC(=O)c1cc2c(cc1[N+](=O)[O-])OCO2 520031081 QCVCNGYPQAGPHR-UHFFFAOYSA-N 488.374 5.048 5 20 JKBD Cc1ccc(Sc2ccc(CNCc3ccc(CN4CCC(O)CC4)cc3)cc2[N+](=O)[O-])cc1 520960234 UCAKEUNVQUJIGG-UHFFFAOYSA-N 477.630 5.301 5 20 JKBD O=C(c1csc(-c2cccc([N+](=O)[O-])c2)n1)N1CCO[C@@H](c2ccc(Cl)c(Cl)c2)C1 524053746 QXCUQPRHUMIDFX-GOSISDBHSA-N 464.330 5.239 5 20 JKBD Cc1csc(Sc2ccc(C(=O)N3C[C@H]4CCCN4c4ccccc43)cc2[N+](=O)[O-])n1 603739563 BXKSPVCQYHYSNM-MRXNPFEDSA-N 452.561 5.140 5 20 JKBD COc1cc(C(=O)N2CCC(CCc3cccc(C(F)(F)F)c3)CC2)c([N+](=O)[O-])cc1OC 603991562 MONVUYODRXUVKL-UHFFFAOYSA-N 466.456 5.116 5 20 JKBD Cc1csc(Sc2ccc(C(=O)Nc3ccc(C(=O)N4CCCC[C@@H]4C)cc3)cc2[N+](=O)[O-])n1 603993298 QTESKGSZDVHCHO-INIZCTEOSA-N 496.614 5.778 5 20 JKBD C[C@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)Nc1ccc(NC(=O)Nc2ccccc2)cc1 604447367 XUAWVUZFOXECRH-AWEZNQCLSA-N 454.870 5.298 5 20 JKBD Cc1ccc(NC(=O)c2ccc(NC3CCN(C(=O)c4ccc(C)cc4)CC3)c([N+](=O)[O-])c2)cc1 608973125 AQVLKCPZVCKGRI-UHFFFAOYSA-N 472.545 5.181 5 20 JKBD O=C(c1cc([N+](=O)[O-])ccc1Sc1ccccc1)N1CCC(c2nc(-c3ccccc3)no2)CC1 609141565 BGMCPOHLQBELFX-UHFFFAOYSA-N 486.553 5.816 5 20 JKBD Cc1ccc(NC(=O)[C@@H](Sc2nnc(-c3ccccc3)n2C)c2ccccc2)c([N+](=O)[O-])c1 619853367 KSLHQXRFQGYQCM-NRFANRHFSA-N 459.531 5.171 5 20 JKBD Cc1ccc(NC(=O)[C@@H](OC(=O)c2csc(-c3ccccc3C)n2)c2ccccc2)c([N+](=O)[O-])c1 727562292 WNAPWMMPHMHCCU-QHCPKHFHSA-N 487.537 5.872 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])c(Cl)c1)c1cnn(-c2cccc(C(F)(F)F)c2)c1C1CC1 727709974 AUWBQCIWVIUTEG-UHFFFAOYSA-N 450.804 5.582 5 20 JKBD Cc1cc(OCc2cccc(Cl)c2)ccc1N[C@@H](C)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 728064798 GBKVQYKXFUJCEC-INIZCTEOSA-N 464.909 6.359 5 20 JKBD CC(=O)N(c1ccc(C)c(C)c1)c1nc(/C=C2\N=C(c3ccc(Cl)c([N+](=O)[O-])c3)OC2=O)cs1 812447962 UFJWWCGSXYQYII-GRSHGNNSSA-N 496.932 5.351 5 20 JKBD Cc1noc(C)c1CN(C)C(=O)c1ccccc1Sc1ccc(C(F)(F)F)cc1[N+](=O)[O-] 915195209 NFHBOSUHFUVYLP-UHFFFAOYSA-N 465.453 5.642 5 20 JKBD COc1ccc(/C=C2/N=C(SCCc3ccc([N+](=O)[O-])cc3)N(c3cccc(OC)c3)C2=O)cc1 915791777 XRLCEJHVQAFXND-LFVJCYFKSA-N 489.553 5.332 5 20 JKBD COc1ccc(NC(=O)OC(C)(C)C)c(NC(=O)Cn2c3ccccc3c(=O)c3ccccc32)c1 915874331 UKBKQFXGOIPJKK-UHFFFAOYSA-N 473.529 5.149 5 20 JKBD C[C@H](NC(=O)C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)c1cccc([N+](=O)[O-])c1 917700453 HULVEULKONPYBP-UEIJICEPSA-N 488.525 5.921 5 20 JKBD CN(Cc1ccccc1[N+](=O)[O-])C(=O)C(=O)Nc1cccc(-c2ccc(Cl)c(Cl)c2)c1 918440191 RQUKHLOQJSYHPS-UHFFFAOYSA-N 458.301 5.166 5 20 JKBD Cc1c(COC(=O)CSc2nnc(-c3ccc(Cl)cc3)n2Cc2ccco2)cccc1[N+](=O)[O-] 919044328 NSAQWBNNCMJAGF-UHFFFAOYSA-N 498.948 5.292 5 20 JKBD Cc1nn(C(C)(C)C)c2nc(C3CC3)cc(C(=O)O[C@H](C)C(=O)Nc3cc([N+](=O)[O-])ccc3Cl)c12 919195345 UZAQTLMKTZATEA-CYBMUJFWSA-N 499.955 5.118 5 20 JKBD Cc1cc(-c2ccccc2)ccc1NC(=O)c1ccc(N[C@@H](C)c2ccccn2)c([N+](=O)[O-])c1 919713658 XABCGCNBZCQCMI-IBGZPJMESA-N 452.514 6.391 5 20 JKBD Cc1ccc2cc(C(=O)Nc3ccc(C4(NC(=O)/C=C/c5ccc([N+](=O)[O-])o5)CCC4)cc3)ccc2n1 1789030321 KOUNNTRXBKVYQY-JLHYYAGUSA-N 496.523 5.506 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)c3cc(O)cc([N+](=O)[O-])c3)CCC2)cc1)c1ccc2occc2c1 1789049291 LERZSCNLEDPBJD-UHFFFAOYSA-N 471.469 5.108 5 20 JKBD Cc1occc1C(=O)NC1(c2ccc(NC(=O)c3ccc(Br)c([N+](=O)[O-])c3)cc2)CCC1 1790642429 VYAVDXKCBURLIC-UHFFFAOYSA-N 498.333 5.320 5 20 JKBD CC[C@H](C)[C@H](C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CSc1ccccc1[N+](=O)[O-])c1ccccc1 1802183271 PPZLZUDFMNEIDO-JHWNQOIGSA-N 495.645 5.155 5 20 JKBD Cc1cccc(C(=O)N2CCC([C@H]3CCCCN3C(=O)Cc3ccc(Cl)cc3[N+](=O)[O-])CC2)c1 1824160274 AVPFMNVPMDYVFA-HSZRJFAPSA-N 483.996 5.033 5 20 JKBD Cc1cccc(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3cc4cc([N+](=O)[O-])ccc4s3)CC2)n1 1825851643 XBYOSXIXMPUNGN-JOCHJYFZSA-N 492.601 5.060 5 20 JKBD O=C(CCc1ncc(-c2ccccc2F)o1)Oc1ccc(NC(=O)c2cccc([N+](=O)[O-])c2)cc1 12832688 CPSVMQQEIYSMOU-UHFFFAOYSA-N 475.432 5.179 5 20 JKBD Cc1ccc(C)c(NC(=O)[C@@H](C)Oc2ccc3c(-c4ccc([N+](=O)[O-])cc4)cc(=O)oc3c2)c1 15370789 JFTSLAANKUGCAG-QGZVFWFLSA-N 458.470 5.391 5 20 JKBD C[C@@H](OC(=O)COc1cc(Cl)c(Cl)cc1Cl)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 17531211 ZDRDNHGWKXJBIF-SECBINFHSA-N 472.668 5.288 5 20 JKBD CCn1c(S[C@H](C)C(=O)NCc2ccccc2Cl)nc2cc3ccccc3cc2c1=O 18467488 HBQZYKJAMPYJPP-OAHLLOKOSA-N 451.979 5.020 5 20 JKBD C[C@H](OC(=O)c1cc2cc(Cl)ccc2o1)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 18751146 LUAZZRBZVQMWGK-VIFPVBQESA-N 456.760 5.197 5 20 JKBD Cc1c(NC(=O)[C@H](C)Sc2nnc(-c3ccccc3Cl)n2C2CCCC2)cccc1[N+](=O)[O-] 21722696 LNIPDSPOIDQAPR-HNNXBMFYSA-N 485.997 6.050 5 20 JKBD COc1cc([N+](=O)[O-])ccc1NC(=O)CSc1ncnc2scc(-c3ccc(F)cc3)c12 21727869 JKTYDIGSFYOWIU-UHFFFAOYSA-N 470.507 5.145 5 20 JKBD C[C@@H](N[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Br)c1ccccc1)c1ccc2c(c1)OCO2 30500866 ZLGHDGIKWHTPBB-JLCFBVMHSA-N 498.333 5.117 5 20 JKBD Cc1ccc(Sc2ccc(C(=O)Nc3cc4c(cc3F)CCC(=O)N4)cc2[N+](=O)[O-])cc1 33217899 XOJDGWURHJLXEL-UHFFFAOYSA-N 451.479 5.331 5 20 JKBD O=C(Nc1ccccc1C(=O)Nc1cccc(C(F)(F)F)c1)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1 72039038 RRMKZBQCOLWFAN-UHFFFAOYSA-N 474.351 5.026 5 20 JKBD Cc1ccc2nc(-c3ccc(NC(=O)c4ccc(-n5cncn5)c([N+](=O)[O-])c4)cc3)sc2c1 104851722 XEHCKDHSMVCRKX-UHFFFAOYSA-N 456.487 5.013 5 20 JKBD Cc1nn(Cc2ccc(C(=O)Nc3ncccc3OCC3CCCCC3)cc2)c(C)c1[N+](=O)[O-] 109900094 JGLFGCOGBJSBAU-UHFFFAOYSA-N 463.538 5.063 5 20 JKBD Cc1onc(-c2c(Cl)cccc2Cl)c1C(=O)Nc1nc(-c2cccc([N+](=O)[O-])c2)c(C)s1 195704261 YDQZZVWXCSQHEH-UHFFFAOYSA-N 489.340 6.549 5 20 JKBD O=C(c1csc(-c2cccc([N+](=O)[O-])c2)n1)N1CCc2sccc2[C@H]1c1cccs1 215709532 FXWDYQXLVJVHRL-IBGZPJMESA-N 453.570 5.629 5 20 JKBD Cn1c(SCC(=O)Nc2ccc([N+](=O)[O-])cc2C(F)(F)F)nnc1-c1ccc(C(C)(C)C)cc1 248155633 DHIBSJYZAAMMEW-UHFFFAOYSA-N 493.511 5.437 5 20 JKBD O=C(C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)N1CC[C@H](c2ccccc2F)C1 410290406 RLRVCLAGXROKNR-RVPSJEOCSA-N 487.556 6.290 5 20 JKBD CS(=O)(=O)Cc1cccc(NC(=O)c2cc([N+](=O)[O-])ccc2Sc2ccc(Cl)cc2)c1 478421045 YQXWGKVYMBMDHB-UHFFFAOYSA-N 476.963 5.196 5 20 JKBD O=C(c1csc(-c2ccc([N+](=O)[O-])cc2)n1)N1CCCN(Cc2ccc(C(F)(F)F)cc2)CC1 496438294 RFSNYRYHYHRMCI-UHFFFAOYSA-N 490.507 5.085 5 20 JKBD COc1cc(CNCc2ccc(Oc3ccc(Oc4ccccc4)cc3)nc2)c([N+](=O)[O-])cc1O 509601086 KVNBVTGOIXKFKE-UHFFFAOYSA-N 473.485 5.578 5 20 JKBD O=[N+]([O-])c1cc(Cl)ccc1Oc1ccc(CNC2CCN(Cc3ccccn3)CC2)cc1 512842485 ZHYWMYPCZVMORF-UHFFFAOYSA-N 452.942 5.190 5 20 JKBD C[C@H](c1ccccc1)n1c(SCC(=O)N2CCc3ccc([N+](=O)[O-])cc32)nnc1-c1ccccc1 515572460 CJIVKOQLHHIAQG-GOSISDBHSA-N 485.569 5.144 5 20 JKBD O=C(Nc1cccc(COCCOc2ccccc2)c1)c1ccc(N2CCCC2)c([N+](=O)[O-])c1 515824484 RUPZTFOEMLEGGE-UHFFFAOYSA-N 461.518 5.043 5 20 JKBD Cc1nc(SCC(=O)N(Cc2ccccc2[N+](=O)[O-])CC(F)(F)F)c2c(C)c(C)sc2n1 517426484 OFXZJDHITMGIGS-UHFFFAOYSA-N 484.525 5.208 5 20 JKBD Cc1ccc(NC(=O)c2ccc(N[C@@H](C)c3ccccn3)c([N+](=O)[O-])c2)cc1NC(=O)c1ccncc1 519173406 HFXNGVVWCJJOAK-SFHVURJKSA-N 496.527 5.371 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Br)[C@@H](NC[C@@H]1CCOc2ccccc21)c1ccccc1 519490723 OLJOBCNGTQNNGF-SBUREZEXSA-N 496.361 5.193 5 20 JKBD C[C@H](NCc1ccc(-c2ccc([N+](=O)[O-])cc2)o1)c1cc2c(cc1Br)OCCO2 520205340 MTSALXFDYSYLNY-ZDUSSCGKSA-N 459.296 5.239 5 20 JKBD COc1cc([C@H](C)Nc2ccc(C(=O)c3nccn3C)cc2[N+](=O)[O-])ccc1OC1CCCC1 520869450 CPAOZNBZROWSEH-INIZCTEOSA-N 464.522 5.062 5 20 JKBD CCCC(=O)NC[C@H]1CCCN(C(=O)c2ccc(Sc3nc4ccccc4s3)c([N+](=O)[O-])c2)C1 523170883 HGKPMMFWWUCIDP-MRXNPFEDSA-N 498.630 5.124 5 20 JKBD C[C@H](NC(C)(C)CNC(=O)c1ccc(N[C@@H](C)c2ccccn2)c([N+](=O)[O-])c1)c1ccccc1 552344039 UJQZRIGBHYTPQY-OALUTQOASA-N 461.566 5.022 5 20 JKBD O=C(Cn1c2ccccc2c(=O)c2ccccc21)N[C@@H]1CCCc2nc(-c3ccc(F)cc3)sc21 591271790 RJOKKHQBXIBELS-OAQYLSRUSA-N 483.568 5.611 5 20 JKBD NC(=O)c1cccc(NC(=O)c2ccccc2Sc2ccc(C(F)(F)F)cc2[N+](=O)[O-])c1 603451867 LIMSEKGOUVWYBS-UHFFFAOYSA-N 461.421 5.116 5 20 JKBD CCOC1CCN(C(=O)c2c3c(nc4ccccc24)/C(=C/c2ccc([N+](=O)[O-])cc2)CCC3)CC1 604255730 GDFSBYDGMCRVOR-CZIZESTLSA-N 471.557 5.661 5 20 JKBD COc1cc(CNCC2(c3ccc(F)cc3)CCOCC2)ccc1OCc1ccc([N+](=O)[O-])cc1 604417955 WMNHKUYYKDJALX-UHFFFAOYSA-N 480.536 5.160 5 20 JKBD Cc1ccc(NC(=O)c2ccc(N[C@@H](C)c3ccc(NC(=O)NC4CC4)cc3)c([N+](=O)[O-])c2)cc1 608973111 ZTCNQYOIVUXFBB-KRWDZBQOSA-N 473.533 5.613 5 20 JKBD CCc1cccc[n+]1/C(C(=S)Nc1ccccc1-c1ccccc1)=C(/O)c1cccc([N+](=O)[O-])c1 725763722 KWNHVKXHPAFICT-UHFFFAOYSA-O 482.585 6.435 5 20 JKBD Cc1ccc(F)c(C(=O)O[C@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Br)c2ccccc2)c1 727214024 DXFORDWHXRSCQS-FQEVSTJZSA-N 487.281 5.342 5 20 JKBD O=C(Nc1ccc(SCc2cccnc2)cc1)c1ccc(I)c([N+](=O)[O-])c1 727748368 QMWRYMUHZKUQPP-UHFFFAOYSA-N 491.310 5.139 5 20 JKBD O=C(Cn1c2ccccc2c(=O)c2ccccc21)Oc1ccc(NC(=O)c2ccsc2)cc1 728887030 QBXBZRLRAFEORI-UHFFFAOYSA-N 454.507 5.074 5 20 JKBD CC(C)(C)OC(=O)Nc1ccc(NC(=O)c2ccc(C(C)(C)C)c([N+](=O)[O-])c2)c(C(F)(F)F)c1 729655206 IQRNGMMOKLEAKU-UHFFFAOYSA-N 481.471 6.510 5 20 JKBD C[C@H](Nc1ccc(OCc2ccccc2F)cc1)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 747458717 SEYMPYHGGCNSAM-AWEZNQCLSA-N 477.414 5.771 5 20 JKBD C[C@H](OC(=O)c1csc(-c2cccc([N+](=O)[O-])c2)n1)C(=O)Nc1cccc(Cl)c1Cl 747964241 WDAJRBLALXACHO-JTQLQIEISA-N 466.302 5.209 5 20 JKBD O=C(c1ccc(Cl)c([N+](=O)[O-])c1)N(Cc1ccccn1)Cc1ccc(Br)cc1F 748639054 RQDJZYRIYFZFJJ-UHFFFAOYSA-N 478.705 5.387 5 20 JKBD COc1ccc(-c2nnc(Sc3ccc([N+](=O)[O-])cc3[N+](=O)[O-])n2C2CCCCC2)cc1OC 799718993 QYNRBMRBFSAQEB-UHFFFAOYSA-N 485.522 5.435 5 20 JKBD CC(C)Cn1c(-c2ccco2)nn(CN(Cc2ccccc2[N+](=O)[O-])CC(F)(F)F)c1=S 917450098 IOIZLOXTZVUKEA-UHFFFAOYSA-N 469.489 5.260 5 20 JKBD COC(=O)Nc1cccc(N[C@@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Br)c2ccccc2)c1 917938239 IWBSPFCAYNUNHY-HXUWFJFHSA-N 499.321 5.328 5 20 JKBD O=C(Nc1ccccc1C(=O)Nc1ccc(N2CCCC2)c(F)c1)c1ccc([N+](=O)[O-])cc1Cl 918652515 CRCJTIXMWTXOOH-UHFFFAOYSA-N 482.899 5.492 5 20 JKBD C[C@@H](Nc1ccc(C(=O)Oc2cccc(C(=O)NCc3ccccc3)c2)cc1[N+](=O)[O-])c1ccccn1 919680286 MSGNAQXYWLECEN-LJQANCHMSA-N 496.523 5.312 5 20 JKBD C[C@H](OC(=O)c1csc(-c2ccc(Cl)s2)n1)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl 920674681 DXDGRQVTWKBNJL-QMMMGPOBSA-N 472.331 5.271 5 20 JKBD CC[C@H]1CC[C@H](C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cc4cc([N+](=O)[O-])ccc4s2)C3)CC1 1802026508 QPWKLIRZOPXQND-FWIIZBITSA-N 469.607 5.278 5 20 JKBD Cc1ccc(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)c3cc(F)cc([N+](=O)[O-])c3)n[nH]2)c(Cl)c1 1821166799 FACPRTBRAFMCEE-HXUWFJFHSA-N 485.903 5.039 5 20 JKBD O=C(c1cc2cc([N+](=O)[O-])ccc2s1)N1CCC([C@@H]2CCCCN2C(=O)[C@@H]2C[C@H]2C2CC2)CC1 1824073347 GKTIQHNINOMBNC-BDTNDASRSA-N 481.618 5.089 5 20 JKBD Cc1cc(Cl)cc(C(=O)N2CCCC[C@H]2C2CCN(C(=O)c3ccc([N+](=O)[O-])cc3F)CC2)c1 1832609461 DMMXPMCGHXQUHA-QHCPKHFHSA-N 487.959 5.243 5 20 JKBD CCn1c(Cc2ccccc2)nnc1S[C@@H](C)C(=O)Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1 9629264 PVJFCSJSJXGSNR-HNNXBMFYSA-N 494.602 5.040 5 20 JKBD Cc1cccc(-n2c(S[C@@H](C)c3nnc(-c4ccc([N+](=O)[O-])cc4)o3)nc3ccccc3c2=O)c1C 17533577 MISSLLJDXGJVFZ-KRWDZBQOSA-N 499.552 5.814 5 20 JKBD CCOc1cc(C(=O)Nc2cc(Cl)ccc2Oc2ccc(OC)cc2)c([N+](=O)[O-])cc1OC 26769925 KWKURSOFQWPNIT-UHFFFAOYSA-N 472.881 5.709 5 20 JKBD CCOc1cc(C(=O)O[C@H](C)C(=O)N2c3ccccc3Sc3ccccc32)c([N+](=O)[O-])cc1OC 27008487 SJRLRUWRVDMUTE-OAHLLOKOSA-N 494.525 5.377 5 20 JKBD C[C@@H](NC(=O)c1cc([N+](=O)[O-])ccc1Sc1ccccc1)c1ccc(NC(=O)C2CC2)cc1 27299866 UNQADPAGJJRJAP-MRXNPFEDSA-N 461.543 5.586 5 20 JKBD NC(=O)c1cc(NC(=O)c2cc([N+](=O)[O-])ccc2Sc2ccc(Cl)cc2)ccc1Cl 29339079 FAXVNGIEXODRGZ-UHFFFAOYSA-N 462.314 5.404 5 20 JKBD Cc1ccc(S(=O)(=O)Nc2ccc(C(=O)Nc3ccccc3C(C)C)cc2)cc1[N+](=O)[O-] 58592073 SQJXLSUVUZXAAO-UHFFFAOYSA-N 453.520 5.080 5 20 JKBD Cc1cccn2cc(-c3ccc(NC(=O)Cn4c5ccccc5c(=O)c5ccccc54)cc3)nc12 59020178 BBQIMROBLOOQQI-UHFFFAOYSA-N 458.521 5.417 5 20 JKBD CC[C@@H](NC(=O)c1ccc(N[C@@H](C)c2ccccn2)c([N+](=O)[O-])c1)c1nc(-c2ccccc2)c[nH]1 109422209 YBCOOWPYFNDTBJ-FXAWDEMLSA-N 470.533 5.434 5 20 JKBD C[C@@H](Nc1ccc(C(=O)Nc2ccc(OCc3ccccc3)cc2)cc1[N+](=O)[O-])c1ccccn1 115700039 IHZZVFYKCNAGKB-LJQANCHMSA-N 468.513 5.994 5 20 JKBD C[C@@H](Nc1ccc(C(=O)N[C@H]2CCCc3cc(OC(F)F)ccc32)cc1[N+](=O)[O-])c1ccccn1 302973698 IZXXXECEDVWYTI-VFNWGFHPSA-N 482.487 5.572 5 20 JKBD CCCCN(C(=O)CCn1cc([N+](=O)[O-])nc1C)c1nc(-c2ccc(Cl)cc2Cl)cs1 488242241 OTTSESXTXOVSDM-UHFFFAOYSA-N 482.393 5.753 5 20 JKBD C[C@H](Nc1ccc(C(=O)Nc2cc(Cl)ccc2N2CCSCC2)cc1[N+](=O)[O-])c1ccccn1 499512640 YBKPVECVCHNQAM-INIZCTEOSA-N 498.008 5.622 5 20 JKBD Cc1ccccc1[C@@H]1CCN(C(=O)C2CCN(c3ccc(C(F)(F)F)cc3[N+](=O)[O-])CC2)C1 504931977 YIELUJXSSIKNLE-GOSISDBHSA-N 461.484 5.155 5 20 JKBD CN(C[C@H]1OCCc2ccccc21)[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1 507258582 CQXNCBLLEPPJPL-RPWUZVMVSA-N 465.937 5.174 5 20 JKBD COc1ccc(-n2c(S[C@H](C)C(=O)Nc3cccc([N+](=O)[O-])c3C)nnc2-c2ccccc2)cc1 514955277 ORBHEXZGBQTLMK-QGZVFWFLSA-N 489.557 5.279 5 20 JKBD O=C(NC[C@@H]1CCCOC1)c1c2c(nc3ccccc13)/C(=C\c1ccc([N+](=O)[O-])cc1)CCC2 604013761 VRFGXWDYKHGTTO-RVPSJEOCSA-N 457.530 5.176 5 20 JKBD CSc1ccc([N+](=O)[O-])c(C(=O)N2CCC[C@@H](c3nc(-c4ccc(Cl)cc4)no3)C2)c1 608800496 MXFTUEMDDFOFAX-CQSZACIVSA-N 458.927 5.040 5 20 JKBD O=[N+]([O-])c1ccc(-c2ccc(CNCc3ccc(OCc4ccccn4)cc3)o2)c(Br)c1 608836048 GANPZGBPRYFFDE-UHFFFAOYSA-N 494.345 5.881 5 20 JKBD O=[N+]([O-])c1ccc(-c2nn(-c3ccccc3)cc2CNCc2nn(-c3ccccc3)c3c2CCC3)cc1 608836049 GARCCOVPCXUFDG-UHFFFAOYSA-N 490.567 5.412 5 20 JKBD O=C(CCCn1c(=O)oc2cc([N+](=O)[O-])ccc21)N1CCCC[C@@H]1c1ccc(C(F)(F)F)cc1 608851057 JRMBBWMZBOKNCY-GOSISDBHSA-N 477.439 5.056 5 20 JKBD O=C(Nc1ccccc1C(=O)Nc1ccc(Cl)cn1)c1csc(-c2cccc([N+](=O)[O-])c2)n1 726530800 XYGPBGJGGQLHJP-UHFFFAOYSA-N 479.905 5.271 5 20 JKBD COc1ccc([C@H](NC(=O)c2cc([N+](=O)[O-])ccc2F)c2ccccc2)cc1Br 728497849 FDKNKIIJYLHAHC-HXUWFJFHSA-N 459.271 5.024 5 20 JKBD Cc1csc(SCc2ccccc2C(=O)OCC2CCN(c3ncccc3[N+](=O)[O-])CC2)n1 729191910 FAPVKXRGVAPDHM-UHFFFAOYSA-N 484.603 5.120 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Cl)[C@@H](c1ccccc1)N1CCC([C@@H](O)c2ccc(F)cc2)CC1 731037821 LKNMBTLHOLICOO-RPBOFIJWSA-N 497.954 5.513 5 20 JKBD C[C@H](OC(=O)c1csc(-c2cccc([N+](=O)[O-])c2)n1)C(=O)Nc1ccccc1-c1ccccc1 747962036 FDLHGFHWPXWDTR-INIZCTEOSA-N 473.510 5.569 5 20 JKBD C[C@H]1CCC[C@H](C)N1C(=O)c1cc(Cl)ccc1NC(=O)c1cc([N+](=O)[O-])ccc1Br 751080939 MZOPVSQYYDZNGR-STQMWFEESA-N 494.773 5.666 5 20 JKBD C[C@H](OC(=O)C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)C(=O)N1CCCCC1 804860875 REWOHKUXRGTBRB-BYFYWULKSA-N 479.558 5.079 5 20 JKBD CSc1ccc([N+](=O)[O-])c(C(=O)O[C@@H](C)C(=O)N2c3ccccc3Sc3ccccc32)c1 857840332 NTHFVSSOTUWEHS-AWEZNQCLSA-N 466.540 5.692 5 20 JKBD C[C@H](Nc1ccc(-c2nc(-c3sccc3Br)no2)cc1[N+](=O)[O-])c1ccccn1 904889943 NEKLWISKQGABEW-NSHDSACASA-N 472.324 5.704 5 20 JKBD CCCOc1c(Br)cc(/C=C/c2ccnc(-c3cccc([N+](=O)[O-])c3)[n+]2[O-])cc1OC 915988202 RZHSQFOMILJPGJ-BQYQJAHWSA-N 486.322 5.021 5 20 JKBD O=C(NCc1nc(C2CC2)no1)c1c2c(nc3ccccc13)/C(=C\c1ccc([N+](=O)[O-])cc1)CCC2 917765312 CUFHMBGWCBNVFM-JXAWBTAJSA-N 481.512 5.210 5 20 JKBD CC(C)Oc1nnc(S[C@@H](C(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)c2ccccc2)s1 918750799 UPHJBCSJSQFKOS-MRXNPFEDSA-N 464.956 5.359 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)[C@H]3C[C@@H]3c3ccc(Cl)cc3)CCC2)cc1)c1ccc([N+](=O)[O-])o1 1785750262 AVJGVTIFSRPQSZ-UXHICEINSA-N 479.920 5.393 5 20 JKBD Cc1c(C(=O)NC2(c3ccc(NC(=O)C(C)(F)F)cc3)CCC2)cc(Br)cc1[N+](=O)[O-] 1787933787 BMVZMEXZQIIYTQ-UHFFFAOYSA-N 496.308 5.069 5 20 JKBD Cc1ncc(C(=O)Nc2ccc(C3(NC(=O)c4cc5cc([N+](=O)[O-])ccc5s4)CCC3)cc2)s1 1788868000 VLADXIMIGJHFKZ-UHFFFAOYSA-N 492.582 5.636 5 20 JKBD COc1cc(C(=O)Nc2ccc(C3(NC(=O)c4ccc(Cl)cc4)CCC3)cc2)c([N+](=O)[O-])cc1O 1790084296 MIFYSCXLUPYWGQ-UHFFFAOYSA-N 495.919 5.024 5 20 JKBD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2ccc([N+](=O)[O-])[nH]2)[nH]n1)c1cc2c(Cl)cccc2s1 1818775258 STSVQUXTBMPGLD-INIZCTEOSA-N 498.952 5.134 5 20 JKBD O=C(CCc1ccccc1Cl)N1CCC([C@H]2CCCCN2C(=O)/C=C/c2ccc([N+](=O)[O-])o2)CC1 1824275864 GZAFGUQIMZNLSF-JYLQPTBZSA-N 499.995 5.107 5 20 JKBD Cc1ccc(SCC(=O)N2CCCC[C@H]2C2CCN(C(=O)c3cc(F)cc([N+](=O)[O-])c3)CC2)cc1 1828345244 VXZQDSNZVMGMAO-DEOSSOPVSA-N 499.608 5.068 5 20 JKBD CC1=CC[C@H](C(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3cc4cc([N+](=O)[O-])ccc4s3)CC2)CC1 1828352273 KBSVVBZTEQLWEW-NZQKXSOJSA-N 495.645 5.789 5 20 JKBD O=C(/C=C/c1ccccc1[N+](=O)[O-])N1CCC([C@@H]2CCCCN2C(=O)c2ccc(Cl)cc2)CC1 1830029373 SAMGHFXKBUQBHP-YYVWFHOOSA-N 481.980 5.195 5 20 JKBD C[C@@H](CC(=O)N1CCC([C@@H]2CCCCN2C(=O)Cc2cc(F)ccc2[N+](=O)[O-])CC1)c1ccccc1 1832888066 BSMLXWKBMILRQK-CPJSRVTESA-N 495.595 5.090 5 20 JKBD C[C@H](Sc1nnc(-c2ccc(Br)cc2)o1)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl 8758642 NNDBXEDAKMFZBU-VIFPVBQESA-N 483.731 5.180 5 20 JKBD C[C@H](Sc1nnc(-c2ccccc2F)n1Cc1ccccc1)C(=O)Nc1ccc(F)c([N+](=O)[O-])c1 9331043 BXTWQXJXFNYSQX-HNNXBMFYSA-N 495.511 5.299 5 20 JKBD CCOC(=O)Nc1ccc2c(CSc3nc4ccc([N+](=O)[O-])cc4s3)cc(=O)oc2c1 10592734 RJEUFOSUTGPKHB-UHFFFAOYSA-N 457.489 5.172 5 20 JKBD CCOc1cc(NC(=O)c2ccccc2)c(OCC)cc1NC(=O)Nc1cccc([N+](=O)[O-])c1 18179532 ZCXXQXCNRIWEIB-UHFFFAOYSA-N 464.478 5.289 5 20 JKBD C[C@@H](OC(=O)c1csc(-c2ccc(F)cc2)n1)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 19617223 ZBQBSWFURAGRDW-SNVBAGLBSA-N 483.399 5.060 5 20 JKBD COc1ccc(-c2cc(C(=O)O[C@@H](C)C(=O)Nc3cccc([N+](=O)[O-])c3C)sc2C)cc1 22295592 JWLHQNAVNNHOQU-AWEZNQCLSA-N 454.504 5.133 5 20 JKBD Cc1ccc(NC(=O)[C@@H](Sc2nc3sc(C)c(C)c3c(=O)n2C)c2ccccc2)c([N+](=O)[O-])c1 25023981 LYILGVQIISPMAQ-FQEVSTJZSA-N 494.598 5.301 5 20 JKBD O=C(NCc1ccc(C(=O)N2CCCCC2)cc1)c1cc([N+](=O)[O-])ccc1Sc1ccccc1 26551061 PHMWSYGLSYMSGI-UHFFFAOYSA-N 475.570 5.302 5 20 JKBD C[C@H](CN1CCCCC1)NC(=O)C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1 27764346 AVMMSDAYYJIGQR-CTBJKRMSSA-N 464.591 5.126 5 20 JKBD CCc1ccc(-n2c(SCc3nnc(-c4ccc([N+](=O)[O-])cc4)o3)nc3ccccc3c2=O)cc1 28614718 SGGXSEGSIIACBX-UHFFFAOYSA-N 485.525 5.199 5 20 JKBD CN(Cc1nccn1C(F)F)C(=O)C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1 29183815 KRAPEHJHTXZTGQ-VBKFSLOCSA-N 483.500 5.385 5 20 JKBD CCOCc1ccccc1CNC(=O)C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1 30508171 UCNWLPXUAJAYHH-JCMHNJIXSA-N 487.581 5.988 5 20 JKBD O=C(Cn1c2ccccc2c(=O)c2ccccc21)Nc1ccc(CN2CCc3ccccc32)cc1 72086822 GDJHWSSPSCIIMI-UHFFFAOYSA-N 459.549 5.356 5 20 JKBD CCCNC(=O)c1cccc(NC(=O)c2ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])cc2)c1 478342544 NKSWQHJTSPHIKF-UHFFFAOYSA-N 453.882 5.433 5 20 JKBD Cc1ccccc1N(C(=O)c1nn(-c2ccccc2[N+](=O)[O-])c(C)cc1=O)c1nc2ccccc2s1 492304467 HHCDVQZHAGYEML-UHFFFAOYSA-N 497.536 5.346 5 20 JKBD CSc1ccc([N+](=O)[O-])c(C(=O)Nc2ccc(=O)n(Cc3ccc(Cl)c(Cl)c3)c2)c1 499023972 QTTOFPNNAKOIJB-UHFFFAOYSA-N 464.330 5.086 5 20 JKBD CCOc1cc2c(cc1[C@@H]1C[C@@H]1NC(=O)CSc1ccc(C(F)(F)F)cc1[N+](=O)[O-])O[C@H](C)C2 504499986 UUWUWDJPUUAVQO-PVUWLOKVSA-N 496.507 5.100 5 20 JKBD O=C(NC1CC1)c1ccc(NCc2ccccc2-c2ccc(Cn3ccnc3)cc2)c([N+](=O)[O-])c1 505616539 ZYORQBWMNYLIOZ-UHFFFAOYSA-N 467.529 5.011 5 20 JKBD CCOc1cc(Br)c(NC(=O)[C@@H](C)Sc2ccc([N+](=O)[O-])cc2)cc1OCC 508053381 ISCAPTMVXZAYRY-GFCCVEGCSA-N 469.357 5.274 5 20 JKBD CC[C@H](NC(=O)c1cc(OC)c(OCc2cscn2)cc1[N+](=O)[O-])c1ccc(Cl)cc1 512309739 NPVPZCWUVVCNFA-KRWDZBQOSA-N 461.927 5.173 5 20 JKBD C[C@H]1CCC[C@@H](C)N1C(=O)c1cc(Cl)ccc1NC(=O)c1ccc(-n2ccnc2)c([N+](=O)[O-])c1 512340147 GGPNURIZYIAESA-IYBDPMFKSA-N 481.940 5.089 5 20 JKBD COc1ccc(Oc2ccc([N+](=O)[O-])cc2C(=O)Nc2ccc(NC(=O)c3cnoc3C)cc2)cc1 512565212 OTABHXKHIIKRHL-UHFFFAOYSA-N 488.456 5.197 5 20 JKBD COc1ccc(CSCC(=O)N2CCc3sccc3[C@H]2c2cccs2)cc1[N+](=O)[O-] 514901886 OQWJZUOKYRCSTF-NRFANRHFSA-N 460.602 5.134 5 20 JKBD Cc1cccc([N+](=O)[O-])c1NC(=O)CSc1nnc(-c2ccco2)n1[C@H](C)[C@H]1C[C@H]2CC[C@H]1C2 515308969 LBESZUOHDVZAGO-VSZNYVQBSA-N 481.578 5.483 5 20 JKBD C[C@@H](Nc1ccc(C(=O)Nc2ccc(-c3nnc4n3CCCC4)cc2)cc1[N+](=O)[O-])c1ccccn1 518229762 VVGSOEGASNJMQU-QGZVFWFLSA-N 483.532 5.010 5 20 JKBD C[C@@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)NCc1ccc(-c2nc3ccccc3s2)o1 520388932 NKZFFXSJGMVQGG-GFCCVEGCSA-N 457.895 5.202 5 20 JKBD Cc1cc(NC(=O)c2ccc(Cn3nc(C)c([N+](=O)[O-])c3C)cc2)n(-c2ccccc2C(F)(F)F)n1 585715778 KJVJBVIEPJBGMI-UHFFFAOYSA-N 498.465 5.222 5 20 JKBD CCOc1cc(NC(=O)c2cnn(-c3ccc(C)c(Cl)c3)c2C2CC2)c([N+](=O)[O-])cc1OCC 603566449 XQSJDUUJTJBJHM-UHFFFAOYSA-N 484.940 5.669 5 20 JKBD O=C(c1c2c(nc3ccccc13)/C(=C/c1cccs1)CC2)N1CCN(c2ccc([N+](=O)[O-])nc2)CC1 603571463 POGOVBOEPOSHON-FBMGVBCBSA-N 497.580 5.049 5 20 JKBD Cc1ccc(C(=O)C2CCN([C@@H](C(=O)Nc3ccc([N+](=O)[O-])cc3Cl)c3ccccc3)CC2)cc1 603937369 ICGOFHWQWGGGHG-RUZDIDTESA-N 491.975 5.831 5 20 JKBD CSCC[C@H](NC(=O)c1cccc([N+](=O)[O-])c1)C(=O)Nc1cccc(Sc2ccccc2)c1 609382299 OGVJCJQXJNSGEZ-QFIPXVFZSA-N 481.599 5.236 5 20 JKBD O=C(OCc1cc([N+](=O)[O-])cc2c1OCOC2)c1nc(-c2ccccc2)oc1-c1ccccc1 731379217 XHRDUWRDGUQUOR-UHFFFAOYSA-N 458.426 5.140 5 20 JKBD C[C@H](OC(=O)CSc1cccc2cccc(Cl)c12)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 745902619 MLKJVEQCLAQCDJ-ZDUSSCGKSA-N 469.906 5.848 5 20 JKBD Cc1noc(C)c1COc1cc2ccccc2cc1C(=O)O[C@H](C)C(=O)Nc1ccccc1[N+](=O)[O-] 775389993 WANPYTAZEWMFOH-QGZVFWFLSA-N 489.484 5.116 5 20 JKBD COCCN(C(=O)c1ccc(Br)c([N+](=O)[O-])c1)[C@@H](C)c1cccc(C(F)(F)F)c1 914515675 GLFWAOMCTCQEKS-LBPRGKRZSA-N 475.261 5.226 5 20 JKBD Cc1cc(C(N)=O)ccc1NC(=O)c1ccccc1Sc1ccc(C(F)(F)F)cc1[N+](=O)[O-] 915174333 NJVCPYKPHCYOKQ-UHFFFAOYSA-N 475.448 5.424 5 20 JKBD CCN(Cc1cccc(NC(=O)C2CCN(c3ccccc3[N+](=O)[O-])CC2)c1)C(=O)OC(C)(C)C 918103625 GXINYXKVEKFIHV-UHFFFAOYSA-N 482.581 5.207 5 20 JKBD C[C@@H](Nc1ccc(C(=O)O[C@H](C)c2nc3ccccc3n2C(F)F)cc1[N+](=O)[O-])c1ccccn1 919684215 IQRFMVURNFIIRN-HUUCEWRRSA-N 481.459 5.826 5 20 JKBD C[C@H](OC(=O)[C@H]1CCCN(C(=O)c2ccc(Cl)c(Cl)c2)C1)c1ccc([N+](=O)[O-])cc1 920157418 GOSIOYNOZVTWSG-BBRMVZONSA-N 451.306 5.058 5 20 JKBD O=C(CCc1ccco1)Nc1ccc(C2(NC(=O)Cc3ccc(Cl)cc3[N+](=O)[O-])CCC2)cc1 1786898276 XRAJDRZCCLGCHN-UHFFFAOYSA-N 481.936 5.151 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)c3cccc(F)c3[N+](=O)[O-])CCC2)cc1)c1ccnc(C(F)F)c1 1787018588 AWOMMTVFVVLFMR-UHFFFAOYSA-N 484.434 5.128 5 20 JKBD O=C(NC1(c2ccc(NC(=O)c3cccc4ncsc34)cc2)CCC1)c1cc(F)cc([N+](=O)[O-])c1 1789344300 KKJPWLOAVNSFAJ-UHFFFAOYSA-N 490.516 5.405 5 20 JKBD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CCc1cccc([N+](=O)[O-])c1)c1cccc2c1oc1ccccc12 1793940328 DUIOROXDXIRSPV-WKCHPHFGSA-N 497.551 5.379 5 20 JKBD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc2cc([N+](=O)[O-])ccc2s1)c1ccc(C2CC2)cc1 1801207228 QBMFGOPHCOSAFZ-WKCHPHFGSA-N 475.570 5.253 5 20 JKBD O=C(c1cc2cc([N+](=O)[O-])ccc2s1)N1CCC2(CCCN(C(=O)[C@@H]3CC=CCC3)C2)CC1 1805407087 QZLIORXFHBXGEP-GOSISDBHSA-N 467.591 5.011 5 20 JKBD Cc1oc(C(C)(C)C)cc1C(=O)N1CCC2(CCCN(C(=O)Cc3cc([N+](=O)[O-])ccc3F)C2)CC1 1806655563 VIKPVDOQFIZWGG-UHFFFAOYSA-N 499.583 5.020 5 20 JKBD C/C(=C\c1cccs1)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cc([N+](=O)[O-])c(O)cc2C)CC1 1823718342 DHSQHFWTUAHFPH-OVWUPXBPSA-N 497.617 5.007 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)N1CCCC[C@@H]1C1CCN(C(=O)[C@H]2CC[C@H](C)CC2)CC1 1830729808 YZJUTDAVMSZDEG-HCLVMJGWSA-N 473.589 5.102 5 20 JKBD Cc1ccc([C@H](C)C(=O)N2CCCC[C@H]2C2CCN(C(=O)c3ccc([N+](=O)[O-])cc3F)CC2)cc1 1831530270 PRMRJMVMSWSWTL-DFBJGRDBSA-N 481.568 5.079 5 20 JKBD CCCCC[C@H](C)C(=O)N1CCC([C@H]2CCCCN2C(=O)CSc2ccccc2[N+](=O)[O-])CC1 1831777906 XTPWPXYHZKWFNJ-RBBKRZOGSA-N 489.682 5.523 5 20 JKBD Cc1ccc(CC(=O)N2CCC([C@H]3CCCCN3C(=O)c3ccccc3C3CC3)CC2)cc1[N+](=O)[O-] 1832556061 NAVKNDQQHHQILK-AREMUKBSSA-N 489.616 5.257 5 20 JKBD COc1ccc(CN(C(=O)C2CCN(c3ccc(C(F)(F)F)cc3[N+](=O)[O-])CC2)C2CC2)cc1 9888721 GPUSYLRTVJMPTR-UHFFFAOYSA-N 477.483 5.030 5 20 JKBD CC(=O)N(c1nc(COC(=O)c2ccc([N+](=O)[O-])cc2Cl)cs1)c1cccc(C)c1C 11028702 JDQFDNMDHVBLQY-UHFFFAOYSA-N 459.911 5.363 5 20 JKBD CC(C)CCn1c(S[C@H](C)C(=O)Nc2cc([N+](=O)[O-])ccc2Cl)nc2ccccc2c1=O 11207392 INHCGROYQSEVRB-CQSZACIVSA-N 474.970 5.124 5 20 JKBD O=C(COC(=O)Cn1c2ccccc2c(=O)c2ccccc21)Nc1ccccc1-c1ccccc1 11276633 CHKSFTPLTSISGU-UHFFFAOYSA-N 462.505 5.004 5 20 JKBD CC(=O)Nc1ccc(NC(=O)c2ccc(Sc3nc4ccccc4s3)c([N+](=O)[O-])c2)cc1Cl 14122766 DZKSOIIIZFJCAM-UHFFFAOYSA-N 498.973 6.220 5 20 JKBD CCCN(CC(=O)Nc1cc(Cl)ccc1Cl)C(=O)c1ccc(SC)c([N+](=O)[O-])c1 15647827 CAEPPVZQWFSVHO-UHFFFAOYSA-N 456.351 5.114 5 20 JKBD CCOc1cc(C(=O)NC[C@@H](c2ccccc2Cl)c2c[nH]c3ccccc23)c([N+](=O)[O-])cc1OC 15758540 BXZLGADYTBQWNA-IBGZPJMESA-N 493.947 5.699 5 20 JKBD Cc1cccc(Oc2ccccc2NC(=O)c2ccc(Sc3nncn3C)c([N+](=O)[O-])c2)c1 15985085 MTLHWPAVECSTFP-UHFFFAOYSA-N 461.503 5.228 5 20 JKBD Cc1sc(NC(=O)C(C)(C)C)c(C(=O)O[C@@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)c1C 17956763 DMJGLKGWYJEIER-LBPRGKRZSA-N 472.523 5.226 5 20 JKBD Cc1ccc(-c2cnc(-c3ccccc3C(=O)OCc3nnc(-c4ccc([N+](=O)[O-])cc4)o3)o2)cc1 18754015 DIQHQTCFEQZTFK-UHFFFAOYSA-N 482.452 5.632 5 20 JKBD O=C(CSc1ncnc2scc(-c3ccc(F)cc3)c12)Nc1ccc(F)c([N+](=O)[O-])c1 21672016 RSSRDLDXFIJXDO-UHFFFAOYSA-N 458.471 5.276 5 20 JKBD Cc1c(NC(=O)[C@H](C)Sc2nn(-c3ccc(Cl)cc3)c(=S)s2)cccc1[N+](=O)[O-] 23500228 PSZXGXJMYVCTBB-NSHDSACASA-N 466.997 5.653 5 20 JKBD CCc1cccc(CC)c1NC(=O)[C@H](C)Sc1nc2cc3ccccc3cc2c(=O)n1CC 26581073 LCGHMMKUJIJDRA-KRWDZBQOSA-N 459.615 5.814 5 20 JKBD Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)N1CCC(C(=O)Nc2ccc(C(C)C)cc2C(C)C)CC1 27136515 UTKJDLIMFHUUIW-UHFFFAOYSA-N 487.622 5.189 5 20 JKBD C[C@H](c1ccccc1)n1c(SCC(=O)Nc2cc([N+](=O)[O-])ccc2Cl)nc2ccccc2c1=O 28831038 NMZHHIHETXAWGA-OAHLLOKOSA-N 494.960 5.298 5 20 JKBD CN(C)c1ccc(C(=O)c2ccccc2C(=O)Nc2ccc3oc(C4CC4)nc3c2)cc1[N+](=O)[O-] 33215058 PMXVYSJIJLOEQL-UHFFFAOYSA-N 470.485 5.163 5 20 JKBD CCCCc1ccc2nc(NC(=O)c3cc(OC)c(OCc4cscn4)cc3[N+](=O)[O-])sc2c1 108936055 QZKMOYZDANZQEO-UHFFFAOYSA-N 498.586 5.844 5 20 JKBD CC(C)CCSc1ccc(C(=O)N2CCC(C(=O)c3ccc(O)cc3)CC2)cc1[N+](=O)[O-] 115495251 AVRGAOBIQGEDNW-UHFFFAOYSA-N 456.564 5.174 5 20 JKBD O=C(CSc1ccc(C(F)(F)F)cc1[N+](=O)[O-])N(CCc1ccccc1)Cc1ccncc1 116482966 WJGYIBHARIDTTD-UHFFFAOYSA-N 475.492 5.372 5 20 JKBD O=C(c1ccc(Br)cc1Cl)N(Cc1ccccc1[N+](=O)[O-])CC(F)(F)F 195695289 UOYFGBLIXJMYRT-UHFFFAOYSA-N 451.626 5.215 5 20 JKBD COc1cc(C(=O)Nc2nc(-c3cccc([N+](=O)[O-])c3)c(C)s2)cc(OC)c1Br 195704050 KWIDYNJPZWNUQC-UHFFFAOYSA-N 478.324 5.059 5 20 JKBD COc1ccc(CSCC(=O)Nc2c(C)c(C(C)(C)C)nn2-c2ccccc2)cc1[N+](=O)[O-] 303357778 ZDHRYPSEQXGLRO-UHFFFAOYSA-N 468.579 5.267 5 20 JKBD CC(C)(C)c1ccc(C(=O)Nc2nc(-c3ccc4c(c3)CCC(=O)N4)cs2)cc1[N+](=O)[O-] 490907511 KXQKVVSHHIUZHA-UHFFFAOYSA-N 450.520 5.153 5 20 JKBD COc1cc(C(=O)Nc2cccc(OCCN(C)C)c2)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 500318275 SHKSPDIWFZFHGB-UHFFFAOYSA-N 485.924 5.242 5 20 JKBD C[C@H](Nc1ccc(C(=O)N(C)[C@H](C)c2ccc(Cl)c(Cl)c2)cc1[N+](=O)[O-])c1ccccn1 506176762 BFFJVCUQJSRLNE-LSDHHAIUSA-N 473.360 6.303 5 20 JKBD COc1cc(C(=O)Nc2nc(-c3cccs3)cs2)c([N+](=O)[O-])cc1OCc1cscn1 512370064 KFVFMTRNAZKHPZ-UHFFFAOYSA-N 474.545 5.076 5 20 JKBD C[C@H](c1cccs1)N(Cc1ccccc1)C(=O)CCCn1c(=O)oc2cc([N+](=O)[O-])ccc21 515370905 MLPDGZNOQUBRSN-QGZVFWFLSA-N 465.531 5.134 5 20 JKBD Cc1ccc([N+](=O)[O-])cc1NC(=O)c1ccc(NC(=O)c2cccc(Br)c2)cc1 517127194 ZEOHOKVKAFCXNX-UHFFFAOYSA-N 454.280 5.170 5 20 JKBD O=[N+]([O-])c1ccc(-c2nn(-c3ccccc3)cc2CNCc2ccc(OCc3ccccn3)cc2)cc1 518263535 RNNVFZNXBXBKTP-UHFFFAOYSA-N 491.551 5.711 5 20 JKBD O=C(Nc1ccc(-c2nnc3n2CCCC3)cc1)c1cc([N+](=O)[O-])ccc1Oc1ccccc1 519504371 MQDHXNWKANLUQF-UHFFFAOYSA-N 455.474 5.234 5 20 JKBD C[C@@H](Nc1ccc(C(=O)Nc2cc(-c3ccoc3)nn2-c2ccccc2)cc1[N+](=O)[O-])c1ccccn1 522098360 IUBJOOCGUSIMOC-GOSISDBHSA-N 494.511 5.861 5 20 JKBD COC(=O)C1CCN(C(=O)c2c3c(nc4ccccc24)/C(=C\c2ccc([N+](=O)[O-])cc2)CCC3)CC1 590851456 TXEKUWVQNAEBHY-JZJYNLBNSA-N 485.540 5.045 5 20 JKBD C[C@@H](NC(=O)C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)c1ccc2c(c1)OCO2 600859458 SYCYDGYXCXMCGQ-PUMYGXPMSA-N 487.537 5.741 5 20 JKBD CC(C)(C)c1ccc(C(=O)Nc2ccc(NC(=O)c3ccoc3)cc2C(F)(F)F)cc1[N+](=O)[O-] 603761930 MJOVWCIIBMBLED-UHFFFAOYSA-N 475.423 6.009 5 20 JKBD C[C@@H](Nc1ccc(NC(=O)c2cc(OCC(F)(F)F)ccc2[N+](=O)[O-])cc1)c1ccccc1 604445489 JQOHSSUAUMFLIW-OAHLLOKOSA-N 459.424 5.961 5 20 JKBD COc1cc(C(=O)Nc2ccc(-c3nc4c(Cl)cccc4[nH]3)cc2)c([N+](=O)[O-])cc1OC 608947908 HOWBSIJBYQKDCE-UHFFFAOYSA-N 452.854 5.061 5 20 JKBD CSc1ccc(C(=O)NC2CCN(Cc3ccc(Cl)c(Cl)c3)CC2)cc1[N+](=O)[O-] 609430102 OBXSVPOXNWVPOO-UHFFFAOYSA-N 454.379 5.018 5 20 JKBD CCCc1cc[n+](/C(C(=S)Nc2ccccc2-c2ccccc2)=C(/O)c2cccc([N+](=O)[O-])c2)cc1 725763344 KJVZWLTZKDDCTD-UHFFFAOYSA-O 496.612 6.825 5 20 JKBD COC(=O)Nc1cc(NC(=O)c2cc([N+](=O)[O-])ccc2Sc2ccc(Cl)cc2)ccc1F 727334558 ABWYJYYSUNVBIC-UHFFFAOYSA-N 475.885 5.969 5 20 JKBD Cc1nnc(SCc2c(C(=O)OCCOc3ccccc3[N+](=O)[O-])oc3ccccc23)s1 742957084 QUOMMYAVESJGBX-UHFFFAOYSA-N 471.516 5.029 5 20 JKBD O=C(OCC1CCN(c2ncccc2[N+](=O)[O-])CC1)c1csc(-c2ccc(Cl)c(Cl)c2)n1 749359608 WRBQZDUYLMELAN-UHFFFAOYSA-N 493.372 5.494 5 20 JKBD CCOC(=O)C[C@@H](c1ccccc1)C1CCN(C(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)CC1 916706304 UWDONGLRYCDMHT-IBGZPJMESA-N 459.930 5.229 5 20 JKBD COc1ccc(NC(=O)/C=C/c2ccc([N+](=O)[O-])cc2)cc1NC(=O)c1ccc(Cl)cc1F 917787549 NBGSZBZCXYBHNR-NYYWCZLTSA-N 469.856 5.300 5 20 JKBD Cc1c(NC(=O)c2ccccc2)cccc1NC(=O)c1cc([N+](=O)[O-])ccc1N1CCC(C)CC1 917794139 DTGIKXPZZVVAGT-UHFFFAOYSA-N 472.545 5.644 5 20 JKBD CCCN(C(=O)c1ccc(C)c([N+](=O)[O-])c1)c1cccc(NC(=O)c2ccc(C)c([N+](=O)[O-])c2)c1 920003204 IDIKMSPZXAOCHN-UHFFFAOYSA-N 476.489 5.429 5 20 JKBD COc1ccc(SCC(=O)O[C@@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2ccccc2)cc1 921175136 OKKIPAUIVCBGMT-JOCHJYFZSA-N 486.933 5.272 5 20 JKBD Cc1noc([C@H](C)OC(=O)C/C(=C/c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)n1 926630693 IBUHRWWCNIARPW-RERGGYADSA-N 450.476 5.131 5 20 JKBD O=C(CCC1CCCC1)NC1(c2ccc(NC(=O)c3cc([N+](=O)[O-])cc4c3OCC4)cc2)CCC1 1790046412 FOZRPNOHBKSMRD-UHFFFAOYSA-N 477.561 5.248 5 20 JKBD CCOc1cccc(C(=O)NC2(c3ccc(NC(=O)c4ccc([N+](=O)[O-])cc4F)cc3)CCC2)c1 1790625687 FHKIETJKKWMLDW-UHFFFAOYSA-N 477.492 5.194 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)Nc1ccc(C2(NC(=O)[C@H]3CCC(F)(F)C3)CCC2)cc1 1790774834 NUZHGJVLXQJPBI-HNNXBMFYSA-N 475.467 5.225 5 20 JKBD COc1ccc(CC(=O)NC2(c3ccc(NC(=O)C[C@H]4C[C@@H]5CC[C@H]4C5)cc3)CCC2)c([N+](=O)[O-])c1 1791324299 VMLNVGZNDQPQDP-SVFBPWRDSA-N 491.588 5.106 5 20 JKBD Cc1cc(CCCC(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cccc3ccoc23)c([N+](=O)[O-])cc1F 1801099178 VQZASGGISOIFMW-WKCHPHFGSA-N 493.535 5.063 5 20 JKBD CC1(C)CCC(CC(=O)Nc2cc([C@@H]3CCCCN3C(=O)Cc3cc(F)ccc3[N+](=O)[O-])[nH]n2)CC1 1820979678 SYZCASVDLHSWHM-QFIPXVFZSA-N 499.587 5.298 5 20 JKBD O=C(c1cc(F)cc([N+](=O)[O-])c1)N1CCC([C@H]2CCCCN2C(=O)CCCc2ccccc2F)CC1 1824167072 PYDFFLJZSJJTQQ-RUZDIDTESA-N 499.558 5.129 5 20 JKBD Cc1cc(C)cc(CCC(=O)N2CCC([C@@H]3CCCCN3C(=O)/C=C/c3ccc([N+](=O)[O-])o3)CC2)c1 1824279593 YBGPSALPWVAYAD-HJKZNEBBSA-N 493.604 5.070 5 20 JKBD Cc1cc(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3cc(C(C)(C)C)oc3C)CC2)ncc1[N+](=O)[O-] 1827828484 AJCKRZCRKJFRDW-JOCHJYFZSA-N 496.608 5.044 5 20 JKBD O=C(CCC(F)(F)F)N1CCC([C@@H]2CCCCN2C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)CC1 1831061445 SPSNVXJENNNMEJ-SFHVURJKSA-N 497.539 5.385 5 20 JKBD CCn1c(SCC(=O)OCc2ccc([N+](=O)[O-])cc2)nnc1-c1ccc(Cl)cc1Cl 9848088 VLGXIZRSDZMEAL-UHFFFAOYSA-N 467.334 5.016 5 20 JKBD COc1ccc(NC(C)=O)cc1NC(=O)c1cc([N+](=O)[O-])ccc1Sc1ccc(Cl)cc1 14793045 JWJZHQYHWWWJMB-UHFFFAOYSA-N 471.922 5.619 5 20 JKBD COc1cc(NC(=O)c2ccc(Sc3nc(C)cs3)c([N+](=O)[O-])c2)c(OC)cc1Cl 15474567 FAPBAZIPORXMLF-UHFFFAOYSA-N 465.940 5.434 5 20 JKBD O=C(Nc1ccc(Cl)c([N+](=O)[O-])c1)[C@H](Sc1nncn1-c1ccccc1F)c1ccccc1 24723254 GFCTVERPPWHSNC-HXUWFJFHSA-N 483.912 5.440 5 20 JKBD Cc1ccc(NC(=O)[C@H](Sc2nncn2-c2cccc(Cl)c2)c2ccccc2)c([N+](=O)[O-])c1 25026414 FIGYQRJQKNPTLJ-OAQYLSRUSA-N 479.949 5.609 5 20 JKBD CC(C)C(=O)Nc1cccc(N[C@@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2ccccc2)c1 27003022 TVRFSDQVZRMUOS-JOCHJYFZSA-N 466.925 5.635 5 20 JKBD CC(C)OC(=O)C[C@@H](NC(=O)c1cc2c(s1)-c1ccccc1OC2)c1ccccc1[N+](=O)[O-] 105281592 ZWTAISNUSYSMCB-GOSISDBHSA-N 466.515 5.029 5 20 JKBD CCOc1cc(NC(=O)c2sc(Cc3ccc(F)cc3)nc2C)c([N+](=O)[O-])cc1OCC 302929586 FVTPXSHZWUZATB-UHFFFAOYSA-N 459.499 5.139 5 20 JKBD O=C(Cc1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1)N[C@H](c1ccccc1)c1nccs1 303237446 YPCJJHJZMGAFIE-AREMUKBSSA-N 495.564 5.352 5 20 JKBD O=C(Nc1nnc(C(F)(F)F)s1)c1ccccc1Sc1ccc(C(F)(F)F)cc1[N+](=O)[O-] 491345090 DOMOECMIJMOXBN-UHFFFAOYSA-N 494.398 5.887 5 20 JKBD Cc1ccc(NC(=O)c2cc3cc([N+](=O)[O-])ccc3o2)cc1S(=O)(=O)Nc1ccccc1Cl 494021818 AJUUBEFNWQVTGP-UHFFFAOYSA-N 485.905 5.356 5 20 JKBD Cc1ccc(S(=O)(=O)Nc2ccc(NC(=O)c3csc(-c4cccc([N+](=O)[O-])c4)n3)cc2)cc1 497261299 LQGIUPWNMHNVJR-UHFFFAOYSA-N 494.554 5.080 5 20 JKBD O=C(CSc1ccc([N+](=O)[O-])cc1)N(Cc1ccc(F)cc1)c1nc2ccccc2s1 501765931 BDCFDXTTZRDGTQ-UHFFFAOYSA-N 453.520 5.669 5 20 JKBD O=C(CCc1nc2cc(C(F)(F)F)ccc2s1)Nc1cc(-c2cccc([N+](=O)[O-])c2)[nH]n1 502970303 OOJXFPPGEZZTMU-UHFFFAOYSA-N 461.425 5.185 5 20 JKBD CNC(=O)c1ccc(Sc2nnc(-c3ccccc3OC)n2-c2ccc(Cl)cc2)c([N+](=O)[O-])c1 507133360 XEOLQUVPADUTFQ-UHFFFAOYSA-N 495.948 5.015 5 20 JKBD O=C(Cn1c2ccccc2c(=O)c2ccccc21)N[C@H](c1ccc(Cl)cc1)c1ccsc1 512252550 KZOJWCFIMPUVSW-RUZDIDTESA-N 458.970 5.775 5 20 JKBD O=[N+]([O-])c1ccc(-c2nn(-c3ccccc3)cc2CNCC2(c3ccccc3)CCOCC2)cc1 518267986 CBDILXUUHVANNH-UHFFFAOYSA-N 468.557 5.286 5 20 JKBD Cc1nn(-c2ccccn2)c2nc(C3CC3)cc(C(=O)Nc3nc(-c4cccc([N+](=O)[O-])c4)cs3)c12 521272840 RQHOJLPQHULORK-UHFFFAOYSA-N 497.540 5.285 5 20 JKBD COCCN(C(=O)Nc1cc([N+](=O)[O-])ccc1OC(F)F)[C@@H](C)c1cccc(C(F)(F)F)c1 521840582 BPXODJLXBLGALM-LBPRGKRZSA-N 477.386 5.457 5 20 JKBD CCOc1cc(NC(=O)c2cc(-c3cc(C)oc3C)nc3onc(C)c23)c([N+](=O)[O-])cc1OCC 561475796 DLFYXPYGHLJPBJ-UHFFFAOYSA-N 480.477 5.366 5 20 JKBD Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)c1ccc(Cl)c(NS(=O)(=O)c2ccc(F)cc2)c1 603501368 KJLKMNHGWZGMHV-UHFFFAOYSA-N 477.901 5.057 5 20 JKBD O=[N+]([O-])c1cccc(-c2noc(CSc3nnc(COc4ccc(Cl)cc4Cl)o3)n2)c1 603565224 RFENTLKOPWNLFD-UHFFFAOYSA-N 480.289 5.206 5 20 JKBD COC(=O)c1cc(CNC(=O)c2ccccc2Sc2ccc(C(F)(F)F)cc2[N+](=O)[O-])oc1C 603571634 KTUREOUKXHAMNJ-UHFFFAOYSA-N 494.447 5.383 5 20 JKBD O=C(Nc1nc(-c2ccco2)c(-c2ccco2)s1)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-] 603727378 OONXKTOZHPIDID-UHFFFAOYSA-N 479.392 5.765 5 20 JKBD CCN(CCC(F)(F)F)C(=O)c1ccc(Sc2nc3ccccc3s2)c([N+](=O)[O-])c1 604524356 IXVNZDALKHILJQ-UHFFFAOYSA-N 455.483 5.770 5 20 JKBD COc1cc(C(=O)N2CC[C@H](Nc3ccccc3)C2)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 609113307 CUICFEWCAHJBDF-IBGZPJMESA-N 467.909 5.376 5 20 JKBD C[C@@H](c1cccc([N+](=O)[O-])c1)S(=O)(=O)C(c1ccc(Cl)cc1)c1ccc(Cl)cc1 609251549 KLNWUWZNSMHFPI-AWEZNQCLSA-N 450.343 6.167 5 20 JKBD O=C(Nc1nc(-c2ccc(OC(F)F)cc2OC(F)F)cs1)c1n[nH]c2ccc([N+](=O)[O-])cc12 609415102 OPMFTNPBCSVVNH-UHFFFAOYSA-N 497.386 5.050 5 20 JKBD O=C(Nc1ccccc1OCc1ncc(-c2cccc(Cl)c2)o1)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1 726762887 GIPFQYUHRYIEAS-UHFFFAOYSA-N 494.847 5.643 5 20 JKBD C[C@H](OC(=O)/C=C/c1cccc(OC2CCCC2)c1)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 727887187 QCCYQMMLNJQXPA-RZXPCSSPSA-N 492.450 5.519 5 20 JKBD O=C(OCC(=O)N1c2ccccc2Sc2ccc(Cl)cc21)c1c(Cl)cccc1[N+](=O)[O-] 730645853 SWTQIEYDBBWHEI-UHFFFAOYSA-N 475.309 5.888 5 20 JKBD Cc1onc(-c2ccccc2)c1-c1nnc(COC(=O)c2csc(-c3ccc([N+](=O)[O-])cc3)n2)o1 747957147 KCCBCMHLYFUWHF-UHFFFAOYSA-N 489.469 5.089 5 20 JKBD COc1ccc(COCc2cccc(NC(=O)c3cc([N+](=O)[O-])ccc3Br)c2)cc1 751110328 LCZNINPMERKTFK-UHFFFAOYSA-N 471.307 5.335 5 20 JKBD C[C@H](OC(=O)COc1ccc(-c2ccccc2)cc1)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 789750014 YJSGJGLGXCRXFR-HNNXBMFYSA-N 488.418 5.230 5 20 JKBD Cc1c(Br)cc(-c2nc(C3(NC(=O)OC(C)(C)C)CCCC3)no2)cc1[N+](=O)[O-] 904417208 DZGLDZPXUSTURD-UHFFFAOYSA-N 467.320 5.010 5 20 JKBD Cc1ccc(-c2nnc(COC(=O)c3ccc(Sc4nc(C)cs4)c([N+](=O)[O-])c3)o2)cc1 914888119 GPMFUIKPROUBLB-UHFFFAOYSA-N 468.516 5.226 5 20 JKBD C[C@@H](OC(=O)c1cnc(-c2ccccc2)s1)C(=O)Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1 915549647 JLNVINRDJVPZHZ-CYBMUJFWSA-N 480.527 5.026 5 20 JKBD COc1ccc(N2C(=S)N[C@@H](c3ccsc3)C(C(=O)Nc3cccc([N+](=O)[O-])c3)=C2C)cc1 916168332 LRNWMNQZGHOGIO-NRFANRHFSA-N 480.571 5.013 5 20 JKBD Cc1sc(NC(=O)c2csc(COc3ccc(F)cc3)n2)nc1-c1cccc([N+](=O)[O-])c1 917790217 BWUKFLJMTQSXFS-UHFFFAOYSA-N 470.507 5.454 5 20 JKBD Cc1cccc([N+](=O)[O-])c1NC(=O)COC(=O)c1ccsc1NC(=O)c1ccc(C(C)C)cc1 919400098 QPZZIFJBOXTELW-UHFFFAOYSA-N 481.530 5.136 5 20 JKBD Cc1cccc(NC(=O)N2CCC[C@H](C(=O)OCc3nc4ccccc4c4ccccc34)C2)c1 919577285 AGXSZMMCGOAOES-FQEVSTJZSA-N 453.542 5.684 5 20 JKBD Cc1ncc(COC(=O)C/C(=C/c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)s1 920347974 KNWOINPTUXAUDB-YBEGLDIGSA-N 451.529 5.644 5 20 JKBD COc1cc(C(=O)OCc2csc(-c3cccs3)n2)c([N+](=O)[O-])cc1OCc1cscn1 920652678 MQHLJNQIIDQKBZ-UHFFFAOYSA-N 489.556 5.181 5 20 JKBD O=C(CSc1ccccc1)Nc1ccc(C2(NC(=O)Cc3ccc([N+](=O)[O-])cc3F)CCC2)cc1 1787774809 LSTBUFVZJBKNOD-UHFFFAOYSA-N 493.560 5.203 5 20 JKBD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2cccc(F)c2[N+](=O)[O-])[nH]n1)c1cccc2ccccc12 1818454256 NQZWJQXHWUAQCH-QFIPXVFZSA-N 487.491 5.230 5 20 JKBD CC1=CC[C@@H](C(=O)N2CCCC[C@@H]2c2cc(NC(=O)c3cc(Cl)cc([N+](=O)[O-])c3C)n[nH]2)CC1 1821294640 RTCVQLJDCCXSEL-OXQOHEQNSA-N 485.972 5.332 5 20 JKBD C[C@@H](Sc1ccccc1)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2ccc([N+](=O)[O-])cc2F)CC1 1824391507 FNZJWJRRWZLTSK-HOYKHHGWSA-N 499.608 5.148 5 20 JKBD C[C@]1(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3cc4cc([N+](=O)[O-])ccc4s3)CC2)CC1(F)F 1832810123 PVDOZKUYHAZJKW-WZONZLPQSA-N 491.560 5.088 5 20 JKBD O=C(Nc1ccccc1)c1nnc(/C(Cl)=C/c2ccc(-c3ccccc3[N+](=O)[O-])o2)s1 22608471 UGQPLWOQYSSVLF-VBKFSLOCSA-N 452.879 5.696 5 20 JKBD Cc1ccc(Sc2ccc(C(=O)N(Cc3nc4ccccc4c(=O)[nH]3)C(C)C)cc2[N+](=O)[O-])cc1 24944314 JKRVUNYINZENGZ-UHFFFAOYSA-N 488.569 5.342 5 20 JKBD Cc1c(-c2ccccc2)sc(NC(=O)COc2cccc([N+](=O)[O-])c2)c1C(=O)N1CCCCC1 45714641 NKSPJZIANVQVDI-UHFFFAOYSA-N 479.558 5.275 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)N[C@@H](c2ccc(C(C)C)cc2)c2cccs2)cc1SC 112530064 ILAIVQUDZOVPOL-QFIPXVFZSA-N 456.589 6.030 5 20 JKBD Cc1cc(NC(=O)c2ccco2)sc1C(=O)Nc1nc(-c2cccc([N+](=O)[O-])c2)c(C)s1 195704141 KNFOIINDGAXBPB-UHFFFAOYSA-N 468.516 5.494 5 20 JKBD O=C(CSc1ccc(C(F)(F)F)cc1[N+](=O)[O-])NCc1cccnc1Oc1cccc(F)c1 479072288 UAXKFWVAVFQDDU-UHFFFAOYSA-N 481.427 5.349 5 20 JKBD Cc1ncc(-c2ccc(NC(=O)c3ccccc3C(=O)c3ccc(N(C)C)c([N+](=O)[O-])c3)cc2)o1 481709611 DAVCDQYSNYRXSR-UHFFFAOYSA-N 470.485 5.108 5 20 JKBD O=C(NCc1ccc(-c2ccc3c(c2)CCO3)cc1)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-] 499943724 DGJWHAFEZQRFDC-UHFFFAOYSA-N 472.419 5.068 5 20 JKBD CNC(=O)c1ccc(Cl)c(NC(=O)c2ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])c(OC)c2)c1 500265419 WAWMCEBLAWVUAL-UHFFFAOYSA-N 490.299 5.314 5 20 JKBD O=[N+]([O-])c1cccc(F)c1CSc1nnc(-c2cccnc2)n1-c1ccc(Br)cc1 504530071 NWMVRMHKPMNTJG-UHFFFAOYSA-N 486.326 5.431 5 20 JKBD O=C(Cn1c2ccccc2c(=O)c2ccccc21)Nc1ccc(I)cc1Cl 512525050 YSQSGYMASNICDL-UHFFFAOYSA-N 488.712 5.051 5 20 JKBD COc1cc(C(=O)N[C@@H](C)c2ccc(OC3CCCC3)c(OC)c2)c([N+](=O)[O-])cc1OC(F)F 514576031 WNKZSIYTKAWFRQ-ZDUSSCGKSA-N 480.464 5.026 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Cl)N1CCC(c2nc3cc(Cl)ccc3s2)CC1 516273155 WPYGZVGYCISXBI-UHFFFAOYSA-N 451.335 5.923 5 20 JKBD COc1ccc(CN[C@H](c2ccc3c(c2)OCCO3)C(C)C)cc1OCc1ccc([N+](=O)[O-])cc1 518270087 XJJJJOFZCSCWBP-MHZLTWQESA-N 478.545 5.441 5 20 JKBD C[C@H](Nc1ccc(C(=O)NCc2nc3cc(Cl)ccc3s2)cc1[N+](=O)[O-])c1ccccn1 518855570 NBJMDWJGIYFPOR-ZDUSSCGKSA-N 467.938 5.356 5 20 JKBD CC(=O)NC[C@@H]1CCCN(C(=O)c2c3c(nc4ccccc24)/C(=C\c2ccc([N+](=O)[O-])cc2)CCC3)C1 519206628 LLPSMTOPMSYXMQ-YVUGPFRESA-N 498.583 5.008 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Cl)[C@H](NCc1cccc(Br)c1)c1ccccc1 520259762 VWHAHJHVRBMDKT-HXUWFJFHSA-N 474.742 5.480 5 20 JKBD COCCN(C(=O)[C@H](C)SCc1ccccc1)c1nc(-c2ccc([N+](=O)[O-])cc2)cs1 603750639 ZYEJZAZDMAPRDR-INIZCTEOSA-N 457.577 5.020 5 20 JKBD Cc1ccc(S(=O)(=O)Nc2ccc(NC(=O)[C@@H]3CCCC[C@@H]3C(F)(F)F)cc2)cc1[N+](=O)[O-] 603780510 OJXICWMXXMVLRE-MSOLQXFVSA-N 485.484 5.011 5 20 JKBD CCCC(=O)Nc1cccc(NC(=O)c2ccc(Sc3nc(C)cs3)c([N+](=O)[O-])c2)c1 603969978 LQDUFPXDSGRCSW-UHFFFAOYSA-N 456.549 5.502 5 20 JKBD C[C@@H]1C[C@@H]1c1ccc(CN[C@@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Br)c2ccccc2)o1 604044523 TUZKRTDILDWIMD-JVJLVOBOSA-N 484.350 5.543 5 20 JKBD CN(C[C@H]1CCCO[C@H]1c1ccccc1)C(=O)c1cc([N+](=O)[O-])ccc1Sc1ccccc1 604519688 OLOBPYZWZCNEHT-NLFFAJNJSA-N 462.571 5.986 5 20 JKBD NC(=O)CCSc1ccccc1NC(=O)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1 609153219 YWJZHTBMMDNBKX-UHFFFAOYSA-N 471.922 5.260 5 20 JKBD O=C(Nc1ccccc1C(=O)Nc1ccc2scnc2c1)c1ccc([N+](=O)[O-])cc1Cl 725737977 JYNVBNYDIQXACI-UHFFFAOYSA-N 452.879 5.363 5 20 JKBD C[C@@H](OC(=O)c1cc([N+](=O)[O-])ccc1Br)C(=O)Nc1ccccc1-c1ccccc1 725986072 RKRNBIQQXWBUPF-CQSZACIVSA-N 469.291 5.208 5 20 JKBD O=C(Nc1ccc(CN2C(=O)Cc3ccc(Cl)cc32)cc1)c1cc([N+](=O)[O-])ccc1N1CCCC1 745125002 RHAQFFRGRONMQT-UHFFFAOYSA-N 490.947 5.190 5 20 JKBD C[C@H](OC(=O)c1cc(-c2ccccc2)nn1-c1ccccc1)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 745962391 PJLYUNWBTYUBFD-KRWDZBQOSA-N 481.468 5.416 5 20 JKBD Cc1cc(-c2noc([C@@H](C)OC(=O)c3csc(-c4cccc([N+](=O)[O-])c4)n3)n2)ccc1F 747955745 LOLQKJDTYQJLKK-GFCCVEGCSA-N 454.439 5.134 5 20 JKBD Cc1cc(C(=O)COC(=O)c2csc(-c3cccc([N+](=O)[O-])c3)n2)c(C)n1Cc1ccc(F)cc1 747961856 KXDHZXUGMKBUBI-UHFFFAOYSA-N 493.516 5.364 5 20 JKBD Cc1nc2ccccc2c(-c2ccccc2)c1CC(=O)OCc1cc([N+](=O)[O-])cc2c1OCOC2 800368974 HEONLUYJUPISLT-UHFFFAOYSA-N 470.481 5.271 5 20 JKBD CC1=C(C(=O)Nc2ccccc2C)[C@@H](c2ccc(-c3ccc([N+](=O)[O-])cc3)s2)NC(=S)N1 818328964 IQTQQARMAZNPMQ-OAQYLSRUSA-N 464.572 5.063 5 20 JKBD COc1cc(C(=O)Nc2ccc(-c3ccccc3)cc2F)c([N+](=O)[O-])cc1OCc1cscn1 919881774 QYILWOLSHSTXCT-UHFFFAOYSA-N 479.489 5.697 5 20 JKBD O=C(Cc1ccc(NC(=O)c2ccc(Br)o2)cc1)Oc1cc(Cl)ccc1[N+](=O)[O-] 921132476 AISGDQRUYNMRDF-UHFFFAOYSA-N 479.670 5.004 5 20 JKBD Cc1nc(C)c(C(=O)Nc2ccc(C3(NC(=O)C4(c5cccc([N+](=O)[O-])c5)CCC4)CCC3)cc2)o1 1789790589 JDBOCNRCBPZTHM-UHFFFAOYSA-N 488.544 5.069 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)c3ccnc4ccccc34)CCC2)cc1)c1cc(F)cc([N+](=O)[O-])c1 1790696417 CIGJUVDMESJVPL-UHFFFAOYSA-N 484.487 5.344 5 20 JKBD CC(C)=CCCC(=O)N1CC[C@H](CNC(=O)c2cc(Cl)cc([N+](=O)[O-])c2C)[C@H]1c1cccnc1 1811794582 PFBJVJOPHKQMHA-NTKDMRAZSA-N 484.984 5.018 5 20 JKBD CC1=CC[C@@H](C(=O)N2CCC([C@H]3CCCCN3C(=O)c3cc4cc([N+](=O)[O-])ccc4s3)CC2)CC1 1831061575 WTFVKRLUQIMTDF-NFBKMPQASA-N 495.645 5.789 5 20 JKBD Cc1ccc(SCC(=O)Nc2c(Br)cc([N+](=O)[O-])cc2Br)cc1 11400499 QXACDEFRWRHQHD-UHFFFAOYSA-N 460.147 5.159 5 20 JKBD O=C(Cn1c2ccccc2c(=O)c2ccccc21)NCc1cn(Cc2ccccc2)nc1-c1ccccc1 14900461 BFCJVBGQOVPKSZ-UHFFFAOYSA-N 498.586 5.383 5 20 JKBD CC(C)(C)c1ccc(-c2nnc(SCC(=O)Nc3nc(-c4cccc([N+](=O)[O-])c4)cs3)o2)cc1 22249905 UZWXGLJNKRRKHF-UHFFFAOYSA-N 495.586 5.797 5 20 JKBD CCOC(=O)c1c(NC(=O)COC(=O)c2c3ccccc3cc3ccccc23)oc(C)c1C(C)=O 22724822 NZAOOWJOEJIBPJ-UHFFFAOYSA-N 473.481 5.069 5 20 JKBD O=C(OCc1csc(-c2ccco2)n1)c1ccccc1C(=O)c1ccc(Cl)c([N+](=O)[O-])c1 25459289 YYIIFQHFKAEVSR-UHFFFAOYSA-N 468.874 5.553 5 20 JKBD Cc1cc(CN2CCSCC2)ccc1NC(=O)c1ccc(N[C@@H](C)c2ccccn2)c([N+](=O)[O-])c1 109976944 WJTVCOPJRWYOAG-IBGZPJMESA-N 491.617 5.272 5 20 JKBD O=C(Nc1ccc(OCc2ccccn2)c(Cl)c1)c1csc(-c2cccc([N+](=O)[O-])c2)n1 215736481 VWZZMYFOMYROSW-UHFFFAOYSA-N 466.906 5.598 5 20 JKBD O=C(Cc1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1)NC[C@@H]1CCCO[C@H]1c1ccccc1 409559844 XVTPOKNVNISDML-IADCTJSHSA-N 496.567 5.274 5 20 JKBD COc1cc([C@H](C)NC(=O)Nc2ccc([N+](=O)[O-])cc2Cl)ccc1OCc1ccncc1 409753562 LSXYSXNCOYMDJU-AWEZNQCLSA-N 456.886 5.114 5 20 JKBD Cc1[nH]c2ccccc2c1C1CCN(C(=O)c2ccc(N[C@@H](C)c3ccccn3)c([N+](=O)[O-])c2)CC1 409891213 FAJFRTBWGMUQLR-SFHVURJKSA-N 483.572 5.972 5 20 JKBD CSc1ccc([N+](=O)[O-])c(C(=O)N[C@@H](C)c2ccc(NC(=O)Nc3ccccc3)cc2)c1 480803822 HFULYJWKYVJKBO-HNNXBMFYSA-N 450.520 5.452 5 20 JKBD COc1cc([C@H](C)NC(=O)c2cc([N+](=O)[O-])ccc2Sc2ccccc2)cc(OC)c1OC 482622898 GGTMRWBGDOMTHV-HNNXBMFYSA-N 468.531 5.263 5 20 JKBD O=C(Nc1ccc(Cl)c(-c2nnc3n2CCCCC3)c1)c1cc2cc([N+](=O)[O-])ccc2s1 484000582 CSVCQLQPTGRMTM-UHFFFAOYSA-N 467.938 5.700 5 20 JKBD O=C(Nc1cccc(CNC(=O)c2csc(-c3cccc([N+](=O)[O-])c3)n2)c1)c1ccc(F)cc1 496633885 VBJCTYUCDPEEQK-UHFFFAOYSA-N 476.489 5.040 5 20 JKBD Cc1cc([N+](=O)[O-])ccc1NC(=O)CSc1nc(NC(=O)c2ccccc2)c2c(C)c(C)oc2n1 501663075 JAGUNQRNXYUMMD-UHFFFAOYSA-N 491.529 5.039 5 20 JKBD CCOc1cc(NC(=O)c2ccccc2)c(OCC)cc1NC(=O)N[C@H](C)c1cccc([N+](=O)[O-])c1 509781043 JYVGVTMJPQIDQF-QGZVFWFLSA-N 492.532 5.527 5 20 JKBD CC(C)Oc1ccc([C@H](C)NC(=O)C2CCN(c3ccc(C(F)(F)F)cc3[N+](=O)[O-])CC2)cc1 518436771 KVBOFGFMLJRACI-INIZCTEOSA-N 479.499 5.495 5 20 JKBD Cc1ccc(-c2ccncc2)cc1NC(=O)Cc1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1 523859973 PVCGVSLZIGOGJG-UHFFFAOYSA-N 489.535 5.999 5 20 JKBD CN(CC(=O)NC(C)(C)C)C(=O)c1c2c(nc3ccccc13)/C(=C\c1ccc([N+](=O)[O-])cc1)CCC2 600840424 LACRJSCEVPHOPH-MNDPQUGUSA-N 486.572 5.007 5 20 JKBD CCOc1c(Br)cc(Cl)cc1NC(=O)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-] 603734932 RXJFNUWDVMQILD-UHFFFAOYSA-N 497.651 5.603 5 20 JKBD COc1ccc(CNC(=O)CCc2c(-c3ccc(F)cc3)[nH]c3ccc(F)cc23)cc1[N+](=O)[O-] 604017161 RQJJBMLIEOBJLX-UHFFFAOYSA-N 465.456 5.279 5 20 JKBD Cc1ccccc1-c1cc(NCc2cn(-c3ccccc3)nc2-c2ccc([N+](=O)[O-])cc2)n(CCO)n1 608982794 ZEASRLRTKVFHGH-UHFFFAOYSA-N 494.555 5.224 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Br)[C@H](Nc1ccc2c(c1)CCCO2)c1ccccc1 725843601 XBLIIZQVYJZHDH-JOCHJYFZSA-N 482.334 5.474 5 20 JKBD O=C(CSc1ccccc1C(=O)Nc1ccc([N+](=O)[O-])cc1F)NC1CCCCCCC1 726916159 NBFNNHUDVZOXMK-UHFFFAOYSA-N 459.543 5.307 5 20 JKBD Cc1ccc2nc(-c3cccnc3)cc(C(=O)O[C@@H](C)C(=O)Nc3ccc([N+](=O)[O-])cc3Cl)c2c1 730442107 RGUKWYNGYIJXHD-HNNXBMFYSA-N 490.903 5.351 5 20 JKBD C[C@H](OC(=O)c1csc(-c2ccc(Cl)c(Cl)c2)n1)C(=O)Nc1cccc([N+](=O)[O-])c1 744604860 LONIUMZDOHLTDM-JTQLQIEISA-N 466.302 5.209 5 20 JKBD Cc1cccc(NC(=O)Nc2cccc(CNC(=O)c3cc([N+](=O)[O-])ccc3Br)c2)c1 751093066 KDXVSALGAUJODR-UHFFFAOYSA-N 483.322 5.240 5 20 JKBD O=C(/C=C/c1ccc([N+](=O)[O-])cc1)N[C@H](C(=O)Nc1ccc(Br)cc1F)c1ccccc1 751231018 NVZCOFKXBUTWJP-SYZXBLONSA-N 498.308 5.006 5 20 JKBD Cc1nc2c(cnn2C(C)C)cc1C(=O)Nc1cc(Cl)c([N+](=O)[O-])cc1OCc1ccccc1 790166385 YAYFXUPUNWTCNU-UHFFFAOYSA-N 479.924 5.714 5 20 JKBD COc1cccc([C@@H](C)C(=O)O[C@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2ccccc2)c1 919733070 PHDIUFIAPXDZCI-QRQCRPRQSA-N 468.893 5.284 5 20 JKBD COC(=O)N(C)c1ccc(NC(=O)c2ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])c(OC)c2)cc1 919890992 XLKOEVBSNYJQDP-UHFFFAOYSA-N 485.880 5.504 5 20 JKBD C[C@H]1C[C@@H](C)CN(c2ccc(C(=O)O[C@@H](C)c3nnc(-c4ccccc4)o3)cc2[N+](=O)[O-])C1 921249396 FDINDSBFWRDNRB-BBWFWOEESA-N 450.495 5.045 5 20 JKBD O=C(CCC1CCCC1)Nc1ccc(C2(NC(=O)c3cc([N+](=O)[O-])cc4c3OCC4)CCC2)cc1 1787618078 AWYAZXHDFNUMFO-UHFFFAOYSA-N 477.561 5.248 5 20 JKBD C/C(=C\c1ccc(C)o1)C(=O)Nc1ccc(C2(NC(=O)Cc3cc([N+](=O)[O-])ccc3F)CCC2)cc1 1789580940 FJXBBSBXSCKLET-SAPNQHFASA-N 491.519 5.415 5 20 JKBD Cc1cc(C(=O)NC2(c3ccc(NC(=O)c4ccc(Cl)cc4)cc3)CCC2)ncc1[N+](=O)[O-] 1790296545 RSQFGIOBMQFULY-UHFFFAOYSA-N 464.909 5.013 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)[C@H]3CCCS3)CCC2)cc1)c1cc2cc([N+](=O)[O-])ccc2s1 1791009883 BTNCWLNYIVTTKR-HXUWFJFHSA-N 481.599 5.453 5 20 JKBD Cc1cc(Cl)cc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cc4cc([N+](=O)[O-])ccc4s2)C3)c1 1803640389 YUVOZZQEOFOQRG-REPLKXPHSA-N 483.977 5.337 5 20 JKBD CC(C)[C@H]1CC[C@H](C(=O)N2CCC([C@H]3CCCCN3C(=O)Cc3cccc([N+](=O)[O-])c3)CC2)CC1 1823681727 VEYINXFLXGCUQQ-QIGHUWCUSA-N 483.653 5.219 5 20 JKBD Cc1c(C(=O)N2CCC([C@H]3CCCCN3C(=O)[C@@H]3CCC(F)(F)C3)CC2)cc(Cl)cc1[N+](=O)[O-] 1823695446 IVZHMNUFMJZTNR-YLJYHZDGSA-N 497.970 5.225 5 20 JKBD C[C@H](Sc1ccccc1)C(=O)N1CCC([C@H]2CCCCN2C(=O)/C=C/c2ccc([N+](=O)[O-])o2)CC1 1824277467 ZBBJENQTYWGPRF-MAPOSKBOSA-N 497.617 5.002 5 20 JKBD CC1=CC[C@@H](C(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3c(F)ccc([N+](=O)[O-])c3C)CC2)CC1 1828351358 FEAKCXDESRQRHW-NFBKMPQASA-N 471.573 5.022 5 20 JKBD O=C(NCCCc1nc2ccccc2[nH]1)c1ccc(NCc2ccccc2Cl)c([N+](=O)[O-])c1 11486321 GOAYHOSVDYEOBQ-UHFFFAOYSA-N 463.925 5.099 5 20 JKBD COCCN(C(=O)CSc1ccc(Cl)cc1)c1nc(-c2ccc([N+](=O)[O-])cc2)cs1 14790442 RDTBQTXHQUNEQF-UHFFFAOYSA-N 463.968 5.143 5 20 JKBD C[C@@H](OC(=O)c1cc([N+](=O)[O-])ccc1NCc1ccccc1)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 16250741 LKOYJQWDRGXAPY-OAHLLOKOSA-N 489.444 5.083 5 20 JKBD Cc1csc(Sc2ccc(C(=O)O[C@H](C)C(=O)Nc3ccccc3Cl)cc2[N+](=O)[O-])n1 16903554 XBAFTKUDPDMLLM-GFCCVEGCSA-N 477.951 5.348 5 20 JKBD C[C@@H](Sc1nnc(-c2ccc(F)cc2)n1-c1ccccc1)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 17654904 LSUPDUORGCMUSS-OAHLLOKOSA-N 488.504 5.885 5 20 JKBD COc1cc(C(=O)NC[C@H](c2ccccc2OC)N(C)C)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 18011407 MHRKXYNTZVIJGG-HXUWFJFHSA-N 499.951 5.090 5 20 JKBD C[C@H](NC(=O)COC(=O)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1)c1cccs1 24772229 SVRGEUIIBLAJQB-ZDUSSCGKSA-N 460.895 5.136 5 20 JKBD COc1cc(C(=O)N[C@H](C)C(c2ccccc2)c2ccccc2)c([N+](=O)[O-])cc1OC(F)F 33178327 AXLNJOJIWBEXBM-OAHLLOKOSA-N 456.445 5.155 5 20 JKBD Cc1csc(Sc2ccc(C(=O)N3C[C@H](c4ccccc4)O[C@H](C)C3)cc2[N+](=O)[O-])n1 109044825 REYZKKYYXRLTKI-DNVCBOLYSA-N 455.561 5.113 5 20 JKBD CC(C)c1ccc(/C=C(/Cl)c2nnc(C(=O)NCc3ccc(F)cc3)s2)cc1[N+](=O)[O-] 215734046 YYSZQGKZSKRFNB-RQZCQDPDSA-N 460.918 5.376 5 20 JKBD C[C@H](Nc1ccc(NC(=O)c2ccc(N[C@@H](C)c3ccccn3)c([N+](=O)[O-])c2)cc1)c1ccccc1 302974691 DRFGUQUGAVJXTF-PMACEKPBSA-N 481.556 6.588 5 20 JKBD C[C@H](Nc1ccc(C(=O)Nc2ccccc2NCC(F)(F)F)cc1[N+](=O)[O-])c1ccccn1 303010473 QQAGHQXHNIPJOZ-AWEZNQCLSA-N 459.428 5.389 5 20 JKBD Cc1nn(Cc2ccc(C(=O)Nc3cc(C(F)(F)F)ccc3N3CCCC3)cc2)c(C)c1[N+](=O)[O-] 499131788 GIPRDXZUZGEQDK-UHFFFAOYSA-N 487.482 5.328 5 20 JKBD Cc1nn(Cc2ccc(C(=O)Nc3cccc(COCC(F)(F)C(F)F)c3)cc2)c(C)c1[N+](=O)[O-] 502135197 FOAWLNZTMZMJDA-UHFFFAOYSA-N 494.445 5.126 5 20 JKBD COc1ccc2cc(CN(C)C(=O)c3ccc(N[C@H](C)c4ccccn4)c([N+](=O)[O-])c3)ccc2c1 506029865 GCWALSBUXLFYAL-GOSISDBHSA-N 470.529 5.597 5 20 JKBD COc1cc(C(=O)N[C@H](CC(C)(C)C)c2ccccc2)c([N+](=O)[O-])cc1OCc1cscn1 512338441 MHKOGLVPFDZAIV-LJQANCHMSA-N 469.563 5.546 5 20 JKBD CC[C@@H](NC(=O)c1cc(OC)c(OCc2cscn2)cc1[N+](=O)[O-])c1cccc(Cl)c1 512402424 AAXTYYFISQHQNU-QGZVFWFLSA-N 461.927 5.173 5 20 JKBD COCCN(C(=O)c1cnn(-c2cccc(Cl)c2)c1C)c1nc(-c2ccc([N+](=O)[O-])cc2)cs1 603514420 YOCDIJUSWQKEBQ-UHFFFAOYSA-N 497.964 5.159 5 20 JKBD O=C(N[C@@H](CC(=O)N(Cc1ccccc1[N+](=O)[O-])CC(F)(F)F)c1ccccc1)c1ccccc1 603742220 PYDSVAVGNZYZHR-NRFANRHFSA-N 485.462 5.047 5 20 JKBD Cc1ccc(NC(=O)c2ccc(NCc3ccc(NC(=O)NC(C)C)cc3)c([N+](=O)[O-])c2)cc1 608972975 OAZQHYPXYLSCFB-UHFFFAOYSA-N 461.522 5.298 5 20 JKBD Cc1csc(Sc2ccc(C(=O)Nc3cccc([C@H](C)N4CCOCC4)c3)cc2[N+](=O)[O-])n1 609182739 FBUXQZCTHYWWMP-INIZCTEOSA-N 484.603 5.156 5 20 JKBD COc1cc(CNCc2ccc(-c3ccc([N+](=O)[O-])cc3Br)o2)ccc1OC(C)C 726607222 JFOKYTPVOMRFMG-UHFFFAOYSA-N 475.339 5.703 5 20 JKBD O=C(Nc1ccc(F)cc1-c1ccc(Cl)cc1)[C@@H]1CC(=O)N(c2ccc(F)c([N+](=O)[O-])c2)C1 728484460 NADWOCGZOPUDKR-CQSZACIVSA-N 471.847 5.185 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])c(Cl)c1)c1cnn(-c2ncccc2Cl)c1C(F)(F)Cl 730970222 VBAAUYTWWZQRMV-UHFFFAOYSA-N 462.627 5.023 5 20 JKBD CCOc1c(Br)cc(Cl)cc1NC(=O)c1cc([N+](=O)[O-])c(C)c([N+](=O)[O-])c1C 748619069 SUYSIBPHOVADLS-UHFFFAOYSA-N 472.679 5.187 5 20 JKBD O=C(CC12C[C@H]3C[C@@H](CC(O)(C3)C1)C2)O[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1 750507769 JHRYURCYFITVAH-JOTUPZIKSA-N 498.963 5.193 5 20 JKBD O=C(COC(=O)/C(=C/c1ccc(F)cc1)c1cccs1)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 772144375 BMXQXBZJQMMVRZ-MHWRWJLKSA-N 494.422 5.537 5 20 JKBD COCCN(C(=O)c1cc2ccccc2c(Cl)n1)c1nc(-c2ccc([N+](=O)[O-])cc2)cs1 914770569 QWTRGGDLVZCKBP-UHFFFAOYSA-N 468.922 5.213 5 20 JKBD COc1ccc(S[C@H](C)C(=O)Oc2ccc(NC(=O)c3cc([N+](=O)[O-])ccc3Cl)cc2)cc1 916952012 NHCLHWRDKKNSTA-CQSZACIVSA-N 486.933 5.595 5 20 JKBD CCC(C)(C)NC(=O)c1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2N2CCCCC2)cc1Cl 917760546 FOQNLLIDASKWDV-UHFFFAOYSA-N 472.973 5.409 5 20 JKBD 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5.225 5 20 JKBD Cc1cccc([N+](=O)[O-])c1NC(=O)COC(=O)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1 21155023 LHONXPCKGCLUJU-UHFFFAOYSA-N 485.836 5.053 5 20 JKBD Cc1ccccc1NC(=O)Cc1nc(COc2ccc([N+](=O)[O-])cc2C(F)(F)F)cs1 72048586 ZBHLOYAKCXSHSC-UHFFFAOYSA-N 451.426 5.139 5 20 JKBD O=C(Nc1ccccc1Oc1ncc(Cl)cc1Cl)c1ccc(NC2CC2)c([N+](=O)[O-])c1 107810938 YRINJFGVILXFSD-UHFFFAOYSA-N 459.289 5.916 5 20 JKBD O=C(NC[C@@H]1CCCO1)c1cccc(CNCc2ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])cc2)c1 302955790 CZJUSGXMIHMACB-QHCPKHFHSA-N 495.963 5.239 5 20 JKBD C[C@H](Nc1ccc(C(=O)NCc2ccc(CN3CCCCCC3)cc2)cc1[N+](=O)[O-])c1ccccn1 303030042 XAYWEEZRADAJKP-NRFANRHFSA-N 487.604 5.469 5 20 JKBD Cc1ccc(NC(=O)[C@@H](Sc2nnc(C)n2CCc2cccs2)c2ccccc2)c([N+](=O)[O-])c1 303145687 FFLKWEWFQQYYJU-QFIPXVFZSA-N 493.614 5.579 5 20 JKBD CCOc1cc(C(=O)Nc2c(C)c(C(C)(C)C)nn2-c2ccccc2)c([N+](=O)[O-])cc1OC 410028682 HHNDTXKZUIZEIU-UHFFFAOYSA-N 452.511 5.046 5 20 JKBD CC(=O)Nc1ccc(C)c(NC(=O)C/C(=C\c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)c1 479116624 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Cc1ccc(Sc2ccc(C(=O)Nc3ccccc3N3CCC(O)CC3)cc2[N+](=O)[O-])cc1 517475937 FSWSEMTZRLEYJJ-UHFFFAOYSA-N 463.559 5.268 5 20 JKBD CC(=O)Nc1ccc(C(F)(F)F)cc1NC(=O)c1ccc(N2C[C@@H](C)C[C@@H](C)C2)c([N+](=O)[O-])c1 521239566 WRSOBBUEAHUQSF-OKILXGFUSA-N 478.471 5.307 5 20 JKBD COc1cc(/C=C(/CCC(=O)O)c2nc3ccccc3s2)c([N+](=O)[O-])cc1OCC(F)(F)F 557517306 IWJJJBRIZBVEIT-WQLSENKSSA-N 482.436 5.560 5 20 JKBD CC(=O)Nc1ccc(NC(=O)c2ccc(N3CCC[C@@H](C)C3)c([N+](=O)[O-])c2)c(C(F)(F)F)c1 590766436 AXAUECQVEMTIBE-CYBMUJFWSA-N 464.444 5.061 5 20 JKBD C[C@@H]1CCCCN1CC(=O)Nc1ccc(F)c(NCc2ccc(C(F)(F)F)cc2[N+](=O)[O-])c1 600857800 SYEHIVDCEIFIQI-CQSZACIVSA-N 468.451 5.178 5 20 JKBD COc1ccc(CN(C)C(=O)C/C(=C\c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)cc1 603463845 KJZCKEUOBOORII-HMMYKYKNSA-N 473.554 5.802 5 20 JKBD CC(C)n1ncc2c(C(=O)Nc3cc([N+](=O)[O-])ccc3OC(F)F)cc(-c3cccs3)nc21 603638145 DJAHWCWZULZGKW-UHFFFAOYSA-N 473.461 5.503 5 20 JKBD C[C@@H](Nc1ccc(C(=O)NCc2cccc(OCc3ccccn3)c2)cc1[N+](=O)[O-])c1ccccn1 604309114 POKYXXFMMWMINT-LJQANCHMSA-N 483.528 5.067 5 20 JKBD O=C(Nc1ccc(CN2C(=O)Cc3ccc(Cl)cc32)cc1)c1c[nH]c2ccc([N+](=O)[O-])cc12 604550659 UVMRPUTXIQXSKH-UHFFFAOYSA-N 460.877 5.071 5 20 JKBD Cc1ncc([N+](=O)[O-])cc1C(=O)Nc1nnc(SCc2c(Cl)cccc2Cl)s1 604560290 OHTMYWLDUALJCX-UHFFFAOYSA-N 456.336 5.001 5 20 JKBD Cc1ccc(NC(=O)c2ccc(N[C@@H](c3ccccc3F)c3nccn3C)c([N+](=O)[O-])c2)cc1 608971336 ICOPNFIKXAVBGW-QHCPKHFHSA-N 459.481 5.230 5 20 JKBD CC[C@@H](NC(=O)N1CCN(Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)CC1)c1nc(C)cs1 609213691 CEIQTSMLFIILBQ-LJQANCHMSA-N 485.635 5.067 5 20 JKBD CCOc1ccc(S(=O)(=O)N(CC)CC)cc1NC(=O)c1cc2ccccc2c2cccnc12 642518055 QUNYEWAPGBKIDJ-UHFFFAOYSA-N 477.586 5.070 5 20 JKBD COc1ccc(Br)cc1-c1nc(COC(=O)c2cc(F)c(F)cc2[N+](=O)[O-])cs1 725934729 HTNCYKKGRXYTDH-UHFFFAOYSA-N 485.262 5.125 5 20 JKBD C[C@H](NCc1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1)c1ccc(N2CCOC2=O)cc1 726607422 URIILSLDEHPSFR-IBGZPJMESA-N 483.528 5.255 5 20 JKBD C[C@@H](Oc1ccccc1Cc1ccccc1)C(=O)O[C@H](C)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 728352030 WGAGZJDOOHGLNN-QZTJIDSGSA-N 473.485 5.307 5 20 JKBD O=C(Nc1ccc(OC(=O)c2cc(F)c(Cl)nc2Cl)cc1)c1cc([N+](=O)[O-])ccc1Cl 728800625 JHLUYQJTIOKDES-UHFFFAOYSA-N 484.654 5.561 5 20 JKBD CC(C)[C@H](OC(=O)c1csc(-c2cccc([N+](=O)[O-])c2)n1)C(=O)Nc1cc(Cl)ccc1Cl 747960848 CUFFUDBGDDFALK-SFHVURJKSA-N 494.356 5.845 5 20 JKBD Cc1ccccc1OCCCC(=O)Nc1ccc(CNC(=O)c2cc([N+](=O)[O-])ccc2Cl)cc1 916076959 FXXLDEORKNXZQH-UHFFFAOYSA-N 481.936 5.284 5 20 JKBD CC(=O)N(c1ccc(Cl)cc1)c1nc(COC(=O)CSc2ccccc2[N+](=O)[O-])cs1 918834211 PSTVKQMVOYMPAR-UHFFFAOYSA-N 477.951 5.225 5 20 JKBD COc1ccc(COC(=O)c2cc(-c3cccs3)nc3c2cnn3C(C)C)cc1[N+](=O)[O-] 918928884 INMJCZCVLLBMFN-UHFFFAOYSA-N 452.492 5.015 5 20 JKBD COc1cc(C(=O)N2CCCc3cc(C(C)C)ccc32)c([N+](=O)[O-])cc1OCc1cscn1 920000294 ONIODWCGUQMREA-UHFFFAOYSA-N 467.547 5.355 5 20 JKBD O=C(Nc1ccc(OC(=O)c2cccnc2SC(F)F)cc1)c1cc([N+](=O)[O-])ccc1Cl 921192531 RNOQQUAQTMATHI-UHFFFAOYSA-N 479.848 5.429 5 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O=C(c1cc(F)cc([N+](=O)[O-])c1)N1CCC([C@H]2CCCCN2C(=O)c2cc(F)cc(Cl)c2)CC1 1832630223 ZPRJWFAPLAOWBG-JOCHJYFZSA-N 491.922 5.074 5 20 JKBD O=C(/C=C/c1cccs1)N1CCC([C@H]2CCCCN2C(=O)/C=C/c2ccccc2[N+](=O)[O-])CC1 1832906969 KHLQBVUQVOYCPN-GQNLSCDNSA-N 479.602 5.003 5 20 JKBD c1ccc([C@@H]2COC(c3cccc4cc5cccc(C6=N[C@H](c7ccccc7)CO6)c5nc34)=N2)cc1 1988187965 CPMLUNQRNAZSRL-SVBPBHIXSA-N 469.544 6.424 5 20 JKBD CC(=O)N(c1ccccc1)c1nc(COc2ccc([N+](=O)[O-])cc2Cc2ccccc2)cs1 10806236 DIHSNUPFINLUAH-UHFFFAOYSA-N 459.527 5.906 5 20 JKBD O=C(Nc1cc2c(cc1[N+](=O)[O-])OCCCO2)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 10963754 COHVCLAOFYZURW-UHFFFAOYSA-N 450.291 5.046 5 20 JKBD CC(C)n1ncc2c(C(=O)O[C@@H](C)C(=O)Nc3cc([N+](=O)[O-])ccc3Cl)cc(-c3ccco3)nc21 11043280 NDHWXCGKEZILQK-ZDUSSCGKSA-N 497.895 5.018 5 20 JKBD Cc1nc(CSc2ccc(C(=O)O[C@@H](C)c3nnc(-c4ccc([N+](=O)[O-])cc4)o3)cc2)cs1 11701917 SZTFMGYBIRWVQO-ZDUSSCGKSA-N 482.543 5.620 5 20 JKBD CSc1ccc(C(=O)O[C@@H](C)C(=O)Nc2ccc(Cl)cc2C(F)(F)F)cc1[N+](=O)[O-] 16913342 RTXTVLZPZARBEC-VIFPVBQESA-N 462.833 5.173 5 20 JKBD C[C@H](OC(=O)c1ccc(Br)c([N+](=O)[O-])c1)C(=O)Nc1ccc(Cl)cc1C(F)(F)F 16927556 FUCNEWBPXBIVHC-QMMMGPOBSA-N 495.635 5.214 5 20 JKBD O=C(COC(=O)c1ccc(Br)c([N+](=O)[O-])c1)Nc1cc(Cl)c(Cl)cc1Cl 22701391 JTBMNHCGTYXGHQ-UHFFFAOYSA-N 482.501 5.113 5 20 JKBD CS(=O)(=O)c1cccc(NC(=O)C/C(=C/c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)c1 25891768 ZQMVAQZHBQFJJD-LGMDPLHJSA-N 493.566 5.177 5 20 JKBD CCn1c(S[C@@H](C(=O)Nc2ccc(C)cc2[N+](=O)[O-])c2ccccc2)nc2ccsc2c1=O 27819959 DWLHGOINPGDFHD-LJQANCHMSA-N 480.571 5.167 5 20 JKBD CC(=O)N(c1nc(COc2ccc(Cl)cc2[N+](=O)[O-])cs1)c1c(C)cc(C)cc1Cl 31708205 ZHBBNXRMECNYFC-UHFFFAOYSA-N 466.346 6.239 5 20 JKBD COc1ccc([N+](=O)[O-])cc1NC(=O)[C@@H]1CCC(=O)N(c2ccc(C)cc2)[C@H]1c1cccs1 104798100 LZABILXCIFJYCL-WZONZLPQSA-N 465.531 5.096 5 20 JKBD CN(CCOc1ccccc1Cl)C(=O)c1ccccc1NC(=O)c1ccc([N+](=O)[O-])cc1Cl 139706197 XUFDTBMWAFTDGW-UHFFFAOYSA-N 488.327 5.305 5 20 JKBD Cc1ccc(C(=O)N2C[C@@H](C)C[C@@H](C)C2)cc1NC(=O)c1cc2ccccc2c2cccnc12 302949464 JVJVPCLBNXEGIZ-KDURUIRLSA-N 451.570 6.067 5 20 JKBD CCCCCC(=O)NC1CCN(C(=O)c2ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])cc2)CC1 498446544 UNWBWRNLVYSNHU-UHFFFAOYSA-N 473.957 5.342 5 20 JKBD CC(=O)N1CCCc2cc(N[C@H](C(=O)Nc3ccc([N+](=O)[O-])cc3Cl)c3ccccc3)ccc21 501978335 FQNPEYVCHVSKEO-DEOSSOPVSA-N 478.936 5.339 5 20 JKBD CCOc1ccc(-n2c(SCc3c(F)cccc3[N+](=O)[O-])nnc2-c2cccnc2)cc1 504519046 RBFNGOGADFBBTN-UHFFFAOYSA-N 451.483 5.068 5 20 JKBD CC(C)N(CC(=O)Nc1ccc(Cl)cc1C(F)(F)F)C(=O)c1ccc(Cl)cc1[N+](=O)[O-] 505381093 COHDQFTVICOTRE-UHFFFAOYSA-N 478.254 5.410 5 20 JKBD O=C(NCc1ccnc(-n2cccn2)c1)c1ccccc1Sc1ccc(C(F)(F)F)cc1[N+](=O)[O-] 505583044 YBCSOHPNEKCEAC-UHFFFAOYSA-N 499.474 5.276 5 20 JKBD C[C@H](Nc1ccc(C(=O)N[C@@H](C)c2ccccc2OC(F)F)cc1[N+](=O)[O-])c1ccccn1 506190394 MQKAXNKAXXEFJS-GJZGRUSLSA-N 456.449 5.255 5 20 JKBD COc1cc(C(=O)N[C@H]2CCCC[C@@H]2c2ccccc2)c([N+](=O)[O-])cc1OCc1cscn1 512748706 JUMXHPFQACACQR-QUCCMNQESA-N 467.547 5.095 5 20 JKBD NC(=O)c1ccc(F)c(NC(=O)c2c3c(nc4ccccc24)/C(=C/c2cccc([N+](=O)[O-])c2)CCC3)c1 515297648 GFRRDSNQJFYODY-GHRIWEEISA-N 496.498 5.510 5 20 JKBD COc1c(F)cc(NC(=O)c2ccccc2C(=O)c2ccc(SC)c([N+](=O)[O-])c2)cc1F 515731854 SOCGBBYLXAFMKO-UHFFFAOYSA-N 458.442 5.087 5 20 JKBD Cn1cc([C@@H]2Nc3ccccc3C(=O)N2c2ccc(F)cc2Cl)c(-c2ccc([N+](=O)[O-])cc2)n1 516370339 ODHBMNGDWAGSHK-HSZRJFAPSA-N 477.883 5.559 5 20 JKBD O=[N+]([O-])c1cccc(-c2ccc(CNCc3ccnc(N4CCN(c5ccc(F)cc5)CC4)c3)o2)c1 518403488 GWLHWIRCJBFSNR-UHFFFAOYSA-N 487.535 5.005 5 20 JKBD O=C(Cn1c2ccccc2c(=O)c2ccccc21)N(Cc1cccc(Br)c1)C1CC1 519166714 DVAINFBVURONFY-UHFFFAOYSA-N 461.359 5.108 5 20 JKBD NC(=O)c1cccc(NC(=O)c2c3c(nc4ccccc24)/C(=C/c2cccc([N+](=O)[O-])c2)CCC3)c1 600840799 ZJLODALKIYHFEU-NBVRZTHBSA-N 478.508 5.371 5 20 JKBD CCOc1cc(NC(=O)NC2C[C@@H](C(F)(F)F)C[C@H](C(F)(F)F)C2)c([N+](=O)[O-])cc1OCC 603651022 ZVUWOJQGTVAPPI-QWRGUYRKSA-N 487.397 5.423 5 20 JKBD C[C@H](NC(=O)Nc1cc(OCC(F)(F)F)cc(OCC(F)(F)F)c1)c1cccc([N+](=O)[O-])c1 603827160 CXIVKESEEYPRHS-NSHDSACASA-N 481.349 5.360 5 20 JKBD CC(C)Oc1ccccc1CN[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1 604048070 ZWDOUASNICZBEF-QHCPKHFHSA-N 453.926 5.505 5 20 JKBD COCCOc1cc([N+](=O)[O-])c(C(=O)Nc2ccc(Sc3cc(C)ccc3C)cc2)cc1OC 619564670 USXGELDQOYMNIT-UHFFFAOYSA-N 482.558 5.649 5 20 JKBD CCSc1ccc(C(=O)Oc2ccc(NC(=O)c3cc([N+](=O)[O-])ccc3Cl)cc2)cn1 727787581 POGHAXUMCRAUDM-UHFFFAOYSA-N 457.895 5.227 5 20 JKBD CC(=O)N1C=Cc2ccccc2[C@H]1CC(=O)Oc1ccc2c(-c3ccc([N+](=O)[O-])cc3)cc(=O)oc2c1 728022095 LYNIYCNQRRHQSR-RUZDIDTESA-N 496.475 5.238 5 20 JKBD CC(=O)N(c1ccc(Cl)c(Cl)c1)c1nc(COC(=O)c2cc([N+](=O)[O-])cnc2C)cs1 730014503 CAXMTPZFBXOFHC-UHFFFAOYSA-N 481.317 5.103 5 20 JKBD CCOc1cc([N+](=O)[O-])c(C(=O)Nc2scc(-c3ccccc3Cl)c2C(=O)OC)cc1OC 750871379 KHBZZEGBWYDIGR-UHFFFAOYSA-N 490.921 5.423 5 20 JKBD CC(=O)N(c1nc(COC(=O)CCOc2cccc([N+](=O)[O-])c2)cs1)c1c(C)cc(C)cc1C 915448922 SQNQBUJBPWRMGJ-UHFFFAOYSA-N 483.546 5.173 5 20 JKBD CC(C)(C)C[C@@H](NC(=O)COC(=O)Cn1c2ccccc2c(=O)c2ccccc21)c1ccc(F)cc1 919056039 SOGNMKCZHCOXRK-HSZRJFAPSA-N 488.559 5.131 5 20 JKBD COc1ccc(NC(=O)[C@H](OC(=O)c2cc([N+](=O)[O-])c(C)c([N+](=O)[O-])c2)c2ccccc2)cc1Cl 919228140 DRISPAXOHRMSGA-OAQYLSRUSA-N 499.863 5.010 5 20 JKBD COc1cc(-c2ccccc2)sc1C(=O)OCC(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 919459456 GPEHUQCSYJKRCH-UHFFFAOYSA-N 480.420 5.146 5 20 JKBD COc1ccc(CSCC(=O)Oc2ccc3ccc(C(F)(F)F)nc3c2)cc1[N+](=O)[O-] 920799755 TZPZXKHSDUJQSR-UHFFFAOYSA-N 452.410 5.009 5 20 JKBD CC(=O)N(c1ccc(Cl)c(Cl)c1)c1nc(COC(=O)c2cc(C)cc([N+](=O)[O-])c2)cs1 920900316 JEKQRUVLOOKHFN-UHFFFAOYSA-N 480.329 5.708 5 20 JKBD O=C(NC1(c2ccc(NC(=O)[C@@H]3C[C@H]3c3ccc(F)c(F)c3)cc2)CCC1)c1ccc([N+](=O)[O-])o1 1786174885 NYMXZKRMEINZDG-ZWKOTPCHSA-N 481.455 5.017 5 20 JKBD Cc1ccc(CC(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2sc3ccccc3c2Cl)cc1[N+](=O)[O-] 1797463434 XSDSOYDYIMQXDE-BCDXTJNWSA-N 498.004 5.266 5 20 JKBD CC[C@@H](C)[C@H](C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1c(F)ccc([N+](=O)[O-])c1C)c1ccccc1 1800699132 IICJCOZJAGBHCB-ZVQINVJOSA-N 481.568 5.124 5 20 JKBD Cc1oc(C(C)(C)C)cc1C(=O)Nc1cc([C@H]2CCCCN2C(=O)Cc2cccc([N+](=O)[O-])c2)[nH]n1 1816461957 GMGXFRCQDOSUHE-OAQYLSRUSA-N 493.564 5.065 5 20 JKBD Cc1c(Cl)cccc1C(=O)N1CCC([C@H]2CCCCN2C(=O)/C=C/c2ccc([N+](=O)[O-])o2)CC1 1824275683 GFAQXOJPVVNQDI-DQACCSDVSA-N 485.968 5.096 5 20 JKBD CC[C@H](C)CC(=O)N1CCC([C@H]2CCCCN2C(=O)c2cccc([N+](=O)[O-])c2Br)CC1 1830516489 FESPWIUYKPAIIC-QFBILLFUSA-N 494.430 5.027 5 20 JKBD CN(C)c1ccc([N+](=O)[O-])cc1C(=O)N1CCCC[C@H]1C1CCN(C(=O)/C=C/C2CCCCC2)CC1 1830767034 AMLROQLBTFFPFU-MYILAFDMSA-N 496.652 5.031 5 20 JKBD Cc1cccc(Nc2nnc(S[C@H](C)C(=O)Nc3ccc([N+](=O)[O-])cc3C(F)(F)F)s2)c1C 10211197 BAOYMIPMYXQWDB-GFCCVEGCSA-N 497.524 5.945 5 20 JKBD CCc1ccc(N(C(C)=O)c2nc(COC(=O)c3ccc(NC4CC4)c([N+](=O)[O-])c3)cs2)cc1 11226981 SSFJTHXRBVCJBF-UHFFFAOYSA-N 480.546 5.230 5 20 JKBD CC(C)OCc1c(C(=O)O[C@H](C)C(=O)Nc2cc([N+](=O)[O-])ccc2Cl)oc2ccccc12 11242222 YOHIQKFGOFSXME-CYBMUJFWSA-N 460.870 5.103 5 20 JKBD CCC(=O)c1ccc(Oc2ccc(S(=O)(=O)N(CC)c3ccccc3)cc2[N+](=O)[O-])cc1 15208993 IGKRUGLMYUGRRM-UHFFFAOYSA-N 454.504 5.195 5 20 JKBD O=C(OCc1cc([N+](=O)[O-])cc2c1OCOC2)c1ccc(Oc2ccc(C(F)(F)F)cn2)cc1 16169045 JJLUJPIDKYKUDY-UHFFFAOYSA-N 476.363 5.024 5 20 JKBD Cc1ccc(NC(=O)[C@@H](C)Sc2nc3cc4ccccc4cc3c(=O)n2C)c(Br)c1 18591173 HCTLNSGNUKSNEK-CQSZACIVSA-N 482.403 5.277 5 20 JKBD CCOc1ccc([C@@H](C)NC(=O)C2CCN(c3ccc(C(F)(F)F)cc3[N+](=O)[O-])CC2)cc1 24830339 AJXQKYQBKGZAFS-OAHLLOKOSA-N 465.472 5.106 5 20 JKBD C[C@@H](OC(=O)CCc1ccc(-c2ccccc2)o1)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 26254043 XVMQJZWYUUNACL-CQSZACIVSA-N 476.407 5.377 5 20 JKBD C[C@H](NC(=O)CSc1ccc(C(F)(F)F)cc1[N+](=O)[O-])c1ccc(OCc2cccnc2)cc1 46774411 ULKVTMRLDUWMPL-HNNXBMFYSA-N 491.491 5.557 5 20 JKBD Cc1cc(NC(=O)c2cc([N+](=O)[O-])cc([N+](=O)[O-])c2C)n(-c2cc(C(F)(F)F)ccc2Cl)n1 71815580 COOWJGMLMSRQTQ-UHFFFAOYSA-N 483.790 5.230 5 20 JKBD C[C@@H]1CN(c2ccc(NC(=O)CSc3ccc(C(F)(F)F)cc3[N+](=O)[O-])cc2F)C[C@@H](C)O1 107963854 XSCSBMLBVXXUOC-CHWSQXEVSA-N 487.475 5.097 5 20 JKBD CCCCCn1nc(C(=O)Nc2nc(-c3cccc([N+](=O)[O-])c3)c(C)s2)c2ccccc2c1=O 195703808 AAPWUSPRORXHPB-UHFFFAOYSA-N 477.546 5.179 5 20 JKBD Cn1cnnc1Sc1ccc(C(=O)Nc2ccc(F)cc2-c2ccc(Cl)cc2)cc1[N+](=O)[O-] 485784729 LASXPAANPIOKNK-UHFFFAOYSA-N 483.912 5.586 5 20 JKBD O=C([C@H]1C[C@H]1c1ccc(Br)cc1)N(Cc1ccccc1[N+](=O)[O-])CC(F)(F)F 499379733 VEVXWNNMXIHWKF-HOTGVXAUSA-N 457.246 5.052 5 20 JKBD CN(CCCCCc1cc(-c2cccc(F)c2)no1)C(=O)c1csc(-c2ccc([N+](=O)[O-])cc2)n1 499703255 COLHQZILVSOTJN-UHFFFAOYSA-N 494.548 5.997 5 20 JKBD CCOc1cc([N+](=O)[O-])c(C(=O)Nc2sc3c(c2-c2nc4ccccc4[nH]2)CCCC3)cc1OC 506767340 MRZGFBZZGFKDPU-UHFFFAOYSA-N 492.557 5.738 5 20 JKBD CCN(Cc1ccc(-c2ccc(C(F)(F)F)cc2)o1)C(=O)c1ccc(-n2cncn2)c([N+](=O)[O-])c1 509730876 UTHLPZVVGBJZCO-UHFFFAOYSA-N 485.422 5.117 5 20 JKBD COc1ccccc1Oc1ccc(NC(=O)c2ccc(Cn3nc(C)c([N+](=O)[O-])c3C)cc2)cc1F 510270651 NLOULHPEDKSAGW-UHFFFAOYSA-N 490.491 5.649 5 20 JKBD O=C(Nc1ccccc1OC[C@@H]1CCCCO1)c1cc([N+](=O)[O-])ccc1NCc1ccccc1 511400631 WVQJCFQHZIWADA-NRFANRHFSA-N 461.518 5.407 5 20 JKBD Cc1ccc(Sc2ccc(NC(=O)c3cc([N+](=O)[O-])cc(S(C)(=O)=O)c3)cc2)cc1C 517868757 JKJKWPUZXFWXNE-UHFFFAOYSA-N 456.545 5.019 5 20 JKBD Cc1nc(NC(=O)c2cc3cc([N+](=O)[O-])ccc3o2)sc1-c1nc2ccccc2n1C(F)F 518227632 LWKDLKXWFFXFKR-UHFFFAOYSA-N 469.429 5.770 5 20 JKBD O=C(Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1)[C@@H]1C[C@H]2CCCC[C@H]2N1C(=O)c1ccccc1 524290498 RCIXJFYVQKDOMF-QIJUGHKUSA-N 476.558 5.130 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1F)c1cc2cc(Br)cc(Br)c2o1 549709236 VOKSJNGTZVUXCH-UHFFFAOYSA-N 458.037 5.257 5 20 JKBD NC(=O)c1cccc2c1CCCN2C(=O)c1ccc(Sc2nc3ccccc3s2)c([N+](=O)[O-])c1 603741020 DLQLPPOBPNONOA-UHFFFAOYSA-N 490.566 5.048 5 20 JKBD Cc1occc1C(=O)Nc1cc(NC(=O)c2ccc(N3C[C@H](C)C[C@@H](C)C3)c([N+](=O)[O-])c2)ccc1F 603896574 IWMPWVHYLVTUHN-HZPDHXFCSA-N 494.523 5.622 5 20 JKBD CC1CCN(c2ccc(C(=O)Nc3ccc(C(=O)N4CCCC[C@H]4C)cc3)cc2[N+](=O)[O-])CC1 603993044 JRUIIUWBRIWQLQ-LJQANCHMSA-N 464.566 5.098 5 20 JKBD COc1cc(C(=O)N(C)c2ccccc2-c2ccccc2)c([N+](=O)[O-])cc1OCc1cscn1 604446269 PXPKWYKRNQZUCN-UHFFFAOYSA-N 475.526 5.583 5 20 JKBD COc1ccc(NC(=O)C/C(=C\c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)c(OC)n1 604471711 STQXYLQUMVPOQP-DTQAZKPQSA-N 476.514 5.186 5 20 JKBD COc1ccc(C[C@H](N[C@@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)c2ccccc2)cc1OC 608980682 FUHKKUDKTRQANV-JTSKRJEESA-N 474.517 5.297 5 20 JKBD Cc1ccccc1-c1nc(C(=O)N2CCN(c3ccc([N+](=O)[O-])cc3C(F)(F)F)CC2)cs1 727330792 WXQUHEGBFADFEW-UHFFFAOYSA-N 476.480 5.008 5 20 JKBD COc1ccc(NC(=O)c2cc(F)c(F)cc2[N+](=O)[O-])cc1OCc1ccc2ccccc2n1 728009161 RRODRBUTJCXJQK-UHFFFAOYSA-N 465.412 5.261 5 20 JKBD Cc1noc([C@H]2CCCN(C(=O)CCC(=O)c3ccc4ccc5cccc6ccc3c4c56)C2)n1 729259971 SUDASBQPHPXVQL-NRFANRHFSA-N 451.526 5.645 5 20 JKBD Cc1c(COC(=O)c2cnn(-c3ncc(C(F)(F)F)cc3Cl)c2C(F)F)cccc1[N+](=O)[O-] 731101468 BOGSOHQKOQVVKS-UHFFFAOYSA-N 490.772 5.451 5 20 JKBD O=C(O[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1)c1csc(C2CC2)n1 747506033 BYPPSCYDGSLJIB-GOSISDBHSA-N 457.895 5.119 5 20 JKBD C[C@@H](OC(=O)c1csc(-c2cccc([N+](=O)[O-])c2)n1)C(=O)Nc1ccc(Cl)c(C(F)(F)F)c1 747962409 OQHGBKMYVCWNCJ-SNVBAGLBSA-N 499.854 5.575 5 20 JKBD O=C(N[C@@H]1C[C@@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1)c1cc([N+](=O)[O-])ccc1N1CCCCC1 914743882 NLHVCNTVDMKESV-WDNDVIMCSA-N 467.410 5.224 5 20 JKBD CC(C)(C)Cc1noc2nc(C3CC3)cc(C(=O)OCC(=O)Nc3ccc([N+](=O)[O-])cc3Cl)c12 915581257 IHLXBZSPKHYTFX-UHFFFAOYSA-N 486.912 5.046 5 20 JKBD O=C(Nc1ccc(Cl)c([N+](=O)[O-])c1)C(=O)NC(c1ccc(Cl)cc1)c1ccc(Cl)cc1 918445879 DKQARRCAVWGGLB-UHFFFAOYSA-N 478.719 5.399 5 20 JKBD Cc1cccc(/C=C/C(=O)Nc2ccc(C3(NC(=O)/C=C/c4ccccc4[N+](=O)[O-])CCC3)cc2)n1 1785827504 VLPHVVMZTMFAPJ-AMRBXKIKSA-N 482.540 5.159 5 20 JKBD CCc1ncsc1C(=O)Nc1ccc(C2(NC(=O)/C=C/c3ccccc3[N+](=O)[O-])CCC2)cc1 1790200554 JTOWIPIPNAYBGH-MDWZMJQESA-N 476.558 5.075 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)c3cc(-c4ccccc4)on3)CCC2)cc1)c1cc(O)cc([N+](=O)[O-])c1 1790755008 BXKJAUDFGZWNJI-UHFFFAOYSA-N 498.495 5.017 5 20 JKBD CCCCC[C@H](C)C(=O)N1CCC([C@@H]2CCCCN2C(=O)Cc2cc([N+](=O)[O-])ccc2F)CC1 1824950084 XALBWJZINLCRTQ-CYFREDJKSA-N 475.605 5.113 5 20 JKBD O=C(/C=C/c1ccccc1[N+](=O)[O-])N1CCC([C@H]2CCCCN2C(=O)c2cc3ccoc3s2)CC1 1827412184 OQMBQNIQSALDKD-MHNQQFQPSA-N 493.585 5.349 5 20 JKBD O=C(c1cccs1)N1CCC([C@@H]2CCCCN2C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)CC1 1831059941 LQBFCQARUOQHOD-IBGZPJMESA-N 483.615 5.418 5 20 JKBD C[C@H](OC(=O)c1ccc(COc2ccccc2)cc1)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 9480596 ONSWPKNTTKKAPD-HNNXBMFYSA-N 488.418 5.377 5 20 JKBD COc1cccc(Nc2nnc(S[C@H](C)C(=O)Nc3ccc([N+](=O)[O-])cc3C(F)(F)F)s2)c1 10267560 FHWYPJFCVHWADR-SNVBAGLBSA-N 499.496 5.337 5 20 JKBD COc1cc(CSc2nnc(Nc3cccc(F)c3)s2)c([N+](=O)[O-])cc1OC(F)F 11058729 KZLLWONWAHUMGH-UHFFFAOYSA-N 458.443 5.231 5 20 JKBD C[C@@H](Sc1nnc(-c2cccs2)n1-c1ccccc1)C(=O)Nc1ccccc1[N+](=O)[O-] 11209821 GRPOGROFBHNHSR-CQSZACIVSA-N 451.533 5.023 5 20 JKBD Cc1ccc(-c2nc(C)sc2CC(=O)O[C@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)cc1 11214230 JDRMPEKZQPOCET-CYBMUJFWSA-N 473.938 5.101 5 20 JKBD Cc1cccc(Oc2ccc(Cl)cc2NC(=O)CSc2ccc(C(N)=O)cc2[N+](=O)[O-])c1 14822051 POMCTFWZJXSWBU-UHFFFAOYSA-N 471.922 5.179 5 20 JKBD O=C(NC[C@@H](c1ccccc1Cl)c1c[nH]c2ccccc12)c1cc2c(cc1[N+](=O)[O-])OCCO2 15758521 OMTXDTVCPUYHCK-SFHVURJKSA-N 477.904 5.063 5 20 JKBD Cc1c([C@@H](C)NC(=O)C/C(=C/c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)cnn1C 25003929 KWVGDVVXRBQABU-PWDRBQJJSA-N 461.547 5.055 5 20 JKBD Cc1nc(CN(C(=O)Cn2c3ccccc3c(=O)c3ccccc32)c2ccc(F)cc2)cs1 107672747 SGFRHNZPKVUFCL-UHFFFAOYSA-N 457.530 5.292 5 20 JKBD COc1cc(C(=O)Nc2cc(NC(=O)Nc3ccccc3)ccc2C)c([N+](=O)[O-])cc1OC(F)F 117221147 IBAOZNYLFJEMES-UHFFFAOYSA-N 486.431 5.410 5 20 JKBD C[C@@H](Sc1ncccc1[N+](=O)[O-])C(=O)N1N=C(c2ccc(Cl)cc2)C[C@H]1c1ccco1 195660995 ULFJQJIDNKKRCA-ACJLOTCBSA-N 456.911 5.095 5 20 JKBD COc1cc([C@@H](C)NC(=O)Nc2ccc([N+](=O)[O-])cc2Cl)ccc1OCc1ccncc1 409753568 LSXYSXNCOYMDJU-CQSZACIVSA-N 456.886 5.114 5 20 JKBD O=C(C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)NCCCn1cnc2ccccc21 486448343 NUEUHZHPKHJGTD-SILNSSARSA-N 497.580 5.691 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Cl)[C@@H](NCC1CCN(Cc2cccs2)CC1)c1ccccc1 488492073 HNVCJTXFCXEFPL-DEOSSOPVSA-N 499.036 5.491 5 20 JKBD COc1ccccc1CN(Cc1cccs1)C(=O)c1ccc(Cn2nc(C)c([N+](=O)[O-])c2C)cc1 499149025 JMSKDEUQWDJVRM-UHFFFAOYSA-N 490.585 5.369 5 20 JKBD O=C(NCc1ccc(OC2CCCCC2)cc1)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-] 499547612 VVEJPGGXFLYZBC-UHFFFAOYSA-N 452.429 5.177 5 20 JKBD CNC(=O)c1ccc(C)c(NC(=O)c2ccccc2Sc2ccc(C(F)(F)F)cc2[N+](=O)[O-])c1 514902145 ILALADWIXDNMSD-UHFFFAOYSA-N 489.475 5.685 5 20 JKBD CCCC(=O)Nc1cccc(NC(=O)c2cc([N+](=O)[O-])ccc2Sc2ccc(Cl)cc2)c1C 518654873 CHGSHBOLYSZSGS-UHFFFAOYSA-N 483.977 6.699 5 20 JKBD Cc1cc(NC(=O)c2ccco2)sc1C(=O)Nc1ccc([N+](=O)[O-])cc1C(=O)c1ccccc1 589649233 DJKKXIFASQHTIT-UHFFFAOYSA-N 475.482 5.293 5 20 JKBD C[C@H](Nc1cccc(NC(=O)c2cccs2)c1)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 602384443 DPJPYCMKBQEFBO-LBPRGKRZSA-N 478.452 5.367 5 20 JKBD O=C(COc1ccc(C(=O)c2ccc(Cl)cc2)cc1)Nc1cc([N+](=O)[O-])ccc1OC(F)F 603742875 RJZYMVHTEWEXKE-UHFFFAOYSA-N 476.819 5.098 5 20 JKBD Cc1cc(Sc2ncccn2)ccc1NC(=O)c1ccc(N[C@@H](C)c2ccccn2)c([N+](=O)[O-])c1 608895594 XGZALOTVWPLFKD-KRWDZBQOSA-N 486.557 5.665 5 20 JKBD C[C@@H](Nc1ccc(C(=O)Nc2cccnc2Oc2ccccc2)cc1[N+](=O)[O-])c1ccccn1 609163649 SWBSJRULMWELFH-QGZVFWFLSA-N 455.474 5.603 5 20 JKBD O=C(Cn1c2ccccc2c(=O)c2ccccc21)N1CCC[C@@H]1c1ccc(Cl)c(Cl)c1 615897193 MHFZYZYJOKFZBH-OAQYLSRUSA-N 451.353 5.825 5 20 JKBD CC(C)C(=O)N1CCC(NC(=O)CCC(=O)c2ccc3ccc4cccc5ccc2c3c45)CC1 727753996 GWMXKQQMHJCTCJ-UHFFFAOYSA-N 454.570 5.310 5 20 JKBD CC(=O)N1CCc2ccccc2[C@@H]1CC(=O)Nc1cc(Cl)c([N+](=O)[O-])cc1OCc1ccccc1 727960767 CFDLNKHJFILKCM-QHCPKHFHSA-N 493.947 5.302 5 20 JKBD O=C(Nc1nc(CC(=O)N(CC2CC2)c2ccc(Cl)c([N+](=O)[O-])c2)cs1)c1ccccc1F 728165904 RXHWVOBCFHBBGT-UHFFFAOYSA-N 488.928 5.082 5 20 JKBD CCCN(C(=O)c1ccc(N[C@H](C)c2ccccn2)c([N+](=O)[O-])c1)[C@H]1CCN(C(=O)OC(C)(C)C)C1 729428147 XLROQGNVEUONTD-QUCCMNQESA-N 497.596 5.025 5 20 JKBD Cc1nnc(SCc2c(C(=O)O[C@H](C)c3cccc([N+](=O)[O-])c3)oc3ccccc23)s1 742955485 BFTKAMJHJXMDHK-GFCCVEGCSA-N 455.517 5.711 5 20 JKBD O=C(O[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1)c1ccc2ncccc2c1 743217684 QVTJBSATWWABGM-QFIPXVFZSA-N 461.861 5.333 5 20 JKBD O=C(CSc1nnc(COc2ccc(Cl)cc2Cl)o1)Nc1cc([N+](=O)[O-])ccc1Cl 745942029 VALUZDHCMZXUIG-UHFFFAOYSA-N 489.724 5.248 5 20 JKBD COc1ccc2c(c1)CCCN2C(=O)c1ccccc1C(=O)c1ccc(SC)c([N+](=O)[O-])c1 843782244 KUECWSZCIMWBCN-UHFFFAOYSA-N 462.527 5.149 5 20 JKBD O=C(CCc1nc(O)c2ccccc2n1)Nc1cc(Cl)c([N+](=O)[O-])cc1OCc1ccccc1 916827793 YUJHVHQFFFDBSK-UHFFFAOYSA-N 478.892 5.047 5 20 JKBD COc1c([N+](=O)[O-])cc(NCc2ccnc(Oc3ccccc3)c2)c([N+](=O)[O-])c1Br 917069121 ILFHTBMBZQZYMT-UHFFFAOYSA-N 475.255 5.074 5 20 JKBD O=C(Nc1cc([N+](=O)[O-])ccc1Nc1cccc(C(F)(F)F)c1)c1cc2c(cc1[N+](=O)[O-])OCO2 917512520 LAIOPBPWKNVVHO-UHFFFAOYSA-N 490.350 5.246 5 20 JKBD Cc1cccc(NC(=O)c2ccccc2NC(=O)c2ccc(N[C@H](C)c3ccccn3)c([N+](=O)[O-])c2)c1 919680158 AMWDQJHMIFUCSX-LJQANCHMSA-N 495.539 5.976 5 20 JKBD CSc1cccc(NC(=O)[C@H](C)OC(=O)c2ccc(N[C@H](C)c3ccccn3)c([N+](=O)[O-])c2)c1 920547500 OHSHFEJQANSVSF-CVEARBPZSA-N 480.546 5.069 5 20 JKBD CO/C=C(\C)C(=O)NC1(c2ccc(NC(=O)CCCc3cc(C)c(F)cc3[N+](=O)[O-])cc2)CCC1 1786274563 BYSCJEXLGWJXTK-FBMGVBCBSA-N 483.540 5.049 5 20 JKBD Cc1ccc(C(=O)NC2(c3ccc(NC(=O)c4cc(Cl)cc([N+](=O)[O-])c4C)cc3)CCC2)c(C)n1 1790773970 MFMGRUPXYJIMJB-UHFFFAOYSA-N 492.963 5.630 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)[C@@H]3CC3(F)F)CCC2)cc1)c1cc2cc([N+](=O)[O-])ccc2s1 1791010011 HSCISSYOXFGCNC-KRWDZBQOSA-N 471.485 5.212 5 20 JKBD Cc1ccc(CC(=O)N2CCCC[C@H]2c2cc(NC(=O)c3ccc(C4CC4)cc3)n[nH]2)cc1[N+](=O)[O-] 1821307042 NJHVCRCHIKXYNM-QHCPKHFHSA-N 487.560 5.052 5 20 JKBD Cc1cc(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3cc4cc([N+](=O)[O-])ccc4s3)CC2)cn1C 1827868846 FVCIXUOHNUKLKC-JOCHJYFZSA-N 494.617 5.004 5 20 JKBD Cc1cc(C(=O)N2CCC([C@H]3CCCCN3C(=O)c3cc4cc([N+](=O)[O-])ccc4s3)CC2)c(C)o1 1831059512 HVDZYPGROMOZOG-JOCHJYFZSA-N 495.601 5.566 5 20 JKBD Cc1cc(F)c(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)/C=C/c3ccccc3[N+](=O)[O-])CC2)cc1F 1832623252 GUIFITZEHULIKL-HBRDYDSTSA-N 497.542 5.128 5 20 JKBD C[C@@H](C(=O)N1CCCC[C@@H]1C1CCN(C(=O)CSc2ccccc2[N+](=O)[O-])CC1)c1ccccc1 1832897616 GJIKNMSIYIJZDX-NFBKMPQASA-N 495.645 5.110 5 20 JKBD Cc1c(Cl)cccc1-n1c(SCC(=O)Nc2ccc(F)c([N+](=O)[O-])c2)nnc1-c1ccncc1 10318256 ACCFHTWVWPVDNT-UHFFFAOYSA-N 498.927 5.069 5 20 JKBD CCOC(=O)c1c(NC(=O)c2ccccc2[N+](=O)[O-])sc(C(=O)Nc2ccc(C)cc2C)c1C 14862860 SXAADUMOLQMMAD-UHFFFAOYSA-N 481.530 5.263 5 20 JKBD Cc1ccc(NC(=O)[C@H](C)OC(=O)c2ccccc2C(=O)c2ccc(Cl)c([N+](=O)[O-])c2)c(C)c1 15710214 GFMUHHCBMNJFAD-INIZCTEOSA-N 480.904 5.280 5 20 JKBD O=C(Nc1ccccc1N1CCCC1=O)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1 16105735 SOEJOXDAPUEJHX-UHFFFAOYSA-N 451.866 5.420 5 20 JKBD O=C(/C=C/c1cccs1)O[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Br)c1ccccc1 20752072 APCQUWAPMXTWIA-WAEYIKQSSA-N 487.331 5.355 5 20 JKBD CCn1c(-c2ccc3c(c2)OCCO3)cnc1S[C@@H](C)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 24108408 YDINIPJOJPQHLM-AWEZNQCLSA-N 479.518 5.153 5 20 JKBD CCOc1cc(C(=O)Nc2c3ccccc3n3c(C)nc4ccccc4c23)c([N+](=O)[O-])cc1OC 26782556 PORRPRWSURHPFN-UHFFFAOYSA-N 470.485 5.517 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Cl)[C@H](Nc1cccc(Cn2cccn2)c1)c1ccccc1 27012933 JVHGQCAILOGRRK-HSZRJFAPSA-N 461.909 5.285 5 20 JKBD O=C(COC(=O)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1)Nc1c(F)cccc1F 28931175 OIEBGEFORNCZPT-UHFFFAOYSA-N 462.792 5.114 5 20 JKBD CSc1ccc(C(=O)c2ccccc2C(=O)Nc2cccc(NC(=O)C3CC3)c2)cc1[N+](=O)[O-] 29170024 LPHYTHDSZUHUAW-UHFFFAOYSA-N 475.526 5.149 5 20 JKBD Cc1ccc(-c2csc(NC(=O)[C@H]3CCCN(C(=O)c4ccc(Cl)cc4)C3)n2)cc1[N+](=O)[O-] 105352611 DWCKEWKEURACQQ-KRWDZBQOSA-N 484.965 5.171 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)Nc2cc(C(C)(C)C)nn2-c2ccc(F)cc2)cc1SC 482864598 BWTBNSOLARBVFG-UHFFFAOYSA-N 458.515 5.200 5 20 JKBD COc1ccc(CN(C)C(=O)c2ccccc2C(=O)c2ccc(SC)c([N+](=O)[O-])c2)cc1C 485969180 UVURZZXBLACMMB-UHFFFAOYSA-N 464.543 5.137 5 20 JKBD O=C(C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)Nc1nnc(-c2ccco2)s1 491394298 IJMYLIDZWGFKQR-NTCAYCPXSA-N 489.538 5.885 5 20 JKBD Cc1ccc(C(=O)N2C[C@@H](C)C[C@H](C)C2)cc1NC(=O)c1csc(-c2cccc([N+](=O)[O-])c2)n1 498777445 BPOAWJCIZBHDNP-HOTGVXAUSA-N 478.574 5.397 5 20 JKBD COc1cc(CCNC(=O)[C@H](Sc2ccc(F)cc2F)c2ccccc2)c([N+](=O)[O-])cc1OC 499664679 ZPXFHGVAYODFKP-HSZRJFAPSA-N 488.512 5.083 5 20 JKBD Cn1cc(C(=O)Nc2nc(-c3cc(Cl)ccc3Cl)cs2)c(-c2ccc([N+](=O)[O-])cc2)n1 506021018 GKUWJTPXJZVAFV-UHFFFAOYSA-N 474.329 5.678 5 20 JKBD CC[C@@H]1CCc2nc(NC(=O)c3ccc(N[C@H](C)c4ccccn4)c([N+](=O)[O-])c3)sc2C1 507401249 IOXGARQCCYXPOP-HUUCEWRRSA-N 451.552 5.387 5 20 JKBD CCOc1cc([N+](=O)[O-])c(C(=O)NCc2nc(-c3ccc(Cl)cc3)c(C)s2)cc1OC 509685499 OFTSMTFNEYJIAE-UHFFFAOYSA-N 461.927 5.017 5 20 JKBD CC(C)Cc1ccc(C(=O)C2CCN(C(=O)Nc3cc([N+](=O)[O-])ccc3OC(F)F)CC2)cc1 510860070 IOZDJVGLEDMQOW-UHFFFAOYSA-N 475.492 5.522 5 20 JKBD Cn1cccc1[C@@H]1CCCCCN1C(=O)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 512563700 GQVJBFWRMCMIGL-NRFANRHFSA-N 478.515 5.312 5 20 JKBD CCc1ccc(-c2csc(NC(=O)c3ccc([N+](=O)[O-])cc3I)n2)s1 523388927 ZWVFDYKTSKHRIL-UHFFFAOYSA-N 485.328 5.199 5 20 JKBD CC(C)C(=O)NC[C@H]1CCCN(C(=O)c2cc([N+](=O)[O-])ccc2Sc2ccc(Cl)cc2)C1 523839243 JCUCMZDEPOBQTR-MRXNPFEDSA-N 475.998 5.024 5 20 JKBD Cc1nn(CCC(=O)N(c2ccc(Cl)c(Cl)c2)c2nc3ccccc3s2)c(C)c1[N+](=O)[O-] 523956394 QGTFNWNGGRYJQG-UHFFFAOYSA-N 490.372 6.080 5 20 JKBD COCCN(C(=O)c1cc2c(C)cc(C)nc2s1)c1nc(-c2ccc([N+](=O)[O-])cc2)cs1 603835960 DBNPLQWFEDAWNZ-UHFFFAOYSA-N 468.560 5.238 5 20 JKBD CC(C)(CCNC(=O)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1)c1ccccc1 604387330 VPROEIMTQJMPNM-UHFFFAOYSA-N 463.500 5.314 5 20 JKBD CN(C[C@H]1CCCO[C@H]1c1ccccc1)C(=O)c1ccc(NCc2ccccc2Cl)c([N+](=O)[O-])c1 604519120 MENLUPBBMXXWTO-GJZUVCINSA-N 493.991 6.100 5 20 JKBD Cc1cc(C(=O)Nc2ccccc2OCc2ncc(-c3cccc(Cl)c3)o2)ccc1[N+](=O)[O-] 608850877 MMLAAXTWOTYUPJ-UHFFFAOYSA-N 463.877 6.043 5 20 JKBD COc1ccccc1[C@H]1CCCN1C(=O)C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1 609036417 FLKYLLUBBJYDOJ-CHAXEMQZSA-N 499.592 6.508 5 20 JKBD CCOc1ccc([C@@H](CNC(=O)c2c[nH]c3cc([N+](=O)[O-])ccc23)c2c[nH]c3ccccc23)cc1OC 610927496 RDFQHBFGHKWBHL-OAQYLSRUSA-N 498.539 5.527 5 20 JKBD CC(=O)N(c1nc(COC(=O)c2cc(F)c(F)cc2[N+](=O)[O-])cs1)c1c(C)cc(C)cc1C 725936286 WWHDVMKFDZSSFR-UHFFFAOYSA-N 475.473 5.296 5 20 JKBD C[C@@H](OC(=O)c1cc(F)c(F)cc1[N+](=O)[O-])C(=O)Nc1ccccc1Sc1ccccc1 725936757 ITQDWCNUPVMJFT-CYBMUJFWSA-N 458.442 5.208 5 20 JKBD CCc1ccc(Cl)c(CC)c1NC(=O)CCCOC(=O)c1c(Cl)cccc1[N+](=O)[O-] 730645443 MFGVZBLOQCCMNT-UHFFFAOYSA-N 453.322 5.602 5 20 JKBD COc1ccc([C@H](CNC(=O)c2cc([N+](=O)[O-])c(C)c([N+](=O)[O-])c2C)c2c[nH]c3ccccc23)cc1 748701461 XSLZEVBGZMCTTD-NRFANRHFSA-N 488.500 5.172 5 20 JKBD O=C(COC(=O)c1cc(-c2ccncc2)nc2ccccc12)Nc1ccc(C(F)(F)F)cc1[N+](=O)[O-] 793126288 VUWDWJITFKDBHK-UHFFFAOYSA-N 496.401 5.019 5 20 JKBD C[C@H](Oc1ccc(F)cc1)C(=O)O[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1 825380209 MJWBLHYZWRQXBC-QKKBWIMNSA-N 472.856 5.078 5 20 JKBD O=C(CCSC(F)(F)F)O[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1 915247715 DSQPAWMGTZHNHB-MRXNPFEDSA-N 462.833 5.114 5 20 JKBD CC1=C(C(=O)Nc2ccccc2C)[C@H](c2ccc(Cl)c([N+](=O)[O-])c2)NC(=S)N1c1ccccc1 916162077 GBFKTVMMLVQMRE-QHCPKHFHSA-N 492.988 5.905 5 20 JKBD C[C@@H](OC(=O)c1cc([N+](=O)[O-])ccc1Oc1ccccc1)C(=O)Nc1ccccc1C(F)(F)F 917257157 KDVCBZSOAHWZOF-CQSZACIVSA-N 474.391 5.590 5 20 JKBD O=C(O[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1)c1cc(-c2ccccc2)no1 919188111 KMNNDQZXAORMIL-QFIPXVFZSA-N 477.860 5.440 5 20 JKBD O=C(O[C@@H](C(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1)c1ccccc1)c1cnc(-c2ccccc2)nc1 921215259 VQQVJGJLHSXTQQ-JOCHJYFZSA-N 488.887 5.242 5 20 JKBD C[C@H](OC(=O)c1csc(-c2ccc(Cl)cc2Cl)n1)C(=O)Nc1cccc([N+](=O)[O-])c1 921225980 XZENCZAMDKJGGP-JTQLQIEISA-N 466.302 5.209 5 20 JKBD O=C(Cc1cccc([N+](=O)[O-])c1)Nc1ccc(C2(NC(=O)COc3cccc(Cl)c3)CCC2)cc1 1785791823 KWWFCUZDJNAFKO-UHFFFAOYSA-N 493.947 5.004 5 20 JKBD Cc1cccc(/C=C/C(=O)Nc2ccc(C3(NC(=O)c4c(F)ccc([N+](=O)[O-])c4C)CCC3)cc2)n1 1785825703 QEBKSVHLKVKDOA-SDNWHVSQSA-N 488.519 5.207 5 20 JKBD O=C(Cc1cc([N+](=O)[O-])ccc1F)Nc1ccc(C2(NC(=O)[C@@H](F)c3ccccc3)CCC2)cc1 1786669916 MBODATYBNAKTBZ-DEOSSOPVSA-N 479.483 5.121 5 20 JKBD COc1ccc(CC(=O)Nc2ccc(C3(NC(=O)[C@@H]4C[C@@H]4c4ccccc4)CCC3)cc2)c([N+](=O)[O-])c1 1790572411 ZTRVMYKMWVTEBT-JWQCQUIFSA-N 499.567 5.084 5 20 JKBD Cc1c(C(=O)Nc2ccc(C3(NC(=O)Cc4cscn4)CCC3)cc2)cc(Cl)cc1[N+](=O)[O-] 1790774356 LYUATABZNFXTHV-UHFFFAOYSA-N 484.965 5.004 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)c3ccc([N+](=O)[O-])cc3F)CCC2)cc1)c1cc2ccsc2[nH]1 1790877244 RQKLDNFCVGWYFV-UHFFFAOYSA-N 478.505 5.338 5 20 JKBD COc1ccc(CC(=O)NC2(c3ccc(NC(=O)[C@]4(C)CC=CCC4)cc3)CCC2)c([N+](=O)[O-])c1 1791991907 NQXAFMJRYKSQSF-AREMUKBSSA-N 477.561 5.026 5 20 JKBD O=C(/C=C/c1ccccc1[N+](=O)[O-])Nc1ccc(C2(NC(=O)c3cc(F)cnc3Cl)CCC2)cc1 1792317702 HHELDOOKBTYOHT-IZZDOVSWSA-N 494.910 5.243 5 20 JKBD CC(C)[C@H](C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2ccc([N+](=O)[O-])[nH]2)[nH]n1)c1ccc(Cl)cc1 1814938334 IDBHKUSHEQEVND-UGKGYDQZSA-N 498.971 5.045 5 20 JKBD O=C(c1ccc([N+](=O)[O-])cc1F)N1CCC([C@H]2CCCCN2C(=O)c2ccc3occc3c2)CC1 1828258385 NWCNXODRPQSIHN-HSZRJFAPSA-N 479.508 5.027 5 20 JKBD O=C(c1ccc([N+](=O)[O-])o1)N1CCC([C@@H]2CCCCN2C(=O)c2ccc(Cl)c(Cl)c2)CC1 1829973219 ADSNSDAYMLCYAW-SFHVURJKSA-N 480.348 5.042 5 20 JKBD O=C(Cc1ccc([N+](=O)[O-])cc1F)N1CCC([C@@H]2CCCCN2C(=O)/C=C/C2CCCCC2)CC1 1830355343 FHXZUIAGNBJAJW-OPATVPMHSA-N 485.600 5.033 5 20 JKBD Cc1ccc(CC(=O)N2CCCC[C@H]2C2CCN(C(=O)c3ccc(Cl)cc3)CC2)cc1[N+](=O)[O-] 1830366795 ZQSLSSHEUAHEIT-QHCPKHFHSA-N 483.996 5.033 5 20 JKBD O=C(CCCc1ccccc1F)N1CCC([C@@H]2CCCCN2C(=O)c2ccc([N+](=O)[O-])cc2F)CC1 1830492310 BZEKONWZUVKYEY-VWLOTQADSA-N 499.558 5.129 5 20 JKBD O=C(c1ccc(Cl)cc1F)N1CCC([C@H]2CCCCN2C(=O)c2ccc([N+](=O)[O-])cc2F)CC1 1830492758 MYAXFYUTNCOOIK-JOCHJYFZSA-N 491.922 5.074 5 20 JKBD CSc1ccc(C(=O)OCC(=O)N2c3ccccc3Sc3ccccc32)cc1[N+](=O)[O-] 9622224 LKJVMMDCCBXBAE-UHFFFAOYSA-N 452.513 5.303 5 20 JKBD COc1cc(CNC(=O)CSc2nc3ccc([N+](=O)[O-])cc3s2)ccc1OCc1ccccc1 10084284 RYQOWDTVXIEQSB-UHFFFAOYSA-N 495.582 5.201 5 20 JKBD CCOc1ccc2nc(S[C@@H](C)C(=O)Nc3ccc([N+](=O)[O-])cc3C(F)(F)F)[nH]c2c1 10732441 JTLVOMQMQPMXDJ-JTQLQIEISA-N 454.430 5.008 5 20 JKBD CCOc1ccccc1NC(=O)[C@@H](C)OC(=O)c1ccccc1C(=O)c1ccc(Cl)c([N+](=O)[O-])c1 15710271 RBDGOONHOMZBRU-OAHLLOKOSA-N 496.903 5.062 5 20 JKBD COc1cccc([C@H](CNC(=O)c2cc([N+](=O)[O-])c(C)s2)c2c[nH]c3ccccc23)c1OC 24441801 XYDYCRQNQMNVLD-SFHVURJKSA-N 465.531 5.025 5 20 JKBD C[C@H](OC(=O)/C(=C/c1ccc(F)cc1)c1cccs1)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl 28672673 AMSZSOOJXJAGDB-HNEYUBDGSA-N 474.897 5.560 5 20 JKBD Cc1cc(-c2cc(C(=O)O[C@@H](C)C(=O)Nc3cccc([N+](=O)[O-])c3C)c3c(C)noc3n2)c(C)s1 28672960 TVQMBGNGVWDBKR-AWEZNQCLSA-N 494.529 5.277 5 20 JKBD Cc1cccc(C(=O)N2CCCN(C(=O)c3cc([N+](=O)[O-])ccc3Sc3ccccc3)CC2)c1 29449144 RFWROMRDNINUCH-UHFFFAOYSA-N 475.570 5.043 5 20 JKBD C[C@@H](N[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1)c1ccc2c(c1)OCO2 30500768 LPVGRRRVCMYFHJ-JLCFBVMHSA-N 453.882 5.008 5 20 JKBD C[C@H](Sc1nnc(-c2cccs2)n1Cc1ccccc1)C(=O)Nc1ccccc1[N+](=O)[O-] 45222527 YQOJNZKMVWDCSY-HNNXBMFYSA-N 465.560 5.082 5 20 JKBD O=C(NCc1ccc(F)cc1)c1nnc(/C(Cl)=C/c2ccc(-c3ccc([N+](=O)[O-])cc3)o2)s1 46570344 RGLXWNPKFSKDBG-WQRHYEAKSA-N 484.896 5.512 5 20 JKBD Cc1cc(O[C@H](C)c2ccccc2)ccc1NC(=O)[C@H]1CCCN1C(=O)c1ccc([N+](=O)[O-])c(C)c1 112519496 MISMZSFGPDJTGV-FQRUVTKNSA-N 487.556 5.595 5 20 JKBD Cc1nc([N+](=O)[O-])cn1CC(=O)Nc1nc(-c2ccccc2Cl)c(-c2ccccc2Cl)s1 302958097 FOEYOJZTRDZWEY-UHFFFAOYSA-N 488.356 5.836 5 20 JKBD O=C(Nc1nnc(C(F)F)s1)c1ccc(Sc2nc3ccccc3s2)c([N+](=O)[O-])c1 409457509 SWEFULIJEGNLCD-UHFFFAOYSA-N 465.488 5.397 5 20 JKBD O=C(Nc1ccn(Cc2ccncc2)n1)c1ccc(Sc2nc3ccccc3s2)c([N+](=O)[O-])c1 499490182 IBMQENZQIZHLHN-UHFFFAOYSA-N 488.554 5.248 5 20 JKBD CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)Nc1cc(Br)ccc1Br 510057775 MJKUKPNNXVGIRN-UHFFFAOYSA-N 471.149 5.562 5 20 JKBD COc1cc(C(=O)NC(c2ccccc2)c2ccccc2)c([N+](=O)[O-])cc1OCc1cscn1 512379360 HCIXPDLBWQGNSS-UHFFFAOYSA-N 475.526 5.158 5 20 JKBD CCCN(C(=O)CCn1cc([N+](=O)[O-])cn1)c1nc(-c2ccc(Cl)cc2Cl)cs1 520079574 GYFFLYZZIGZLRX-UHFFFAOYSA-N 454.339 5.055 5 20 JKBD COc1ccc(CC[C@@H]2CCCCN2C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)cc1OC 523565699 NBJNBGQFNATSOR-SFHVURJKSA-N 454.548 5.454 5 20 JKBD CCc1ccc(-c2nc(CS(=O)(=O)Cc3cc(OC)c(OC(F)F)cc3[N+](=O)[O-])cs2)cc1 524602669 URGJWAYZHJOIMT-UHFFFAOYSA-N 498.529 5.006 5 20 JKBD Cn1ccnc1[C@@H](NCc1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1)c1ccc(F)cc1 550812367 IMUIMODNJZZSDO-QHCPKHFHSA-N 466.900 5.792 5 20 JKBD CCOc1ccc([C@@H](C)N[C@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2ccccc2)cc1OC 603598534 JFQHFYOPRFZLFW-GYCJOSAFSA-N 483.952 5.686 5 20 JKBD CCOC(=O)C[C@H](c1ccccc1)C1CCN(C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)CC1 603928067 KCDRMWJNXQMTTQ-OAQYLSRUSA-N 466.559 5.399 5 20 JKBD CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)C[C@H](NC(=O)c1ccccc1Cl)c1ccccc1 604388534 MSPZCVUDEIECQB-DEOSSOPVSA-N 479.964 5.547 5 20 JKBD Cc1cc(C)n([C@H](C)C(=O)Nc2ccc(NC(=O)c3ccc([N+](=O)[O-])cc3Cl)cc2Cl)n1 604441841 LEWZTEJYGVBSFU-CYBMUJFWSA-N 476.320 5.167 5 20 JKBD C[C@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)Nc1nc(-c2ccccc2OC(F)F)cs1 609021856 SWMIVKUUTFGQDD-JTQLQIEISA-N 469.853 5.379 5 20 JKBD CC(C)N(Cc1nnc(-c2cccc([N+](=O)[O-])c2)o1)C(=O)c1csc(-c2c(F)cccc2F)n1 726136149 CQVDRGVTVUEMBK-UHFFFAOYSA-N 485.472 5.097 5 20 JKBD Cc1ccc(NC(=O)CCC(=O)c2ccc3ccc4cccc5ccc2c3c45)cc1S(N)(=O)=O 727752240 DYNUXCGYAIVVKH-UHFFFAOYSA-N 470.550 5.141 5 20 JKBD Cc1ccc(-c2ncc(C(=O)O[C@@H](C)C(=O)Nc3cc([N+](=O)[O-])ccc3Cl)s2)c(C)c1 747261148 SWJAMIPSSKQUHV-ZDUSSCGKSA-N 459.911 5.173 5 20 JKBD O=C(Nc1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2Br)c(C(F)(F)F)c1)c1ccco1 751073637 VZVRJPRABAIGLT-UHFFFAOYSA-N 498.211 5.474 5 20 JKBD Cc1nc(-c2ccc(Cl)cc2)sc1C(=O)OCc1nc(-c2cccc([N+](=O)[O-])c2)no1 914797970 IJJLQCWJFKBKNQ-UHFFFAOYSA-N 456.867 5.087 5 20 JKBD CCOc1cc(/C=C(\C(=O)OCc2nc(-c3cccc([N+](=O)[O-])c3)no2)c2ccccc2)ccc1O 914892716 HGBAAFJDNUZFBU-BKUYFWCQSA-N 487.468 5.033 5 20 JKBD CCC(CC)c1cc[n+](/C(C(=S)N[C@H](C)c2ccccc2)=C(/O)c2ccc([N+](=O)[O-])cc2)cc1 917611386 BQVLQAZKLXSNPI-LJQANCHMSA-O 476.622 6.348 5 20 JKBD CCSc1cc(C(=O)Oc2ccc(NC(=O)c3cc([N+](=O)[O-])ccc3Cl)cc2)ccn1 919678739 HEDGMIHZXWLDKC-UHFFFAOYSA-N 457.895 5.227 5 20 JKBD COc1cc(C(=O)Nc2ccc(OC)c(OC3CCCC3)c2)c([N+](=O)[O-])cc1OCc1cscn1 919881397 IYXKRNORYKTMEF-UHFFFAOYSA-N 499.545 5.221 5 20 JKBD COc1cccc(-c2nc(COC(=O)c3ccc(N[C@H](C)c4ccccn4)c([N+](=O)[O-])c3)cs2)c1 920544491 CAPZHRBTKHWVSS-MRXNPFEDSA-N 490.541 5.652 5 20 JKBD Cc1cccc(-c2nnc([C@H](C)OC(=O)c3ccc(N[C@@H](C)c4ccccn4)c([N+](=O)[O-])c3)o2)c1 920544904 NGTCWHKEJIQWOC-IRXDYDNUSA-N 473.489 5.439 5 20 JKBD CN(C)c1ccc([N+](=O)[O-])c(C(=O)Nc2ccc(C3(NC(=O)c4cccc5cc[nH]c45)CCC3)cc2)c1 1790055600 AYWODPCDHUDNIX-UHFFFAOYSA-N 497.555 5.204 5 20 JKBD Cc1cc2cccc(C(=O)NC3(c4ccc(NC(=O)c5ccc(O)c([N+](=O)[O-])c5)cc4)CCC3)c2[nH]1 1790619565 FRZRMRJQISQSKA-UHFFFAOYSA-N 484.512 5.152 5 20 JKBD CCC1(C(=O)NC[C@@H]2CCN(C(=O)c3cc4cc([N+](=O)[O-])ccc4s3)[C@H]2c2cccnc2)CCC1 1809648500 AVQAVFHHANNMHQ-MBSDFSHPSA-N 492.601 5.104 5 20 JKBD Cc1c(C(=O)NC[C@@H]2CCN(C(=O)[C@H]3CC[C@H](C)CC3)[C@@H]2c2cccnc2)cc(Cl)cc1[N+](=O)[O-] 1811796076 CTXIAYLNILNXAQ-LRYGAUQLSA-N 499.011 5.098 5 20 JKBD Cc1c(Cl)ccc(C(=O)N2CCCC[C@H]2c2cc(NC(=O)c3ccc([N+](=O)[O-])o3)n[nH]2)c1Cl 1814313773 YCQXCJKUVIUEGW-HNNXBMFYSA-N 492.319 5.146 5 20 JKBD O=C(O[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Br)c1ccccc1)c1ccc(F)cc1 11116322 PCIQJCSJOUXLNA-IBGZPJMESA-N 473.254 5.033 5 20 JKBD O=C(COC(=O)CCc1ncc(-c2ccc(Cl)cc2)o1)Nc1ccc(C(F)(F)F)cc1[N+](=O)[O-] 12257703 QVFKSQQEFJBYME-UHFFFAOYSA-N 497.813 5.037 5 20 JKBD CN(c1ccccc1)S(=O)(=O)c1ccccc1C(=O)OCc1nc2ccccc2c2ccccc12 14634003 OERYMZWYGHBHLV-UHFFFAOYSA-N 482.561 5.570 5 20 JKBD Cc1sc(NC(=O)c2cc([N+](=O)[O-])ccc2Cl)nc1-c1ccc(Br)cc1 14911520 UISKRKUXLBAARP-UHFFFAOYSA-N 452.717 5.695 5 20 JKBD Cn1c(CNC(=O)c2cc([N+](=O)[O-])ccc2Sc2ccc(Cl)cc2)nc2ccccc21 15132252 RTJLLJJRCCEZKL-UHFFFAOYSA-N 452.923 5.216 5 20 JKBD O=C(COC(=O)c1ccccc1SCc1ccco1)Nc1ccc(C(F)(F)F)cc1[N+](=O)[O-] 18410385 MBZHEDIJORZNBM-UHFFFAOYSA-N 480.420 5.294 5 20 JKBD C[C@H](Sc1nnc(COc2ccccc2F)n1-c1ccccc1)C(=O)Nc1cccc([N+](=O)[O-])c1 23591474 UQSSQHJEPXDUII-INIZCTEOSA-N 493.520 5.013 5 20 JKBD Cc1csc(Sc2ccc(C(=O)Nc3ccccc3NC(=O)c3ccccc3)cc2[N+](=O)[O-])n1 25871507 NFDRYGRTYVGRIJ-UHFFFAOYSA-N 490.566 6.016 5 20 JKBD O=C(c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1)N1CCO[C@@H](c2ccc(F)cc2)C1 29113431 QYINOUDAWCAECD-JOCHJYFZSA-N 456.857 5.393 5 20 JKBD COc1cc2c(cc1NC(=O)c1ccc([N+](=O)[O-])cc1I)oc1ccccc12 72068390 TZDLUKZCHMVWLX-UHFFFAOYSA-N 488.237 5.360 5 20 JKBD Cc1ccc(CNC(=O)c2ccccc2NC(=O)Cn2c3ccccc3c(=O)c3ccccc32)cc1 105498531 MTYNFHVBOHBFIU-UHFFFAOYSA-N 475.548 5.032 5 20 JKBD O=C(C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)N1CCCCC[C@@H]1c1ccncc1 479304855 SUNFQZJUXXJXMK-WJIBEPFQSA-N 498.608 6.674 5 20 JKBD COc1ccccc1[C@@H](C)CC(=O)N1CCN(Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)CC1 482752882 OIMDQKRXVPJJDW-IBGZPJMESA-N 479.602 5.170 5 20 JKBD Cc1c(C(=O)N(Cc2ccccc2[N+](=O)[O-])CC(F)(F)F)cnn1-c1ccc(Br)cc1 486072143 VIRLSFVVJJTZMI-UHFFFAOYSA-N 497.271 5.056 5 20 JKBD O=C(Cn1c2ccccc2c(=O)c2ccccc21)Nc1nc(-c2sccc2Br)cs1 500731613 RHARFJRHSOQPKO-UHFFFAOYSA-N 496.411 5.741 5 20 JKBD CCN(C(=O)c1ccc(Sc2nc(C)cs2)c([N+](=O)[O-])c1)c1ccc(OC)c(OC)c1 500920952 DXOQEQHDTQKBMA-UHFFFAOYSA-N 459.549 5.195 5 20 JKBD CC[C@H](C(=O)N1CCC(NC(=O)c2ccc(Nc3ccccc3)c([N+](=O)[O-])c2)CC1)c1ccccc1 502046610 TUBOLHHPGKZTNL-DEOSSOPVSA-N 486.572 5.253 5 20 JKBD O=C(Nc1cccc(C(=O)N2CCCC2)c1)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1 502697053 XKIGCBFDOOMTIU-UHFFFAOYSA-N 465.893 5.529 5 20 JKBD CCOc1cc2c(cc1NC(=O)c1ccc(N[C@@H](C)c3ccccn3)c([N+](=O)[O-])c1)O[C@H](C)C2 506099984 XWTZVRZNLZHBMT-CVEARBPZSA-N 462.506 5.137 5 20 JKBD C[C@@H](Nc1ccc(C(=O)N(C2CC2)[C@H](C)c2ccc(Cl)cc2)cc1[N+](=O)[O-])c1ccccn1 509245893 HORVXHNMNGNJLD-IAGOWNOFSA-N 464.953 6.182 5 20 JKBD Cc1csc(Sc2ccc(C(=O)Nc3ccccc3NC(=O)NC(C)C)cc2[N+](=O)[O-])n1 511983957 RGESFHJDWDZNSP-UHFFFAOYSA-N 471.564 5.293 5 20 JKBD CC[C@H](C)[C@H](NC(=O)c1cc(OC)c(OCc2cscn2)cc1[N+](=O)[O-])c1nc2ccccc2[nH]1 512185139 ZRFOFHQYJCOTGT-FPTDNZKUSA-N 495.561 5.032 5 20 JKBD CS(=O)(=O)c1cc(C(=O)Nc2ccc(Sc3ccccc3)c(Cl)c2)cc([N+](=O)[O-])c1 512537081 YVKRZDMDAWGWRR-UHFFFAOYSA-N 462.936 5.055 5 20 JKBD O=C(Nc1ccc(Cl)cc1Cl)[C@@H]1CCCCN1C(=O)CSc1ccc([N+](=O)[O-])cc1 515204016 RVJCZSWUHNVCGW-SFHVURJKSA-N 468.362 5.014 5 20 JKBD CC(C)N(C(=O)CCNc1ccc(C(F)(F)F)cc1[N+](=O)[O-])c1ccc(Br)cn1 515628636 VRLKBPMBLDLODX-UHFFFAOYSA-N 475.265 5.015 5 20 JKBD C[C@@H](NC(=O)c1ccc2c(c1)C(=O)N(c1cc(Cl)ccc1Cl)C2=O)c1cccc([N+](=O)[O-])c1 515681785 JIQKFUGLJJSVJL-GFCCVEGCSA-N 484.295 5.193 5 20 JKBD O=[N+]([O-])c1ccc(-c2ccc(CNCCc3nccn3Cc3ccccc3)o2)c(Br)c1 520207850 NCZBTXQWUHNESU-UHFFFAOYSA-N 481.350 5.194 5 20 JKBD O=[N+]([O-])c1ccc(-c2ccc(CNCc3cccc(OC(F)F)c3)o2)c(Br)c1 521828240 MYCXXYYOKITEKS-UHFFFAOYSA-N 453.239 5.509 5 20 JKBD COc1ccc(CC(=O)N(c2ccc(Cl)c(Cl)c2)c2nc3ccccc3s2)cc1[N+](=O)[O-] 524088529 GXBOMMATLWFNHU-UHFFFAOYSA-N 488.352 6.427 5 20 JKBD Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)c1cccnc1SCc1cccc(Br)c1 603637438 GCLFADLSDRJLPI-UHFFFAOYSA-N 472.364 5.914 5 20 JKBD Cc1ccc(NC(=O)c2ccccc2)cc1NC(=O)c1ccc(N2CCC[C@H](C)C2)c([N+](=O)[O-])c1 603909458 AJMMVWBCWNLMCL-SFHVURJKSA-N 472.545 5.644 5 20 JKBD Cc1c(NC(=O)c2ccc(N3CCC(C)CC3)c([N+](=O)[O-])c2)cccc1-c1nnc2n1CCCCC2 603962048 BJVZYWGHNQACGH-UHFFFAOYSA-N 488.592 5.377 5 20 JKBD COc1ccc([C@H](Cc2ccccc2C)N[C@@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2C)cc1OC 604474114 PMHSZHAWRKQWNN-CVDCTZTESA-N 477.561 5.129 5 20 JKBD C[C@@H]1CCCN(c2ccc(C(=O)N3CCC[C@@H](c4nc(-c5ccc(F)cc5)no4)C3)cc2[N+](=O)[O-])C1 608817231 GNBXDJPXNDXMMD-YLJYHZDGSA-N 493.539 5.040 5 20 JKBD CSc1ccc(C(=O)c2ccccc2C(=O)NCCc2csc(C(C)C)n2)cc1[N+](=O)[O-] 608820084 RSWKKDSNQNGIRM-UHFFFAOYSA-N 469.588 5.100 5 20 JKBD CC[C@@H](NC(=O)Cc1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1)c1nc(C)cs1 609192134 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C[C@H](OC(=O)COc1ccc(Cl)c2ccccc12)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 749992281 RDMLXLAKPCNSKU-LBPRGKRZSA-N 496.825 5.369 5 20 JKBD C[C@@H]1CCCCN1C(=O)c1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2Br)cc1Cl 751094501 WBRQEKRVIPBDPW-GFCCVEGCSA-N 480.746 5.278 5 20 JKBD Cc1cc(-c2cc(C(=O)O[C@@H](C)C(=O)Nc3ccc([N+](=O)[O-])cc3Cl)c3c(C)noc3n2)c(C)o1 813318778 DRDLQAGXJZKVTL-ZDUSSCGKSA-N 498.879 5.154 5 20 JKBD CC(C)(C)OC(=O)NCc1ccc(-c2noc(-c3ccc4[nH]c5ccccc5c(=O)c4c3)n2)cc1 904717015 ROTKYBIIMUEUPU-UHFFFAOYSA-N 468.513 5.423 5 20 JKBD Cc1nc(Cc2ccc(F)cc2)sc1C(=O)O[C@@H](C)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 915399898 XOLHLCHSSVLBIW-ZDUSSCGKSA-N 468.466 5.058 5 20 JKBD C[C@@H](OC(=O)c1cccc(OCc2cccs2)c1)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 915465260 XTNNAFPTJDKBJC-CYBMUJFWSA-N 494.447 5.438 5 20 JKBD CN(Cc1ccc(Cl)s1)C(=O)COc1ccc2c(-c3ccc([N+](=O)[O-])cc3)cc(=O)oc2c1 916497229 CRUZCZTXBUNZAJ-UHFFFAOYSA-N 484.917 5.121 5 20 JKBD CC(C)(C)c1cc[n+](/C(C(=S)Nc2ccc3ccccc3c2)=C(/O)c2ccc([N+](=O)[O-])cc2)cc1 917610879 YFENWMMIXLQJKW-UHFFFAOYSA-O 484.601 6.656 5 20 JKBD CN(Cc1cccc(C(F)(F)F)c1)C(=O)c1ccccc1NC(=O)c1ccc([N+](=O)[O-])cc1Cl 918622958 XOBNDAAPVDNKDN-UHFFFAOYSA-N 491.853 5.792 5 20 JKBD CC(C)N(Cc1nnc(-c2cccc([N+](=O)[O-])c2)o1)C(=O)c1csc(-c2ccc(Cl)s2)n1 920016189 BNSCYJOAZXYXNA-UHFFFAOYSA-N 489.966 5.534 5 20 JKBD C[C@@H](OC(=O)c1cccc(-n2nccc2-c2ccccc2)c1)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 920706908 POFXUGHHOOJAIX-QGZVFWFLSA-N 481.468 5.416 5 20 JKBD COc1cc(C(=O)OCc2csc3ccccc23)c([N+](=O)[O-])cc1OCc1cscn1 920823709 OLKYJXVLQKTIGY-UHFFFAOYSA-N 456.501 5.211 5 20 JKBD C[C@@H](C(=O)Nc1ccc(C2(NC(=O)c3ccc([N+](=O)[O-])[nH]3)CCC2)cc1)c1ccc(Cl)cc1 1785988937 POQMMLBYLYCRNF-OAHLLOKOSA-N 466.925 5.128 5 20 JKBD CC1=CC[C@@H](C(=O)NC2(c3ccc(NC(=O)Cc4cc([N+](=O)[O-])ccc4F)cc3)CCC2)CC1 1786671046 AEISMYYJFZZBNB-GOSISDBHSA-N 465.525 5.157 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)NC1(c2ccc(NC(=O)Cc3cccnc3Cl)cc2)CCC1 1786772533 XHLWTSQDQREAFL-UHFFFAOYSA-N 496.926 5.081 5 20 JKBD Cc1cc(C(=O)Nc2ccc(C3(NC(=O)Cn4ccc5ccc([N+](=O)[O-])cc54)CCC3)cc2)c(C)o1 1787341986 FRBITSLEABLEJT-UHFFFAOYSA-N 486.528 5.207 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)[C@H]3CC[C@H](C(F)(F)F)CC3)CCC2)cc1)c1ccc([N+](=O)[O-])[nH]1 1790188395 NDHSEGHHACAXOM-KOMQPUFPSA-N 478.471 5.039 5 20 JKBD COC1(CC(=O)NC2(c3ccc(NC(=O)C4(c5cccc([N+](=O)[O-])c5)CCC4)cc3)CCC2)CCC1 1790476683 UJGKNRTTWZODHS-UHFFFAOYSA-N 491.588 5.110 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)N1CCC([C@H]2CCCCN2C(=O)C2(C(F)(F)F)CCC2)CC1 1826762784 AAHPSLJASVGFAW-LJQANCHMSA-N 499.505 5.008 5 20 JKBD CC(=O)Nc1ccc(NC(=O)C2CCN(c3ccc(C(F)(F)F)cc3[N+](=O)[O-])CC2)cc1Cl 12735850 VMFDGDUYDZANGZ-UHFFFAOYSA-N 484.862 5.081 5 20 JKBD CCOC(=O)c1sc(-c2ccc(OC)c(OC)c2)cc1NC(=S)Nc1ccc([N+](=O)[O-])cc1 18946322 FUTBMOYBRVYWFG-UHFFFAOYSA-N 487.559 5.326 5 20 JKBD O=C(c1cccs1)N1CCN(C(=O)c2cc([N+](=O)[O-])ccc2Sc2ccc(Cl)cc2)CC1 25269412 QEFQXRMXYPOYST-UHFFFAOYSA-N 487.990 5.059 5 20 JKBD Cc1c(C(=O)N(Cc2ccccc2[N+](=O)[O-])CC(F)(F)F)sc2nc(C(F)(F)F)ccc12 195611899 ONENACOZQGOSMN-UHFFFAOYSA-N 477.386 5.736 5 20 JKBD O=C(CSc1ccc(C(F)(F)F)cc1[N+](=O)[O-])N(Cc1ccco1)Cc1cccs1 247333183 PMHIMWWOXFTPLA-UHFFFAOYSA-N 456.467 5.589 5 20 JKBD Cc1ccc(C(=O)N2C[C@@H](C)C[C@H](C)C2)cc1NC(=O)c1cc2ccccc2c2cccnc12 302949467 JVJVPCLBNXEGIZ-OALUTQOASA-N 451.570 6.067 5 20 JKBD CCOc1cc2c(cc1[C@@H]1C[C@@H]1C(=O)N(Cc1ccccc1[N+](=O)[O-])CC(F)(F)F)O[C@H](C)C2 409796351 XUBAEKLHUNJKAF-LJHODMEESA-N 478.467 5.012 5 20 JKBD CCC(=O)Nc1ccc(C)c(NC(=O)c2ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])c(OC)c2)c1 481945157 MAIZSDYUIHSRTB-UHFFFAOYSA-N 483.908 5.958 5 20 JKBD C[C@@H](NC(=O)c1cc([N+](=O)[O-])ccc1Sc1ccc(Cl)cc1)c1ccc2c(c1)CC(=O)N2 501025886 SYFDDCXYDUCUNM-CYBMUJFWSA-N 467.934 5.385 5 20 JKBD O=C(Cn1c2ccccc2c(=O)c2ccccc21)Nc1cccc(COCCOc2ccccc2)c1 502724811 RJAQEOZKNYWOOZ-UHFFFAOYSA-N 478.548 5.389 5 20 JKBD COc1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2NCc2ccccc2)cc1OCc1cccnc1 512340687 LHNYWHLUSLTKEM-UHFFFAOYSA-N 484.512 5.442 5 20 JKBD O=C(Cc1csc(Cc2ccc(F)cc2)n1)Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1 518949282 DEVKRCKKEINYRM-UHFFFAOYSA-N 454.508 5.086 5 20 JKBD Cc1ccc(NC(=O)Nc2ccccc2)cc1NC(=O)c1ccc(N2CCCC2)c([N+](=O)[O-])c1 603743131 XIYVTYMJGUJMLK-UHFFFAOYSA-N 459.506 5.400 5 20 JKBD COc1cc2c(cc1OC)[C@H](c1ccccc1)N(C(=O)N[C@@H](C)c1cccc([N+](=O)[O-])c1)CC2 604126754 VFHXVANGMNQOGZ-GKVSMKOHSA-N 461.518 5.030 5 20 JKBD CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccc(NC(=O)C2CC2)cc1C(F)(F)F 609147686 ZWDUOATUGLOFOC-UHFFFAOYSA-N 464.444 5.405 5 20 JKBD O=C(CCC(=O)c1ccc2ccc3cccc4ccc1c2c34)NC1CCN(Cc2ccccn2)CC1 727768513 GMQALWVSEBMTGM-UHFFFAOYSA-N 475.592 5.723 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)O[C@H](C)C(=O)Nc2ccccc2Cc2ccccc2)cc1SC 728658756 WTXZNAAUISXRQP-MRXNPFEDSA-N 480.542 5.100 5 20 JKBD COc1ccc(CSCC(=O)Nc2ccc3c(c2)CCCN3C(=O)OC(C)(C)C)cc1[N+](=O)[O-] 729410662 DLLJPBCHLHYCRL-UHFFFAOYSA-N 487.578 5.163 5 20 JKBD COc1cc(/C=C(/Cl)c2nc(O)c3cc(-c4ccccc4)sc3n2)cc([N+](=O)[O-])c1O 747165240 SQRWGMWYZAJESD-VGOFMYFVSA-N 455.879 5.423 5 20 JKBD Cc1ccc(Sc2ccc(CNc3cccc(C(=O)N4CCC(CO)CC4)c3)cc2[N+](=O)[O-])cc1 864027063 CZXGMHGOTYIGGW-UHFFFAOYSA-N 491.613 5.511 5 20 JKBD Cc1ccc[n+](/C(C(=S)Nc2c(C(C)C)cccc2C(C)C)=C(/O)c2cccc([N+](=O)[O-])c2)c1 917609836 BDGDQZZWBMEASX-UHFFFAOYSA-O 476.622 6.761 5 20 JKBD CC(C)c1ccc(CN(C(=O)COC(=O)Cn2c3ccccc3c(=O)c3ccccc32)C2CC2)cc1 919056102 UVNFIYAPEROHOA-UHFFFAOYSA-N 482.580 5.013 5 20 JKBD CC(C)N(C(=O)COC(=O)c1cc([N+](=O)[O-])ccc1F)c1ccc(Nc2ccccc2)cc1 919250742 UJNZGEQZBXGZFX-UHFFFAOYSA-N 451.454 5.076 5 20 JKBD Cc1sc(CNC(=O)c2cc([N+](=O)[O-])ccc2N2CCCC2)nc1-c1ccc(Cl)cc1 919864727 ZUVJCWKOIJYHBI-UHFFFAOYSA-N 456.955 5.210 5 20 JKBD CSc1ccccc1NC(=O)[C@H](C)OC(=O)c1ccc(N[C@H](C)c2ccccn2)c([N+](=O)[O-])c1 920544974 ORLKLRDLBWKBNO-CVEARBPZSA-N 480.546 5.069 5 20 JKBD CC(=O)NC1(c2noc(CCC(=O)OCc3nc4ccccc4c4ccccc34)n2)CCCCCC1 920620697 VQOYHUJTNRFICB-UHFFFAOYSA-N 486.572 5.133 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)c3ccc4ccoc4c3)CCC2)cc1)c1cc(F)cc([N+](=O)[O-])c1 1790699343 LCJFZSWRVLBOPZ-UHFFFAOYSA-N 473.460 5.542 5 20 JKBD COC1(CC(=O)Nc2ccc(C3(NC(=O)c4cc5cc([N+](=O)[O-])ccc5s4)CCC3)cc2)CCC1 1792052207 LVEMRLRLUHQDEH-UHFFFAOYSA-N 493.585 5.516 5 20 JKBD C/C(=C\c1ccc(C)o1)C(=O)N1CCC2(CCCN(C(=O)Cc3ccc(Cl)cc3[N+](=O)[O-])C2)CC1 1805485959 NYOVPEVOBBJMLO-NBVRZTHBSA-N 499.995 5.027 5 20 JKBD COc1cc(C(=O)N2CCC([C@H]3CCCCN3C(=O)c3ccc(C(C)C)cc3)CC2)ccc1[N+](=O)[O-] 1830061294 WLKAWNOUHNFGCM-XMMPIXPASA-N 493.604 5.274 5 20 JKBD Cc1cccc(Cl)c1C(=O)N1CCC([C@H]2CCCCN2C(=O)c2ccc([N+](=O)[O-])cc2F)CC1 1830498782 JQHLDEOGQZPIRP-JOCHJYFZSA-N 487.959 5.243 5 20 JKBD CC(C)(C)c1ccc(C(=O)N2CCC([C@H]3CCCCN3C(=O)c3cc(O)cc([N+](=O)[O-])c3)CC2)s1 1830704433 LDZQAQCTMRRDHJ-OAQYLSRUSA-N 499.633 5.207 5 20 JKBD CN(Cc1cc([N+](=O)[O-])ccc1Cl)C(=O)c1ccc(Oc2ccc(C(F)(F)F)cn2)cc1 10377371 CRHQTXDFHQZGAB-UHFFFAOYSA-N 465.815 5.727 5 20 JKBD CC(C)c1cc(C(=O)O[C@@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)c2cnn(C(C)C)c2n1 17727924 JFYJHKPUUVDIEC-AWEZNQCLSA-N 464.482 5.012 5 20 JKBD CCN(CC)c1ccc(-c2nnc(S[C@@H](C)c3nnc(-c4ccc([N+](=O)[O-])cc4)o3)n2CC)cc1 17957403 JADFNHGXJFBTPN-INIZCTEOSA-N 493.593 5.623 5 20 JKBD C[C@@H](Sc1nnc(Nc2ccccc2)s1)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 21452210 HQXCWPFLNBEIGQ-SNVBAGLBSA-N 469.470 5.328 5 20 JKBD Cc1ccc(Cn2c(S[C@H](C)C(=O)Nc3cccc([N+](=O)[O-])c3C)nc3ccccc3c2=O)cc1 21779357 FIDTYSRQVNAGLA-GOSISDBHSA-N 488.569 5.089 5 20 JKBD CC(C)CCSc1ccc(C(=O)O[C@@H](C)C(=O)Nc2c(F)cccc2F)cc1[N+](=O)[O-] 24083513 CBJBDUKFYLQIBA-ZDUSSCGKSA-N 452.479 5.195 5 20 JKBD O=C(CSc1ccc(C(F)(F)F)cc1[N+](=O)[O-])Nc1nnc(SCc2ccccc2)s1 104684468 QOHYFVSXUJDHGU-UHFFFAOYSA-N 486.522 5.488 5 20 JKBD Cc1ccc(-c2csc(NC(=O)COc3ccc(C4SCCCS4)cc3)n2)cc1[N+](=O)[O-] 105353516 XKCYKWMCYCNLQK-UHFFFAOYSA-N 487.628 5.913 5 20 JKBD Cc1c(NC(=O)CSc2ccc(C(F)(F)F)cc2[N+](=O)[O-])cccc1C(=O)Nc1ccccc1 303053566 SCAQWSGPANHGQI-UHFFFAOYSA-N 489.475 5.905 5 20 JKBD C[C@@H](NC(=O)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-])c1cccc(NC(=O)c2ccccc2)c1 480319860 SEGQAMJORAUXOU-OAHLLOKOSA-N 487.434 5.279 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)Nc2ccc(Cc3nc4ccccc4s3)cc2)cc1SC 482025035 LDXVWHKNGGCLAV-UHFFFAOYSA-N 465.556 5.778 5 20 JKBD CCOc1cc(C(=O)Nc2cccc(Cl)c2Sc2nc(C)cs2)c([N+](=O)[O-])cc1OC 499242822 HSQDUSBKJDLSBM-UHFFFAOYSA-N 479.967 5.824 5 20 JKBD CCOc1ccc(OCC)c(NC(=O)c2ccc(N[C@H](C)c3ccccn3)c([N+](=O)[O-])c2)c1 506010192 QICBERASQDNXKW-MRXNPFEDSA-N 450.495 5.213 5 20 JKBD CCCCNC(=O)C1CCN(C(=O)c2ccc(Sc3nc4ccccc4s3)c([N+](=O)[O-])c2)CC1 506233955 PBMRBULLBANCRC-UHFFFAOYSA-N 498.630 5.124 5 20 JKBD O=C(Cn1ccc([N+](=O)[O-])n1)Nc1cc(Cl)ccc1Oc1ccc(C(=O)c2ccccc2)cc1 515437906 ISDASDFVTLUOSI-UHFFFAOYSA-N 476.876 5.107 5 20 JKBD C[C@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)Nc1ccccc1-c1n[nH]c(-c2ccccc2)n1 518831649 PBMZPFYCTJQWCG-AWEZNQCLSA-N 463.881 5.106 5 20 JKBD Cc1cc(NC(=O)c2ccccc2Cl)sc1C(=O)Nc1cc(-c2cccc([N+](=O)[O-])c2)[nH]n1 522353195 MMDBOTCYXSNWTI-UHFFFAOYSA-N 481.921 5.513 5 20 JKBD Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)CSCc1nc(O)c2c(-c3ccccc3)csc2n1 603501427 OJIOAMSKGAJABO-UHFFFAOYSA-N 480.571 5.461 5 20 JKBD O=C(NC[C@H](c1ccccc1Cl)c1c[nH]c2ccccc12)c1cc2c(cc1[N+](=O)[O-])OCO2 603941074 FTSAZAFKJGFHNW-QGZVFWFLSA-N 463.877 5.020 5 20 JKBD Cc1ccc(NC(=O)c2ccc(N[C@H](C)c3ccc(NC(=O)NC4CC4)cc3)c([N+](=O)[O-])c2)cc1 608973112 ZTCNQYOIVUXFBB-QGZVFWFLSA-N 473.533 5.613 5 20 JKBD CC(C)N1CCCN(C(=O)C/C(=C/c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)CC1 609035900 FSWRLYULWPRSSR-SILNSSARSA-N 464.591 5.078 5 20 JKBD CN(Cc1ccccc1Cl)C(=O)c1ccc(C(=O)N(C)Cc2ccccc2Cl)c([N+](=O)[O-])c1 609043573 YSDCQLPMQPWFKA-UHFFFAOYSA-N 486.355 5.446 5 20 JKBD COc1cc(C(=O)Nc2ccc(Oc3cccc(F)c3)c3ccncc23)c([N+](=O)[O-])cc1OC(F)F 609106192 ZFLBEFBDGZBQMB-UHFFFAOYSA-N 499.401 5.937 5 20 JKBD CC[C@H](C)c1ccc(N(Cc2cccc(C(=O)N(C)C)c2)S(=O)(=O)c2cccc([N+](=O)[O-])c2)cc1 609220666 ABPRHUCGBVVJBR-IBGZPJMESA-N 495.601 5.206 5 20 JKBD O=[N+]([O-])c1cccc(/C(O)=C(/C(=S)Nc2ccccc2-c2ccccc2)[n+]2ccccc2)c1 725762597 CKCPZKRKMCPOAS-UHFFFAOYSA-O 454.531 5.873 5 20 JKBD Cn1cc(C(=O)Oc2ccc(NC(=O)c3cc([N+](=O)[O-])ccc3Cl)cc2)c(C2CCCCC2)n1 726751683 DFYHKNXSOQDMRK-UHFFFAOYSA-N 482.924 5.501 5 20 JKBD CN(C[C@@H]1CCN(C(=O)c2ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])cc2)C1)C(=O)OC(C)(C)C 729388234 QZJUKQRKXHWMAS-INIZCTEOSA-N 489.956 5.370 5 20 JKBD CCOc1cc(-c2nnc(Sc3nc4ccc([N+](=O)[O-])cc4s3)o2)cc(OCC)c1OCC 731205993 SQNYLSDAMJJTIM-UHFFFAOYSA-N 488.547 5.602 5 20 JKBD COCc1c(C(=O)N(Cc2nnc(-c3cccc([N+](=O)[O-])c3)o2)C(C)C)sc2cccc(F)c12 744001376 CZHXDSYDWTZGGJ-UHFFFAOYSA-N 484.509 5.196 5 20 JKBD C[C@H](OC(=O)c1csc(-c2ccc([N+](=O)[O-])cc2)n1)C(=O)N[C@H](C)c1ccc(Cl)cc1Cl 747955561 AUXRBLCQZVTFTH-NEPJUHHUSA-N 494.356 5.448 5 20 JKBD CC(C)[C@H](OC(=O)c1csc(-c2cccc([N+](=O)[O-])c2)n1)C(=O)N1CCSc2ccccc21 747961624 GVXGUVNPXYDHCZ-FQEVSTJZSA-N 483.571 5.039 5 20 JKBD O=C(COC(=O)c1csc(-c2cccc([N+](=O)[O-])c2)n1)NCc1ccc(-c2ccc(Cl)cc2)o1 747963045 VRYQEBDWZIJDMI-UHFFFAOYSA-N 497.916 5.105 5 20 JKBD COc1ccc(-c2cc(C(=O)Nc3cc([N+](=O)[O-])ccc3OC(F)F)c3ccccc3n2)cc1OC 915283346 MUPOSJDPQVRVQM-UHFFFAOYSA-N 495.438 5.681 5 20 JKBD CC(C)OC(=O)C[C@H](NC(=O)Nc1ccc(SC(F)F)cc1)c1ccccc1[N+](=O)[O-] 915301076 NYIXOEWSMUNWKJ-INIZCTEOSA-N 453.467 5.114 5 20 JKBD CCN1C(=O)N[C@@H](c2ccc(Cl)c([N+](=O)[O-])c2)C(C(=O)Nc2ccccc2C(F)(F)F)=C1C 916164994 JJIKZNOHTQOYIS-SFHVURJKSA-N 482.846 5.266 5 20 JKBD O=C(O[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1)c1cc2cc([N+](=O)[O-])ccc2[nH]1 917329795 JPOIYYWDFGVUQY-NRFANRHFSA-N 494.847 5.175 5 20 JKBD C[C@H](Nc1ccc(C(=O)OC2C[C@@H]3CC[C@H](C2)N3C(=O)OC(C)(C)C)cc1[N+](=O)[O-])c1ccccn1 920138511 QYBBEKWFHASKBP-DAABDDCCSA-N 496.564 5.250 5 20 JKBD C[C@H](OC(=O)c1ccc(N[C@@H](C)c2ccccn2)c([N+](=O)[O-])c1)C(=O)N1c2ccccc2CC[C@@H]1C 920546466 YLDTWYSIISYCPT-FHWLQOOXSA-N 488.544 5.076 5 20 JKBD O=C(Cc1cc([N+](=O)[O-])ccc1F)NC1(c2ccc(NC(=O)c3ccnc(C(F)F)c3)cc2)CCC1 1787014712 QZBVHGOCMXEQNA-UHFFFAOYSA-N 498.461 5.057 5 20 JKBD Cc1nc2ccncc2cc1C(=O)Nc1ccc(C2(NC(=O)c3ccc([N+](=O)[O-])cc3F)CCC2)cc1 1789248349 JGXWNKQLKVNUON-UHFFFAOYSA-N 499.502 5.047 5 20 JKBD CCSc1cccnc1C(=O)NC1(c2ccc(NC(=O)c3cc(F)cc([N+](=O)[O-])c3)cc2)CCC1 1790697403 HLZHVGZEPIGJHQ-UHFFFAOYSA-N 494.548 5.302 5 20 JKBD O=C(NC1(c2ccc(NC(=O)c3cccc4ccoc34)cc2)CCC1)c1ccc([N+](=O)[O-])c2c1OCO2 1790956677 GGGZDXJDZZZVCC-UHFFFAOYSA-N 499.479 5.131 5 20 JKBD O=C(NC1(c2ccc(NC(=O)c3cc4cc([N+](=O)[O-])ccc4s3)cc2)CCC1)c1coc(Cl)n1 1791011196 PJNMJLSVTCYGKT-UHFFFAOYSA-N 496.932 5.512 5 20 JKBD CCOc1cccc(C(=O)NC2(c3ccc(NC(=O)Cc4cc(F)ccc4[N+](=O)[O-])cc3)CCC2)c1 1792308815 OJGAPLJVIJQIDJ-UHFFFAOYSA-N 491.519 5.123 5 20 JKBD CC[C@@H](C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cc3cc([N+](=O)[O-])ccc3s1)C2)c1ccccc1 1795457126 BKTHMRSBJWPAAB-XAPVIXHLSA-N 477.586 5.255 5 20 JKBD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(F)cc(Cl)c1)c1cc2cc([N+](=O)[O-])ccc2s1 1803674474 QTUHLCVSUUOAKA-BCDXTJNWSA-N 487.940 5.168 5 20 JKBD CC(C)Oc1ccc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)/C=C/c2ccccc2[N+](=O)[O-])cc1Cl 1804345358 AARQMCRUZRXQBA-LGMYYNHISA-N 497.979 5.001 5 20 JKBD Cc1c(C(=O)N2CCCC[C@H]2c2cc(NC(=O)C3CCCCC3)n[nH]2)cc(Cl)cc1[N+](=O)[O-] 1816708905 SPJZCCODHOXRAA-IBGZPJMESA-N 473.961 5.166 5 20 JKBD O=C(/C=C/c1ccccc1[N+](=O)[O-])N1CCC([C@@H]2CCCCN2C(=O)[C@@H]2CCCCC2(F)F)CC1 1824651106 KHYXEHRCBOUXHF-KFDAMUOLSA-N 489.563 5.053 5 20 JKBD CCCCC[C@@H](C)C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cc(N(C)C)ccc2[N+](=O)[O-])CC1 1829648248 GVWZOIVLQSJUTB-YKSBVNFPSA-N 486.657 5.111 5 20 JKBD O=C(c1ccc([N+](=O)[O-])o1)N1CCC([C@H]2CCCCN2C(=O)c2c(F)cc(Cl)cc2Cl)CC1 1830655563 OXMILORASNKKHF-QGZVFWFLSA-N 498.338 5.181 5 20 JKBD C[C@]1(C(=O)N2CCC([C@H]3CCCCN3C(=O)c3cc4cc([N+](=O)[O-])ccc4s3)CC2)CC1(F)F 1831062107 PKQMWPGIAUQHEY-WZONZLPQSA-N 491.560 5.088 5 20 JKBD C[C@H](CC(=O)N1CCCC[C@@H]1C1CCN(C(=O)/C=C/c2ccc([N+](=O)[O-])o2)CC1)c1ccccc1 1831502604 CKHQWCBUBPSPRU-UDLMQIBTSA-N 479.577 5.015 5 20 JKBD Cc1c(NC(=O)CSc2nnc(-c3ccccc3F)n2-c2ccccc2)cccc1[N+](=O)[O-] 9928981 CDQLHEYOVDJGDI-UHFFFAOYSA-N 463.494 5.021 5 20 JKBD COc1cc(N[C@@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2ccccc2)ccc1N1CCCC1=O 10184786 ADEAMMLQUPSKTR-XMMPIXPASA-N 494.935 5.176 5 20 JKBD C[C@@H](Sc1ncnc2scc(-c3ccc(F)cc3)c12)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 17709924 GIUGLABYERLUSG-GFCCVEGCSA-N 479.518 6.309 5 20 JKBD Cc1ccc(C(=O)N(C)c2ccc(OC(=O)Cn3c4ccccc4c(=O)c4ccccc43)cc2)cc1 22137900 AOXIYYRIEPXPSK-UHFFFAOYSA-N 476.532 5.345 5 20 JKBD C[C@H](c1cccc(NC(=O)c2ccccc2)c1)N(C)C(=O)COc1ccc(Cl)cc1[N+](=O)[O-] 24123010 BPARRRQSHAVCEO-MRXNPFEDSA-N 467.909 5.099 5 20 JKBD Cc1nc(COc2ccccc2C(=O)Oc2ccc(NC(=O)c3cccc([N+](=O)[O-])c3)cc2)cs1 25710122 PCUPWLYMZBJNQU-UHFFFAOYSA-N 489.509 5.410 5 20 JKBD CCOc1ccc(C(=O)Nc2ccc(NC(=O)c3ccccc3F)cc2C(F)(F)F)cc1[N+](=O)[O-] 69643828 ZFYWMGABWHUYGS-UHFFFAOYSA-N 491.397 5.656 5 20 JKBD O=C(Nc1ccc(NC(=O)c2ccc(Br)c([N+](=O)[O-])c2)c(C(F)(F)F)c1)c1ccoc1 71924794 XKWWXGNZDFFWFY-UHFFFAOYSA-N 498.211 5.474 5 20 JKBD CCOc1ccc2nc(NC(=O)c3ccc(N[C@@H](C)c4ccccn4)c([N+](=O)[O-])c3)sc2c1 72016418 IYYCGXFSENWNFG-AWEZNQCLSA-N 463.519 5.424 5 20 JKBD O=C(Nc1ccc2nc(N3CCCC3)sc2c1)c1csc(-c2cccc([N+](=O)[O-])c2)n1 215792264 KTBDPAKHAKGRJK-UHFFFAOYSA-N 451.533 5.181 5 20 JKBD O=C(NCc1ccc(F)cc1)C1CCN(C(=O)c2cc([N+](=O)[O-])ccc2Sc2ccccc2)CC1 486134409 MNKLLIYIOITQPF-UHFFFAOYSA-N 493.560 5.054 5 20 JKBD O=C(c1csc(-c2ccc([N+](=O)[O-])cc2)n1)N1CCC[C@H]1c1cccc(Br)c1 497501826 GDUDKDCHPVMJBH-SFHVURJKSA-N 458.337 5.458 5 20 JKBD O=C(N[C@H]1CCOc2c(-c3ccccc3)cccc21)C1CCN(c2ccccc2[N+](=O)[O-])CC1 505076851 SXJMBKFUEJKHAE-QHCPKHFHSA-N 457.530 5.118 5 20 JKBD CN(Cc1ccccc1N1CCCC1)C(=O)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 512578464 PSEKNINMKUSFSQ-UHFFFAOYSA-N 490.526 5.089 5 20 JKBD Cc1cc(NC(=O)Cc2csc(-c3ccc(Cl)cc3)n2)n(-c2ccc([N+](=O)[O-])cc2)n1 514343901 QKBOBEFEDBFNQJ-UHFFFAOYSA-N 453.911 5.047 5 20 JKBD CC(C)N(C)C(=O)C1CCN(C(=O)c2ccc(Sc3nc4ccccc4s3)c([N+](=O)[O-])c2)CC1 516754055 GAICQLBMMHBWHB-UHFFFAOYSA-N 498.630 5.075 5 20 JKBD CCOc1cc(C(=O)N2CCCc3cc(Br)cc(Cl)c32)c([N+](=O)[O-])cc1OC 520625467 IXXBMASWZLGGSX-UHFFFAOYSA-N 469.719 5.011 5 20 JKBD CC(=O)N1CCc2c(sc3nc(-c4cccc([N+](=O)[O-])c4C)cc(-c4ccc(C)cc4)c23)C1 543445574 VCGZQSYWECWICY-UHFFFAOYSA-N 457.555 6.060 5 20 JKBD CC1CCC(OC2CCN(C(=O)c3cc([N+](=O)[O-])ccc3NCc3ccccc3)CC2)CC1 553312583 OLCPKEQWTJQXSQ-UHFFFAOYSA-N 451.567 5.407 5 20 JKBD C[C@H](Sc1nnc(-c2ccccc2)n1[C@H](C)c1ccccc1)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 603917262 LBJHUBLQGJVRTH-MSOLQXFVSA-N 498.568 6.366 5 20 JKBD Cc1ccc(Sc2ccc(C(=O)N3CCC(CC(=O)NC4CCCC4)CC3)cc2[N+](=O)[O-])cc1 604396619 GCLPBMOTFZKDSB-UHFFFAOYSA-N 481.618 5.356 5 20 JKBD CCc1cc[n+](/C(C(=S)Nc2ccccc2-c2ccccc2)=C(/O)c2ccc([N+](=O)[O-])cc2)cc1 725763853 PERCQIHUKDVTKM-UHFFFAOYSA-O 482.585 6.435 5 20 JKBD C[C@@H](NC(=S)/C(=C(/O)c1cccc([N+](=O)[O-])c1)[n+]1ccc(C(C)(C)C)cc1)c1cccs1 726578912 GRWZMLXPMGRAQR-MRXNPFEDSA-O 468.624 5.803 5 20 JKBD C[C@H](CC(=O)Oc1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2Cl)cc1)c1ccccc1F 726751636 CNKMAANTJAACOX-CQSZACIVSA-N 456.857 5.739 5 20 JKBD Cc1cc(=O)oc2cc(OCc3ccc(C(=O)N4c5ccc([N+](=O)[O-])cc5C[C@H]4C)cc3)ccc12 728812031 VOLCEPSHHFOBMT-QGZVFWFLSA-N 470.481 5.180 5 20 JKBD Cc1nc2ccc(C(=O)Oc3ccc(NC(=O)c4cc([N+](=O)[O-])ccc4Cl)cc3)cc2nc1C 743886704 AUODATXIOONCKN-UHFFFAOYSA-N 476.876 5.280 5 20 JKBD Cc1ccc(NC(=O)[C@@H](OC(=O)c2csc(CC(C)C)n2)c2ccccc2)c([N+](=O)[O-])c1 746607084 MZZVONRDBNNPRL-NRFANRHFSA-N 453.520 5.095 5 20 JKBD CCOC(=O)N1CCC(NC(=O)c2ccccc2Sc2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 818029949 SFZYYKPGEGWRTA-UHFFFAOYSA-N 497.495 5.116 5 20 JKBD COCCN(C(=O)c1sc2ccccc2c1Cl)c1nc(-c2ccc([N+](=O)[O-])cc2)cs1 900790899 ASTMSKNERLJJES-UHFFFAOYSA-N 473.963 5.880 5 20 JKBD Cc1sc(NC(=O)c2cc([N+](=O)[O-])ccc2I)nc1-c1cccc(Cl)c1 915276448 ZRRBRKQKGYONBA-UHFFFAOYSA-N 499.717 5.537 5 20 JKBD C[C@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)OCC(=O)Nc1ccccc1Oc1ccccc1 916523246 VNAKATZJTRZDTC-INIZCTEOSA-N 452.488 5.050 5 20 JKBD O=C(/C=C\c1ccsc1)O[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Br)c1ccccc1 917949606 CWUWBOFYUMOHSN-NSDNCLLMSA-N 487.331 5.355 5 20 JKBD CNC(=O)c1cc(Cl)ccc1NC(=O)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])c(OC)c1 918570544 FDIFUGFCJSQFNT-UHFFFAOYSA-N 490.299 5.314 5 20 JKBD Cc1cc2cccc(C(=O)Nc3ccc(C4(NC(=O)/C=C/c5ccc([N+](=O)[O-])o5)CCC4)cc3)c2[nH]1 1789015916 MIWLTXRQGYMADH-ZRDIBKRKSA-N 484.512 5.439 5 20 JKBD O=C(NC1(c2ccc(NC(=O)c3cccc([N+](=O)[O-])c3Br)cc2)CCC1)c1ccco1 1790636767 QICIIOAAZOHTAY-UHFFFAOYSA-N 484.306 5.012 5 20 JKBD Cc1cc(CCCC(=O)N2CCC([C@H]3CCCCN3C(=O)CC(C)C)CC2)c([N+](=O)[O-])cc1F 1826340382 ULEHKEFDAYASJJ-HSZRJFAPSA-N 475.605 5.031 5 20 JKBD Cc1cccc2cc(C(=O)N3CCC([C@H]4CCCCN4C(=O)c4ccc([N+](=O)[O-])cc4F)CC3)[nH]c12 1830497063 XEKILJQTEKBXSL-XMMPIXPASA-N 492.551 5.071 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cc3[nH]ccc3s2)CC1 1830733729 RDOYRAISENKRHS-HXUWFJFHSA-N 498.580 5.132 5 20 JKBD Cc1ccc(CC(=O)N2CCC([C@@H]3CCCCN3C(=O)c3cc4cc([N+](=O)[O-])ccc4s3)CC2)o1 1831061171 BTZZPVJRYUPLJY-QFIPXVFZSA-N 495.601 5.187 5 20 JKBD O=C(c1cc2ccccc2o1)N1CCC([C@H]2CCCCN2C(=O)/C=C/c2ccccc2[N+](=O)[O-])CC1 1832906876 HFWLTDKXKRKVIE-MDRMPYQZSA-N 487.556 5.288 5 20 JKBD CCn1c(S[C@@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)nnc1-c1ccc(Cl)cc1 17659601 XXIHWVIMRWOVDZ-LBPRGKRZSA-N 456.915 5.430 5 20 JKBD C[C@@H](Nc1ccc(C(=O)Nc2cccc(OCC(F)(F)F)c2)cc1[N+](=O)[O-])c1ccccn1 302973159 IJIKEFRDKPMUDE-CQSZACIVSA-N 460.412 5.356 5 20 JKBD O=C(NC1CCN(c2ccccn2)CC1)c1ccc(Sc2nc3ccccc3s2)c([N+](=O)[O-])c1 478796404 NLYLBFSHSLEOCY-UHFFFAOYSA-N 491.598 5.150 5 20 JKBD O=C(Nc1cc([N+](=O)[O-])ccc1OC(F)F)c1csc(-c2cc(Br)cs2)n1 485889979 GFVAKNACPIHZJO-UHFFFAOYSA-N 476.280 5.396 5 20 JKBD COc1ccc([C@H](Nc2cc3c(cc2[N+](=O)[O-])CCC(=O)N3)c2ccccc2)cc1Br 488047409 YZAJUZXKCUQFEP-HSZRJFAPSA-N 482.334 5.452 5 20 JKBD COc1ccc([C@H]2Nc3ccc(Cl)cc3C(=O)N2C)cc1OCc1ccc([N+](=O)[O-])cc1 515592081 COGIQLBKCAJKLQ-QFIPXVFZSA-N 453.882 5.032 5 20 JKBD C[C@@H](NC(=O)Cn1c2ccccc2c(=O)c2ccccc21)c1cccc(OCc2ccccn2)c1 515613801 VBMUEQDSLMTPFX-HXUWFJFHSA-N 463.537 5.006 5 20 JKBD Cc1csc(Sc2ccc(C(=O)N3CCN(c4nc5ccccc5s4)CC3)cc2[N+](=O)[O-])n1 523374789 NHEDHOMVMHUVLE-UHFFFAOYSA-N 497.627 5.083 5 20 JKBD CCCOc1cc(NC(=O)N2CCO[C@@H](c3ccc(F)c(F)c3)C2)c([N+](=O)[O-])cc1OCCC 524307978 ZQSAOXALMUGKLF-JOCHJYFZSA-N 479.480 5.056 5 20 JKBD CN(C(=O)c1nc(-c2cccs2)n(-c2cccc(C(F)(F)F)c2)n1)c1ccc([N+](=O)[O-])cc1 553806367 QWJDGCSPZFISQV-UHFFFAOYSA-N 473.436 5.199 5 20 JKBD Cc1nc(C)c(-c2csc(NC(=O)c3ccc(N4CCC[C@@H](C)C4)c([N+](=O)[O-])c3)n2)s1 603904786 SWEQOIRJEOWAKT-GFCCVEGCSA-N 457.581 5.280 5 20 JKBD Cc1ccccc1-c1nc(C(=O)O[C@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2C(F)(F)F)cs1 727559839 OXIWXOGQOLJLDJ-GFCCVEGCSA-N 479.436 5.230 5 20 JKBD COc1ccc(CC(=O)OCc2csc(-c3ccc(C(F)(F)F)cc3)n2)cc1[N+](=O)[O-] 727884236 UZJOVDCSWSWFIW-UHFFFAOYSA-N 452.410 5.032 5 20 JKBD O=C(OCc1nc(-c2cccc([N+](=O)[O-])c2)no1)c1nc(-c2ccccc2)oc1-c1ccccc1 731376874 IVCCZMGJDFCGJD-UHFFFAOYSA-N 468.425 5.324 5 20 JKBD Cc1ccc(S(=O)(=O)c2ccc(COC(=O)c3csc(-c4cccc([N+](=O)[O-])c4)n3)cc2)cc1 747956484 UASNNMTZXWHSKJ-UHFFFAOYSA-N 494.550 5.217 5 20 JKBD O=C(OCc1coc(-c2ccc(Br)cc2)n1)c1csc(-c2cccc([N+](=O)[O-])c2)n1 747956760 ZXNVVYUEJDETDW-UHFFFAOYSA-N 486.303 5.493 5 20 JKBD CC(C)N(CC(=O)Nc1ccc(Cl)cc1C(F)(F)F)C(=O)c1cc([N+](=O)[O-])ccc1Cl 820135027 XSNUDBRYYSGJKW-UHFFFAOYSA-N 478.254 5.410 5 20 JKBD Cc1ccc(NC(=O)[C@H](OC(=O)C2CCN(c3ccccc3[N+](=O)[O-])CC2)c2ccccc2)cc1 844239736 MYAPJHIAWLYZKX-RUZDIDTESA-N 473.529 5.043 5 20 JKBD Cc1nn(Cc2ccc(-c3nc(-c4ccc(Oc5ccc(F)cc5)nc4)no3)cc2)c(C)c1[N+](=O)[O-] 904513182 ROZUNTJVSTWQTP-UHFFFAOYSA-N 486.463 5.500 5 20 JKBD O=C(Cn1c2ccccc2c(=O)c2ccccc21)OCc1c(Cl)nc(Cl)n1-c1ccccc1 917403573 LJSNALBFPSXGOS-UHFFFAOYSA-N 478.335 5.391 5 20 JKBD Cc1ccc(C(=O)Nc2cccc(C(F)(F)F)c2)cc1NC(=O)c1cc([N+](=O)[O-])ccc1N(C)C 920845570 VIPURJZMNBMGOE-UHFFFAOYSA-N 486.450 5.493 5 20 JKBD O=C(Cn1c2ccccc2c(=O)c2ccccc21)Oc1c(Br)cccc1Br 921291294 NWLQJFPJOOYPRC-UHFFFAOYSA-N 487.147 5.285 5 20 JKBD COc1ccc(C(=O)Nc2ccc(C3(NC(=O)c4cc(Cl)cc([N+](=O)[O-])c4C)CCC3)cc2)cn1 1786531937 TZOTZJSUXHSNAN-UHFFFAOYSA-N 494.935 5.022 5 20 JKBD Cc1cc(C(=O)NC2(c3ccc(NC(=O)c4oc5ccccc5c4C)cc3)CCC2)ncc1[N+](=O)[O-] 1788967980 LPIABMAYDKTOKB-UHFFFAOYSA-N 484.512 5.414 5 20 JKBD COc1cc(C(=O)NC2(c3ccc(NC(=O)c4cccc5cnccc45)cc3)CCC2)ccc1[N+](=O)[O-] 1789327375 DRMFRZBNZSMCRN-UHFFFAOYSA-N 496.523 5.213 5 20 JKBD Cc1noc(C)c1CCC(=O)NC1(c2ccc(NC(=O)c3c(F)ccc([N+](=O)[O-])c3C)cc2)CCC1 1790771230 XPWRJSGPFWPCDK-UHFFFAOYSA-N 494.523 5.028 5 20 JKBD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc2sccc2s1)c1cc2cc([N+](=O)[O-])ccc2s1 1798033932 MMNDNJFNVOHGKN-QDMKHBRRSA-N 497.623 5.651 5 20 JKBD CC(C)(C)CCCCCC(=O)NC[C@@H]1CCN(C(=O)c2cc(O)cc([N+](=O)[O-])c2)[C@@H]1c1cccnc1 1812808793 JATGNCRLLFBOCV-NBGIEHNGSA-N 496.608 5.012 5 20 JKBD O=C(/C=C/c1cc2ccccc2o1)Nc1cc([C@H]2CCCCN2C(=O)Cc2cccc([N+](=O)[O-])c2)[nH]n1 1818811056 VMSNICBZPFXUQA-HRBBJJPOSA-N 499.527 5.012 5 20 JKBD O=C(c1cccc2ccccc12)N1CCC([C@@H]2CCCCN2C(=O)c2ccc(O)c([N+](=O)[O-])c2)CC1 1830490073 ZISGZRIMTCSIRL-DEOSSOPVSA-N 487.556 5.001 5 20 JKBD C/C=C(\C)C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)CC1 1831342281 BZYRNWFBKAPFOR-QPHYPNAHSA-N 455.580 5.009 5 20 JKBD COc1cc(C(=O)N2CCCC[C@H]2C2CCN(C(=O)C[C@H](C)c3ccccc3)CC2)ccc1[N+](=O)[O-] 1832697226 KRGKBWGPWQTROZ-RDPSFJRHSA-N 493.604 5.031 5 20 JKBD Cc1nc(-c2ccc(NC(=O)c3ccc(NS(=O)(=O)c4cccc([N+](=O)[O-])c4)cc3)cc2)cs1 16504479 AARQTXADNVFQIP-UHFFFAOYSA-N 494.554 5.080 5 20 JKBD Cc1ccc(NC(=O)[C@H](Sc2nc3ccccc3c(=O)n2C2CC2)c2ccccc2)c([N+](=O)[O-])c1 18964482 OVJRWKQUHVSLLR-HSZRJFAPSA-N 486.553 5.420 5 20 JKBD CC(C)c1ccccc1N(C(=O)CCNC(=O)c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1 21054266 JBMLTURFJYKXPI-UHFFFAOYSA-N 488.569 5.813 5 20 JKBD CCn1c(SCc2csc(N(C(C)=O)c3ccccc3)n2)nc2cc3ccccc3cc2c1=O 22178719 RLIXVMDYGRDYSL-UHFFFAOYSA-N 486.622 6.003 5 20 JKBD O=C(OCc1nnc(-c2ccc([N+](=O)[O-])cc2)o1)c1cc(-c2ccco2)n(-c2cccc(Cl)c2)n1 25785754 PBWYHFXQHUGWOI-UHFFFAOYSA-N 491.847 5.101 5 20 JKBD O=C(Nc1ccccc1-c1nc(-c2ccccc2)n[nH]1)c1csc(-c2ccc([N+](=O)[O-])cc2)n1 302982640 DJDOURGGDHTOCG-UHFFFAOYSA-N 468.498 5.423 5 20 JKBD CCOc1ccc(Br)cc1NC(=O)c1ccc(N[C@@H](C)c2ccccn2)c([N+](=O)[O-])c1 303203983 OXYRWCWLFZYHGK-AWEZNQCLSA-N 485.338 5.576 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)N(Cc2ccc(Cl)c(Cl)c2)Cc2ccccn2)cc1SC 483696013 HDDQOEAGHKMEAM-UHFFFAOYSA-N 492.384 5.870 5 20 JKBD CCN(Cc1cc(Br)ccc1F)C(=O)c1csc(-c2cccc([N+](=O)[O-])c2)n1 499356793 MUJXVQLFAUYHDD-UHFFFAOYSA-N 464.316 5.282 5 20 JKBD C[C@H](Nc1ccc(C(=O)N2CC3(CCCC3)c3c(F)cccc32)cc1[N+](=O)[O-])c1ccccn1 501790623 DJKAPGYCVGMMBF-KRWDZBQOSA-N 460.509 5.774 5 20 JKBD O=C(Nc1cccc(C(=O)Nc2ccccn2)c1)c1ccc(NCc2ccccc2)c([N+](=O)[O-])c1 505818768 PHTGCVIMYNLQSO-UHFFFAOYSA-N 467.485 5.107 5 20 JKBD COc1cc(C(=O)Nc2nc(-c3ccccc3)cs2)c([N+](=O)[O-])cc1OCc1cscn1 506769128 ZXHFBHIXOAFZSH-UHFFFAOYSA-N 468.516 5.015 5 20 JKBD Cc1nc(-c2ccccc2)sc1[C@H](C)NC(=O)c1ccc(Cn2nc(C)c([N+](=O)[O-])c2C)cc1 507537727 QKDUARPPTLTZKV-INIZCTEOSA-N 475.574 5.379 5 20 JKBD COc1ccc([N+](=O)[O-])cc1NC(=O)N(C)[C@@H]1CCSc2ccc(Br)cc21 509071931 RWJHFXQVEFCTMI-OAHLLOKOSA-N 452.330 5.067 5 20 JKBD Cc1csc(Sc2ccc(C(=O)Nc3ccccc3OC[C@H]3CCCCO3)cc2[N+](=O)[O-])n1 510028574 JJHPNIOVDTYHQX-QGZVFWFLSA-N 485.587 5.711 5 20 JKBD COc1cc(C(=O)N[C@@H](CC(C)(C)C)c2ccccc2)c([N+](=O)[O-])cc1OCc1cscn1 512338440 MHKOGLVPFDZAIV-IBGZPJMESA-N 469.563 5.546 5 20 JKBD CC(=O)c1ccc(Sc2nnc(-c3ccccc3Cl)n2Cc2ccccc2)c([N+](=O)[O-])c1 515164668 MHGMNIATDRVEND-UHFFFAOYSA-N 464.934 5.909 5 20 JKBD CCN(C(=O)c1ccc(NC2CC2)c([N+](=O)[O-])c1)[C@H](c1cccnc1)c1ccc(F)c(F)c1 517812084 PTTMNMJHQNWXKG-QHCPKHFHSA-N 452.461 5.094 5 20 JKBD CCCC(=O)Nc1cccc(NC(=O)Cc2cn(-c3ccccc3)nc2-c2ccc([N+](=O)[O-])cc2)c1C 518661748 TYLIMJSYHDCDTG-UHFFFAOYSA-N 497.555 5.676 5 20 JKBD CCN(CC)C(=O)c1ccc(CNCc2cn(-c3ccccc3)nc2-c2ccc([N+](=O)[O-])cc2)cc1 518770589 UWHJSSJUHJYZHO-UHFFFAOYSA-N 483.572 5.219 5 20 JKBD O=C(Nc1ccc2ncsc2c1)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 520003186 XNSMSZDALUISPA-UHFFFAOYSA-N 450.442 5.078 5 20 JKBD C[C@@H](COCC(F)(F)F)NC(=O)C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1 521504808 QPODLUCBMBYEST-FBKCMUNRSA-N 479.480 5.219 5 20 JKBD O=C(Nc1ccc(Cl)cc1)N1CCCN(C(=O)c2ccc(Nc3ccccc3)c([N+](=O)[O-])c2)CC1 521700668 ZIWMZLIMWBTMEM-UHFFFAOYSA-N 493.951 5.372 5 20 JKBD COc1ccc(CSc2nnc(-c3ccncc3)n2-c2cccc(Cl)c2C)cc1[N+](=O)[O-] 603722586 JFVYTQODHGDIAL-UHFFFAOYSA-N 467.938 5.500 5 20 JKBD Cc1ccc(NS(=O)(=O)c2ccc(Nc3cccc(NC(=O)C4CC4)c3)c([N+](=O)[O-])c2)c(C)c1 603845664 GAGNFSNPLGKKBY-UHFFFAOYSA-N 480.546 5.105 5 20 JKBD CCc1cccc[n+]1/C(C(=S)Nc1ccccc1-c1ccccc1)=C(/O)c1ccc([N+](=O)[O-])cc1 725762618 CWWCEMBAVANAOR-UHFFFAOYSA-O 482.585 6.435 5 20 JKBD O=[N+]([O-])c1ccc(-c2ccc(CNC[C@H](O)c3cccc(C(F)(F)F)c3)o2)c(Br)c1 730817396 RPFMDMVASXYFNY-SFHVURJKSA-N 485.256 5.459 5 20 JKBD CCOc1cc(NC(=O)c2cc(F)ccc2[N+](=O)[O-])c(OCC)cc1NC(=O)c1ccccc1 745371290 JOTMSCAPRXOQAT-UHFFFAOYSA-N 467.453 5.036 5 20 JKBD Cc1c(NC(=O)c2cc([N+](=O)[O-])ccc2Br)cccc1C(=O)Nc1ccccc1 751118226 OADZBXQSQJWAMH-UHFFFAOYSA-N 454.280 5.170 5 20 JKBD CC(C)N(Cc1nnc(-c2cccc([N+](=O)[O-])c2)o1)C(=O)CCCOc1ccc(Cl)cc1Cl 864244940 VJRHNZNHZDWZQZ-UHFFFAOYSA-N 493.347 5.548 5 20 JKBD COc1cc(NC(=O)c2c3ccccc3cc3ccccc23)c(OC)cc1NC(=O)c1ccccc1 916647403 BCGKBRVIGLYVNZ-UHFFFAOYSA-N 476.532 6.515 5 20 JKBD Cc1c(C(=O)Oc2ccc(NC(=O)c3cc([N+](=O)[O-])ccc3Cl)cc2)cnn1Cc1ccccc1 916952121 QGKKWNWNUPZKII-UHFFFAOYSA-N 490.903 5.273 5 20 JKBD C[C@H](Nc1ccc(C(=O)Nc2cccc(-c3cn4c(n3)CCCC4)c2)cc1[N+](=O)[O-])c1ccccn1 919719525 OCTGGSLMZGIJOF-SFHVURJKSA-N 482.544 5.615 5 20 JKBD Cc1ccc[n+](/C(C(=S)Nc2ccc3c(c2)OC(F)(F)O3)=C(/O)c2ccc(C)c([N+](=O)[O-])c2)c1 920393730 CISVNVLKYXQJQW-UHFFFAOYSA-O 486.476 5.144 5 20 JKBD Cc1ccc(C)c2c(C)c(C(=O)OCC(=O)Nc3ccc([N+](=O)[O-])cc3C(F)(F)F)oc12 920649216 CNIIHUJNIIFTDU-UHFFFAOYSA-N 450.369 5.081 5 20 JKBD O=C(NC1(c2ccc(NC(=O)c3ccc([N+](=O)[O-])o3)cc2)CCC1)c1cccc(C(F)(F)F)c1 1785749561 DVLRAARDNQCJSC-UHFFFAOYSA-N 473.407 5.268 5 20 JKBD O=C(NC1(c2ccc(NC(=O)c3ccc([N+](=O)[O-])o3)cc2)CCC1)c1ccc(-c2ccccc2)nc1 1785750130 UKUOALWFNCXFCW-UHFFFAOYSA-N 482.496 5.311 5 20 JKBD O=C(c1ccc([N+](=O)[O-])o1)N1CCCC2(CCN(C(=O)C3(c4cccc(Cl)c4)CCCC3)CC2)C1 1804649556 CMJUNNAXRLHNMS-UHFFFAOYSA-N 499.995 5.198 5 20 JKBD CC1(C)CCC(CC(=O)NC[C@H]2CCN(C(=O)c3ccc([N+](=O)[O-])cc3F)[C@H]2c2cccnc2)CC1 1808903416 NDHUXIAHPBRCQM-NLFFAJNJSA-N 496.583 5.055 5 20 JKBD Cc1c(C(=O)NC[C@H]2CCN(C(=O)C3(C)CCCCC3)[C@@H]2c2cccnc2)cc(Cl)cc1[N+](=O)[O-] 1811796753 KZEMJENGAXYGBV-AUSIDOKSSA-N 499.011 5.242 5 20 JKBD CC[C@H]1CC[C@H](C(=O)N2CCCC[C@H]2c2cc(NC(=O)CCc3cccc([N+](=O)[O-])c3)n[nH]2)CC1 1815538482 KZZUWLLWELWNBD-LEDOBFOHSA-N 481.597 5.159 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2ccc(Cl)cc2)[nH]n1 1821287232 PPOCRQNVXKMKOD-IBGZPJMESA-N 485.903 5.039 5 20 JKBD O=C(/C=C/c1ccccc1[N+](=O)[O-])Nc1cc([C@H]2CCCCN2C(=O)c2c(F)cccc2Cl)[nH]n1 1823502577 BIDLRXZULRNSIT-YVNCXZRQSA-N 497.914 5.130 5 20 JKBD Cc1cccc(C(=O)N2CCCC[C@H]2C2CCN(C(=O)c3cc4cc([N+](=O)[O-])ccc4s3)CC2)n1 1825851644 XBYOSXIXMPUNGN-QFIPXVFZSA-N 492.601 5.060 5 20 JKBD CCc1ccnc(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3cc(Cl)cc([N+](=O)[O-])c3C)CC2)c1 1827360478 XXDKWROLYVOJJP-HSZRJFAPSA-N 499.011 5.061 5 20 JKBD CC(C)[C@H]1CC[C@H](C(=O)N2CCCC23CN(C(=O)c2cc4cc([N+](=O)[O-])ccc4s2)C3)CC1 1846079985 IJHXIVRETBMUMK-IYARVYRRSA-N 469.607 5.089 5 20 JKBD COc1cc(NC(=O)c2cc3cc([N+](=O)[O-])ccc3s2)c(OC)cc1NC(=O)c1ccccc1 11652075 RWTHBWRXMYMMNY-UHFFFAOYSA-N 477.498 5.331 5 20 JKBD O=C(NC1CC1)c1ccc(CN(C(=O)c2ccc(Nc3ccccc3)c([N+](=O)[O-])c2)C2CC2)cc1 26108566 VXUXJBWBOOZHFH-UHFFFAOYSA-N 470.529 5.035 5 20 JKBD COc1cc([N+](=O)[O-])ccc1NC(=O)CNc1ccccc1NC12CC3CC(CC(C3)C1)C2 72058755 VFJIJBPQSJMHHW-UHFFFAOYSA-N 450.539 5.035 5 20 JKBD Cc1csc(Sc2ccc(NC(=O)c3ccc(N[C@@H](C)c4ccccn4)c([N+](=O)[O-])c3)cc2)n1 108866275 XGOAKRMKCPLHSD-INIZCTEOSA-N 491.598 6.331 5 20 JKBD Cc1csc(Sc2ccc(C(=O)Nc3c(C)cccc3OC(F)F)cc2[N+](=O)[O-])n1 116483934 GNYURVVCVTVXKT-UHFFFAOYSA-N 451.476 5.673 5 20 JKBD Cc1cc(NC(=O)c2c3c(nc4ccccc24)/C(=C\c2ccc([N+](=O)[O-])cc2)CCC3)n(C)n1 409793768 UVBZZDOYYWHCKM-SDXDJHTJSA-N 453.502 5.314 5 20 JKBD COc1cc(C(=O)NCc2ccccc2Sc2ccccc2)c([N+](=O)[O-])cc1OC(F)F 410366265 GSWKZDVNDWRRIE-UHFFFAOYSA-N 460.458 5.286 5 20 JKBD COc1ccc(CSCC(=O)Nc2cccc(C(=O)Nc3ccccc3)c2C)cc1[N+](=O)[O-] 498437244 WHOGJLKSBDGREX-UHFFFAOYSA-N 465.531 5.036 5 20 JKBD CN(C(=O)CSc1ccc([N+](=O)[O-])cc1)[C@@H]1CCSc2ccc(Br)cc21 504559311 QKVVXCTYRHROOS-MRXNPFEDSA-N 453.383 5.145 5 20 JKBD Cc1ccccc1-c1csc(NC(=O)c2ccc(N[C@@H](C)c3ccccn3)c([N+](=O)[O-])c2)n1 507387744 UKSMDAYEOOGDAR-INIZCTEOSA-N 459.531 5.847 5 20 JKBD COc1ccc(CNCc2ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])cc2)cc1NC(C)=O 507912513 GWLFECWMERDLFC-UHFFFAOYSA-N 455.898 5.297 5 20 JKBD Cc1ccc(-c2ccc(CN(C(=O)c3ccc(-n4cncn4)c([N+](=O)[O-])c3)C(C)C)s2)cc1 516373028 CLVGRUFSASMPNC-UHFFFAOYSA-N 461.547 5.263 5 20 JKBD C[C@H](NCc1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1)c1cccc(OC(F)F)c1 520949911 ZKQSLBRLGUEFOY-KRWDZBQOSA-N 464.472 5.900 5 20 JKBD O=C(Cc1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1)Nc1cccc(COCC2CC2)c1 521291964 HMDSXALWDGYNTN-UHFFFAOYSA-N 482.540 5.555 5 20 JKBD COCCN(C(=O)c1ccnc(Oc2ccccc2)c1)c1nc(-c2ccc([N+](=O)[O-])cc2)cs1 523868152 SHOYMFIAPKBDPV-UHFFFAOYSA-N 476.514 5.199 5 20 JKBD Cc1nn(C)cc1[C@@H](C)NC(=O)C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1 524341115 LNTPCIKRPISXSH-PWDRBQJJSA-N 461.547 5.055 5 20 JKBD CN(CCc1ccccn1)C(=O)c1ccc(Sc2nc3ccccc3s2)c([N+](=O)[O-])c1 524489501 YJSISVFAQYHYRO-UHFFFAOYSA-N 450.545 5.065 5 20 JKBD CC(=O)N1CCc2c(sc3nc(Cc4ccccc4)c([N+](=O)[O-])c(-c4ccc(C)cc4)c23)C1 542515738 ZYGWECXYWQSMRI-UHFFFAOYSA-N 457.555 5.675 5 20 JKBD CCOc1ccc(CN(C(=O)c2ccc(N[C@@H](C)c3ccccn3)c([N+](=O)[O-])c2)C(C)C)cc1 554094148 JULOQTMLUQMRJA-IBGZPJMESA-N 462.550 5.612 5 20 JKBD COc1cc(C(=O)Nc2c3ccccc3n3c(C)nc4ccccc4c23)c([N+](=O)[O-])cc1OC(F)F 585701397 NSQHWKQHDBJQEM-UHFFFAOYSA-N 492.438 5.720 5 20 JKBD CCOc1cc(NC(=O)c2ccc(SCc3csc(C)n3)cc2)c([N+](=O)[O-])cc1OCC 591599879 IVXOIQMRVRMMGV-UHFFFAOYSA-N 473.576 5.702 5 20 JKBD Cc1c(NC(=O)[C@H](C)Sc2nnc(-c3ccccc3)c(-c3ccccc3)n2)cccc1[N+](=O)[O-] 597224118 YBVZVXDDZVAPBC-KRWDZBQOSA-N 471.542 5.542 5 20 JKBD Cc1ccc(Sc2ccc(C(=O)NC3CCN(C(=O)c4ccccc4F)CC3)cc2[N+](=O)[O-])cc1 603666389 MOYGUEUGHYXBBV-UHFFFAOYSA-N 493.560 5.228 5 20 JKBD COc1cc(OC)c(C2CCN(C(=O)c3cc([N+](=O)[O-])ccc3Oc3ccccc3)CC2)c(OC)c1 603784722 JLZQZFCBCLPUAF-UHFFFAOYSA-N 492.528 5.433 5 20 JKBD O=C(C1CCN(c2ccccc2[N+](=O)[O-])CC1)N(Cc1cccnc1)c1ccc(Cl)cc1 603963842 AIJSHVZVNMQVFC-UHFFFAOYSA-N 450.926 5.093 5 20 JKBD CSc1ccc([N+](=O)[O-])c(C(=O)Nc2cc(OCC(F)(F)F)cc(OCC(F)(F)F)c2)c1 604077663 UWPDUFAXKUEELL-UHFFFAOYSA-N 484.374 5.451 5 20 JKBD CCS(=O)(=O)Nc1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2Sc2ccc(Cl)cc2)cc1 604175463 DMZLGQRQJCADBI-UHFFFAOYSA-N 491.978 5.413 5 20 JKBD Cc1nn(C)cc1[C@H](C)NC(=O)c1ccccc1Sc1ccc(C(F)(F)F)cc1[N+](=O)[O-] 609025937 UWIGTKJJBIULLO-LBPRGKRZSA-N 464.469 5.298 5 20 JKBD C[C@@H](NCc1ccc(Oc2ccc(F)cc2)c([N+](=O)[O-])c1)c1ccc(N2CCOC2=O)cc1 725847993 LZIDSUBJKIRDJR-MRXNPFEDSA-N 451.454 5.334 5 20 JKBD CC(=O)N(c1nc(COC(=O)c2cc(F)c(F)cc2[N+](=O)[O-])cs1)c1c(C)cc(C)cc1Cl 725935194 HLCKEDICGBLODD-UHFFFAOYSA-N 495.891 5.641 5 20 JKBD O=C(CCC(=O)N1CCC(C(=O)Nc2ccccc2)CC1)c1ccc2ccc3cccc4ccc1c2c34 727754346 PGBVDZMRTZTBGN-UHFFFAOYSA-N 488.587 6.424 5 20 JKBD O=C(OCC(=O)N1c2ccccc2Sc2ccc(Cl)cc21)c1cc(F)ccc1[N+](=O)[O-] 743197005 DQSVPMRUFZCRAW-UHFFFAOYSA-N 458.854 5.374 5 20 JKBD CC(=O)c1cccc(OCCCC(=O)Oc2ccc3c(-c4ccc([N+](=O)[O-])cc4)cc(=O)oc3c2)c1 746763487 RUNYCDCNJVNTOJ-UHFFFAOYSA-N 487.464 5.335 5 20 JKBD O=C(Oc1ccc(NC(=O)c2cccs2)cc1)c1csc(-c2ccc([N+](=O)[O-])cc2)n1 747625939 WMEWSXPRDFCPPQ-UHFFFAOYSA-N 451.485 5.251 5 20 JKBD C[C@@H](OC(=O)c1csc(-c2cccc([N+](=O)[O-])c2)n1)C(=O)N[C@H](C)c1ccc2ccccc2c1 747963739 ZPOGVCKZOVWFGR-HZPDHXFCSA-N 475.526 5.294 5 20 JKBD O=C(Nc1ccnn1Cc1cccc(Cl)c1Cl)c1cc([N+](=O)[O-])ccc1Br 751070122 DZUTYENGSIDTBW-UHFFFAOYSA-N 470.110 5.161 5 20 JKBD C[C@H](OC(=O)c1ccc(N2CCCC2)c([N+](=O)[O-])c1)C(=O)N1c2ccccc2Sc2ccccc21 822594200 IQVVHSZWJFPPEK-KRWDZBQOSA-N 489.553 5.570 5 20 JKBD O=C(Cc1noc(C/C(=C/c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)n1)Nc1ccccc1 904383299 VJOFTOSAYDFYND-JXAWBTAJSA-N 497.536 5.552 5 20 JKBD C[C@H](OC(=O)CCOc1ccccc1-c1ccccc1)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl 914998952 CIIDSPJPKGNUST-INIZCTEOSA-N 468.893 5.255 5 20 JKBD CC1=C(C(=O)Nc2ccccc2C(F)(F)F)[C@H](c2ccc(C(C)C)c([N+](=O)[O-])c2)NC(=S)N1 916191142 NUIPDYUXPPUFGB-IBGZPJMESA-N 478.496 5.169 5 20 JKBD O=C(O[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1)c1cc(-c2cccs2)[nH]n1 917259356 HFMDLVOYIGIGHN-HXUWFJFHSA-N 482.905 5.237 5 20 JKBD CC(C)(F)C(=O)Nc1ccc(C2(NC(=O)c3cc4cc([N+](=O)[O-])ccc4s3)CCC2)cc1 1787941214 YFNQICPWVIPLNN-UHFFFAOYSA-N 455.511 5.305 5 20 JKBD CC(C)[C@H](C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)C1(c3cccc([N+](=O)[O-])c3)CCC1)C2)c1ccccc1 1793208030 CACNGXRIGLYRKO-UHCVVMIDSA-N 489.616 5.095 5 20 JKBD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C1(c2cccc([N+](=O)[O-])c2)CCC1)[C@@H]1CCC[C@H]2CCCC[C@H]21 1800040814 LQNJJDDKZGPMLW-SZJVGWFLSA-N 493.648 5.261 5 20 JKBD Cc1oc(C(C)(C)C)cc1C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cccc(F)c2[N+](=O)[O-])[nH]n1 1816462682 DBPOSWUWDMAOQS-LJQANCHMSA-N 497.527 5.276 5 20 JKBD Cc1cccc(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)c3cccc(F)c3[N+](=O)[O-])n[nH]2)c1Cl 1821174873 OXWFRWPNXZMURE-GOSISDBHSA-N 485.903 5.039 5 20 JKBD O=C(CC1CCCC1)N1CCCC[C@H]1C1CCN(C(=O)C2(c3cccc([N+](=O)[O-])c3)CCC2)CC1 1826264908 YDBXRHMRNVBKAP-VWLOTQADSA-N 481.637 5.217 5 20 JKBD CCn1c(Cc2ccccc2)nnc1S[C@H](C(=O)Nc1ccc(C)cc1[N+](=O)[O-])c1ccccc1 9629183 PAGBSZJKKSSAEW-DEOSSOPVSA-N 487.585 5.578 5 20 JKBD CCOc1cc(/C=C(/C(=O)OCC(=O)Nc2cc([N+](=O)[O-])ccc2Cl)c2ccccc2)ccc1O 10911219 YYJHKJGRQDDIIC-XDHOZWIPSA-N 496.903 5.075 5 20 JKBD Cc1ccc(-n2ccnc2S[C@@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2C(F)(F)F)c(C)c1 11424624 MFGDCVONHWVGDW-AWEZNQCLSA-N 464.469 5.535 5 20 JKBD Cc1ccc(C)c(NC(=O)[C@@H](C)OC(=O)c2ccccc2C(=O)c2ccc(Cl)c([N+](=O)[O-])c2)c1 15710199 QLEIYEBHEQKZOZ-MRXNPFEDSA-N 480.904 5.280 5 20 JKBD CCn1c(S[C@@H](C)C(=O)Nc2ccccc2C(F)(F)F)nc2cc3ccccc3cc2c1=O 18467442 MTNNNXOPTRBWNW-AWEZNQCLSA-N 471.504 5.708 5 20 JKBD COc1cccc([C@H](NC(=O)c2ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])cc2)c2nccn2C)c1 24018069 VFCAFZUYNJOQSE-QHCPKHFHSA-N 492.919 5.302 5 20 JKBD COc1ccc(-c2nnc(SCC(=O)Nc3cc([N+](=O)[O-])ccc3F)n2C2CCCCC2)cc1 28606478 KWWBWHCSCGUNTF-UHFFFAOYSA-N 485.541 5.237 5 20 JKBD Cc1nc(SCc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)c2cc(-c3ccccc3)sc2n1 28614927 WKXWTYMKOGQHRA-UHFFFAOYSA-N 461.528 5.917 5 20 JKBD Cc1ccc(NC(=O)[C@@H](C)SCc2nc(=O)c3c(-c4ccccc4)csc3[nH]2)cc1[N+](=O)[O-] 29486335 XHLFTGPMYVPXSB-CQSZACIVSA-N 480.571 5.129 5 20 JKBD Cc1nn(Cc2ccc(C(=O)NC3C[C@H](C(F)(F)F)C[C@@H](C(F)(F)F)C3)cc2)c(C)c1[N+](=O)[O-] 33195893 UVZDQVVFIZRUAJ-HZPDHXFCSA-N 492.420 5.096 5 20 JKBD C[C@H](Sc1nc(-c2ccco2)nc2ccccc12)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl 45677317 GCQPJQCCVFZGPV-LBPRGKRZSA-N 454.895 5.571 5 20 JKBD CCOc1cccc2cc([C@H](C)NC(=O)c3ccc(N[C@H](C)c4ccccn4)c([N+](=O)[O-])c3)oc12 108789324 NXFSUBUIBKJBMD-SJORKVTESA-N 474.517 5.799 5 20 JKBD Cc1sc(NC(=O)c2ccc(F)cc2I)nc1-c1cccc([N+](=O)[O-])c1 195704335 KOQWJSBJYJRJSM-UHFFFAOYSA-N 483.262 5.023 5 20 JKBD C[C@H](SC1=N/C(=C/c2ccccc2)C(=O)N1c1ccc(F)cc1)C(=O)Nc1cccc([N+](=O)[O-])c1 207429721 SHQJXMBCHAMQNB-SITPEIFSSA-N 490.516 5.238 5 20 JKBD Cc1cccc(C)c1NS(=O)(=O)c1ccc(NC(=O)c2cc3ccccc3c3cccnc23)cc1 303060803 XKBLUTBESOFDJQ-UHFFFAOYSA-N 481.577 6.058 5 20 JKBD COc1ccc([C@H](NC(=O)c2ccc([N+](=O)[O-])cc2F)c2ccccc2)cc1Br 303221669 VKIXKXKBLYSURF-HXUWFJFHSA-N 459.271 5.024 5 20 JKBD O=C(c1csc(-c2cccc([N+](=O)[O-])c2)n1)N(Cc1ccc(Cl)c(Cl)c1)Cc1ccccn1 499606445 AYEYBEDPDSORLZ-UHFFFAOYSA-N 499.379 6.263 5 20 JKBD CC(C)CC(=O)N1CCC(NC(=O)c2ccc(Sc3nc4ccccc4s3)c([N+](=O)[O-])c2)CC1 500072289 IWHVRFIPVTUWBV-UHFFFAOYSA-N 498.630 5.123 5 20 JKBD CCOc1cc([N+](=O)[O-])c(C(=O)NCC2(c3cccc(C(F)(F)F)c3)CCCC2)cc1OC 502882157 YAKRXQZPBSPGCM-UHFFFAOYSA-N 466.456 5.263 5 20 JKBD COc1cc(C(=O)Nc2ccc(Sc3nnc(C)s3)cc2C)c([N+](=O)[O-])cc1OC(F)F 509282817 DJRZUXAAODYSRZ-UHFFFAOYSA-N 482.490 5.077 5 20 JKBD C[C@H](NCC1(c2ccc(Cl)cc2Cl)CCOCC1)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl 513181442 AVPRDTFLKGVJIA-ZDUSSCGKSA-N 486.783 5.220 5 20 JKBD C[C@@H](NC(=O)CSc1ccc(C(F)(F)F)cc1[N+](=O)[O-])c1ccc(OCC(F)(F)F)cc1 517875213 XWWAROGILQUYKE-LLVKDONJSA-N 482.402 5.524 5 20 JKBD CCN(Cc1ccccc1)C(=O)c1cc(NC(=O)c2cc(OC)ccc2[N+](=O)[O-])ccc1Cl 518615077 WCXKOKFTIIRVTP-UHFFFAOYSA-N 467.909 5.171 5 20 JKBD Cc1ccc(NC(=O)Nc2ccccc2)cc1NC(=O)[C@@H](C)Oc1ccc(Cl)cc1[N+](=O)[O-] 518832991 RIZDEOJZSJEAOV-OAHLLOKOSA-N 468.897 5.607 5 20 JKBD O=C(Nc1ccc(Oc2ccccc2C(F)(F)F)cc1)N1CCN(c2ccc([N+](=O)[O-])nc2)CC1 519054459 WHUGJMRZAIRFID-UHFFFAOYSA-N 487.438 5.155 5 20 JKBD Cc1n[nH]c(C)c1NC(=O)CSc1nc2cc([N+](=O)[O-])ccc2n1-c1cccc(C(F)(F)F)c1 585694257 TXSHGARLLVCSBW-UHFFFAOYSA-N 490.467 5.023 5 20 JKBD C[C@@H]1CCCCN1Cc1ccc(NC(=O)c2cc(OCC(F)(F)F)ccc2[N+](=O)[O-])cc1 603965635 DVRPJLUTLNHYCG-OAHLLOKOSA-N 451.445 5.163 5 20 JKBD C[C@H]1CCC[C@@H](C)N1C(=O)c1cc(Cl)ccc1NCc1nc(-c2cccc([N+](=O)[O-])c2)no1 604010097 NOMWLDSIFIEOHL-GASCZTMLSA-N 469.929 5.313 5 20 JKBD COC(=O)c1ccc2c(c1)CCN2C(=O)C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1 604233414 TWGYWIDMAGJLGX-XSFVSMFZSA-N 499.548 5.511 5 20 JKBD COc1cccc(OC)c1OC1CCN(c2ccc(C(=O)Nc3ccc(C)cc3)cc2[N+](=O)[O-])CC1 608972752 LOITYTMMQAAMSN-UHFFFAOYSA-N 491.544 5.221 5 20 JKBD Cn1cc(-c2cncc(C(=O)Nc3cc([N+](=O)[O-])ccc3Nc3cccc(C(F)(F)F)c3)c2)cn1 609407365 AYIUDQSEMYBIBP-UHFFFAOYSA-N 482.422 5.405 5 20 JKBD COc1cccc([C@H](CNC(=O)c2cc(SC)ccc2[N+](=O)[O-])c2c[nH]c3ccccc23)c1OC 612566065 WRQBSWATZDEFOJ-NRFANRHFSA-N 491.569 5.377 5 20 JKBD CCC(CC)c1cc[n+](/C(C(=S)NCC(F)(F)F)=C(/O)c2ccc(C)c([N+](=O)[O-])c2)cc1 725760056 JJDOUIZIYVVIHJ-UHFFFAOYSA-O 468.521 5.457 5 20 JKBD Cc1ccc(-c2nnco2)cc1NC(=O)CCC(=O)c1ccc2ccc3cccc4ccc1c2c34 727755821 KFPXQNHEEUHUKN-UHFFFAOYSA-N 459.505 6.544 5 20 JKBD C[C@H](NC(=O)CCC(=O)c1ccc2ccc3cccc4ccc1c2c34)c1cccc(NS(C)(=O)=O)c1 727756229 VXNKANPGIOVOEF-SFHVURJKSA-N 498.604 5.796 5 20 JKBD O=C(COc1ccc(Oc2ccccn2)cc1)N(CC1CC1)c1ccc(Cl)c([N+](=O)[O-])c1 728165968 TUAPTSWETVPYOP-UHFFFAOYSA-N 453.882 5.258 5 20 JKBD Cc1ccc(C(=O)N(CC2CC2)c2ccc(Cl)c([N+](=O)[O-])c2)cc1NC(=O)c1ccco1 728166959 QDGXVCNFMQHEMW-UHFFFAOYSA-N 453.882 5.459 5 20 JKBD CC(C)N(Cc1nnc(-c2cccc([N+](=O)[O-])c2)o1)C(=O)c1ccc(NC(=O)OC(C)(C)C)cc1 747572532 APCXXMBWXCWXAT-UHFFFAOYSA-N 481.509 5.043 5 20 JKBD COc1ccc(NC(=O)[C@H](C)Sc2ncc(-c3ccccc3)n2CC(F)(F)F)c([N+](=O)[O-])c1 748031778 PQOHKPAAVQAHMD-ZDUSSCGKSA-N 480.468 5.149 5 20 JKBD CC1=C(C(=O)Nc2ccc(F)cc2)[C@@H](c2ccc([N+](=O)[O-])o2)NC(=S)N1c1ccc(C)c(C)c1 812835121 MVEBCPBKCKZZQO-JOCHJYFZSA-N 480.521 5.292 5 20 JKBD O=C(OCc1csc(-c2ccco2)n1)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 825265151 JDFQKCZLTNPLFT-UHFFFAOYSA-N 481.452 5.290 5 20 JKBD O=C(COC(=O)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1)Nc1ccnn1C1CCCC1 849192316 VWRKVCCDXLBHRJ-UHFFFAOYSA-N 484.896 5.148 5 20 JKBD O=C(Oc1ccc2c(-c3ccc([N+](=O)[O-])cc3)cc(=O)oc2c1)c1cc([N+](=O)[O-])ccc1Cl 890307833 NAZFLTRKDGYBRD-UHFFFAOYSA-N 466.789 5.149 5 20 JKBD C[C@H](Nc1ccc(-c2nc(-c3ccc(N4CCCCC4)nc3)no2)cc1[N+](=O)[O-])c1ccccn1 904427546 SPTPXZGFHUZKSU-KRWDZBQOSA-N 471.521 5.265 5 20 JKBD COc1ccc(CSCC(=O)Nc2ccccc2SC[C@@H]2CC2(Cl)Cl)cc1[N+](=O)[O-] 917752453 VPOBEMIZZZPEGR-AWEZNQCLSA-N 487.430 5.761 5 20 JKBD CCOC(=O)Nc1ccc(N[C@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2ccccc2)cc1 917933060 CVYHMICKKHNLES-NRFANRHFSA-N 468.897 5.609 5 20 JKBD O=C(Nc1ccccc1C(=O)Nc1ccc(N2CCCCC2)cn1)c1ccc([N+](=O)[O-])cc1Cl 919852288 GZPSHAMGPLVMIP-UHFFFAOYSA-N 479.924 5.138 5 20 JKBD CC1=CC[C@H](C(=O)NC2(c3ccc(NC(=O)Cc4cc([N+](=O)[O-])ccc4F)cc3)CCC2)CC1 1786671047 AEISMYYJFZZBNB-SFHVURJKSA-N 465.525 5.157 5 20 JKBD CC(C)[C@H](C(=O)NC1(c2ccc(NC(=O)c3nc[nH]c3[N+](=O)[O-])cc2)CCC1)c1ccc(Cl)cc1 1788610423 HYGHOEHFGYGWRI-FQEVSTJZSA-N 495.967 5.159 5 20 JKBD Cc1ncsc1C(=O)NC1(c2ccc(NC(=O)c3cc4cc([N+](=O)[O-])ccc4s3)cc2)CCC1 1791010932 JQAFYLMIBHLNCQ-UHFFFAOYSA-N 492.582 5.636 5 20 JKBD CC(C)=CCCC(=O)NC[C@@H]1CCN(C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)[C@@H]1c1cccnc1 1807997049 KNJSMODQTPGNTQ-UQBPGWFLSA-N 492.601 5.271 5 20 JKBD O=C(Nc1cc([C@H]2CCCCN2C(=O)c2sc3ccccc3c2Cl)[nH]n1)c1ccc([N+](=O)[O-])o1 1814309117 GMQXJLKOKNOOSZ-CQSZACIVSA-N 499.936 5.399 5 20 JKBD Cc1ccc2[nH]c(C(=O)N3CCC([C@H]4CCCCN4C(=O)c4ccc([N+](=O)[O-])cc4F)CC3)cc2c1 1830496181 JMQYTHFHWKWCKK-RUZDIDTESA-N 492.551 5.071 5 20 JKBD COc1cc(C(=O)N2CCC([C@@H]3CCCCN3C(=O)c3ccc(C)cc3Cl)CC2)ccc1[N+](=O)[O-] 1832608279 MAVITNOGCFMNLW-QFIPXVFZSA-N 499.995 5.112 5 20 JKBD O=C(c1ccccc1[N+](=O)[O-])N(C[C@@H]1CCCO1)c1nc(-c2ccc(Cl)cc2Cl)cs1 14819613 GIIZZHFJLXUROZ-AWEZNQCLSA-N 478.357 5.851 5 20 JKBD COc1ccc(NC(=O)[C@@H](OC(=O)[C@@H](C)Sc2ccc([N+](=O)[O-])cc2)c2ccccc2)cc1 16118552 YRERYBFBAZHXEI-ZHRRBRCNSA-N 466.515 5.007 5 20 JKBD CSc1ccc([N+](=O)[O-])c(C(=O)OCc2csc(N(C(C)=O)c3ccc(C)c(C)c3)n2)c1 16196841 YHABBKSFLKXYRO-UHFFFAOYSA-N 471.560 5.432 5 20 JKBD CCn1c(S[C@H](C)C(=O)Nc2ccc(F)cc2Cl)nc2cc3ccccc3cc2c1=O 22178135 ATUBPFNXGQMCAD-CYBMUJFWSA-N 455.942 5.481 5 20 JKBD CCCCSc1nnc(S[C@@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2C(F)(F)F)s1 22490734 GMRUCWQVAVTWOT-VIFPVBQESA-N 466.532 5.477 5 20 JKBD O=C(OCc1coc(-c2ccccc2)n1)c1ccccc1C(=O)c1ccc(Cl)c([N+](=O)[O-])c1 24279293 XAEYERCVVHAKKW-UHFFFAOYSA-N 462.845 5.491 5 20 JKBD C[C@H](OC(=O)Cn1c2ccccc2c(=O)c2ccccc21)C(=O)Nc1ccccc1Oc1ccccc1 28775139 CNONOYLPQXXXOD-FQEVSTJZSA-N 492.531 5.517 5 20 JKBD O=[N+]([O-])c1cccc(-c2noc(CSc3nnc(-c4ccc(Cl)cc4)n3Cc3ccco3)n2)c1 31842880 XJQBEGZJSQPSQZ-UHFFFAOYSA-N 494.920 5.490 5 20 JKBD CCC[C@H](NC(=O)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1)c1nnc2ccccn12 116458602 HFSTXKDJXJOSQD-SFHVURJKSA-N 465.897 5.354 5 20 JKBD C[C@H](Nc1ccc(C(=O)N[C@@H]2C[C@@H]2c2ccccc2C(F)(F)F)cc1[N+](=O)[O-])c1ccccn1 116554196 DDFIQUALOYVRPR-AVBTWRTFSA-N 470.451 5.468 5 20 JKBD Cc1ccc(CN(C(=O)c2ccc(Sc3nncn3C)c([N+](=O)[O-])c2)[C@H]2CCc3ccccc32)cc1 302934463 IGSQGPJYKHUVIM-QHCPKHFHSA-N 499.596 5.513 5 20 JKBD C[C@H](Nc1ccc(C(=O)N[C@@H](C)c2nc(-c3ccccc3)cs2)cc1[N+](=O)[O-])c1ccccn1 410288341 KTZIVODFDIHUBG-IRXDYDNUSA-N 473.558 5.777 5 20 JKBD C[C@@H](NC(=O)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1)c1cc2ccccc2o1 500420160 DRCOTZVOBRTCGO-CQSZACIVSA-N 461.440 5.454 5 20 JKBD O=C(C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)NCCc1cccc(F)c1 503242338 MFHAOKIYZLAXDR-RGEXLXHISA-N 461.518 5.633 5 20 JKBD CC[C@H](C)n1c(SCC(=O)N(Cc2ccc([N+](=O)[O-])cc2)C(C)C)nnc1-c1ccccc1 504063873 YBCLGZBSODFGDA-SFHVURJKSA-N 467.595 5.354 5 20 JKBD Cc1c(NC(=O)[C@@H](C)Nc2cccc(NC(=O)c3cccc(C(F)(F)F)c3)c2)cccc1[N+](=O)[O-] 507506464 FFEGRYLCVCIXFM-OAHLLOKOSA-N 486.450 5.613 5 20 JKBD COc1ccc(CNCc2ccc(Sc3ccc(C)cc3)c([N+](=O)[O-])c2)cc1NC(C)=O 507914016 NHYARKZNLUUTEO-UHFFFAOYSA-N 451.548 5.311 5 20 JKBD Cc1ccc([C@H](NC(=O)c2ccc([N+](=O)[O-])cc2I)c2ccccc2)cc1 508761254 FXUQPQOXOGNQBJ-HXUWFJFHSA-N 472.282 5.027 5 20 JKBD CC(C)N1CCC[C@H](CNC(=O)C/C(=C\c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)C1 521143240 RXQKWHQRWFAFKQ-DOAWATSRSA-N 478.618 5.372 5 20 JKBD CCCc1ccc([C@@H](NC(=O)C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2cccs2)cc1 603705433 BEDDGCRNILDUKL-HXUWFJFHSA-N 457.939 5.107 5 20 JKBD O=C(CSc1ccc(C(F)(F)F)cc1[N+](=O)[O-])Nc1ccc(C(=O)NC2CCCC2)cc1 603976818 YAWZKTFWOKICTG-UHFFFAOYSA-N 467.469 5.017 5 20 JKBD Cc1cc(C(=O)N2CCC(C)CC2)ccc1NC(=O)c1ccc(N2CCC[C@@H](C)C2)c([N+](=O)[O-])c1 603993373 UBYVXIYYNYZFFT-LJQANCHMSA-N 478.593 5.264 5 20 JKBD O=[N+]([O-])c1cccc(-c2noc(CN[C@H](c3ccccc3)c3ccc(Br)cc3F)n2)c1 604009355 DNWAWXFBUMBJJQ-OAQYLSRUSA-N 483.297 5.426 5 20 JKBD O=C(Nc1nc(C2CC2)c(Cc2ccc(F)cc2)s1)c1ccc(-n2ccnc2)c([N+](=O)[O-])c1 608902224 KTQKNKFBIZLVSN-UHFFFAOYSA-N 463.494 5.097 5 20 JKBD Cc1ccc(Sc2ccc(C(=O)N(C)C3CCN(C(=O)c4ccccc4)CC3)cc2[N+](=O)[O-])cc1 608953121 UOHBBFIVCLIUFA-UHFFFAOYSA-N 489.597 5.431 5 20 JKBD COc1cc(CNCc2ccc(Oc3ccc(F)cc3)c([N+](=O)[O-])c2)cc(Br)c1OC 609223654 YTEHCKPFBNEYFN-UHFFFAOYSA-N 491.313 5.596 5 20 JKBD COc1ccc([C@@H]2CCCCCN2C(=O)CSc2nc3cc4ccccc4cc3c(=O)n2C)cc1 613973428 XBTBHEMXXORFNG-VWLOTQADSA-N 487.625 5.331 5 20 JKBD O=C(Cn1c2ccccc2c(=O)c2ccccc21)Nc1ccc(CC[C@@H](O)c2ccccc2)cc1 727763051 QPXPDNVAWWNUGD-MUUNZHRXSA-N 462.549 5.460 5 20 JKBD C[C@H](OC(=O)C[C@@H](c1ccccc1)C(F)(F)F)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 728654006 SXIOWKZTMWLFCU-FZMZJTMJSA-N 478.345 5.220 5 20 JKBD CC(=O)N(c1nc(COC(=O)Cn2ccc3cc([N+](=O)[O-])ccc32)cs1)c1c(C)cc(C)cc1C 744616278 NRKVBNBOYGZPEB-UHFFFAOYSA-N 492.557 5.359 5 20 JKBD CCc1cccc(CC)c1-n1c(-c2cccnc2)nn(CN(C)Cc2ccccc2[N+](=O)[O-])c1=S 914783332 WCMUFCFGYVBNKR-UHFFFAOYSA-N 488.617 5.588 5 20 JKBD O=C(Cc1cccc([N+](=O)[O-])c1)Nc1ccc(C2(NC(=O)[C@@H]3C[C@H]3c3ccccc3)CCC2)cc1 1785795408 NETGZKQEXJLCCV-LOSJGSFVSA-N 469.541 5.075 5 20 JKBD O=C(CCc1cccc([N+](=O)[O-])c1)Nc1ccc(C2(NC(=O)c3ccc(Cl)o3)CCC2)cc1 1786600313 MQEOOYJDZIIBSZ-UHFFFAOYSA-N 467.909 5.222 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)c3cc4cc([N+](=O)[O-])ccc4s3)CCC2)cc1)c1ccco1 1787272577 UGBXKGFWZFDWHC-UHFFFAOYSA-N 461.499 5.464 5 20 JKBD O=C(CCc1c[nH]c2ccccc12)Nc1ccc(C2(NC(=O)c3cc(O)cc([N+](=O)[O-])c3)CCC2)cc1 1788244254 JRLQBNFVTWUGFM-UHFFFAOYSA-N 498.539 5.162 5 20 JKBD Cc1c(C(=O)Nc2ccc(C3(NC(=O)/C=C/c4ccccc4[N+](=O)[O-])CCC3)cc2)nc2ccccn12 1788932945 BQDRRCNYEZBBPQ-XNTDXEJSSA-N 495.539 5.012 5 20 JKBD Cc1cc(C(=O)Nc2ccc(C3(NC(=O)/C=C/c4ccc([N+](=O)[O-])o4)CCC3)cc2)ccc1F 1790665632 YTOYGHMEJMLPJB-DHZHZOJOSA-N 463.465 5.096 5 20 JKBD CCOc1ccsc1C(=O)NC1(c2ccc(NC(=O)Cc3cc(F)ccc3[N+](=O)[O-])cc2)CCC1 1792307524 FCGXDOPECCOWHO-UHFFFAOYSA-N 497.548 5.185 5 20 JKBD COc1cc(C)c(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cc4cc([N+](=O)[O-])ccc4s2)C3)c(C)c1 1800652411 GCTKZQCISXAJKR-REPLKXPHSA-N 493.585 5.001 5 20 JKBD Cc1ccc(CC(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3ccc4ccoc4c3)CC2)cc1[N+](=O)[O-] 1830364047 HVLIETPLQBOFON-XMMPIXPASA-N 489.572 5.125 5 20 JKBD Cc1c(Cl)cccc1C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cc(F)cc([N+](=O)[O-])c2)CC1 1830612399 FYDUHWBFHOEUPP-HSZRJFAPSA-N 487.959 5.243 5 20 JKBD O=C(/C=C/c1ccccc1[N+](=O)[O-])N1CCC([C@H]2CCCCN2C(=O)c2cc3ccsc3[nH]2)CC1 1830888531 RZGWVINUBMUILF-HYGBKTPJSA-N 492.601 5.084 5 20 JKBD CCOc1ccc(NC(=O)c2ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])c(OC)c2)cc1OC 11870512 DALJLRVZHKQCTH-UHFFFAOYSA-N 472.881 5.709 5 20 JKBD O=C(Nc1ccccc1Cl)C(=Cc1ccccc1[N+](=O)[O-])C(=O)Nc1ccccc1Cl 20794261 WKRHKUOYRMHGCF-UHFFFAOYSA-N 456.285 5.562 5 20 JKBD CCNC(=O)COc1cccc(NC(=O)c2cc([N+](=O)[O-])ccc2Sc2ccc(Cl)cc2)c1 27503588 ISIRHQOJYQPHHL-UHFFFAOYSA-N 485.949 5.167 5 20 JKBD COc1cccc(-c2nnc(SCc3nnc(-c4ccc([N+](=O)[O-])cc4)o3)n2-c2ccccc2)c1 29838417 OYFANUMEOFGHQZ-UHFFFAOYSA-N 486.513 5.193 5 20 JKBD Cc1cc(Br)ccc1NC(=O)c1ccccc1NC(=O)c1ccc([N+](=O)[O-])cc1Cl 72100318 UDBVMZMXQFHZFQ-UHFFFAOYSA-N 488.725 5.824 5 20 JKBD O=C(Nc1ccc(NC(=O)c2ccc(N3CCCC3)c([N+](=O)[O-])c2)c(C(F)(F)F)c1)c1ccoc1 107888017 WYMNGQPSWQNYFU-UHFFFAOYSA-N 488.422 5.311 5 20 JKBD CCC(C)(C)NC(=O)c1ccc(NC(=O)c2ccc(NCc3ccccc3)c([N+](=O)[O-])c2)cc1 115653714 SQEGOUXMDCEKRI-UHFFFAOYSA-N 460.534 5.378 5 20 JKBD COc1ccc(CSCC(=O)Nc2ccc(C(=O)N3CCCC[C@H]3C)c(Cl)c2)cc1[N+](=O)[O-] 496933656 WRSBWWFQLYZZRB-OAHLLOKOSA-N 491.997 5.143 5 20 JKBD COc1ccc(F)cc1-c1csc(NC(=O)c2ccc(N[C@H](C)c3ccccn3)c([N+](=O)[O-])c2)n1 507354135 RNLMZJZQBWVVTP-CQSZACIVSA-N 493.520 5.686 5 20 JKBD Cc1sc(CNC(=O)c2ccc(N3CCCC3)c([N+](=O)[O-])c2)nc1-c1ccc(Cl)cc1 507917288 IQUIHFATNBPDQQ-UHFFFAOYSA-N 456.955 5.210 5 20 JKBD O=C(c1ccc(Sc2nc3ccccc3s2)c([N+](=O)[O-])c1)N(Cc1ccccn1)C1CC1 508109549 LEQZCKKGPNBDOG-UHFFFAOYSA-N 462.556 5.556 5 20 JKBD Cc1cc(NC(=O)c2cccc(F)c2)sc1C(=O)N(Cc1ccc([N+](=O)[O-])cc1)C(C)C 509731484 XIXMARMJAZKPMV-UHFFFAOYSA-N 455.511 5.407 5 20 JKBD O=C(NCC1(c2ccc(Cl)cc2Cl)CCOCC1)Nc1ccc([N+](=O)[O-])cc1Cl 517805846 FYDSOYYCQSRSLE-UHFFFAOYSA-N 458.729 5.425 5 20 JKBD C[C@H](NC(=O)C(=O)Nc1ccc(Oc2ccccc2C(F)(F)F)c(F)c1)c1cccc([N+](=O)[O-])c1 519956713 WBKMADBJBCXVLO-ZDUSSCGKSA-N 491.397 5.361 5 20 JKBD COCCOc1c(Cl)cccc1NC(=O)c1ccc(N2C[C@@H](C)C[C@@H](C)C2)c([N+](=O)[O-])c1 520006084 HJWHGFBYYWYIGK-IYBDPMFKSA-N 461.946 5.008 5 20 JKBD Cc1ccc2cccc(NC(=O)c3ccc(C(=O)Nc4cccc5ccc(C)nc45)c([N+](=O)[O-])c3)c2n1 524357294 NFDWHAVITDIGJS-UHFFFAOYSA-N 491.507 5.813 5 20 JKBD O=C(C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1)N1CCC[C@H]1c1ccccc1Cl 603996679 OVRKLVPKAOCEAC-IBGZPJMESA-N 481.902 5.847 5 20 JKBD Cc1sc(NC(=O)[C@H]2CCCN(c3ncccc3C(F)(F)F)C2)nc1-c1cccc([N+](=O)[O-])c1 603997892 XIYLUIMLMIIJNF-HNNXBMFYSA-N 491.495 5.296 5 20 JKBD C[C@H]1CCC[C@H](C)N1C(=O)c1cc(Cl)ccc1NCc1nc(-c2ccc([N+](=O)[O-])cc2)no1 604010253 XZWSFPVTVSGXBS-GJZGRUSLSA-N 469.929 5.313 5 20 JKBD CCCCN(C(=O)c1ccc(N[C@H](C)c2ccccn2)c([N+](=O)[O-])c1)[C@H](C)c1ccc(C)o1 604491523 WPEQFXCDPRQNKO-RTBURBONSA-N 450.539 6.068 5 20 JKBD O=C(NCc1ccccc1F)c1cc(NC(=O)c2c[nH]c3ccc([N+](=O)[O-])cc23)ccc1Cl 608853095 ZHWBSHMVVVCBAQ-UHFFFAOYSA-N 466.856 5.051 5 20 JKBD Cc1ccc(NC(=O)c2ccc(N[C@@H](C)c3ccc(NC(=O)C4CC4)cc3)c([N+](=O)[O-])c2)cc1 608972439 KEUZVJODQJQDIO-KRWDZBQOSA-N 458.518 5.677 5 20 JKBD CCC(CC)c1cc[n+](/C(C(=S)Nc2ccc(OC)nc2)=C(/O)c2ccc(C)c([N+](=O)[O-])c2)cc1 726962927 NLXXVWLJOMSNQX-UHFFFAOYSA-O 493.609 5.821 5 20 JKBD O=C1OCCN1c1cccc(CNCc2ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])cc2)c1 727469529 VPWMBTWWULDYMU-UHFFFAOYSA-N 453.882 5.287 5 20 JKBD CCN(C(=S)Nc1ccc([N+](=O)[O-])cc1)[C@H]1CCSc2ccc(Br)cc21 728797755 SSKRYJSITKOHQL-INIZCTEOSA-N 452.399 5.613 5 20 JKBD O=C(CSc1nc2ccc([N+](=O)[O-])cc2s1)N1CCC(c2nc3ccccc3s2)CC1 748124171 VFRGLCMQGHJHFE-UHFFFAOYSA-N 470.601 5.313 5 20 JKBD Cc1cccc2sc(C(=O)OCC(=O)Nc3ccc([N+](=O)[O-])cc3C(F)(F)F)c(Cl)c12 875311867 MJGNBDLSMNAZSC-UHFFFAOYSA-N 472.828 5.586 5 20 JKBD O=C(c1ccc([N+](=O)[O-])s1)N1CCC[C@H]1c1nc(-c2ccc(Oc3ccc(F)cc3)nc2)no1 904504765 IXJXPMXTLMAWKB-INIZCTEOSA-N 481.465 5.010 5 20 JKBD Cc1onc(-c2c(Cl)cccc2Cl)c1C(=O)OCc1cc([N+](=O)[O-])cc2c1OCOC2 913349973 BLYINHGWBLTLRA-UHFFFAOYSA-N 465.245 5.089 5 20 JKBD COC(=O)Nc1ccc(NC(=O)c2ccc(NCc3ccccc3Cl)c([N+](=O)[O-])c2)cc1 916473970 YCNKNISKUWJDSH-UHFFFAOYSA-N 454.870 5.291 5 20 JKBD O=C(Nc1ccc(-c2csc(N3CCOCC3)n2)cc1)c1cc2ccccc2c2cccnc12 916740287 NVJSKNXVFPTAEL-UHFFFAOYSA-N 466.566 5.600 5 20 JKBD C[C@@H](Sc1nc2cc3ccccc3cc2c(=O)n1C)C(=O)Nc1ccc(N2CCCCC2)cc1 918054279 IEDCGHRANINABE-GOSISDBHSA-N 472.614 5.196 5 20 JKBD O=C(c1ccccc1C1CC1)N1CCC([C@H]2CCCCN2C(=O)c2cc(F)cc([N+](=O)[O-])c2)CC1 1830615550 KPTDSJLHGAEQJW-RUZDIDTESA-N 479.552 5.158 5 20 JKBD Cc1ccc(CC(=O)N2CCC([C@H]3CCCCN3C(=O)C34CCC(CC3)CC4)CC2)cc1[N+](=O)[O-] 1832389819 IPACOVQUVAMUJP-MKNZIIIOSA-N 481.637 5.036 5 20 JKBD C[C@@H](Sc1nnc(CN2CCCCC2)n1-c1ccccc1)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 17718319 KCTLRRULDDMVNP-QGZVFWFLSA-N 491.577 5.065 5 20 JKBD COc1ccc2c(CC(=O)O[C@H](C(=O)Nc3ccc(C)cc3[N+](=O)[O-])c3ccccc3)coc2c1 20974125 DYRATVRYEMJAIM-VWLOTQADSA-N 474.469 5.124 5 20 JKBD O=C(CCCn1c(=O)oc2cc([N+](=O)[O-])ccc21)Nc1ccccc1Oc1ccccc1Cl 24401371 BJMKFBQTLRJNPN-UHFFFAOYSA-N 467.865 5.367 5 20 JKBD Cc1c(NC(=O)c2sc(-c3ccccc3)cc2OCC(=O)N2CCCCC2)cccc1[N+](=O)[O-] 410153951 KLFQFVWZCPTHRO-UHFFFAOYSA-N 479.558 5.275 5 20 JKBD COc1ccc(OC)c(CNC(=O)C/C(=C\c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)c1 483080373 FPWKYZZBOIXHCM-QGOAFFKASA-N 489.553 5.469 5 20 JKBD O=C(Nc1ccc(F)cc1-c1ccc(Cl)cc1)N1CCN(C(=O)c2ccc([N+](=O)[O-])s2)CC1 491424239 PSJJFECXRANMBX-UHFFFAOYSA-N 488.928 5.106 5 20 JKBD Cc1ccc(NC(=O)c2csc(-c3ccc([N+](=O)[O-])cc3)n2)cc1NS(=O)(=O)c1ccccc1 497499862 NBSHGJBLNWZPCY-UHFFFAOYSA-N 494.554 5.080 5 20 JKBD C[C@H](Sc1nc2ccccc2c(=O)n1Cc1ccccc1)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 501106196 FJGPRYUCIWNQOE-INIZCTEOSA-N 485.525 5.256 5 20 JKBD CN(CCCCCc1cc(-c2ccccc2)no1)C(=O)c1cn(C)nc1-c1ccc([N+](=O)[O-])cc1 506556635 SPPYEVPPMOUPJT-UHFFFAOYSA-N 473.533 5.135 5 20 JKBD Cc1ccccc1-c1csc(NC(=O)c2ccc(N[C@H](C)c3ccccn3)c([N+](=O)[O-])c2)n1 507387751 UKSMDAYEOOGDAR-MRXNPFEDSA-N 459.531 5.847 5 20 JKBD COc1ccc(Br)c(CNCc2cc(OC)c(OCc3ccccc3)cc2[N+](=O)[O-])c1 507905373 SLCLHDJAOQICKF-UHFFFAOYSA-N 487.350 5.243 5 20 JKBD C[C@H](Nc1ccc(C(=O)N[C@H](C)Cc2ccc(Br)cc2)cc1[N+](=O)[O-])c1ccccn1 508840927 FXHWYJDLSFYJGM-CVEARBPZSA-N 483.366 5.286 5 20 JKBD Cc1cccc(-c2nc(C(C)C)no2)c1NC(=O)c1ccc(N2CCC[C@H](C)C2)c([N+](=O)[O-])c1 509348481 PUXKKYDRAKSAQH-INIZCTEOSA-N 463.538 5.565 5 20 JKBD COc1ccc([C@H](NC(=O)CSCc2ccc(OC)c([N+](=O)[O-])c2)c2ccc(C)cc2)cc1 512874408 NQWVCKSQMNLUER-RUZDIDTESA-N 466.559 5.059 5 20 JKBD CC[C@H]1c2ccsc2CCN1C(=O)C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1 515078620 YHGCCUKMJWETCV-BBXQBHCASA-N 489.622 6.733 5 20 JKBD O=[N+]([O-])c1ccc(-c2ccc(CN[C@@H](c3ccc(F)cc3)[C@@H]3CCCO3)o2)c(Br)c1 517553191 UOHXVDAKZDVCFZ-VXKWHMMOSA-N 475.314 5.766 5 20 JKBD Cc1ccc(Sc2ccc(CN[C@H](c3cccc(F)c3)c3nccn3C)cc2[N+](=O)[O-])cc1 603633423 FPYULCOUMALYMK-XMMPIXPASA-N 462.550 5.806 5 20 JKBD O=C(Nc1cccc(-c2nc3ccccc3[nH]2)c1)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-] 603730457 JTYSDVLWBXGNIV-UHFFFAOYSA-N 456.380 5.332 5 20 JKBD O=[N+]([O-])c1ccc(-c2noc(CSc3nnc(-c4cccs4)n3-c3ccccc3)n2)cc1 603748478 VTWAVOVMBYWXCO-UHFFFAOYSA-N 462.516 5.246 5 20 JKBD COc1cccc(OC)c1Oc1ccc(CNC(=O)c2ccc(C(C)(C)C)c([N+](=O)[O-])c2)cn1 603970986 FOAMKJDSOGBVGX-UHFFFAOYSA-N 465.506 5.027 5 20 JKBD CC(=O)Nc1ccc(-c2csc(NC(=O)c3cc4ccccc4c4cccnc34)n2)c(F)c1 643131883 DMYWLMCBJHXMGT-UHFFFAOYSA-N 456.502 5.861 5 20 JKBD O=C(CSc1nnc(-c2ccccc2)c(-c2ccccc2)n1)Nc1cc(Cl)ccc1[N+](=O)[O-] 789674079 ZMNJICNUDBCCNM-UHFFFAOYSA-N 477.933 5.498 5 20 JKBD COc1cc(COC(=O)c2csc(-c3ccc(Cl)cc3)n2)c([N+](=O)[O-])cc1OC(F)F 792599746 BKNXRPVNRDCZRX-UHFFFAOYSA-N 470.837 5.339 5 20 JKBD COc1ccc(C)cc1NC(=O)[C@@H](OC(=O)c1ccc(N2CCCC2)c([N+](=O)[O-])c1)c1ccccc1 798273191 SIQJKGGNPOXPBD-VWLOTQADSA-N 489.528 5.049 5 20 JKBD Cc1nc2ccccc2c(-c2ccccc2)c1CC(=O)O[C@@H](C)C(=O)Nc1cccc([N+](=O)[O-])c1C 855747587 PGLRIRDOWSYKDW-IBGZPJMESA-N 483.524 5.540 5 20 JKBD CCOc1ccc(C(=O)O[C@@H](C)C(=O)N2c3ccccc3Sc3ccccc32)cc1[N+](=O)[O-] 856716799 ZNFVCZIKDIXYRV-HNNXBMFYSA-N 464.499 5.368 5 20 JKBD CC(=O)c1ccc(OCCCC(=O)Oc2ccc3c(-c4ccc([N+](=O)[O-])cc4)cc(=O)oc3c2)cc1 890296476 XKJVOJMXWUYKTB-UHFFFAOYSA-N 487.464 5.335 5 20 JKBD COc1ccc(COC(=O)c2ccccc2NC(=O)c2ccc([N+](=O)[O-])cc2Cl)cc1F 916596731 GZHDYXIORXHDOV-UHFFFAOYSA-N 458.829 5.005 5 20 JKBD CC1CCN(c2ccc([N+](=O)[O-])cc2C(=O)Nc2cccc(NC(=O)c3ccccc3)c2)CC1 917222069 BBTKKGAYPHDFSU-UHFFFAOYSA-N 458.518 5.336 5 20 JKBD CN(Cc1ccccc1)c1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2I)cc1 917824432 VXNGRJOOZFKYTI-UHFFFAOYSA-N 487.297 5.088 5 20 JKBD C[C@@H](N[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1)c1cccc([N+](=O)[O-])c1 917939536 VOPDOZCLVPDBJM-SPLOXXLWSA-N 454.870 5.187 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)c3cc4cc[nH]c4cc3Cl)CCC2)cc1)c1ccc([N+](=O)[O-])o1 1785750678 MQKBLPJOMKNGOI-UHFFFAOYSA-N 478.892 5.384 5 20 JKBD O=C(NC1(c2ccc(NC(=O)[C@H]3C[C@H]3c3ccc(F)c(F)c3)cc2)CCC1)c1ccc([N+](=O)[O-])o1 1786174883 NYMXZKRMEINZDG-ROUUACIJSA-N 481.455 5.017 5 20 JKBD O=C(/C=C/c1ccc([N+](=O)[O-])o1)NC1(c2ccc(NC(=O)CSc3ccccc3)cc2)CCC1 1787775537 QTQJNDPGFRXELC-ACCUITESSA-N 477.542 5.127 5 20 JKBD Cc1cc(CCCC(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)C[C@H](C)c2ccccc2)C3)c([N+](=O)[O-])cc1F 1793405640 VQXQLMUHGVJRQL-ABQRKTDGSA-N 495.595 5.197 5 20 JKBD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C1(c2cccc([N+](=O)[O-])c2)CCC1)c1cccc2ccccc12 1800040703 ZAWJLFSFMUQNEJ-NUNAXRQHSA-N 483.568 5.122 5 20 JKBD CC(C)(C)CCCCCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)Cn1ccc3ccc([N+](=O)[O-])cc31)C2 1801829167 PARMHCBDEMYEIV-KOUNCHBCSA-N 482.625 5.184 5 20 JKBD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)/C=C/c1ccccc1[N+](=O)[O-])c1ccc(-c2ccccc2)c(F)c1 1804344184 ZNYMZFFDGMANPJ-HVFRCHRUSA-N 499.542 5.366 5 20 JKBD O=C(/C=C/c1ccc([N+](=O)[O-])o1)N1CCCC2(CCN(C(=O)c3ccc(-c4ccccc4)cc3)CC2)C1 1805685181 CBPUZHFOWNLFGT-ACCUITESSA-N 499.567 5.413 5 20 JKBD Cc1c(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)/C=C/c3ccccc3[N+](=O)[O-])[nH]n2)oc2ccccc12 1818571360 UUYPNVQZVUQAFP-TWLJRWAQSA-N 499.527 5.392 5 20 JKBD O=C([C@H](F)c1ccccc1)N1CCC([C@H]2CCCCN2C(=O)CSc2ccccc2[N+](=O)[O-])CC1 1831774854 FAGWITZYOQAGQL-PXDATVDWSA-N 499.608 5.017 5 20 JKBD O=C(c1cc2cc([N+](=O)[O-])ccc2s1)N1CCC([C@@H]2CCCCN2C(=O)CCc2ccoc2)CC1 1832349091 GCZCESVDEWXXPG-QFIPXVFZSA-N 495.601 5.269 5 20 JKBD CCCCC[C@@H](C)C(=O)N1CCC([C@H]2CCCCN2C(=O)Cc2cc(F)ccc2[N+](=O)[O-])CC1 1832889351 WACFMTHKHLVKPF-AUSIDOKSSA-N 475.605 5.113 5 20 JKBD O=C(/C=C/c1ccccc1[N+](=O)[O-])N1CC2(CCCN2C(=O)c2ccc(-c3ccc(Cl)cc3)o2)C1 1843459954 KOANGYOFOIHYBK-MDWZMJQESA-N 491.931 5.039 5 20 JKBD O=C(COC(=O)c1cc([N+](=O)[O-])ccc1Sc1ccccc1)Nc1ccccc1C(F)(F)F 9066997 ZNQILJPVVYYXJY-UHFFFAOYSA-N 476.432 5.560 5 20 JKBD Cc1ccc(NC(=O)[C@H](Sc2nnc(C)n2-c2ccccc2C)c2ccccc2)c([N+](=O)[O-])c1 10245687 OBLYFRNDXFSGMS-HSZRJFAPSA-N 473.558 5.573 5 20 JKBD COc1cc(CSc2nc(C(F)(F)F)nc3ccccc23)c([N+](=O)[O-])cc1OC(F)F 11016208 GLAFMMNRMSQHKP-UHFFFAOYSA-N 461.368 5.459 5 20 JKBD COc1cccc(-c2nn(-c3ccc(C)cc3)cc2C(=O)Nc2cc([N+](=O)[O-])c(F)cc2F)c1 115521614 WZMMNUGFUMFQLF-UHFFFAOYSA-N 464.428 5.295 5 20 JKBD CCn1c(S[C@H](C)C(=O)Nc2nc(-c3cccc([N+](=O)[O-])c3)cs2)nnc1-c1cccc(C)c1 255934479 RSJGVRVBVZKBOI-OAHLLOKOSA-N 494.602 5.424 5 20 JKBD Brc1ccc(-c2nnc(CSc3nc4ccccc4c4nc5ccccc5n34)o2)o1 410241446 LAOKOVGZGUOFKB-UHFFFAOYSA-N 478.331 5.734 5 20 JKBD O=C(CCNc1ccc(C(F)(F)F)cc1[N+](=O)[O-])Nc1ccc(-n2cccn2)cc1C(F)(F)F 482450135 SKFVTYKVODIYKA-UHFFFAOYSA-N 487.360 5.259 5 20 JKBD O=C(Nc1ccc(-c2nc3c(F)cccc3[nH]2)cc1)C1CCN(c2ccccc2[N+](=O)[O-])CC1 502573572 FGWCLIOSYPXFGY-UHFFFAOYSA-N 459.481 5.132 5 20 JKBD C[C@H](Nc1ccc(C(=O)N(C)Cc2cccc(Br)c2)cc1[N+](=O)[O-])c1ccccn1 503276858 VEZGGKIFBOZWST-HNNXBMFYSA-N 469.339 5.198 5 20 JKBD COCCCOc1ccccc1NC(=O)c1ccc(Sc2nc(C)cs2)c([N+](=O)[O-])c1 507803361 HTRGQNVDKVAUAW-UHFFFAOYSA-N 459.549 5.179 5 20 JKBD CCOC(=O)c1sc(-c2ccccc2)cc1NC(=O)c1cc(OC)c(OCC)cc1[N+](=O)[O-] 512067289 KOPUSYXKUXNWDI-UHFFFAOYSA-N 470.503 5.160 5 20 JKBD CCN(CC)S(=O)(=O)c1ccc(Cl)c(NC(=O)c2cc3ccccc3c3cccnc23)c1 514560665 OKWRTXDVHNFVKR-UHFFFAOYSA-N 467.978 5.324 5 20 JKBD O=C(Nc1nnc(C(F)(F)F)s1)c1cc([N+](=O)[O-])ccc1Sc1ccc(Cl)cc1 515193159 AXPOARCJRYOSHH-UHFFFAOYSA-N 460.846 5.522 5 20 JKBD C[C@H](Nc1ccccc1OC[C@H]1CCCCO1)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 518013026 BWASXFKKZHIZAD-GOEBONIOSA-N 467.444 5.001 5 20 JKBD C[C@@H](Nc1ccc(C(=O)Nc2ccc(-c3cn4ccccc4n3)cc2)cc1[N+](=O)[O-])c1ccccn1 518394932 GACMRZBUYYOVIS-GOSISDBHSA-N 478.512 5.730 5 20 JKBD Cc1cc(COc2ccc(C(=O)Nc3cc([N+](=O)[O-])c(C)cc3C)cc2Br)no1 521420894 SWPSKWGDPCTVGY-UHFFFAOYSA-N 460.284 5.102 5 20 JKBD C[C@@H](Nc1ccc(C(=O)N2CCc3c(Br)cccc3C2)cc1[N+](=O)[O-])c1ccccn1 523366460 BKBYACYHAPPCQS-OAHLLOKOSA-N 481.350 5.124 5 20 JKBD O=C(CN(Cc1ccco1)C(=O)c1csc([N+](=O)[O-])c1)Nc1ccc(Cl)c(C(F)(F)F)c1 603751142 GDQYHLPJLPTOPX-UHFFFAOYSA-N 487.843 5.203 5 20 JKBD CC(C)[C@H](Oc1ccccc1Br)C(=O)Nc1cc([N+](=O)[O-])ccc1OC(F)F 603757148 PZCIRKSNRXDKEO-INIZCTEOSA-N 459.243 5.001 5 20 JKBD C[C@@H]1CCCN(c2ccc(C(=O)N3CCC[C@H](c4nc(-c5ccc(F)cc5)no4)C3)cc2[N+](=O)[O-])C1 608817230 GNBXDJPXNDXMMD-XLIONFOSSA-N 493.539 5.040 5 20 JKBD O=C(c1c2c(nc3ccccc13)/C(=C/c1ccc([N+](=O)[O-])cc1)CCC2)N1CCC[C@H](c2ncc[nH]2)C1 609025651 WNPHIPMXCDHJIK-NUTRWHQKSA-N 493.567 5.763 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)NCCOc2ccc3cc(Br)ccc3c2)cc1SC 609126866 WEILJHLXNHTHOQ-UHFFFAOYSA-N 491.363 5.050 5 20 JKBD Cc1cc(C(=O)N2CCC[C@H]2C(=O)OCc2csc(-c3ccc(Cl)cc3)n2)ccc1[N+](=O)[O-] 726675059 PCARMDPJKQHIGT-FQEVSTJZSA-N 485.949 5.028 5 20 JKBD COc1ccc(NC(=O)[C@H](C)OC(=O)Cc2c(C)nc3ccccc3c2-c2ccccc2)c([N+](=O)[O-])c1 729235791 UPQJBNNEUGRXNW-SFHVURJKSA-N 499.523 5.240 5 20 JKBD COc1cc(C(=O)OCc2nc(-c3ccoc3)no2)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 729864200 KBXFHIOFURATCI-UHFFFAOYSA-N 471.809 5.049 5 20 JKBD COc1ccc(-c2cc(C(=O)O[C@H](C)c3nnc(-c4ccc([N+](=O)[O-])cc4)o3)sc2C)cc1 746154390 NZKQARQQNGAFMI-CYBMUJFWSA-N 465.487 5.608 5 20 JKBD O=C(NC[C@@H](c1ccccc1)c1c[nH]c2ccccc12)c1cc([N+](=O)[O-])ccc1Br 750604073 WBDDBYWGFOXUAJ-IBGZPJMESA-N 464.319 5.401 5 20 JKBD CC1CCN(c2ccc([N+](=O)[O-])cc2C(=O)Nc2cccc(OCc3cscn3)c2)CC1 751166362 KISLXEJNACMKLN-UHFFFAOYSA-N 452.536 5.119 5 20 JKBD CN(C)c1ccc(C(=O)c2ccccc2C(=O)OCc2coc(-c3cccc(F)c3)n2)cc1[N+](=O)[O-] 914617292 SEUHBDYLVBHVMB-UHFFFAOYSA-N 489.459 5.043 5 20 JKBD Cc1ccc(-c2nnc(COC(=O)c3cc([N+](=O)[O-])ccc3Sc3nc(C)cs3)o2)cc1 914888624 IOEBTPHSRRIAPF-UHFFFAOYSA-N 468.516 5.226 5 20 JKBD COc1cccc(OC)c1OC1CCN(c2cc(Cl)c(C(F)(F)F)cc2[N+](=O)[O-])CC1 917083322 QIFLAFNWGBLAPY-UHFFFAOYSA-N 460.836 5.332 5 20 JKBD C[C@H](OC(=O)c1ccc(N[C@@H](C)c2ccccn2)c([N+](=O)[O-])c1)C(=O)N1CCC[C@H]1c1cccs1 920546333 YHIBSQLNDBVVND-FIKGOQFSSA-N 494.573 5.133 5 20 JKBD O=C(Cc1cc(F)ccc1[N+](=O)[O-])NC1(c2ccc(NC(=O)[C@H]3CCCCC3(F)F)cc2)CCC1 1786467039 KTVXGNBHDJIHRI-HXUWFJFHSA-N 489.494 5.236 5 20 JKBD O=C(Cc1cc([N+](=O)[O-])ccc1F)Nc1ccc(C2(NC(=O)c3cc4ccsc4[nH]3)CCC2)cc1 1786672671 JXSACWIFCQGWAH-UHFFFAOYSA-N 492.532 5.267 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)c3n[nH]cc3[N+](=O)[O-])CCC2)cc1)c1cc2c(Cl)cccc2s1 1789093004 PMCOLLYBVYYYCG-UHFFFAOYSA-N 495.948 5.248 5 20 JKBD Cc1cccc(C)c1SCC(=O)Nc1ccc(C2(NC(=O)c3ccc([N+](=O)[O-])[nH]3)CCC2)cc1 1789647117 FSWHKWWWAFPIMC-UHFFFAOYSA-N 478.574 5.080 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)C3CCC(F)(F)CC3)CCC2)cc1)c1cc([N+](=O)[O-])cc2c1OCC2 1790044313 NFHFBHGNMTWYRC-UHFFFAOYSA-N 499.514 5.103 5 20 JKBD Cc1cc(C(=O)NC2(c3ccc(NC(=O)c4cc(Cl)cc([N+](=O)[O-])c4C)cc3)CCC2)cc(O)n1 1790773741 HEUULRZICIRKII-UHFFFAOYSA-N 494.935 5.027 5 20 JKBD Cc1cc2cc(C(=O)Nc3ccc(C4(NC(=O)c5cc(C)c([N+](=O)[O-])cn5)CCC4)cc3)ccc2[nH]1 1790988884 PQEZTTSCECQYQY-UHFFFAOYSA-N 483.528 5.149 5 20 JKBD O=C(c1ccc2occc2c1)N1CCC([C@@H]2CCCCN2C(=O)c2cccc(F)c2[N+](=O)[O-])CC1 1830621902 QGTIZCSGVYKRFX-QFIPXVFZSA-N 479.508 5.027 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2sccc2Cl)CC1 1830733736 REZPEXKJCDVHCA-IBGZPJMESA-N 493.988 5.304 5 20 JKBD C[C@@H](Sc1nc2ccc([N+](=O)[O-])cc2s1)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 10592834 JPUYXSWUCWUJKR-MRVPVSSYSA-N 472.426 5.251 5 20 JKBD O=[N+]([O-])c1cc2c(c(CSc3nnc(COc4ccccc4F)n3-c3ccccc3)c1)OCOC2 15278116 YEGFKMKORNYWLF-UHFFFAOYSA-N 494.504 5.052 5 20 JKBD CC(C)CCn1c(S[C@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)nc2ccccc2c1=O 17719605 XACHWSYEIXQNTP-OAHLLOKOSA-N 465.535 5.254 5 20 JKBD Cc1csc(Sc2ccc(C(=O)Nc3ccc(C(=O)Nc4cccnc4)cc3)cc2[N+](=O)[O-])n1 24897558 IJFNVACLOBDGSE-UHFFFAOYSA-N 491.554 5.411 5 20 JKBD O=C(c1ccc(Sc2nc3ccccc3s2)c([N+](=O)[O-])c1)N1CCC[C@H]1c1ccncc1 27270148 KWAANVHEFRZNSJ-SFHVURJKSA-N 462.556 5.728 5 20 JKBD COc1ccc([N+](=O)[O-])cc1OCc1csc(N(C(C)=O)c2c(C)cc(C)cc2Cl)n1 31673919 IGLHRMDMFXNIIR-UHFFFAOYSA-N 461.927 5.594 5 20 JKBD O=C(CSc1ccc([N+](=O)[O-])cc1)Nc1ccccc1Oc1ncc(Cl)cc1Cl 58987496 ANJISSWPORIECJ-UHFFFAOYSA-N 450.303 5.820 5 20 JKBD CC(=O)NCc1ccc(-c2nc(NC(=O)c3csc(-c4ccc([N+](=O)[O-])cc4)n3)sc2C)s1 215715915 NRFBEPJPZPGSQN-UHFFFAOYSA-N 499.599 5.100 5 20 JKBD COc1cc(OCC(=O)Nc2ccccc2NC23CC4CC(CC(C4)C2)C3)ccc1[N+](=O)[O-] 302998328 HGGBDXQFEWBOPZ-UHFFFAOYSA-N 451.523 5.002 5 20 JKBD Cc1ccc(NC(=O)c2cc3cc([N+](=O)[O-])ccc3s2)cc1NS(=O)(=O)c1ccccc1 478558884 JTKZANUYOADETD-UHFFFAOYSA-N 467.528 5.171 5 20 JKBD CN(C[C@H]1OCCc2ccccc21)C(=O)C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1 506266992 ADZFEYCNWPFKOT-KZTQLJDNSA-N 499.592 5.908 5 20 JKBD O=C(N[C@H](Cc1ccc(O)cc1)c1nc2ccccc2[nH]1)c1cc2cc([N+](=O)[O-])ccc2s1 512074058 GCNSKPOZCLDYJX-HXUWFJFHSA-N 458.499 5.105 5 20 JKBD O=C(CN1CCC[C@@H]1c1cccs1)Nc1cc(N2CCC[C@H]2c2cccs2)ccc1[N+](=O)[O-] 514884972 QAVYPUZPXDGSOA-RTWAWAEBSA-N 482.631 5.835 5 20 JKBD C[C@@H](c1nnc(Sc2ccc([N+](=O)[O-])c3cnccc23)n1-c1ccccc1)N1CCCCC1 515163960 AQEXGFRUNUGTHY-KRWDZBQOSA-N 460.563 5.422 5 20 JKBD CC1CCN(C(=O)c2ccc(NC(=O)CSc3ccc(C(F)(F)F)cc3[N+](=O)[O-])cc2)CC1 515457518 HDYRTHOUMDJRJN-UHFFFAOYSA-N 481.496 5.217 5 20 JKBD CCOc1ccc(C(F)(F)F)cc1NC(=O)c1ccc(Cn2nc(C)c([N+](=O)[O-])c2C)cc1 516353371 MCUIHPMTQGTBSR-UHFFFAOYSA-N 462.428 5.126 5 20 JKBD COc1cc(CN[C@H]2CCCc3cc(OC(F)F)ccc32)c([N+](=O)[O-])cc1OCC(F)(F)F 517552962 JVOXTNYEGBKJOA-INIZCTEOSA-N 476.398 5.313 5 20 JKBD COc1cc(C(=O)NCC2(c3cccc(F)c3)CCCCC2)c([N+](=O)[O-])cc1OCc1cscn1 517938588 PLPZUZWGXRRJRN-UHFFFAOYSA-N 499.564 5.410 5 20 JKBD CN(C[C@H]1CCCOC1)C(=O)c1ccccc1Sc1ccc(C(F)(F)F)cc1[N+](=O)[O-] 520771451 JGOFSEZJNPAFSF-CQSZACIVSA-N 454.470 5.263 5 20 JKBD Cc1ccc(NS(=O)(=O)c2ccc(NCc3ncc(-c4ccccc4)o3)c([N+](=O)[O-])c2)c(C)c1 572977996 VUZKMWUYCSEFKI-UHFFFAOYSA-N 478.530 5.280 5 20 JKBD O=C(CSc1nnc(-c2ccc(Cl)cc2)o1)Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1 588962677 LEOKBFTVOORXJJ-UHFFFAOYSA-N 473.923 5.153 5 20 JKBD CSc1ccc(C(=O)Nc2cc(OCC(F)(F)F)cc(OCC(F)(F)F)c2)cc1[N+](=O)[O-] 590098763 ZGJAYIFTRKKHDD-UHFFFAOYSA-N 484.374 5.451 5 20 JKBD COc1ccc([N+](=O)[O-])cc1C(=O)Nc1cc(-c2ccccc2OC)nn1-c1ccc(C)cc1 603760410 NFSAQRSRZDYZEU-UHFFFAOYSA-N 458.474 5.025 5 20 JKBD CC(=O)Nc1cc(NC(=O)c2cc([N+](=O)[O-])ccc2Sc2ccc(Cl)cc2)ccc1C 603774424 CFGGVRDSDWCKMN-UHFFFAOYSA-N 455.923 5.919 5 20 JKBD CCSc1nnc(Sc2ccc(S(=O)(=O)Nc3ccc(C)cc3C)cc2[N+](=O)[O-])s1 603839379 XMEIIXXTOBPQLB-UHFFFAOYSA-N 482.634 5.127 5 20 JKBD C[C@@H]1C[C@@H]1c1ccc(CNC(=O)Cc2cn(-c3ccccc3)nc2-c2ccc([N+](=O)[O-])cc2)o1 603971442 LCKJUUMOHMMGFQ-HXOBKFHXSA-N 456.502 5.023 5 20 JKBD Cc1csc(Sc2ccc(C(=O)N(c3ccc(Br)cn3)C(C)C)cc2[N+](=O)[O-])n1 603998759 QWLPGFOXGUQUTG-UHFFFAOYSA-N 493.408 5.724 5 20 JKBD Cc1ccc(NC(=O)c2ccc(NCc3ccc(NC(=O)c4ccco4)cc3)c([N+](=O)[O-])c2)cc1 608972425 JASZXASLMLIBQC-UHFFFAOYSA-N 470.485 5.613 5 20 JKBD CC(=O)Nc1ccc(NC(=O)c2ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])cc2)c(Cl)c1 609018474 AUNBSDMZPPQHGC-UHFFFAOYSA-N 460.273 5.905 5 20 JKBD O=C(Nc1ccc(-c2nc3ccccc3s2)cn1)c1csc(-c2cccc([N+](=O)[O-])c2)n1 609407611 SHGQCIKOHLAZHR-UHFFFAOYSA-N 459.512 5.642 5 20 JKBD C[C@H]1CN(c2ccc(NC(=O)c3cc(Cl)ccc3[N+](=O)[O-])cc2C(F)(F)F)C[C@@H](C)O1 728010931 KQAHANCWFXUXIM-TXEJJXNPSA-N 457.836 5.133 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)O[C@@H](C)c2ccc(NC(=O)c3ccccc3)cc2)cc1SC 728770901 ZMRKLLINJDZUOD-HNNXBMFYSA-N 466.515 5.496 5 20 JKBD CC(C)(C)OC(=O)Nc1ccc(NC(=O)/C=C\c2ccc([N+](=O)[O-])cc2)c(C(F)(F)F)c1 729656404 APBXBOAPCHULJH-WDZFZDKYSA-N 451.401 5.613 5 20 JKBD C[C@H]1CN(c2ccc(NC(=O)CNc3cc([N+](=O)[O-])ccc3Nc3ccccc3)cc2)C[C@H](C)O1 747449844 MBEAKIQGXNWSRT-OALUTQOASA-N 475.549 5.003 5 20 JKBD O=C(OCc1coc(-c2ccc(Br)cc2)n1)c1csc(-c2ccc([N+](=O)[O-])cc2)n1 747954724 KUGFKUFDYFJCBT-UHFFFAOYSA-N 486.303 5.493 5 20 JKBD Cc1ccc([C@@H](NC(=O)COC(=O)c2csc(-c3ccc([N+](=O)[O-])cc3)n2)c2cccs2)cc1 747958826 WFXCCNMGFLJSLM-JOCHJYFZSA-N 493.566 5.151 5 20 JKBD CC(C)[C@@H](OC(=O)c1csc(-c2cccc([N+](=O)[O-])c2)n1)C(=O)Nc1ccc2c(c1)CCC2 747962163 LWWXCCPALQCYGX-OAQYLSRUSA-N 465.531 5.027 5 20 JKBD O=C(c1ccc(Br)c([N+](=O)[O-])c1)N(Cc1ccc(Cl)c(Cl)c1)Cc1ccccn1 748640863 NMKDNRKMJHEITB-UHFFFAOYSA-N 495.160 5.902 5 20 JKBD Cc1csc(Sc2ccc(-c3nc(C(C)(C)NC(=O)OC(C)(C)C)no3)cc2[N+](=O)[O-])n1 904761757 ITEXMUSYEQOZLS-UHFFFAOYSA-N 477.568 5.321 5 20 JKBD O=C1N[C@@H](c2ccc(Sc3nc4ccc([N+](=O)[O-])cc4s3)c([N+](=O)[O-])c2)Nc2ccccc21 917499707 PQIPIIYDKXSNPZ-IBGZPJMESA-N 479.499 5.118 5 20 JKBD O=C(OCc1cc(Cl)ccc1OCc1cccnc1)C1CCN(c2ccccc2[N+](=O)[O-])CC1 918841677 OGNLUNRAXDAHBK-UHFFFAOYSA-N 481.936 5.182 5 20 JKBD Cc1ccc(NC(=O)[C@H](OC(=O)[C@@H]2CCC[C@@H](C(F)(F)F)C2)c2ccccc2)c([N+](=O)[O-])c1 919372401 YGJWHACOHYKUCH-MBOZVWFJSA-N 464.440 5.495 5 20 JKBD C[C@@H](Nc1ccc(C(=O)OCc2nc(-c3ccccc3)cs2)cc1[N+](=O)[O-])c1ccccn1 920121248 WNKRUDGHQDCPNN-MRXNPFEDSA-N 460.515 5.643 5 20 JKBD C[C@H](c1cccc(NC(=O)c2ccccc2)c1)N(C)C(=O)COc1cc(Cl)ccc1[N+](=O)[O-] 920993049 HPBDKUZXMTZJKW-MRXNPFEDSA-N 467.909 5.099 5 20 JKBD CC1=C(C(=O)NC2(c3ccc(NC(=O)CCCc4cc(C)c(F)cc4[N+](=O)[O-])cc3)CCC2)CCO1 1786274633 IZAGOCIQEXHXDL-UHFFFAOYSA-N 495.551 5.193 5 20 JKBD Cc1c(C(=O)Nc2ccc(C3(NC(=O)c4ccc([N+](=O)[O-])o4)CCC3)cc2)[nH]c2c(Cl)cccc12 1788499931 VLGPXDJYXWUNDV-UHFFFAOYSA-N 492.919 5.692 5 20 JKBD Cc1ncc(C(=O)Nc2ccc(C3(NC(=O)Cc4ccc(Cl)cc4[N+](=O)[O-])CCC3)cc2)s1 1788863584 YVKGBBCTMSGTAG-UHFFFAOYSA-N 484.965 5.004 5 20 JKBD O=C(CCCCn1cccc1)Nc1ccc(C2(NC(=O)Cc3cc(F)ccc3[N+](=O)[O-])CCC2)cc1 1789605556 FORBXFMBCJBXKG-UHFFFAOYSA-N 492.551 5.083 5 20 JKBD Cc1ccc(CC(=O)Nc2ccc(C3(NC(=O)c4ccoc4Cl)CCC3)cc2)cc1[N+](=O)[O-] 1790525160 DQGDFRJCHZQOMU-UHFFFAOYSA-N 467.909 5.140 5 20 JKBD O=C(Cc1ccc([N+](=O)[O-])cc1F)Nc1ccc(C2(NC(=O)[C@]3(F)CCCC=C3F)CCC2)cc1 1791185657 DBPFHFRFMJEMEC-VWLOTQADSA-N 487.478 5.156 5 20 JKBD Cc1cccc(C(=O)Nc2ccc(C3(NC(=O)c4ccc([N+](=O)[O-])o4)CCC3)cc2)c1Cl 1792109110 QPGSFMLDDWVKNA-UHFFFAOYSA-N 453.882 5.211 5 20 JKBD CCC[C@H]1CC[C@H](C(=O)N2CCC3(CCCN(C(=O)CCc4cccc([N+](=O)[O-])c4)C3)CC2)CC1 1806494366 KTCZSBGUJUIPEW-HCGLCNNCSA-N 483.653 5.365 5 20 JKBD C[C@H](Sc1ccccc1)C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2ccc([N+](=O)[O-])cc2F)CC1 1824391514 FNZJWJRRWZLTSK-UUOWRZLLSA-N 499.608 5.148 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)N1CCC([C@@H]2CCCCN2C(=O)[C@@H]2C[C@H]2c2ccccc2)CC1 1831785615 BPLXPNMNSIMOTM-FBLLAGFSSA-N 493.579 5.079 5 20 JKBD Cc1ccc(NC(=O)[C@@H](Sc2ccc3c(c2)OCCCO3)c2ccccc2)c([N+](=O)[O-])c1 10603281 VEJJBWJSIXBYTO-QHCPKHFHSA-N 450.516 5.537 5 20 JKBD CC(C)(C)c1ccc(C(=O)Nc2ccc(Oc3ccc(S(C)(=O)=O)cc3[N+](=O)[O-])cc2)cc1 15131451 UCECDZVNBUXVBT-UHFFFAOYSA-N 468.531 5.340 5 20 JKBD CCCCNS(=O)(=O)c1cccc(NC(=O)c2cc([N+](=O)[O-])ccc2Sc2ccccc2)c1 18705429 KWBJBFSHVAHSOF-UHFFFAOYSA-N 485.587 5.077 5 20 JKBD Cc1nn(Cc2ccc(C(=O)Nc3c(-c4ccccc4)nc4c(C)cccn34)cc2)c(C)c1[N+](=O)[O-] 20019674 XNYNVLQFIOKEQZ-UHFFFAOYSA-N 480.528 5.332 5 20 JKBD O=C(CSc1ccccc1C(=O)Nc1cccc([N+](=O)[O-])c1)NC12CC3CC(CC(C3)C1)C2 23243590 JWOCKCIPWSHVQI-UHFFFAOYSA-N 465.575 5.024 5 20 JKBD Cc1c(NC(=O)[C@@H](C)Sc2nnc(-c3cccs3)n2-c2ccccc2)cccc1[N+](=O)[O-] 23284626 ZZQVCXYDVOACHE-OAHLLOKOSA-N 465.560 5.332 5 20 JKBD CCn1c(SCC(=O)Nc2ncc(C(F)(F)F)cc2Cl)nc2cc3ccccc3cc2c1=O 29450575 CHNIIMMBGYMXLQ-UHFFFAOYSA-N 492.910 5.368 5 20 JKBD O=[N+]([O-])c1cccc(-c2noc(CSc3nnc(-c4ccc(F)cc4)n3Cc3ccccc3)n2)c1 31842794 DVILAITYOOGSQA-UHFFFAOYSA-N 488.504 5.383 5 20 JKBD O=C(Nc1cccc(Oc2cnccn2)c1)c1cc([N+](=O)[O-])ccc1Sc1ccc(Cl)cc1 33136449 VWEMFPXOEOPBJT-UHFFFAOYSA-N 478.917 6.234 5 20 JKBD C[C@H](Nc1cccc(COCCc2ccccc2)c1)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl 109169770 XAMMXUUUHRXCFW-KRWDZBQOSA-N 453.926 5.447 5 20 JKBD Cc1sc(NC(=O)Cc2ccc(F)c(Br)c2)nc1-c1cccc([N+](=O)[O-])c1 195704390 WUEBKKXJWICUIF-UHFFFAOYSA-N 450.289 5.110 5 20 JKBD C[C@H]1CCCN(c2ccc(C(=O)N[C@@H](C)c3nc4ccccc4n3C(F)F)cc2[N+](=O)[O-])C1 491396870 QMTDDJVOOBHUFC-GJZGRUSLSA-N 457.481 5.067 5 20 JKBD O=C(NCc1cscn1)c1c2c(nc3ccccc13)/C(=C/c1ccc([N+](=O)[O-])cc1)CCC2 495565784 ZDRZUMDOSPCVPM-SFQUDFHCSA-N 456.527 5.406 5 20 JKBD CCN(C(=O)Cc1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1)c1ccc(OC)c(OC)c1 500925118 NQODZJFGHMKUPM-UHFFFAOYSA-N 486.528 5.060 5 20 JKBD O=C(Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1)c1cccc(-n2nccc2C(F)(F)F)c1 501554066 MTGIYYCFIJTEBI-UHFFFAOYSA-N 459.409 5.175 5 20 JKBD C[C@H](Nc1ccc(C(=O)Nc2nc(-c3ccc(F)c(F)c3)cs2)cc1[N+](=O)[O-])c1ccccn1 506233562 HMCDYKLHPGIYGV-ZDUSSCGKSA-N 481.484 5.817 5 20 JKBD C[C@@H](NC(=O)c1ccc(N[C@H](C)c2ccccn2)c([N+](=O)[O-])c1)c1ccc(OC(F)F)cc1 506847819 SVYPCACXKTWCMQ-HUUCEWRRSA-N 456.449 5.255 5 20 JKBD C[C@H](Nc1ccc(C(=O)Nc2nc3cc(F)c(F)cc3s2)cc1[N+](=O)[O-])c1ccccn1 512045810 MWHXVBBRMXNWSW-NSHDSACASA-N 455.446 5.303 5 20 JKBD Cn1c(SCC(=O)N2CCc3sccc3[C@H]2c2ccccc2)nc2cc3ccccc3cc2c1=O 515424045 LXEIRHQZWNOCAR-AREMUKBSSA-N 497.645 5.415 5 20 JKBD CCN(CC)[C@H](CNC(=O)C1CCN(c2ccccc2[N+](=O)[O-])CC1)c1ccc(C(F)(F)F)cc1 521297461 WOOUZCWWUVBENM-HSZRJFAPSA-N 492.542 5.029 5 20 JKBD COCCOc1c(Cl)cccc1NC(=O)CSc1ccc(C(F)(F)F)cc1[N+](=O)[O-] 521378055 BFDSYWMROQLZGZ-UHFFFAOYSA-N 464.849 5.023 5 20 JKBD O=C(C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)N1CC2C[C@H]3CC1C[C@@H](C2)C3 521592870 MZSXKTTUIODRGO-WZFLMILYSA-N 473.598 6.172 5 20 JKBD Cc1cc(Sc2ccccc2)ccc1NC(=O)CNC(=O)c1c(Cl)cccc1[N+](=O)[O-] 561178637 RAMYUYUJIYSHGR-UHFFFAOYSA-N 455.923 5.076 5 20 JKBD CSc1nnc(CCCNC(=O)c2ccc(Nc3ccccc3)c([N+](=O)[O-])c2)n1C1CCCC1 592532268 DOMAPUMDJYNCPM-UHFFFAOYSA-N 480.594 5.130 5 20 JKBD COC(=O)c1ccc(CNC(=O)C/C(=C/c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)cc1 603468790 ZREYAWJQPOVKPU-ZHZULCJRSA-N 487.537 5.238 5 20 JKBD CCC(=O)Nc1ccc(NC(=O)c2ccccc2C(=O)c2ccc(SC)c([N+](=O)[O-])c2)cc1 603775692 YUXFRTHGVOXFSX-UHFFFAOYSA-N 463.515 5.149 5 20 JKBD CCN(CC)S(=O)(=O)c1ccc(N[C@@H](C)c2cccc(NC(=O)c3ccccc3)c2)c([N+](=O)[O-])c1 603856526 YWFNMGGVUNGNAQ-SFHVURJKSA-N 496.589 5.051 5 20 JKBD CC(C)c1nc(CSc2ccc(S(=O)(=O)N3CCCCCC3)cc2[N+](=O)[O-])cs1 604062120 NSOGMRPPNTVUBL-UHFFFAOYSA-N 455.627 5.032 5 20 JKBD Cc1ccc(-c2nc(C)c([C@@H](C)N[C@@H](C)C(=O)Nc3ccc([N+](=O)[O-])cc3Cl)s2)cc1 609352752 BYOCCDYRRMHDOQ-HIFRSBDPSA-N 458.971 5.666 5 20 JKBD CCCc1nc(C(=O)N(CC2CC2)c2ccc(Cl)c([N+](=O)[O-])c2)nn1-c1ccccc1Cl 728165471 KYEMXLGBBSOLDZ-UHFFFAOYSA-N 474.348 5.492 5 20 JKBD CCn1c(SCC(=O)N(CC2CC2)c2ccc(Cl)c([N+](=O)[O-])c2)nnc1-c1cccs1 745353666 GRAXRDFFMMASOS-UHFFFAOYSA-N 477.999 5.123 5 20 JKBD CC(C)Cn1cc([C@@H]2N(Cc3ccc(-c4ccccc4[N+](=O)[O-])o3)CC23CCOCC3)cn1 849479979 ZZHFHGNIXGDUQK-DEOSSOPVSA-N 450.539 5.061 5 20 JKBD O=C(Nc1ccc(OC[C@@H](O)COCc2ccc(Cl)cc2)cc1)c1cc([N+](=O)[O-])ccc1Cl 914795783 ZQWYAVYEUVWADP-IBGZPJMESA-N 491.327 5.110 5 20 JKBD CC(C)(C)c1ccc(Oc2ccc(CNCc3ccc(-n4ccnc4)nc3)cc2[N+](=O)[O-])cc1 915227894 POXQPDOARCGYPN-UHFFFAOYSA-N 457.534 5.555 5 20 JKBD CC1=C(C(=O)Nc2cccc(F)c2)[C@@H](c2cc([N+](=O)[O-])c(F)cc2F)NC(=S)N1c1ccccc1 916723873 PSNQGUUJFRNAIB-JOCHJYFZSA-N 498.486 5.361 5 20 JKBD Cc1c(C(=O)Nc2cc(Cl)c([N+](=O)[O-])cc2OCc2ccccc2)cc([N+](=O)[O-])cc1[N+](=O)[O-] 916827458 JYQQBNPUBRIZHC-UHFFFAOYSA-N 486.824 5.204 5 20 JKBD O=C(c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1)N1CCC(CCc2cccc(C(F)(F)F)c2)CC1 917775201 UOXYRDIMOLFXSC-UHFFFAOYSA-N 451.401 5.007 5 20 JKBD O=C(Nc1cccc(COCCOc2ccccc2)c1)c1cc([N+](=O)[O-])ccc1N1CCCC1 918623046 GAQYZHSNDBCAEF-UHFFFAOYSA-N 461.518 5.043 5 20 JKBD CN(C)c1ccc(C(=O)c2ccccc2C(=O)Oc2ccc(OCc3ccncc3)cc2)cc1[N+](=O)[O-] 919664624 KKWBBKNGMIELTP-UHFFFAOYSA-N 497.507 5.085 5 20 JKBD CC(C)c1ccc(-c2nc(C(=O)OCCNC(=O)c3ccc([N+](=O)[O-])cc3Cl)cs2)cc1 920148851 ODOIGYCVGDLSHC-UHFFFAOYSA-N 473.938 5.082 5 20 JKBD C[C@@H](NC(=O)c1ccc(NCc2ccccc2Cl)c([N+](=O)[O-])c1)c1ccc(N2CCOC2=O)cc1 920952428 OCBFNIVJUHGUTJ-MRXNPFEDSA-N 494.935 5.308 5 20 JKBD COc1cc(Cl)cc(C(=O)Nc2ccc(C3(NC(=O)c4ccc(O)c([N+](=O)[O-])c4)CCC3)cc2)c1 1792148970 GQAFSHGBGXNJSD-UHFFFAOYSA-N 495.919 5.024 5 20 JKBD Cc1c(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)c3cccc(F)c3)n[nH]2)cc(Cl)cc1[N+](=O)[O-] 1820491005 ICIHCVKDFIKSKR-LJQANCHMSA-N 485.903 5.039 5 20 JKBD CCc1ncccc1C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cc(Cl)cc([N+](=O)[O-])c2C)CC1 1825517929 RIKSEHMQRIILQF-QHCPKHFHSA-N 499.011 5.061 5 20 JKBD C/C=C/C=C\C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)CC1 1831061075 LYBOGXZLUFLZAY-MESDEOKJSA-N 467.591 5.175 5 20 JKBD O=C(c1cc2cc([N+](=O)[O-])ccc2s1)N1CCC([C@@H]2CCCCN2C(=O)CC2CCC2)CC1 1832835889 FRSYMAWHQHHBGP-NRFANRHFSA-N 469.607 5.233 5 20 JKBD Cc1ccc(-c2nnc(SCC(=O)Nc3ccc([N+](=O)[O-])cc3C(F)(F)F)o2)cc1C 10846441 JAMCVXIEAARKSC-UHFFFAOYSA-N 452.414 5.011 5 20 JKBD CCOC(=O)Nc1ccc(C(=O)Oc2ccc(NC(=O)c3cc([N+](=O)[O-])ccc3Cl)cc2)cc1 15603738 JTRNGSDNHMEHEA-UHFFFAOYSA-N 483.864 5.288 5 20 JKBD CCOc1cc([N+](=O)[O-])c(C(=O)OCc2csc(N(C(C)=O)c3cccc(C)c3C)n2)cc1OC 19159341 VSQVOEZIOJBZGV-UHFFFAOYSA-N 499.545 5.117 5 20 JKBD Cc1ccc([N+](=O)[O-])cc1NC(=O)CSc1nnc(COc2ccccc2C)n1-c1ccccc1 21229362 YRYJARCIZGTWEE-UHFFFAOYSA-N 489.557 5.102 5 20 JKBD O=C1c2ccccc2N[C@@H](c2ccc(-c3ccc([N+](=O)[O-])cc3Br)o2)N1C1CC1 23986750 UNASXCMBLNQKCY-HXUWFJFHSA-N 454.280 5.346 5 20 JKBD Cn1ccnc1C(=O)c1ccc(NC(=O)c2ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])cc2)cc1 24596830 AOSSYRYNYCAHNS-UHFFFAOYSA-N 476.876 5.257 5 20 JKBD CN(Cc1cc([N+](=O)[O-])ccc1Cl)Cn1nc(-c2cccnc2)n(Cc2ccccc2)c1=S 27533120 UGAYHFQFJBSKLS-UHFFFAOYSA-N 480.981 5.175 5 20 JKBD CC(C)c1ccccc1-n1c(SCC(=O)Nc2ccccc2[N+](=O)[O-])nnc1-c1cccnc1 28388421 YJRTYYDQURQDQS-UHFFFAOYSA-N 474.546 5.092 5 20 JKBD Cc1ccc(-c2csc(NC(=O)CCc3nc(-c4ccc(Cl)cc4)no3)n2)cc1[N+](=O)[O-] 105351072 CYSAJIQFULHBGC-UHFFFAOYSA-N 469.910 5.301 5 20 JKBD CC(C)C(=O)Nc1cccc(NC(=O)Cc2cn(-c3ccccc3)nc2-c2ccc([N+](=O)[O-])cc2)c1 105987089 WVYAEMLXJWRKQS-UHFFFAOYSA-N 483.528 5.223 5 20 JKBD Cc1csc(Sc2ccc(C(=O)N3C[C@H](C)O[C@H](c4ccccc4)C3)cc2[N+](=O)[O-])n1 109044820 REYZKKYYXRLTKI-KXBFYZLASA-N 455.561 5.113 5 20 JKBD COc1ccc(-c2nnc(SCC(=O)c3cccc([N+](=O)[O-])c3)n2C2CCCCC2)cc1 216815776 XAQQIYZOZIBMQS-UHFFFAOYSA-N 452.536 5.342 5 20 JKBD CCOc1ccc(Oc2ccc(C(F)(F)F)cc2NC(=O)CCn2cc([N+](=O)[O-])nc2C)cc1 303004163 OXCWLZIXMHYSAL-UHFFFAOYSA-N 478.427 5.338 5 20 JKBD CCCN(CCC)C(=O)c1cccc(C(=O)Nc2nc(-c3cccc([N+](=O)[O-])c3)cs2)c1 482152066 JXZLHHXISYIRTC-UHFFFAOYSA-N 452.536 5.233 5 20 JKBD CCNC(=O)c1ccc(C)c(NC(=O)c2ccc(Sc3nc4ccccc4s3)c([N+](=O)[O-])c2)c1 482904600 CIEMLXCNPMDRAE-UHFFFAOYSA-N 492.582 5.666 5 20 JKBD O=C(CN(Cc1ccc(Cl)cc1)C(=O)c1cc2cccc([N+](=O)[O-])c2[nH]1)Nc1ccccc1F 488048710 IIAMSVMCYRSGBX-UHFFFAOYSA-N 480.883 5.150 5 20 JKBD C[C@@H](Nc1ccc(C(=O)N2CCC(c3nc4ccccc4[nH]3)CC2)cc1[N+](=O)[O-])c1ccccn1 506161416 WKPJHWXEDQKWRG-QGZVFWFLSA-N 470.533 5.059 5 20 JKBD C[C@H](Nc1ccc(C(=O)Nc2cccc(OCc3cccnc3)c2)cc1[N+](=O)[O-])c1ccccn1 507402196 KAYHVCXAMVRVCR-SFHVURJKSA-N 469.501 5.389 5 20 JKBD COc1ccccc1N1CC[C@H](CNCc2ccc(Oc3ccc(F)cc3)c([N+](=O)[O-])c2)C1 507920197 FXAVXZNHWPJXMC-LJQANCHMSA-N 451.498 5.151 5 20 JKBD COc1cc(C(=O)N(Cc2ccc([C@@H]3C[C@H]3C)o2)C2CC2)c([N+](=O)[O-])cc1OCc1cscn1 512343293 NVWCHMJTZCKNDF-RDTXWAMCSA-N 483.546 5.160 5 20 JKBD COc1ccc(Oc2cc(CNCc3ccc(Oc4ccc(F)cc4)c([N+](=O)[O-])c3)ccn2)cc1 513109878 GZYHKHUWBABXQJ-UHFFFAOYSA-N 475.476 6.012 5 20 JKBD O=C(Nc1ccc(-c2cn3ccccc3n2)cc1)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-] 514562639 NJPRQLWQSLXSHW-UHFFFAOYSA-N 456.380 5.103 5 20 JKBD C[C@@H](Sc1nc2cc3ccccc3cc2c(=O)n1C)C(=O)N(C)Cc1c(F)cccc1Cl 514960985 FEMLDPWCQJSYLZ-CQSZACIVSA-N 469.969 5.018 5 20 JKBD Cc1cccc2sc(N(Cc3ccccc3)C(=O)CSc3ncccc3[N+](=O)[O-])nc12 520087791 BYUXUNIFISRCDP-UHFFFAOYSA-N 450.545 5.233 5 20 JKBD COc1ccc([N+](=O)[O-])cc1NC(=O)N(C)CCCCCc1cc(-c2cccc(F)c2)no1 520171000 CJBFCYGQSCKPPE-UHFFFAOYSA-N 456.474 5.274 5 20 JKBD Cc1ccc([N+](=O)[O-])cc1C(=O)Nc1ccc(NS(=O)(=O)c2c(Cl)cccc2Cl)cc1 520777083 VQILINQOMYLJPZ-UHFFFAOYSA-N 480.329 5.263 5 20 JKBD Cc1ccc(NC(=O)c2cccc(C(F)(F)F)c2)cc1NC(=O)CCn1nc(C)c([N+](=O)[O-])c1C 523253492 KICRHJXLHQNYFF-UHFFFAOYSA-N 489.454 5.016 5 20 JKBD COc1ccc([N+](=O)[O-])cc1NC(=O)[C@@H](Oc1ccccc1Br)c1ccccc1 603750391 NGCATCBYHKCYCL-FQEVSTJZSA-N 457.280 5.125 5 20 JKBD CCOc1cc([N+](=O)[O-])c(C(=O)N2CC[C@@H](C)Sc3ccc(C(F)(F)F)cc32)cc1OC 603961826 KQLHQLNBTFKJGL-GFCCVEGCSA-N 470.469 5.552 5 20 JKBD CCOc1cc([N+](=O)[O-])c(C(=O)N(Cc2cccnc2)c2ccc(Br)cc2)cc1OC 603990490 UUXJJVTXFSLAFR-UHFFFAOYSA-N 486.322 5.007 5 20 JKBD CCN(C(=O)c1ccc(SCCC(C)C)c([N+](=O)[O-])c1)c1ccc(Br)cn1 608808023 JEXNZVAOPISXOD-UHFFFAOYSA-N 452.374 5.557 5 20 JKBD O=C(Nc1ccccc1OCc1ncc(-c2cccc(Cl)c2)o1)c1cc2cc([N+](=O)[O-])ccc2o1 608851058 QOKZWFCPCKDCEX-UHFFFAOYSA-N 489.871 6.481 5 20 JKBD CCOc1ccc(N(C(=O)Cc2ccc(OC)c([N+](=O)[O-])c2)c2nc3ccccc3s2)cc1 609009517 YJDMBGHTZXIRET-UHFFFAOYSA-N 463.515 5.519 5 20 JKBD O=C(C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)N1CCC[C@H](N2CCCC2)C1 609346252 WDQISEIVQDURTL-PTMWEUFISA-N 476.602 5.222 5 20 JKBD Cc1ccc([C@H](C)NC(=O)c2ccc(C(=O)N[C@H](C)c3ccc(C)s3)cc2[N+](=O)[O-])s1 727851826 OGENIDXTELEXSJ-CABCVRRESA-N 457.577 5.317 5 20 JKBD O=C(Nc1nc2ccccc2n1Cc1cccc(C(F)(F)F)c1)c1cc(F)c(F)cc1[N+](=O)[O-] 727999553 QQCNXWFPBCEPMV-UHFFFAOYSA-N 476.361 5.542 5 20 JKBD CC(C)(C)OC(=O)NCc1ccc2c(c1)CCCN2C(=O)c1csc(-c2cccc([N+](=O)[O-])c2)n1 731023839 ZYZWTHZUIAYXQN-UHFFFAOYSA-N 494.573 5.336 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Cl)[C@@H](c1ccccc1)N1CCC([C@H](O)c2ccc(F)cc2)CC1 731037819 LKNMBTLHOLICOO-JWQCQUIFSA-N 497.954 5.513 5 20 JKBD CC(C)(C)OC(=O)Nc1ccc(C(F)(F)F)cc1NC(=O)COc1ccc([N+](=O)[O-])c(F)c1 745861077 BOVBDISWZMTMAU-UHFFFAOYSA-N 473.379 5.117 5 20 JKBD CCn1c(CN[C@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2ccccc2)nc2ccccc21 750297407 PMGODAYRCZWGDB-QHCPKHFHSA-N 463.925 5.087 5 20 JKBD O=C(Nc1ccccc1SC(F)F)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 899898919 ZJYBOPNKHKGNKC-UHFFFAOYSA-N 475.439 5.783 5 20 JKBD Cc1ccc(/C(O)=C(/C(=S)N[C@H]2C[C@H]3CC[C@H]2C3)[n+]2ccc(C(C)(C)C)cc2)cc1[N+](=O)[O-] 912844240 NYEGOUIACLBBJN-WFXMLNOXSA-O 466.627 5.478 5 20 JKBD O=C(Nc1ccc(OC[C@@H](O)c2cccc(Br)c2)cc1)c1cc([N+](=O)[O-])ccc1Cl 914683771 JUVLQNYHZNHUOG-HXUWFJFHSA-N 491.725 5.375 5 20 JKBD CCCc1ccc([C@@H](NC(=O)C(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)c2cccs2)cc1 915741506 YHJKLCGCSKJKFR-HXUWFJFHSA-N 457.939 5.107 5 20 JKBD CC(=O)N(c1ccc(C)cc1)c1nc(COC(=O)[C@H](C)Sc2ccc([N+](=O)[O-])cc2)cs1 918875484 NQGXNWLVPDAOOT-HNNXBMFYSA-N 471.560 5.268 5 20 JKBD O=C(C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)Nc1cccc(-n2ccnc2O)c1 920082427 CPPBFDHRNSXFKT-NBVRZTHBSA-N 497.536 5.665 5 20 JKBD C[C@@H](Nc1ccccc1)C(=O)NC1(c2ccc(NC(=O)CCc3cccc([N+](=O)[O-])c3)cc2)CCC1 1786602188 FQEFLULEGRZCMT-HXUWFJFHSA-N 486.572 5.162 5 20 JKBD CCc1ncccc1C(=O)NC1(c2ccc(NC(=O)c3c(F)ccc([N+](=O)[O-])c3C)cc2)CCC1 1790770574 IIFLGDPTRURKRW-UHFFFAOYSA-N 476.508 5.061 5 20 JKBD Cc1c(C(=O)Nc2ccc(C3(NC(=O)CC4CCOCC4)CCC3)cc2)cc(Cl)cc1[N+](=O)[O-] 1790774353 LWLLOEZIVSWPOS-UHFFFAOYSA-N 485.968 5.121 5 20 JKBD C/C(=C\c1ccc(C)o1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cc3cc([N+](=O)[O-])ccc3s1)C2 1798531989 MDXFAXVDBKRWOJ-QZBGTXJESA-N 479.558 5.066 5 20 JKBD O=C(CC1CCCC1)Nc1cc([C@H]2CCCCN2C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)[nH]n1 1816688282 ORMGMWQTVJARAM-LJQANCHMSA-N 481.578 5.419 5 20 JKBD CC(C)[C@H]1CC[C@H](C(=O)Nc2cc([C@@H]3CCCCN3C(=O)Cc3cc([N+](=O)[O-])ccc3F)[nH]n2)CC1 1822101845 ASENIQZUXJNKCT-BSRJHKFKSA-N 499.587 5.154 5 20 JKBD Cc1oc(C(C)(C)C)cc1C(=O)N1CCC([C@@H]2CCCCN2C(=O)/C=C/c2ccc([N+](=O)[O-])o2)CC1 1824274912 PNEFMLINCGMWTI-RCHCNPRSSA-N 497.592 5.333 5 20 JKBD Cc1ccc(C(=O)N2CCCC[C@H]2C2CCN(C(=O)c3cc4cc([N+](=O)[O-])ccc4s3)CC2)cn1 1825817808 GHZIZAUIARDVGJ-QFIPXVFZSA-N 492.601 5.060 5 20 JKBD CC[C@H]1CC[C@H](C(=O)N2CCC([C@H]3CCCCN3C(=O)c3cc([N+](=O)[O-])ccc3N(C)C)CC2)CC1 1830766971 WVKMOADKRBRASW-QFZWGZQFSA-N 498.668 5.111 5 20 JKBD O=[N+]([O-])c1ccc([C@]23CC4C[C@](c5ccc([N+](=O)[O-])cc5)(C2)C[C@@](c2ccc([N+](=O)[O-])cc2)(C4)C3)cc1 2332239715 JIOGYTVWYIZINK-YWDUBSAXSA-N 499.523 6.523 5 20 JKBD CC(=O)N(c1ccccc1)c1nc(COC(=O)c2ccc(N3CCC[C@H](C)C3)c([N+](=O)[O-])c2)cs1 10210221 PPNJGNUKOREDOD-KRWDZBQOSA-N 494.573 5.329 5 20 JKBD CCn1c(S[C@@H](C(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)c2ccccc2)nnc1C1CC1 17769323 CIMXCQLFXOIGPQ-GOSISDBHSA-N 457.943 5.209 5 20 JKBD C[C@@H](Sc1nnc(-c2ccccc2)n1-c1ccccc1)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 17899350 MYXJQBYSOXOOGU-MRXNPFEDSA-N 470.514 5.746 5 20 JKBD CC(C)N(Cc1nnc(-c2cccc([N+](=O)[O-])c2)o1)C(=S)Nc1ccc(Oc2ccccc2)cc1 18142990 LOGINPOUIFOOPJ-UHFFFAOYSA-N 489.557 6.045 5 20 JKBD CC(C)NC(=O)Nc1ccc(NC(=O)c2ccc(NCc3ccccc3Cl)c([N+](=O)[O-])c2)cc1 30994378 OUJKQZPOAQKOQI-UHFFFAOYSA-N 481.940 5.643 5 20 JKBD COc1ccc(-n2c(SCC(=O)Nc3ccccc3[N+](=O)[O-])nnc2-c2ccccc2)cc1Cl 36185894 KGZCJUKYXSEQLJ-UHFFFAOYSA-N 495.948 5.235 5 20 JKBD C[C@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)N[C@@H](C)c1ccc(NC(=O)c2ccc(F)cc2)cc1 71988244 QJFVBXCEIUFAIQ-HOTGVXAUSA-N 467.522 5.344 5 20 JKBD COc1cc(C(=O)Nc2ccc(C)cc2OCc2ccccc2)c([N+](=O)[O-])cc1OC(F)F 117555711 SJIDHDLAOVMXCC-UHFFFAOYSA-N 458.417 5.345 5 20 JKBD COc1ccc(CNC(=O)c2ccc(N[C@@H](C)c3ccccn3)c([N+](=O)[O-])c2)cc1OC1CCCC1 485456694 XAXVDMOEBMNKJA-SFHVURJKSA-N 490.560 5.423 5 20 JKBD CSc1ccc(C(=O)N(CC(=O)Nc2ccccc2F)Cc2ccc(Cl)cc2)cc1[N+](=O)[O-] 488051760 QDQBHGVRUVYNMU-UHFFFAOYSA-N 487.940 5.390 5 20 JKBD Cc1cccc(C)c1Oc1ccccc1NC(=O)N1CCN(C(=O)c2ccc([N+](=O)[O-])s2)CC1 507787480 FVOGZOYTBCIVPI-UHFFFAOYSA-N 480.546 5.055 5 20 JKBD C[C@@H](Nc1ccc(C(=O)Nc2ccc(CN3CCCC[C@H]3C)cc2)cc1[N+](=O)[O-])c1ccccn1 518439357 NKBSKVKSUGVTAN-WOJBJXKFSA-N 473.577 5.790 5 20 JKBD CCCOc1cc(NC(=O)c2cc(C)nc3onc(C(C)C)c23)c([N+](=O)[O-])cc1OCCC 520466109 JHRVRXWWWULERC-UHFFFAOYSA-N 456.499 5.393 5 20 JKBD O=C(Cc1ccccc1[N+](=O)[O-])N(c1ccc(Cl)c(Cl)c1)c1nc2ccccc2s1 603006212 YQYIYXVCSDECDP-UHFFFAOYSA-N 458.326 6.419 5 20 JKBD CCOc1ccc(N(C(=O)[C@@H](C)Sc2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)cc1 603818786 UMNCUUZCAYZOHJ-MRXNPFEDSA-N 479.583 6.449 5 20 JKBD C[C@H]1CCCN(c2ccc(C(=O)N3CCC([C@H]4C(=O)Nc5cc(Cl)ccc54)CC3)cc2[N+](=O)[O-])C1 608971108 IGQFRTNXLXZQPP-UPCLLVRISA-N 496.995 5.073 5 20 JKBD COc1nc(C)cc(C)c1CNC(=O)C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1 608972099 SZZSRLIIJPFSPE-CPNJWEJPSA-N 488.569 5.472 5 20 JKBD CCN(C(=O)C1CCN(c2ccccc2[N+](=O)[O-])CC1)[C@H](c1cccnc1)c1ccc(F)c(F)c1 609151725 SFKGUYIAISNBPA-VWLOTQADSA-N 480.515 5.123 5 20 JKBD CCN1CCC(N(C)C(=O)C/C(=C/c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)CC1 609231838 BDSQVFOBEJQYQP-MNDPQUGUSA-N 464.591 5.078 5 20 JKBD O=C1CCc2cc(-c3csc(NC(=O)c4cc([N+](=O)[O-])ccc4SC4CCCC4)n3)ccc2N1 619735843 QGDWGNGRXBLTHY-UHFFFAOYSA-N 494.598 5.890 5 20 JKBD CC(=O)N(c1nc(COC(=O)c2cc3cc([N+](=O)[O-])ccc3o2)cs1)c1cccc(C)c1C 728328550 VAIFJAICWYOVNE-UHFFFAOYSA-N 465.487 5.456 5 20 JKBD Cc1ccc2nc(-c3cccnc3)cc(C(=O)O[C@@H](C)c3nnc(-c4ccc([N+](=O)[O-])cc4)o3)c2c1 730442791 YBKYHIOLUOXMDY-INIZCTEOSA-N 481.468 5.481 5 20 JKBD O=C(O[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Br)c1ccccc1)c1ccc2[nH]ccc2c1 730856046 SEDLGIGTHWAVFD-NRFANRHFSA-N 494.301 5.375 5 20 JKBD CCC(C)(C)NC(=O)c1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2Br)cc1Cl 751094507 WEQKRFJXRXXFLA-UHFFFAOYSA-N 468.735 5.181 5 20 JKBD C[C@H](Nc1ccc(-c2nc(-c3ccc(Oc4ccc(F)cc4)nc3)no2)cc1[N+](=O)[O-])c1ccccn1 904511706 SZRGRBGTXAAOSG-INIZCTEOSA-N 498.474 6.206 5 20 JKBD COc1cc2[nH]c(/C(Cl)=C/c3ccc(-c4cccc([N+](=O)[O-])c4)s3)nc(=O)c2cc1OC 912859429 SECDENICIUCTEX-SXGWCWSVSA-N 469.906 5.314 5 20 JKBD CCCc1cc[n+](/C(C(=S)Nc2cccc(C(F)(F)F)c2)=C(/O)c2cccc([N+](=O)[O-])c2)cc1 916202334 USPHMXPQIWLCME-UHFFFAOYSA-O 488.511 6.177 5 20 JKBD Cc1nc(Oc2ccc(NC(=O)c3cccc([N+](=O)[O-])c3)cc2)c2cnn(-c3ccccc3)c2n1 916974088 GHKWJCMGCLMSLP-UHFFFAOYSA-N 466.457 5.077 5 20 JKBD COc1cc(/C=C(\Cl)c2nc3ccc([N+](=O)[O-])cc3[nH]2)cc(Br)c1OC(F)F 917143902 STWRCBLYEDPNQE-WZUFQYTHSA-N 474.645 5.581 5 20 JKBD COc1cc(/C=C\C(=O)Oc2c(C)cc(C)cc2[N+](=O)[O-])ccc1OCc1c(C)noc1C 918680702 XKPJOHUREFHMMW-CLFYSBASSA-N 452.463 5.023 5 20 JKBD CC(C)CCSc1ccc(C(=O)N[C@H](C)c2ccc(N3CCOC3=O)cc2)cc1[N+](=O)[O-] 920955594 WHQWTZHIPDVWEP-MRXNPFEDSA-N 457.552 5.181 5 20 JKBD CC(C)N(Cc1nnc(-c2cccc([N+](=O)[O-])c2)o1)C(=O)CCCOc1cccc(Cl)c1Cl 921147575 HIUCCKWPRGPIRV-UHFFFAOYSA-N 493.347 5.548 5 20 JKBD O=C(Cc1ccc(Cl)cc1[N+](=O)[O-])Nc1ccc(C2(NC(=O)c3cnoc3C3CC3)CCC2)cc1 1786116614 WKVKKQGXOIBGCM-UHFFFAOYSA-N 494.935 5.104 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)c3cc([N+](=O)[O-])cc4c3OCC4)CCC2)cc1)c1ccc2occc2c1 1789050537 ZDCMPKFZIAABDB-UHFFFAOYSA-N 497.507 5.337 5 20 JKBD O=C(CCc1cccc([N+](=O)[O-])c1)NC1(c2ccc(NC(=O)c3ccc(Cl)cn3)cc2)CCC1 1789732935 PHVURYUMEAESOX-UHFFFAOYSA-N 478.936 5.024 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)[C@@H]3CCCCC3(F)F)CCC2)cc1)c1cc([N+](=O)[O-])cc2c1OCC2 1790044127 AJGBVUBBSHSKBL-NRFANRHFSA-N 499.514 5.103 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)[C@H]3C[C@]3(F)Cl)CCC2)cc1)c1cc2cc([N+](=O)[O-])ccc2s1 1791009850 AIFBNUYIXWZQOV-UZUQRXQVSA-N 487.940 5.482 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2c[nH]c(C(C)(C)C)c2)[nH]n1 1821282900 GKRPMJIQIDXBNP-IBGZPJMESA-N 496.543 5.011 5 20 JKBD Cc1c(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)C3CC4(CCC4)C3)n[nH]2)cc(Cl)cc1[N+](=O)[O-] 1823057003 ULLWCFFKZLYPHF-LJQANCHMSA-N 485.972 5.166 5 20 JKBD C/C(=C\c1cccs1)C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cc([N+](=O)[O-])c(O)cc2C)CC1 1830787848 QJIPITOJOFPMFI-OVWUPXBPSA-N 497.617 5.007 5 20 JKBD Cc1cc2cc(C(=O)N3CCCC[C@H]3C3CCN(C(=O)c4cccc(F)c4[N+](=O)[O-])CC3)ccc2[nH]1 1831035583 FADJZLKDSLDFMK-DEOSSOPVSA-N 492.551 5.071 5 20 JKBD Cc1c(C(=O)N2CCC([C@H]3CCCCN3C(=O)/C=C/C(C)C)CC2)cc(Cl)cc1[N+](=O)[O-] 1832512498 GMRCCIFQIKDJCG-QQUYBBDPSA-N 461.990 5.002 5 20 JKBD CC(=O)N(c1ccc(C)c(C)c1)c1nc(COC(=O)/C=C/c2ccc([N+](=O)[O-])cc2)cs1 10757085 JGGZWGDWCPPGLV-YRNVUSSQSA-N 451.504 5.109 5 20 JKBD COc1ccc(CSc2nnc(S[C@@H](C)c3nnc(-c4ccc([N+](=O)[O-])cc4)o3)s2)cc1 17705272 FFNWPBKLRVHSDT-LBPRGKRZSA-N 487.588 5.651 5 20 JKBD CCCn1c(=O)c2ccccc2n2c(SCc3nc4ccccc4c4ccccc34)nnc12 20069679 ZPCXFOYRSTYANB-UHFFFAOYSA-N 451.555 5.448 5 20 JKBD C[C@@H](Sc1nnc(-c2ccc(Br)cc2)o1)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 104938035 YVTCVCXXTZIFTG-SNVBAGLBSA-N 474.296 5.311 5 20 JKBD COc1ccc(C(=O)Nc2cccc(/C=C(/c3ccncc3)c3ccc([N+](=O)[O-])cc3)c2)cc1 215737559 CWHLAIVRGIDSCW-NLRVBDNBSA-N 451.482 5.840 5 20 JKBD O=C(Nc1nnc(C(F)F)s1)c1c2c(nc3ccccc13)/C(=C\c1cccc([N+](=O)[O-])c1)CCC2 409460536 GYBSHUKPFIZULT-KAMYIIQDSA-N 493.495 6.061 5 20 JKBD O=C(CSc1nnc(-c2ccc(Br)o2)n1Cc1ccccc1)c1ccc([N+](=O)[O-])cc1 409606879 BVHHMEDLRAZXNL-UHFFFAOYSA-N 499.346 5.232 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Cl)N[C@H](Cn1cnc2ccccc21)c1ccc(F)cc1 409754892 OWHOMOFIGQEQOJ-HXUWFJFHSA-N 453.861 5.300 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)Nc2nc(-c3ccc(OC(F)F)cc3)cs2)cc1SC 483015702 AYWBEKGNPRZBLI-UHFFFAOYSA-N 467.475 5.303 5 20 JKBD CN(Cc1ccc2c(c1)OCO2)C(=O)C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1 493579544 OOJVACFFTLHCMD-UNOMPAQXSA-N 487.537 5.523 5 20 JKBD CN(C)C(=O)Cc1ccc(NC(=O)c2ccc(Sc3nc4ccccc4s3)c([N+](=O)[O-])c2)cc1 500024624 LMAJKAAHSRQWRS-UHFFFAOYSA-N 492.582 5.239 5 20 JKBD COc1cc(C(=O)NCC(C)(C)c2ccc(Cl)c(Cl)c2)c([N+](=O)[O-])cc1OC(F)F 502586554 VGCDOSUSAAFHPT-UHFFFAOYSA-N 463.264 5.219 5 20 JKBD COc1cc([C@H](C)NC(=O)c2cc3ccccc3c3cccnc23)ccc1OCc1ccncc1 502729263 XGHCSKPSTWRGMH-IBGZPJMESA-N 463.537 5.862 5 20 JKBD C[C@@H]1Cc2cc([N+](=O)[O-])ccc2N1C(=O)c1ccc(COc2ccc(Br)cc2)o1 504302963 CXJYGIZXMINTQH-CYBMUJFWSA-N 457.280 5.121 5 20 JKBD COc1ccc(Br)cc1[C@H]1CCCN1C(=O)[C@@H](C)Sc1ccc([N+](=O)[O-])cc1 504857096 JIDRBNXHXUTNAX-FZKQIMNGSA-N 465.369 5.210 5 20 JKBD Cc1csc(Sc2ccc(C(=O)Nc3cc(N4CCCC4=O)ccc3Cl)cc2[N+](=O)[O-])n1 509406123 GKKGJSHLRHWMEK-UHFFFAOYSA-N 488.978 5.543 5 20 JKBD C[C@@H](c1ccccc1)n1c(SCC(=O)Nc2ccccc2[N+](=O)[O-])nnc1-c1ccccc1 510247678 ZFDCOWWDVWYBTA-KRWDZBQOSA-N 459.531 5.193 5 20 JKBD CC(C)(C)c1ccc(Oc2ccc(CNCc3ccc(CS(C)(=O)=O)cc3)cc2[N+](=O)[O-])cc1 513631756 GXDDTDSXZSQXQT-UHFFFAOYSA-N 482.602 5.519 5 20 JKBD CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)c1ccc(Cl)c(NC(=O)c2cccs2)c1 516209330 BGHRFTCOWLNHPO-UHFFFAOYSA-N 457.939 5.613 5 20 JKBD Cc1nc(NC(=O)Cn2c3ccccc3c(=O)c3ccccc32)sc1Cc1ccccc1F 517105513 WYTQUZSMTIGSFK-UHFFFAOYSA-N 457.530 5.288 5 20 JKBD Cc1nccn1-c1ccc(CNCc2cn(-c3ccccc3)nc2-c2ccc([N+](=O)[O-])cc2)cc1F 517550945 VSMHAEIKMBJYTE-UHFFFAOYSA-N 482.519 5.371 5 20 JKBD C[C@@H](c1ccncc1)N(C)C(=O)c1ccc(Sc2nc3ccccc3s2)c([N+](=O)[O-])c1 520098403 LMMUEBKKSIACER-AWEZNQCLSA-N 450.545 5.584 5 20 JKBD Cc1cc(NC(=O)c2ccc(N[C@@H](C)c3ccccn3)c([N+](=O)[O-])c2)n(-c2ccccc2F)n1 520646112 FLGARZNMRGTQMU-INIZCTEOSA-N 460.469 5.048 5 20 JKBD CC(=O)c1sc(NC(=O)c2cc(OCC(F)(F)F)ccc2[N+](=O)[O-])nc1-c1ccccc1 603728263 HFRYNZJQCKINCL-UHFFFAOYSA-N 465.409 5.114 5 20 JKBD O=[N+]([O-])c1ccc(-c2noc(CNc3ccc(Oc4ncc(Cl)cc4Cl)cc3)n2)cc1 604009504 HDMDDTFDJVHZKC-UHFFFAOYSA-N 458.261 5.751 5 20 JKBD CCOc1cc(NC(=O)NCc2cccc(NC(=O)c3cccc(F)c3)c2)c([N+](=O)[O-])cc1OCC 604082829 BSCQNHNIIOHVMP-UHFFFAOYSA-N 496.495 5.105 5 20 JKBD O=C(c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1)N(Cc1ccncc1)C[C@@H]1CCCO1 604545929 SDKJUIAGXIOSCT-NRFANRHFSA-N 467.909 5.257 5 20 JKBD CC[C@@H](Cc1ccccc1)NC(=O)c1ccccc1NC(=O)c1ccc([N+](=O)[O-])cc1Cl 727810639 BMDLEWVJBZVSNE-KRWDZBQOSA-N 451.910 5.252 5 20 JKBD C[C@H]1CN(c2ccc(NC(=O)c3cc(Cl)ccc3[N+](=O)[O-])cc2C(F)(F)F)C[C@H](C)O1 728010930 KQAHANCWFXUXIM-RYUDHWBXSA-N 457.836 5.133 5 20 JKBD Cc1nc(COc2ccc(F)cc2)sc1C(=O)N(CC1CC1)c1ccc(Cl)c([N+](=O)[O-])c1 728165707 PQHWLBVIIIVSES-UHFFFAOYSA-N 475.929 5.788 5 20 JKBD COc1ccc(C)cc1-c1csc(NC(=O)c2cc([N+](=O)[O-])ccc2N2CCCCC2)n1 728312447 PNVRGKCCWSOBKS-UHFFFAOYSA-N 452.536 5.278 5 20 JKBD C[C@H](OC(=O)c1cnn(-c2ncc(C(F)(F)F)cc2Cl)c1C(F)F)c1cccc([N+](=O)[O-])c1 730962104 JYZHIFSELHSFAJ-VIFPVBQESA-N 490.772 5.703 5 20 JKBD COc1cc(C2SCCS2)ccc1OC(=O)c1csc(-c2cccc([N+](=O)[O-])c2)n1 747628143 VBRJEOXTTKICPZ-UHFFFAOYSA-N 460.558 5.425 5 20 JKBD CC[C@@H](C)n1ncc2c(C(=O)Oc3ccc(NC(=O)c4cccc([N+](=O)[O-])c4)cc3)cc(C)nc21 751055537 VKZXUPIPWMAOGR-MRXNPFEDSA-N 473.489 5.090 5 20 JKBD Cc1cccc(-n2ncc(C(=O)O[C@@H](C)c3nnc(-c4ccc([N+](=O)[O-])cc4)o3)c2C(F)(F)F)c1 904954600 GVXROHKHELRZMX-ZDUSSCGKSA-N 487.394 5.076 5 20 JKBD CC(C)N(Cc1nnc(-c2cccc([N+](=O)[O-])c2)o1)C(=O)c1cc(-c2ccc(Cl)s2)on1 915281185 UYMVJPOEVCNIMN-UHFFFAOYSA-N 473.898 5.066 5 20 JKBD C[C@H](NC(=O)C(=O)Nc1cccc(-c2ccc(Cl)c(Cl)c2)c1)c1cccc([N+](=O)[O-])c1 918447748 FTNHGOZLGOHZEF-ZDUSSCGKSA-N 458.301 5.385 5 20 JKBD Cc1c([N+](=O)[O-])cc(C(=O)N(CCc2ccccc2)c2nc(-c3ccccc3)cs2)cc1[N+](=O)[O-] 918555207 CUEBHCABTIBGGC-UHFFFAOYSA-N 488.525 5.824 5 20 JKBD Cc1ccc2c(/C=C/C(=O)NC3(c4ccc(NC(=O)c5ccc([N+](=O)[O-])o5)cc4)CCC3)c[nH]c2c1 1785752431 FXVBPIBBRCQTGZ-NYYWCZLTSA-N 484.512 5.439 5 20 JKBD CCOc1ccsc1C(=O)NC1(c2ccc(NC(=O)Cc3cc([N+](=O)[O-])ccc3F)cc2)CCC1 1786669895 KKDOAKNLMMPEFP-UHFFFAOYSA-N 497.548 5.185 5 20 JKBD Cc1snc2sc(C(=O)Nc3ccc(C4(NC(=O)c5ccc([N+](=O)[O-])o5)CCC4)cc3)cc12 1788417128 ZSMPEQMCSVCGLV-UHFFFAOYSA-N 482.543 5.229 5 20 JKBD O=C(/C=C/c1ccc([N+](=O)[O-])o1)NC1(c2ccc(NC(=O)c3ccc4cnccc4c3)cc2)CCC1 1789010828 YBJGLYVBZNYCKI-CSKARUKUSA-N 482.496 5.197 5 20 JKBD O=C(Cc1cc([N+](=O)[O-])ccc1F)NC1(c2ccc(NC(=O)c3cccc4cnccc34)cc2)CCC1 1789325189 FAYUHKIBWGLZGT-UHFFFAOYSA-N 498.514 5.273 5 20 JKBD O=C(Cn1ccc2ccc([N+](=O)[O-])cc21)NC1(c2ccc(NC(=O)c3cccc(F)c3)cc2)CCC1 1790259148 HAJAKOZBPISLCA-UHFFFAOYSA-N 486.503 5.137 5 20 JKBD O=C(C[C@@H]1C[C@@H]2CC[C@H]1C2)Nc1ccc(C2(NC(=O)Cc3ccc([N+](=O)[O-])cc3F)CCC2)cc1 1791324904 CMBUZVCSQRLGSU-HBFSDRIKSA-N 479.552 5.237 5 20 JKBD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc([N+](=O)[O-])o1)c1ccccc1CSc1ccccc1 1792399116 XVTTVFIDOMUDLF-ACDBMABISA-N 491.569 5.046 5 20 JKBD Cc1c(C(=O)NC[C@H]2CCN(C(=O)/C=C/C3CCCC3)[C@H]2c2cccnc2)cc(Cl)cc1[N+](=O)[O-] 1811797640 VIJCLTYMBKDPLG-LEQOFBOASA-N 496.995 5.018 5 20 JKBD CCC[C@H]1CC[C@H](C(=O)N2CCCC[C@H]2c2cc(NC(=O)Cc3cccc([N+](=O)[O-])c3)n[nH]2)CC1 1814376953 MXBRUIQXYVAAQY-LEDOBFOHSA-N 481.597 5.159 5 20 JKBD COc1cc(C(=O)Nc2cc([C@H]3CCCCN3C(=O)c3cccc4ccccc34)[nH]n2)ccc1[N+](=O)[O-] 1823283865 NQAQWODDRBBOJO-JOCHJYFZSA-N 499.527 5.099 5 20 JKBD C[C@@H](C(=O)N1CCC([C@H]2CCCCN2C(=O)Cc2cccc([N+](=O)[O-])c2)CC1)c1ccc(Cl)cc1 1823676998 MRQRZKFFVWJXGH-KBMIEXCESA-N 498.023 5.214 5 20 JKBD CC(C)(Cc1ccccc1)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)/C=C/c2ccc([N+](=O)[O-])o2)CC1 1824097261 OSHYKFLWBHSVDO-CYNGKWMKSA-N 493.604 5.090 5 20 JKBD CC(C)=CCCC(=O)N1CCC([C@H]2CCCCN2C(=O)c2cc(Cl)cc([N+](=O)[O-])c2C)CC1 1830734305 CSCLDHGCEYTLNT-JOCHJYFZSA-N 476.017 5.536 5 20 JKBD Cc1c(C(=O)N2CCCC[C@H]2C2CCN(C(=O)C(C)(C)C(C)(F)F)CC2)cc(Cl)cc1[N+](=O)[O-] 1830734415 JMYRKTXIRRZOPB-IBGZPJMESA-N 499.986 5.471 5 20 JKBD O=C(CSc1nnc(-c2ccco2)n1C1CCCCC1)Nc1ccc(Cl)c([N+](=O)[O-])c1 10015334 YQIYISFCCTYPRK-UHFFFAOYSA-N 461.931 5.336 5 20 JKBD CC(=O)N(c1cccc(Cl)c1)c1nc(COC(=O)c2cc([N+](=O)[O-])ccc2Cl)cs1 10665566 ZSMZXVYEEDVRJP-UHFFFAOYSA-N 466.302 5.400 5 20 JKBD C[C@H](OC(=O)c1c2c(nc3ccccc13)CCCCC2)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 17661354 GOHKKXVPHOOTKC-HNNXBMFYSA-N 458.474 5.380 5 20 JKBD Cc1occc1-c1nnc(S[C@@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)n1Cc1ccccc1 17662442 AFAXLLGDMNLFLG-INIZCTEOSA-N 488.529 5.706 5 20 JKBD COc1ccc(C[C@H](N[C@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2ccc(OC)cc2)cc1 19670892 QUTDDTZYLANBID-GYCJOSAFSA-N 483.952 5.166 5 20 JKBD COc1cc(/C=C(/Cl)c2nc3sc(C)c(-c4ccccc4)c3c(=O)[nH]2)cc([N+](=O)[O-])c1O 229928131 RVRBONYNIBCXLT-RIYZIHGNSA-N 469.906 5.319 5 20 JKBD CN(Cc1csc(Br)c1)C(=O)CSc1ccc(C(F)(F)F)cc1[N+](=O)[O-] 303051856 YETAHUVZBKALMK-UHFFFAOYSA-N 469.304 5.188 5 20 JKBD C[C@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccc(F)c(NC(=O)Cc2ccccc2)c1 502810312 ORYXNSZMLBTLTG-HNNXBMFYSA-N 453.495 5.034 5 20 JKBD CCOc1cc(CN[C@@H]2CCSc3ccc(F)cc32)ccc1OCCn1c([N+](=O)[O-])cnc1C 507947709 FNODTNLNYJANEM-HXUWFJFHSA-N 486.569 5.043 5 20 JKBD CC(C)CCSc1ccc(C(=O)N2CCCN(C(=O)c3cccc(Cl)c3)CC2)cc1[N+](=O)[O-] 508014000 JTNKKNOPHBOEAK-UHFFFAOYSA-N 490.025 5.375 5 20 JKBD CC(C)c1ccccc1N(C(=O)c1cc([N+](=O)[O-])cc(S(C)(=O)=O)c1)c1nc2ccccc2s1 512861636 NBEJMBOULCRVEU-UHFFFAOYSA-N 495.582 5.710 5 20 JKBD O=C(C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)N[C@@H](c1cccs1)C1CC1 515008689 IFXKMIRZABWUAX-IERWFCSNSA-N 475.595 6.464 5 20 JKBD Cc1sc(NC(=O)c2ccc([N+](=O)[O-])cc2I)nc1-c1cccc(Cl)c1 554609553 XEONYPPWECRTHM-UHFFFAOYSA-N 499.717 5.537 5 20 JKBD COc1cc(C(=O)Nc2ccccc2C(F)(F)F)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 602355954 HHASLNJTEBLWCA-UHFFFAOYSA-N 466.799 6.320 5 20 JKBD O=C(Nc1nc2c(C(F)(F)F)cccc2s1)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-] 603732218 CPFWYQNLWNKNTI-UHFFFAOYSA-N 465.331 5.417 5 20 JKBD CCOc1cc(C(=O)Nc2cc(-c3cccc(OC)c3)nn2-c2ccccc2)c([N+](=O)[O-])cc1OC 603760131 GDAQZOYCSVCTHV-UHFFFAOYSA-N 488.500 5.116 5 20 JKBD O=C(C1CCN(c2ccccc2[N+](=O)[O-])CC1)N(Cc1cccnc1)c1ccc(Br)cc1 603990396 TVWSSTBADZSKCR-UHFFFAOYSA-N 495.377 5.202 5 20 JKBD O=[N+]([O-])c1ccc(-c2ccc(CNCc3nnc4c(Cl)cc(C(F)(F)F)cn34)s2)cc1 608835705 KZLQGTMILBSPLY-UHFFFAOYSA-N 467.860 5.328 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])c(Cl)c1)[C@@H]1CCCN(C(=O)c2ccc(Cl)c(Cl)c2)C1 727711162 PCVQMIFLUGTLCY-GFCCVEGCSA-N 456.713 5.046 5 20 JKBD COc1ccc(-c2nc(C)c(C(=O)N(CC3CC3)c3ccc(Cl)c([N+](=O)[O-])c3)s2)cc1 728166964 QLHZMPWVGVONBR-UHFFFAOYSA-N 457.939 5.746 5 20 JKBD O=C(Nc1cc([N+](=O)[O-])ccc1F)c1cnn(-c2ncc(C(F)(F)F)cc2Cl)c1C(F)F 730958452 UTQWTZJIUAWNPB-UHFFFAOYSA-N 479.724 5.177 5 20 JKBD C[C@@H]1C[C@@H]1c1ccc(CCC(=O)Oc2ccc(NC(=O)c3cc([N+](=O)[O-])ccc3Cl)cc2)o1 783505105 DWJIAZNMZFXGNY-KUHUBIRLSA-N 468.893 5.755 5 20 JKBD Cc1ccc(OC(=O)[C@H](C)SCc2nc(O)c3c(-c4ccccc4)csc3n2)c([N+](=O)[O-])c1 818037586 RABWMLTUVWOQPZ-AWEZNQCLSA-N 481.555 5.508 5 20 JKBD Cc1ccccc1-c1cc(C(=O)O[C@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2)c2cnn(C(C)C)c2n1 827213921 YZPBPCQOCSXFEB-QGZVFWFLSA-N 487.516 5.080 5 20 JKBD Cc1cc(C(=O)N2CCC[C@H]2c2nc(-c3ccc(Oc4ccc(F)cc4)nc3)no2)ccc1[N+](=O)[O-] 904508047 MTLGJDHVXUDYEH-NRFANRHFSA-N 489.463 5.257 5 20 JKBD O=C(COC(=O)CCOc1cccc([N+](=O)[O-])c1)Nc1c(Cl)c(Cl)cc(Cl)c1Cl 915451338 ZJWYLWQOBDHNLY-UHFFFAOYSA-N 482.103 5.159 5 20 JKBD Cc1ccc(NC(=O)C(=O)N[C@H](c2ccc(CC(C)C)cc2)c2cccs2)cc1[N+](=O)[O-] 915740688 IEGNNNQYIJOHMO-JOCHJYFZSA-N 451.548 5.008 5 20 JKBD CCc1ccc(N(C(C)=O)c2nc(COC(=O)c3ccc(C(C)(C)C)c([N+](=O)[O-])c3)cs2)cc1 917349304 SZOXMHWMNAQZKZ-UHFFFAOYSA-N 481.574 5.953 5 20 JKBD CC(C)c1nn(CN(Cc2ccccc2[N+](=O)[O-])CC(F)(F)F)c(=S)n1Cc1ccco1 917451522 VGIVFONACDDCAZ-UHFFFAOYSA-N 469.489 5.109 5 20 JKBD C[C@@H](OC(=O)CCOc1ccccc1[N+](=O)[O-])C(=O)N1c2ccccc2Sc2ccccc21 919491229 JOTBJZIGDBCLLI-MRXNPFEDSA-N 464.499 5.125 5 20 JKBD COc1ccc2c(c1)CCC[C@@H]2CC(=O)O[C@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 920665189 WMHRWQYRMHQRGS-UKRRQHHQSA-N 480.439 5.003 5 20 JKBD O=C(OCc1nccn1C(F)F)c1ccc(Sc2nc3ccccc3s2)c([N+](=O)[O-])c1 926447330 ARFZHDYVLVAXEN-UHFFFAOYSA-N 462.459 5.304 5 20 JKBD CC(C)c1nc(C(=O)NC2(c3ccc(NC(=O)CCc4cccc([N+](=O)[O-])c4)cc3)CCC2)co1 1786601603 BCFRAIHTSPMIMA-UHFFFAOYSA-N 476.533 5.087 5 20 JKBD CC1=C(C(=O)Nc2ccc(C3(NC(=O)c4cc5cc([N+](=O)[O-])ccc5s4)CCC3)cc2)CCO1 1788328786 VWYSJUTVSAJTSW-UHFFFAOYSA-N 477.542 5.252 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)[C@H](F)c3ccccc3)CCC2)cc1)c1ccc([N+](=O)[O-])cc1F 1790622617 PPPGELUTCUFURV-JOCHJYFZSA-N 465.456 5.192 5 20 JKBD O=C(NC1(c2ccc(NC(=O)c3ccc4occc4c3O)cc2)CCC1)c1cccc(F)c1[N+](=O)[O-] 1790930771 FJDRZYCCPVJCRE-UHFFFAOYSA-N 489.459 5.247 5 20 JKBD COc1ccc(C(=O)Nc2ccc(C3(NC(=O)c4ccc(O)c([N+](=O)[O-])c4)CCC3)cc2)cc1Cl 1792142668 FOLPQXGFONXGPC-UHFFFAOYSA-N 495.919 5.024 5 20 JKBD O=C(/C=C/c1ccc([N+](=O)[O-])o1)N1CCCC2(CCN(C(=O)c3cc4sccc4s3)CC2)C1 1805684652 SRMOHZXGNUGJJY-DUXPYHPUSA-N 485.587 5.022 5 20 JKBD O=C(c1cc2sccc2s1)N1CCC([C@H]2CCCCN2C(=O)Cc2cccc([N+](=O)[O-])c2)CC1 1823679738 QJFYOTNEQNIWMX-HXUWFJFHSA-N 497.642 5.347 5 20 JKBD O=C(CCC1CCC1)N[C@@H]1CCc2nc(NC(=O)c3cc4cc([N+](=O)[O-])ccc4s3)sc2C1 1824426164 HJOHMHZNLKEWNT-OAHLLOKOSA-N 484.603 5.072 5 20 JKBD O=C(/C=C/c1ccccc1[N+](=O)[O-])N1CCC([C@H]2CCCCN2C(=O)c2ccnc3ccccc23)CC1 1828002340 FVSWWHVATFFOOX-WUZNFDRSSA-N 498.583 5.090 5 20 JKBD Cc1c(Cl)cccc1C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cccc(F)c2[N+](=O)[O-])CC1 1830616276 GKRZQDCMCPJMMP-JOCHJYFZSA-N 487.959 5.243 5 20 JKBD Cc1cc2cc(C(=O)N3CCCC[C@@H]3C3CCN(C(=O)c4ccc([N+](=O)[O-])cc4F)CC3)ccc2[nH]1 1831035587 FEBXFDCWMFIXPF-RUZDIDTESA-N 492.551 5.071 5 20 JKBD CC(C)[C@H](C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2ccc([N+](=O)[O-])o2)CC1)c1ccc(F)cc1 1831751031 SZEXGIMJBRSBOI-URXFXBBRSA-N 485.556 5.000 5 20 JKBD O=C(COC(=O)CCNc1ccccc1[N+](=O)[O-])Nc1c(Cl)c(Cl)cc(Cl)c1Cl 11311765 CIYRBFIYVRSCRJ-UHFFFAOYSA-N 481.119 5.192 5 20 JKBD CCN(CC)C(=O)c1ccc(NC(=O)c2ccc(Sc3nc(C)cs3)c([N+](=O)[O-])c2)cc1 16000915 NDFYTPHFZJWSED-UHFFFAOYSA-N 470.576 5.245 5 20 JKBD O=[N+]([O-])c1cc(S(=O)(=O)N(Cc2coc(-c3ccccc3)n2)c2ccccc2)ccc1Cl 21047636 HSAYDMBWMRYLBC-UHFFFAOYSA-N 469.906 5.299 5 20 JKBD Cc1ccc(-n2c(S[C@@H](C)C(=O)Nc3cccc([N+](=O)[O-])c3C)nnc2-c2ccncc2)cc1C 22174856 FOKYEEDJOOSUET-SFHVURJKSA-N 488.573 5.282 5 20 JKBD Cc1occc1-c1nnc(S[C@@H](C)C(=O)Nc2cc([N+](=O)[O-])ccc2Cl)n1-c1ccccc1 22217269 MJCZFRSPIBBZGD-AWEZNQCLSA-N 483.937 5.517 5 20 JKBD O=C(O[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1)c1cc(Cl)ccc1[N+](=O)[O-] 23515105 SZPCAOGJGQSPQI-IBGZPJMESA-N 490.255 5.347 5 20 JKBD Cn1c(SCC(=O)Nc2nc(-c3ccc(F)cc3)cs2)nc2cc3ccccc3cc2c1=O 24969880 NHEGYHOPOKYVNR-UHFFFAOYSA-N 476.558 5.080 5 20 JKBD O=C(C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1)N(C1CC1)[C@@H]1CCc2ccccc21 303014090 XSDJWQUAKAZYHU-OAQYLSRUSA-N 473.495 5.509 5 20 JKBD COc1ccc(CNC(=O)c2oc3ccccc3c2CSc2cccs2)cc1[N+](=O)[O-] 501704383 SBBZHYVPJAPWEN-UHFFFAOYSA-N 454.529 5.633 5 20 JKBD Cc1ccc(Sc2ccc(C(=O)N3CCC(C(=O)Nc4ccc(C)cn4)CC3)cc2[N+](=O)[O-])cc1 503064230 SXKMILPIBJJBMS-UHFFFAOYSA-N 490.585 5.249 5 20 JKBD O=C(Cn1c2ccccc2c(=O)c2ccccc21)N[C@H]1CCOc2c(-c3ccccc3)cccc21 505091116 QMQULQGDXJOXFQ-VWLOTQADSA-N 460.533 5.462 5 20 JKBD C[C@@H](Nc1ccc(C(=O)Nc2cccc(NC(=O)Nc3ccccc3)c2)cc1[N+](=O)[O-])c1ccccn1 506086075 NGALWYLVJOCMMD-GOSISDBHSA-N 496.527 6.059 5 20 JKBD O=C(Nc1ccc2[nH]ccc2c1)N1CCN(Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)CC1 510000023 UFHMFSQDEDQSDC-UHFFFAOYSA-N 461.547 5.154 5 20 JKBD CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccc(CC(=O)Nc2ccccc2F)cc1 510006665 HYKUVNFAOZSNHD-UHFFFAOYSA-N 464.497 5.358 5 20 JKBD O=C(C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)N[C@H]1CCN(Cc2ccccc2)C1 515360166 HJDKHAYJRWHYTM-AEUZFIIDSA-N 498.608 5.526 5 20 JKBD C[C@H](NCc1ccc(Oc2ccc(F)cc2)c([N+](=O)[O-])c1)c1ccc(NC(=O)NC2CC2)cc1 517537315 PXWQVQUWFHFMMR-INIZCTEOSA-N 464.497 5.661 5 20 JKBD COc1ccc([N+](=O)[O-])c(C(=O)Nc2cc(-c3ccccc3OC)nn2-c2ccc(C)cc2)c1 517877189 UZMOVURKFLEHSY-UHFFFAOYSA-N 458.474 5.025 5 20 JKBD Cc1nn(C)c(C(=O)Nc2ccc(Oc3ccnc4cc(Cl)ccc34)c(F)c2)c1[N+](=O)[O-] 524413194 UGRSFMJOSVWNCG-UHFFFAOYSA-N 455.833 5.022 5 20 JKBD COc1ccc(NC(=O)CSc2ccccc2C(=O)Nc2cc([N+](=O)[O-])c(C)cc2C)cc1OC 603501466 QBMHGUXMIRIVIK-UHFFFAOYSA-N 495.557 5.212 5 20 JKBD COc1ccc(C)cc1-c1csc(NC(=O)c2cc(OCC(F)(F)F)ccc2[N+](=O)[O-])n1 603733672 AYSNEZNVIJYEQK-UHFFFAOYSA-N 467.425 5.229 5 20 JKBD C[C@@H](c1ccccc1)n1c(SCC(=O)N2CCc3cc([N+](=O)[O-])ccc32)nnc1-c1ccccc1 603917235 HUCIBOVDQXUHFI-SFHVURJKSA-N 485.569 5.144 5 20 JKBD COc1cccc(-c2nn(Cc3ccccc3)cc2C(=O)N[C@H](C)c2cccc([N+](=O)[O-])c2)c1 604109101 XEKQLRXZVCAVMN-GOSISDBHSA-N 456.502 5.006 5 20 JKBD O=[N+]([O-])c1ccc(-c2ccc(CNCc3ccc(Cn4ccnc4)cc3)o2)c(Br)c1 608836314 GSFKUWGKHPNBJS-UHFFFAOYSA-N 467.323 5.152 5 20 JKBD COCCOc1cc([N+](=O)[O-])c(C(=O)N2CCCC[C@@H]2c2ccccc2C(F)(F)F)cc1OC 608945395 LBKOZSSNRIFMKS-GOSISDBHSA-N 482.455 5.015 5 20 JKBD Cc1nc(-c2ccc(F)cc2)sc1[C@@H](C)NC(=O)c1cc([N+](=O)[O-])ccc1Br 729659585 VUAKGCGDNSOUOW-SNVBAGLBSA-N 464.316 5.419 5 20 JKBD COc1ccc([C@H](NC(=O)c2cc([N+](=O)[O-])ccc2Br)c2ccc(F)cc2)cc1 751108255 OXOQZDQUFOULQL-HXUWFJFHSA-N 459.271 5.024 5 20 JKBD Cc1oc(-c2ccccc2)nc1CC(=O)Nc1cc(Cl)c([N+](=O)[O-])cc1OCc1ccccc1 818893707 CXIJDYNBMDXLCF-UHFFFAOYSA-N 477.904 5.972 5 20 JKBD O=[N+]([O-])c1ccc(-c2nc(-c3nc(-c4ccc(-n5cnc6ccccc65)nc4)no3)cs2)cc1 904489349 ZSGIKQIDZSRNTK-UHFFFAOYSA-N 467.470 5.169 5 20 JKBD Cc1ccc(-c2nc(C(=O)O[C@H](C(=O)Nc3ccc([N+](=O)[O-])cc3Cl)c3ccccc3)cs2)o1 915254513 FSICAIJVVAMUES-FQEVSTJZSA-N 497.916 5.810 5 20 JKBD CSc1ccc([N+](=O)[O-])c(C(=O)Nc2ccc(N3C(=O)c4ccccc4C3=O)c(Cl)c2)c1 916061643 MHHAYZDYCRATGL-UHFFFAOYSA-N 467.890 5.023 5 20 JKBD Cc1ccc(CNC(=O)C2CCN(c3cc(Cl)c(C(F)(F)F)cc3[N+](=O)[O-])CC2)cc1F 917075976 FCLPRRFGLUFQLK-UHFFFAOYSA-N 473.854 5.247 5 20 JKBD C[C@@H]1C[C@@H]1c1ccc(CNC(=O)c2ccccc2NC(=O)c2ccc([N+](=O)[O-])cc2Cl)o1 918632464 HGMRJZNPKOHEDJ-ACJLOTCBSA-N 453.882 5.147 5 20 JKBD Cc1ccc(NC(=O)[C@H](OC(=O)c2cc3cc([N+](=O)[O-])ccc3o2)c2ccccc2)c([N+](=O)[O-])c1 919214416 RBQXDDGBJREFJU-JOCHJYFZSA-N 475.413 5.094 5 20 JKBD Cc1cc(C)c(NC(=O)[C@@H](C)OC(=O)c2ccc(N[C@H](C)c3ccccn3)c([N+](=O)[O-])c2)c(C)c1 920545596 UEMUEZHVSVFPGN-RTBURBONSA-N 476.533 5.272 5 20 JKBD COc1cc(C(=O)OCc2cc(Cl)cc3cccnc23)c([N+](=O)[O-])cc1OCc1cscn1 920650813 AQYNMERQYKNYPZ-UHFFFAOYSA-N 485.905 5.198 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)c3c[nH]c4cc(Cl)ccc34)CCC2)cc1)c1ccc([N+](=O)[O-])o1 1785748861 MSTORPSPIPYVMZ-UHFFFAOYSA-N 478.892 5.384 5 20 JKBD Cc1c(C(=O)NC2(c3ccc(NC(=O)C4=CCCS4)cc3)CCC2)cc(Cl)cc1[N+](=O)[O-] 1786414096 XMYDOKFASSCQMN-UHFFFAOYSA-N 471.966 5.325 5 20 JKBD C[C@@H]1CCC[C@H]1C(=O)NC1(c2ccc(NC(=O)CSc3ccccc3[N+](=O)[O-])cc2)CCC1 1791522447 TVDKMPGBDFLHAP-YLJYHZDGSA-N 467.591 5.257 5 20 JKBD O=C(Cc1ccc(Cl)cc1[N+](=O)[O-])N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(Cl)c(Cl)c1 1799621173 CEEPGBNBOBFXFG-BJWYYQGGSA-N 496.778 5.050 5 20 JKBD O=C(Nc1cc([C@H]2CCCCN2C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)[nH]n1)c1ccsc1 1816357584 GKOMTVLAQUPFCS-QGZVFWFLSA-N 481.559 5.214 5 20 JKBD Cc1cc(CCCC(=O)N2CCC([C@@H]3CCCCN3C(=O)[C@@H]3C[C@@H]3C3CC3)CC2)c([N+](=O)[O-])cc1F 1824066350 VKENPPOQRFMZDT-OYRHQHFDSA-N 499.627 5.031 5 20 JKBD C[C@@H](CC(=O)N1CCC([C@H]2CCCCN2C(=O)Cc2cc([N+](=O)[O-])ccc2F)CC1)c1ccccc1 1824949184 JFCMZYPKCZXUQJ-RXFWQSSRSA-N 495.595 5.090 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)N1CCC([C@@H]2CCCCN2C(=O)[C@@H](C)c2ccccc2)CC1 1832897998 PJFVOKQTQJYLEX-UUOWRZLLSA-N 481.568 5.079 5 20 JKBD O=C(c1cc2cc([N+](=O)[O-])ccc2s1)N1CC2(CCCN2C(=O)[C@H]2C[C@@H]2c2ccc(Cl)cc2)C1 1843876921 SYJZOMJKPBKDPO-UXHICEINSA-N 495.988 5.084 5 20 JKBD O=C(c1cc2cc([N+](=O)[O-])ccc2s1)N1CC2(CCCN2C(=O)C2(c3ccc(Cl)cc3)CC2)C1 1845917761 YEGJIXWADVYLEE-UHFFFAOYSA-N 495.988 5.012 5 20 JKBD COCCn1c(S[C@@H](C(=O)Nc2ccc(C)cc2[N+](=O)[O-])c2ccccc2)nc2ccccc21 9073679 JAGDRTSEANMSOG-HSZRJFAPSA-N 476.558 5.371 5 20 JKBD O=C(O[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1)c1cc([N+](=O)[O-])ccc1Cl 10665348 NVRSUUMTYFNWNK-LJQANCHMSA-N 490.255 5.347 5 20 JKBD C[C@H](Sc1nnc(NCCc2ccccc2)s1)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 10775969 PTCGSYWVKLWEHJ-LBPRGKRZSA-N 497.524 5.239 5 20 JKBD Cc1ccc(NC(=O)[C@H](Sc2nnc(-c3cccnc3)n2C2CC2)c2ccccc2)c([N+](=O)[O-])c1 11541524 XONFGBBZTOYRST-JOCHJYFZSA-N 486.557 5.364 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Br)[C@H](NCCc1ccccc1F)c1ccccc1 18942299 VOPUVDULTUWUEX-OAQYLSRUSA-N 472.314 5.009 5 20 JKBD COc1ccc(Cl)cc1NC(=O)Cc1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1 19179905 DRMDMMWORPQDTA-UHFFFAOYSA-N 462.893 5.291 5 20 JKBD Cc1ccc(S(=O)(=O)Nc2ccc(C(=O)Nc3ccccc3SC(F)F)cc2)cc1[N+](=O)[O-] 29481651 XJRJUKHOHKRLBB-UHFFFAOYSA-N 493.513 5.271 5 20 JKBD O=C(Nc1cccc(CN2CCCC2=O)c1)c1cc([N+](=O)[O-])ccc1Sc1ccc(Cl)cc1 30129228 OTNUDMVQDPGZCL-UHFFFAOYSA-N 481.961 5.774 5 20 JKBD Cc1csc(Sc2ccc(C(=O)Nc3ccc(NC(=O)NC(C)C)cc3)cc2[N+](=O)[O-])n1 31021306 KNSOZELZPUFPBY-UHFFFAOYSA-N 471.564 5.293 5 20 JKBD COc1cc(C(=O)Nc2ccccc2-c2noc(C)n2)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 107516721 JAERUOHRUXFOJX-UHFFFAOYSA-N 480.864 5.660 5 20 JKBD CSc1ccc([N+](=O)[O-])c(C(=O)Nc2ccc(N(C)C(=O)c3ccc(Cl)cc3)cc2)c1 303023938 PLASVQSDNWJYEI-UHFFFAOYSA-N 455.923 5.499 5 20 JKBD C[C@H](Nc1ccc(C(=O)N(C)Cc2csc(Br)c2)cc1[N+](=O)[O-])c1ccccn1 303024591 PPWPHTTZDXDPRK-ZDUSSCGKSA-N 475.368 5.259 5 20 JKBD COc1ccccc1CN(C(=O)CCn1cc([N+](=O)[O-])nc1C)c1cc(Cl)cc(Cl)c1 488592043 GJCSBASFVRWADT-UHFFFAOYSA-N 463.321 5.039 5 20 JKBD CC[C@@H](C)Sc1ccc(NC(=O)c2ccc(N[C@H](C)c3ccccn3)c([N+](=O)[O-])c2)c(C)c1 498446358 SQUMFIDFEUNVPJ-QZTJIDSGSA-N 464.591 6.614 5 20 JKBD COc1ccc(Br)cc1[C@H]1CCCN1C(=O)[C@H](C)Sc1ccc([N+](=O)[O-])cc1 504857097 JIDRBNXHXUTNAX-SCLBCKFNSA-N 465.369 5.210 5 20 JKBD O=C(Nc1cc(Cl)ccc1Cl)[C@H]1CCCCN1C(=O)c1cc2cccc([N+](=O)[O-])c2[nH]1 507347156 DVVGNDYBHXUCDG-GOSISDBHSA-N 461.305 5.016 5 20 JKBD CC[C@H]1CCc2nc(NC(=O)c3ccc(N[C@@H](C)c4ccccn4)c([N+](=O)[O-])c3)sc2C1 507401247 IOXGARQCCYXPOP-GJZGRUSLSA-N 451.552 5.387 5 20 JKBD COc1ccc(CN[C@H](c2ccc(F)cc2)[C@H]2CCCO2)cc1OCc1ccc([N+](=O)[O-])cc1 507915899 WGTUNYINSMFSCJ-AOYPEHQESA-N 466.509 5.331 5 20 JKBD CC[C@@H]1CCc2sc(-c3nnc(SCc4nnc(-c5ccc([N+](=O)[O-])cc5)o4)n3C)cc2C1 509957770 LHWPXAALOACPTK-CYBMUJFWSA-N 482.591 5.309 5 20 JKBD O=C(C1CCN(c2ccccc2[N+](=O)[O-])CC1)N(c1cccc(Cl)c1)c1nc2ccccc2s1 515321074 OTNVRCILESBKQO-UHFFFAOYSA-N 492.988 6.439 5 20 JKBD C[C@H](NCc1ccccc1CN1C[C@H](C)C[C@@H](C)C1)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 515759504 MPYYVOFZFVIHPU-KURKYZTESA-N 492.542 5.208 5 20 JKBD CN(C)c1ncccc1NC(=O)C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1 521389187 KOOATWQDRIVFNI-VKAVYKQESA-N 459.531 5.235 5 20 JKBD Cc1csc(Sc2ccc(NC(=O)[C@H]3CCCN3C(=O)c3ccc([N+](=O)[O-])c(C)c3)cc2)n1 522573078 WFKWZOKTCPRIGV-HXUWFJFHSA-N 482.587 5.063 5 20 JKBD CCOc1cc([N+](=O)[O-])c(C(=O)N[C@@H]2CCCc3nc(-c4ccc(F)cc4)sc32)cc1OC 609186789 QIIBAZOCYICQSH-MRXNPFEDSA-N 471.510 5.072 5 20 JKBD COc1ccc2nc(Cl)ccc2c1S(=O)(=O)Oc1ccc([N+](=O)[O-])cc1-c1cccs1 725819661 URBQMWAFFKHCSE-UHFFFAOYSA-N 476.919 5.301 5 20 JKBD CCn1cc(Br)cc1C(=O)Oc1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2Cl)cc1 726767673 FEMFYPDZDABYQJ-UHFFFAOYSA-N 492.713 5.304 5 20 JKBD COc1ccc([C@H](OC(=O)c2csc(-c3cccc([N+](=O)[O-])c3)n2)[C@@H](C)n2cccn2)cc1 729803352 NHTMGZMDIACYCK-QVKFZJNVSA-N 464.503 5.083 5 20 JKBD C[C@@H](OC(=O)c1ccccc1OCc1cccs1)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 730617502 IRPBXHPCLWDRAW-CYBMUJFWSA-N 494.447 5.438 5 20 JKBD CCc1nc2ccccc2c(C(=O)O[C@@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2C(F)(F)F)c1C 787858175 POKDUGJOXIYGDP-ZDUSSCGKSA-N 475.423 5.217 5 20 JKBD CC(=O)N(c1nc(COC(=O)c2cc([N+](=O)[O-])ccc2N2CCCC2)cs1)c1cccc(C)c1C 846275442 GVTWVNDNPKORER-UHFFFAOYSA-N 494.573 5.310 5 20 JKBD Cc1cc(NC(=O)c2ccccc2Cl)sc1C(=O)OCc1nnc(-c2ccc([N+](=O)[O-])cc2)o1 915581725 XUUVWINUYXBLLH-UHFFFAOYSA-N 498.904 5.277 5 20 JKBD COc1ccc(Oc2ccc([N+](=O)[O-])cc2C(=O)Nc2ccc(N(C)C3CCN(C)CC3)cc2)cc1 917798399 HKIOHQRCTBTMON-UHFFFAOYSA-N 490.560 5.178 5 20 JKBD C[C@H](Nc1ccc(C(=O)OCC(=O)Nc2cccc(Cl)c2Cl)cc1[N+](=O)[O-])c1ccccn1 920543636 GQSASSDCUQBXRQ-ZDUSSCGKSA-N 489.315 5.265 5 20 JKBD C[C@H](OC(=O)c1ccc(N[C@H](C)c2ccccn2)c([N+](=O)[O-])c1)c1nc(-c2cccs2)no1 920544725 DZWNYYBRRJRYIM-KGLIPLIRSA-N 465.491 5.192 5 20 JKBD Cc1[nH]ccc1C(=O)Nc1ccc(C2(NC(=O)c3cccc(Br)c3[N+](=O)[O-])CCC2)cc1 1788809443 ONHSXGPFDWBEHS-UHFFFAOYSA-N 497.349 5.055 5 20 JKBD CN(C)c1ccc([N+](=O)[O-])c(C(=O)Nc2ccc(C3(NC(=O)[C@@H](F)c4ccccc4)CCC3)cc2)c1 1790055092 XTVFAXJAVZITSG-DEOSSOPVSA-N 490.535 5.119 5 20 JKBD COc1cc(CC(=O)NC2(c3ccc(NC(=O)CCC=C(C)C)cc3)CCC2)ccc1[N+](=O)[O-] 1790452545 KFWITJAWECAVGZ-UHFFFAOYSA-N 465.550 5.026 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)c3ccc([N+](=O)[O-])o3)CCC2)cc1)c1cc(F)cc(C(F)(F)F)c1 1790646435 SQHXVCZWRSENSN-UHFFFAOYSA-N 491.397 5.407 5 20 JKBD O=C(CCc1ccccc1Cl)Nc1cc([C@H]2CCCCN2C(=O)c2cccc(F)c2[N+](=O)[O-])[nH]n1 1817004615 PVKIGFDCFOBYBH-HXUWFJFHSA-N 499.930 5.049 5 20 JKBD O=C(Nc1cc([C@H]2CCCCN2C(=O)/C=C/c2ccccc2[N+](=O)[O-])[nH]n1)c1ccc(Cl)c(F)c1 1821042699 PGNAAZMNBDDPJW-FKVRIVCVSA-N 497.914 5.130 5 20 JKBD Cc1cc(C)cc(C(=O)N2CCCC[C@H]2c2cc(NC(=O)CSc3ccccc3[N+](=O)[O-])n[nH]2)c1 1822313287 OGHHXAYTNZSLKQ-FQEVSTJZSA-N 493.589 5.033 5 20 JKBD CC[C@H](C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cc([N+](=O)[O-])c(O)cc2C)CC1)c1ccccc1 1830788273 IMBDMLNNDNCTGI-LADGPHEKSA-N 493.604 5.036 5 20 JKBD O=C([C@@H]1C[C@@H]1C1CC1)N1CCC([C@@H]2CCCCN2C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)CC1 1831060294 QSDHATZFFUXHFS-VSKRKVRLSA-N 481.618 5.089 5 20 JKBD CC(C)/C=C/C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)CC1 1831062489 VUJKAPCQHYFWLR-VHTFYLNKSA-N 469.607 5.255 5 20 JKBD C[C@H](Sc1nnc(-c2ccccc2Cl)n1C1CCCC1)C(=O)Nc1ccc([N+](=O)[O-])cc1 8988888 QNMROTZVSMDGTR-AWEZNQCLSA-N 471.970 5.741 5 20 JKBD Cc1ccc(-c2cc(C(=O)O[C@@H](C)C(=O)Nc3cc([N+](=O)[O-])ccc3Cl)c3c(C)noc3n2)cc1 12177519 MUYNXLHHGPKWIJ-AWEZNQCLSA-N 494.891 5.252 5 20 JKBD Cc1oc(-c2ccccc2)nc1COC(=O)c1ccccc1NC(=O)c1ccc([N+](=O)[O-])cc1Cl 12475203 QZNCARLUNDLPHV-UHFFFAOYSA-N 491.887 5.821 5 20 JKBD CCOc1ccc(NS(=O)(=O)c2cc(NC(=O)c3ccc([N+](=O)[O-])cc3Cl)ccc2C)cc1 15430985 RNVAGMHNDUHYQF-UHFFFAOYSA-N 489.937 5.008 5 20 JKBD C[C@@H](OC(=O)c1ccc(NCc2ccccc2Cl)c([N+](=O)[O-])c1)C(=O)Nc1cccnc1Cl 16868758 PDMIEZDGNGAPIC-CYBMUJFWSA-N 489.315 5.093 5 20 JKBD O=[N+]([O-])c1ccc(-c2nnc(CSc3nc(-c4ccccc4)c(-c4ccccc4)o3)o2)cc1 20530232 KXAMDTQRHJPZFQ-UHFFFAOYSA-N 456.483 6.259 5 20 JKBD Cc1ccc(C(=O)N(C)c2ccc(OC(=O)c3ccc(Br)c([N+](=O)[O-])c3)cc2)cc1 25921038 MONDLDULWFXVHU-UHFFFAOYSA-N 469.291 5.162 5 20 JKBD COc1ccc(Cn2c(S[C@H](C)c3cccc([N+](=O)[O-])c3)nc3ccccc3c2=O)cc1OC 26591660 CEJHCOZUFDIFIH-MRXNPFEDSA-N 477.542 5.224 5 20 JKBD O=C(c1ccccc1)c1ccc(Sc2nnc(CN3CCCC3)n2Cc2ccccc2)c([N+](=O)[O-])c1 29000635 XKBQOEUYFVXUAM-UHFFFAOYSA-N 499.596 5.213 5 20 JKBD O=C(Nc1nc(-c2cccnc2)cs1)c1cc([N+](=O)[O-])ccc1Sc1ccc(Cl)cc1 29251813 DVCPMVSVEJIBSR-UHFFFAOYSA-N 468.947 6.170 5 20 JKBD O=C(c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1)N(Cc1ccc(Cl)c(Cl)c1)Cc1ccccn1 72052679 POVXPEFMWFOKKF-UHFFFAOYSA-N 461.261 5.047 5 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GVVQPUWPYVJFEO-DEOSSOPVSA-N 455.518 5.369 5 20 JKBD COc1ccc([C@@H](NCc2ccc(-c3ccc([N+](=O)[O-])cc3Br)o2)c2nccn2C)cc1 520954305 SPVDWLHOFNOBRP-JOCHJYFZSA-N 497.349 5.239 5 20 JKBD C[C@H](C[C@@H]1CCCO1)NC(=O)C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1 522552086 QWUVHOKBHNADGR-GNLACTJSSA-N 451.548 5.209 5 20 JKBD CCOC(=O)c1cc(-c2ccccc2)sc1NC(=O)c1cc(OC)c(OC(F)F)cc1[N+](=O)[O-] 585699437 XQUFUTSLFZAKPM-UHFFFAOYSA-N 492.456 5.362 5 20 JKBD Cc1ccc([N+](=O)[O-])cc1NC(=O)CSc1nnc(-c2ccccc2)n1[C@H](C)c1ccccc1 603917257 JKXXMHHKXDAZCC-GOSISDBHSA-N 473.558 5.502 5 20 JKBD C[C@H]1CN(Cc2ccc(CNCc3ccc(-c4ccccc4[N+](=O)[O-])s3)cc2)C[C@@H](C)O1 608835818 WOMXJJUBTXRASG-KDURUIRLSA-N 451.592 5.222 5 20 JKBD O=C(CSc1ccc(C(F)(F)F)cc1[N+](=O)[O-])Nc1cccc(-c2n[nH]c(C3CC3)n2)c1 608851221 YMHNFWMNSOPEMS-UHFFFAOYSA-N 463.441 5.007 5 20 JKBD COc1cc(-n2cccc2)c(Cl)cc1C(=O)O[C@@H](C)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 725944099 DMDLNUKPIRQUSV-ZDUSSCGKSA-N 468.853 5.016 5 20 JKBD CC(C)(C)OC(=O)Nc1ccc(NC(=O)Cn2ccc3cc([N+](=O)[O-])ccc32)c(C(F)(F)F)c1 729654850 FLOGHJUHROEMBA-UHFFFAOYSA-N 478.427 5.554 5 20 JKBD CC(C)(C)OC(=O)NC1(c2noc(-c3ccc(Sc4ccc([N+](=O)[O-])cc4)cc3)n2)CC1 904992057 ROCZBMKSDQSSPG-UHFFFAOYSA-N 454.508 5.310 5 20 JKBD CC(C)c1c(C(=O)O[C@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2C(F)(F)F)cnn1-c1ccccc1 913379296 HIXFXXZPXWCKSP-CQSZACIVSA-N 490.438 5.107 5 20 JKBD O=C(Oc1ccc2c(-c3ccc([N+](=O)[O-])cc3)cc(=O)oc2c1)[C@@H]1CCC[C@@H](C(F)(F)F)C1 916035256 IBXORKZHYRAJGX-HUUCEWRRSA-N 461.392 5.642 5 20 JKBD O=c1nc(/C(Cl)=C\c2ccc([N+](=O)[O-])cc2)[nH]c2c(Br)cc(Br)cc12 916127411 SYANXWBCORAJKE-WLRTZDKTSA-N 485.519 5.093 5 20 JKBD CCC(C)(C)NC(=O)c1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2N2CCC(C)CC2)cc1 917764141 ZTAWAIBDWHIVRC-UHFFFAOYSA-N 452.555 5.002 5 20 JKBD CCOc1ccc([N+](=O)[O-])cc1COC(=O)C1CCN(c2ncc(C(F)(F)F)cc2Cl)CC1 918532142 MUYDYJKFFBGTAV-UHFFFAOYSA-N 487.862 5.021 5 20 JKBD C[C@H]1CCCN(c2ccc(C(=O)Nc3cc(NC(=O)OC(C)(C)C)ccc3F)cc2[N+](=O)[O-])C1 918600031 JXZSSTINXPXFNY-HNNXBMFYSA-N 472.517 5.570 5 20 JKBD CC(C)(C)NC(=O)c1cccc(NC(=O)c2ccccc2NC(=O)c2ccc([N+](=O)[O-])cc2Cl)c1 918622778 GZEMBZCWGVXVMP-UHFFFAOYSA-N 494.935 5.281 5 20 JKBD Cc1cc(O[C@@H](C)C(=O)O[C@@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2C(F)(F)F)ccc1C(C)C 919406746 FEUGEBRCOTYRKH-GJZGRUSLSA-N 482.455 5.383 5 20 JKBD C[C@@H](Nc1ccc(C(=O)Oc2ccc(NC(=O)c3ccccc3)cc2)cc1[N+](=O)[O-])c1ccccn1 919678964 IKHZKVPZJVQDBD-GOSISDBHSA-N 482.496 5.634 5 20 JKBD C[C@H](Nc1ccc(C(=O)OCc2ncc(-c3ccc(F)cc3)o2)cc1[N+](=O)[O-])c1ccccn1 920546500 KIPSBCGZDFRYGT-HNNXBMFYSA-N 462.437 5.314 5 20 JKBD CC(=O)N(c1nc(COC(=O)[C@@H](C)Oc2ccc(Cl)cc2[N+](=O)[O-])cs1)c1ccccc1F 920778232 LKRIJVDHVQWJMV-GFCCVEGCSA-N 493.900 5.039 5 20 JKBD O=C(Cc1cccc([N+](=O)[O-])c1)Nc1ccc(C2(NC(=O)c3cccc4ccncc34)CCC2)cc1 1785795485 QRJAKBLQGCLJBW-UHFFFAOYSA-N 480.524 5.133 5 20 JKBD Cc1cc(C(=O)Nc2ccc(C3(NC(=O)c4cccc(Br)c4[N+](=O)[O-])CCC3)cc2)c[nH]1 1788814998 CHCOHAOAISAIQR-UHFFFAOYSA-N 497.349 5.055 5 20 JKBD O=C(/C=C/c1ccccc1[N+](=O)[O-])NC1(c2ccc(NC(=O)c3ccc(Cl)o3)cc2)CCC1 1788881779 NIBHNEJXVHDJNU-AWNIVKPZSA-N 465.893 5.302 5 20 JKBD O=C(CCc1cccc([N+](=O)[O-])c1)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(-c2ccccc2)cc1 1803825966 XTMQMKJYMNRTSP-OOSCYNTBSA-N 483.568 5.146 5 20 JKBD O=C(c1ccc2occ(Cl)c2c1)N1CCC([C@H]2CCCCN2C(=O)c2ccc([N+](=O)[O-])o2)CC1 1823614097 RJXLLDFBLSWUGT-LJQANCHMSA-N 485.924 5.135 5 20 JKBD O=C(/C=C/c1ccccc1[N+](=O)[O-])N1CCC([C@H]2CCCCN2C(=O)c2ccc(Cl)cc2)CC1 1830029372 SAMGHFXKBUQBHP-UQNNOOFXSA-N 481.980 5.195 5 20 JKBD Cc1cccc(C(=O)N2CCC([C@H]3CCCCN3C(=O)c3ccc([N+](=O)[O-])cc3F)CC2)c1Cl 1830497325 FAXFXHPKTBSNEH-JOCHJYFZSA-N 487.959 5.243 5 20 JKBD O=C(c1ccc(C2CC2)cc1)N1CCC([C@@H]2CCCCN2C(=O)c2cccc(F)c2[N+](=O)[O-])CC1 1830620660 DJPHYQUPUHHCAJ-DEOSSOPVSA-N 479.552 5.158 5 20 JKBD COc1cccc(C(=O)N2CCC([C@H]3CCCCN3C(=O)c3cc(Cl)cc([N+](=O)[O-])c3C)CC2)c1 1830734303 CKXHSZAHVWFKHQ-HSZRJFAPSA-N 499.995 5.112 5 20 JKBD CC(C)CCC(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2ccc(Br)c([N+](=O)[O-])c2)CC1 1831382544 OQISGUNJELHGFN-HXUWFJFHSA-N 494.430 5.027 5 20 JKBD Cc1c(NC(=O)[C@H](C)OC(=O)c2ccccc2SCc2cccs2)cccc1[N+](=O)[O-] 26599447 LACSDUBFMRZADO-HNNXBMFYSA-N 456.545 5.441 5 20 JKBD O=C(Nc1ccc(N[C@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2ccccc2)cc1)[C@@H]1CCCO1 27000694 YGZGJRCQDLPBFZ-GOTSBHOMSA-N 494.935 5.158 5 20 JKBD Cc1nc(CN(C(=O)CSc2ccc(C(F)(F)F)cc2[N+](=O)[O-])c2ccc(F)cc2)cs1 302975054 TYUWVYLSWCIXDR-UHFFFAOYSA-N 485.484 5.843 5 20 JKBD C[C@H](Nc1ccc(C(=O)N2CCC[C@@H]2c2ccccc2Cl)cc1[N+](=O)[O-])c1ccccn1 410083522 AWFYVNVXIYFZGX-KSFYIVLOSA-N 450.926 5.794 5 20 JKBD CCCOc1ccc(Oc2ncccc2CNC(=O)C2CCN(c3ccccc3[N+](=O)[O-])CC2)cc1 501631600 WJARRZVDLVEAON-UHFFFAOYSA-N 490.560 5.104 5 20 JKBD C[C@@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)NCc1ccccc1-c1ccc(Cn2ccnc2)cc1 504776474 SAPMFMSJNZEGPL-GOSISDBHSA-N 490.947 5.244 5 20 JKBD COc1cc(C)ccc1Oc1ccc(NC(=O)c2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)cc1F 510258406 ZJLFBCYVAFXZHU-UHFFFAOYSA-N 476.464 5.496 5 20 JKBD CCc1ccc([C@H](NC(=O)c2cc(OC)c(OCc3cscn3)cc2[N+](=O)[O-])C(C)C)cc1 512305381 DLDFZJOEYZLNBO-HSZRJFAPSA-N 469.563 5.328 5 20 JKBD COc1cc(C(=O)Nc2ccc(Oc3ccccc3)nc2)c([N+](=O)[O-])cc1OCc1cscn1 512320254 BHNQFSNXGLYBHC-UHFFFAOYSA-N 478.486 5.079 5 20 JKBD Cc1nc(-c2ccc(CNC(=O)c3ccc(N[C@H](C)c4ccccn4)c([N+](=O)[O-])c3)s2)cs1 516585828 BGZMKLQYWBRFOO-CQSZACIVSA-N 479.587 5.586 5 20 JKBD Cc1cc(NC(=O)c2ccc(Cl)cc2[N+](=O)[O-])n(-c2cc(C(F)(F)F)ccc2Cl)n1 585752861 NCBMIOYDYRLHSK-UHFFFAOYSA-N 459.211 5.667 5 20 JKBD CCN1C/C(=C\c2ccc(-c3ccc([N+](=O)[O-])cc3)s2)c2nc3ccccc3c(C(=O)O)c2C1 591632335 FWDXPEJGAXXDRJ-GHRIWEEISA-N 471.538 5.946 5 20 JKBD CNc1ccc(C(=O)Nc2nc(C)c(-c3nc4ccccc4n3C(F)F)s2)cc1[N+](=O)[O-] 592042912 PBYPNMXSVNXARL-UHFFFAOYSA-N 458.450 5.066 5 20 JKBD COc1ccc(C(=O)Nc2nc(-c3ccccc3)c(C(=O)c3ccccc3)s2)cc1[N+](=O)[O-] 599809838 XHUXQYMIWGOMAL-UHFFFAOYSA-N 459.483 5.210 5 20 JKBD O=C(C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)Nc1nc(-c2ccncc2)cs1 603454834 SRNDJVGAPYFQFT-AQTBWJFISA-N 499.577 6.292 5 20 JKBD Cc1cc([C@H](C)NC(=O)C2CCN(c3ccc(C(F)(F)F)cc3[N+](=O)[O-])CC2)c(C)s1 603873561 ROZDQLRBHZCRFR-ZDUSSCGKSA-N 455.502 5.386 5 20 JKBD Cc1csc(Sc2ccc(C(=O)Nc3cccc(-c4noc(C)n4)c3)cc2[N+](=O)[O-])n1 604441240 FOFDNOJRYCKKPW-UHFFFAOYSA-N 453.505 5.122 5 20 JKBD CC[C@@H](C)c1ccc2nc(N(Cc3ccccc3)C(=O)Cn3cccc([N+](=O)[O-])c3=O)sc2c1 608801405 LJKHJVXGLPXYCB-QGZVFWFLSA-N 476.558 5.113 5 20 JKBD CC(C)(C)c1cc[n+](/C(C(=S)NCCc2cccs2)=C(/O)c2cccc([N+](=O)[O-])c2)cc1 727812338 MRVVMLDVSOOEHO-UHFFFAOYSA-O 468.624 5.285 5 20 JKBD CCN(CCc1ccccn1)C(=O)c1ccccc1Sc1ccc(C(F)(F)F)cc1[N+](=O)[O-] 746832018 FDPGNAIFMAZPAP-UHFFFAOYSA-N 475.492 5.865 5 20 JKBD CC(=O)N(c1nc(COC(=O)c2c3ccccc3cc3ccccc23)cs1)c1ccccc1F 754588894 IMCHWBYFSWETHD-UHFFFAOYSA-N 470.525 6.630 5 20 JKBD O=C(COC(=O)c1cc([N+](=O)[O-])ccc1N1CCCCC1)Nc1c(Cl)cc(Cl)cc1Cl 823291932 UUQKKPCGFONBPY-UHFFFAOYSA-N 486.739 5.341 5 20 JKBD C[C@H](OC(=O)C1CCN(c2ccccc2[N+](=O)[O-])CC1)C(=O)Nc1ccccc1Oc1ccccc1 856475623 UCYLBONSLWNCNX-IBGZPJMESA-N 489.528 5.174 5 20 JKBD Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)CC[C@@H](C)CC(=O)Nc1cc([N+](=O)[O-])c(C)cc1C 864237720 GOEIPJXQJNQKSK-CYBMUJFWSA-N 456.499 5.120 5 20 JKBD CC1=C(C(=O)Nc2ccccc2C)[C@H](c2ccc([N+](=O)[O-])cc2)NC(=S)N1c1ccccc1Cl 887932424 GAPXFQJCNSSTOH-QHCPKHFHSA-N 492.988 5.905 5 20 JKBD Nc1ccc(C(=O)Nc2cccc(NC(=O)Nc3cccc(C(F)(F)F)c3)c2)cc1[N+](=O)[O-] 919871557 VSADZJASERQFGB-UHFFFAOYSA-N 459.384 5.092 5 20 JKBD O=C(Nc1ccccc1Oc1ccc(Cl)cc1)c1cc([N+](=O)[O-])ccc1N1CCOCC1 920223837 WPQHNLROAMKCCT-UHFFFAOYSA-N 453.882 5.129 5 20 JKBD C[C@@H](OC(=O)c1ccc(N[C@H](C)c2ccccn2)c([N+](=O)[O-])c1)C(=O)c1ccc2c(c1)CCC2 920546103 ULNBOKCGUDLILP-IAGOWNOFSA-N 459.502 5.080 5 20 JKBD C[C@H](Nc1ccc(C(=O)OCc2csc(-c3ccsc3)n2)cc1[N+](=O)[O-])c1ccccn1 920548234 RYWRCZNZUMIINL-AWEZNQCLSA-N 466.544 5.705 5 20 JKBD Cc1cc(O)c([N+](=O)[O-])cc1C(=O)NC1(c2ccc(NC(=O)c3ccc4ncccc4c3)cc2)CCC1 1788908462 VHSAWMULMGWEHT-UHFFFAOYSA-N 496.523 5.219 5 20 JKBD Cc1ccc(CCC(=O)NC2(c3ccc(NC(=O)c4cccc(F)c4[N+](=O)[O-])cc3)CCC2)c(C)n1 1790698614 JMNMDOLICWTGNQ-UHFFFAOYSA-N 490.535 5.126 5 20 JKBD Cc1c(C(=O)Nc2ccc(C3(NC(=O)c4ccc([N+](=O)[O-])o4)CCC3)cc2)cc(Cl)cc1[N+](=O)[O-] 1790773920 UWOADXAJUSTSSS-UHFFFAOYSA-N 498.879 5.119 5 20 JKBD Cc1ccc(C(=O)NC2(c3ccc(NC(=O)c4cc5cc([N+](=O)[O-])ccc5s4)cc3)CCC2)cn1 1791011263 UWDLGEXMDMNNPP-UHFFFAOYSA-N 486.553 5.574 5 20 JKBD COc1cc(C(=O)NC2(c3ccc(NC(=O)C4(C)CCCCC4)cc3)CCC2)c([N+](=O)[O-])cc1O 1791534215 YWKMKKAGYQJDLC-UHFFFAOYSA-N 481.549 5.027 5 20 JKBD COc1cc(CC(=O)NC2(c3ccc(NC(=O)[C@]4(F)CCCC=C4F)cc3)CCC2)ccc1[N+](=O)[O-] 1792379275 IFIKVRNZTUMGLB-SANMLTNESA-N 499.514 5.026 5 20 JKBD CCCCC[C@H](C)C(=O)N1CC[C@H](CNC(=O)CSc2ccccc2[N+](=O)[O-])[C@H]1c1cccnc1 1812985162 HTLYDQKYXYGYFY-PIBDYAPNSA-N 498.649 5.004 5 20 JKBD CC1(C)CCC(CC(=O)N2CCC([C@@H]3CCCCN3C(=O)/C=C/c3ccc([N+](=O)[O-])o3)CC2)CC1 1824276365 SMVGCIQCEHSPOS-DRGXBFSJSA-N 485.625 5.427 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2ccc3cc[nH]c3c2)CC1 1828044568 UAIKTZRKEFSONL-DEOSSOPVSA-N 492.551 5.071 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cc3ccccc3o2)CC1 1828190885 OZNXKTSEHLPVNA-QFIPXVFZSA-N 493.535 5.336 5 20 JKBD CCCCC[C@H](C)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)Cc2cc([N+](=O)[O-])ccc2F)CC1 1831462273 IDMXLFZVYQLPBT-YADARESESA-N 475.605 5.113 5 20 JKBD CC1(C)CC(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)C3(c4cccc([N+](=O)[O-])c4)CCC3)CC2)C1 1831930817 AIORCNOEHWOKOG-XMMPIXPASA-N 481.637 5.072 5 20 JKBD O=C(CSc1nnc(COc2ccccc2Cl)n1C1CC1)Nc1ccc(Cl)cc1[N+](=O)[O-] 9414981 DHVAVJVAHNUKGQ-UHFFFAOYSA-N 494.360 5.138 5 20 JKBD Cc1nc(SCC(=O)Nc2ccc([N+](=O)[O-])cc2C(F)(F)F)c2c(C)c(C)sc2n1 9812393 NMGKVQSKNYQRFE-UHFFFAOYSA-N 456.471 5.274 5 20 JKBD O=C(COc1cc(F)ccc1[N+](=O)[O-])Nc1cccc(C(=O)Nc2cccc(C(F)(F)F)c2)c1 10446152 UDCXKDAGRZDJHF-UHFFFAOYSA-N 477.370 5.023 5 20 JKBD Cc1ccc(-c2nnc([C@H](C)OC(=O)c3ccc(Sc4nc(C)cs4)c([N+](=O)[O-])c3)o2)cc1 17715753 AZBCGAUJXDKJQQ-AWEZNQCLSA-N 482.543 5.787 5 20 JKBD Cc1ccc(C(C)C)c(Oc2ccc([C@@H]3NC(N)=Nc4nc5ccccc5n43)cc2[N+](=O)[O-])c1 18053539 IAWYKHTYLKSRHR-HSZRJFAPSA-N 456.506 5.265 5 20 JKBD C[C@H](Sc1nnc(-c2nn(Cc3ccccc3)c(=O)c3ccccc23)o1)c1cccc([N+](=O)[O-])c1 23272968 NSGLQXFYLIZTNW-INIZCTEOSA-N 485.525 5.256 5 20 JKBD CSc1ccc(C(=O)c2ccccc2C(=O)Nc2cccc(-c3ccn[nH]3)c2)cc1[N+](=O)[O-] 24891439 IRMMXPHNZSXNIF-UHFFFAOYSA-N 458.499 5.190 5 20 JKBD C[C@@H](Nc1ccc(C(=O)Nc2ccc(Oc3ccncc3)cc2)cc1[N+](=O)[O-])c1ccccn1 60265447 OUFRKJFYQTUXEB-QGZVFWFLSA-N 455.474 5.603 5 20 JKBD CSc1ccc(Cl)c(C(=O)O[C@@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2C(F)(F)F)c1 104545095 JJBZOTVGSXOIIK-VIFPVBQESA-N 462.833 5.173 5 20 JKBD Cc1[nH]c2ccc(CNC(=O)c3ccccc3NC(=O)c3ccc([N+](=O)[O-])cc3Cl)cc2c1C 109176385 VMZSVMOPAADYFA-UHFFFAOYSA-N 476.920 5.529 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)Nc2ccc(Oc3ccccc3)cc2C(F)(F)F)cc1SC 483470532 NWAHXQBAJWYJTM-UHFFFAOYSA-N 478.448 6.389 5 20 JKBD CC(=O)Nc1cc(N[C@@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2ccccc2)ccc1F 493436214 BZCOBTGLYBKXSK-OAQYLSRUSA-N 456.861 5.138 5 20 JKBD CC(C)n1c(SCCC(=O)Nc2ccccc2[N+](=O)[O-])nnc1-c1ccc(Cl)cc1Cl 498021517 CCBPCXKZULAABH-UHFFFAOYSA-N 480.377 5.862 5 20 JKBD CN(C)c1cccc(CNC(=O)C/C(=C\c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)c1 498532213 QQRYNFJKGNCYDO-XSFVSMFZSA-N 472.570 5.518 5 20 JKBD C[C@@H](Sc1nc2ccccc2c(=O)n1Cc1ccccc1)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 501106197 FJGPRYUCIWNQOE-MRXNPFEDSA-N 485.525 5.256 5 20 JKBD CN(C(=O)Cn1c2ccccc2c(=O)c2ccccc21)[C@@H]1CCSc2ccc(Br)cc21 504579527 MYNDGFRTWLNLKO-HXUWFJFHSA-N 493.426 5.613 5 20 JKBD C[C@H](Nc1ccc(C(=O)NCc2ccnc(OCc3ccccc3)c2)cc1[N+](=O)[O-])c1ccccn1 507034882 IYHYPTNDWHINQA-IBGZPJMESA-N 483.528 5.067 5 20 JKBD Cc1noc([C@@H](C)NC(=O)c2c3c(nc4ccccc24)/C(=C/c2ccc([N+](=O)[O-])cc2)CCC3)n1 509115922 UKXUADUMPNUEPV-LWFDYCOSSA-N 469.501 5.202 5 20 JKBD COc1cc(C(=O)N2CCSc3ccc(Cl)cc32)c([N+](=O)[O-])cc1OCc1cscn1 512237740 VNHSVJPRUWLFOT-UHFFFAOYSA-N 477.951 5.045 5 20 JKBD CC[C@@H](C)NC(=O)c1ccc(NC(=O)c2ccc(Sc3nc(C)cs3)c([N+](=O)[O-])c2)cc1 512695602 VOGIEECJSNVFMH-CYBMUJFWSA-N 470.576 5.292 5 20 JKBD Cc1onc(-c2c(Cl)cccc2Cl)c1C(=O)Nc1cc([N+](=O)[O-])ccc1OC(F)F 514501814 QPYMNDQBOYNYIM-UHFFFAOYSA-N 458.204 5.719 5 20 JKBD C[C@@H](Nc1cccc(OCc2cccc(F)c2)c1)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 515735391 BUGUMKDDPWBIFH-CQSZACIVSA-N 477.414 5.771 5 20 JKBD Cc1ccc2nc([C@@H]3CCCN3C(=O)CSc3ccc(C(F)(F)F)cc3[N+](=O)[O-])[nH]c2c1 522041597 IOPOWBXTSYABKK-INIZCTEOSA-N 464.469 5.254 5 20 JKBD O=C(Cc1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1)N[C@@H](c1ccccc1)[C@@H]1CCCO1 523275395 VSGYJOXMLIABTH-LSYYVWMOSA-N 482.540 5.027 5 20 JKBD O=C(Cn1c2ccccc2c(=O)c2ccccc21)N1CCCC[C@H]1c1ccccc1C(F)(F)F 589369634 GSSBBOMXHMHSEJ-QFIPXVFZSA-N 464.487 5.927 5 20 JKBD COc1cccc([C@H](C)NC(=O)C/C(=C/c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)c1 603518389 NYRNNQVIADAGCO-PNWWAVQQSA-N 473.554 6.021 5 20 JKBD CCOc1cc(NC(=O)N(C)Cc2ccccc2[N+](=O)[O-])c(OCC)cc1NC(=O)c1ccccc1 603650571 VWHVAILXCOMZIK-UHFFFAOYSA-N 492.532 5.308 5 20 JKBD COc1cc(C(=O)N2CCC(Oc3ccc(C(C)C)cc3)CC2)c([N+](=O)[O-])cc1OC(F)F 603814457 ORMKCEJKJNWHHC-UHFFFAOYSA-N 464.465 5.012 5 20 JKBD C[C@@H](NCc1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1)c1ccc(NC(=O)NC2CC2)cc1 608836274 YRWLEYPPCHGVLV-LJQANCHMSA-N 496.571 5.582 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)Nc2ccccc2SC[C@@H]2CC2(Cl)Cl)cc1SC 728468747 KIOXJGGWDRHLEH-NSHDSACASA-N 473.403 5.864 5 20 JKBD COc1cc(C(=O)Nc2cc([N+](=O)[O-])c(F)cc2F)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 825487975 MLTLGRKEHRRWQH-UHFFFAOYSA-N 479.779 5.488 5 20 JKBD O=C(C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)OCCCc1ccncc1 863949574 RDPBCRVKLHWUGS-SILNSSARSA-N 459.527 5.706 5 20 JKBD COCCN(C(=O)c1cc2c3ccccc3n(C)c2s1)c1nc(-c2ccc([N+](=O)[O-])cc2)cs1 900792511 JCIUVCBVCKLMOT-UHFFFAOYSA-N 492.582 5.718 5 20 JKBD C[C@H](OCc1ccccc1)C(=O)O[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1 915248173 IYLCDRBYIGGEIW-AOMKIAJQSA-N 468.893 5.077 5 20 JKBD Cc1cccc(NC(=O)c2ccccc2NC(=O)c2cc(OCC(F)(F)F)ccc2[N+](=O)[O-])c1 915812703 LREUUTDIHXQTBN-UHFFFAOYSA-N 473.407 5.349 5 20 JKBD CCCN1C(=S)N[C@@H](c2ccccc2[N+](=O)[O-])C(C(=O)Nc2ccccc2C(F)(F)F)=C1C 916169199 RNLNIGKETHOUOT-IBGZPJMESA-N 478.496 5.168 5 20 JKBD COc1c([N+](=O)[O-])cc(N[C@H](C)c2cccc(OC(F)F)c2)c([N+](=O)[O-])c1Br 917070916 UKQHYNQWRZXDQB-MRVPVSSYSA-N 462.203 5.049 5 20 JKBD COc1ccc(C2=N/C(=C/c3csc(-c4ccc(C(F)(F)F)cc4)n3)C(=O)O2)cc1[N+](=O)[O-] 918727339 SVQCQAUMORGXNA-OQLLNIDSSA-N 475.404 5.090 5 20 JKBD Cc1c(C(=O)NCCN2C(=O)S/C(=C\c3ccc(Cl)c([N+](=O)[O-])c3)C2=O)oc2c(C)cccc12 919679621 ZDUXDANKFAXCKO-WQRHYEAKSA-N 499.932 5.078 5 20 JKBD C[C@@H](Nc1ccc(C(=O)Oc2ccc(N(C)C(=O)C(C)(C)C)cc2)cc1[N+](=O)[O-])c1ccccn1 919682732 SQGOBLCPFFOCGY-QGZVFWFLSA-N 476.533 5.391 5 20 JKBD CN(C)c1ccc([N+](=O)[O-])cc1C(=O)NC1(c2ccc(NC(=O)c3cccc4cc[nH]c34)cc2)CCC1 1789094115 WPWKWGPRNXYDEB-UHFFFAOYSA-N 497.555 5.204 5 20 JKBD CC1=CC[C@H](C(=O)Nc2ccc(C3(NC(=O)Cc4cc(F)ccc4[N+](=O)[O-])CCC3)cc2)CC1 1789113746 CVOUSYQCSDWNNF-SFHVURJKSA-N 465.525 5.157 5 20 JKBD Cc1cc(CCCC(=O)NC2(c3ccc(NC(=O)[C@H]4CC4(F)F)cc3)CCC2)c([N+](=O)[O-])cc1F 1789130479 IKONBSUOVIYUPZ-LJQANCHMSA-N 489.494 5.154 5 20 JKBD Cc1cc(C(=O)NC2(c3ccc(NC(=O)c4cc5cc([N+](=O)[O-])ccc5s4)cc3)CCC2)ccn1 1791010389 MSEOSYWTNNUPFE-UHFFFAOYSA-N 486.553 5.574 5 20 JKBD C[C@H](C(=O)Nc1ccc(C2(NC(=O)/C=C/c3ccc([N+](=O)[O-])o3)CCC2)cc1)c1ccccc1 1792309725 JLZGXMVQEGRSJV-SZEUEKNRSA-N 459.502 5.139 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)N1CCC([C@@H]2CCCCN2C(=O)C2CCC(F)(F)CC2)CC1 1824328258 UWWAJNAYJSNXMK-NRFANRHFSA-N 495.542 5.101 5 20 JKBD CC(C)(C)c1ccc(C(=O)N2CCCC[C@H]2C2CCN(C(=O)c3ccc(O)c([N+](=O)[O-])c3)CC2)s1 1827903833 JHPGKTUBVBZTFS-IBGZPJMESA-N 499.633 5.207 5 20 JKBD Cc1ccc(CC(=O)N2CCCC[C@H]2C2CCN(C(=O)c3ccc(C4CC4)cc3)CC2)cc1[N+](=O)[O-] 1830364617 VADAITFPOJIZKE-SANMLTNESA-N 489.616 5.257 5 20 JKBD O=C(c1ccc2occc2c1)N1CCC([C@H]2CCCCN2C(=O)c2cccc(F)c2[N+](=O)[O-])CC1 1830621900 QGTIZCSGVYKRFX-JOCHJYFZSA-N 479.508 5.027 5 20 JKBD O=C(/C=C/c1ccccc1[N+](=O)[O-])N1CCC([C@H]2CCCCN2C(=O)c2ccc3ccoc3c2)CC1 1830909972 JFPPPWVFIQOFQJ-NFPSEPLVSA-N 487.556 5.288 5 20 JKBD COc1cc(C(=O)N2CCC([C@@H]3CCCCN3C(=O)c3cccc(C)c3Cl)CC2)ccc1[N+](=O)[O-] 1832603957 XQNXWALLKSDYFK-NRFANRHFSA-N 499.995 5.112 5 20 JKBD COc1cc(C(=O)OCc2csc(N(C(C)=O)c3c(C)cc(C)cc3C)n2)c([N+](=O)[O-])cc1OC 9487403 LPKMAYBRNGLOAB-UHFFFAOYSA-N 499.545 5.035 5 20 JKBD O=C(N[C@@H]1CCSc2ccc(F)cc21)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 10964287 FYCVPKDAPGQWBE-QGZVFWFLSA-N 483.487 5.322 5 20 JKBD COc1ccc(-c2nc(COC(=O)Cn3c4ccccc4c(=O)c4ccccc43)cs2)cc1 11278107 QJMGSFCIHXYFTR-UHFFFAOYSA-N 456.523 5.030 5 20 JKBD CC(=O)Nc1c(C)cccc1C(=O)O[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1 11811532 HRBBHENTVFTPDV-QFIPXVFZSA-N 481.892 5.052 5 20 JKBD COc1ccc(Nc2nnc(S[C@@H](C)c3nnc(-c4ccc([N+](=O)[O-])cc4)o3)s2)cc1 17662915 JBDXLKLSTRIXST-NSHDSACASA-N 456.509 5.102 5 20 JKBD C[C@@H](OC(=O)C[C@@H](NC(=O)c1ccccc1Cl)c1ccccc1)c1cccc([N+](=O)[O-])c1 21673025 VNHFYVGDABZFNR-OPAMFIHVSA-N 452.894 5.414 5 20 JKBD O=C(CCCc1cccs1)O[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1 22036421 RRCHQRRMHNXXTJ-NRFANRHFSA-N 458.923 5.556 5 20 JKBD CC(=O)N(c1nc(COC(=O)c2ccc([N+](=O)[O-])c(C)c2)cs1)c1c(C)cc(C)cc1Cl 28644437 SAYHYJXUXLEMBX-UHFFFAOYSA-N 473.938 5.672 5 20 JKBD Cc1cc(-c2cc(C(=O)N3CCc4ccc([N+](=O)[O-])cc43)c3cnn(C(C)C)c3n2)c(C)s1 29888867 VSJRODJIRJVDBK-UHFFFAOYSA-N 461.547 5.469 5 20 JKBD Cc1csc(Sc2ccc(NC(=O)Cn3c4ccccc4c(=O)c4ccccc43)cc2)n1 71937933 WHXRZLGWGOKKLL-UHFFFAOYSA-N 457.580 5.710 5 20 JKBD CSCC[C@H](NC(=O)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1)c1nnc2ccccn12 105220859 RHKZIIJOUHUOOO-SFHVURJKSA-N 497.964 5.307 5 20 JKBD Cc1cc(CSc2ncccc2C(=O)Nc2nc(-c3cccc([N+](=O)[O-])c3)c(C)s2)no1 195703989 AZWJJFKADWRKSR-UHFFFAOYSA-N 467.532 5.263 5 20 JKBD C[C@@H]1CCC[C@@H](C)N1C(=O)c1cc(Cl)ccc1NC(=O)c1ccc([N+](=O)[O-])cc1Cl 302941846 LJDUIECMKGKSTK-CHWSQXEVSA-N 450.322 5.557 5 20 JKBD C[C@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)N[C@@H](C)c1cccc(NC(=O)Cc2ccccc2F)c1 483238470 KICFRBBIAOYJKD-IRXDYDNUSA-N 481.549 5.273 5 20 JKBD CSc1ccc(C(=O)c2ccccc2C(=O)N2CC=C(c3c[nH]c4ncccc34)CC2)cc1[N+](=O)[O-] 485386833 RAGBAWCCROMQIM-UHFFFAOYSA-N 498.564 5.354 5 20 JKBD COc1ccc2[nH]cc(C3=CCN(C(=O)c4csc(-c5ccc([N+](=O)[O-])cc5)n4)CC3)c2c1 497363821 JWLRYVGODALDIO-UHFFFAOYSA-N 460.515 5.138 5 20 JKBD CC(=O)N(c1ccc(C(F)(F)F)cc1)c1nc(COc2cccc([N+](=O)[O-])c2C)cs1 505886806 MISCIMYDIHWRGO-UHFFFAOYSA-N 451.426 5.642 5 20 JKBD CN(Cc1ccc(Br)o1)C(=O)Cc1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1 508758748 VLYZSXBUOARQIP-UHFFFAOYSA-N 495.333 5.004 5 20 JKBD CSc1ccc(C(=O)c2ccccc2C(=O)Nc2nc(C(F)(F)F)cs2)cc1[N+](=O)[O-] 509322993 ZBIWGTPTVDCUAX-UHFFFAOYSA-N 467.450 5.275 5 20 JKBD O=C(c1ccn(-c2ccc([N+](=O)[O-])cc2)n1)N(CCc1ccccc1)c1nc2ccccc2s1 519109619 OMYVBCCSQXLLQI-UHFFFAOYSA-N 469.526 5.280 5 20 JKBD Cc1csc(Sc2ccc(C(=O)Nc3ccc(OCc4ccncc4)cc3)cc2[N+](=O)[O-])n1 519127678 LYUNSHVRKIJRTK-UHFFFAOYSA-N 478.555 5.737 5 20 JKBD C[C@@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)Nc1cc(C(=O)Nc2ccccc2)ccc1Cl 521250459 YPNDFDKQQAMCHV-CYBMUJFWSA-N 474.300 5.560 5 20 JKBD COc1cc(C(=O)N2CCC[C@@H]2c2ccc(C)c(C)c2)c([N+](=O)[O-])cc1OCc1cscn1 521250609 CVNMLHWCEIAWQR-HXUWFJFHSA-N 467.547 5.233 5 20 JKBD O=[N+]([O-])c1cc(Br)ccc1Sc1nnc(-c2ccc(Br)cc2)o1 524267390 QXCXPHXRVHMPNS-UHFFFAOYSA-N 457.103 5.321 5 20 JKBD CC(C)n1cc(NC(=O)c2ccccc2Sc2ccc(C(F)(F)F)cc2[N+](=O)[O-])cn1 550445997 VVYPUTRBJQSENO-UHFFFAOYSA-N 450.442 5.795 5 20 JKBD COc1cc(NC(=O)c2ccc(NCc3ccccc3Cl)c([N+](=O)[O-])c2)ccc1NC(C)=O 603774959 CQGJPWDOOMVNNA-UHFFFAOYSA-N 468.897 5.080 5 20 JKBD CC(C)c1ccc([C@@H](NC(=O)C(=O)Nc2cc([N+](=O)[O-])ccc2OC(F)F)c2cccs2)cc1 604140770 ZCMDUJJRCPRCAH-HXUWFJFHSA-N 489.500 5.225 5 20 JKBD Cc1ccccc1NC(=O)[C@H]1CSCN1C(=O)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1 608799787 JAVIUHSJEJTAEJ-OAQYLSRUSA-N 497.960 5.503 5 20 JKBD CC[C@@H](C)Sc1ccc(NC(=O)[C@H]2CCCN2C(=O)c2ccc([N+](=O)[O-])c(C)c2)c(C)c1 608806141 OBHOPPGUGOQCRS-VGOFRKELSA-N 455.580 5.346 5 20 JKBD NC(=O)c1ccc(NC(=O)c2c3c(nc4ccccc24)/C(=C/c2ccc([N+](=O)[O-])cc2)CCC3)cc1F 608850967 QVLDXRYRYSMTSW-SAPNQHFASA-N 496.498 5.510 5 20 JKBD CC(=O)N1C=Cc2ccccc2[C@H]1CC(=O)Nc1cc(Cl)c([N+](=O)[O-])cc1OCc1ccccc1 727961163 IENSNYCSFXATEX-HSZRJFAPSA-N 491.931 5.730 5 20 JKBD CC[C@H](NC(=O)c1ccccc1NC(=O)c1ccc([N+](=O)[O-])cc1Cl)c1nc(C)cs1 729449284 POVYGKGYQOBPDK-KRWDZBQOSA-N 458.927 5.147 5 20 JKBD C[C@H](SCc1nc(O)c2c(-c3ccccc3)csc2n1)C(=O)O[C@H](C)c1cccc([N+](=O)[O-])c1 729758363 ITZHXRVSGJYDGH-CABCVRRESA-N 495.582 5.898 5 20 JKBD CC1=C(C(=O)Nc2ccccc2C(C)C)[C@H](c2ccc([N+](=O)[O-])cc2)NC(=O)N1Cc1cccs1 732049682 ZAEMMDWMTNHPNK-DEOSSOPVSA-N 490.585 5.959 5 20 JKBD O=C(COC(=O)c1csc(-c2ccc([N+](=O)[O-])cc2)n1)Nc1ccc(Cl)cc1C(F)(F)F 747958678 SKSMSVZIEACZOR-UHFFFAOYSA-N 485.827 5.186 5 20 JKBD CCCOc1ccc(-c2nc(C(=O)O[C@H](C)C(=O)Nc3ccc([N+](=O)[O-])cc3Cl)cs2)cc1 750273627 CFZORPRYVRJNNK-CYBMUJFWSA-N 489.937 5.345 5 20 JKBD Cc1cc(C)cc(NC(=S)Nc2ccc(NS(=O)(=O)c3ccc(C)c([N+](=O)[O-])c3)cc2)c1 916120004 MDSVMNPEYWRNME-UHFFFAOYSA-N 470.576 5.130 5 20 JKBD O=C(OCC(=O)N1N=C(c2cc3ccccc3o2)C[C@H]1c1ccco1)c1cc2cc([N+](=O)[O-])ccc2o1 917263423 OHOHRSONIUHSHF-IBGZPJMESA-N 499.435 5.215 5 20 JKBD O=C(CCCCn1cccc1)Nc1ccc(C2(NC(=O)Cc3ccc([N+](=O)[O-])cc3F)CCC2)cc1 1789604724 IFCLNHMFIVQBNO-UHFFFAOYSA-N 492.551 5.083 5 20 JKBD Cc1cnc(Cl)c(C(=O)NC2(c3ccc(NC(=O)c4cc(F)cc([N+](=O)[O-])c4)cc3)CCC2)c1 1790696726 OFXVJOMBPOVVGE-UHFFFAOYSA-N 482.899 5.152 5 20 JKBD CCc1cnc(C(=O)NC2(c3ccc(NC(=O)CSc4ccccc4[N+](=O)[O-])cc3)CCC2)s1 1791522064 AXXFJKUFKWVHIY-UHFFFAOYSA-N 496.614 5.154 5 20 JKBD C[C@@H]1CCC[C@@H]1C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)[nH]n1 1818960248 RSHPEONQMVDFBA-DKSSEZFCSA-N 481.578 5.275 5 20 JKBD Cc1c(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)[C@H]3CCC(F)(F)C3)[nH]n2)cc(Cl)cc1[N+](=O)[O-] 1821290289 TZFLRNFIHVJGRV-GUYCJALGSA-N 495.914 5.021 5 20 JKBD Cc1ccc(CC(=O)N2CCC([C@H]3CCCCN3C(=O)c3ccc(Cl)cc3)CC2)cc1[N+](=O)[O-] 1830028268 WOWNKNCGODLRDD-HSZRJFAPSA-N 483.996 5.033 5 20 JKBD Cc1ccc(CC(=O)N2CCCC[C@H]2C2CCN(C(=O)C34CCC(CC3)CC4)CC2)cc1[N+](=O)[O-] 1830364049 HYHXHYQRBNBVPQ-CJQCTXEWSA-N 481.637 5.036 5 20 JKBD Cc1ccoc1C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)CC1 1831060654 CHVHFCXVBHKHSK-HXUWFJFHSA-N 481.574 5.258 5 20 JKBD O=C(c1ccc(Cl)s1)N1CCC([C@@H]2CCCCN2C(=O)/C=C/c2ccccc2[N+](=O)[O-])CC1 1832902892 CSKXUVKFLFGBIV-BLRBJFNZSA-N 488.009 5.256 5 20 JKBD C[C@H](Sc1nc2ccccc2c(=O)n1Cc1ccccc1Cl)C(=O)Nc1ccccc1[N+](=O)[O-] 9456495 IEJPYPFVZXWXAX-HNNXBMFYSA-N 494.960 5.126 5 20 JKBD CSc1ccccc1NC(=O)[C@H](C)OC(=O)c1ccccc1C(=O)c1ccc(Cl)c([N+](=O)[O-])c1 11029267 XVZHVAIVKYMYMN-AWEZNQCLSA-N 498.944 5.385 5 20 JKBD CC(=O)N(c1nc(COC(=O)COc2ccccc2[N+](=O)[O-])cs1)c1c(C)cc(C)cc1Cl 11083651 PGIKJQIVTHXVFZ-UHFFFAOYSA-N 489.937 5.128 5 20 JKBD O=C(/C=C/c1ccc(-c2ccc(F)cc2)s1)OCc1nnc(-c2ccc([N+](=O)[O-])cc2)o1 11373012 DVTNFLDDWFUPAX-ZRDIBKRKSA-N 451.435 5.269 5 20 JKBD C[C@@H](Sc1nc(-c2ccccc2)c(-c2ccccc2)o1)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 17660682 OBPAXWUAXSXMQS-MRXNPFEDSA-N 470.510 6.820 5 20 JKBD CC(C)c1cc(C(=O)O[C@@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2C(F)(F)F)c2ccccc2n1 18024414 CRABPFFUNGMXBQ-ZDUSSCGKSA-N 475.423 5.469 5 20 JKBD Cn1cnnc1Sc1ccc(C(=O)N[C@@H](Cc2ccc(Cl)cc2)c2ccccc2)cc1[N+](=O)[O-] 68740241 URGZZHSHXLBOTD-FQEVSTJZSA-N 493.976 5.242 5 20 JKBD O=C(NC1(c2ccc(Cl)cc2)CCOCC1)c1ccc(NCc2ccccc2)c([N+](=O)[O-])c1 116589292 AEAIPJLMQCLCLL-UHFFFAOYSA-N 465.937 5.296 5 20 JKBD COc1cc(CN[C@H](c2ccccc2)c2ccncc2)ccc1OCc1ccc([N+](=O)[O-])cc1 488532988 XVDXDKHJUWXVFR-HHHXNRCGSA-N 455.514 5.457 5 20 JKBD O=C1c2ccccc2N[C@H](c2ccc(-c3ccc([N+](=O)[O-])cc3Cl)o2)N1Cc1cccnc1 489294084 VIZCAGLBSMFDAL-QHCPKHFHSA-N 460.877 5.670 5 20 JKBD Cn1c(SCc2nnc(-c3ccccc3Br)o2)nc2cc3ccccc3cc2c1=O 495366223 YFPXKLIAJXXVRM-UHFFFAOYSA-N 479.359 5.192 5 20 JKBD Cc1nn(Cc2ccc(C(=O)Nc3ccc(NC(=O)N4CCCCCC4)cc3)cc2)c(C)c1[N+](=O)[O-] 498514319 NYMZVRHODFGSAN-UHFFFAOYSA-N 490.564 5.117 5 20 JKBD COc1cc(C(=O)Nc2cccc(NC(=O)c3cccc(C(F)(F)F)c3)c2)c([N+](=O)[O-])cc1OC 504811984 CRNKCBKMTQEJCW-UHFFFAOYSA-N 489.406 5.135 5 20 JKBD Cn1cc(C(=O)NCc2ccccc2-c2ccc(CN3CCCC3)cc2)c(-c2ccc([N+](=O)[O-])cc2)n1 507250638 BHBSMHAWEKVFOD-UHFFFAOYSA-N 495.583 5.188 5 20 JKBD COc1ccc(CCCN[C@@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2ccccc2)cc1 511424404 RCNGZTLVJFHAKI-HSZRJFAPSA-N 453.926 5.159 5 20 JKBD CNc1ccc(C(=O)N[C@H](c2ccccc2)c2ccc3nc(C(F)(F)F)[nH]c3c2)cc1[N+](=O)[O-] 514523816 HDDCVQRQXOVMIH-HXUWFJFHSA-N 469.423 5.051 5 20 JKBD O=C(C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)Nc1ccc2n[nH]cc2c1 515762942 XUIUINCPOZBTCU-WJDWOHSUSA-N 455.499 5.650 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Cl)[C@@H](NCCCc1nc2c(s1)CCCC2)c1ccccc1 608910302 NHQGEAYAFJMZES-QHCPKHFHSA-N 485.009 5.486 5 20 JKBD O=[N+]([O-])c1cc(C(F)(F)F)ccc1Sc1nnc(-c2ccc(F)cc2)n1C[C@@H]1CCCO1 619714555 FEUCRNKMPCMDOC-HNNXBMFYSA-N 468.432 5.341 5 20 JKBD CN1CCN(C(=O)c2ccc(CNCc3c4ccccc4c(Cl)c4ccccc34)cc2)CC1 727643502 UIYGCNCHJMZXGC-UHFFFAOYSA-N 458.005 5.324 5 20 JKBD Cc1cnn([C@H]2CCCc3ccccc32)c1NC(=O)c1cc([N+](=O)[O-])ccc1Br 727993181 JPIDJFYYCYFIOG-IBGZPJMESA-N 455.312 5.040 5 20 JKBD O=C(Nc1ccc(Sc2nncs2)c(Cl)c1)c1cc([N+](=O)[O-])ccc1Br 728184028 BLMRXGPAYQLJOM-UHFFFAOYSA-N 471.745 5.266 5 20 JKBD Cc1ccc2nc(-c3cccnc3)cc(C(=O)Nc3cc(-c4cccc([N+](=O)[O-])c4)[nH]n3)c2c1 730589012 RVKZYOWHUQFEGR-UHFFFAOYSA-N 450.458 5.156 5 20 JKBD COc1cc(COC(=O)CCc2nc3cc(Cl)ccc3s2)c([N+](=O)[O-])cc1OC(F)F 730609424 RVPQTVBVFWLMPI-UHFFFAOYSA-N 472.853 5.144 5 20 JKBD O=[N+]([O-])c1ccccc1-c1ccc(/C=C(/c2nc3ccccc3[nH]2)S(=O)(=O)c2ccccc2)o1 745997587 CWLOOTFLTAGUTD-JLPGSUDCSA-N 471.494 5.703 5 20 JKBD C[C@H](OC(=O)c1ccccc1NC(=O)c1ccc(Cl)cc1)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 746156465 INAXFLPRWHUAKS-AWEZNQCLSA-N 492.875 5.469 5 20 JKBD CC(C)C[C@H](C)N(C(=O)c1ccc(Sc2nncn2C)c([N+](=O)[O-])c1)c1ccc2[nH]ccc2c1 750826381 LTMFNNQHBKGRLM-INIZCTEOSA-N 478.578 5.437 5 20 JKBD O=C1c2cc(Cl)ccc2N[C@H](c2ccc(Br)c([N+](=O)[O-])c2)N1c1ccncc1 877852439 AERVBUWYYLIXTA-SFHVURJKSA-N 459.687 5.177 5 20 JKBD Cc1ccc(C(C)C)c(Oc2ccc(CNCc3ccc(-n4ccnc4C)nc3)cc2[N+](=O)[O-])c1 916839916 OZAHTSVTACCWJO-UHFFFAOYSA-N 471.561 5.998 5 20 JKBD Cc1ccc(NC(=O)[C@@H](OC(=O)c2cnc(C(C)(C)C)s2)c2ccccc2)c([N+](=O)[O-])c1 920692170 NHBQWWISVFPHRR-IBGZPJMESA-N 453.520 5.194 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)c3cccc(F)c3[N+](=O)[O-])CCC2)cc1)c1ccc2scnc2c1 1789341191 SAUXIHSWPDKGCG-UHFFFAOYSA-N 490.516 5.405 5 20 JKBD Cc1cc(C(=O)NC2(c3ccc(NC(=O)c4sccc4Cl)cc3)CCC2)ncc1[N+](=O)[O-] 1789900424 QSEBGBNUOLZCJC-UHFFFAOYSA-N 470.938 5.075 5 20 JKBD Cc1c(C(=O)Nc2ccc(C3(NC(=O)c4cc(F)c[nH]4)CCC3)cc2)cc(Cl)cc1[N+](=O)[O-] 1790773819 HXEVDINESIYWBY-UHFFFAOYSA-N 470.888 5.085 5 20 JKBD O=C(/C=C/c1ccc([N+](=O)[O-])o1)NC1(c2ccc(NC(=O)[C@H]3C[C@@H]3c3ccccc3)cc2)CCC1 1791526502 BOTYZKLYXHWGLC-XWDPTAOESA-N 471.513 5.139 5 20 JKBD Cc1cccc(C(=O)N2CCC([C@@H]3CCCCN3C(=O)/C=C/c3ccc([N+](=O)[O-])o3)CC2)c1Cl 1824279556 XGYBRFLOXOFIEW-DJGBTNNQSA-N 485.968 5.096 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)N1CCC([C@H]2CCCCN2C(=O)[C@@H]2C[C@H]2c2ccccc2)CC1 1832023005 BPLXPNMNSIMOTM-SGIRGMQISA-N 493.579 5.079 5 20 JKBD CC(=O)N(c1nc(COC(=O)CSc2ccc([N+](=O)[O-])cc2)cs1)c1c(C)cc(C)cc1C 9352165 RVLAVGADOLXWHD-UHFFFAOYSA-N 485.587 5.497 5 20 JKBD Cc1ccsc1C(=O)O[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Br)c1ccccc1 10647313 RXAFQLZBJZLHFG-KRWDZBQOSA-N 475.320 5.264 5 20 JKBD Cc1cc(C)c(NC(=O)COc2ccc3c(-c4ccc([N+](=O)[O-])cc4)cc(=O)oc3c2)c(Cl)c1 14305192 AXHQJSVECMXATC-UHFFFAOYSA-N 478.888 5.656 5 20 JKBD Cc1nc(COc2ccc(Cl)cc2)sc1C(=O)OCC(=O)Nc1ccc([N+](=O)[O-])cc1Cl 17733262 YYFZQNZTMSFRNQ-UHFFFAOYSA-N 496.328 5.041 5 20 JKBD Cc1cccc(C)c1NC(=O)[C@H](C)OC(=O)Cc1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1 18589362 VRLNKFJPGJUKOJ-FQEVSTJZSA-N 498.539 5.177 5 20 JKBD Cc1csc(Sc2ccc(C(=O)N3CCC[C@@H](c4nc5ccccc5o4)C3)cc2[N+](=O)[O-])n1 24695506 KRYWKCOKMLDKPP-MRXNPFEDSA-N 480.571 5.672 5 20 JKBD Cc1ccc(C)c(-c2nn(CN(C)Cc3cc([N+](=O)[O-])ccc3Cl)c(=O)c3ccccc23)c1 27533723 CBHRUPFIEDAJIS-UHFFFAOYSA-N 462.937 5.331 5 20 JKBD COc1cc(C(=O)N2CCO[C@@H](c3ccc(F)cc3)C2)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 29113552 IUEKGSRYPQKHSQ-HSZRJFAPSA-N 486.883 5.402 5 20 JKBD Cc1ccc(-n2c(SCc3nnc(-c4ccc([N+](=O)[O-])cc4)o3)nnc2-c2ccncc2)cc1C 29812557 UURAZBSAGMCSSN-UHFFFAOYSA-N 485.529 5.197 5 20 JKBD O=C(Nc1ccc(N2C(=O)CCCC2=O)cc1)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1 46776471 HXFJTRRVTHEDMX-UHFFFAOYSA-N 479.876 5.336 5 20 JKBD Cc1cccc([N+](=O)[O-])c1NC(=O)COC(=O)c1c2c(nc3ccccc13)/C(=C\c1ccco1)CCC2 102050489 IXUVKFWPUUKANQ-SDXDJHTJSA-N 497.507 5.717 5 20 JKBD Cc1ccc(C)c(Oc2ccc(CNC(=O)Cn3c4ccccc4c(=O)c4ccccc43)cn2)c1 107637421 OGJSAAYDESPVDC-UHFFFAOYSA-N 463.537 5.275 5 20 JKBD C[C@@H](Nc1ccc(C(=O)N[C@H](c2ccccc2)c2nccs2)cc1[N+](=O)[O-])c1ccccn1 303231196 VPXNCEMCPJOADP-OPAMFIHVSA-N 459.531 5.139 5 20 JKBD C[C@H]1C[C@H](C)CN(c2ccc(C(=O)Nc3ccccc3NC(=O)Cc3cccs3)cc2[N+](=O)[O-])C1 409992248 JRYFLFCXJLKIBL-ROUUACIJSA-N 492.601 5.572 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)Nc2ccc(NC(=O)c3ccco3)cc2C(F)(F)F)cc1SC 482019370 YTNROZOVMWNKAT-UHFFFAOYSA-N 495.435 5.442 5 20 JKBD O=C(Cc1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1)N[C@@H](c1ccccc1)c1cccnc1 485476969 GEBRFTFCZLELDD-NDEPHWFRSA-N 489.535 5.291 5 20 JKBD CCN(C(=O)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1)c1ccc(OC)c(OC)c1 500929729 YWFUWQFOJHVIEL-UHFFFAOYSA-N 456.882 5.724 5 20 JKBD O=C(Nc1ccc(=O)n(Cc2ccccc2Cl)c1)c1cc([N+](=O)[O-])ccc1Sc1ccccc1 501422206 KXBNKPATRFODMB-UHFFFAOYSA-N 491.956 5.862 5 20 JKBD CCN(C(=O)c1csc(-c2ccc([N+](=O)[O-])cc2)n1)[C@@H]1CCN([C@@H](C)c2ccccc2)C1 501948589 PZLWZXAQOZVMLD-LAUBAEHRSA-N 450.564 5.016 5 20 JKBD O=C(Cc1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1)Nc1ccc(-c2ncc[nH]2)cc1 502569089 KEALCTSIZAAACS-UHFFFAOYSA-N 464.485 5.019 5 20 JKBD COc1ccc([N+](=O)[O-])cc1OCc1csc(N(C(C)=O)c2ccc(C(F)(F)F)cc2)n1 512684345 GSTRJKPTKQZZPK-UHFFFAOYSA-N 467.425 5.342 5 20 JKBD CCN(Cc1cccc(Cl)c1)C(=O)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 514534086 QYJBCBLJXSJCCF-UHFFFAOYSA-N 469.891 5.532 5 20 JKBD O=C(C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)N1CCC[C@@H]1c1cccnc1 515747577 RNQAFZHSPDINOE-QFXGEWDLSA-N 470.554 5.894 5 20 JKBD C[C@H]1C[C@@H](C)CN(c2ccc(C(=O)N3CCC(C(=O)c4ccc(Cl)cc4)CC3)cc2[N+](=O)[O-])C1 515988696 FXGIREMBIBZGBQ-HDICACEKSA-N 483.996 5.466 5 20 JKBD O=[N+]([O-])c1ccc(-c2ccc(CNCc3ccc(OCC(F)(F)F)cc3)o2)c(Br)c1 518770593 VASUFDGDSKTETL-UHFFFAOYSA-N 485.256 5.848 5 20 JKBD COc1ccc(CN[C@@H](c2ccccc2)c2ccccn2)cc1OCc1ccc([N+](=O)[O-])cc1 518771738 VGXHLUCIUVPLJF-MHZLTWQESA-N 455.514 5.457 5 20 JKBD COc1cc(C)ccc1Oc1ccc(F)cc1NC(=O)c1ccn(-c2ccc([N+](=O)[O-])cc2)n1 520734294 QALBAWRXWILIOE-UHFFFAOYSA-N 462.437 5.281 5 20 JKBD CCOc1cc(C(=O)Nc2cc(-c3cccc(C)c3)nn2-c2ccccc2)c([N+](=O)[O-])cc1OC 585714983 OKVXTAAFNFBIML-UHFFFAOYSA-N 472.501 5.416 5 20 JKBD CC(=O)Nc1ccc(NC(=O)c2ccc(NCc3ccccc3)c([N+](=O)[O-])c2)c(C(F)(F)F)c1 590766468 IGANXCXANXRMSW-UHFFFAOYSA-N 472.423 5.436 5 20 JKBD CN(Cc1ccccc1NCc1ccc(C(F)(F)F)cc1[N+](=O)[O-])C(=O)c1cc2ccccc2o1 600852468 GUOSCSKROJWLBV-UHFFFAOYSA-N 483.446 6.244 5 20 JKBD CN(C)C(=O)c1ccc(NC(=O)c2ccccc2Sc2ccc(C(F)(F)F)cc2[N+](=O)[O-])cc1 600864675 RUGUABWZZZQPRR-UHFFFAOYSA-N 489.475 5.719 5 20 JKBD CC(C)(C)c1ccc(C(=O)Nc2ccc(C(=O)NCc3ccccn3)c(Cl)c2)cc1[N+](=O)[O-] 603774103 XCAXSHGWZBGAFI-UHFFFAOYSA-N 466.925 5.123 5 20 JKBD CCOc1cc(C(=O)N[C@H](Cc2ccc(Cl)cc2)c2ccccc2)c([N+](=O)[O-])cc1OC 604118946 OKTLIFMLIDRIKJ-HXUWFJFHSA-N 454.910 5.369 5 20 JKBD C[C@H](Nc1ccc(C(=O)N(C)Cc2ccc(C(F)(F)F)cc2)cc1[N+](=O)[O-])c1ccccn1 604295499 JWRFPIGXQNVYFN-HNNXBMFYSA-N 458.440 5.454 5 20 JKBD CCc1nc2cc(NC(=O)c3ccc(C(=O)Nc4ccc5oc(CC)nc5c4)c([N+](=O)[O-])c3)ccc2o1 609044298 GLIAOCHSXYFJNG-UHFFFAOYSA-N 499.483 5.507 5 20 JKBD Cc1cccc(-n2ncc(C(=O)Nc3nc(-c4ccc(C)c([N+](=O)[O-])c4)cs3)c2C(F)(F)F)c1 619729720 AROBETWMBVVMJA-UHFFFAOYSA-N 487.463 5.792 5 20 JKBD Cc1ccc(/C(O)=C(/C(=S)N[C@@H](C)c2cccs2)[n+]2ccc3c(c2)CCCC3)cc1[N+](=O)[O-] 726577856 BKKFBIAIWLKAKM-KRWDZBQOSA-O 480.635 5.693 5 20 JKBD C[C@H](Nc1ccc(C(=O)Nc2ccc(OCc3cccnc3)cc2)cc1[N+](=O)[O-])c1ccccn1 728496083 ORHWNIUTJHPWIH-SFHVURJKSA-N 469.501 5.389 5 20 JKBD CCOC(=O)Nc1ccc(OC(=O)c2ccccc2NC(=O)c2ccc([N+](=O)[O-])cc2Cl)cc1 730783737 JGPUTDIYEBKOCA-UHFFFAOYSA-N 483.864 5.288 5 20 JKBD O=C(O[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Br)c1ccccc1)c1ccc2[nH]ccc2c1 730856049 SEDLGIGTHWAVFD-OAQYLSRUSA-N 494.301 5.375 5 20 JKBD Cc1ccc(N2C(=O)/C(=C/c3ccc4c(c3)OCO4)N=C2SCc2ccccc2[N+](=O)[O-])cc1 776251467 ZKHXEMRLOMLAIY-NDENLUEZSA-N 473.510 5.309 5 20 JKBD O=C(Cc1csc(-c2ccc(C(F)(F)F)cc2)n1)OCc1nnc(-c2ccc([N+](=O)[O-])cc2)o1 824923635 QOHUNRIOBUPSDE-UHFFFAOYSA-N 490.419 5.073 5 20 JKBD O=C(CCOc1ccccc1Cl)Oc1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2Cl)cc1 914712290 ZMLBJSZMCAGNJV-UHFFFAOYSA-N 475.284 5.528 5 20 JKBD CC(C)[C@H](OC(=O)c1ccc(NC2CC2)c([N+](=O)[O-])c1)C(=O)Nc1ccccc1C(F)(F)F 915366837 IMGLGWDHASLHHT-IBGZPJMESA-N 465.428 5.008 5 20 JKBD CCN(Cc1ccc(OCc2cccs2)c(OC)c1)C(=O)/C=C\c1ccc([N+](=O)[O-])cc1 917526011 BXYRSQUKESMNJA-LCYFTJDESA-N 452.532 5.306 5 20 JKBD C[C@@H](NC(=S)/C(=C(/O)c1cccc([N+](=O)[O-])c1)[n+]1ccc2c(c1)CCCC2)c1ccccc1 917611402 CKZCHOMZNGRBHU-GOSISDBHSA-O 460.579 5.323 5 20 JKBD C[C@@H](SCc1nc(O)c2c(-c3ccccc3)csc2n1)C(=O)OCc1cc(F)ccc1[N+](=O)[O-] 918899190 DUXVYUJLEQXTJW-CYBMUJFWSA-N 499.545 5.476 5 20 JKBD O=C(COC(=O)c1cc([N+](=O)[O-])ccc1Oc1ccccc1)Nc1ccc(Cl)cc1C(F)(F)F 919191459 FRTBHXWJKYNERN-UHFFFAOYSA-N 494.809 5.855 5 20 JKBD O=C(O[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1)c1cccn1Cc1cccs1 919624672 GGGYTMOCNBVMQU-QFIPXVFZSA-N 495.944 5.696 5 20 JKBD O=C(Cn1ncc2ccc([N+](=O)[O-])cc21)Nc1cccc(NC(=O)Nc2cccc(C(F)(F)F)c2)c1 919873135 KWCJBGKDJDZNSQ-UHFFFAOYSA-N 498.421 5.246 5 20 JKBD COc1ccc(COCc2cccc(NC(=O)c3cc([N+](=O)[O-])ccc3N3CCCCC3)c2)cc1 921155472 QWJKQUIKOZFRRK-UHFFFAOYSA-N 475.545 5.563 5 20 JKBD O=C(CCC(F)(F)F)Nc1ccc(C2(NC(=O)Cn3ccc4ccc([N+](=O)[O-])cc43)CCC2)cc1 1787868643 CJXGEXGSQVEJGQ-UHFFFAOYSA-N 488.466 5.026 5 20 JKBD O=C(/C=C/c1ccccc1[N+](=O)[O-])NC1(c2ccc(NC(=O)c3cc(-c4ccco4)no3)cc2)CCC1 1788420575 LTGIFEBSIIFQMO-MDWZMJQESA-N 498.495 5.304 5 20 JKBD O=C(NC1(c2ccc(NC(=O)[C@@H]3C[C@H]3c3ccccc3)cc2)CCC1)c1nc2cc([N+](=O)[O-])ccc2[nH]1 1791533920 OMZVCLUKWYAXHW-FCHUYYIVSA-N 495.539 5.023 5 20 JKBD Cc1c(C(=O)N2CC[C@@H](CNC(=O)/C=C/C3CCCC3)[C@H]2c2cccnc2)cc(Cl)cc1[N+](=O)[O-] 1808492203 CHBBAIMXAHYZBT-DMGXODIQSA-N 496.995 5.018 5 20 JKBD Cc1c(C(=O)N2CCC([C@H]3CCCCN3C(=O)C3CC(C)(C)C3)CC2)cc(Cl)cc1[N+](=O)[O-] 1831930935 IGGVPWMRSISKIY-OAQYLSRUSA-N 476.017 5.226 5 20 JKBD O=C(c1ccc2occc2c1)N1CCC([C@@H]2CCCCN2C(=O)/C=C/c2ccccc2[N+](=O)[O-])CC1 1832906996 LGCDRSOAZJHIIY-LJTKGQTQSA-N 487.556 5.288 5 20 JKBD COc1ccc(/C=C/C(=O)O[C@@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2ccccc2)cc1 10899146 DOWTWKVFMYNRAV-VTJDKEBTSA-N 466.877 5.193 5 20 JKBD COc1cc(C(=O)Nc2ccc(F)c(F)c2F)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 15002007 VOYUVMNSTHKMSR-UHFFFAOYSA-N 452.772 5.719 5 20 JKBD COc1ccc(NC(=O)[C@@H](C)OC(=O)c2ccc(-c3nc4ccccc4s3)s2)c([N+](=O)[O-])c1 21248432 NEGFCGYDGANGBV-GFCCVEGCSA-N 483.527 5.126 5 20 JKBD C[C@H](Sc1ncnc2scc(-c3ccc(F)cc3)c12)C(=O)Nc1ccccc1[N+](=O)[O-] 21751132 XGVJRGNRBHKNAD-LBPRGKRZSA-N 454.508 5.525 5 20 JKBD CCCCCN(C(=O)Cn1c2ccccc2c(=O)c2ccccc21)c1nc(C)c(C(=O)OCC)s1 22143104 DZTRDBFEWYOACI-UHFFFAOYSA-N 491.613 5.320 5 20 JKBD CSc1ccc(C(=O)c2ccccc2C(=O)NCCc2cccc3cccnc23)cc1[N+](=O)[O-] 29454286 ALCCLVRXPMIVOA-UHFFFAOYSA-N 471.538 5.068 5 20 JKBD C[C@@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)N(Cc1ccccn1)c1ccc(Br)cc1 68734255 HUDBREHAXOCFKC-OAHLLOKOSA-N 472.364 5.466 5 20 JKBD O=C(Nc1cccc(C(F)(F)F)c1)c1ccccc1NC(=O)c1ccc(Cl)cc1[N+](=O)[O-] 72046953 PKLYBJYPEVQUMB-UHFFFAOYSA-N 463.799 5.772 5 20 JKBD Cc1csc(Sc2ccc(C(=O)NCC3CCN(Cc4cccs4)CC3)cc2[N+](=O)[O-])n1 109513840 PYXHVLVNYJFYFI-UHFFFAOYSA-N 488.660 5.214 5 20 JKBD Cc1cccc(C)c1NS(=O)(=O)c1ccc(NC(=O)c2ccc(C(C)(C)C)c([N+](=O)[O-])c2)cc1 303021001 OUSDVYRDHXZOMW-UHFFFAOYSA-N 481.574 5.562 5 20 JKBD O=C(Nc1ccc(-c2nnco2)cc1)c1cc([N+](=O)[O-])ccc1Sc1ccc(Cl)cc1 481833418 YVJUUZFTNDTLQC-UHFFFAOYSA-N 452.879 5.702 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)Nc2ccc(Oc3ncc(Cl)cc3Cl)cc2)cc1SC 482909801 WXVXRZFBHXRBDI-UHFFFAOYSA-N 480.329 6.072 5 20 JKBD Cn1c(Sc2ccc([N+](=O)[O-])c3cnccc23)nc2scc(-c3cccs3)c2c1=O 497723803 XIBJLYUKKSHVMX-UHFFFAOYSA-N 452.542 5.331 5 20 JKBD COc1ccc(CN[C@@H](C)c2nc(-c3ccccc3)cs2)cc1OCc1ccc([N+](=O)[O-])cc1 501352062 QZKMUOPAHUIGRN-SFHVURJKSA-N 475.570 6.157 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)Nc2ccc(-c3nc4c(F)cccc4[nH]3)cc2)cc1SC 502580932 JYPLRJWANHYBJQ-UHFFFAOYSA-N 452.467 5.260 5 20 JKBD CCOc1ccc(-c2csc(NC(=O)c3ccc(N[C@H](C)c4ccccn4)c([N+](=O)[O-])c3)n2)cc1 507420462 AOYMSKYICXWXDM-MRXNPFEDSA-N 489.557 5.937 5 20 JKBD Cc1cc(SC2CCCCC2)ccc1NC(=O)c1ccc(Sc2nncn2C)c([N+](=O)[O-])c1 509051366 ZTFHFSDAEMBHLS-UHFFFAOYSA-N 483.619 5.860 5 20 JKBD COc1cc(C(=O)Nc2ccc(OC(C)C)c(Cl)c2)c([N+](=O)[O-])cc1OCc1cscn1 509917568 UTCSZESYEPPFFV-UHFFFAOYSA-N 477.926 5.332 5 20 JKBD Cc1nn(Cc2ccc(C(=O)N3CCC[C@@H]3c3cccc4ccccc34)cc2)c(C)c1[N+](=O)[O-] 510120729 NWJGAOSHZWOKKD-RUZDIDTESA-N 454.530 5.587 5 20 JKBD CCCN(C(=O)c1cc(OC)c(OCc2cscn2)cc1[N+](=O)[O-])[C@H](C)c1cc2ccccc2o1 511428181 WEHNEGZAXXWQHO-MRXNPFEDSA-N 495.557 5.999 5 20 JKBD C[C@H](Nc1ccc(C(=O)Nc2ccc(NC3CCOCC3)cc2)cc1[N+](=O)[O-])c1ccccn1 513054326 LGPHRLCIHABTFD-KRWDZBQOSA-N 461.522 5.006 5 20 JKBD COCCOc1cc([N+](=O)[O-])c(C(=O)N[C@H](c2ccc3c(c2)CCCC3)c2cccs2)cc1OC 514879336 CNYADGQIHSGZCJ-RUZDIDTESA-N 496.585 5.088 5 20 JKBD C[C@@H]1CCCCN1CCCCNC(=O)C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1 516397503 KELNGFZJRDTICL-AFHODHPKSA-N 492.645 5.906 5 20 JKBD Cc1ccc(Sc2ccc(CNCc3cccc(NC(=O)[C@@H]4CCCO4)c3)cc2[N+](=O)[O-])cc1 518277274 CHZOHUWAMNRXQQ-DEOSSOPVSA-N 477.586 5.462 5 20 JKBD C[C@H]1CN(Cc2ccc(CNCc3ccc(-c4ccc([N+](=O)[O-])cc4)s3)cc2)C[C@@H](C)O1 518768040 AKXFXUPJMUKVDG-KDURUIRLSA-N 451.592 5.222 5 20 JKBD CCOc1cc(C(=O)N[C@@H](C)c2sc(-c3ccc(F)cc3)nc2C)c([N+](=O)[O-])cc1OC 519131419 MTEUHVLJZLBUHZ-LBPRGKRZSA-N 459.499 5.064 5 20 JKBD CCOc1cc(NC(=O)C(C)(C)c2cccc(Br)c2)c([N+](=O)[O-])cc1OCC 523228774 YKMMVLRBEBOHOC-UHFFFAOYSA-N 451.317 5.071 5 20 JKBD C[C@@H]1CN(c2ccc(N[C@@H](C(=O)Nc3ccc([N+](=O)[O-])cc3Cl)c3ccccc3)cn2)C[C@@H](C)O1 559912727 DPHMVTHAPYQSOZ-HOZJOUCCSA-N 495.967 5.049 5 20 JKBD O=C(Nc1cccc(Cl)c1Cl)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 603470512 RUNCTGXLJRYEFW-UHFFFAOYSA-N 462.255 5.776 5 20 JKBD CC(C)CCSc1ccc(C(=O)N(C)C[C@H]2CCCO[C@H]2c2ccccc2)cc1[N+](=O)[O-] 604519185 RCNPWOPRMCZRMO-QPPBQGQZSA-N 456.608 5.973 5 20 JKBD CC[C@@H](NC(=O)Cc1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2[nH]1 608950508 ZYKPPKZWEPJUJW-JOCHJYFZSA-N 480.528 5.134 5 20 JKBD C[C@H](CN(C)C(=O)c1ccc(C(=O)N(C)C[C@@H](C)c2ccccc2)c([N+](=O)[O-])c1)c1ccccc1 609044501 ABXMCTKVCZMKGZ-NHCUHLMSSA-N 473.573 5.346 5 20 JKBD Cc1ccc(NS(=O)(=O)c2ccc(N3CCC(OCc4ccccc4)CC3)c([N+](=O)[O-])c2)c(C)c1 619515568 WBSYSNORAGHQGW-UHFFFAOYSA-N 495.601 5.198 5 20 JKBD C[C@H](c1nnc(-c2cccc(Cl)c2)o1)N1CCN(c2ccc([N+](=O)[O-])cc2C(F)(F)F)CC1 727438339 SUOMXADYELBPEM-CYBMUJFWSA-N 481.862 5.200 5 20 JKBD Cc1ccc(NC(=O)c2ccc(N3CCC([C@@H](O)c4ccc(F)cc4)CC3)c([N+](=O)[O-])c2)cc1 731028102 DFJSCZNDTWIHLW-VWLOTQADSA-N 463.509 5.245 5 20 JKBD CC(C)(C)OC(=O)N1CCC[C@H]1[C@H]1CCCN(C(=O)c2ccc(C(C)(C)C)c([N+](=O)[O-])c2)C1 749644105 BETQVMKYYPRKSU-ICSRJNTNSA-N 459.587 5.144 5 20 JKBD CSc1ccc(C(=O)c2ccccc2C(=O)O[C@@H](C)C(=O)Nc2ccccc2C)cc1[N+](=O)[O-] 777426742 ICWSRHONLQVGEB-INIZCTEOSA-N 478.526 5.040 5 20 JKBD COc1ccc(NC(=O)c2ccccc2NCc2c(Br)cccc2[N+](=O)[O-])cc1 863994864 LPLVJCKLKOKLCS-UHFFFAOYSA-N 456.296 5.230 5 20 JKBD Cc1cc(C(=O)N2CCC[C@H]2c2nc(-c3cccnc3Oc3ccccc3)no2)ccc1[N+](=O)[O-] 904452691 MRPOLQDAACVQKK-NRFANRHFSA-N 471.473 5.118 5 20 JKBD Cc1cc(C)n(-c2ccc(-c3noc(-c4ccc(NCc5ccccc5)c([N+](=O)[O-])c4)n3)cn2)n1 904523458 TXJMPRBKTAJINO-UHFFFAOYSA-N 467.489 5.121 5 20 JKBD CCCc1nc(C)c(C(=O)O[C@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2ccccc2)s1 915508327 OJDYTOAQADQYGK-IBGZPJMESA-N 473.938 5.502 5 20 JKBD O=C(Nc1cccc(F)c1)c1cccc(NC(=O)c2ccc(Br)c([N+](=O)[O-])c2)c1 917782562 OXFVGBOODDTTEQ-UHFFFAOYSA-N 458.243 5.001 5 20 JKBD COc1ccc([N+](=O)[O-])c(C(=O)OCc2csc(N(C(C)=O)c3ccc(C(F)(F)F)cc3)n2)c1 920704012 QQPCGYSFDZJXTF-UHFFFAOYSA-N 495.435 5.120 5 20 JKBD CCOC(=O)c1sc(N(Cc2ccccc2)C(=O)c2ccc(Cl)c([N+](=O)[O-])c2)nc1C 920976979 IBBYRHAATVPZBU-UHFFFAOYSA-N 459.911 5.037 5 20 JKBD COc1ccc([C@H](Cc2ccccc2C)NC(=O)c2cc(Cl)ccc2[N+](=O)[O-])cc1OC 921284205 DAYPBLLIAFWIAZ-FQEVSTJZSA-N 454.910 5.288 5 20 JKBD O=C(Nc1cccc(Oc2ccc([N+](=O)[O-])cc2)c1)N1CCc2c(ncn2-c2ccccc2)C1 929080014 VOBXNNFMPPDFSI-UHFFFAOYSA-N 455.474 5.163 5 20 JKBD Cc1cccc(/C=C/C(=O)Nc2ccc(C3(NC(=O)CCc4cccc([N+](=O)[O-])c4)CCC3)cc2)n1 1785822773 LVACRFAXFSGSSO-JQIJEIRASA-N 484.556 5.078 5 20 JKBD O=C(CSc1ccccc1[N+](=O)[O-])Nc1ccc(C2(NC(=O)c3ccc(Cl)nc3)CCC2)cc1 1791521607 CZLHNDRAZGEUAT-UHFFFAOYSA-N 496.976 5.183 5 20 JKBD CC(C)[C@H]1CC[C@H](C(=O)N2CCCC[C@H]2c2cc(NC(=O)/C=C/c3ccc([N+](=O)[O-])o3)n[nH]2)CC1 1814970218 WVMQQOKEKJYZHB-LHDMFZGTSA-N 483.569 5.079 5 20 JKBD C[C@@H]1CCC[C@H]1C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)[nH]n1 1818960247 RSHPEONQMVDFBA-BJZITVGISA-N 481.578 5.275 5 20 JKBD Cc1ncc(C(=O)N2CCCC[C@H]2C2CCN(C(=O)c3cc4cc([N+](=O)[O-])ccc4s3)CC2)s1 1827967600 HZSVXIGYGCAFPR-IBGZPJMESA-N 498.630 5.122 5 20 JKBD O=C(c1ccc([N+](=O)[O-])cc1F)N1CCC([C@@H]2CCCCN2C(=O)c2ccc3occc3c2)CC1 1828258386 NWCNXODRPQSIHN-QHCPKHFHSA-N 479.508 5.027 5 20 JKBD Cc1cccc2[nH]c(C(=O)N3CCCC[C@H]3C3CCN(C(=O)c4cc(F)cc([N+](=O)[O-])c4)CC3)cc12 1828578113 ZIGXFHWHGLVUPD-VWLOTQADSA-N 492.551 5.071 5 20 JKBD Cc1cccc(C)c1C(=O)N1CCCC[C@H]1C1CCN(C(=O)CSc2ccccc2[N+](=O)[O-])CC1 1830641804 OZHXBAJYRXYWTE-QFIPXVFZSA-N 495.645 5.237 5 20 JKBD O=C(c1ccc2ccoc2c1)N1CCC([C@@H]2CCCCN2C(=O)/C=C/c2ccccc2[N+](=O)[O-])CC1 1832904198 OUFGTQJHMPIBGL-LTDXDOBXSA-N 487.556 5.288 5 20 JKBD Cc1cccc(C(C)C)c1NC(=O)[C@@H](C)OC(=O)Cn1c2ccccc2c(=O)c2ccccc21 10722833 PUPUBCOHEOEOKA-LJQANCHMSA-N 456.542 5.157 5 20 JKBD CC(=O)N(c1cccc(C(F)(F)F)c1)c1nc(COC(=O)/C=C/c2ccc([N+](=O)[O-])cc2)cs1 10757006 SJVAJCTZWHBIHR-JXMROGBWSA-N 491.447 5.511 5 20 JKBD O=C(COC(=O)c1ccc([N+](=O)[O-])cc1Cl)Nc1c(Cl)c(Cl)cc(Cl)c1Cl 11028667 ONEBRDLVWSACKH-UHFFFAOYSA-N 472.495 5.657 5 20 JKBD Cc1ccc(NC(=O)[C@@H](Sc2nncn2CCc2cccs2)c2ccccc2)c([N+](=O)[O-])c1 11105588 QGTONNVTWATCLR-NRFANRHFSA-N 479.587 5.271 5 20 JKBD COc1ccc([N+](=O)[O-])cc1NC(=O)[C@@H](C)Sc1nnc(-c2ccc(C(C)(C)C)cc2)o1 22249656 XZPHJNCLTPMQFI-CYBMUJFWSA-N 456.524 5.070 5 20 JKBD COc1cccc([C@H](CNc2ccc(C(C)=O)cc2[N+](=O)[O-])c2c[nH]c3ccccc23)c1OC 23381118 VNMMJUFVOOPTOI-NRFANRHFSA-N 459.502 5.540 5 20 JKBD O=C(CSc1nnc(-c2ccc(Cl)cc2)n1Cc1ccccc1)Nc1cc([N+](=O)[O-])ccc1F 28609069 UHDMFTLDLVEMJA-UHFFFAOYSA-N 497.939 5.425 5 20 JKBD CN(CCCCCc1cc(-c2ccc(F)cc2)n[nH]1)C(=O)c1ccc(N2CCCC2)c([N+](=O)[O-])c1 59584222 VUECBWHYCOYWDO-UHFFFAOYSA-N 479.556 5.209 5 20 JKBD C[C@@H](Cc1cccc(Br)c1)NC(=O)c1ccc(N[C@@H](C)c2ccccn2)c([N+](=O)[O-])c1 195676478 AXBLXNBQJLVYFX-HOTGVXAUSA-N 483.366 5.286 5 20 JKBD Cc1noc(CSc2ccccc2C(=O)Nc2nc(-c3cccc([N+](=O)[O-])c3)c(C)s2)n1 195704170 FBRVTWOAQKHYKA-UHFFFAOYSA-N 467.532 5.263 5 20 JKBD C[C@H]1CCCCN1Cc1ccc(CNC(=O)c2ccc(N[C@H](C)c3ccccn3)c([N+](=O)[O-])c2)cc1 302979505 JJIDPSDTTMVSQL-LEWJYISDSA-N 487.604 5.467 5 20 JKBD CC[C@H](C)[C@H](NC(=O)c1ccc(N[C@@H](C)c2ccccn2)c([N+](=O)[O-])c1)c1nc2ccccc2[nH]1 410078166 QGLDFKXGBHXJAG-UAVUOLJFSA-N 472.549 5.556 5 20 JKBD Cn1cc(C(=O)Nc2ccc(OCc3cccc(F)c3)c(F)c2)c(-c2ccc([N+](=O)[O-])cc2)n1 484001982 CXUAMPDBJIIYLY-UHFFFAOYSA-N 464.428 5.105 5 20 JKBD CC[C@@H](C)Sc1ccc(NC(=O)c2ccc(N[C@@H](C)c3ccccn3)c([N+](=O)[O-])c2)c(C)c1 498446349 SQUMFIDFEUNVPJ-MSOLQXFVSA-N 464.591 6.614 5 20 JKBD O=C(Nc1ccccn1)c1cccc(NC(=O)c2cc([N+](=O)[O-])ccc2Sc2ccccc2)c1 505829658 GYJFOOPVYGSVIF-UHFFFAOYSA-N 470.510 5.646 5 20 JKBD CN(C[C@H]1OCCc2ccccc21)C(=O)C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1 506266994 ADZFEYCNWPFKOT-RNEGFDSTSA-N 499.592 5.908 5 20 JKBD Cc1ccc(C(=O)Nc2cccc(CNC(=O)N(Cc3ccc([N+](=O)[O-])cc3)C(C)C)c2)cc1 509751099 OXAFHLWRYVSHTD-UHFFFAOYSA-N 460.534 5.276 5 20 JKBD COc1cc(C(=O)N2CCC[C@@H]2c2nc3ccccc3s2)c([N+](=O)[O-])cc1OCc1cscn1 512600111 PFUGWIJYWOIPFQ-QGZVFWFLSA-N 496.570 5.226 5 20 JKBD COc1ccc(C(=O)c2c(NC(=O)c3cc(OC)ccc3[N+](=O)[O-])sc3c2CCCC3)cc1 512846457 PDNGYTSWXMMYHV-UHFFFAOYSA-N 466.515 5.036 5 20 JKBD O=C(C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)NCc1ccc(F)c(F)c1 514396080 LIZUDVBDQHQMEW-GZTJUZNOSA-N 465.481 5.730 5 20 JKBD C[C@H](N[C@@H](CCc1ccccc1)c1ccccc1)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 515431931 RHROHHHKSVXUQT-JTSKRJEESA-N 471.479 5.904 5 20 JKBD C[C@@H](Nc1ccc(C(=O)N2CCC[C@@H](c3nc4ccccc4s3)C2)cc1[N+](=O)[O-])c1ccccn1 518421823 XMTPNLWMLHIVTF-IEBWSBKVSA-N 487.585 5.792 5 20 JKBD C[C@@H]1CN(c2ccc(N[C@H](C(=O)Nc3ccc([N+](=O)[O-])cc3Cl)c3ccccc3)cn2)C[C@@H](C)O1 559912728 DPHMVTHAPYQSOZ-OJLQRUNKSA-N 495.967 5.049 5 20 JKBD O=C(Nc1nnc(SCc2ccc(Cl)cc2)s1)c1ccc(N2CCCC2)c([N+](=O)[O-])c1 600855421 CDOURHGTCXUKPS-UHFFFAOYSA-N 475.983 5.245 5 20 JKBD O=C(Nc1ncc(Cc2cc(F)cc(F)c2)s1)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-] 603737952 HPKZMSYLEAVRGM-UHFFFAOYSA-N 473.379 5.114 5 20 JKBD Cc1cc(C(=O)N2CCC[C@H]2C(=O)Nc2nc(-c3cc4ccccc4o3)cs2)ccc1[N+](=O)[O-] 608802930 MFOAQCAMASUPJO-IBGZPJMESA-N 476.514 5.016 5 20 JKBD COc1ccc(CC(=O)Nc2cc(C(=O)Nc3cccc(C(F)(F)F)c3)ccc2C)cc1[N+](=O)[O-] 609012412 WEUFYTATRCFUJX-UHFFFAOYSA-N 487.434 5.364 5 20 JKBD O=C(c1c2c(nc3ccccc13)/C(=C\c1cccc([N+](=O)[O-])c1)CCC2)N1CCC[C@@H](n2ccnc2)C1 609131130 ICDZXWZNHYBJOT-LHBRDVBXSA-N 493.567 5.694 5 20 JKBD O=C(c1ccccc1Sc1ccc(C(F)(F)F)cc1[N+](=O)[O-])N1CCC[C@@H](n2ccnc2)C1 609131527 RKYQPKWCPRYKIC-MRXNPFEDSA-N 476.480 5.439 5 20 JKBD O=C(O[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Br)c1ccccc1)c1cccc(F)c1F 726679894 CDNACMKECVZCDA-IBGZPJMESA-N 491.244 5.172 5 20 JKBD COc1ccc2cc([C@H](C)C(=O)N(Cc3nnc(-c4cccc([N+](=O)[O-])c4)o3)C(C)C)ccc2c1 728083578 FQMVRROLZOFXJW-KRWDZBQOSA-N 474.517 5.347 5 20 JKBD C[C@@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)N(CC1CC1)c1ccc(Cl)c([N+](=O)[O-])c1 728167264 WCCSCTFQAWWQJU-LLVKDONJSA-N 454.266 5.020 5 20 JKBD Cc1ccc(NC(=O)c2ccccc2NC(=O)c2ccc([N+](=O)[O-])cc2Cl)cc1C(=O)NC(C)C 731202989 XVZIJUNQKNYIOZ-UHFFFAOYSA-N 494.935 5.199 5 20 JKBD Cc1ccc[n+](/C(C(=S)Nc2cccc(Br)c2)=C(/O)c2ccc(C)c([N+](=O)[O-])c2)c1 747876172 BARXEVZCTTUMSB-UHFFFAOYSA-O 485.383 5.585 5 20 JKBD CC(C)(C)OC(=O)N1CCC[C@@H]1[C@H]1CCCN(C(=O)c2cc3ccccc3c3cccnc23)C1 749648326 NUIMNSAHGZSMCN-GBXCKJPGSA-N 459.590 5.640 5 20 JKBD CC(=O)N1CCc2c(sc3nc(-c4cc([N+](=O)[O-])ccc4F)cc(-c4ccc(C)cc4)c23)C1 753916817 DACYDHRNWYOLBD-UHFFFAOYSA-N 461.518 5.891 5 20 JKBD COc1cc(COC(=O)c2ccc(C3SCCCS3)cc2)c([N+](=O)[O-])cc1OC(F)F 791426341 UVHATWWARSANBB-UHFFFAOYSA-N 471.503 5.431 5 20 JKBD Cc1nc2ccccc2cc1C(=O)Oc1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2Cl)cc1 809742720 HGDIUNDBRLATKK-UHFFFAOYSA-N 461.861 5.576 5 20 JKBD CC(C)C(=O)Nc1ccc(C(=O)Oc2ccc(NC(=O)c3cc([N+](=O)[O-])ccc3Cl)cc2)cc1 914712157 VTGMMGKKJYLWTJ-UHFFFAOYSA-N 481.892 5.314 5 20 JKBD O=C1/C(=C\c2ccccc2)N=C(SCc2cc(F)ccc2[N+](=O)[O-])N1c1ccc(F)cc1 915792197 WQBFHSCYLNIBSJ-UDWIEESQSA-N 451.454 5.550 5 20 JKBD COc1ccc(N2C(=S)N[C@H](c3ccc([N+](=O)[O-])cc3)C(C(=O)Nc3ccc(F)cc3)=C2C)cc1 916168328 LPAATQQDKLHWBF-HSZRJFAPSA-N 492.532 5.091 5 20 JKBD COc1ccc(N2C(=S)N[C@@H](c3ccc([N+](=O)[O-])cc3)C(C(=O)Nc3cccc(F)c3)=C2C)cc1 917378128 HUUSZYQDUQFMCS-QHCPKHFHSA-N 492.532 5.091 5 20 JKBD COc1ccccc1-c1nc(COC(=O)c2ccc(N[C@H](C)c3ccccn3)c([N+](=O)[O-])c2)cs1 920549234 WWPJRZPHSHKUQD-MRXNPFEDSA-N 490.541 5.652 5 20 JKBD COc1ccc(-c2nc(Sc3cc(Cl)c(C(F)(F)F)cc3[N+](=O)[O-])n[nH]2)c(OC)c1 921058321 CRHKJVYXGQJFIM-UHFFFAOYSA-N 460.821 5.221 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)c3cc4cc([N+](=O)[O-])ccc4s3)CCC2)cc1)c1cncc(F)c1 1787474229 VKLYLVHAVVJSGC-UHFFFAOYSA-N 490.516 5.405 5 20 JKBD COc1ccnc(C(=O)NC2(c3ccc(NC(=O)c4cc(Cl)cc([N+](=O)[O-])c4C)cc3)CCC2)c1 1790774913 VDOLIICDWONSAO-UHFFFAOYSA-N 494.935 5.022 5 20 JKBD CC(C)(C)CCCCCC(=O)NC[C@@H]1CCN(C(=O)c2cccc(F)c2[N+](=O)[O-])[C@@H]1c1cccnc1 1812809550 STVHYNCJQMVLPY-GBXCKJPGSA-N 498.599 5.445 5 20 JKBD CC(C)(C)CCCCCC(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2ccc([N+](=O)[O-])o2)n[nH]1 1814311228 BKZRLSFCGJHXQE-QGZVFWFLSA-N 459.547 5.213 5 20 JKBD C[C@@H](C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2ccc([N+](=O)[O-])cc2F)[nH]n1)c1ccc(Cl)cc1 1814660669 MZWXRAXVKPAUHI-SPLOXXLWSA-N 499.930 5.220 5 20 JKBD C[C@H](C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cccc(F)c2[N+](=O)[O-])n[nH]1)c1ccc(Cl)cc1 1821167093 CUTBVOJGJKLCMZ-VBKZILBWSA-N 499.930 5.220 5 20 JKBD CC1(C)CCC(CC(=O)N2CCC([C@H]3CCCCN3C(=O)Cc3cccc([N+](=O)[O-])c3)CC2)CC1 1823680143 TXIRLBONUNIICO-RUZDIDTESA-N 483.653 5.364 5 20 JKBD Cc1cc(Cl)ccc1C(=O)N1CCC([C@H]2CCCCN2C(=O)c2ccc([N+](=O)[O-])cc2F)CC1 1830493555 WNXFKQXPDHXBQP-HSZRJFAPSA-N 487.959 5.243 5 20 JKBD CC[C@H](C)CC(=O)N1CCC([C@H]2CCCCN2C(=O)c2cc(Cl)cc([N+](=O)[O-])c2C)CC1 1830734809 RWWRURWLZQDKMD-HRAATJIYSA-N 464.006 5.226 5 20 JKBD O=C(/C=C/c1ccoc1)N1CCC([C@@H]2CCCCN2C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)CC1 1831060011 MSIWNZITRVQMRA-SNXGKTBFSA-N 493.585 5.349 5 20 JKBD O=C(c1ccccc1C1CC1)N1CCC([C@H]2CCCCN2C(=O)Cc2ccc([N+](=O)[O-])cc2F)CC1 1831292803 GZNKXJKKHSVOAF-AREMUKBSSA-N 493.579 5.087 5 20 JKBD CCCCC[C@@H](C)C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cc(N(C)C)ccc2[N+](=O)[O-])CC1 1831467155 VFINIJFWKIBEPD-YKSBVNFPSA-N 486.657 5.111 5 20 JKBD COc1ccc(C)cc1NC(=O)[C@@H](OC(=O)c1ccc(SC)c([N+](=O)[O-])c1)c1ccccc1 9620554 GXQKLISGAPUASN-QFIPXVFZSA-N 466.515 5.171 5 20 JKBD C[C@@H](OC(=O)c1c(Cl)cccc1Cl)C(=O)Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1 11030126 OUHGNZLACBSINH-SNVBAGLBSA-N 466.302 5.209 5 20 JKBD Cc1ccc(-c2ccsc2C(=O)Nc2ncc(S(=O)(=O)c3ccc([N+](=O)[O-])cc3)s2)cc1 17369468 LWBOJXVIEYSRMA-UHFFFAOYSA-N 485.568 5.173 5 20 JKBD C[C@H](OC(=O)c1ccc(-c2ccccc2)cc1)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 20989066 CNEFPOJUIVACKG-AWEZNQCLSA-N 458.392 5.465 5 20 JKBD COc1ccc2nc(C(=O)Oc3ccc(NC(=O)c4cc([N+](=O)[O-])ccc4Cl)cc3)ccc2c1 26076305 HFIQGNDCDRLUFY-UHFFFAOYSA-N 477.860 5.277 5 20 JKBD C[C@@H](Nc1ccc(C(=O)Nc2cccc(I)c2)cc1[N+](=O)[O-])c1ccccn1 108754642 KAIJHRPFMPUPBJ-CYBMUJFWSA-N 488.285 5.020 5 20 JKBD C[C@H](Nc1ccc(C(=O)Nc2ccc(C(=O)N3CCCCCC3)cc2)cc1[N+](=O)[O-])c1ccccn1 108884794 PNTAXNPBANFYMT-IBGZPJMESA-N 487.560 5.431 5 20 JKBD C[C@H]1CN(CC2CCN(C(=O)c3ccc(Oc4ccc(Cl)cc4[N+](=O)[O-])cc3)CC2)C[C@H](C)O1 110460091 XZLQLXILWIYAJQ-ROUUACIJSA-N 487.984 5.002 5 20 JKBD Cc1nn(-c2ccccc2)c(C)c1CNCc1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1 215866706 QGWOMDOBFWMWST-UHFFFAOYSA-N 478.556 5.540 5 20 JKBD O=C(Nc1ccccc1-c1ccccc1)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 247356801 YAWPCMHCAMTJNQ-UHFFFAOYSA-N 469.463 6.136 5 20 JKBD Cc1cc(NC(=O)c2ccc(N[C@H](C)c3ccccn3)c([N+](=O)[O-])c2)ccc1NC(=O)c1ccco1 409843694 JAOZPUUOFHCWPM-QGZVFWFLSA-N 485.500 5.569 5 20 JKBD O=C(N[C@H]1CCN2CCCC[C@H]12)c1ccccc1Sc1ccc(C(F)(F)F)cc1[N+](=O)[O-] 481415607 PAPBQUMPMOMLNJ-DLBZAZTESA-N 465.497 5.121 5 20 JKBD COc1ccc(Oc2ccc([N+](=O)[O-])cc2C(=O)N2CCC[C@H](CN3CCCCCC3)C2)cc1 487944245 JZJLPKMWAJJWOX-HXUWFJFHSA-N 467.566 5.124 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)Nc2ccc(NCc3ccccc3)c(Cl)c2)cc1SC 490037578 WFWRTZFNKGBIJT-UHFFFAOYSA-N 457.939 5.843 5 20 JKBD C[C@@H]1C[C@@H](C)CN(c2ccc(C(=O)N[C@H](c3ccccc3)c3nccs3)cc2[N+](=O)[O-])C1 505052918 AAGLBHAKCGGFKP-DRSNIGMVSA-N 450.564 5.053 5 20 JKBD CN1CCC(CN(C)C(=O)c2ccccc2Sc2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 505773282 YPMBJHKQCYNGAE-UHFFFAOYSA-N 467.513 5.179 5 20 JKBD CC(=O)N(c1ccc(C(F)(F)F)cc1)c1nc(COc2ccc([N+](=O)[O-])cc2Cl)cs1 505867983 JQUIGVFIUKBEOI-UHFFFAOYSA-N 471.844 5.987 5 20 JKBD Cc1nn(-c2ccccc2)c(C)c1NC(=O)c1ccc(N[C@@H](C)c2ccccn2)c([N+](=O)[O-])c1 506084548 BCKAMFCDKSPAQQ-INIZCTEOSA-N 456.506 5.218 5 20 JKBD C[C@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccc(N(C)C(=O)c2ccc(Cl)cc2)cc1 511603986 DEIYGKBHHLYSFM-HNNXBMFYSA-N 469.950 5.644 5 20 JKBD O=c1c(Cl)c(Oc2ccc(-c3ccccc3)cc2[N+](=O)[O-])cnn1-c1ccc(C(F)(F)F)cn1 513188237 BHYXCNCMPVJFDF-UHFFFAOYSA-N 488.809 5.667 5 20 JKBD CSc1ccc([N+](=O)[O-])c(C(=O)Nc2ccc(NC(=O)Nc3ccc(Cl)cc3)cc2)c1 517933524 ICMSFYSGZXETFI-UHFFFAOYSA-N 456.911 5.866 5 20 JKBD C[C@H](NCc1ccc(Oc2ccc(F)cc2)c([N+](=O)[O-])c1)c1cc(F)ccc1N1CCN(C)CC1 518275124 CSCPVMJDINWSKY-SFHVURJKSA-N 482.531 5.268 5 20 JKBD CC(C)(C)c1ccc(Oc2ccc(CNCc3cccc(CN4CCCC4=O)c3)cc2[N+](=O)[O-])cc1 518796349 CBHXLDURUXLWOX-UHFFFAOYSA-N 487.600 6.097 5 20 JKBD Cc1c(NC(=O)c2ccccc2)cccc1NC(=O)[C@@H](C)Oc1ccc(Cl)cc1[N+](=O)[O-] 521250928 VMESLUGCNAUYJK-OAHLLOKOSA-N 453.882 5.215 5 20 JKBD COc1ccc(CC[C@H]2CCCCN2C(=O)[C@H](C)Sc2ccc([N+](=O)[O-])cc2)cc1OC 522368764 DEMUVMXBSWXGCR-PKOBYXMFSA-N 458.580 5.107 5 20 JKBD CO[C@@H](C)c1cccc(NC(=O)c2ccc(C(=O)Nc3cccc([C@@H](C)OC)c3)c([N+](=O)[O-])c2)c1 524357905 VXECLCJVVADZEM-DLBZAZTESA-N 477.517 5.514 5 20 JKBD Cc1noc(CSc2ccc(C(=O)Nc3nc(-c4ccc(C)c([N+](=O)[O-])c4)cs3)cc2)n1 591888430 GXWFERPXLMRGPL-UHFFFAOYSA-N 467.532 5.263 5 20 JKBD O=C(C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)N1CCC[C@@H]1c1ccc(F)cc1 592950233 QZKQKOGPDIURPY-ZOSFRFIDSA-N 487.556 6.638 5 20 JKBD C[C@@H](Sc1n[nH]c(/C=C\c2ccccc2)n1)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 598953751 XNERDVTVJONLLB-MQGYJPLLSA-N 463.441 5.021 5 20 JKBD C[C@@H](NC(=O)c1cc2cc([N+](=O)[O-])ccc2o1)c1cccc(NC(=O)Cc2ccccc2F)c1 603765036 UDERGGWYKCHIPA-OAHLLOKOSA-N 461.449 5.152 5 20 JKBD COCCN(C(=O)c1cnc(Cc2ccc(F)cc2)s1)c1nc(-c2ccc([N+](=O)[O-])cc2)cs1 608895743 OVBHKVXVJGSSSZ-UHFFFAOYSA-N 498.561 5.198 5 20 JKBD CCN1CCC(n2nccc2NC(=O)c2ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])c(OC)c2)CC1 609355371 FYQBPWYJMMULTA-UHFFFAOYSA-N 499.955 5.155 5 20 JKBD C[C@H](NC(=S)/C(=C(/O)c1ccc([N+](=O)[O-])cc1)[n+]1cccc(O)c1)c1ccc(Cl)cc1Cl 726570666 QIXWGGRURPWNTR-ZDUSSCGKSA-O 491.376 5.457 5 20 JKBD C[C@@H](Nc1nc2ccc([N+](=O)[O-])cc2s1)c1cccc(NC(=O)Cc2ccccc2F)c1 731206303 FYFGCRMWRMREDK-CQSZACIVSA-N 450.495 5.698 5 20 JKBD O=C(COC(=O)c1csc(-c2cccc([N+](=O)[O-])c2)n1)Nc1ccccc1Cc1ccccc1 747960991 BMLXLEJYPRCMFQ-UHFFFAOYSA-N 473.510 5.105 5 20 JKBD C[C@H](OC(=O)c1csc(-c2cccc([N+](=O)[O-])c2)n1)C(=O)Nc1nc(-c2ccccc2)cs1 747961614 GIQOBQGZWBXEGM-ZDUSSCGKSA-N 480.527 5.026 5 20 JKBD Cc1ccc(-c2nnc3n2CCCCC3)cc1NC(=O)c1cc([N+](=O)[O-])ccc1N1CCC(C)CC1 900242929 HBADSUXISDGMMV-UHFFFAOYSA-N 488.592 5.377 5 20 JKBD O=[N+]([O-])c1ccc(C(F)(F)F)c(-c2nc(-c3ccc(-n4cnc5ccccc54)nc3)no2)c1 904490194 ZVNPFTDJSOXRPF-UHFFFAOYSA-N 452.352 5.065 5 20 JKBD CN(Cc1ccccc1[N+](=O)[O-])C(=O)C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1 914729218 YXBPETDCHRICIB-XMHGGMMESA-N 488.525 5.702 5 20 JKBD Cc1sc2nc([C@H](C)OC(=O)c3cc([N+](=O)[O-])ccc3Oc3ccccc3)nc(O)c2c1C 919191111 CCCRDGHHLZMXSQ-ZDUSSCGKSA-N 465.487 5.632 5 20 JKBD O=C(CCNC(=O)c1cc(F)ccc1Br)OCc1nc2ccccc2c2ccccc12 919445995 SSZPNFQFYDONTI-UHFFFAOYSA-N 481.321 5.153 5 20 JKBD CCN(CC)C(=O)c1ccccc1NC(=O)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1 919876699 HQZZEAVFDPFENA-UHFFFAOYSA-N 467.909 5.775 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)NC1(c2ccc(NC(=O)c3coc(C(C)C)n3)cc2)CCC1 1787028319 ZEVBHRVUYSOQJY-UHFFFAOYSA-N 480.496 5.215 5 20 JKBD Cc1ccc(O)c(C(=O)Nc2ccc(C3(NC(=O)CSc4ccccc4[N+](=O)[O-])CCC3)cc2)c1 1790248907 DPCUBHYSTFEWNQ-UHFFFAOYSA-N 491.569 5.149 5 20 JKBD O=C(/C=C/C1CC1)NC1(c2ccc(NC(=O)c3cccc([N+](=O)[O-])c3Br)cc2)CCC1 1790636943 ZUPCXGFATYBIIS-KPKJPENVSA-N 484.350 5.071 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)[C@@H](F)c3ccccc3)CCC2)cc1)c1cc(F)cc([N+](=O)[O-])c1 1790695217 HSXPUXDIIKVGEQ-QFIPXVFZSA-N 465.456 5.192 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)c3cc4[nH]ccc4s3)CCC2)cc1)c1cc(F)cc([N+](=O)[O-])c1 1790696656 TZQWLKRMPMICHG-UHFFFAOYSA-N 478.505 5.338 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)c3ccc4ccoc4c3)CCC2)cc1)c1cc(O)cc([N+](=O)[O-])c1 1790756523 KFNNYIIQHLTWRV-UHFFFAOYSA-N 471.469 5.108 5 20 JKBD C[C@@H](C(=O)NC1(c2ccc(NC(=O)CSc3ccccc3[N+](=O)[O-])cc2)CCC1)c1ccccn1 1791523285 OMMJYYNUMUHUSB-GOSISDBHSA-N 490.585 5.020 5 20 JKBD Cc1c(C(=O)NC2(c3ccc(NC(=O)CC[C@@H]4CCOC4)cc3)CCC2)cc(Cl)cc1[N+](=O)[O-] 1792026286 VXCWTUUNTSKGRH-QGZVFWFLSA-N 485.968 5.121 5 20 JKBD COc1cc(C(=O)Nc2ccc(C3(NC(=O)CCc4cccs4)CCC3)cc2)ccc1[N+](=O)[O-] 1792163993 NWDAYISBLIWQEX-UHFFFAOYSA-N 479.558 5.045 5 20 JKBD Cc1ccncc1CCC(=O)NC1(c2ccc(NC(=O)/C=C/c3ccccc3[N+](=O)[O-])cc2)CCC1 1792315436 OIOOXFSLZMBBAF-NTUHNPAUSA-N 484.556 5.078 5 20 JKBD O=C(Nc1cc([C@H]2CCCCN2C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)[nH]n1)[C@H]1CC=CCC1 1820831040 ZQYXLEQOHXUEPN-HNAYVOBHSA-N 479.562 5.195 5 20 JKBD Cc1ccc(C(=O)N2CCCC[C@H]2c2cc(NC(=O)c3cc4cc([N+](=O)[O-])ccc4s3)n[nH]2)o1 1821611007 LHWOXKOGQORHLO-KRWDZBQOSA-N 479.518 5.054 5 20 JKBD CN(C)c1ccc([N+](=O)[O-])cc1C(=O)N1CCC([C@@H]2CCCCN2C(=O)/C=C/C2CCCCC2)CC1 1830355508 IYPMGAVAYYDCHO-MYILAFDMSA-N 496.652 5.031 5 20 JKBD Cc1ccc(NC(=O)[C@@H](Sc2nnc(-c3ccccc3Cl)n2C)c2ccccc2)c([N+](=O)[O-])c1 9809164 PMDXIZOVXKPRAM-NRFANRHFSA-N 493.976 5.824 5 20 JKBD O=C(Nc1ccccc1)C1CCN(C(=O)c2ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])cc2)CC1 15182406 GRPBVZIAMYDTTK-UHFFFAOYSA-N 479.920 5.531 5 20 JKBD C[C@H](OC(=O)CCCc1ccc(Br)s1)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 16584149 VUEOAODLQQPSCO-NSHDSACASA-N 466.313 5.096 5 20 JKBD Cn1cnnc1Sc1ccc(C(=O)OCc2sc3ccccc3c2Cl)cc1[N+](=O)[O-] 21837709 BFKGGZIHYHCMIX-UHFFFAOYSA-N 460.924 5.100 5 20 JKBD CCn1c(SCC(=O)Nc2ccc(Cl)cc2Cl)nc2cc3ccccc3cc2c1=O 22177856 PLOJFJUCQRKXJX-UHFFFAOYSA-N 458.370 5.607 5 20 JKBD COc1cc(CN(C)C(=O)[C@H](C)Sc2ccc([N+](=O)[O-])cc2)ccc1OCc1ccccc1 25280982 WQUFIEQOTNPYSL-SFHVURJKSA-N 466.559 5.322 5 20 JKBD Cc1ccc(-c2nnc3n2CCCCC3)cc1NC(=O)c1ccc(N2CCC[C@H](C)C2)c([N+](=O)[O-])c1 25847788 TUCHQSSOMBHQSH-SFHVURJKSA-N 488.592 5.377 5 20 JKBD COc1ccc(C)cc1CN[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Br)c1ccccc1 28374561 INHJMPLAPOKSHW-QFIPXVFZSA-N 484.350 5.144 5 20 JKBD Cc1cccc(Nc2nnc(SCC(=O)Nc3ccc([N+](=O)[O-])cc3C(F)(F)F)s2)c1 28811188 YIIATGPKBGGJEC-UHFFFAOYSA-N 469.470 5.248 5 20 JKBD COc1cc2c(cc1OC)[C@@H](c1ccccc1)N(C(=O)[C@H](C)Sc1ccc([N+](=O)[O-])cc1)CC2 32891787 ZDGFTFCLWDFPEP-SSOJOUAXSA-N 478.570 5.267 5 20 JKBD C[C@H](NC(=O)c1ccc(N[C@@H](C)c2ccccn2)c([N+](=O)[O-])c1)c1cccc(OC(F)F)c1 108832723 PDFKOPHJFYRBGA-GJZGRUSLSA-N 456.449 5.255 5 20 JKBD O=C(Nc1cccc(F)c1)c1cccc(NC(=O)c2csc(-c3cccc([N+](=O)[O-])c3)n2)c1 215725939 OTGBKFWGFXGGJU-UHFFFAOYSA-N 462.462 5.362 5 20 JKBD O=C(Cc1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1)N1CC=C(c2ccc(O)cc2)CC1 216853432 AHOCYLQCGJRZAU-UHFFFAOYSA-N 480.524 5.012 5 20 JKBD CC(C)CC(=O)Nc1ccc(NC(=O)CCNc2ccc(C(F)(F)F)cc2[N+](=O)[O-])cc1 477010194 KVQLFWHJPCMQFA-UHFFFAOYSA-N 452.433 5.039 5 20 JKBD O=C(C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)N[C@H]1CCCc2occc21 493325725 YZPZHUCPNSGKBJ-QMEWPPBRSA-N 459.527 5.922 5 20 JKBD Cc1csc(Sc2ccc(C(=O)Nc3ccc(C(=O)N4CCCC4)cc3C)cc2[N+](=O)[O-])n1 498435466 LUZSMIDWRGQTPL-UHFFFAOYSA-N 482.587 5.308 5 20 JKBD O=C(C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1)N1CCC[C@H]1c1cccc(Cl)c1 502989744 IJBXVHWAKFLTRY-IBGZPJMESA-N 481.902 5.847 5 20 JKBD C[C@@H](Nc1ccc(C(=O)Nc2ccc(NC3CCOCC3)cc2)cc1[N+](=O)[O-])c1ccccn1 513054327 LGPHRLCIHABTFD-QGZVFWFLSA-N 461.522 5.006 5 20 JKBD C[C@H](NC(=O)c1cc([N+](=O)[O-])ccc1Sc1ccccc1)c1cccc(N2CCCC2=O)c1 520502977 FMYIRTRLSAZLBW-KRWDZBQOSA-N 461.543 5.364 5 20 JKBD Cc1ccccc1-n1ncc(C(=O)Nc2nc(-c3cccc([N+](=O)[O-])c3)cs2)c1C(F)(F)F 603564502 LCWBGVHXYGPSQA-UHFFFAOYSA-N 473.436 5.484 5 20 JKBD CC(C)CCSc1ccc(C(=O)N2CCC(C(=O)NCc3ccc(F)cc3)CC2)cc1[N+](=O)[O-] 603930155 ITOKMCXPZWAPEG-UHFFFAOYSA-N 487.597 5.041 5 20 JKBD CSc1ccc([N+](=O)[O-])c(C(=O)N(Cc2cccnc2)c2ccc(Br)cc2)c1 603990096 IIVPEVSWUAIDTQ-UHFFFAOYSA-N 458.337 5.321 5 20 JKBD COc1cc(C(=O)N(Cc2ccccn2)c2ccc(Cl)cc2)c([N+](=O)[O-])cc1OC(F)F 603998515 XJTXJWVODYXBIM-UHFFFAOYSA-N 463.824 5.100 5 20 JKBD C[C@@H](Sc1cc2c(cc1Cl)OCCO2)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 608930451 WZPZTEGOKJKYSD-SECBINFHSA-N 462.833 5.158 5 20 JKBD C[C@H]1CSc2ccc(Br)cc2[C@H]1NC(=O)CSc1ccc([N+](=O)[O-])cc1 609192308 NISIGPXRSNIEOK-VOJFVSQTSA-N 453.383 5.049 5 20 JKBD O=C(Cc1c[nH]c2cc(F)ccc12)O[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1 725947862 ITQMJJNJRDLGQR-HSZRJFAPSA-N 481.867 5.334 5 20 JKBD CCn1cc(NC(=S)/C(=C(/O)c2cccc([N+](=O)[O-])c2)[n+]2ccc(Cc3ccccc3)cc2)cn1 726179953 RYPCAJPVQHVUCM-UHFFFAOYSA-O 486.577 5.013 5 20 JKBD C[C@@H](Nc1ccc(C(=O)O[C@H](c2ccccc2)c2cccnc2)cc1[N+](=O)[O-])c1ccccn1 728419539 UUUQCVVNEZOIHR-IQGLISFBSA-N 454.486 5.504 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)O[C@H](C)C(=O)Nc2ccc(Cl)cc2C(F)(F)F)cc1SC 728657264 PDHJLFBPHQKCOU-SECBINFHSA-N 492.859 5.182 5 20 JKBD COc1ccc(-c2ccc(C(=O)Nc3cc([N+](=O)[O-])ccc3OC(F)F)c(F)c2)c(F)c1 730476722 CFIFYTLMRJJGLQ-UHFFFAOYSA-N 450.344 5.402 5 20 JKBD C[C@H](OC(=O)c1ccc(CSc2ccccc2)cc1)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 746137820 QTPJWMBMOKRJIP-INIZCTEOSA-N 461.499 5.855 5 20 JKBD Cc1c(C(=O)NC[C@H](c2ccccc2)c2c[nH]c3ccccc23)cc([N+](=O)[O-])c(C)c1[N+](=O)[O-] 748605648 AQODPTDVGNLSFX-HXUWFJFHSA-N 458.474 5.163 5 20 JKBD O=C(Nc1ccc(CC(=O)N2CCCc3ccccc32)cc1)c1ccc(Br)c([N+](=O)[O-])c1 749534327 MFTQWQHTXDMMKO-UHFFFAOYSA-N 494.345 5.132 5 20 JKBD Cc1nnc(Sc2ccc(NC(=O)c3cc([N+](=O)[O-])ccc3N3CCC(C)CC3)c(C)c2)s1 751199694 QMFAGKXLQCAPIU-UHFFFAOYSA-N 483.619 5.703 5 20 JKBD C[C@@H](Sc1ncc(-c2ccccc2)n1C[C@@H]1CCCO1)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 828604406 OXNBHJIRAXFENA-UZLBHIALSA-N 477.546 5.541 5 20 JKBD O=c1nc(/C(Cl)=C\c2ccc(-c3cccc([N+](=O)[O-])c3)o2)[nH]c2cc(C(F)(F)F)ccc12 916128132 SCFBFXQUDYKSSJ-MHWRWJLKSA-N 461.783 5.847 5 20 JKBD Cc1ccc(C)c(NC(=O)Cc2nc(COC(=O)[C@@H](C)Sc3ccc([N+](=O)[O-])cc3)cs2)c1 916523150 JSJQTZVASXOXTL-MRXNPFEDSA-N 485.587 5.073 5 20 JKBD CC(C)c1ccc(CCC(=O)O[C@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2C(F)(F)F)cc1 919394845 IFCQZZLPSUJBST-CQSZACIVSA-N 452.429 5.240 5 20 JKBD CC(C)N(Cc1ccc([N+](=O)[O-])cc1)Cn1nc([C@@H](C)N(C)C)n(-c2ccc(Cl)cc2)c1=S 919950384 IWQBRRWATAHTTF-QGZVFWFLSA-N 489.045 5.456 5 20 JKBD C=CC(=O)NCc1ccc(C(=O)Nc2cc([N+](=O)[O-])ccc2Nc2cccc(C(F)(F)F)c2)cc1 921149639 XNRPLWXCKGZWQD-UHFFFAOYSA-N 484.434 5.412 5 20 JKBD Cc1ccc(CC(=O)NC2(c3ccc(NC(=O)c4cc(C(C)C)on4)cc3)CCC2)cc1[N+](=O)[O-] 1787546623 QOSRXZQLVHVMAG-UHFFFAOYSA-N 476.533 5.005 5 20 JKBD O=C(CSc1ccccc1[N+](=O)[O-])NC1(c2ccc(NC(=O)c3ccc(F)cc3)cc2)CCC1 1790293944 FIUVSFJGSRXOLO-UHFFFAOYSA-N 479.533 5.274 5 20 JKBD CC1(C)CCC(CC(=O)N2CCCC[C@H]2c2cc(NC(=O)c3ccc([N+](=O)[O-])cc3F)n[nH]2)CC1 1821051637 CSEQYTPWVYFOQV-NRFANRHFSA-N 485.560 5.369 5 20 JKBD Cc1cc2cc(C(=O)N3CCCC[C@@H]3c3cc(NC(=O)/C=C/c4ccccc4[N+](=O)[O-])n[nH]3)ccc2[nH]1 1823503022 HVMCXAGWXHYNJJ-IYNHSRRRSA-N 498.543 5.127 5 20 JKBD Cc1c(C(=O)N2CCC([C@H]3CCCCN3C(=O)CC3CCCC3)CC2)cc(Cl)cc1[N+](=O)[O-] 1826264210 NMFFGEZIQDCFQO-JOCHJYFZSA-N 476.017 5.370 5 20 JKBD Cc1cc(C(=O)N2CCCC[C@H]2C2CCN(C(=O)c3cc4sccc4s3)CC2)ncc1[N+](=O)[O-] 1827828162 PCGYPEZPBCYUQP-SFHVURJKSA-N 498.630 5.122 5 20 JKBD C[C@H](CC(=O)N1CCC([C@@H]2CCCCN2C(=O)c2ccc([N+](=O)[O-])cc2F)CC1)c1ccccc1 1830498460 WEXPUIBGNKNGPE-CLOONOSVSA-N 481.568 5.161 5 20 JKBD COc1cc(C(=O)N2CCC([C@H]3CCCCN3C(=O)C[C@@H](C)c3ccccc3)CC2)ccc1[N+](=O)[O-] 1831510264 LDNBPGZAWXFGQR-HYBUGGRVSA-N 493.604 5.031 5 20 JKBD Cc1ccc(C(=O)N2CCCC[C@H]2C2CCN(C(=O)c3ccc([N+](=O)[O-])cc3F)CC2)c(Cl)c1 1832608255 YTKYPHCZJRUAPD-QHCPKHFHSA-N 487.959 5.243 5 20 JKBD CCOc1ccc(C(=O)O[C@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2ccccc2)cc1OC 9920970 RXABTUYOEMFMRH-QFIPXVFZSA-N 484.892 5.192 5 20 JKBD O=C(NCCNc1ccc(C(F)(F)F)cc1[N+](=O)[O-])c1ccccc1SCc1ccco1 16235387 DWHOEKGGNLQXDW-UHFFFAOYSA-N 465.453 5.341 5 20 JKBD Cc1ccc(NC(=O)[C@@H](Sc2nc3ccccc3c(=O)n2C2CC2)c2ccccc2)c([N+](=O)[O-])c1 18964481 OVJRWKQUHVSLLR-QHCPKHFHSA-N 486.553 5.420 5 20 JKBD CCn1c(SCC(=O)N[C@@H](C)c2ccc(Cl)cc2)nc2cc3ccccc3cc2c1=O 22178744 BSWOBBBNQSNNDI-HNNXBMFYSA-N 451.979 5.193 5 20 JKBD CC(C)(C)c1ccc(-c2nnc(SCC(=O)Nc3ccc([N+](=O)[O-])cc3C(F)(F)F)o2)cc1 22249559 ODQSHMOFGDEKQS-UHFFFAOYSA-N 480.468 5.692 5 20 JKBD COc1ccc(-c2[nH]c3ccccc3c2CCC(=O)OCc2cc([N+](=O)[O-])cc3c2OCOC3)cc1 27418454 FNRFITVHSFRIPZ-UHFFFAOYSA-N 488.496 5.294 5 20 JKBD CC(C)CCSc1ccc(C(=O)Nc2cccc(NC(=O)[C@@H](C)n3cccn3)c2)cc1[N+](=O)[O-] 31613255 CTOHNTFSSFUTNG-QGZVFWFLSA-N 481.578 5.382 5 20 JKBD COc1ccc([C@H]2CCCCCN2C(=O)c2ccc(N[C@H](C)c3ccccn3)c([N+](=O)[O-])c2)cc1 303037766 VMUQXJCECNATDR-KBMIEXCESA-N 474.561 5.929 5 20 JKBD O=C(Nc1cccc(F)c1)C1CCN(C(=O)c2cc([N+](=O)[O-])ccc2Oc2ccccc2)CC1 505212072 VXELTHRZCVAVIK-UHFFFAOYSA-N 463.465 5.017 5 20 JKBD CCOC(=O)CC1CCN(C(=O)c2ccccc2Sc2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 505764205 VTWNHSXKAIYICI-UHFFFAOYSA-N 496.507 5.570 5 20 JKBD CN(Cc1ccccc1[N+](=O)[O-])C(=O)Nc1cccc(NC(=O)Nc2cccc(C(F)(F)F)c2)c1 510979013 CCWMOHPNVFJAOJ-UHFFFAOYSA-N 487.438 5.922 5 20 JKBD CCCc1noc2nc(-c3ccco3)cc(C(=O)Nc3cc(OCC)c(OCC)cc3[N+](=O)[O-])c12 512854457 BGIGXPWYXMHVKS-UHFFFAOYSA-N 480.477 5.393 5 20 JKBD Cc1cc([N+](=O)[O-])ccc1NC(=O)CCSc1nnc(-c2ccccc2C)n1Cc1ccco1 514941660 MWBTYRSZCATCFY-UHFFFAOYSA-N 477.546 5.232 5 20 JKBD O=C(C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)N1CCC[C@H]1c1ccsc1 516071423 HAAKRXNMADCTLG-SLTDHEAWSA-N 475.595 6.560 5 20 JKBD CC(=O)Nc1cccc([C@@H](C)N(Cc2ccccc2)C(=O)c2ccn(-c3ccc([N+](=O)[O-])cc3)n2)c1 520021920 HTWKHJBZPRSFBN-LJQANCHMSA-N 483.528 5.143 5 20 JKBD COc1ccc([C@H](CNC(=O)[C@@H](C)Sc2ccc([N+](=O)[O-])cc2)c2c[nH]c3ccccc23)cc1 603819591 NIWKDUCRBXXPOM-HXOBKFHXSA-N 475.570 5.514 5 20 JKBD O=C(c1cc([N+](=O)[O-])ccc1Oc1ccccc1)N1CCN(C(=O)c2ccccc2C(F)(F)F)CC1 603875641 ZJECIYPBNUZIHR-UHFFFAOYSA-N 499.445 5.004 5 20 JKBD COc1cc(C(=O)N(C)Cc2ccc(Cl)cc2Cl)c([N+](=O)[O-])cc1OCc1cscn1 604349923 PTEFHSHUBHCWHX-UHFFFAOYSA-N 482.345 5.218 5 20 JKBD C[C@@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)Nc1nc(-c2ccccc2OC(F)F)cs1 609021857 SWMIVKUUTFGQDD-SNVBAGLBSA-N 469.853 5.379 5 20 JKBD CC(C)(C)n1nccc1NC(=O)C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1 609326974 KQEJPSAZXUXMNJ-VKAVYKQESA-N 461.547 5.725 5 20 JKBD COc1ccc(-c2nc(C(=O)N(CC3CC3)c3ccc(Cl)c([N+](=O)[O-])c3)cs2)cc1OC 728166651 KDIWEYBLNZBRMT-UHFFFAOYSA-N 473.938 5.446 5 20 JKBD CC(C)(C)OC(=O)N1CCCc2cc(NC(=O)c3ccc(Br)c([N+](=O)[O-])c3)ccc21 729658996 NIQUMCQXWHDSEH-UHFFFAOYSA-N 476.327 5.297 5 20 JKBD C[C@@H](OC(=O)c1csc(-c2cccc([N+](=O)[O-])c2)n1)c1cccc(NC(=O)c2ccccc2)c1 747955905 OLODUFRJOKXHEH-MRXNPFEDSA-N 473.510 5.889 5 20 JKBD CC(C)n1ncc2cc(C(=O)Nc3cc(Cl)c([N+](=O)[O-])cc3OCc3ccccc3)cnc21 812040895 KUVYVMCUUXBXFC-UHFFFAOYSA-N 465.897 5.405 5 20 JKBD COc1ccc(-c2noc(-c3ccc(Sc4nc(C)cs4)c([N+](=O)[O-])c3)n2)cc1OC 904285036 AGSGPBUQCJWLAX-UHFFFAOYSA-N 456.505 5.245 5 20 JKBD O=[N+]([O-])c1ccc(/C=C(/Cc2nc(CCC(F)(F)F)no2)c2nc3ccccc3s2)cc1 904868933 RVFQACQWERUYHZ-KAMYIIQDSA-N 460.437 5.866 5 20 JKBD C[C@@H](NC(=S)/C(=C(/O)c1cccc([N+](=O)[O-])c1)[n+]1ccc(Cc2ccccc2)cc1)c1ccccc1 917613335 SLSUNOWXRGTUMV-OAQYLSRUSA-O 496.612 6.035 5 20 JKBD O=C(Nc1ccccc1C(=O)Nc1ccc(-c2ccccc2)cn1)c1ccc([N+](=O)[O-])cc1Cl 918674287 XJCWDOLDZCRDFI-UHFFFAOYSA-N 472.888 5.815 5 20 JKBD Cc1ccc(C(=O)Nc2cccc(C(F)(F)F)c2)cc1NC(=O)c1cc([N+](=O)[O-])ccc1F 920845728 XVFDUDYKPSFNGJ-UHFFFAOYSA-N 461.371 5.566 5 20 JKBD COc1ccc([C@@H]2C[C@H]2C(=O)Nc2ccc(C3(NC(=O)Cc4cccc([N+](=O)[O-])c4)CCC3)cc2)cc1 1786328808 UOZSTLNFUGKBKS-IZZNHLLZSA-N 499.567 5.084 5 20 JKBD CN(C)c1ccc([N+](=O)[O-])c(C(=O)NC2(c3ccc(NC(=O)c4cccc5ccoc45)cc3)CCC2)c1 1790957144 NQQMTTAYSBGGBT-UHFFFAOYSA-N 498.539 5.469 5 20 JKBD O=C(NC1(c2ccc(NC(=O)[C@@H]3C[C@@H]3c3ccccc3)cc2)CCC1)c1nc2cc([N+](=O)[O-])ccc2[nH]1 1791533923 OMZVCLUKWYAXHW-FGZHOGPDSA-N 495.539 5.023 5 20 JKBD O=C(c1ccc(Cl)nc1)N1CCCC2(CCN(C(=O)c3cc4cc([N+](=O)[O-])ccc4s3)CC2)C1 1804668345 GXMSRGSTROXEKF-UHFFFAOYSA-N 498.992 5.017 5 20 JKBD O=C(Nc1cc([C@H]2CCCCN2C(=O)/C=C/c2ccccc2[N+](=O)[O-])[nH]n1)c1cc(Cl)ccc1F 1814624034 BWHHDSPHQJQBRJ-OGECGYFKSA-N 497.914 5.130 5 20 JKBD O=C(/C=C/c1ccccc1[N+](=O)[O-])Nc1cc([C@@H]2CCCCN2C(=O)c2cccc3ccoc23)[nH]n1 1823504070 ZWLYRLJKJFDSEQ-LEQVUBRHSA-N 485.500 5.083 5 20 JKBD O=C(c1cc2ccoc2s1)N1CCC([C@H]2CCCCN2C(=O)Cc2cc(F)ccc2[N+](=O)[O-])CC1 1832890258 VWJFADTYIDBDQZ-HXUWFJFHSA-N 499.564 5.018 5 20 JKBD O=C(OCc1nnc(-c2ccc(Cl)cc2)o1)c1ccccc1C(=O)c1ccc(Cl)c([N+](=O)[O-])c1 11029153 KZKYZMXHLHOGSE-UHFFFAOYSA-N 498.278 5.540 5 20 JKBD O=C(O[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1)c1ccc(F)cc1Cl 11445444 ZQOQEEPYUPMWSS-LJQANCHMSA-N 463.248 5.578 5 20 JKBD Cc1nc(S[C@@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2C(F)(F)F)n(C2CCCCC2)c1C 22216313 SZZIEDTUGIOLFP-AWEZNQCLSA-N 470.517 6.051 5 20 JKBD Cc1c(NC(=O)c2cc3cc([N+](=O)[O-])ccc3s2)cccc1C(=O)N1CCc2sccc2C1 26047431 AEJCZCKDKJEYMW-UHFFFAOYSA-N 477.567 5.630 5 20 JKBD CCOc1cc([N+](=O)[O-])c(C(=O)N(C/C=C/c2ccccc2)c2ccc3c(c2)OCCO3)cc1OC 28251759 UIJUNJLSPBCBBW-JXMROGBWSA-N 490.512 5.134 5 20 JKBD COc1ccc(Oc2ccc([N+](=O)[O-])cc2C(=O)Nc2ccc(C(=O)NC(C)(C)C)cc2)cc1 32953294 MZFDXJMCJDLPCW-UHFFFAOYSA-N 463.490 5.176 5 20 JKBD O=C(Nc1cccc(Oc2cnccn2)c1)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 33136792 PAJYMKXMEQWXCA-UHFFFAOYSA-N 487.438 5.051 5 20 JKBD CCc1ccc(CN(C)C(=O)c2ccccc2NC(=O)c2ccc([N+](=O)[O-])cc2Cl)cc1 104715548 RIOAFLHHAXHQRB-UHFFFAOYSA-N 451.910 5.335 5 20 JKBD O=C(C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)Nc1ccc2c(c1)OCCO2 141615191 QNOMSYUQALVYHH-GHRIWEEISA-N 473.510 5.545 5 20 JKBD O=C(c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1)N1CCC(c2c[nH]c3ncccc23)CC1 195628463 LVYLRGPTTLKDBF-UHFFFAOYSA-N 476.920 5.937 5 20 JKBD CSc1ccc([N+](=O)[O-])c(C(=O)Nc2ccc(Cl)cc2C(=O)N2[C@@H](C)CCC[C@@H]2C)c1 302996906 YNRNCIFVEJHOOO-KBPBESRZSA-N 461.971 5.626 5 20 JKBD C[C@H](NC(=O)CCCNc1ccc([N+](=O)[O-])cc1)c1ccc(NC(=O)Nc2ccccc2)cc1 480771031 ARXQHHFGHYKCQA-SFHVURJKSA-N 461.522 5.308 5 20 JKBD O=C(Nc1cccc(NC(=O)c2cnn(-c3ccc([N+](=O)[O-])cc3)c2)c1)c1cccc(C(F)(F)F)c1 504796453 LFICCKFVADGXTG-UHFFFAOYSA-N 495.417 5.304 5 20 JKBD C[C@@H](Nc1ccc(C(=O)N(Cc2ccc(Cl)cc2)C2CC2)cc1[N+](=O)[O-])c1ccccn1 506174866 NZXRUZHTZXIZAK-MRXNPFEDSA-N 450.926 5.621 5 20 JKBD COc1ccc([C@H](CNC(=O)N(Cc2ccc([N+](=O)[O-])cc2)C(C)C)c2c[nH]c3ccccc23)cc1 509366302 NNPNVEQMHUSKPM-VWLOTQADSA-N 486.572 5.837 5 20 JKBD COc1cc(C(=O)Nc2ccc(Oc3ccc(Cl)cc3)nc2)c([N+](=O)[O-])cc1OC(F)F 512117663 YIUIFBWJKKTQJT-UHFFFAOYSA-N 465.796 5.298 5 20 JKBD Cc1ccc(-c2csc(NC(=O)c3sc(Cc4ccccc4)nc3C)n2)cc1[N+](=O)[O-] 512235252 WGLDHOAIDYXJBT-UHFFFAOYSA-N 450.545 5.635 5 20 JKBD Cn1c(SCc2nc(-c3cccc([N+](=O)[O-])c3)no2)nnc1-c1ccc(C(C)(C)C)cc1 514903437 IXRCUHIITNLYPX-UHFFFAOYSA-N 450.524 5.030 5 20 JKBD CN(C)C1(CNC(=O)C/C(=C/c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)CCCC1 517092457 ZZMZXCSGUIEALR-CYVLTUHYSA-N 464.591 5.126 5 20 JKBD CCN(C(=O)c1ccc(N[C@@H](C)c2ccccn2)c([N+](=O)[O-])c1)[C@@H](C)Cc1ccc(OC)cc1 520914366 KUVCVPQOAASFNG-OALUTQOASA-N 462.550 5.265 5 20 JKBD COc1cc(C(=O)Nc2nc3c(C(F)(F)F)cccc3s2)c([N+](=O)[O-])cc1OC(F)F 585704112 HDLMWOOMPBNOPH-UHFFFAOYSA-N 463.340 5.086 5 20 JKBD COC(=O)c1ccc(F)c(NC(=O)C/C(=C/c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)c1 593271746 QZJFDBYTYNILGS-ATVHPVEESA-N 491.500 5.700 5 20 JKBD C[C@H](c1ccccc1)n1c(SCc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)nnc1-c1ccccc1 603917208 CUYHDKAWUZZDAW-QGZVFWFLSA-N 484.541 5.805 5 20 JKBD O=C(CSc1nc2ccc(C(F)(F)F)cc2[nH]1)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 603937975 DDWLLONEPFETCS-UHFFFAOYSA-N 464.347 5.240 5 20 JKBD O=[N+]([O-])c1ccc(Sc2nnc(-c3c[nH]c4ccccc34)n2C[C@@H]2CCCO2)c2ccncc12 619671264 ODGNOWZKACBKDJ-HNNXBMFYSA-N 472.530 5.213 5 20 JKBD Cc1oc(-c2ccsc2)nc1COC(=O)c1ccc(N[C@@H](C)c2ccccn2)c([N+](=O)[O-])c1 726812815 LVYSAZSHQUJEMM-AWEZNQCLSA-N 464.503 5.545 5 20 JKBD COc1ccc(C(=O)N(C)C)cc1NC(=O)CCC(=O)c1ccc2ccc3cccc4ccc1c2c34 727756126 QEGQRQQHZFEGIH-UHFFFAOYSA-N 478.548 5.896 5 20 JKBD CC1=C(C(=O)Nc2ccccc2C)[C@H](c2ccc([N+](=O)[O-])cc2)NC(=S)N1c1cccc(Cl)c1 901414823 VYTZOTOIQZQYHN-QHCPKHFHSA-N 492.988 5.905 5 20 JKBD CC(C)(C)OC(=O)NCc1ccc(-c2noc(-c3ccc([N+](=O)[O-])cc3Br)n2)cc1 904716151 MRJUEOBXFYLSOO-UHFFFAOYSA-N 475.299 5.099 5 20 JKBD CC(C)N(C)Cc1ccccc1CNC(=O)c1ccccc1NC(=O)c1ccc([N+](=O)[O-])cc1Cl 918589325 NPWQZICSLJTOKB-UHFFFAOYSA-N 494.979 5.271 5 20 JKBD O=C(Nc1ccccc1C(=O)NCC1(c2ccc(F)cc2)CC1)c1ccc([N+](=O)[O-])cc1Cl 918596309 ZXIOHOXGHZMFJF-UHFFFAOYSA-N 467.884 5.101 5 20 JKBD Cc1occc1C(=O)Nc1nc(CC(=O)Oc2ccc(-c3ccccc3)cc2[N+](=O)[O-])cs1 920330350 AOKCZEGPCVYPSI-UHFFFAOYSA-N 463.471 5.020 5 20 JKBD O=C(/C=C/c1ccccc1[N+](=O)[O-])NC1(c2ccc(NC(=O)c3cccnc3Cl)cc2)CCC1 1785756303 NREMLWJDUYYDEO-MDWZMJQESA-N 476.920 5.104 5 20 JKBD O=C(CCCC(F)(F)F)Nc1ccc(C2(NC(=O)Cc3ccc([N+](=O)[O-])cc3F)CCC2)cc1 1786621651 PLWQTEDXEKPNQQ-UHFFFAOYSA-N 481.446 5.143 5 20 JKBD O=C(Cc1cc([N+](=O)[O-])ccc1F)Nc1ccc(C2(NC(=O)c3cccc4ncccc34)CCC2)cc1 1786671087 FKKVRQWDYUHFQZ-UHFFFAOYSA-N 498.514 5.273 5 20 JKBD O=C(/C=C/c1ccc([N+](=O)[O-])o1)NC1(c2ccc(NC(=O)C3(C(F)(F)F)CCC3)cc2)CCC1 1787936362 CGYGQFQLNCXUCL-VQHVLOKHSA-N 477.439 5.068 5 20 JKBD CN(C)c1ccc([N+](=O)[O-])cc1C(=O)NC1(c2ccc(NC(=O)c3ccc4occc4c3)cc2)CCC1 1789049554 LOACMQQOFGTQIN-UHFFFAOYSA-N 498.539 5.469 5 20 JKBD O=C(/C=C/c1ccccc1[N+](=O)[O-])NC1(c2ccc(NC(=O)c3cc(F)cnc3Cl)cc2)CCC1 1789718840 GXPXEVDABMLKJR-IZZDOVSWSA-N 494.910 5.243 5 20 JKBD O=C(/C=C/C1CC1)NC1(c2ccc(NC(=O)c3cc(Br)ccc3[N+](=O)[O-])cc2)CCC1 1790663619 GDYZJTJQCUWWLQ-NYYWCZLTSA-N 484.350 5.071 5 20 JKBD CC(C)c1ccc(CC(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)cc1 1801208515 ICGLJQMDDIDCQP-KOUNCHBCSA-N 491.613 5.427 5 20 JKBD O=C(c1ccc([N+](=O)[O-])o1)N1CCCC2(CCN(C(=O)c3ccc(C(F)(F)F)cc3Cl)CC2)C1 1804650926 ARRBDGSNSNJMSD-UHFFFAOYSA-N 499.873 5.019 5 20 JKBD CC[C@@H](C)[C@@H](C(=O)N1CCCC2(CCN(C(=O)c3cccc(F)c3[N+](=O)[O-])CC2)C1)c1ccccc1 1809162369 MLFIDMXLPPVHKM-HYBUGGRVSA-N 495.595 5.409 5 20 JKBD O=C(Nc1cc([C@H]2CCCCN2C(=O)c2ccc([N+](=O)[O-])o2)[nH]n1)c1cc2c(Cl)cccc2s1 1818773408 QOTKJKRAKWJTDM-OAHLLOKOSA-N 499.936 5.399 5 20 JKBD Cc1cccc2cc(C(=O)N3CCCC[C@@H]3C3CCN(C(=O)c4cc(F)cc([N+](=O)[O-])c4)CC3)[nH]c12 1828549697 SFPBSTCHBNXGOI-XMMPIXPASA-N 492.551 5.071 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cccc3ccoc23)CC1 1830991187 XXLZYWPHYAWRMH-HSZRJFAPSA-N 493.535 5.336 5 20 JKBD Cc1cnc(C(=O)N2CCC([C@H]3CCCCN3C(=O)c3cc4cc([N+](=O)[O-])ccc4s3)CC2)s1 1831059539 IHVVAKGXHYNKOC-LJQANCHMSA-N 498.630 5.122 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Cl)[C@H](Nc1cccc(N2CCCC2=O)c1)c1ccccc1 15506839 OEUBVYJZCJRCES-HSZRJFAPSA-N 464.909 5.167 5 20 JKBD Cc1cccc(C)c1NC(=O)CN(C)C(=O)c1cc([N+](=O)[O-])ccc1Sc1ccc(Cl)cc1 17972868 BHLCXTDOZJAKTL-UHFFFAOYSA-N 483.977 5.727 5 20 JKBD O=C(COC(=O)c1cc2cc([N+](=O)[O-])ccc2s1)N[C@@H](c1ccc(F)cc1)c1cccs1 18549051 LOZJZQYHVSONKN-NRFANRHFSA-N 470.503 5.073 5 20 JKBD C[C@H](OC(=O)c1csc(-c2ccc(F)cc2)n1)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 19617226 ZBQBSWFURAGRDW-JTQLQIEISA-N 483.399 5.060 5 20 JKBD COc1cc(C(=O)N[C@H](C)c2cccc(NC(C)=O)c2)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 30276149 ZKXXAIPVBQMLPR-CQSZACIVSA-N 483.908 5.499 5 20 JKBD Cc1noc2nc(-c3ccc(F)cc3)cc(C(=O)O[C@H](C)C(=O)Nc3cc([N+](=O)[O-])ccc3Cl)c12 105432034 NVEHFHMGMXXJKC-GFCCVEGCSA-N 498.854 5.083 5 20 JKBD O=C(CCNc1ccccc1[N+](=O)[O-])Nc1ccc(NC(=O)c2ccccc2F)cc1C(F)(F)F 107812891 GNEXMYMTNLWVSL-UHFFFAOYSA-N 490.413 5.446 5 20 JKBD Cc1cc(C)n([C@@H](C)C(=O)Nc2ccc(NC(=O)c3ccc(Cl)cc3[N+](=O)[O-])cc2Cl)n1 109141001 ZZPHVCULKPEWHD-ZDUSSCGKSA-N 476.320 5.167 5 20 JKBD Cc1csc(Sc2ccc(C(=O)N3CCC[C@H](CN4CCC(C)CC4)C3)cc2[N+](=O)[O-])n1 109661709 ZIAOYKQIIHASLL-GOSISDBHSA-N 474.652 5.095 5 20 JKBD Cc1csc(N(CC(F)(F)F)C(=O)c2ccc(N3C[C@@H](C)C[C@@H](C)C3)c([N+](=O)[O-])c2)n1 195644749 UOBZXINDVRXTBA-BETUJISGSA-N 456.490 5.051 5 20 JKBD O=C(Cn1c2ccccc2c(=O)c2ccccc21)N[C@H](c1ccccc1)c1ccc2c(c1)CCCO2 303314045 PSZTYRAYAMBIEE-SSEXGKCCSA-N 474.560 5.386 5 20 JKBD Cc1ccc(S(=O)(=O)Nc2ccc(C(=O)Nc3cccc(-c4nccs4)c3)cc2)cc1[N+](=O)[O-] 489717433 XAKHCGBFUFZEPH-UHFFFAOYSA-N 494.554 5.080 5 20 JKBD COc1cc(OC)c(NC(=O)c2ccc(N[C@H](C)c3ccccn3)c([N+](=O)[O-])c2)cc1Cl 506219628 MJCHRWCLIQRGGD-CYBMUJFWSA-N 456.886 5.086 5 20 JKBD COc1cc(C(=O)Nc2cccc(NC(=O)Nc3cccc(C(F)(F)F)c3)c2)ccc1[N+](=O)[O-] 508584953 AAJNKAHZXRVPAG-UHFFFAOYSA-N 474.395 5.519 5 20 JKBD CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccc(NC(=O)c2ccco2)cc1C(F)(F)F 510030469 QICNEWDJSDPIHY-UHFFFAOYSA-N 490.438 5.901 5 20 JKBD COc1cc(CSc2nnc(-c3ccncc3)n2-c2ccccc2)c([N+](=O)[O-])cc1OC(F)F 514883090 GOVJBAHATHJOBK-UHFFFAOYSA-N 485.472 5.140 5 20 JKBD O=C(c1cc(NCc2cn(-c3ccccc3)nc2-c2ccccc2)ccc1[N+](=O)[O-])N1CCCC1 515606818 YVDACRHTQLPOOX-UHFFFAOYSA-N 467.529 5.296 5 20 JKBD COc1ccc(C(=O)Nc2ccccc2OCc2ncc(-c3cccc(Cl)c3)o2)cc1[N+](=O)[O-] 524210204 PHDMXQGJHUYXNF-UHFFFAOYSA-N 479.876 5.743 5 20 JKBD O=C(NCc1ccccc1C(F)(F)F)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 603507330 VRCWXWQNQLJSCX-UHFFFAOYSA-N 475.389 5.165 5 20 JKBD Cc1cccc(NC(=O)Nc2cccc(CNC(=O)[C@@H](C)Sc3ccc([N+](=O)[O-])cc3)c2)c1 604180428 XGOPOVLFIIPDDY-QGZVFWFLSA-N 464.547 5.344 5 20 JKBD C[C@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)Nc1ccc(NC(=O)c2ccco2)c(Cl)c1 604443657 HOFKAABSJHVPOP-NSHDSACASA-N 464.261 5.153 5 20 JKBD O=C(Nc1ncn(Cc2ccccc2)n1)c1ccccc1Sc1ccc(C(F)(F)F)cc1[N+](=O)[O-] 604446254 JNCGJAMKBWLUQN-UHFFFAOYSA-N 499.474 5.657 5 20 JKBD O=C(N[C@@H]1C[C@@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1)c1csc(-c2cccc([N+](=O)[O-])c2)n1 604517452 JMDPUALSXLDIEP-GDNZZTSVSA-N 467.391 5.358 5 20 JKBD CCN(CC)c1ccc(CNCc2ccc(-c3ccc([N+](=O)[O-])cc3Br)o2)cn1 608836120 OSOMXLPAIOYOQT-UHFFFAOYSA-N 459.344 5.148 5 20 JKBD Cc1ccc(NC(=O)c2ccc(N3CCO[C@@H](c4ccc(F)c(F)c4)C3)c([N+](=O)[O-])c2)cc1 608973402 AMJABMKTVFLYSA-HSZRJFAPSA-N 453.445 5.012 5 20 JKBD CC(=O)Nc1ccc(NC(=O)c2ccc(NCc3ccccc3Cl)c([N+](=O)[O-])c2)c(Cl)c1 609018656 LEIHTJYPBJNPIE-UHFFFAOYSA-N 473.316 5.724 5 20 JKBD COc1cc(C(=O)Nc2ccc(-c3cccc(Cl)c3)cc2C)c([N+](=O)[O-])cc1OC(F)F 726762296 AKJSHDKZIYVILK-UHFFFAOYSA-N 462.836 6.086 5 20 JKBD C[C@H](OC(=O)c1csc(-c2cccc([N+](=O)[O-])c2)n1)C(=O)N[C@H](C)c1cccc2ccccc12 747962820 UYPXMBJXCAFYHJ-CVEARBPZSA-N 475.526 5.294 5 20 JKBD Cc1cccc(NC(=O)[C@@H](OC(=O)c2csc(-c3cccc([N+](=O)[O-])c3)n2)C(C)C)c1C 747963639 XELUWDGOFGSDBK-FQEVSTJZSA-N 453.520 5.155 5 20 JKBD Cc1cc(N2CCCC2)ccc1NC(=O)COc1ccc2c(-c3ccc([N+](=O)[O-])cc3)cc(=O)oc2c1 748687347 OWSGNQMBAJYNJU-UHFFFAOYSA-N 499.523 5.294 5 20 JKBD Cc1noc2nc(-c3ccc(F)cc3)cc(C(=O)O[C@H](C)c3nnc(-c4ccc([N+](=O)[O-])cc4)o3)c12 813355045 WCADEWSXBSUFKS-CYBMUJFWSA-N 489.419 5.214 5 20 JKBD O=C(COC(=O)c1sc2cc(C(F)(F)F)ccc2c1Cl)Nc1cc([N+](=O)[O-])ccc1F 914963209 AFRJNNUOPFWMDG-UHFFFAOYSA-N 476.791 5.416 5 20 JKBD COc1cc(NC(=O)Cn2c3ccccc3c(=O)c3ccccc32)ccc1NC(=O)OC(C)(C)C 916431622 ILYPUNSNRXQEJM-UHFFFAOYSA-N 473.529 5.149 5 20 JKBD Cc1ccc(C(=O)Nc2cc([N+](=O)[O-])ccc2F)cc1NC(=O)c1ccc(Br)cc1 917612222 XRLAHMGFVGAGFQ-UHFFFAOYSA-N 472.270 5.309 5 20 JKBD CCCC(=O)Nc1c(Cl)cc(Cl)cc1C(=O)OCc1nnc(-c2ccc([N+](=O)[O-])cc2)o1 919557738 HYRZCHQRHQHPKZ-UHFFFAOYSA-N 479.276 5.047 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)c3ccc(F)cc3C(F)(F)F)CCC2)cc1)c1ccc([N+](=O)[O-])o1 1785752439 GGYRQPHLMFWKLS-UHFFFAOYSA-N 491.397 5.407 5 20 JKBD CCC[C@H]1CC[C@H](C(=O)Nc2cc([C@@H]3CCCCN3C(=O)Cc3cccc([N+](=O)[O-])c3)[nH]n2)CC1 1822099214 UTDAUGSLNFDSNF-LEDOBFOHSA-N 481.597 5.159 5 20 JKBD O=C(/C=C/c1ccc([N+](=O)[O-])o1)N1CCC([C@H]2CCCCN2C(=O)c2cc3sccc3s2)CC1 1828547624 YQEGANJBGUXULG-MJICGBHWSA-N 499.614 5.411 5 20 JKBD O=C(c1c(F)cccc1Cl)N1CCC([C@@H]2CCCCN2C(=O)c2cccc(F)c2[N+](=O)[O-])CC1 1830620819 GONBPYRBKJKSLK-FQEVSTJZSA-N 491.922 5.074 5 20 JKBD Cc1cc(F)c(F)c(C(=O)N2CCC([C@@H]3CCCCN3C(=O)/C=C/c3ccccc3[N+](=O)[O-])CC2)c1 1832903410 BLBPHEHVVPAGQU-ZUTVHTERSA-N 497.542 5.128 5 20 JKBD Cc1cccc([N+](=O)[O-])c1NC(=O)COC(=O)c1ccccc1OCc1cccc(Br)c1 9747497 PMFWSYWXYTXFHD-UHFFFAOYSA-N 499.317 5.040 5 20 JKBD Cc1ccc(-c2nnc(SCC(=O)Nc3nc(-c4cccc([N+](=O)[O-])c4)cs3)o2)cc1C 10843216 OYSQDFKDIHXZJM-UHFFFAOYSA-N 467.532 5.116 5 20 JKBD COc1cc(C(=O)OCC(=O)N[C@H](C)c2cccs2)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 10911443 MQDBTFBSMCIBHN-CYBMUJFWSA-N 490.921 5.145 5 20 JKBD O=C(CCNc1ccc(C(F)(F)F)cc1[N+](=O)[O-])Nc1cccc(C2SCCS2)c1 18216748 JJKKBEKENQBPFX-UHFFFAOYSA-N 457.499 5.533 5 20 JKBD CC(=O)c1ccc(-c2ccc(C(=O)O[C@H](C)C(=O)Nc3ccc([N+](=O)[O-])cc3C(F)(F)F)o2)cc1 22847308 XQVFPYVMJGMVGQ-CYBMUJFWSA-N 490.390 5.260 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Cl)[C@@H](NCc1ccccc1OC(F)(F)F)c1ccccc1 28623316 XOQGVOSKHJDTGI-FQEVSTJZSA-N 479.842 5.616 5 20 JKBD CC(C)Oc1ccccc1NC(=O)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 31775419 BUZLJFJRJUVEEY-UHFFFAOYSA-N 451.445 5.256 5 20 JKBD Cc1cc([N+](=O)[O-])ccc1NC(=O)CSc1nnc(-c2cccnc2)n1-c1ccccc1C(C)C 39589872 CSJBTTGJWSZELV-UHFFFAOYSA-N 488.573 5.400 5 20 JKBD O=C(Cn1c2ccccc2c(=O)c2ccccc21)Nc1ccc(Cl)c(-c2nnc3n2CCCCC3)c1 45949860 YCWKIIXARIOLPT-UHFFFAOYSA-N 497.986 5.432 5 20 JKBD O=C(c1cccc(C(F)(F)F)c1)N1CCN(C(=O)c2cc3ccccc3c3cccnc23)CC1 107899318 GKDJHPHKZZQHPZ-UHFFFAOYSA-N 463.459 5.005 5 20 JKBD O=C(c1ccc(Nc2ccccc2)c([N+](=O)[O-])c1)N1CCC(c2nc(-c3ccccc3)n[nH]2)CC1 116494574 QDRJVVCOWWIMIQ-UHFFFAOYSA-N 468.517 5.143 5 20 JKBD Cc1ccc([N+](=O)[O-])cc1NC(=O)CSC1=N/C(=C/c2ccccc2)C(=O)N1c1ccc(F)cc1 207429965 RIVLVUSGTLTDTH-LPYMAVHISA-N 490.516 5.158 5 20 JKBD CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)CCc1nc2cc(C(F)(F)F)ccc2s1 409860458 HICRHGUDXJOPBT-UHFFFAOYSA-N 451.470 5.593 5 20 JKBD CCN(CC)C(=O)Cc1ccc(NC(=O)c2ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])cc2)cc1 482546374 BIJGIVQZZJKLIX-UHFFFAOYSA-N 481.936 5.704 5 20 JKBD CNC(=O)c1cc(NC(=O)c2ccc(Sc3ccc(C)cc3)c([N+](=O)[O-])c2)ccc1Cl 489249968 HZSXCGIOEWKOKA-UHFFFAOYSA-N 455.923 5.320 5 20 JKBD COCc1c(C(=O)N2CCN(Cc3ccc(-c4ccccc4[N+](=O)[O-])s3)CC2)oc2ccccc12 500747976 YTEKLBVBIJPVAA-UHFFFAOYSA-N 491.569 5.174 5 20 JKBD COc1ccc([C@H](Cc2ccccc2C)Nc2cc3c(cc2[N+](=O)[O-])CCC(=O)N3)cc1OC 507037903 NGPCAMNJZBSQGF-FQEVSTJZSA-N 461.518 5.201 5 20 JKBD COc1ccc(CNC(=O)[C@@](C)(Cc2nc3ccccc3s2)c2ccccc2)cc1[N+](=O)[O-] 516536675 JSLUVORVVPLVTD-VWLOTQADSA-N 461.543 5.030 5 20 JKBD CCOc1ccc(CN[C@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Br)c2ccccc2)cc1 516835327 GMDDYEVMXNQZKO-QFIPXVFZSA-N 484.350 5.226 5 20 JKBD CCOc1ccccc1Oc1ccc(CNCc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)cn1 518272799 SATKUEFQAXZWJZ-UHFFFAOYSA-N 461.543 6.199 5 20 JKBD O=[N+]([O-])c1cc(CNCc2nnc3c(Cl)cc(C(F)(F)F)cn23)ccc1Oc1ccc(F)cc1 603633602 VNPKNFBSBQSXJE-UHFFFAOYSA-N 495.820 5.531 5 20 JKBD Cc1cc(C(=O)NC2CCCCC2)ccc1NC(=O)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-] 603970324 WBVVMNKEHDMNCS-UHFFFAOYSA-N 479.455 5.159 5 20 JKBD COc1cc([C@H](C)NC(=O)[C@@H](C)Oc2ccc(Cl)cc2[N+](=O)[O-])ccc1OC1CCCC1 604442625 MFSGLJKFRXGWCE-LSDHHAIUSA-N 462.930 5.223 5 20 JKBD COc1cc(C(=O)Nc2cc(F)ccc2N2CCCCC2)c([N+](=O)[O-])cc1OCc1cscn1 608874347 LTRGQLHFFYOJRU-UHFFFAOYSA-N 486.525 5.021 5 20 JKBD Cc1cc([N+](=O)[O-])ccc1NC(=O)CNc1ccc(NC(=O)OC(C)(C)C)cc1C(F)(F)F 729675425 JASTWVRXGBXTBI-UHFFFAOYSA-N 468.432 5.320 5 20 JKBD C[C@H](OC(=O)c1ccccc1C(=O)c1ccc(Cl)c(Cl)c1)C(=O)Nc1ccccc1[N+](=O)[O-] 729727217 OKEBFPPIVOXABK-ZDUSSCGKSA-N 487.295 5.317 5 20 JKBD C[C@@H](OC(=O)/C=C\c1cc(C(F)(F)F)ccc1Cl)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 746154331 IRPUSJBJVAWFID-KSHIFHCESA-N 467.787 5.635 5 20 JKBD Cc1c([N+](=O)[O-])cc(C(=O)Nc2ccc(Oc3cccc(Br)c3)nc2)cc1[N+](=O)[O-] 749520891 HWPZBKCTPFQECP-UHFFFAOYSA-N 473.239 5.014 5 20 JKBD O=C(OCC1CCN(c2ccc([N+](=O)[O-])cn2)CC1)[C@H]1CC=CC[C@H]1c1nc2ccccc2s1 750428620 UBAINPPUFYJYOZ-UXHICEINSA-N 478.574 5.109 5 20 JKBD O=C(Cc1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1)Nc1ccnn1C1CCCCC1 750732006 JLXLMXUMMOBUHS-UHFFFAOYSA-N 470.533 5.330 5 20 JKBD CCCCOc1ccc([C@H](C)NC(=O)c2cc([N+](=O)[O-])ccc2Br)cc1OC 751091787 ZTAQVTFGIHFGBN-ZDUSSCGKSA-N 451.317 5.036 5 20 JKBD Cn1cnnc1Sc1ccc(C(=O)OCc2csc(-c3ccc(Cl)cc3)n2)cc1[N+](=O)[O-] 789861290 YANOYVNXJPDZRD-UHFFFAOYSA-N 487.950 5.008 5 20 JKBD CCc1cccc(CC)c1NC(=O)[C@H](C)OC(=O)c1ccc(N2CCC(C)CC2)c([N+](=O)[O-])c1 826130042 DAICSCXOLGHUQV-SFHVURJKSA-N 467.566 5.140 5 20 JKBD Cc1cc(-c2cc(C(=O)Nc3cc([N+](=O)[O-])ccc3F)c3cnn(C(C)C)c3n2)c(C)s1 832855110 BQJGUKAJFWSODJ-UHFFFAOYSA-N 453.499 5.657 5 20 JKBD C[C@@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)OCC(=O)Nc1ccccc1Oc1ccccc1 916523247 VNAKATZJTRZDTC-MRXNPFEDSA-N 452.488 5.050 5 20 JKBD O=C(OCC(=O)N1c2ccccc2Sc2ccc(Cl)cc21)c1cc2c(cc1[N+](=O)[O-])OCCO2 917235149 HGIXDLGBVULIDP-UHFFFAOYSA-N 498.900 5.006 5 20 JKBD C[C@H](Sc1ccc(Br)cc1)C(=O)O[C@H](C)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 919469418 ZIQBWQDDZLYXKZ-NEPJUHHUSA-N 478.324 5.192 5 20 JKBD COc1ccc(SCC(=O)Oc2ccc3c(-c4ccc([N+](=O)[O-])cc4)cc(=O)oc3c2)cc1 921193099 JGVKNWQLEMCTKX-UHFFFAOYSA-N 463.467 5.075 5 20 JKBD Cc1ccc(C(=O)NC2(c3ccc(NC(=O)Cn4ccc5ccc([N+](=O)[O-])cc54)cc3)CCC2)cc1O 1786276675 KFMCQFVWPQRXMA-UHFFFAOYSA-N 498.539 5.011 5 20 JKBD Cc1cc(C(=O)Nc2ccc(C3(NC(=O)[C@@H](C)Sc4cccs4)CCC3)cc2)ncc1[N+](=O)[O-] 1788767076 WVUWSSAMUHNURH-MRXNPFEDSA-N 496.614 5.288 5 20 JKBD Cc1cc(C(=O)NC2(c3ccc(NC(=O)c4cc(-c5ccccc5)no4)cc3)CCC2)ncc1[N+](=O)[O-] 1789782430 PWIQYBRWROLJDL-UHFFFAOYSA-N 497.511 5.015 5 20 JKBD C[C@@H](C(=O)Nc1ccc(C2(NC(=O)c3cc([N+](=O)[O-])cc4c3OCC4)CCC2)cc1)c1cccs1 1791814954 BNTGBQMJCGSGKP-MRXNPFEDSA-N 491.569 5.143 5 20 JKBD O=C(CCc1cccc([N+](=O)[O-])c1)Nc1cc([C@H]2CCCCN2C(=O)c2c(F)cccc2Cl)[nH]n1 1815538277 FXBQSIGZVUVDQN-HXUWFJFHSA-N 499.930 5.049 5 20 JKBD C[C@H](CC(=O)N1CCC([C@@H]2CCCCN2C(=O)Cc2cc([N+](=O)[O-])ccc2F)CC1)c1ccccc1 1824949181 JFCMZYPKCZXUQJ-IBVKSMDESA-N 495.595 5.090 5 20 JKBD CC1=CC[C@@H](C(=O)N2CCCC[C@@H]2C2CCN(C(=O)CSc3ccccc3[N+](=O)[O-])CC2)CC1 1828352319 OMEKGGZGLWHMRT-FGZHOGPDSA-N 485.650 5.053 5 20 JKBD CC1(C(=O)N2CCC([C@@H]3CCCCN3C(=O)CSc3ccccc3[N+](=O)[O-])CC2)CCCCC1 1831777649 VSMYNQHZXNOPDZ-NRFANRHFSA-N 487.666 5.277 5 20 JKBD O=C(c1cc2cc([N+](=O)[O-])ccc2s1)N1CC2(CCCN2C(=O)c2ccncc2-c2ccccc2)C1 1844588323 GXEKKVCCRBYJHR-UHFFFAOYSA-N 498.564 5.002 5 20 JKBD C[C@@H](OC(=O)c1ccc([N+](=O)[O-])cc1Cl)C(=O)Nc1ccc(Cl)c(C(F)(F)F)c1 11028895 NEMNRJCRUKQBKO-MRVPVSSYSA-N 451.184 5.104 5 20 JKBD COc1ccc(NC(=O)[C@@H](C)OC(=O)[C@@H](Sc2ccccc2)c2ccccc2)c([N+](=O)[O-])c1 15815204 UGEAYTBWKFVOSR-ZHRRBRCNSA-N 466.515 5.007 5 20 JKBD CCOc1cc([N+](=O)[O-])c(C(=O)O[C@H](C(=O)Nc2cc(C)ccc2C)c2ccccc2)cc1OC 18969099 GNDIDOGPKCELHR-DEOSSOPVSA-N 478.501 5.156 5 20 JKBD Cc1c(NC(=O)c2cc(-c3ccccc3)nc3c2cnn3Cc2ccco2)cccc1[N+](=O)[O-] 22082099 BCVXRQOQNSXLSW-UHFFFAOYSA-N 453.458 5.209 5 20 JKBD CC(=O)N1CCc2cc(NC(=O)c3cc([N+](=O)[O-])ccc3Sc3ccc(Cl)cc3)ccc21 22643004 OXVOSEARKVAYIO-UHFFFAOYSA-N 467.934 5.561 5 20 JKBD CSc1ccc(C(=O)c2ccccc2C(=O)Nc2cccc(Cn3cccn3)c2)cc1[N+](=O)[O-] 32469499 IXRPJMYIRLNWAF-UHFFFAOYSA-N 472.526 5.045 5 20 JKBD CC(C)c1nc2ccc(NC(=O)c3ccc([N+](=O)[O-])cc3I)cc2s1 303121486 NCYNNDQQJYGILK-UHFFFAOYSA-N 467.288 5.185 5 20 JKBD CC(C)N1CCC(N(C)C(=O)c2c3c(nc4ccccc24)/C(=C\c2cccc([N+](=O)[O-])c2)CCC3)CC1 476181246 OLTVESQONOJFEN-PYCFMQQDSA-N 498.627 5.965 5 20 JKBD O=C(NC1CCN(C(=O)c2ccccc2F)CC1)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1 480323147 XESNQPOQKCBZJY-UHFFFAOYSA-N 497.910 5.214 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Cl)[C@@H](NCc1ccc(Oc2ccccc2)nc1)c1ccccc1 504427133 PKIBLGOYRIHLIE-VWLOTQADSA-N 488.931 5.905 5 20 JKBD Cc1cccc([N+](=O)[O-])c1NC(=O)CSc1nnc(-c2ccco2)n1[C@@H](C)[C@H]1C[C@H]2CC[C@H]1C2 515308970 LBESZUOHDVZAGO-XLAORIBOSA-N 481.578 5.483 5 20 JKBD CCCCc1ccc([C@H](NC(=O)CNC(=O)c2c(Cl)cccc2[N+](=O)[O-])c2cccs2)cc1 518654625 KRCKXOOHCUUZDM-QHCPKHFHSA-N 485.993 5.288 5 20 JKBD C[C@@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)Nc1cccc(NC(=O)Nc2ccccc2)c1 520439128 QGWQUBZOJPEQOG-CQSZACIVSA-N 454.870 5.298 5 20 JKBD C[C@@H](NCc1ccc(-c2ccc([N+](=O)[O-])cc2Br)o1)c1ccc(NC(=O)C2CC2)cc1 521816120 KOKCZGQHSZLSQN-CQSZACIVSA-N 484.350 5.817 5 20 JKBD COc1ccc(OC)c(-c2csc(NC(=O)c3csc(-c4ccc([N+](=O)[O-])cc4)n3)n2)c1 522092968 NIRZAQRIFHQWCV-UHFFFAOYSA-N 468.516 5.111 5 20 JKBD Cc1ccc(C(=O)Nc2cccc(C(F)(F)F)c2)cc1NC(=O)CCn1nc(C)c([N+](=O)[O-])c1C 522530487 HIDVCNVTNKADND-UHFFFAOYSA-N 489.454 5.016 5 20 JKBD CCOC(=O)c1csc(NC(=O)C/C(=C\c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)n1 550262060 NJAUYDZUGMMOOU-RVDMUPIBSA-N 494.554 5.407 5 20 JKBD C[C@@H]1CSc2ccc(Br)cc2[C@H]1NC(=O)Cn1c2ccccc2c(=O)c2ccccc21 591369835 KQZGDVCSKRZMSD-MYYSRTQBSA-N 493.426 5.517 5 20 JKBD COCCOCc1cccc(NC(=O)c2ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])cc2)c1 603816226 KVTCFRCLZBZFNU-UHFFFAOYSA-N 456.882 5.456 5 20 JKBD CCOc1cc(C)ccc1NC(=O)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 603977671 GYYCHOHAHMMWDY-UHFFFAOYSA-N 451.445 5.176 5 20 JKBD O=C(N[C@@H](c1ccc(Br)cc1)C1CCC1)C1CCN(c2ccccc2[N+](=O)[O-])CC1 604016854 IZGDNYWSDQTBDG-JOCHJYFZSA-N 472.383 5.231 5 20 JKBD CCOC(=O)c1cccc(N(CC)C(=O)C2CCN(c3ccc(C(F)(F)F)cc3[N+](=O)[O-])CC2)c1 604025125 OHYKREPMGFMWOS-UHFFFAOYSA-N 493.482 5.060 5 20 JKBD C[C@H]1CCCN(c2ccc(C(=O)N3C[C@@H](C(F)(F)F)C[C@@H](C(F)(F)F)C3)cc2[N+](=O)[O-])C1 604257574 IFFGIOGXUBNOMD-AEGPPILISA-N 467.410 5.034 5 20 JKBD CSCC(=O)Nc1ccc(Oc2ccc(C(=O)Nc3ccc(C)cc3)cc2[N+](=O)[O-])cc1 608974621 QEEUYYFRBMIBGK-UHFFFAOYSA-N 451.504 5.249 5 20 JKBD CC(C)[C@H](OC(=O)c1cc([N+](=O)[O-])ccc1Br)C(=O)Nc1ccccc1C(F)(F)F 725985433 JHUOZQVOSGTYMQ-INIZCTEOSA-N 489.244 5.196 5 20 JKBD O=C(O[C@H](C(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1)c1ccccc1)c1cnc(-c2ccccn2)s1 727890226 JMXTUDZRCXEGOU-FQEVSTJZSA-N 494.916 5.304 5 20 JKBD Cc1nnc(SCc2c(C(=O)OCCc3ccc([N+](=O)[O-])cc3)oc3ccccc23)s1 742957090 QXPRLLVIENVOCT-UHFFFAOYSA-N 455.517 5.193 5 20 JKBD CC1CCN(c2ccc([N+](=O)[O-])cc2C(=O)N(C)C[C@@H]2CCCO[C@@H]2c2ccccc2)CC1 747785062 RIPCYDOELPXPDI-SQJMNOBHSA-N 451.567 5.071 5 20 JKBD O=C(OCC1CCN(c2ccc([N+](=O)[O-])cn2)CC1)/C(=C\c1ccc(F)cc1)c1cccs1 750426791 PCMDJNTWHXKITM-STZFKDTASA-N 467.522 5.191 5 20 JKBD COc1ccccc1N1C(=O)/C(=C/c2ccc(Br)c([N+](=O)[O-])c2)c2ccccc2C1=O 767923969 XFRRTQZZMIWDJS-SFQUDFHCSA-N 479.286 5.094 5 20 JKBD O=C(Nc1ccc(N2CCOCC2)cc1)c1cc([N+](=O)[O-])ccc1Sc1ccc(Cl)cc1 912620354 AMOFHRFLFXNZTP-UHFFFAOYSA-N 469.950 5.488 5 20 JKBD Cc1cc(-c2nnc(COC(=O)c3ccccc3NC(=O)c3ccc([N+](=O)[O-])cc3Cl)o2)c(C)o1 917938786 MVYRTQQCVOPCKU-UHFFFAOYSA-N 496.863 5.117 5 20 JKBD O=C(Nc1ccccc1C(=O)Nc1ccc(-c2csnn2)cc1)c1ccc([N+](=O)[O-])cc1Cl 918754472 JHVZFRYYZJQQEK-UHFFFAOYSA-N 479.905 5.271 5 20 JKBD CC(=O)Nc1cc(C(=O)Nc2cc(Cl)c([N+](=O)[O-])cc2OCc2ccccc2)ccc1F 919683192 YGQCHIKNWVWCDS-UHFFFAOYSA-N 457.845 5.177 5 20 JKBD Cc1c(C(=O)OCC(=O)Nc2ccc([N+](=O)[O-])cc2C(F)(F)F)sc2ccc(F)cc12 920552093 IBIYESPOYGAWAL-UHFFFAOYSA-N 456.373 5.071 5 20 JKBD O=[N+]([O-])c1cccc(/C(O)=C(/C(=S)NCC2CCC2)[n+]2ccc(Cc3ccccc3)cc2)c1 1338396025 MKOANPASQJJPHY-UHFFFAOYSA-O 460.579 5.074 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)c3cc(Cl)ccc3F)CCC2)cc1)c1ccc([N+](=O)[O-])o1 1785748694 KWBVWARYDTVXQU-UHFFFAOYSA-N 457.845 5.042 5 20 JKBD O=C(NC1(c2ccc(NC(=O)[C@H]3C[C@@H]3c3ccccc3)cc2)CCC1)c1nc2cc([N+](=O)[O-])ccc2[nH]1 1791533928 OMZVCLUKWYAXHW-YADHBBJMSA-N 495.539 5.023 5 20 JKBD C[C@@H](Sc1ccccc1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cc3cc([N+](=O)[O-])ccc3s1)C2 1793441115 AEZIYJKOKKXRHI-OQIJWPOYSA-N 495.626 5.242 5 20 JKBD C[C@H](C(=O)N1CCC2(CCCN(C(=O)CCc3cccc([N+](=O)[O-])c3)C2)CC1)c1ccc(Cl)cc1 1806486362 JICONTYVVMWDRG-FQEVSTJZSA-N 498.023 5.216 5 20 JKBD O=C(Cc1cc([N+](=O)[O-])ccc1F)N1CCCC2(CCN(C(=O)[C@@H]3CCC[C@@H]4CCCC[C@H]43)CC2)C1 1806655546 GNXWCJZJOCCMQW-TUACAJSNSA-N 499.627 5.114 5 20 JKBD O=C(CCc1cccc([N+](=O)[O-])c1)N1CCC2(CCCN(C(=O)CCc3ccccc3Cl)C2)CC1 1809354964 XIOPRADGCSZAAP-UHFFFAOYSA-N 498.023 5.045 5 20 JKBD CC[C@H](C(=O)N1CCCC[C@H]1c1cc(NC(=O)CCc2cccc([N+](=O)[O-])c2)n[nH]1)c1ccccc1 1815537171 DPVXLNBCCJNDNV-UPVQGACJSA-N 489.576 5.137 5 20 JKBD Cc1cc(Cl)cc(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)c3ccc([N+](=O)[O-])cc3F)n[nH]2)c1 1821051184 VGVLVPUGUYQXEP-HXUWFJFHSA-N 485.903 5.039 5 20 JKBD O=C(Nc1cc([C@H]2CCCCN2C(=O)CC2CCCC2)[nH]n1)c1cc2cc([N+](=O)[O-])ccc2s1 1821610005 RSOIPCGBXBBIDK-LJQANCHMSA-N 481.578 5.419 5 20 JKBD CC[C@H](C)CC(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cc3cc([N+](=O)[O-])ccc3s2)n[nH]1 1821611004 LFZWRVDKGLOAMZ-KBXCAEBGSA-N 469.567 5.275 5 20 JKBD Cc1ccc(C(=O)N2CCC([C@@H]3CCCCN3C(=O)/C=C/c3ccc([N+](=O)[O-])o3)CC2)cc1Cl 1824275509 BXVNAQGSBLCDLZ-GLJAUCNMSA-N 485.968 5.096 5 20 JKBD Cc1ccc(CCC(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3ccc([N+](=O)[O-])cc3F)CC2)cc1F 1824456014 DLQQIWDOWQOJFI-RUZDIDTESA-N 499.558 5.048 5 20 JKBD O=C(c1cc2ccccc2o1)N1CCC([C@@H]2CCCCN2C(=O)CCc2cccc([N+](=O)[O-])c2)CC1 1824839613 MSZKPDNZAAIMHP-DEOSSOPVSA-N 489.572 5.207 5 20 JKBD CC(C)(C)CC(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cccc(Br)c2[N+](=O)[O-])CC1 1826338893 ZJKRZPNEVRTYRZ-LJQANCHMSA-N 494.430 5.027 5 20 JKBD O=C(NCc1coc(-c2cccs2)n1)c1ccc(NCc2ccccc2Cl)c([N+](=O)[O-])c1 10871708 QNCSWNNQTUXTAR-UHFFFAOYSA-N 468.922 5.507 5 20 JKBD CSc1ccc(C(=O)Nc2cccc(S(=O)(=O)Nc3ccccc3Cl)c2)cc1[N+](=O)[O-] 15437144 ZWLKZNZCKLQASJ-UHFFFAOYSA-N 477.951 5.023 5 20 JKBD CCOc1cc(C(=O)Nc2cc(Cl)cc(Br)c2OCC)c([N+](=O)[O-])cc1OC 22312521 QTYRRPXBCHLVRT-UHFFFAOYSA-N 473.707 5.069 5 20 JKBD O=C(CSc1ccc(C(F)(F)F)cc1[N+](=O)[O-])Nc1ccc(-c2cn3c(n2)CCCC3)cc1 68729070 DVODIRZTHZJMNL-UHFFFAOYSA-N 476.480 5.544 5 20 JKBD O=C1/C(=C\c2ccccc2)N=C(SCCOc2ccccc2[N+](=O)[O-])N1c1ccc(F)cc1 215990307 IXQVRGZSHYCYQO-CAPFRKAQSA-N 463.490 5.290 5 20 JKBD COc1cccc(CCNC(=O)C/C(=C\c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)c1 483765501 ZHLGXPDGPHWAAJ-HMMYKYKNSA-N 473.554 5.503 5 20 JKBD C[C@@H](c1ccccc1F)N(C)C(=O)Cc1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1 498330357 PNBCWTWENKRFRK-SFHVURJKSA-N 458.493 5.349 5 20 JKBD CC[C@H](C)Sc1ccc(NC(=O)CCNC(=O)c2ccc([N+](=O)[O-])cc2)c(C(F)(F)F)c1 499572517 OZFBUCVQNDICLV-ZDUSSCGKSA-N 469.485 5.263 5 20 JKBD C[C@H](Nc1ccc(C(=O)NCCCc2cccc(C(F)(F)F)c2)cc1[N+](=O)[O-])c1ccccn1 507017301 ULRYUEDXANTOGC-INIZCTEOSA-N 472.467 5.544 5 20 JKBD CC[C@@H](C)C(=O)Nc1cccc(CNC(=O)c2ccc(N[C@H](C)c3ccccn3)c([N+](=O)[O-])c2)c1 507367882 MTGXFXPBQYPMAV-QZTJIDSGSA-N 475.549 5.078 5 20 JKBD CCOc1cc(CN[C@H]2CCc3c(Cl)cccc32)ccc1OCCn1c([N+](=O)[O-])cnc1C 507934101 UQOKSGRBVJYGOB-NRFANRHFSA-N 470.957 5.008 5 20 JKBD CSc1cc2c(cc1NC(=O)c1cc([N+](=O)[O-])ccc1Sc1ccccc1)OCCO2 509287576 HYQGAXRRIGFJNG-UHFFFAOYSA-N 454.529 5.491 5 20 JKBD COc1cc(C(=O)N2CCCCC[C@@H]2c2ccccc2)c([N+](=O)[O-])cc1OCc1cscn1 512318965 FABOQIJJPQQSHV-HXUWFJFHSA-N 467.547 5.396 5 20 JKBD COc1ccc([N+](=O)[O-])cc1NC(=O)[C@@H](C)Nc1ccc(Oc2ccc(C)cc2OC)c(F)c1 512544269 LOBLGRIUPBKXTJ-OAHLLOKOSA-N 469.469 5.291 5 20 JKBD Cc1ccc(Sc2ccc(C(=O)Nc3cc(C(N)=O)ccc3N3CCCC3)cc2[N+](=O)[O-])cc1 514706118 FBJDSENXCOMEEW-UHFFFAOYSA-N 476.558 5.006 5 20 JKBD Cc1cc(-c2cc(C(=O)Nc3cc([N+](=O)[O-])ccc3OC(F)F)c3cnn(C(C)C)c3n2)c(C)o1 515098270 BCAAQMKFTYJRID-UHFFFAOYSA-N 485.447 5.651 5 20 JKBD CC[C@@H](C)NC(=O)c1ccc(NC(=O)CSc2ccc(C(F)(F)F)cc2[N+](=O)[O-])c(C)c1 520592438 PHOFBIPUQFHZCT-CYBMUJFWSA-N 469.485 5.181 5 20 JKBD Cc1csc(Sc2ccc(C(=O)NCCc3nc(-c4ccncc4)cs3)cc2[N+](=O)[O-])n1 523225099 QVZJVUKUONOYKG-UHFFFAOYSA-N 483.600 5.002 5 20 JKBD O=C(c1c2c(nc3ccccc13)/C(=C/c1cccc([N+](=O)[O-])c1)CCC2)N1CCC[C@@H](c2ncc[nH]2)C1 524339992 KJHAVUSCYRYGEE-ICFXLVBESA-N 493.567 5.763 5 20 JKBD CS(=O)(=O)c1ccc(-c2nc(COc3ccc([N+](=O)[O-])cc3Cc3ccccc3)cs2)cc1 524458237 NIRHOKVVWJLYIQ-UHFFFAOYSA-N 480.567 5.292 5 20 JKBD C[C@@H](c1nnc(SCc2nc(-c3ccc([N+](=O)[O-])cc3)no2)n1-c1ccccc1)N1CCCCC1 603748170 DELHBXHRCPOAHX-KRWDZBQOSA-N 491.577 5.065 5 20 JKBD Cc1ccccc1CN1CCC(N[C@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2ccccc2)CC1 604045785 UFYKCLFUXKDUSW-SANMLTNESA-N 493.007 5.491 5 20 JKBD O=C(c1cc([N+](=O)[O-])ccc1Sc1ccccc1)N1C[C@H](C(F)(F)F)C[C@@H](C(F)(F)F)C1 604257696 LWBQECJNRSHDTF-CHWSQXEVSA-N 478.414 5.949 5 20 JKBD C[C@@H](Nc1ccc(C(=O)Nc2cc(C3CC3)nn2-c2ccccc2)cc1[N+](=O)[O-])c1ccccn1 608963013 FQRNPJYVCFITOH-QGZVFWFLSA-N 468.517 5.478 5 20 JKBD CSc1ccc([N+](=O)[O-])c(C(=O)N[C@H]2c3cc(Br)ccc3SC[C@H]2C)c1 609219118 GSMFGUHUHBHDFG-BMLIUANNSA-N 453.383 5.292 5 20 JKBD COc1ccc(-c2cc3[nH]c(/C(Cl)=C\c4ccc(Cl)c([N+](=O)[O-])c4)nc(=O)c3s2)cc1 797247357 PNEQZZQQADAKCA-OVCLIPMQSA-N 474.325 5.959 5 20 JKBD Cc1oc(-c2cccs2)nc1CN(c1ccccc1)S(=O)(=O)c1ccc(Cl)c([N+](=O)[O-])c1 818215051 VMPLEEKBUHQRTC-UHFFFAOYSA-N 489.962 5.669 5 20 JKBD COc1ccc(-c2nn(Cc3ccccc3)cc2C(=O)Nc2cc([N+](=O)[O-])c(F)cc2F)cc1 825487620 GEXGAGZULGUNIC-UHFFFAOYSA-N 464.428 5.046 5 20 JKBD C[C@@H]1C[C@@H](C)CN(c2ccc(-c3nc([C@@H]4CCC(=O)N(CC5CCCC5)C4)no3)cc2[N+](=O)[O-])C1 856582792 VWBYWMMDBZCNFB-DBXWQHBBSA-N 481.597 5.023 5 20 JKBD CN(Cc1ccccc1[N+](=O)[O-])C(=O)c1ccc(NCc2ccccc2Cl)c([N+](=O)[O-])c1 914729067 SJASKJITUOLWDJ-UHFFFAOYSA-N 454.870 5.041 5 20 JKBD CC1=C(C(=O)Nc2ccc([N+](=O)[O-])cc2)[C@H](c2cccs2)NC(=S)N1c1ccccc1 916160406 JYBPATJBKBNMLD-FQEVSTJZSA-N 450.545 5.005 5 20 JKBD COc1cccc(SCC(=O)O[C@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2ccccc2)c1 917290900 AZXXAECRCKUOHZ-QFIPXVFZSA-N 486.933 5.272 5 20 JKBD O=C(/C=C/c1ccc([N+](=O)[O-])o1)Nc1ccc(C2(NC(=O)c3ccoc3C(F)(F)F)CCC2)cc1 1786204772 RWXVKLYQSVAMTQ-SOFGYWHQSA-N 489.406 5.261 5 20 JKBD O=C(Cn1ccc2ccc([N+](=O)[O-])cc21)Nc1ccc(C2(NC(=O)c3ccoc3Cl)CCC2)cc1 1786277025 AFJAWJQDJLFOQU-UHFFFAOYSA-N 492.919 5.244 5 20 JKBD Cc1ccc(CC(=O)NC2(c3ccc(NC(=O)c4cc5sccn5c4)cc3)CCC2)cc1[N+](=O)[O-] 1788411964 BNLBUBHDJZMZJJ-UHFFFAOYSA-N 488.569 5.208 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)NC1(c2ccc(NC(=O)c3ccc4cccnc4n3)cc2)CCC1 1789246153 RNXIOACQTFDBLI-UHFFFAOYSA-N 499.502 5.047 5 20 JKBD CC1(C(=O)N2CC[C@@H](CNC(=O)c3cc4cc([N+](=O)[O-])ccc4s3)[C@@H]2c2cccnc2)CCCC1 1812304866 VJQGPBYBROZLMI-MBSDFSHPSA-N 492.601 5.104 5 20 JKBD CC(C)[C@H](C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cccc(F)c2[N+](=O)[O-])[nH]n1)c1ccccc1 1814931830 QPRQWCVJOATSQG-GMAHTHKFSA-N 493.539 5.203 5 20 JKBD CC(C)(C)c1ccc(C(=O)Nc2cc([C@H]3CCCCN3C(=O)c3ccc(O)c([N+](=O)[O-])c3)[nH]n2)s1 1818342831 BRNXATNOBNDEGR-MRXNPFEDSA-N 497.577 5.002 5 20 JKBD Cc1oc(C(C)(C)C)cc1C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cc(F)cc([N+](=O)[O-])c2)n[nH]1 1821164082 JZYBPWPJTJSJFD-FQEVSTJZSA-N 497.527 5.276 5 20 JKBD C[C@]1(C(=O)N2CCC([C@@H]3CCCCN3C(=O)Cc3ccc(Cl)cc3[N+](=O)[O-])CC2)CC=CCC1 1824159125 SODXDRCZUGMABV-NVQXNPDNSA-N 488.028 5.157 5 20 JKBD Cc1ccc(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)CCCc3cc(C)c(F)cc3[N+](=O)[O-])CC2)o1 1824679881 FRCJITPKXXYASX-HSZRJFAPSA-N 499.583 5.200 5 20 JKBD O=C(c1cccc2ccoc12)N1CCC([C@H]2CCCCN2C(=O)c2cc(F)cc([N+](=O)[O-])c2)CC1 1830617947 GMECPILUWFEMTI-HSZRJFAPSA-N 479.508 5.027 5 20 JKBD CC(C)c1ccc(C(=O)N2CCCC23CN(C(=O)c2cc4cc([N+](=O)[O-])ccc4s2)C3)cc1 1844950762 BPJBWXJDNAJNMX-UHFFFAOYSA-N 463.559 5.064 5 20 JKBD CCOc1ccc(Oc2ccc(NC(=O)c3cc(OC)c(OC(F)F)cc3[N+](=O)[O-])cc2)cc1 10962884 ORMPCLRZWSQJKO-UHFFFAOYSA-N 474.416 5.648 5 20 JKBD CN(CC(=O)Nc1ccccc1Cl)C(=O)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1 15388562 VZEWHJQGTVGUKO-UHFFFAOYSA-N 474.300 5.405 5 20 JKBD O=C(COC(=O)c1cn(Cc2ccccc2)c2ccccc12)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 16403019 RHPJXZUQSCTMPP-UHFFFAOYSA-N 497.429 5.412 5 20 JKBD COc1cc(CC(=O)O[C@@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2ccccc2)ccc1C 26246865 YRUBWAPHZVKANL-HSZRJFAPSA-N 468.893 5.031 5 20 JKBD O=C(c1cc([N+](=O)[O-])ccc1Sc1ccccc1)N1CCC(c2nc3ccccc3[nH]2)CC1 27998310 POWBKLHDINPYKV-UHFFFAOYSA-N 458.543 5.642 5 20 JKBD COc1ccc(Oc2ccc([N+](=O)[O-])cc2C(=O)Nc2cc(OC)c(Cl)cc2OC)cc1 33155499 YQWNLBFTPXZICU-UHFFFAOYSA-N 458.854 5.319 5 20 JKBD CC(=O)Nc1ccc(Cl)c(NC(=O)c2ccc(Sc3ccc(C)cc3)c([N+](=O)[O-])c2)c1 71987579 PYWOZGRXHOVDQC-UHFFFAOYSA-N 455.923 5.919 5 20 JKBD O=C(C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)N1CC[C@@H](c2ccccc2F)C1 410290405 RLRVCLAGXROKNR-NGYXKBBWSA-N 487.556 6.290 5 20 JKBD COc1cc(C(=O)Nc2ccc3nc(C(C)(C)C)[nH]c3c2)c([N+](=O)[O-])cc1OCc1cscn1 476182071 ZTCAZPXPHTVMBQ-UHFFFAOYSA-N 481.534 5.065 5 20 JKBD CC[C@H](C)Sc1ccc(NC(=O)c2nnn(-c3cccc([N+](=O)[O-])c3)c2C)c(C(F)(F)F)c1 499595628 SZBAMFMFBXDUHM-LBPRGKRZSA-N 479.484 5.646 5 20 JKBD COc1ccc(N(C(=O)c2ccc(N[C@@H](C)c3ccccn3)c([N+](=O)[O-])c2)[C@@H](C)C2CC2)cc1 499600650 YTFYPYZCWZELJP-ROUUACIJSA-N 460.534 5.617 5 20 JKBD C[C@H](Nc1ccc(C(=O)N2CCC[C@H]2Cc2c(F)cccc2Cl)cc1[N+](=O)[O-])c1ccccn1 507388450 KAWYBGBJTOCBGC-WMZOPIPTSA-N 482.943 5.803 5 20 JKBD Cc1ccc(C)n1C1CCN(C(=O)c2ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])cc2)CC1 509955199 FLOPCZIFHWWSSK-UHFFFAOYSA-N 453.926 5.936 5 20 JKBD COCCN(C(=O)[C@H](C)Oc1cccc(Cl)c1Cl)c1nc(-c2ccc([N+](=O)[O-])cc2)cs1 518171377 RNJYMTRHCKNQLB-ZDUSSCGKSA-N 496.372 5.472 5 20 JKBD CCOc1ccc(Oc2ccc(Cl)cc2NC(=O)c2cc(OC)c(OC)cc2[N+](=O)[O-])cc1 600819206 RJWYCHVIDHVGJK-UHFFFAOYSA-N 472.881 5.709 5 20 JKBD COc1cccc(/C=C2\CCc3c2nc2ccccc2c3C(=O)N(C)c2ccc([N+](=O)[O-])cc2)c1OC 603565952 IBGIIQNWQWMQGY-ISLYRVAYSA-N 495.535 5.924 5 20 JKBD COc1ccc(Oc2ccc([N+](=O)[O-])cc2C(=O)Nc2cc(NC(C)=O)ccc2Cl)cc1 604013589 RYEJPSDYRGDVOT-UHFFFAOYSA-N 455.854 5.260 5 20 JKBD C[C@H](NC(=O)N(C)Cc1cn(-c2ccccc2)nc1-c1ccccc1)c1cccc([N+](=O)[O-])c1 604126733 UPPWUNIZWGLVNG-IBGZPJMESA-N 455.518 5.350 5 20 JKBD C[C@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)NCc1ccccc1COCc1ccccc1 604442899 USXZJMRYTRVCHU-KRWDZBQOSA-N 454.910 5.049 5 20 JKBD C[C@H]1C[C@@H](C)CN(c2ccc(C(=O)N(C)C[C@@H]3CCCO[C@H]3c3ccccc3)cc2[N+](=O)[O-])C1 604519058 HJGXFQNCADGILO-QEUIGEMPSA-N 465.594 5.317 5 20 JKBD CC(C)C[C@H](NC(=O)C(=O)Nc1cc([N+](=O)[O-])ccc1OC(F)F)c1cccc(C(F)(F)F)c1 608865387 KUHGWIUVBBPUAX-HNNXBMFYSA-N 489.397 5.057 5 20 JKBD C[C@H]([C@@H]1C[C@H]2CC[C@H]1C2)n1c(SCC(=O)N(C)c2ccc([N+](=O)[O-])cc2)nnc1-c1ccco1 619816341 DRPKITYFGFLMSY-YLAKUSLOSA-N 481.578 5.199 5 20 JKBD Cc1ccc(Oc2ccccc2NC(=O)COC(=O)c2cc([N+](=O)[O-])ccc2Br)cc1 725984841 MDHFWAKUYJSLOP-UHFFFAOYSA-N 485.290 5.254 5 20 JKBD C[C@@H](OC(=O)c1csc(-c2ccccc2Cl)n1)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 727562362 AHWPYQVMYYMSDU-SNVBAGLBSA-N 499.854 5.575 5 20 JKBD Cc1ccc(C(=O)Nc2nc3ccc(NC(=O)c4cc([N+](=O)[O-])ccc4F)cc3s2)s1 729178608 ORVYBWDKNAKZOV-UHFFFAOYSA-N 456.480 5.218 5 20 JKBD C[C@H](OC(=O)[C@H]1C[C@H]1c1cccc2ccccc12)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 730872049 CBANBQYAIFJZCR-AGRHKRQWSA-N 472.419 5.441 5 20 JKBD Cn1c2ccccc2c2cc(C(=O)OCC(=O)Nc3ccc([N+](=O)[O-])cc3C(F)(F)F)sc21 762206559 FHOBNGCXNBXUIG-UHFFFAOYSA-N 477.420 5.116 5 20 JKBD CC(=O)N(c1ccc(Cl)c(Cl)c1)c1nc(COC(=O)c2ccc([N+](=O)[O-])c(C)c2)cs1 792242268 QAAAYZKUAROYTE-UHFFFAOYSA-N 480.329 5.708 5 20 JKBD O=[N+]([O-])c1ccc(Sc2nnc(Cc3cccs3)n2CCc2ccccc2)c([N+](=O)[O-])c1 799721320 BEVMJDXOXRPSJS-UHFFFAOYSA-N 467.532 5.141 5 20 JKBD COc1cccc([C@@H](CNC(=O)c2ccc(Cl)c([N+](=O)[O-])c2)c2c[nH]c3ccccc23)c1OC 912663979 GQZSEXSYFVKBJX-LJQANCHMSA-N 479.920 5.309 5 20 JKBD CC(C)c1c(C(=O)O[C@@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)cnn1-c1ccc(F)cc1 914670320 YJTDPKCLISIALZ-AWEZNQCLSA-N 465.441 5.011 5 20 JKBD O=C(Nc1ccc(-c2nnc3n2CCCCCC3)cc1)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-] 915836606 IPVDWIHCRSOCDY-UHFFFAOYSA-N 489.454 5.163 5 20 JKBD CC(=O)Nc1cccc(Nc2nn(CN(Cc3ccc([N+](=O)[O-])cc3)C(C)C)c(=S)s2)c1 919950464 OEFFMMVGHWOSRT-UHFFFAOYSA-N 472.596 5.152 5 20 JKBD COc1ccc([C@H](Cc2ccc(F)cc2)N[C@H](C)C(=O)Nc2cc([N+](=O)[O-])ccc2Cl)cc1 921065405 ACYKWAYAKYVXPQ-QRQCRPRQSA-N 471.916 5.297 5 20 JKBD O=C(Cc1cc([N+](=O)[O-])ccc1F)NC1(c2ccc(NC(=O)[C@H]3CCCCC3(F)F)cc2)CCC1 1786463068 YIEXWZLWEMGRRC-HXUWFJFHSA-N 489.494 5.236 5 20 JKBD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc2cc([N+](=O)[O-])ccc2s1)c1c(F)cccc1Cl 1801206866 BRPUPYWUFHDWKC-QDMKHBRRSA-N 487.940 5.168 5 20 JKBD CC(C)[C@@H](C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cccc(F)c2[N+](=O)[O-])n[nH]1)c1ccccc1 1821167209 FRCLYXBNQVQWSQ-FYYLOGMGSA-N 493.539 5.203 5 20 JKBD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2ccc([N+](=O)[O-])o2)[nH]n1)c1ccc(-c2ccccc2)cc1 1823287194 PPZFEGIBQYGWJW-NRFANRHFSA-N 485.500 5.198 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cc3[nH]ccc3s2)CC1 1828335461 XQCRDIUJQHNBPN-HXUWFJFHSA-N 498.580 5.132 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2ccccc2Cl)CC1 1829895256 NNSGBOZYABVTHN-QFIPXVFZSA-N 487.959 5.243 5 20 JKBD CCCOc1ccc(C(=O)N2CCCC[C@H]2C2CCN(C(=O)c3ccc([N+](=O)[O-])cc3F)CC2)cc1 1830102268 CRNCSGBZQSQPNG-VWLOTQADSA-N 497.567 5.070 5 20 JKBD Cc1c(C(=O)N2CCCC[C@H]2C2CCN(C(=O)/C=C/c3ccco3)CC2)cc(Cl)cc1[N+](=O)[O-] 1830734556 NEGUJBVHANDCHX-DORXLWPQSA-N 485.968 5.096 5 20 JKBD Cc1cc(C)nc(C(=O)N2CCC([C@@H]3CCCCN3C(=O)c3cc(Cl)cc([N+](=O)[O-])c3C)CC2)c1 1830736638 XVTMYYMMKNGALG-QHCPKHFHSA-N 499.011 5.116 5 20 JKBD Cc1cccc(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)/C=C/c3ccc([N+](=O)[O-])o3)CC2)c1Cl 1832604873 XCNBFOBIWFUDGL-ZQAUEJBPSA-N 485.968 5.096 5 20 JKBD O=C(OCc1nnc(-c2ccc([N+](=O)[O-])cc2)o1)c1cc2sc(Nc3ccccc3)nc2s1 10712194 HNXQWPWLSKEPFV-UHFFFAOYSA-N 479.499 5.417 5 20 JKBD CCc1ccccc1N(C(C)=O)c1nc(COC(=O)c2ccc(NC3CC3)c([N+](=O)[O-])c2)cs1 11227004 LQRVJUSMNDWDOA-UHFFFAOYSA-N 480.546 5.230 5 20 JKBD C[C@H](Sc1nnc(-c2c[nH]c3ccccc23)n1C1CC1)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 17883494 IIFUMJSDEIQPSX-ZDUSSCGKSA-N 473.518 5.573 5 20 JKBD Cc1ccc(-c2cnc(-c3ccccc3C(=O)OCC(=O)Nc3ccccc3[N+](=O)[O-])o2)cc1 24211195 NHZJNEIPGADJHQ-UHFFFAOYSA-N 457.442 5.021 5 20 JKBD CS(=O)(=O)Nc1cc(NC(=O)c2cc([N+](=O)[O-])ccc2Sc2ccc(Cl)cc2)ccc1F 26288270 JXEDRLARWVEJFM-UHFFFAOYSA-N 495.941 5.162 5 20 JKBD Cc1occc1-c1nnc(SCc2nc(-c3ccc([N+](=O)[O-])cc3)no2)n1-c1ccccc1 46864871 MPKMSTVREUULSM-UHFFFAOYSA-N 460.475 5.086 5 20 JKBD Cc1nn(C(C)(C)C)c2nc(C3CC3)cc(C(=O)Nc3nc(-c4cccc([N+](=O)[O-])c4)cs3)c12 69640670 MHCSJBOQSMRSCL-UHFFFAOYSA-N 476.562 5.656 5 20 JKBD COc1cccc(-c2nnc(Sc3ccc(Br)cc3[N+](=O)[O-])n2Cc2ccco2)c1 110453930 MZFUTSYBUPVYMR-UHFFFAOYSA-N 487.335 5.417 5 20 JKBD COc1ccc([C@H](NC(=O)N[C@H](C)c2cccc([N+](=O)[O-])c2)c2ccccc2)cc1Br 490268201 CNWFIMMUJPACRS-IVZQSRNASA-N 484.350 5.516 5 20 JKBD CCc1cccc2c(C3CCN(C(=O)c4csc(-c5ccc([N+](=O)[O-])cc5)n4)CC3)c[nH]c12 497503620 LKGVTCSDYFXILS-UHFFFAOYSA-N 460.559 5.782 5 20 JKBD Cc1ccc(Sc2ccc(C(=O)N3CCC(NC(=O)c4ccc(F)cc4)CC3)cc2[N+](=O)[O-])cc1 499332578 YVWMCIOUPHPWCE-UHFFFAOYSA-N 493.560 5.228 5 20 JKBD Cc1csc(Sc2ccc(C(=O)Nc3ccc(OC[C@H]4CCCO4)cc3)cc2[N+](=O)[O-])n1 502030936 WKVYLTISLRKSOU-GOSISDBHSA-N 471.560 5.321 5 20 JKBD O=C(Nc1nnc(-c2ccccn2)s1)c1cc([N+](=O)[O-])ccc1Sc1ccc(Cl)cc1 502859906 KXAZLBKHUXRBLA-UHFFFAOYSA-N 469.935 5.565 5 20 JKBD O=C(Nc1cccc(NC(=O)c2c[nH]c3cc([N+](=O)[O-])ccc23)c1)c1cccc(C(F)(F)F)c1 505772477 SKKNEJWHWJBUDK-UHFFFAOYSA-N 468.391 5.600 5 20 JKBD CCN(Cc1cccc(Br)c1)C(=O)c1ccc(N[C@H](C)c2ccccn2)c([N+](=O)[O-])c1 506209292 ZAAVJIFKJOHXMR-MRXNPFEDSA-N 483.366 5.588 5 20 JKBD CC(C)(C)c1ccc(Oc2ccc(CNc3ccnn3C[C@H]3CCOC3)cc2[N+](=O)[O-])cc1 517550881 QEUSDYHJTQZNFD-LJQANCHMSA-N 450.539 5.530 5 20 JKBD Cc1ccc(C)c(Oc2ccc(CNC(=O)c3ccc(N[C@@H](C)c4ccccn4)c([N+](=O)[O-])c3)cn2)c1 517575308 JERSFHQJVZCBGZ-FQEVSTJZSA-N 497.555 5.897 5 20 JKBD O=C(N[C@@H]1CCCc2nc(-c3ccc(F)cc3)sc21)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-] 520566291 NUDNIPZTBPPWJC-MRXNPFEDSA-N 495.454 5.606 5 20 JKBD Cc1ccc(Sc2ccc(CNCc3cccc(CN4CCCC4=O)c3)cc2[N+](=O)[O-])cc1 556191881 VZJPLDXDNMRUOQ-UHFFFAOYSA-N 461.587 5.467 5 20 JKBD COCCN(C(=O)[C@H]1C[C@H]1c1ccccc1C(F)(F)F)c1nc(-c2ccc([N+](=O)[O-])cc2)cs1 589197815 BOHWEWVPLQYZLK-ROUUACIJSA-N 491.491 5.520 5 20 JKBD NC(=O)Nc1cccc(NC(=O)C/C(=C\c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)c1 599770221 HLDDPDWGBAUZMA-FOWTUZBSSA-N 473.514 5.265 5 20 JKBD CNC(=O)Nc1cccc(NC(=O)c2ccccc2Sc2ccc(C(F)(F)F)cc2[N+](=O)[O-])c1 599779005 NJQGHIDDPWAXQZ-UHFFFAOYSA-N 490.463 5.768 5 20 JKBD Cc1ccc(-n2c(S[C@H](C)c3nnc(-c4ccc([N+](=O)[O-])cc4)o3)nnc2-c2ccccn2)c(C)c1 603918386 RQFGCPBMAHYDLY-QGZVFWFLSA-N 499.556 5.758 5 20 JKBD C[C@@H]1CCC[C@@H](C)N1C(=O)c1cc(Cl)ccc1NCc1nc(-c2cccc([N+](=O)[O-])c2)no1 604010099 NOMWLDSIFIEOHL-HUUCEWRRSA-N 469.929 5.313 5 20 JKBD CCCC(=O)Nc1cccc(N[C@@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2ccccc2)c1 604044323 IBOCLFVABDOIGV-HSZRJFAPSA-N 466.925 5.779 5 20 JKBD COc1cc(C(=O)N[C@@H](c2ccc(C(C)(C)C)cc2)C(F)(F)F)c([N+](=O)[O-])cc1OC(F)F 604257471 NBVZZYBAEDSWPE-KRWDZBQOSA-N 476.398 5.536 5 20 JKBD CN(C(=O)C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)c1ccc(F)c(F)c1 604343393 HJOOTMOYDUNXLV-VBKFSLOCSA-N 465.481 6.076 5 20 JKBD C[C@H](Nc1ccc(C(=O)N(CCc2ccccc2)C2CCCC2)cc1[N+](=O)[O-])c1ccccn1 604491470 NIRRZFYPTUMLOG-FQEVSTJZSA-N 458.562 5.790 5 20 JKBD COc1ccccc1CN(C(=O)CCn1nc(C)c([N+](=O)[O-])c1C)c1cc(Cl)cc(Cl)c1 608804612 SDYJAXZTGHOVDC-UHFFFAOYSA-N 477.348 5.347 5 20 JKBD COc1cc(C(=O)N2CCO[C@@H](c3cccc(F)c3)C2)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 608965113 QONVAGRSCBKPGV-HSZRJFAPSA-N 486.883 5.402 5 20 JKBD Cc1ccc(C(=O)N2CCC(NCc3ccc(-c4ccc([N+](=O)[O-])cc4Br)o3)CC2)cc1 608983305 WMEKQOFURPDHAI-UHFFFAOYSA-N 498.377 5.320 5 20 JKBD CCc1cc[n+](/C(C(=S)Nc2ccc(OC)c(Cl)c2)=C(/O)c2ccc([N+](=O)[O-])cc2)cc1 726961935 MTJLYOCKNGRQQY-UHFFFAOYSA-O 470.958 5.430 5 20 JKBD CCCc1cc[n+](/C(C(=S)Nc2ccc(OC)c(Cl)c2)=C(/O)c2ccc(C)c([N+](=O)[O-])c2)cc1 726963022 XHEAJFPCOZRXBI-UHFFFAOYSA-O 499.012 6.129 5 20 JKBD C[C@H](CC(=O)Nc1cc(Cl)c([N+](=O)[O-])cc1OCc1ccccc1)NC(=O)C1CCCCC1 727298023 QKCXIDABDVNDCM-MRXNPFEDSA-N 473.957 5.241 5 20 JKBD O=C(c1c2c(nc3ccccc13)/C(=C\c1cccc([N+](=O)[O-])c1)CCC2)N1CCC[C@H](C2OCCO2)C1 729361300 VIHGXWNGFUHPCD-LDETYFQJSA-N 499.567 5.245 5 20 JKBD Cc1ccccc1N(C(=O)c1ccc(OS(=O)(=O)c2cc([N+](=O)[O-])ccc2C)cc1)C(C)C 729831741 CDDUZSIVOWUDNP-UHFFFAOYSA-N 468.531 5.035 5 20 JKBD O=C(OCc1cc(=O)c(O)co1)c1c2c(nc3ccccc13)/C(=C/c1cccc([N+](=O)[O-])c1)CCC2 746839816 DSSJAUGPELHGMV-GZTJUZNOSA-N 484.464 5.036 5 20 JKBD Cc1cc(=O)oc2cc(OCc3ccc(C(=O)N[C@@H](C)c4cccc([N+](=O)[O-])c4)cc3)ccc12 917702463 VLFVDOFOQSODDS-KRWDZBQOSA-N 458.470 5.080 5 20 JKBD O=[N+]([O-])c1c(F)cccc1S(=O)(=O)Nc1ccc(Oc2ncc(Cl)cc2Cl)cc1 918398758 AILOFUDUXXIPFE-UHFFFAOYSA-N 458.254 5.029 5 20 JKBD C[C@H](OC(=O)[C@H](C)SCc1ncc(-c2ccc(Cl)cc2)o1)C(=O)Nc1ccc([N+](=O)[O-])cc1 920671053 KNXIHNWCHAUVPP-KBPBESRZSA-N 489.937 5.095 5 20 JKBD O=C(/C=C/c1ccc([N+](=O)[O-])o1)Nc1ccc(C2(NC(=O)[C@H]3C[C@H]3c3ccccc3)CCC2)cc1 1786208073 IZZVGPNHOXJWBY-FAKVZGHMSA-N 471.513 5.139 5 20 JKBD Cc1nc(C(=O)Nc2ccc(C3(NC(=O)CCc4cccc([N+](=O)[O-])c4)CCC3)cc2)sc1C 1789982108 QTWXLUHYZOYAGN-UHFFFAOYSA-N 478.574 5.049 5 20 JKBD COc1cc(C(=O)Nc2ccc(C3(NC(=O)C4(C)CCCCC4)CCC3)cc2)c([N+](=O)[O-])cc1O 1790085096 KYRICJFDTRCZDC-UHFFFAOYSA-N 481.549 5.027 5 20 JKBD CC(C)c1ccc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)C2(c4cccc([N+](=O)[O-])c4)CCC2)C3)cc1 1799711507 XFBKPXMNZCTWRB-BKFWDETESA-N 475.589 5.092 5 20 JKBD Cc1cc(CCCC(=O)N2CCCC3(CCN(C(=O)[C@H]4CCC[C@@H]4C)CC3)C2)c([N+](=O)[O-])cc1F 1805821572 WFXYEZDNZVCLNY-UGKGYDQZSA-N 487.616 5.032 5 20 JKBD C[C@H](CC(=O)N1CCCC[C@H]1c1cc(NC(=O)CCc2cccc([N+](=O)[O-])c2)n[nH]1)c1ccccc1 1815538438 JRLKKDRYUPPXLY-DVECYGJZSA-N 489.576 5.137 5 20 JKBD C/C(=C\c1cccs1)C(=O)N1CCC([C@@H]2CCCCN2C(=O)Cc2ccc([N+](=O)[O-])cc2F)CC1 1831290528 ICYAIEAKBJOTJG-UFIOJNINSA-N 499.608 5.061 5 20 JKBD Cc1ccc(C(=O)N2CCC([C@H]3CCCCN3C(=O)CSc3ccccc3[N+](=O)[O-])CC2)c(F)c1 1831777294 NZRIZEPRBJGKHH-JOCHJYFZSA-N 499.608 5.068 5 20 JKBD Cc1ccc([C@@H](C)C(=O)N2CCC([C@@H]3CCCCN3C(=O)Cc3cc(F)ccc3[N+](=O)[O-])CC2)cc1 1832888116 FJMZFVWIPCRPSF-NLFFAJNJSA-N 495.595 5.008 5 20 JKBD Cc1csc(Sc2ccc(C(=O)N[C@@H](C)c3nc4ccccc4n3C(F)F)cc2[N+](=O)[O-])n1 9758969 DAZSONQRRZECGE-LBPRGKRZSA-N 489.529 5.747 5 20 JKBD Cc1c(C(=O)Nc2ccc(NS(=O)(=O)c3c(Cl)cccc3Cl)cc2)cccc1[N+](=O)[O-] 11325544 QNTHXAGFOXCZSF-UHFFFAOYSA-N 480.329 5.263 5 20 JKBD CCN(CC)c1ccc(-c2nnc(S[C@@H](C)C(=O)Nc3ccc([N+](=O)[O-])cc3Cl)o2)cc1 22003064 RBOGYIMKFWQZDT-ZDUSSCGKSA-N 475.958 5.264 5 20 JKBD Cc1nnc(COC(=O)c2c3c(nc4ccccc24)/C(=C/c2cccc([N+](=O)[O-])c2)CCC3)o1 23544354 SRXAFYQRNHKLRE-SFQUDFHCSA-N 456.458 5.068 5 20 JKBD Cc1c(NC(=O)[C@@H](C)Sc2nnc(-c3ccc(F)cc3)n2Cc2ccccc2)cccc1[N+](=O)[O-] 23602844 RYLUCJKYTMCDDU-QGZVFWFLSA-N 491.548 5.468 5 20 JKBD CN(Cc1cc([N+](=O)[O-])ccc1Cl)Cn1nc(CN2CCCCC2)n(-c2ccccc2)c1=S 27533470 URDOPVJTDRSMKE-UHFFFAOYSA-N 487.029 5.040 5 20 JKBD Cc1ccc(-n2c(SCc3nnc(-c4ccc([N+](=O)[O-])cc4)o3)nnc2-c2ccccc2)cc1C 29816085 FYJOIKBQAHUAFV-UHFFFAOYSA-N 484.541 5.802 5 20 JKBD Cc1ccccc1-n1nc(C)c(CN(C)C(=O)c2csc(-c3ccc([N+](=O)[O-])cc3)n2)c1C 303000834 HKLLYMFRFPSSLD-UHFFFAOYSA-N 461.547 5.101 5 20 JKBD CC(C)N(Cc1cccnc1)C(=O)C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1 488641669 LFFFFPWFUOGWNJ-KGENOOAVSA-N 472.570 5.967 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Cl)[C@@H](N[C@@H](CN1CCCC1)c1ccccc1)c1ccccc1 493536737 LVMURQOGZQUUNO-DQEYMECFSA-N 478.980 5.355 5 20 JKBD COc1ccc(F)cc1-c1csc(NC(=O)c2csc(-c3cccc([N+](=O)[O-])c3)n2)n1 496241838 CNMMQNGEROSTJQ-UHFFFAOYSA-N 456.480 5.242 5 20 JKBD COc1ccc(Oc2ccc([N+](=O)[O-])cc2C(=O)Nc2cccc(CN3CCCCC3=O)c2)cc1 497320045 JAZLOJLEZFHEGU-UHFFFAOYSA-N 475.501 5.161 5 20 JKBD COc1cc(C(=O)N(C)Cc2ccccc2-c2ccccc2)c([N+](=O)[O-])cc1OCc1cscn1 506557823 XQEBPWLQUNAMSN-UHFFFAOYSA-N 489.553 5.578 5 20 JKBD COCCOc1ccc(NC(=O)C/C(=C/c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)cn1 506777458 HMKKHIQBISDUOA-JXAWBTAJSA-N 490.541 5.194 5 20 JKBD CN(c1ccccc1)c1ccc(CNCc2ccc(NC(=O)c3ccco3)cc2)cc1[N+](=O)[O-] 507942227 QMHZWTOOOSRVSI-UHFFFAOYSA-N 456.502 5.498 5 20 JKBD CCN(C(=O)NCc1ccc([N+](=O)[O-])cc1)[C@@H]1CCSc2ccc(Br)cc21 508109583 LOGKUXWMENMVBL-QGZVFWFLSA-N 450.358 5.126 5 20 JKBD CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccccc1C(=O)N1C[C@@H](C)C[C@H](C)C1 509249004 VNWSSQMLXGREHI-OALUTQOASA-N 452.555 5.155 5 20 JKBD Cc1ccc(-c2csc(NC(=O)c3cc(OCC(F)(F)F)ccc3[N+](=O)[O-])n2)cc1C 512123764 QNKFYZZTJVGHSR-UHFFFAOYSA-N 451.426 5.529 5 20 JKBD COCCN(C(=O)c1ccc(N2CCCC2)c([N+](=O)[O-])c1)[C@@H](C)c1cccc(C(F)(F)F)c1 514534835 HUCSWIHCNXPWGW-INIZCTEOSA-N 465.472 5.064 5 20 JKBD Cc1ccc(NC(=O)Cc2cn(-c3ccccc3)nc2-c2ccc([N+](=O)[O-])cc2)cc1C(=O)NC(C)C 517482596 NXSGVFPUFFFMNI-UHFFFAOYSA-N 497.555 5.075 5 20 JKBD CC(C)COC1CCN(C(=O)c2ccccc2Sc2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 520017135 QTKGJKGPHUNUHL-UHFFFAOYSA-N 482.524 6.042 5 20 JKBD COc1ccc([N+](=O)[O-])cc1NC(=O)[C@H](Oc1ccc(F)cc1Br)c1ccccc1 520765237 XUWJVPQCZHLNKD-HXUWFJFHSA-N 475.270 5.264 5 20 JKBD COc1cc(C)ccc1Oc1ccc(NC(=O)c2ccc(N[C@H](C)c3ccccn3)c([N+](=O)[O-])c2)cn1 523298569 RPNYILKRNSXHHE-GOSISDBHSA-N 499.527 5.920 5 20 JKBD CCOc1cc(NC(=O)c2cc(-c3ccco3)nc3onc(C(C)C)c23)c([N+](=O)[O-])cc1OCC 524316679 SVCMFNNZTCENCW-UHFFFAOYSA-N 480.477 5.564 5 20 JKBD COc1ccc(NC(=O)N[C@H](C)c2cccc([N+](=O)[O-])c2)cc1OCc1ccc2ccccc2n1 551395519 SSDRHERMRQKMKC-QGZVFWFLSA-N 472.501 5.613 5 20 JKBD CC(=O)Nc1cccc([C@@H](C)N(Cc2ccccc2)C(=O)c2ccc(NC3CC3)c([N+](=O)[O-])c2)c1 591353896 SMQUQIMELSZBEM-GOSISDBHSA-N 472.545 5.531 5 20 JKBD COc1ccc(Oc2ccc(Cl)cc2NC(=O)c2cc(OC)c(OC)cc2[N+](=O)[O-])cc1 603467226 UMQQPAWOAIZRPT-UHFFFAOYSA-N 458.854 5.319 5 20 JKBD Cc1ccc(-c2csc(NC(=O)Cc3csc(NC(=O)c4ccccc4F)n3)n2)cc1[N+](=O)[O-] 603733520 UHZIDSHPWVICIJ-UHFFFAOYSA-N 497.533 5.056 5 20 JKBD CCOC(=O)C[C@H](c1ccccc1)C1CCN(C(=O)[C@@H](C)Sc2ccc([N+](=O)[O-])cc2)CC1 603928133 LXXKNOVJGJDOAQ-WZONZLPQSA-N 470.591 5.051 5 20 JKBD COc1ccc(-c2n[nH]c(NC(=O)c3ccc(Oc4ccc(Cl)cc4[N+](=O)[O-])cc3)n2)c(OC)c1 604546229 YMYDRZMUSDEFDP-UHFFFAOYSA-N 495.879 5.095 5 20 JKBD CC(C)NC(=O)c1ccc(Cl)c(NC(=O)c2cc([N+](=O)[O-])ccc2Sc2ccccc2)c1 608938164 GGWVRKFXDMWAGO-UHFFFAOYSA-N 469.950 5.790 5 20 JKBD C[C@H](c1ccc(S(N)(=O)=O)cc1)N(C)C(=O)CCC(=O)c1ccc2ccc3cccc4ccc1c2c34 727753435 UAGCHQOQZYVIAC-GOSISDBHSA-N 498.604 5.414 5 20 JKBD C[C@H](NC(=O)[C@@H](C)OC(=O)c1csc(-c2cccc([N+](=O)[O-])c2)n1)c1ccc2c(c1)CCCC2 747961701 IUPDPSSLMBKRBN-JKSUJKDBSA-N 479.558 5.020 5 20 JKBD O=[N+]([O-])c1ccc(/C=C\Sc2nnc(-c3cccnc3)n2-c2ccc(Br)cc2)o1 825276568 IXGBJJCAYQZCAI-LUAWRHEFSA-N 470.308 5.356 5 20 JKBD C[C@H]1CCC[C@@H](C)N1NC(=O)C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1 864846230 LOXOEFQAKQTOFA-JGSSCENWSA-N 450.564 5.429 5 20 JKBD CN(C)Cc1ccc(-c2noc(C3CCN(c4ccc(C(F)(F)F)cc4[N+](=O)[O-])CC3)n2)cc1 904621451 WZSGNUNUMAZLKP-UHFFFAOYSA-N 475.471 5.109 5 20 JKBD COc1ccc(Oc2ccc([N+](=O)[O-])cc2C(=O)O[C@H](C)C(=O)Nc2ccc(C)cc2C)cc1 915442716 PXEVEEWHGROAIN-QGZVFWFLSA-N 464.474 5.197 5 20 JKBD COc1cc(C2SCCS2)ccc1OC(=O)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-] 915827258 LDVXWBLWBLUCQQ-UHFFFAOYSA-N 475.466 5.242 5 20 JKBD CCCN1C(=S)N[C@H](c2ccc([N+](=O)[O-])cc2)C(C(=O)Nc2ccccc2C(F)(F)F)=C1C 916167700 BPFBYSNRJDMKOB-LJQANCHMSA-N 478.496 5.168 5 20 JKBD CNC(=O)c1ccc(Sc2nnc(Nc3ccc(SC(F)F)cc3)s2)c([N+](=O)[O-])c1 919721375 DRQLZJRHBGGSED-UHFFFAOYSA-N 469.520 5.015 5 20 JKBD C[C@H](CNC(=O)c1ccccc1NC(=O)c1ccc([N+](=O)[O-])cc1Cl)c1ccc(F)cc1 920043470 QMVSLUXXWYVQTL-CQSZACIVSA-N 455.873 5.173 5 20 JKBD O=C(OCc1nnc(-c2ccc(Cl)cc2Cl)o1)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-] 920526572 USGNFCJSAKYLNI-UHFFFAOYSA-N 492.193 5.250 5 20 JKBD Cc1c(F)cccc1C(=O)NC1(c2ccc(NC(=O)/C=C/c3ccc([N+](=O)[O-])o3)cc2)CCC1 1786205938 VHEKAQTXTZQULG-ZRDIBKRKSA-N 463.465 5.096 5 20 JKBD CSc1cccc(C(=O)Nc2ccc(C3(NC(=O)Cc4cccc([N+](=O)[O-])c4)CCC3)cc2)c1O 1790065789 VDUCYTNNSMOJAK-UHFFFAOYSA-N 491.569 5.013 5 20 JKBD CC(C)=CCCC(=O)Nc1ccc(C2(NC(=O)Cc3ccc([N+](=O)[O-])cc3F)CCC2)cc1 1790452721 NZOQOJDGQGZPGB-UHFFFAOYSA-N 453.514 5.157 5 20 JKBD O=C(Cc1ccncc1)NC1(c2ccc(NC(=O)c3cc4cc([N+](=O)[O-])ccc4s3)cc2)CCC1 1791010353 JJVPLDONEWWZFY-UHFFFAOYSA-N 486.553 5.195 5 20 JKBD Cc1cc(Cl)c(Cl)cc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1c(F)ccc([N+](=O)[O-])c1C 1800700095 LTZCVJZHUYUJOR-QDMKHBRRSA-N 494.350 5.223 5 20 JKBD O=C(Nc1cc([C@H]2CCCCN2C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)[nH]n1)c1ccc(F)cc1 1820556999 HBWJYEUPPIHUSI-LJQANCHMSA-N 493.520 5.291 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2ccc(Cl)cc2)[nH]n1 1821287233 PPOCRQNVXKMKOD-LJQANCHMSA-N 485.903 5.039 5 20 JKBD Cc1cccc2cc(C(=O)N3CCCC[C@H]3c3cc(NC(=O)/C=C/c4ccccc4[N+](=O)[O-])n[nH]3)[nH]c12 1823505103 VJKHRNUTYOVMRU-OTOIZHKDSA-N 498.543 5.127 5 20 JKBD Cc1c(C(=O)N2CCCC[C@H]2C2CCN(C(=O)c3ccc(F)cc3)CC2)cc(Cl)cc1[N+](=O)[O-] 1830736294 VHGIGRMZJHJAQG-QFIPXVFZSA-N 487.959 5.243 5 20 JKBD CCCCC[C@@H](C)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)CSc2ccccc2[N+](=O)[O-])CC1 1831467764 ABNGOOSCGVQRTP-IFMALSPDSA-N 489.682 5.523 5 20 JKBD Cc1cccc(C(=O)N2CCC([C@H]3CCCCN3C(=O)CSc3ccccc3[N+](=O)[O-])CC2)c1F 1831776070 RLBBSYUQKYCHBX-OAQYLSRUSA-N 499.608 5.068 5 20 JKBD CN(C)c1ccc([N+](=O)[O-])cc1C(=O)OCC(=O)Nc1c(Cl)c(Cl)cc(Cl)c1Cl 10016992 WVXKCOSVBJHQRD-UHFFFAOYSA-N 481.119 5.070 5 20 JKBD COc1ccc([N+](=O)[O-])cc1NC(=O)[C@H](C)Sc1nnc(-c2ccccc2)n1-c1ccc(F)cc1 10212530 RKJVWLHWAIORFE-HNNXBMFYSA-N 493.520 5.110 5 20 JKBD O=C(COC(=O)c1nc(Cl)c(Cl)c(Cl)c1Cl)Nc1ccc(Cl)c([N+](=O)[O-])c1 12684278 NBRGTCMVTRBOCT-UHFFFAOYSA-N 473.483 5.052 5 20 JKBD CSc1ccc([N+](=O)[O-])c(C(=O)OCc2csc(N(C(C)=O)c3ccc(C)cc3C)n2)c1 16196863 JINNOGUMFJYRSQ-UHFFFAOYSA-N 471.560 5.432 5 20 JKBD COc1cc(C(=O)Nc2nc(-c3cccc([N+](=O)[O-])c3)cs2)cc(OC)c1OCc1ccccc1 16961332 NKWVLMGRRDDLGL-UHFFFAOYSA-N 491.525 5.567 5 20 JKBD C[C@@H](OC(=O)/C(=C/c1ccc(F)cc1)c1cccs1)C(=O)Nc1ccc(F)c([N+](=O)[O-])c1 21679320 ZKIJOERDBUFHHD-VVBXCHJUSA-N 458.442 5.046 5 20 JKBD Cc1cccc([N+](=O)[O-])c1C(=O)O[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1 22003732 YCLYLJCSEBMJFE-HXUWFJFHSA-N 469.837 5.002 5 20 JKBD CCn1c(SCC(=O)Nc2c(C)cc(C)cc2Cl)nc2cc3ccccc3cc2c1=O 22178815 CDWWQQNVUBXUFE-UHFFFAOYSA-N 451.979 5.571 5 20 JKBD C[C@H](N[C@@H]1CCSc2ccc(Cl)cc21)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 25216108 STNMSVVMBAYKHZ-ZUZCIYMTSA-N 459.877 5.421 5 20 JKBD Cc1c(NC(=O)[C@H](C)OC(=O)CCc2ncc(-c3ccc(Cl)cc3Cl)o2)cccc1[N+](=O)[O-] 28773289 YJMVSRWPNHFYMI-ZDUSSCGKSA-N 492.315 5.368 5 20 JKBD COc1cc(C(=O)Nc2nc(-c3cc(Cl)sc3Cl)cs2)c([N+](=O)[O-])cc1OC(F)F 29583304 QZLMRZLJNWFSAV-UHFFFAOYSA-N 496.300 5.949 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Cl)[C@H](NC1CCN(CCc2ccccc2)CC1)c1ccccc1 30501190 XOBDKNXKYMTMAT-AREMUKBSSA-N 493.007 5.225 5 20 JKBD COc1ccc(-c2noc(CCCC(=O)Nc3nc(-c4ccc(C)c([N+](=O)[O-])c4)cs3)n2)cc1 106203992 WIGMWXFRICXHJY-UHFFFAOYSA-N 479.518 5.047 5 20 JKBD CN(C)C(=O)c1cc(NC(=O)c2ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])cc2)ccc1Cl 106232518 SLUWPPNVTLSIHC-UHFFFAOYSA-N 474.300 5.648 5 20 JKBD Cn1cnnc1Sc1ccc(C(=O)N[C@H](c2ccc(Cl)cc2)c2ccsc2)cc1[N+](=O)[O-] 108945117 BGSQXEGABUJEQY-LJQANCHMSA-N 485.978 5.109 5 20 JKBD CC(C)OCc1ccc(NC(=O)C2CCN(c3ccc(C(F)(F)F)cc3[N+](=O)[O-])CC2)cc1 195643025 BCOONAHZJDYAJJ-UHFFFAOYSA-N 465.472 5.394 5 20 JKBD C[C@H](Nc1ccc(C(=O)NC[C@H]2CCCO[C@H]2c2ccccc2)cc1[N+](=O)[O-])c1ccccn1 409571662 QZTKDGLXUHGTFL-HCYUJWNOSA-N 460.534 5.061 5 20 JKBD O=C(Nc1ccc(NC(=O)c2ccco2)c(Cl)c1)c1csc(-c2ccc([N+](=O)[O-])cc2)n1 496613612 VZRMAQSBYSXBJE-UHFFFAOYSA-N 468.878 5.469 5 20 JKBD COc1cc2c(cc1OC)[C@@H](c1cccs1)N(C(=O)CCCNc1ccc([N+](=O)[O-])cc1)CC2 502868172 RDOYLWNHRCDTEU-VWLOTQADSA-N 481.574 5.040 5 20 JKBD C[C@H](Nc1ccc(C(=O)N[C@H]2CCSc3ccc(Cl)cc32)cc1[N+](=O)[O-])c1ccccn1 506069123 BBAGMVZIQBLQHV-LIRRHRJNSA-N 468.966 5.783 5 20 JKBD O=C(C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)N1CCCC[C@H]1c1ncc[nH]1 509974900 ZSCXDTHFWGHAMA-TXOBRMIJSA-N 473.558 5.612 5 20 JKBD CN(CCC(F)(F)F)C(=O)c1ccccc1Sc1ccc(C(F)(F)F)cc1[N+](=O)[O-] 511384161 ZNMVFRNFYFIXNR-UHFFFAOYSA-N 452.376 5.789 5 20 JKBD CCn1c(SCc2ccc(OCc3nccn3C)cc2)nc2cc3ccccc3cc2c1=O 515592394 DMKHWKONIVGGJF-UHFFFAOYSA-N 456.571 5.174 5 20 JKBD COc1cc(C(=O)Nc2ccc(Cl)c3cccnc23)c([N+](=O)[O-])cc1OCc1cscn1 517755819 NEKZUMFFYGHORD-UHFFFAOYSA-N 470.894 5.093 5 20 JKBD C[C@H](Nc1ccc(C(=O)Nc2ccc(Oc3ccccc3)nc2)cc1[N+](=O)[O-])c1ccccn1 555209621 BDLAFEGXPSZYMN-KRWDZBQOSA-N 455.474 5.603 5 20 JKBD COc1ccc(CN(C)C(=O)C/C(=C/c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)cc1 603463844 KJZCKEUOBOORII-HKWRFOASSA-N 473.554 5.802 5 20 JKBD CCOc1ccc(C(=O)Nc2sc3c(c2-c2nc4ccccc4[nH]2)CCCC3)cc1[N+](=O)[O-] 603825292 HJLIFQXPGDUOLZ-UHFFFAOYSA-N 462.531 5.729 5 20 JKBD O=C(Cc1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1)N1CCC[C@@H]1c1ccsc1 603897123 CPEUREHSSDAWNE-HSZRJFAPSA-N 458.543 5.415 5 20 JKBD Cc1nc(C)c(-c2csc(NC(=O)c3ccc(N4CCC[C@H](C)C4)c([N+](=O)[O-])c3)n2)s1 603904787 SWEQOIRJEOWAKT-LBPRGKRZSA-N 457.581 5.280 5 20 JKBD O=C(CCOc1ccccc1[N+](=O)[O-])Nc1ccc(NC(=O)c2ccccc2F)cc1C(F)(F)F 603961115 FIWULRYSQHSKIQ-UHFFFAOYSA-N 491.397 5.413 5 20 JKBD CCOc1cc([N+](=O)[O-])c(C(=O)N[C@@H](c2cccc(C(F)(F)F)c2)C(C)(C)C)cc1OC 608899121 PSJABBNYLIBRQM-IBGZPJMESA-N 454.445 5.538 5 20 JKBD COCCN(C(=O)c1ccc(-c2ccccc2)nc1C)c1nc(-c2ccc([N+](=O)[O-])cc2)cs1 612565952 QYNXJUGVHZUYPK-UHFFFAOYSA-N 474.542 5.382 5 20 JKBD C[C@@H](Nc1ccc(C(=O)OCc2nnc(-c3ccccc3Cl)o2)cc1[N+](=O)[O-])c1ccccn1 728837204 KLNWCZDVZXWQOQ-CQSZACIVSA-N 479.880 5.223 5 20 JKBD O=C(CCC(=O)N1CCN(Cc2ccncc2)CC1)c1ccc2ccc3cccc4ccc1c2c34 729257988 WCPSSQZTKQOLJT-UHFFFAOYSA-N 461.565 5.286 5 20 JKBD C[C@H](NC(=O)Nc1ccc(NC(=O)OC(C)(C)C)cc1C(F)(F)F)c1cccc([N+](=O)[O-])c1 729571488 LSGILNXDLSBXHM-LBPRGKRZSA-N 468.432 5.843 5 20 JKBD C[C@H](OC(=O)c1cnn(-c2ncccc2Cl)c1C(F)(F)Cl)c1cccc([N+](=O)[O-])c1 730962610 XFEKOUFSFUAXLW-JTQLQIEISA-N 457.220 5.035 5 20 JKBD COc1ccccc1-c1nnc(Sc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])n1CCc1ccccc1 800068232 TVVGUZZDNKVVGW-UHFFFAOYSA-N 477.502 5.164 5 20 JKBD COc1cccc([C@@H](CNC(=O)/C=C/c2ccc([N+](=O)[O-])cc2)c2c[nH]c3ccccc23)c1OC 912664137 XFLRTVYEORDMQK-MEWQITQSSA-N 471.513 5.055 5 20 JKBD C[C@H](Oc1ccccc1Cl)C(=O)Oc1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2Cl)cc1 914222179 VXHVJKPXKZFUQE-ZDUSSCGKSA-N 475.284 5.527 5 20 JKBD Cc1cccc(C)c1NC(=O)CN(CC(=O)Nc1c(C)cccc1C)Cc1cccc([N+](=O)[O-])c1C 917031258 QWLCXPNEWLPHDJ-UHFFFAOYSA-N 488.588 5.216 5 20 JKBD O=C(CCc1nc2ccccc2o1)O[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1 917234102 PDQVDDQPUDPTDK-QHCPKHFHSA-N 479.876 5.245 5 20 JKBD Cc1csc(SCc2c(C(=O)N[C@H](C)c3cccc([N+](=O)[O-])c3)oc3ccccc23)n1 917701011 POZSHJJBBATEGT-CQSZACIVSA-N 453.545 5.889 5 20 JKBD CCN(Cc1cccc(NC(=O)c2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)c1)C(=O)OC(C)(C)C 919714507 OJWRDJMCGLJOFG-UHFFFAOYSA-N 479.537 5.005 5 20 JKBD CCCn1cc(NC(=O)C/C(=C/c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)ccc1=O 919845551 ZNTKQGHOUVTLJP-JXAWBTAJSA-N 474.542 5.346 5 20 JKBD O=C(/C=C/C1CC1)Nc1ccc(C2(NC(=O)c3cccc(Br)c3[N+](=O)[O-])CCC2)cc1 1786161169 ZXWQDZIOQLKOAO-KPKJPENVSA-N 484.350 5.071 5 20 JKBD O=C(CCc1cccc([N+](=O)[O-])c1)NC1(c2ccc(NC(=O)c3ccncc3Cl)cc2)CCC1 1789727514 RVDBVEJPNBZZBE-UHFFFAOYSA-N 478.936 5.024 5 20 JKBD O=C(NC1(c2ccc(NC(=O)C3(c4cccc([N+](=O)[O-])c4)CCC3)cc2)CCC1)[C@@H]1C[C@@]1(F)Cl 1790476330 BRAJDANBASPMQG-CPJSRVTESA-N 485.943 5.075 5 20 JKBD C[C@@H](C(=O)N1CCCC2(CCN(C(=O)/C=C/c3ccccc3[N+](=O)[O-])CC2)C1)c1ccc(Cl)cc1 1805194095 CEZBSHUPNTZARW-RGFVMQALSA-N 496.007 5.296 5 20 JKBD Cc1ccc(CC(=O)Nc2cc([C@H]3CCCCN3C(=O)C[C@@H](C)c3ccccc3)[nH]n2)cc1[N+](=O)[O-] 1820918571 IFFRLZBFKVFXRF-AUSIDOKSSA-N 489.576 5.055 5 20 JKBD CC1(C)CCC(CC(=O)N2CCCC[C@H]2C2CCN(C(=O)c3ccc(O)c([N+](=O)[O-])c3)CC2)CC1 1830423695 WGMIREWZGXTCEM-QFIPXVFZSA-N 485.625 5.140 5 20 JKBD Cc1c(C(=O)N2CCCC[C@H]2C2CCN(C(=O)CC(C)(C)C)CC2)cc(Cl)cc1[N+](=O)[O-] 1830736697 YWUASWKILWCOBQ-FQEVSTJZSA-N 464.006 5.226 5 20 JKBD CC(C)=CCCC(=O)N1CCC([C@@H]2CCCCN2C(=O)CSc2ccccc2[N+](=O)[O-])CC1 1831777290 NYSODGPBXCJHNA-NRFANRHFSA-N 473.639 5.053 5 20 JKBD O=C(c1cc(F)cc([N+](=O)[O-])c1)N1CCC([C@@H]2CCCCN2C(=O)C2(c3ccccc3)CCC2)CC1 1831781876 JYTUIKVZGBALQP-VWLOTQADSA-N 493.579 5.089 5 20 JKBD C[C@@H](OC(=O)Cn1c2ccccc2c(=O)c2ccccc21)C(=O)Nc1ccc(C(C)(C)C)cc1 11277554 DFUYNSBCSJPVSA-GOSISDBHSA-N 456.542 5.023 5 20 JKBD Cc1ccc(-n2c(S[C@H](C)c3nnc(-c4ccc([N+](=O)[O-])cc4)o3)nc3ccccc3c2=O)cc1 17532952 AYNOXPIZYMXZTQ-MRXNPFEDSA-N 485.525 5.506 5 20 JKBD C[C@H]1CCCCN1C(=O)COC(=O)C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1 18494166 XUQBTFYRCYDPRV-FJSNCCPHSA-N 479.558 5.079 5 20 JKBD COc1ccccc1-n1c(S[C@@H](C)C(=O)Nc2ccccc2[N+](=O)[O-])nnc1-c1cccs1 21738307 KBMSDQCBONBCTJ-AWEZNQCLSA-N 481.559 5.032 5 20 JKBD O=[N+]([O-])c1cc2c(c(CSc3nnc(Nc4ccc(OC(F)(F)F)cc4)s3)c1)OCOC2 22181114 VSBROESKUNABAR-UHFFFAOYSA-N 486.453 5.247 5 20 JKBD CC(=O)Nc1ccc(N[C@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Br)c2ccccc2)cc1 23864488 UZMVFPFURDRGDX-NRFANRHFSA-N 483.322 5.108 5 20 JKBD COc1cc(Cn2cnc3scc(-c4ccc(Cl)cc4)c3c2=O)c([N+](=O)[O-])cc1OC(F)F 24880244 QZCKLNOINAEXIC-UHFFFAOYSA-N 493.875 5.345 5 20 JKBD CC(C)C(=O)Nc1ccc(CN[C@@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2ccccc2)cc1 27024220 MMCIRNJCUMQCCD-HSZRJFAPSA-N 480.952 5.312 5 20 JKBD O=C(CCCn1c(=O)oc2cc([N+](=O)[O-])ccc21)Nc1nc(-c2cccc(C(F)(F)F)c2)cs1 29013473 WPSLKEJHBDKNCT-UHFFFAOYSA-N 492.435 5.064 5 20 JKBD O=C(Cn1c2ccccc2c(=O)c2ccccc21)NC[C@H](c1ccccc1)c1c[nH]c2ccccc12 105448480 PZCUEEKNLTUDKS-RUZDIDTESA-N 471.560 5.584 5 20 JKBD Cc1csc(Sc2ccc(C(=O)N3CC=C(c4c[nH]c5ncccc45)CC3)cc2[N+](=O)[O-])n1 105740306 DCBJCZJLGGUDRU-UHFFFAOYSA-N 477.571 5.317 5 20 JKBD O=C(c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1)N1CCN(c2ccc(Cl)cn2)CC1 109250790 YOLPOFOMJSSGMW-UHFFFAOYSA-N 473.316 5.051 5 20 JKBD C[C@H](Nc1ccc(C(=O)Nc2ccc3nc(C4CC4)sc3c2)cc1[N+](=O)[O-])c1ccccn1 195734145 YLKNAAVUDQTCNE-AWEZNQCLSA-N 459.531 5.902 5 20 JKBD CC(C)n1ncc2ccc(NC(=O)Cc3cn(-c4ccccc4)nc3-c3ccc([N+](=O)[O-])cc3)cc21 195743676 IOBDFCCDJDUVCL-UHFFFAOYSA-N 480.528 5.559 5 20 JKBD O=C(Nc1cc(Br)ccc1Br)c1csc(-c2cccc([N+](=O)[O-])c2)n1 302987155 FDXPEKBLIHRUST-UHFFFAOYSA-N 483.141 5.496 5 20 JKBD Cc1csc(Sc2ccc(C(=O)Nc3ccc(NC(=O)c4ccco4)c(C)c3)cc2[N+](=O)[O-])n1 490113592 UNFTWAVXRWQSFT-UHFFFAOYSA-N 494.554 5.917 5 20 JKBD C[C@H]1CCCN(c2ccc(C(=O)Nc3cccc(OCc4cscn4)c3)cc2[N+](=O)[O-])C1 504988086 HMOIIMSAAYDPJF-INIZCTEOSA-N 452.536 5.119 5 20 JKBD C[C@@H](NC(=O)c1ccc(Sc2nncn2C)c([N+](=O)[O-])c1)c1ccccc1Oc1ccccc1 506152413 HMYQORYGRVSDSB-MRXNPFEDSA-N 475.530 5.158 5 20 JKBD CCOc1cc(NC(=O)N2CCC[C@H]2c2cccc(Br)c2)c([N+](=O)[O-])cc1OCC 511284608 JMKOQZJJOFWFKI-KRWDZBQOSA-N 478.343 5.524 5 20 JKBD CC1CCN(C(=O)c2ccc(NC(=O)c3cc([N+](=O)[O-])ccc3Sc3ccccc3)cc2)CC1 515871520 QRKKNYNGUJSKPJ-UHFFFAOYSA-N 475.570 5.870 5 20 JKBD CC(C)c1ccc(-c2csc(NC(=O)c3cc([N+](=O)[O-])cc(S(C)(=O)=O)c3)n2)c(C(C)C)c1 517899623 BAIULAQITOAECH-UHFFFAOYSA-N 487.603 5.621 5 20 JKBD COc1ccc(Cl)c(NC(=O)Cc2cn(-c3ccccc3)nc2-c2ccc([N+](=O)[O-])cc2)c1 518861037 DWNWBBZIYZAEOI-UHFFFAOYSA-N 462.893 5.291 5 20 JKBD Cc1nn(Cc2ccccc2Cl)c(C)c1C(=O)Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1 601908640 MUQSQGKUTIUGDE-UHFFFAOYSA-N 467.938 5.486 5 20 JKBD COc1cc(C(=O)Nc2nc(-c3ccncc3)cs2)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 603454699 FLJKLQVKSINOSQ-UHFFFAOYSA-N 482.905 5.820 5 20 JKBD COCCN(C(=O)c1cc2c(s1)CC[C@H](C)C2)c1nc(-c2ccc([N+](=O)[O-])cc2)cs1 603461154 ANQAYOOTSMICHN-AWEZNQCLSA-N 457.577 5.198 5 20 JKBD Cc1ccc(C(=O)Nc2ccc(NC(=O)c3ccccc3F)cc2C(F)(F)F)cc1[N+](=O)[O-] 603742822 CUUGKSTWOQPXKB-UHFFFAOYSA-N 461.371 5.566 5 20 JKBD CN1C/C(=C/c2ccc(-c3ccc([N+](=O)[O-])cc3Cl)o2)c2nc3ccccc3c(C(=O)O)c2C1 603781503 NZXRGCGAJCDVES-UVTDQMKNSA-N 475.888 5.741 5 20 JKBD Cc1ccc2oc(C(=O)Nc3ccc(NS(=O)(=O)c4ccc(C)c([N+](=O)[O-])c4)cc3)cc2c1 604166514 BOJFWVWSGHCBRK-UHFFFAOYSA-N 465.487 5.011 5 20 JKBD COC(=O)c1ccc2c(O)nc(/C=C\c3ccc(-c4ccc([N+](=O)[O-])cc4Br)o3)nc2c1 608801347 XPHURDNRNHVZHX-UITAMQMPSA-N 496.273 5.223 5 20 JKBD O=C(c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1)N1CCCO[C@H](c2ccccc2)C1 609230253 BBTQBGZBMDKUMF-QHCPKHFHSA-N 452.894 5.644 5 20 JKBD Cc1ccc(-c2csc(NC(=O)c3cn(Cc4ccccc4)nc3-c3cccnc3)n2)cc1[N+](=O)[O-] 619729490 PFJQWHHRFINLTK-UHFFFAOYSA-N 496.552 5.586 5 20 JKBD C[C@H](NCc1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1)c1ccc(N2CCOC2=O)cc1 725848252 OAQIYKKPVOYMDL-INIZCTEOSA-N 467.909 5.848 5 20 JKBD CC1(C)CC(=O)c2sc(NC(=O)c3ccccc3NC(=O)c3ccc([N+](=O)[O-])cc3Cl)nc2C1 726936635 OBWDUGXMAJDMAG-UHFFFAOYSA-N 498.948 5.364 5 20 JKBD O=C(Nc1ccccc1)Nc1cccc(CNC(=O)c2cc([N+](=O)[O-])ccc2N2CCCCC2)c1 727854547 LELAVTHIFBBTSC-UHFFFAOYSA-N 473.533 5.159 5 20 JKBD O=C(O[C@H](C(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1)c1ccccc1)c1nccc2ccccc12 743199406 IAFPKBCGUDAYKV-QFIPXVFZSA-N 461.861 5.333 5 20 JKBD Cc1c(-c2ccccc2)sc(NC(=S)Nc2ccc([N+](=O)[O-])cc2)c1C(=O)N1CCCCC1 747724617 VTGBWYWRGHZZLR-UHFFFAOYSA-N 480.615 6.067 5 20 JKBD Cc1ccc(C(=O)c2ccccc2C(=O)O[C@H](C)C(=O)Nc2cc([N+](=O)[O-])ccc2Cl)cc1C 800460371 QDVJLCWSMBOZHN-MRXNPFEDSA-N 480.904 5.280 5 20 JKBD CSc1ccc([N+](=O)[O-])c(C(=O)N2CCC(C(O)(c3ccccc3)c3ccccc3)CC2)c1 831905925 UFWLOCMDJGYLFT-UHFFFAOYSA-N 462.571 5.105 5 20 JKBD O=C(Cc1noc(-c2ccc(Sc3nc4ccccc4s3)c([N+](=O)[O-])c2)n1)NC1CCCCC1 904244312 CTGGVELLOSOQMZ-UHFFFAOYSA-N 495.586 5.397 5 20 JKBD Cc1cc(C(N)=O)ccc1NC(=O)c1c2c(nc3ccccc13)/C(=C\c1ccc([N+](=O)[O-])cc1)CCC2 915177406 SUSADHNKFUCCLV-MNDPQUGUSA-N 492.535 5.680 5 20 JKBD Cc1ccc(NC(=O)[C@@H](OC(=O)c2csc(-c3ccc(C)o3)n2)c2ccccc2)c([N+](=O)[O-])c1 915467080 DTQGPZLLHINTIX-NRFANRHFSA-N 477.498 5.465 5 20 JKBD O=C1N[C@H](c2ccc(Sc3nc4ccc([N+](=O)[O-])cc4s3)c([N+](=O)[O-])c2)Nc2ccccc21 917499708 PQIPIIYDKXSNPZ-LJQANCHMSA-N 479.499 5.118 5 20 JKBD C[C@@H](Nc1ccc(C(=O)OCc2coc(-c3cccs3)n2)cc1[N+](=O)[O-])c1ccccn1 920543744 IKZTYWUZAWKHNI-CQSZACIVSA-N 450.476 5.236 5 20 JKBD O=C(Cc1ccc2ccccc2c1)Nc1cc([C@H]2CCCCN2C(=O)/C=C/c2ccc([N+](=O)[O-])o2)[nH]n1 1816824727 YSNKFMOUONDDEP-JBOJMBJVSA-N 499.527 5.012 5 20 JKBD Cc1ccc(/C=C/C(=O)N2CCC([C@H]3CCCCN3C(=O)c3ccc([N+](=O)[O-])cc3F)CC2)s1 1830497713 LDDVOXKNFASTJF-YIEPXFBBSA-N 485.581 5.051 5 20 JKBD Cc1cccc(Cl)c1C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cccc(F)c2[N+](=O)[O-])CC1 1830595645 IJUZFRRGTXPFHJ-OAQYLSRUSA-N 487.959 5.243 5 20 JKBD CC[C@H]1CC[C@H](C(=O)N2CCC([C@@H]3CCCCN3C(=O)Cc3ccc([N+](=O)[O-])cc3F)CC2)CC1 1831294384 OCTJGSCOHXOSOU-OWHZGTRUSA-N 487.616 5.113 5 20 JKBD CCOc1ccsc1C(=O)N1CCC([C@@H]2CCCCN2C(=O)/C=C/c2ccccc2[N+](=O)[O-])CC1 1832899609 DDACEKHRZLWXPS-ZJVMWOEPSA-N 497.617 5.002 5 20 JKBD Cc1sc(NC(=O)c2ccc([N+](=O)[O-])cc2Cl)nc1-c1ccc(Br)cc1 14911532 DZGOYTKXUGYOSN-UHFFFAOYSA-N 452.717 5.695 5 20 JKBD Cc1ccc(-n2c(S[C@@H](C)c3nnc(-c4ccc([N+](=O)[O-])cc4)o3)nnc2-c2ccccc2)cc1 17707068 AJSIKMHSGYVLNM-KRWDZBQOSA-N 484.541 6.054 5 20 JKBD C[C@H](Sc1nnc(-c2c[nH]c3ccccc23)n1C1CC1)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl 17882244 PGZLYEFCXGQXND-LBPRGKRZSA-N 482.953 5.442 5 20 JKBD COC(=O)c1cc(C(=O)Nc2nc(-c3cc(Cl)sc3Cl)cs2)cc([N+](=O)[O-])c1 18091524 NJRVZJANGNVZEZ-UHFFFAOYSA-N 458.304 5.126 5 20 JKBD O=C(Cc1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1)N[C@H]1CCSc2ccccc21 18134436 OYJKJBGVSFCVOY-QHCPKHFHSA-N 470.554 5.343 5 20 JKBD COc1ccc(-c2nnc(SCC(=O)Nc3c(C)cccc3[N+](=O)[O-])n2-c2ccc(C)cc2)cc1 20888510 LXZVBZIYBNTKFD-UHFFFAOYSA-N 489.557 5.199 5 20 JKBD C[C@H](OC(=O)c1cc2ccc(F)cc2s1)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 26222265 HJNAOAGGDGLZNF-VIFPVBQESA-N 456.373 5.151 5 20 JKBD COc1cc(C(=O)N(C)Cc2ccc(Br)o2)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 28349434 TZQKYVOKJLCUEM-UHFFFAOYSA-N 495.713 5.677 5 20 JKBD COc1ccc(OC)c(-c2csc(NC(=O)c3ccc(N4CCC(C)CC4)c([N+](=O)[O-])c3)n2)c1 35105140 YGCUXPDRGVVTPI-UHFFFAOYSA-N 482.562 5.224 5 20 JKBD CC(C)OC(=O)C[C@H](NC(=O)c1[nH]c2ccc(Cl)cc2c1Cl)c1ccccc1[N+](=O)[O-] 108420412 BBANVVIEBPKQML-INIZCTEOSA-N 464.305 5.196 5 20 JKBD CCOc1ccc(Oc2ccc(Cl)cc2NC(=O)c2cc([N+](=O)[O-])cc(S(C)(=O)=O)c2)cc1 109025121 USBIAALMGISUSV-UHFFFAOYSA-N 490.921 5.095 5 20 JKBD COc1cc(C(=O)Nc2ccc(NC(C)=O)cc2Cl)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 110588915 QFJFDBFKFLHHQV-UHFFFAOYSA-N 490.299 5.913 5 20 JKBD COCc1c(C(=O)Nc2nc(-c3cccc([N+](=O)[O-])c3)c(C)s2)sc2cccc(F)c12 195704003 FZZOIDGJXINHIA-UHFFFAOYSA-N 457.508 5.779 5 20 JKBD O=C(Nc1ccc(NC(=O)N2CCCCCC2)cc1)c1csc(-c2cccc([N+](=O)[O-])c2)n1 216449906 XEYUUETUTSGSEB-UHFFFAOYSA-N 465.535 5.379 5 20 JKBD C[C@@H]1CCC[C@@H](C)N1C(=O)c1cc(Cl)ccc1NC(=O)c1ccc(N2CCCC2)c([N+](=O)[O-])c1 302948222 LXDFXVLZHNQZMD-IAGOWNOFSA-N 484.984 5.504 5 20 JKBD CC[C@H](c1ccc(F)cc1)N(Cc1cccc(F)c1)C(=O)CCn1nc(C)c([N+](=O)[O-])c1C 303097281 AVHDKRKBFHNMQD-JOCHJYFZSA-N 456.493 5.257 5 20 JKBD CC(C)N1CCC(N(C)C(=O)C/C(=C\c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)CC1 483943644 OLIQVWFGXKCASM-CAPFRKAQSA-N 478.618 5.466 5 20 JKBD C[C@@H](NC(=O)c1ccc(Sc2nncn2C)c([N+](=O)[O-])c1)c1ccc(Oc2ccccc2)c(F)c1 488997920 ACZZTHIFUNKPAI-OAHLLOKOSA-N 493.520 5.297 5 20 JKBD CCCCCC(=O)NC1CCN([C@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2ccccc2)CC1 498644642 GSYWQKRNSUPLDK-DEOSSOPVSA-N 487.000 5.089 5 20 JKBD C[C@H]1Cc2cc([N+](=O)[O-])ccc2N1C(=O)c1ccc(COc2ccc(Br)cc2)o1 504302964 CXJYGIZXMINTQH-ZDUSSCGKSA-N 457.280 5.121 5 20 JKBD CC(C)N(CC(=O)Nc1ccc(Cl)cc1C(F)(F)F)C(=O)c1cc2cccc([N+](=O)[O-])c2[nH]1 505349178 KKHJDCYFBIKNCQ-UHFFFAOYSA-N 482.846 5.238 5 20 JKBD COc1ccc([C@H]2CCCN2C(=O)c2ccc(N[C@H](C)c3ccccn3)c([N+](=O)[O-])c2)c(OC)c1 506069045 DIYIVHPVCQCAFZ-UZUQRXQVSA-N 476.533 5.157 5 20 JKBD CCOc1cc(NC(=O)N2CCC(Oc3ccc(C)c(C)c3)CC2)c([N+](=O)[O-])cc1OCC 509727057 JDVLCZGPPLGIOZ-UHFFFAOYSA-N 457.527 5.084 5 20 JKBD O=C(c1c2c(nc3ccccc13)/C(=C/c1ccc([N+](=O)[O-])cc1)CCC2)N1CCC(n2cncn2)CC1 509970272 OSDSQOYAASTENC-CAPFRKAQSA-N 494.555 5.089 5 20 JKBD Cc1cc(C)n([C@H](C)C(=O)Nc2ccc(NC(=O)c3cc4ccccc4c4cccnc34)cc2Cl)n1 521540810 HLQJDAILZROFJJ-GOSISDBHSA-N 497.986 6.307 5 20 JKBD Cc1csc(Sc2ccc(C(=O)N[C@@H](c3nc(-c4cccnc4)no3)C(C)C)cc2[N+](=O)[O-])n1 522503990 AXRQSRXRTLHGQQ-GOSISDBHSA-N 496.574 5.083 5 20 JKBD CC(=O)N(c1cccc(C(F)(F)F)c1)c1nc(COc2ccc([N+](=O)[O-])cc2F)cs1 603726732 NLGQLTRTUPNZNJ-UHFFFAOYSA-N 455.389 5.473 5 20 JKBD COc1ccc(CN(Cc2ccccc2)S(=O)(=O)c2ccccc2C(F)(F)F)cc1[N+](=O)[O-] 603934163 HGGNAMKJKQXXGY-UHFFFAOYSA-N 480.464 5.013 5 20 JKBD O=C(Nc1sc2c(c1-c1nc3ccccc3[nH]1)CCCC2)c1cc2c(cc1[N+](=O)[O-])OCO2 603941524 LDPWPHNLBRQPEN-UHFFFAOYSA-N 462.487 5.059 5 20 JKBD CCOc1cc(C(=O)N(c2cccc(C(F)(F)F)c2)[C@H](C)C2CC2)c([N+](=O)[O-])cc1OC 603964323 DMQFRGDXZKBEGY-CYBMUJFWSA-N 452.429 5.466 5 20 JKBD CC[C@@H](C)C(=O)Nc1cccc(CN[C@@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2ccccc2)c1 604044631 BFLZDMAEKRICHZ-MZNJEOGPSA-N 494.979 5.702 5 20 JKBD O=C(CSc1ccc(C(F)(F)F)cc1[N+](=O)[O-])Nc1ccccc1NC(=O)c1cccs1 608808822 FQGHSPGMIVUMGL-UHFFFAOYSA-N 481.477 5.658 5 20 JKBD CC(C)S(=O)(=O)c1ccccc1NC(=O)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1 608872611 VNFNDNRHDNAPIL-UHFFFAOYSA-N 474.922 5.475 5 20 JKBD C[C@@H]1CSc2ccc(Br)cc2[C@@H]1NC(=O)CSc1ccc([N+](=O)[O-])cc1 609192306 NISIGPXRSNIEOK-ADLMAVQZSA-N 453.383 5.049 5 20 JKBD CCN(C)Cc1cccc(CNCc2ccc(-c3ccc([N+](=O)[O-])cc3Br)o2)c1 609223344 HSGZPRFDBLHCMN-UHFFFAOYSA-N 458.356 5.359 5 20 JKBD COc1ccc(CC(=O)Nc2cccc(NC(=O)Nc3cccc4c3CCCC4)c2)cc1[N+](=O)[O-] 609428086 AYAYOVQVLHWSRR-UHFFFAOYSA-N 474.517 5.307 5 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RGUKWYNGYIJXHD-OAHLLOKOSA-N 490.903 5.351 5 20 JKBD C[C@H](OC(=O)c1sccc1SC(F)F)C(=O)Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1 730659480 BKAMHYQAQYQCEF-VIFPVBQESA-N 485.515 5.279 5 20 JKBD O=C(Nc1ccccc1)c1cccc(OC(=O)c2cc(OCC(F)(F)F)ccc2[N+](=O)[O-])c1 746785514 MBOXJABLPVGCGJ-UHFFFAOYSA-N 460.364 5.007 5 20 JKBD CC(C)Oc1ccc(NC(=O)c2ccccc2NC(=O)c2ccc([N+](=O)[O-])cc2Cl)c(F)c1 748060860 DUTCZYMRYVOKQD-UHFFFAOYSA-N 471.872 5.679 5 20 JKBD COc1cc(C)ccc1Oc1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2Br)cc1F 751109031 XFGPGGALIWOUQN-UHFFFAOYSA-N 475.270 5.858 5 20 JKBD CC(=O)N[C@@H](CC(=O)Nc1cc(Cl)c([N+](=O)[O-])cc1OCc1ccccc1)c1ccc(C)cc1 822219472 HIPUKDYIDJHUJH-NRFANRHFSA-N 481.936 5.342 5 20 JKBD COc1ccc(NC(=O)COc2ccc3c(-c4ccc([N+](=O)[O-])cc4)cc(=O)oc3c2)cc1Cl 844161036 TWOKYESGEXVVMI-UHFFFAOYSA-N 480.860 5.048 5 20 JKBD Cc1csc(Sc2ccc(-c3nc([C@@H]4CCC(=O)N(CC5CCC5)C4)no3)cc2[N+](=O)[O-])n1 856567744 YKDOGQJGDVNEQZ-MRXNPFEDSA-N 485.591 5.067 5 20 JKBD Cn1cnnc1Sc1ccc(-c2nc(-c3ccc(OCc4ccccc4)cc3)no2)cc1[N+](=O)[O-] 904422309 CBOGHXGCKCVDKT-UHFFFAOYSA-N 486.513 5.171 5 20 JKBD O=C(C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)Nc1ccc(-n2ccnc2)nc1 914452119 ITEPQDHQOUPRJR-QGOAFFKASA-N 482.525 5.355 5 20 JKBD COc1ccc([C@@H]2[C@H](C(=O)Nc3cc([N+](=O)[O-])ccc3OC)CCC(=O)N2c2ccc(C)cc2)cc1 916665257 QHLBIZHGUIMXSC-ATIYNZHBSA-N 489.528 5.043 5 20 JKBD Cc1ccc(/C(O)=C(/C(=S)Nc2ccc3ccccc3c2)[n+]2cccc(O)c2)cc1[N+](=O)[O-] 917609655 CUCNPWITXJDWTK-UHFFFAOYSA-O 458.519 5.373 5 20 JKBD C[C@H](Sc1cc(Cl)ccc1Cl)C(=O)O[C@@H](C)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 919509302 NSQGLZKVUNZBFV-QWRGUYRKSA-N 468.318 5.737 5 20 JKBD C[C@H](NC(=O)c1cc([N+](=O)[O-])ccc1Sc1ccccc1)c1ccc(N2CCOC2=O)cc1 920953017 WYHSGVJFDXIADA-INIZCTEOSA-N 463.515 5.194 5 20 JKBD O=C(/C=C\c1ccc(Br)o1)Oc1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2Cl)cc1 923478849 IAFVSVYCFGXTJH-YFHOEESVSA-N 491.681 5.475 5 20 JKBD C[C@@H](Sc1cccs1)C(=O)NC1(c2ccc(NC(=O)/C=C/c3ccc([N+](=O)[O-])o3)cc2)CCC1 1786207496 RWWXCAAHFVZLDJ-PXUDHTSWSA-N 497.598 5.577 5 20 JKBD CCOc1cccc(C(=O)Nc2ccc(C3(NC(=O)c4cccc(F)c4[N+](=O)[O-])CCC3)cc2)c1 1790342411 MPSACDKTFIBCIL-UHFFFAOYSA-N 477.492 5.194 5 20 JKBD COc1ccc(CC(=O)Nc2ccc(C3(NC(=O)[C@@]4(F)CCCC=C4F)CCC3)cc2)c([N+](=O)[O-])c1 1790573552 IEAZYSLZPOKYRY-AREMUKBSSA-N 499.514 5.026 5 20 JKBD COc1cc(C(=O)Nc2ccc(C3(NC(=O)[C@H]4CC[C@H](C)CC4)CCC3)cc2)cc([N+](=O)[O-])c1OC 1790813366 ZFUUMQYNEUBBLQ-IYARVYRRSA-N 495.576 5.186 5 20 JKBD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc2cc([N+](=O)[O-])ccc2s1)c1cccc(Cl)c1 1801207348 XCCHJXWVGPGURH-BCDXTJNWSA-N 469.950 5.029 5 20 JKBD CCC[C@H]1CC[C@H](C(=O)NC[C@@H]2CCN(C(=O)c3ccc([N+](=O)[O-])cc3F)[C@H]2c2cccnc2)CC1 1812789319 IERQJOKXZVTITN-DDLLOKISSA-N 496.583 5.055 5 20 JKBD C[C@@H](C(=O)N1CCCC[C@@H]1c1cc(NC(=O)/C=C/c2ccc([N+](=O)[O-])o2)n[nH]1)c1ccc(Cl)cc1 1814964881 QBLWMZLVSOEGDK-NEWQJLAGSA-N 497.939 5.074 5 20 JKBD C[C@H](Sc1nnc(-c2ccccc2Cl)n1C1CCCC1)C(=O)Nc1ccccc1[N+](=O)[O-] 8988903 YJVCFEVMDJWSAZ-AWEZNQCLSA-N 471.970 5.741 5 20 JKBD O=C(COc1ccc2c(-c3ccc([N+](=O)[O-])cc3)cc(=O)oc2c1)Nc1ccccc1-c1ccccc1 28609991 SMUMLBQNNPXJAS-UHFFFAOYSA-N 492.487 6.053 5 20 JKBD O=C(c1ccc(NCc2ccccc2Cl)c([N+](=O)[O-])c1)N1CCC(c2nc3ccccc3[nH]2)CC1 29268306 KOLXHWQRCQBHOK-UHFFFAOYSA-N 489.963 5.756 5 20 JKBD Cc1c(NC(=O)Cn2c3ccccc3c(=O)c3ccccc32)cccc1C(=O)Nc1ccccc1 60274115 VUHLRSPAXUQMFU-UHFFFAOYSA-N 461.521 5.354 5 20 JKBD Cc1csc(Sc2ccc(C(=O)Nc3cccc(OCc4cccnc4)c3)cc2[N+](=O)[O-])n1 107986050 VCJQWLLUSUWJEL-UHFFFAOYSA-N 478.555 5.737 5 20 JKBD Cc1ccc(NC(=O)[C@@H](OC(=O)c2cc(C3CC3)nc3onc(C)c23)c2ccccc2)c([N+](=O)[O-])c1 115406847 GFYQENZVIUCZDV-QHCPKHFHSA-N 486.484 5.162 5 20 JKBD O=C(c1csc(-c2ccc([N+](=O)[O-])cc2)n1)N(C[C@H]1CCCO1)c1nc2ccccc2s1 496411807 OPOSEKZNWDRCTH-MRXNPFEDSA-N 466.544 5.154 5 20 JKBD CC(C)(C)S(=O)(=O)Cc1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2Oc2ccccc2)cc1 497778734 NPHLAXYNLJYYLJ-UHFFFAOYSA-N 468.531 5.353 5 20 JKBD O=C(NC[C@H]1CCCCN1C(=O)c1ccc(NCc2ccccc2)c([N+](=O)[O-])c1)Nc1ccccc1 502717751 FFLLNOAXDRLOAZ-HSZRJFAPSA-N 487.560 5.023 5 20 JKBD Cn1c([C@@H]2CCCN2C(=O)c2ccc(NCc3ccccc3)c([N+](=O)[O-])c2)nc2ccccc21 503147774 JSVJNPPBWBCDIA-QHCPKHFHSA-N 455.518 5.071 5 20 JKBD CCN(C(=O)c1ccc(OC)c([N+](=O)[O-])c1)[C@@H]1CCSc2ccc(Br)cc21 504630624 ZSIDKXDRQCXULK-OAHLLOKOSA-N 451.342 5.065 5 20 JKBD C[C@H](Nc1ccc(C(=O)Nc2cc(Cl)c(Cl)cc2Cl)cc1[N+](=O)[O-])c1ccccn1 506159636 IXQAMWXGOYSATF-NSHDSACASA-N 465.724 6.375 5 20 JKBD COc1cc(C(=O)Nc2ccc(NC(=O)c3ccccc3)cc2C(F)(F)F)ccc1[N+](=O)[O-] 508925172 GBERLWPPBGDZIJ-UHFFFAOYSA-N 459.380 5.127 5 20 JKBD CCOc1cc(NC(=O)C(=O)N[C@H](c2ccc(Cl)cc2)C2CCCC2)c([N+](=O)[O-])cc1OCC 517288286 LKBGFBLYKWAPGC-QFIPXVFZSA-N 489.956 5.032 5 20 JKBD C[C@H](Nc1ccc(C(=O)Nc2cc(C(C)(C)C)nn2-c2ccccn2)cc1[N+](=O)[O-])c1ccccn1 518126785 IYEYYHRWSNEIAD-KRWDZBQOSA-N 485.548 5.293 5 20 JKBD O=C(NC1(c2ccc(Br)cc2)CCC1)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-] 520012502 YQZIMGZVADYHAV-UHFFFAOYSA-N 473.245 5.108 5 20 JKBD O=C(Cn1c2ccccc2c(=O)c2ccccc21)N(Cc1ccccc1)Cc1ccccc1F 520152277 ORAFATNZJLKGMT-UHFFFAOYSA-N 450.513 5.523 5 20 JKBD COc1ccc(COCc2cccc(NC(=O)C3CCN(c4ccccc4[N+](=O)[O-])CC3)c2)cc1 520652415 ZHINGDXESWSXHD-UHFFFAOYSA-N 475.545 5.175 5 20 JKBD O=[N+]([O-])c1ccc(-c2ccc(CNCc3ccnc(OCC(F)(F)F)c3)o2)c(Br)c1 521815402 YTPALEPAFBQMIZ-UHFFFAOYSA-N 486.244 5.243 5 20 JKBD Cc1cc(-c2cc(C(=O)N(Cc3ccccc3[N+](=O)[O-])CC(F)(F)F)c3c(C)noc3n2)c(C)o1 603741921 DSSOJPANVSVFTB-UHFFFAOYSA-N 488.422 5.521 5 20 JKBD O=C(Cc1csc(-c2ccc(Cl)cc2)n1)Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1 603818789 WUPQHOAIWYFZIR-UHFFFAOYSA-N 456.936 5.676 5 20 JKBD COc1ccccc1N1CC[C@H](CNCc2ccc(-c3ccc([N+](=O)[O-])cc3Br)o2)C1 608836904 PVAUTFKIWRPKSA-MRXNPFEDSA-N 486.366 5.242 5 20 JKBD CCN1CCC(n2nccc2NC(=O)c2ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])cc2)CC1 609355368 FTWJRNBQVCBGCT-UHFFFAOYSA-N 469.929 5.146 5 20 JKBD CC(C)(C)c1nc(C(=O)Oc2ccc(NC(=O)c3cc([N+](=O)[O-])ccc3Cl)cc2)cs1 726497166 FISNLXDUSYKYBK-UHFFFAOYSA-N 459.911 5.474 5 20 JKBD O=C(C[C@@H](c1ccccc1)C(F)(F)F)Oc1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2Cl)cc1 728456310 HYZQUXCOUYQQJS-IBGZPJMESA-N 492.837 6.142 5 20 JKBD Cc1ccc(Cl)c(NC(=S)/C(=C(/O)c2ccc([N+](=O)[O-])cc2)[n+]2cccc(O)c2)c1Cl 728558300 JUVCZIWWXFUKQJ-UHFFFAOYSA-O 477.349 5.526 5 20 JKBD COc1ccccc1[C@H](C)CC(=O)O[C@H](C(=O)Nc1ccc(C)cc1[N+](=O)[O-])c1ccccc1 728658691 NIIPQLFALCDASE-CJAUYULYSA-N 462.502 5.329 5 20 JKBD O=C(Nc1cc([N+](=O)[O-])c(F)cc1F)c1cnn(-c2ncc(Cl)cc2Cl)c1C(F)(F)F 730742378 BGKXKYHEODEPPH-UHFFFAOYSA-N 482.152 5.032 5 20 JKBD O=C(Nc1ccc(OCc2ccccn2)c(Cl)c1)c1ccc(Br)c([N+](=O)[O-])c1 743695594 LAIOBLRWMXYTNA-UHFFFAOYSA-N 462.687 5.237 5 20 JKBD Cc1ccc(C)c(C(=O)c2ccccc2C(=O)O[C@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)c1 746114838 WQKRXFSYWMMFLX-QGZVFWFLSA-N 471.469 5.411 5 20 JKBD O=C(Nc1ccc(OC(=O)c2ccccc2Oc2cccnc2)cc1)c1cc([N+](=O)[O-])ccc1Cl 748044531 DXLXNMNMJKDNHJ-UHFFFAOYSA-N 489.871 5.907 5 20 JKBD CSc1ccc(C(=O)c2ccccc2C(=O)Nc2ccc(NC(C)=O)c(C)c2)cc1[N+](=O)[O-] 893602767 PPWJIWVRCVCVIU-UHFFFAOYSA-N 463.515 5.067 5 20 JKBD C[C@@H](NC(=O)c1ccccc1NC(=O)c1ccc([N+](=O)[O-])cc1Cl)c1ccc(OC(F)F)cc1 913016004 MFXVDOOHKOFDNN-CYBMUJFWSA-N 489.862 5.593 5 20 JKBD CCN(Cc1ccccc1)C(=O)c1cc(NC(=O)c2cc([N+](=O)[O-])cc([N+](=O)[O-])c2)ccc1Cl 917765899 AMUHKSPUUBIFJZ-UHFFFAOYSA-N 482.880 5.071 5 20 JKBD Cc1ccc(C(C)C)cc1O[C@@H](C)C(=O)O[C@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 919408919 WPYFQIDJTBUYSQ-CABCVRRESA-N 482.455 5.383 5 20 JKBD Cn1cc(CCCOC(=O)C/C(=C/c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)cn1 920514469 XRLWHCCXAMPQEX-UYRXBGFRSA-N 462.531 5.045 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)c3cnc(-c4ccccc4)s3)CCC2)cc1)c1ccc([N+](=O)[O-])o1 1785750055 OOKHWULKAQBUGX-UHFFFAOYSA-N 488.525 5.373 5 20 JKBD O=C(NC1(c2ccc(NC(=O)[C@@H]3C[C@@H]3C3CC3)cc2)CCC1)c1cc(Br)ccc1[N+](=O)[O-] 1786056023 JQJSTNFAVXVJLV-RTBURBONSA-N 498.377 5.151 5 20 JKBD O=C(Cc1cccc([N+](=O)[O-])c1)NC1(c2ccc(NC(=O)[C@H]3CCCCC3(F)F)cc2)CCC1 1786461748 IUXATUFCFWBLNH-OAQYLSRUSA-N 471.504 5.097 5 20 JKBD Cc1cc(C(=O)Nc2ccc(C3(NC(=O)c4cc(-c5ccccc5)on4)CCC3)cc2)ncc1[N+](=O)[O-] 1788764368 AIMMXXYENJPKIS-UHFFFAOYSA-N 497.511 5.015 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)c3ccc([N+](=O)[O-])[nH]3)CCC2)cc1)c1csc(-c2ccccc2)n1 1788835071 UBHNLBLSVMPUKU-UHFFFAOYSA-N 487.541 5.108 5 20 JKBD COc1cc(CC(=O)Nc2ccc(C3(NC(=O)/C=C/c4cccs4)CCC3)cc2)ccc1[N+](=O)[O-] 1790478224 SXAZXURKXQTOGN-ZRDIBKRKSA-N 491.569 5.055 5 20 JKBD Cc1ccc(C2(C(=O)N[C@@H]3C[C@@H]4CC[C@H](C3)N4C(=O)/C=C/c3ccc([N+](=O)[O-])o3)CCCCC2)cc1 1793277349 HGHHXJMMVFVCBF-QZSXNWDBSA-N 491.588 5.050 5 20 JKBD CC[C@H](C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cc(Cl)cc([N+](=O)[O-])c1C)C2)c1ccccc1 1795457879 NBIBHEORLGQRNX-WOZUAGRISA-N 469.969 5.002 5 20 JKBD CC(C)(C)CCCCCC(=O)N1CC[C@H](CNC(=O)Cc2cccc([N+](=O)[O-])c2)[C@@H]1c1cccnc1 1802382159 OOTWCJOMYKIDQB-KCWPFWIISA-N 494.636 5.235 5 20 JKBD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2ccc([N+](=O)[O-])[nH]2)[nH]n1)c1cccc2c1oc1ccccc12 1821612140 YVGCNZVORCGDGB-FQEVSTJZSA-N 498.499 5.165 5 20 JKBD C[C@@H](C(=O)N1CCC([C@@H]2CCCCN2C(=O)Cc2cccc([N+](=O)[O-])c2)CC1)c1ccc(Cl)cc1 1823676996 MRQRZKFFVWJXGH-CLOONOSVSA-N 498.023 5.214 5 20 JKBD COc1cc(C(=O)N2CCC([C@@H]3CCCCN3C(=O)/C(C)=C/c3cccs3)CC2)ccc1[N+](=O)[O-] 1823719691 NKLMBGDKVSLQPU-BKELBIJQSA-N 497.617 5.002 5 20 JKBD O=C(c1cc2sccc2s1)N1CCC([C@@H]2CCCCN2C(=O)/C=C/c2ccc([N+](=O)[O-])o2)CC1 1824277127 QLAFNCZTKURBPG-JXTAAOLFSA-N 499.614 5.411 5 20 JKBD O=C(c1cc2cc([N+](=O)[O-])ccc2s1)N1CCC([C@H]2CCCCN2C(=O)Cc2cccs2)CC1 1827160174 MSVZNBVHEGUDFZ-OAQYLSRUSA-N 497.642 5.347 5 20 JKBD CN(C)c1ccc([N+](=O)[O-])c(C(=O)N2CCC([C@@H]3CCCCN3C(=O)/C=C/C3CCCCC3)CC2)c1 1830356180 PWKJULRUIXNCKF-MYILAFDMSA-N 496.652 5.031 5 20 JKBD O=C(c1cccc2ccoc12)N1CCC([C@@H]2CCCCN2C(=O)c2ccc([N+](=O)[O-])cc2F)CC1 1830498686 DAUHKZXAUDFWEA-QHCPKHFHSA-N 479.508 5.027 5 20 JKBD O=C(CCc1ccoc1)N1CCC([C@@H]2CCCCN2C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)CC1 1831061729 JKUFRIFIQBHINI-QFIPXVFZSA-N 495.601 5.269 5 20 JKBD O=C(C1CCC(c2ccc(Cl)cc2)CC1)N1CC2(CCCN2C(=O)/C=C/c2ccc([N+](=O)[O-])o2)C1 1841442952 LVFYAVBJMKIRER-ZRDIBKRKSA-N 497.979 5.032 5 20 JKBD Cc1ccc([N+](=O)[O-])cc1NC(=O)CSc1nnc(-c2ccccc2F)n1Cc1ccccc1 9330664 SHLLCMJNVHDWQM-UHFFFAOYSA-N 477.521 5.080 5 20 JKBD Cc1ccc(-c2cc(C(=O)O[C@H](C)c3nnc(-c4ccc([N+](=O)[O-])cc4)o3)c3ccccc3n2)o1 17654376 PEEDPODSILMDPV-OAHLLOKOSA-N 470.441 5.679 5 20 JKBD CC(=O)N1C=Cc2ccccc2[C@H]1CC(=O)O[C@H](C(=O)Nc1ccc(C)cc1[N+](=O)[O-])c1ccccc1 18745592 RKLUUYKAVXEQDL-SQHAQQRYSA-N 499.523 5.090 5 20 JKBD CCOC(=O)c1sc(-c2ccc(OC)cc2)cc1NC(=S)Nc1ccc([N+](=O)[O-])cc1 18944962 LLTHXXZYHABALV-UHFFFAOYSA-N 457.533 5.318 5 20 JKBD O=C(CSc1ncnc2sc(-c3ccccc3)cc12)Nc1ccc([N+](=O)[O-])cc1Cl 20789972 MAXKLAIRCGHTDX-UHFFFAOYSA-N 456.936 5.651 5 20 JKBD C[C@@H](Sc1nc2nn(-c3ccccc3)c(=O)c-2c2n1CCCCC2)c1cccc([N+](=O)[O-])c1 21245989 AHDNICXXIUEURO-MRXNPFEDSA-N 461.547 5.022 5 20 JKBD Cc1c(NC(=O)[C@@H](C)OC(=O)/C(=C/c2ccc(F)cc2)c2cccs2)cccc1[N+](=O)[O-] 23196740 VWVJGRIMALVXPO-COYFKBPASA-N 454.479 5.215 5 20 JKBD O=C(C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)NCCc1cccc2cccnc12 29454312 XDTCFWQCRLDZAW-XLNRJJMWSA-N 494.576 6.042 5 20 JKBD C[C@@H](NC(=O)Cn1c2ccccc2c(=O)c2ccccc21)c1ccc(OCc2cccnc2)cc1 32678157 UUWLOZXPCDYJLK-HXUWFJFHSA-N 463.537 5.006 5 20 JKBD COc1cc(C(=O)Nc2ccc(Br)cn2)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 69524681 FQFCLGFIGUBNPP-UHFFFAOYSA-N 478.686 5.459 5 20 JKBD COc1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2I)cc1Cc1ccccc1 106282917 JAVBJVOKDBVPJW-UHFFFAOYSA-N 488.281 5.051 5 20 JKBD CCCS(=O)(=O)Nc1cccc(NC(=O)c2ccc(Nc3ccccc3)c([N+](=O)[O-])c2)c1C 109146217 KSFLIWDXXIGFOO-UHFFFAOYSA-N 468.535 5.051 5 20 JKBD C[C@H](Nc1ccc(C(=O)N(Cc2cccc(Br)c2)C2CC2)cc1[N+](=O)[O-])c1ccccn1 302967418 HKULPOJXZGJWGN-INIZCTEOSA-N 495.377 5.730 5 20 JKBD O=C(NCc1ccccc1F)c1ccc(NC(=O)c2csc(-c3ccc([N+](=O)[O-])cc3)n2)cc1 496241716 CGHCUQNKNSAEDB-UHFFFAOYSA-N 476.489 5.040 5 20 JKBD COc1ccc(F)cc1-c1csc(NC(=O)c2csc(-c3ccc([N+](=O)[O-])cc3)n2)n1 496242331 DNRKVOCGQPTGRK-UHFFFAOYSA-N 456.480 5.242 5 20 JKBD Cc1nn(Cc2ccc(C(=O)N(C)[C@H](C)c3ccc(Cl)c(Cl)c3)cc2)c(C)c1[N+](=O)[O-] 498992716 YFKYSZUDQJYWQJ-CQSZACIVSA-N 461.349 5.596 5 20 JKBD O=C(C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1)N1CCCc2cc(OC(F)F)ccc21 509655364 FMNUKNXTHGLFQE-UHFFFAOYSA-N 499.436 5.411 5 20 JKBD O=C(c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1)N(Cc1ccncc1)Cc1cccnc1 517805429 FNSLVUIKRLZROA-UHFFFAOYSA-N 474.904 5.673 5 20 JKBD C[C@@H]1CN(C(=O)C/C(=C\c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)CC(C)(C)O1 518929464 UWRIXCMIVUBXOQ-YAJBTMAUSA-N 451.548 5.161 5 20 JKBD CC(=O)Nc1cccc(OCCNC(=O)c2cc([N+](=O)[O-])ccc2Sc2ccc(Cl)cc2)c1 519124568 LOHMKMUITUXHPI-UHFFFAOYSA-N 485.949 5.167 5 20 JKBD Cc1cc(C(=O)NC2CCCC2)ccc1NC(=O)CCNc1ccc(C(F)(F)F)cc1[N+](=O)[O-] 521325630 UAPNUTZCJKOZRG-UHFFFAOYSA-N 478.471 5.035 5 20 JKBD Cc1ncc(CN(c2cccc(C(F)(F)F)c2)S(=O)(=O)c2ccc(C)c([N+](=O)[O-])c2)s1 521592361 IEXYHYCVVNGBFT-UHFFFAOYSA-N 471.482 5.082 5 20 JKBD C[C@H]1CCCN(c2ccc(C(=O)N3CCC[C@@H](c4nc(-c5cccc(F)c5)no4)C3)cc2[N+](=O)[O-])C1 522577642 VICCWUUKRIIVPI-FXAWDEMLSA-N 493.539 5.040 5 20 JKBD CC(=O)c1ccc(NC(=O)C/C(=C\c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)cc1 601126678 YGAMRAYKCYZVFW-XMHGGMMESA-N 457.511 5.977 5 20 JKBD Cc1cc(C)n(-c2cccc(NC(=O)C3CCN(c4ccc(C(F)(F)F)cc4[N+](=O)[O-])CC3)c2)n1 603667150 VALRTVCQBIOABX-UHFFFAOYSA-N 487.482 5.271 5 20 JKBD O=C(Cc1csc2nc(-c3ccccc3)cn12)N(Cc1ccccc1[N+](=O)[O-])CC(F)(F)F 603741937 FZULVUJQJMIVNU-UHFFFAOYSA-N 474.464 5.105 5 20 JKBD C[C@@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccc(NC(=O)c2ccccc2)cc1C(F)(F)F 603742877 JAYKFRRQOVQCLW-CQSZACIVSA-N 489.475 5.985 5 20 JKBD Cc1csc(Sc2ccc(C(=O)NCc3ccc(OCc4ccccn4)cc3)cc2[N+](=O)[O-])n1 603982799 LGXQYRUAUUEENI-UHFFFAOYSA-N 492.582 5.415 5 20 JKBD O=C(Nc1ccc(Cl)c(C(=O)NC2CCCCC2)c1)c1cc2cc([N+](=O)[O-])ccc2s1 604025696 PIIBYUZNYHKUTM-UHFFFAOYSA-N 457.939 5.778 5 20 JKBD O=C(Nc1ccccc1OCc1ncc(-c2cccc(Cl)c2)o1)c1c[nH]c2cc([N+](=O)[O-])ccc12 608855258 FBDIZZXACIQWBW-UHFFFAOYSA-N 488.887 6.216 5 20 JKBD Cc1[nH]c2ccccc2c1CCNC(=O)Cc1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1 608881748 FHAVHMDRVPYZHH-UHFFFAOYSA-N 479.540 5.139 5 20 JKBD O=C1CCCCN1c1ccc(CNCc2cn(-c3ccccc3)nc2-c2ccc([N+](=O)[O-])cc2)cc1 726607552 ZQQHYQUIEGNXQE-UHFFFAOYSA-N 481.556 5.254 5 20 JKBD C[C@@H](OC(=O)[C@@H](C)Oc1cc(Cl)cc(Cl)c1)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 727217529 DVKPIPJLYGAPED-NXEZZACHSA-N 495.237 5.258 5 20 JKBD Cc1csc(SCc2ccc(C(=O)OC[C@H]3CCCN3C(=O)c3ccccc3[N+](=O)[O-])cc2)n1 730702610 CRBQBQWLXHUNFY-LJQANCHMSA-N 497.598 5.114 5 20 JKBD O=C(OCc1nc(-c2cccc(C(F)(F)F)c2)no1)c1csc(-c2cccc([N+](=O)[O-])c2)n1 747962412 OQONDSKCNTZIIP-UHFFFAOYSA-N 476.392 5.144 5 20 JKBD O=C(Nc1ccc(Oc2ccccc2)cc1C(F)(F)F)c1cc([N+](=O)[O-])ccc1Br 751111686 WBWINSSNEYCOEQ-UHFFFAOYSA-N 481.224 6.421 5 20 JKBD O=C(Nc1ncc(Cc2cccc(Br)c2)s1)c1cc([N+](=O)[O-])ccc1Br 751150124 VSHSZQDJNYSWOJ-UHFFFAOYSA-N 497.168 5.419 5 20 JKBD COc1ccc(Oc2ccc([N+](=O)[O-])cc2C(=O)O[C@@H](C)C(=O)Nc2cc(C)ccc2C)cc1 915250283 RLPSCVGAYACELZ-KRWDZBQOSA-N 464.474 5.197 5 20 JKBD Cc1cc(O[C@@H](C)C(=O)N(Cc2nnc(-c3cccc([N+](=O)[O-])c3)o2)C(C)C)ccc1C(C)C 916036168 FITJRLHLZURRFY-SFHVURJKSA-N 466.538 5.281 5 20 JKBD Cc1nn(C(C)(C)C)c2nc(C(C)C)cc(C(=O)N(C)Cc3cc([N+](=O)[O-])ccc3Cl)c12 917069005 GROCYYVYGPNYTE-UHFFFAOYSA-N 457.962 5.452 5 20 JKBD CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)Cc1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1 919868094 QQDKAAKBGMWSTG-UHFFFAOYSA-N 499.527 5.335 5 20 JKBD O=C(NC1(c2ccc(NC(=O)[C@H]3C[C@@H]3C3CC3)cc2)CCC1)c1ccc(Br)c([N+](=O)[O-])c1 1786057672 XDFOGSXORJICEP-MOPGFXCFSA-N 498.377 5.151 5 20 JKBD COc1cc(C(=O)Nc2ccc(C3(NC(=O)[C@]4(F)CCCC=C4F)CCC3)cc2)ccc1[N+](=O)[O-] 1792166399 PFLCYYRHSWOLSK-VWLOTQADSA-N 485.487 5.097 5 20 JKBD O=C(NC1(c2ccc(NC(=O)c3cc(F)ccc3C(F)(F)F)cc2)CCC1)c1ccc([N+](=O)[O-])[nH]1 1792172981 ARDXALYEQUFULB-UHFFFAOYSA-N 490.413 5.142 5 20 JKBD Cc1c(C(=O)N2CC[C@@H](CNC(=O)C3(C(C)C)CCC3)[C@@H]2c2cccnc2)cc(Cl)cc1[N+](=O)[O-] 1813665830 LEYRJCWXPLYCHF-CVDCTZTESA-N 499.011 5.098 5 20 JKBD CC(C)(C)CC(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)[nH]n1 1816763790 QUCMYSFPIWNQQV-KRWDZBQOSA-N 469.567 5.275 5 20 JKBD O=C(Cn1ccc2ccc([N+](=O)[O-])cc21)N1CCC([C@@H]2CCCCN2C(=O)CCC2CCCC2)CC1 1826264479 FPSWOZCQDQHANJ-VWLOTQADSA-N 494.636 5.140 5 20 JKBD O=C(c1ccc([N+](=O)[O-])o1)N1CCC([C@H]2CCCCN2C(=O)c2cc(Cl)sc2Cl)CC1 1829451041 KGRXQMDMMZOXDP-CQSZACIVSA-N 486.377 5.103 5 20 JKBD Cc1ccc([C@H](C)C(=O)N2CCC([C@@H]3CCCCN3C(=O)Cc3ccc([N+](=O)[O-])cc3F)CC2)cc1 1831293738 HLBRDEIVUFXSGV-FNZWTVRRSA-N 495.595 5.008 5 20 JKBD CC1(C(=O)N2CCCC[C@H]2C2CCN(C(=O)CSc3ccccc3[N+](=O)[O-])CC2)CCCCC1 1831794299 DAGKIVCXQGNWCF-NRFANRHFSA-N 487.666 5.277 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Cl)[C@H](NCc1ccc(OCC(F)(F)F)cc1)c1ccccc1 23630535 RKOYSKFFIUYJRV-OAQYLSRUSA-N 493.869 5.659 5 20 JKBD CN(Cc1ccccc1C(F)(F)F)C(=O)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 69550885 SZHCDYUBDJIJCR-UHFFFAOYSA-N 489.416 5.507 5 20 JKBD C[C@@H]1CCCN(c2ccc(C(=O)Nc3nnc(SCc4ccccc4)s3)cc2[N+](=O)[O-])C1 409595281 KSCGSYAKGDVRCC-OAHLLOKOSA-N 469.592 5.227 5 20 JKBD C[C@@H](Nc1ccc(C(=O)Nc2ccccc2NC(=O)C[C@H]2C=CCC2)cc1[N+](=O)[O-])c1ccccn1 409988497 WHUKTGWJSPWSQT-MOPGFXCFSA-N 485.544 5.710 5 20 JKBD CC(C)N1CCC(N(C)C(=O)c2ccccc2Sc2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 476156578 OJSROPRBMAOYSB-UHFFFAOYSA-N 481.540 5.710 5 20 JKBD O=C(C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)Nc1ccnn1C[C@H]1CCOC1 486244879 MPHZZYPNOUZIOK-UIMCMNAESA-N 489.557 5.007 5 20 JKBD O=C(C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)NCCOC1CCCC1 489009558 YSRRANKFYNBXJI-OBGWFSINSA-N 451.548 5.211 5 20 JKBD C[C@@H](c1ccccc1F)N(C)C(=O)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 498326271 PIOVNTHNTMCIGW-AWEZNQCLSA-N 453.436 5.189 5 20 JKBD O=C(C[C@H]1C=CCC1)Nc1ccccc1NC(=O)c1ccc(NCc2ccccc2)c([N+](=O)[O-])c1 500901884 GTRSIMQZLNNUCU-IBGZPJMESA-N 470.529 5.754 5 20 JKBD C[C@H](NC(=O)C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)c1ccc2c(c1)CC(=O)N2 501049670 CHOGKTAPOXOWIT-DORSJAEJSA-N 498.564 5.507 5 20 JKBD CCCCOc1ccc([C@@H](C)NC(=O)Cn2c3ccccc3c(=O)c3ccccc32)cc1OC 501485054 ZOZVFCBXKALQLI-LJQANCHMSA-N 458.558 5.220 5 20 JKBD O=C(Cc1ccc([N+](=O)[O-])cc1)Nc1nnc(SCc2c(Cl)cccc2Cl)s1 514612951 WMTZAYNNZBFXGE-UHFFFAOYSA-N 455.348 5.227 5 20 JKBD C[C@@H](Cc1ccsc1)NC(=O)C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1 516538414 PHSSWCYUZZPLQX-HUCUOGIVSA-N 463.584 5.944 5 20 JKBD O=C(Nc1ccc(Oc2ccccc2)cc1C(F)(F)F)c1ccn(-c2cccc([N+](=O)[O-])c2)n1 519082820 JTDFKXZPAISKGA-UHFFFAOYSA-N 468.391 5.844 5 20 JKBD CCOc1ccc(OC)cc1NC(=O)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])c(OC)c1 520546445 DERXVDUCHPLYBI-UHFFFAOYSA-N 472.881 5.709 5 20 JKBD COc1ccc(NC(=O)CCOc2ccccc2[N+](=O)[O-])cc1OCc1ccc2ccccc2n1 524127762 KAXIEPDIVHRSRQ-UHFFFAOYSA-N 473.485 5.138 5 20 JKBD O=C(CSc1ccc([N+](=O)[O-])cc1)N(c1cccc(Cl)c1)c1nc2ccccc2s1 601867536 BUCDWONUQGUAKI-UHFFFAOYSA-N 455.948 6.315 5 20 JKBD CC(C)Oc1cccc([C@H](C)N[C@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2ccccc2)c1 604044820 COGGTZRTXSFUDM-XDHUDOTRSA-N 467.953 6.066 5 20 JKBD O=C(Nc1cc(OCC(F)(F)F)cc(OCC(F)(F)F)c1)c1c[nH]c2ccc([N+](=O)[O-])cc12 608853278 YMPIZYCENZFCNV-UHFFFAOYSA-N 477.317 5.211 5 20 JKBD CC1CCN(c2ccc(C(=O)Nc3ccc(C(=O)Nc4cccnc4)c(Cl)c3)cc2[N+](=O)[O-])CC1 608874800 IVQHHFRLXRZXIO-UHFFFAOYSA-N 493.951 5.384 5 20 JKBD Cc1oc(-c2ccsc2)nc1COC(=O)c1ccccc1C(=O)c1ccc(N(C)C)c([N+](=O)[O-])c1 726804369 XKGXVJPNAQWQST-UHFFFAOYSA-N 491.525 5.274 5 20 JKBD Cc1c(C(=O)Nc2ccc(N3C[C@@H](C)O[C@H](C)C3)c(C(F)(F)F)c2)cc([N+](=O)[O-])c(C)c1[N+](=O)[O-] 728013617 ZVFYNIKGKQKSCV-VXGBXAGGSA-N 496.442 5.005 5 20 JKBD C[C@H](OC(=O)c1c(Cl)cccc1[N+](=O)[O-])C(=O)N1c2ccccc2Sc2ccccc21 730643223 OLYPUJGCZVPYLT-ZDUSSCGKSA-N 454.891 5.623 5 20 JKBD C[C@H](OC(=O)CSc1ccc2c3c(cccc13)CC2)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 746095495 RLVHTWUXMOZDLL-AWEZNQCLSA-N 461.499 5.293 5 20 JKBD C[C@@H](Nc1ccc(C(=O)O[C@H](c2ccncc2)c2ccc(F)cc2)cc1[N+](=O)[O-])c1ccccn1 748569918 AOMZYSREXHTAPU-NSYGIPOTSA-N 472.476 5.643 5 20 JKBD CC(C)(C)OC(=O)N1CCC[C@@H](CNC(=O)c2cc([N+](=O)[O-])ccc2Sc2ccccc2)C1 751162066 HVYDZITXPCRGNM-KRWDZBQOSA-N 471.579 5.123 5 20 JKBD O=[N+]([O-])c1cc(C(F)(F)F)ccc1NCCc1nc(-c2ccc(OCc3cccnc3)cc2)no1 904467020 VYISOSHWEYHPET-UHFFFAOYSA-N 485.422 5.292 5 20 JKBD C[C@@H](Oc1ccc(Cl)cc1Br)C(=O)O[C@H](C)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 907683922 OMMGDJKMCNOSLN-GHMZBOCLSA-N 496.701 5.132 5 20 JKBD Cn1c(C(=O)O[C@@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2ccccc2)cc(Cl)c1Cl 914614558 KUCVVWYQUTWRGV-QGZVFWFLSA-N 482.707 5.430 5 20 JKBD O=c1nc(/C(Cl)=C\c2ccc(-c3ccc([N+](=O)[O-])cc3Br)o2)[nH]c2ccccc12 916139957 ILUVNGDUDDZHLH-MHWRWJLKSA-N 472.682 5.591 5 20 JKBD O=C(/C=C/c1ccc([N+](=O)[O-])o1)Nc1ccc(C2(NC(=O)c3cccc4ccncc34)CCC2)cc1 1786207913 SQEWCUZOSKYKDN-PKNBQFBNSA-N 482.496 5.197 5 20 JKBD Cc1ccc(CCC(=O)Nc2ccc(C3(NC(=O)c4ccc([N+](=O)[O-])o4)CCC3)cc2)cc1F 1786333536 VEJOBSUYACBVID-UHFFFAOYSA-N 465.481 5.016 5 20 JKBD O=C(Cc1ccc([N+](=O)[O-])cc1F)NC1(c2ccc(NC(=O)[C@@H]3CCCCC3(F)F)cc2)CCC1 1786464477 CARHFGOPHFBCOX-FQEVSTJZSA-N 489.494 5.236 5 20 JKBD CCO/C=C/C(=O)Nc1ccc(C2(NC(=O)CCCc3cc(C)c(F)cc3[N+](=O)[O-])CCC2)cc1 1791738781 PBHMSVUTWRDOMN-NTCAYCPXSA-N 483.540 5.049 5 20 JKBD C[C@H](C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cc(F)cc([N+](=O)[O-])c2)[nH]n1)c1ccc(Cl)cc1 1814662092 YXISGRZJOKMPBV-QKKBWIMNSA-N 499.930 5.220 5 20 JKBD Cc1ccc2cc(C(=O)N3CCC([C@H]4CCCCN4C(=O)c4ccc([N+](=O)[O-])o4)CC3)sc2c1 1823614822 CHFIMYOANCDABO-LJQANCHMSA-N 481.574 5.258 5 20 JKBD CC[C@@H](C(=O)N1CCC([C@H]2CCCCN2C(=O)Cc2ccc([N+](=O)[O-])cc2F)CC1)c1ccccc1 1831290790 HKDPTULKHATOKF-AOYPEHQESA-N 495.595 5.090 5 20 JKBD O=C(/C=C/c1ccsc1)N1CCC([C@@H]2CCCCN2C(=O)/C=C/c2ccccc2[N+](=O)[O-])CC1 1832899572 DAEPCDLEYMZJFS-AGGCPREJSA-N 479.602 5.003 5 20 JKBD Cc1ccc(C)c(N2C(=O)c3ccc(C(=O)Nc4nc(-c5cccc([N+](=O)[O-])c5)cs4)cc3C2=O)c1 14376430 AMDQGILZCIIZOP-UHFFFAOYSA-N 498.520 5.388 5 20 JKBD C[C@H](Sc1nnc([C@H](C)N(C)C)n1-c1ccc(Cl)cc1)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 17718190 JWNHPENHHMQIIO-KBPBESRZSA-N 499.984 5.355 5 20 JKBD COCCN(C(=O)c1sc2cccc(F)c2c1C)c1nc(-c2ccc([N+](=O)[O-])cc2)cs1 20006492 ZXLFVWDTTSHXNV-UHFFFAOYSA-N 471.535 5.674 5 20 JKBD CCn1c(SCC(=O)Nc2ccc([N+](=O)[O-])cc2C)nnc1-c1ccc(C(C)(C)C)cc1 23554480 NBLDDWLQFIIYQM-UHFFFAOYSA-N 453.568 5.210 5 20 JKBD COCc1cccc(C(=O)O[C@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Br)c2ccccc2)c1 26165782 ACXYITZWGJWWEM-NRFANRHFSA-N 499.317 5.041 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Br)[C@@H](c1ccccc1)N1CCO[C@@H](c2ccccc2)C1 29533028 PYDFQZIKKCDGCG-DHIUTWEWSA-N 496.361 5.111 5 20 JKBD O=C(CSc1ccc(C(F)(F)F)cc1[N+](=O)[O-])Nc1ccc(-n2ccnc2)c(Cl)c1 60290234 KOVKMLLYZLSEAY-UHFFFAOYSA-N 456.833 5.184 5 20 JKBD C[C@@H](Nc1ccc(C(=O)Nc2cccc(NC(=O)c3cccs3)c2)cc1[N+](=O)[O-])c1ccccn1 108786761 GSFGUEYLJGSVPL-MRXNPFEDSA-N 487.541 5.729 5 20 JKBD O=c1ccccn1Cc1ccc(CNCc2ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])cc2)cc1 195653601 HHQUTVXGHDFRJQ-UHFFFAOYSA-N 475.932 5.540 5 20 JKBD O=C(Nc1ccc(CNCc2ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])cc2)cc1)c1ccco1 302935816 HYUKKRYDDJQKBW-UHFFFAOYSA-N 477.904 6.176 5 20 JKBD CCOc1ccc(C(=O)N(Cc2ccccc2)[C@H](C)c2cccc(NC(C)=O)c2)cc1[N+](=O)[O-] 302982626 UHEBASLSMYAOLD-GOSISDBHSA-N 461.518 5.356 5 20 JKBD COc1ccc(Oc2ccc([N+](=O)[O-])cc2C(=O)NC[C@H]2CCCO[C@H]2c2ccccc2)cc1 409581257 KBUNMIWVKZGDAQ-CLOONOSVSA-N 462.502 5.293 5 20 JKBD Cc1cc([C@H]2CCCN2C(=O)C/C(=C/c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)on1 481567836 CIFNCWOFTOERMV-JOIYNNFJSA-N 474.542 5.795 5 20 JKBD Cc1cc(NC(=O)c2ccc(NCc3ccccc3)c([N+](=O)[O-])c2)ccc1NC(=O)c1ccco1 492633749 BGUGPYDHWSYPTA-UHFFFAOYSA-N 470.485 5.613 5 20 JKBD CCN(CC)[C@@H](CNC(=O)c1cc(SC)ccc1[N+](=O)[O-])c1ccc(C(F)(F)F)cc1 502528947 CZZKLDOZBCXOSK-IBGZPJMESA-N 455.502 5.148 5 20 JKBD C[C@@H]1CCCN(c2ccc(C(=O)Nc3cccc(OCc4cscn4)c3)cc2[N+](=O)[O-])C1 504988087 HMOIIMSAAYDPJF-MRXNPFEDSA-N 452.536 5.119 5 20 JKBD COc1ccc2[nH]cc(C3=CCN(C(=O)c4ccc(N[C@@H](C)c5ccccn5)c([N+](=O)[O-])c4)CC3)c2c1 507067571 MSLYVKRLVHDOJH-SFHVURJKSA-N 497.555 5.582 5 20 JKBD O=C(Nc1c(F)cc(F)cc1-c1ccccc1)c1ccc([N+](=O)[O-])cc1I 508753109 GPILITPYRBFPNZ-UHFFFAOYSA-N 480.208 5.397 5 20 JKBD Cc1ccc(-c2csc(NC(=O)Cc3csc(-c4ccc5c(c4)OCO5)n3)n2)cc1[N+](=O)[O-] 508803164 STBZYYQBCMWDMK-UHFFFAOYSA-N 480.527 5.060 5 20 JKBD COc1ccc(Oc2ccc([N+](=O)[O-])cc2C(=O)NCc2cccc(NC(=O)C3CCC3)c2)cc1 509202801 LUOQMELRSJOTJT-UHFFFAOYSA-N 475.501 5.064 5 20 JKBD C[C@H]1CCC[C@H](C)N1C(=O)c1cc(Cl)ccc1NC(=O)c1ccn(-c2cccc([N+](=O)[O-])c2)n1 512346996 MNZDAVTUNHBCRC-HOTGVXAUSA-N 481.940 5.089 5 20 JKBD C[C@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)Nc1ccc(NC(=O)c2ccoc2)cc1C(F)(F)F 518857846 DZASOJKZULGWOS-NSHDSACASA-N 497.813 5.518 5 20 JKBD C[C@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)N(Cc1cccnc1)c1ccc(Br)cc1 521250043 LDWFBDQXSRBONP-AWEZNQCLSA-N 490.741 5.406 5 20 JKBD COc1cccc([C@H]2CCCN2C(=O)C/C(=C/c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)c1 590671063 LRNOPIPBKHRSNR-RNEGFDSTSA-N 499.592 6.508 5 20 JKBD CSc1ccc(C(=O)c2ccccc2C(=O)Nc2cccc(OC[C@H]3CCCO3)c2)cc1[N+](=O)[O-] 603496580 YNDYDBSWIFFDGA-HXUWFJFHSA-N 492.553 5.358 5 20 JKBD O=C(c1cc([N+](=O)[O-])ccc1Sc1ccccc1)N1CCC[C@@H](c2nc3ccccc3o2)C1 603626422 QHOVEPRMZJVBNZ-QGZVFWFLSA-N 459.527 5.907 5 20 JKBD COc1ccc([N+](=O)[O-])cc1NC(=O)c1cccnc1SCc1cccc(Br)c1 603637451 JKVANRZUEHDWRQ-UHFFFAOYSA-N 474.336 5.306 5 20 JKBD CC(C)[C@@H](Oc1ccccc1Br)C(=O)Nc1cc([N+](=O)[O-])ccc1OC(F)F 603757149 PZCIRKSNRXDKEO-MRXNPFEDSA-N 459.243 5.001 5 20 JKBD Cc1ccc(C)c(SCc2nc(=O)c3c(C)c(C(=O)NCc4ccc([N+](=O)[O-])cc4)sc3[nH]2)c1 604183942 IJPRBPJERHIZKO-UHFFFAOYSA-N 494.598 5.040 5 20 JKBD Cc1cc(NC(=O)Cc2ccc(NC(=O)c3cc4ccccc4o3)cc2)n(-c2ccc([N+](=O)[O-])cc2)n1 604384936 SINHDPVALYISGZ-UHFFFAOYSA-N 495.495 5.269 5 20 JKBD C[C@@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)Nc1ccc(Cl)c(C(=O)NC2CCCCC2)c1 604446243 GUMHGXYJKWZRBQ-CYBMUJFWSA-N 480.348 5.370 5 20 JKBD Cn1cc(C(=O)Nc2nc(C3CC3)c(Cc3ccc(F)cc3)s2)c(-c2ccc([N+](=O)[O-])cc2)n1 608902605 RKBVLGZZFXKHGJ-UHFFFAOYSA-N 477.521 5.311 5 20 JKBD CCOc1cc(C(=O)N[C@H](C)c2ccc(OCc3cccc(C)c3)cc2)c([N+](=O)[O-])cc1OC 609033091 LKRNWQVFNKNNNK-GOSISDBHSA-N 464.518 5.381 5 20 JKBD O=C(CCC(=O)c1ccc2ccc3cccc4ccc1c2c34)Nc1nnc(-c2ccccn2)s1 727755892 IHDYTECEVXQOCV-UHFFFAOYSA-N 462.534 6.099 5 20 JKBD CC1=C(C(=O)Nc2cccc(C)c2C)[C@@H](c2ccc(-c3ccccc3[N+](=O)[O-])s2)NC(=S)N1 812923824 FTZDOBOJXBXCIX-JOCHJYFZSA-N 478.599 5.372 5 20 JKBD COc1cccc(-c2nc(COC(=O)c3cc([N+](=O)[O-])ccc3N3CCCCC3)cs2)c1OC 823314267 BGLUVODERHGNRT-UHFFFAOYSA-N 483.546 5.083 5 20 JKBD COc1ccc(-c2nc(COC(=O)c3ccccc3C(=O)c3ccc(Cl)c([N+](=O)[O-])c3)co2)cc1 823361690 ORHLYZDNAQWKMG-UHFFFAOYSA-N 492.871 5.500 5 20 JKBD CCOC(=O)c1c(-c2ccc(OC)c(OC)c2)csc1NC(=O)c1cc(Cl)ccc1[N+](=O)[O-] 863982708 ZJRLWFOEAJJRLG-UHFFFAOYSA-N 490.921 5.423 5 20 JKBD Cc1ccc(-c2nnc3n2CCCCC3)cc1NC(=O)c1cc([N+](=O)[O-])ccc1N1CCCCC1 900228864 SRCXPIPEOADEAL-UHFFFAOYSA-N 474.565 5.131 5 20 JKBD O=C(O[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1)c1cc2cc([N+](=O)[O-])ccc2[nH]1 917329796 JPOIYYWDFGVUQY-OAQYLSRUSA-N 494.847 5.175 5 20 JKBD C[C@@H](OC(=O)[C@@H](C)SCc1ncc(-c2ccc(Cl)cc2)o1)C(=O)Nc1ccccc1[N+](=O)[O-] 920673916 YALKSVHZNIUHPH-ZIAGYGMSSA-N 489.937 5.095 5 20 JKBD C[C@@H](Nc1ccc(C(=O)O[C@@H](c2ccccc2)c2ccccn2)cc1[N+](=O)[O-])c1ccccn1 920771119 LPEJULXHGOVAGE-CJAUYULYSA-N 454.486 5.504 5 20 JKBD CCc1cc(C(=O)Nc2ccc(C3(NC(=O)c4cc5cc([N+](=O)[O-])ccc5s4)CCC3)cc2)n[nH]1 1788333674 KFYRSGMJFSDNGN-UHFFFAOYSA-N 489.557 5.157 5 20 JKBD CCOc1ccccc1C(=O)Nc1ccc(C2(NC(=O)c3ccc([N+](=O)[O-])c(OC)c3)CCC2)cc1 1790239900 CVSNLHOPVKTQTM-UHFFFAOYSA-N 489.528 5.064 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)c3cc(O)cc([N+](=O)[O-])c3)CCC2)cc1)c1ccc(Cl)cc1 1790295625 BWFOKOAEJBEHDR-UHFFFAOYSA-N 465.893 5.015 5 20 JKBD Cc1cc(C(=O)NC2(c3ccc(NC(=O)c4ccc(Br)c([N+](=O)[O-])c4)cc3)CCC2)c[nH]1 1790642302 OHQKUKOTSDIDAL-UHFFFAOYSA-N 497.349 5.055 5 20 JKBD CC(=O)Nc1ccccc1C(=O)Nc1ccc(C2(NC(=O)/C=C/c3ccccc3[N+](=O)[O-])CCC2)cc1 1792134311 USTXFSNNCTUNBI-LFIBNONCSA-N 498.539 5.014 5 20 JKBD O=C(/C=C/c1ccccc1[N+](=O)[O-])NC1(c2ccc(NC(=O)[C@@]3(F)CCCC=C3F)cc2)CCC1 1792378474 SYQYBFQGVOWXEX-OYGPHJITSA-N 481.499 5.488 5 20 JKBD Cc1ccc(SCC(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cc4cc([N+](=O)[O-])ccc4s2)C3)cc1 1797688700 WVAOXOSJYMTWOE-REPLKXPHSA-N 495.626 5.162 5 20 JKBD Cc1c(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cccc4ccccc24)C3)cc(Cl)cc1[N+](=O)[O-] 1800711042 KHEPEBXVDMMJRR-ACDBMABISA-N 477.948 5.275 5 20 JKBD C[C@@H](C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cccc(F)c2[N+](=O)[O-])n[nH]1)c1ccc(Cl)cc1 1821167092 CUTBVOJGJKLCMZ-JLTOFOAXSA-N 499.930 5.220 5 20 JKBD O=C(Nc1cc([C@H]2CCCCN2C(=O)CCc2cccc([N+](=O)[O-])c2)[nH]n1)c1ccc(C2CC2)cc1 1821301557 XTHKMEBORFOUAX-XMMPIXPASA-N 487.560 5.134 5 20 JKBD Cc1ccc(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)c3cc4cc([N+](=O)[O-])ccc4s3)n[nH]2)o1 1821611008 LHWOXKOGQORHLO-QGZVFWFLSA-N 479.518 5.054 5 20 JKBD Cc1ccc(CC(=O)N2CCCC[C@H]2c2cc(NC(=O)C[C@H](C)c3ccccc3)n[nH]2)cc1[N+](=O)[O-] 1822045151 NSJBGRHVWDNECX-CVDCTZTESA-N 489.576 5.055 5 20 JKBD Cc1ccc(C(=O)N2CCC([C@H]3CCCCN3C(=O)Cc3cccc([N+](=O)[O-])c3)CC2)cc1Cl 1823676711 BRIYEPAUQTVVKU-XMMPIXPASA-N 483.996 5.033 5 20 JKBD Cc1cccc(Cl)c1C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2ccc([N+](=O)[O-])cc2F)CC1 1830595907 OKONOGIGSPPDDF-JOCHJYFZSA-N 487.959 5.243 5 20 JKBD O=C(c1sccc1Cl)N1CCC([C@@H]2CCCCN2C(=O)/C=C/c2ccccc2[N+](=O)[O-])CC1 1832903893 HKGWOICHAPYDDN-IBDYFIJFSA-N 488.009 5.256 5 20 JKBD C[C@H](Sc1nnc(-c2ccccc2)n1Cc1ccco1)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl 3412867 SFEKIZYBWJUHBT-AWEZNQCLSA-N 483.937 5.267 5 20 JKBD Cc1ccccc1NC(=O)c1cc2ccccc2cc1OS(=O)(=O)c1ccccc1[N+](=O)[O-] 15331322 SXJWKTZYZBMPFC-UHFFFAOYSA-N 462.483 5.076 5 20 JKBD CSc1ccc([N+](=O)[O-])c(C(=O)O[C@@H](C)C(=O)Nc2ccc(Cl)cc2C(F)(F)F)c1 16197187 TWPLTEKWIXYLQX-VIFPVBQESA-N 462.833 5.173 5 20 JKBD O=C(C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)OCC(=O)c1ccccc1 18494031 FFDYGFRCTINMGT-RGEXLXHISA-N 458.495 5.561 5 20 JKBD COc1ccc(NC(=O)c2cc3c(C)nn(Cc4ccccc4Cl)c3s2)c([N+](=O)[O-])c1 19160139 GWUZZMFUMURKFR-UHFFFAOYSA-N 456.911 5.277 5 20 JKBD COCc1c(C(=O)O[C@H](C(=O)Nc2ccc(C)cc2[N+](=O)[O-])c2ccccc2)oc2ccccc12 21122604 UDQJOSNDNHKBQY-QHCPKHFHSA-N 474.469 5.333 5 20 JKBD O=C(CSc1ccc([N+](=O)[O-])cc1)N[C@H](c1ccccc1)c1ccc2nc(C(F)(F)F)[nH]c2c1 23359716 WSHXBDWHEUEYAX-OAQYLSRUSA-N 486.475 5.488 5 20 JKBD O=C(Nc1ccccc1C(=O)Nc1cccc(Br)c1)c1ccc([N+](=O)[O-])cc1Cl 29507385 NTXDVLRVUKOYKO-UHFFFAOYSA-N 474.698 5.515 5 20 JKBD O=[N+]([O-])c1cccc(-c2noc(CSc3nnc(COc4ccccc4Cl)n3C3CC3)n2)c1 31839410 RHLIXPDGNAPAGD-UHFFFAOYSA-N 484.925 5.096 5 20 JKBD C[C@@H](NC(=O)c1ccc(NS(=O)(=O)c2cc(Cl)ccc2Cl)cc1)c1cccc([N+](=O)[O-])c1 108456863 GQRPVGCRQKUBFT-CYBMUJFWSA-N 494.356 5.193 5 20 JKBD Cc1cc(CN2CCSCC2)ccc1NC(=O)c1ccc(N[C@H](C)c2ccccn2)c([N+](=O)[O-])c1 109976947 WJTVCOPJRWYOAG-LJQANCHMSA-N 491.617 5.272 5 20 JKBD Cc1cccc(NC(=O)Nc2cccc(CNC(=O)CCCNc3ccc([N+](=O)[O-])cc3)c2)c1 195587579 FUVMQDACNKADNR-UHFFFAOYSA-N 461.522 5.056 5 20 JKBD COc1c(C)cnc(CN(C)C(=O)c2ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])cc2)c1C 476145052 IHLWTZOWZNOCLQ-UHFFFAOYSA-N 455.898 5.333 5 20 JKBD CSc1ccc([N+](=O)[O-])c(C(=O)N[C@@H](C)c2cccc(NC(=O)Cc3ccccc3F)c2)c1 483290178 BFHLCKMJKJCQSI-HNNXBMFYSA-N 467.522 5.128 5 20 JKBD CC(C)NC(=O)Nc1ccccc1NC(=O)c1ccc(NCc2ccccc2Cl)c([N+](=O)[O-])c1 484803257 DSLALWCWENVBDM-UHFFFAOYSA-N 481.940 5.643 5 20 JKBD CC(C)CN1CCC(NC(=O)c2ccccc2Sc2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 502611073 XAQDEGCTYIGCFY-UHFFFAOYSA-N 481.540 5.615 5 20 JKBD Cn1c([C@H]2CCCN2C(=O)c2ccc(NCc3ccccc3)c([N+](=O)[O-])c2)nc2ccccc21 503147772 JSVJNPPBWBCDIA-HSZRJFAPSA-N 455.518 5.071 5 20 JKBD COc1cc(CNCc2ccc(F)cc2C(F)(F)F)ccc1OCc1ccc([N+](=O)[O-])cc1 509621413 URZWXARQANSCJF-UHFFFAOYSA-N 464.415 5.630 5 20 JKBD C[C@H](CNC(=O)Cc1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1)c1ccc(F)cc1 512823480 KWQUNSMHZTWDHW-GOSISDBHSA-N 458.493 5.049 5 20 JKBD C[C@@H](NC(=O)c1cc([N+](=O)[O-])ccc1NCc1ccccc1)c1nc2ccccc2n1C(F)F 514909786 BHOWSZBIDDWYOU-OAHLLOKOSA-N 465.460 5.443 5 20 JKBD O=C(Nc1ccc(Cl)c(C(=O)NC2CC2)c1)c1ccc(Nc2ccccc2)c([N+](=O)[O-])c1 516136341 FYWDOXVJZATHHZ-UHFFFAOYSA-N 450.882 5.136 5 20 JKBD COCCN(C(=O)[C@H](C)Oc1cc(C)ccc1Cl)c1nc(-c2ccc([N+](=O)[O-])cc2)cs1 516462528 YPNXDJVRUBPPES-HNNXBMFYSA-N 475.954 5.127 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1Br)[C@@H](Nc1ccc2ncsc2c1)c1ccccc1 520029377 URSBCMIUZXNJAG-FQEVSTJZSA-N 483.347 5.759 5 20 JKBD Cc1cc(C(=O)N2CCC[C@@H]2C(=O)Nc2nc(-c3ccco3)c(-c3ccco3)s2)ccc1[N+](=O)[O-] 521915380 UZGRNQNHRVPFPT-QGZVFWFLSA-N 492.513 5.123 5 20 JKBD Cc1sc(NC(=O)c2cc(C(C)C)nc3c2cnn3C(C)C)nc1-c1cccc([N+](=O)[O-])c1 603997002 METJMWYPMQFKLF-UHFFFAOYSA-N 464.551 5.728 5 20 JKBD O=C(NC[C@H]1CCCOC1)c1c2c(nc3ccccc13)/C(=C/c1ccc([N+](=O)[O-])cc1)CCC2 604013759 VRFGXWDYKHGTTO-NGYXKBBWSA-N 457.530 5.176 5 20 JKBD Cc1cc([N+](=O)[O-])c(S(=O)(=O)Nc2nc(C)c(-c3nc4ccccc4n3C(F)F)s2)cc1C 604277107 JOAQUTUQYXLIID-UHFFFAOYSA-N 493.517 5.189 5 20 JKBD COc1cc(OCC(=O)NC[C@H](c2ccccc2Cl)c2c[nH]c3ccccc23)ccc1[N+](=O)[O-] 604456936 LKUDIBUWSGKEGT-LJQANCHMSA-N 479.920 5.065 5 20 JKBD CN(C[C@H]1CCCO[C@@H]1c1ccccc1)C(=O)c1cc([N+](=O)[O-])ccc1Sc1ccccc1 604519685 OLOBPYZWZCNEHT-CJFMBICVSA-N 462.571 5.986 5 20 JKBD Cc1ccc(NC(=O)c2ccc(Sc3nnc(NCC(F)(F)F)s3)c([N+](=O)[O-])c2)cc1 608973234 BNYUDWPBNKHUEZ-UHFFFAOYSA-N 469.470 5.132 5 20 JKBD CCc1cc[n+](/C(C(=S)NC23CC4CC(CC(C4)C2)C3)=C(/O)c2ccc(C)c([N+](=O)[O-])c2)cc1 725761999 LJHHQGRVXDPIHZ-UHFFFAOYSA-O 478.638 5.523 5 20 JKBD COc1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2Cl)cc1OCc1ccc2ccccc2n1 728009332 ZPXVMYCMNSPABP-UHFFFAOYSA-N 463.877 5.636 5 20 JKBD O=C(OCC[C@@H]1CCCCN1C(=O)C[C@H](c1ccccc1)C(F)(F)F)c1cccc([N+](=O)[O-])c1 728516711 ZACBZVDRMVWQEV-PZJWPPBQSA-N 478.467 5.259 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)O[C@@H](C)C(=O)Nc2c(Cl)cc(Cl)cc2Cl)cc1SC 728655058 AEURLLITTAOGFM-QMMMGPOBSA-N 493.752 5.470 5 20 JKBD CC(C)(C)OC(=O)Nc1ccc(N[C@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2ccccc2)cc1 729676446 NHJHKTRGHUJSHU-QFIPXVFZSA-N 496.951 6.387 5 20 JKBD O=C(Nc1nc(-c2ccc(OC(F)F)cc2OC(F)F)cs1)c1cc([N+](=O)[O-])ccc1F 747387394 WEILZRPVXMCQSJ-UHFFFAOYSA-N 475.351 5.313 5 20 JKBD CC(C)[C@@H](OC(=O)c1csc(-c2ccc([N+](=O)[O-])cc2)n1)C(=O)Nc1cc(Cl)ccc1Cl 747955755 XMUQLOVMKWMRBW-GOSISDBHSA-N 494.356 5.845 5 20 JKBD O=C(N[C@H](c1ccccc1)c1cc2ccccc2o1)c1cc([N+](=O)[O-])ccc1Br 751076192 SQCUHANHANPNBB-OAQYLSRUSA-N 451.276 5.623 5 20 JKBD C[C@H](Sc1nc(-c2ccco2)nc2ccccc12)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl 811804927 FTXGGNAHFXMPCC-LBPRGKRZSA-N 454.895 5.571 5 20 JKBD O=C1/C(=C/c2ccc(-c3ccc([N+](=O)[O-])cc3)s2)c2ccccc2C(=O)N1Cc1ccccn1 817919111 PVIVHAGOKUTCSG-HZHRSRAPSA-N 467.506 5.442 5 20 JKBD O=C(Nc1cc(Cl)c([N+](=O)[O-])cc1OCc1ccccc1)c1ccc(C(F)(F)F)nc1 844280078 UOZPVSQTSIFPKD-UHFFFAOYSA-N 451.788 5.493 5 20 JKBD COc1cc([C@@H](C)NC(=O)c2cc([N+](=O)[O-])ccc2N2CCCCC2)ccc1OCc1ccncc1 916492482 FHQIMHHBUAUTEA-LJQANCHMSA-N 490.560 5.059 5 20 JKBD CSc1ccc(C(=O)COC(=O)c2cc([N+](=O)[O-])ccc2Oc2ccccc2)cc1NC(C)=O 919191040 BALQKPPIVORNSK-UHFFFAOYSA-N 480.498 5.107 5 20 JKBD CC(=O)N(c1ccc(C)cc1)c1nc(COC(=O)c2cc3cc([N+](=O)[O-])ccc3o2)cs1 919210591 HOQZRHUVJDLBCK-UHFFFAOYSA-N 451.460 5.148 5 20 JKBD C[C@H](OC(=O)[C@@H](C)Oc1ccc(Cl)cc1[N+](=O)[O-])c1nc(-c2cccc(C(F)(F)F)c2)no1 920778197 KYRKLUBUENSROB-WDEREUQCSA-N 485.802 5.389 5 20 JKBD Cc1nc2ccccc2n1CCCOC(=O)c1ccc(N[C@@H](C)c2ccccn2)c([N+](=O)[O-])c1 920792484 XVPHRJFBWYLBNT-KRWDZBQOSA-N 459.506 5.068 5 20 JKBD O=C(/C=C/c1ccc([N+](=O)[O-])o1)NC1(c2ccc(NC(=O)[C@]3(F)CCCCC3(F)F)cc2)CCC1 1789164261 ZATFCDPKTRJJPF-YIEPXFBBSA-N 491.466 5.253 5 20 JKBD O=C(/C=C/c1ccc([N+](=O)[O-])o1)NC1(c2ccc(NC(=O)c3cc4cc(F)ccc4[nH]3)cc2)CCC1 1789231187 SARPDISHYRYMHA-JXMROGBWSA-N 488.475 5.269 5 20 JKBD O=C(CCC1CCCC1)NC1(c2ccc(NC(=O)c3ccc([N+](=O)[O-])c4c3OCO4)cc2)CCC1 1790094959 MLXAJTUWMHDVAL-UHFFFAOYSA-N 479.533 5.042 5 20 JKBD Cc1cc(CCCC(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3ccoc3C)CC2)c([N+](=O)[O-])cc1F 1824369889 BDRMSXUAAMIIPK-XMMPIXPASA-N 499.583 5.200 5 20 JKBD O=C(C1=CCCS1)N1CCC([C@@H]2CCCCN2C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)CC1 1831059657 JMCOJIXCJWOFLK-IBGZPJMESA-N 485.631 5.064 5 20 JKBD COc1cc(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3ccccc3C3CC3)CC2)ccc1[N+](=O)[O-] 1832697850 RUBXHTDIVXCGAK-XMMPIXPASA-N 491.588 5.028 5 20 JKBD CC(C)CCn1c(S[C@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)nc2ccccc2c1=O 11205906 DRFNETPDMQIFJN-CQSZACIVSA-N 474.970 5.124 5 20 JKBD CC(C)n1c(SC[C@@H](O)COc2cccc([N+](=O)[O-])c2)nnc1-c1ccc(Cl)cc1Cl 15244599 UHOJWUDINVXLHF-HNNXBMFYSA-N 483.377 5.273 5 20 JKBD Cc1ccccc1-n1c(S[C@@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)nnc1-c1cccnc1 17542118 OYKSZKRBYOJLSX-INIZCTEOSA-N 485.529 5.449 5 20 JKBD Cc1ccc(Cn2nc(C)c(C(=O)O[C@H](C)c3nnc(-c4ccc([N+](=O)[O-])cc4)o3)c2Cl)cc1 17721726 NLAVOLWWEAUCML-OAHLLOKOSA-N 481.896 5.078 5 20 JKBD Cc1cccc([N+](=O)[O-])c1NC(=O)CSc1nc2sc(C)c(C)c2c(=O)n1C1CCCC1 21996721 YBVSNBAWQPCIRH-UHFFFAOYSA-N 472.592 5.137 5 20 JKBD O=C(CCSc1nnc(COc2ccccc2F)n1-c1ccccc1)Nc1ccc([N+](=O)[O-])cc1 26368976 BOTMUTWTXPQCTG-UHFFFAOYSA-N 493.520 5.015 5 20 JKBD Cc1nc(-c2ccc(Cl)cc2)sc1C(=O)O[C@@H](C)C(=O)Nc1cccc([N+](=O)[O-])c1C 27781308 UEONCBGWSINTEU-ZDUSSCGKSA-N 459.911 5.173 5 20 JKBD Cc1ccc(Sc2ccc(C(=O)Nc3ccc(NS(C)(=O)=O)c(Cl)c3)cc2[N+](=O)[O-])cc1 29309513 YVBFEPRIDBWDEW-UHFFFAOYSA-N 491.978 5.332 5 20 JKBD Cc1ccc(NC(=O)C/C(=C/c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)cc1-n1cnnn1 33083466 SCYBLRSQXDQDNT-PDGQHHTCSA-N 497.540 5.058 5 20 JKBD CC[C@H](NC(=O)c1ccc(N[C@H](C)c2ccccn2)c([N+](=O)[O-])c1)c1nc(-c2ccccc2)c[nH]1 109422212 YBCOOWPYFNDTBJ-XLIONFOSSA-N 470.533 5.434 5 20 JKBD CC(=O)Nc1cccc([C@H](C)N(Cc2ccccc2)C(=O)c2cnn(-c3ccc([N+](=O)[O-])cc3)c2)c1 302938957 KNNUMNJYZKUJTH-IBGZPJMESA-N 483.528 5.143 5 20 JKBD C[C@H](Cn1ccnc1)NC(=O)c1c2c(nc3ccccc13)/C(=C\c1cccc([N+](=O)[O-])c1)CCC2 481310961 OGOGEYRCLMSGIC-WRDGEJPTSA-N 467.529 5.035 5 20 JKBD CC(=O)Nc1cccc(CNC(=O)C/C(=C\c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)c1 482468882 YRDWSFCHCNLHIN-DEDYPNTBSA-N 486.553 5.410 5 20 JKBD CCN(CC)c1ccc(-c2nnc(S[C@H](C)c3nnc(-c4ccc([N+](=O)[O-])cc4)o3)n2C)cc1 501099534 LPZTWUYPDOIUGY-OAHLLOKOSA-N 479.566 5.140 5 20 JKBD COC(=O)c1ccc(COc2ccc(/C=C(/c3ccncc3)c3ccc([N+](=O)[O-])cc3)cc2OC)o1 502202289 DHCAQNOGPPTKKW-HZHRSRAPSA-N 486.480 5.546 5 20 JKBD CC(C)N(CC(=O)Nc1ccc(Cl)cc1C(F)(F)F)C(=O)Cn1ccc2cc([N+](=O)[O-])ccc21 504775023 JBNMZDMUBGVVMS-UHFFFAOYSA-N 496.873 5.097 5 20 JKBD CSc1ccc(C(=O)c2ccccc2C(=O)N2CC[C@H](c3ccccc3C)C2)cc1[N+](=O)[O-] 504926160 TXULPVLFNPPDGA-IBGZPJMESA-N 460.555 5.486 5 20 JKBD C[C@H](Nc1ccc(C(=O)NCCSc2ccc(Cl)cc2)cc1[N+](=O)[O-])c1ccccn1 506025886 IKCGSEACASKMCW-HNNXBMFYSA-N 456.955 5.338 5 20 JKBD Cc1ccc(Sc2ccc(C(=O)N3CCC(C(=O)N[C@H](C)C(C)C)CC3)cc2[N+](=O)[O-])cc1 512298832 LZJDXNYVDZPEHP-GOSISDBHSA-N 469.607 5.067 5 20 JKBD CN(C(=O)c1cccc(NC(=O)c2cc([N+](=O)[O-])ccc2Sc2ccccc2)c1)c1ccccc1 515626518 MNXYXEWEIBMTDK-UHFFFAOYSA-N 483.549 6.275 5 20 JKBD COc1ccc([C@@H](Cc2ccc(F)cc2)N[C@@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)cc1 520627535 RKIAXECUYFKXCH-NPMXOYFQSA-N 471.916 5.297 5 20 JKBD COc1cc(C(=O)Nc2cccc(NC(=O)Nc3ccccc3)c2)c([N+](=O)[O-])cc1OC(F)F 591764363 HEVDPPHAEVOTHP-UHFFFAOYSA-N 472.404 5.101 5 20 JKBD O=C(Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1)c1cn(-c2ccccc2)nc1-c1cccnc1 601904429 HCVOJHQXJNQZMW-UHFFFAOYSA-N 468.498 5.218 5 20 JKBD C[C@H](Nc1ccc([N+](=O)[O-])c(C(=O)N2CCCC2)c1)c1cccc(NC(=O)c2ccccc2)c1 603943916 OQSYVKQVYMMLDV-SFHVURJKSA-N 458.518 5.256 5 20 JKBD C[C@H]1C[C@H](C)CN(c2ccc(C(=O)Nc3ccc(Sc4nncs4)cc3)cc2[N+](=O)[O-])C1 604119622 XHMMNUHSNMLTGI-GJZGRUSLSA-N 469.592 5.332 5 20 JKBD C[C@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)N(c1ccccc1)c1nc2ccccc2s1 604446663 NVGZLOZIGWGHCL-AWEZNQCLSA-N 453.907 5.990 5 20 JKBD COCCOc1cc([N+](=O)[O-])c(C(=O)Nc2ccc(Sc3ccc(C)cc3C)cc2)cc1OC 619564626 JURFQHGZABPEAN-UHFFFAOYSA-N 482.558 5.649 5 20 JKBD COc1ccc(-c2nc(C(=O)Nc3nc(-c4ccc(C)c([N+](=O)[O-])c4)cs3)cs2)cc1OC 619729668 WRHKPVCUHPIITN-UHFFFAOYSA-N 482.543 5.420 5 20 JKBD CCOc1cc([N+](=O)[O-])c(C(=O)Nc2ccc(NC(=O)OC(C)(C)C)cc2C(F)(F)F)cc1OC 729655122 GHWYIDFZHILZAU-UHFFFAOYSA-N 499.442 5.620 5 20 JKBD O=C(CC12C[C@H]3C[C@@H](CC(O)(C3)C1)C2)Oc1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2Cl)cc1 763093874 ISODKAAMVISJDI-KTYQWQPMSA-N 484.936 5.127 5 20 JKBD CC(C)Cn1cc([C@@H]2N(c3ccc([N+](=O)[O-])c(-c4ccc(F)cc4)n3)CC23CCOCC3)cn1 849478292 ICYKHRHOQMVFGK-DEOSSOPVSA-N 465.529 5.007 5 20 JKBD O=c1c2ccccc2[nH]c2ccc(-c3nc(-c4ccc(Oc5ccc(F)cc5)nc4)no3)cc12 904507652 DOFQPHTYHDXSLI-UHFFFAOYSA-N 450.429 5.725 5 20 JKBD O=C(Nc1sc2c(c1-c1nc3ccccc3[nH]1)CCCC2)c1cc(Cl)ccc1[N+](=O)[O-] 908181547 FOWYSZCBULSXBI-UHFFFAOYSA-N 452.923 5.984 5 20 JKBD Cc1c([N+](=O)[O-])cc(C(=O)O[C@@H](C)C(=O)Nc2ccccc2Sc2ccccc2)cc1[N+](=O)[O-] 919225189 VJJVEBBFPAKHGP-HNNXBMFYSA-N 481.486 5.147 5 20 JKBD O=C(Cc1cccc([N+](=O)[O-])c1)Nc1ccc(C2(NC(=O)c3cccc4cccnc34)CCC2)cc1 1785791922 OQYXURCEIUPNDZ-UHFFFAOYSA-N 480.524 5.133 5 20 JKBD O=C(/C=C/c1ccc([N+](=O)[O-])o1)Nc1ccc(C2(NC(=O)[C@@]3(F)CCCC=C3F)CCC2)cc1 1786208447 KBXYZGCVELRGKE-KMEWNKIWSA-N 471.460 5.081 5 20 JKBD Cc1ccc(C(=O)Nc2ccc(C3(NC(=O)c4c(F)ccc([N+](=O)[O-])c4C)CCC3)cc2)o1 1786491932 HDSSNQGFULPLON-UHFFFAOYSA-N 451.454 5.005 5 20 JKBD COc1cc(C(=O)NC2(c3ccc(NC(=O)c4cscc4C)cc3)CCC2)ccc1[N+](=O)[O-] 1788746684 LEBLTFMBLORYID-UHFFFAOYSA-N 465.531 5.035 5 20 JKBD O=C(Cc1ccncc1)Nc1ccc(C2(NC(=O)c3cc4cc([N+](=O)[O-])ccc4s3)CCC2)cc1 1790387475 CDFXPKHERWRWGR-UHFFFAOYSA-N 486.553 5.195 5 20 JKBD O=C(NC1(c2ccc(NC(=O)c3cccc4c3oc3ccccc34)cc2)CCC1)c1ccc([N+](=O)[O-])o1 1791007614 YAJJVMOAOOYNKL-UHFFFAOYSA-N 495.491 6.149 5 20 JKBD Cc1c(C(=O)NC[C@H]2CCN(C(=O)C3(C(C)C)CCC3)[C@H]2c2cccnc2)cc(Cl)cc1[N+](=O)[O-] 1811796233 FPXQKALOCOJXEA-XXBNENTESA-N 499.011 5.098 5 20 JKBD O=C(c1cc2cc([N+](=O)[O-])ccc2s1)N1CCC([C@@H]2CCCCN2C(=O)[C@@H]2C[C@@H]2C2CC2)CC1 1824073353 GKTIQHNINOMBNC-VSKRKVRLSA-N 481.618 5.089 5 20 JKBD O=C(COC(=O)CSc1cc(Cl)ccc1Cl)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 11465460 NJJSMOYLLLGVBC-UHFFFAOYSA-N 483.251 5.194 5 20 JKBD CCCCc1ccc2nc(NC(=O)c3ccc(Sc4nncn4C)c([N+](=O)[O-])c3)sc2c1 14379511 OMQMVSVJXNNMOF-UHFFFAOYSA-N 468.564 5.079 5 20 JKBD O=C(CSc1nnc(-c2ccccc2)c2ccccc12)Nc1cc([N+](=O)[O-])ccc1Cl 21607329 LQUFZXQVGAYDAU-UHFFFAOYSA-N 450.907 5.589 5 20 JKBD Cn1cnnc1Sc1ccc(C(=O)N(c2ccccc2)c2nc3ccccc3s2)cc1[N+](=O)[O-] 21907777 CZJDMNLKZJGQHD-UHFFFAOYSA-N 488.554 5.463 5 20 JKBD CC(=O)Nc1cccc(NC(=O)[C@@H](C)OC(=O)c2ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])cc2)c1 23988976 IPCQTPIXKLDINN-CQSZACIVSA-N 497.891 5.183 5 20 JKBD O=C1CSc2ccc(N[C@@H](C(=O)Nc3ccc([N+](=O)[O-])cc3Cl)c3ccccc3)cc2N1 25702120 XAXQQRXDTQOTMK-OAQYLSRUSA-N 468.922 5.084 5 20 JKBD CSc1ccc(C(=O)c2ccccc2C(=O)N2CC=C(c3c[nH]c4ccccc34)CC2)cc1[N+](=O)[O-] 26690480 JUHXRVIXTZQMLQ-UHFFFAOYSA-N 497.576 5.959 5 20 JKBD CN(Cc1ccccc1[N+](=O)[O-])C(=O)c1ccccc1SCC(=O)NC12CC3CC(CC(C3)C1)C2 31930014 YHCHQXWPJNMNHJ-UHFFFAOYSA-N 493.629 5.044 5 20 JKBD COc1ccc(Cl)cc1NC(=O)c1ccccc1C(=O)c1ccc(SC)c([N+](=O)[O-])c1 60390220 VNEOZVWOZXJYGM-UHFFFAOYSA-N 456.907 5.462 5 20 JKBD O=C(CCNc1ccc(C(F)(F)F)cc1[N+](=O)[O-])Nc1nnc(SCc2cccs2)s1 105010699 JNDQCMZERHTRDY-UHFFFAOYSA-N 489.526 5.260 5 20 JKBD Cc1ccccc1[C@@H]1CCCN1C(=O)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 108330720 RLYCTFUNPWGOBP-FQEVSTJZSA-N 461.484 5.502 5 20 JKBD C[C@H](Nc1ccc(C(=O)Nc2ccc(N3CCCCCC3)cc2)cc1[N+](=O)[O-])c1ccccn1 108831776 GRGNYPQRABYTOJ-IBGZPJMESA-N 459.550 5.796 5 20 JKBD O=C(Cc1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1)Nc1cccc(N2CCCC2)c1 409451823 GHLSBVXJGRXGTM-UHFFFAOYSA-N 467.529 5.229 5 20 JKBD CCn1c(SCC(=O)N(Cc2ccccc2)CC(F)(F)F)nc2cc3ccccc3cc2c1=O 498479704 BPDIMNUFVAGDBJ-UHFFFAOYSA-N 485.531 5.253 5 20 JKBD C[C@@H](Nc1ccc(C(=O)N(C)Cc2ccc(OC(F)F)cc2)cc1[N+](=O)[O-])c1ccccn1 505999676 LNPURDHPVINCOK-OAHLLOKOSA-N 456.449 5.037 5 20 JKBD C[C@@H]1CCCCN1C(=O)c1ccc(NC(=O)c2cc(OCC(F)(F)F)ccc2[N+](=O)[O-])cc1Cl 515442120 IBQJNHXMSQZMTD-CYBMUJFWSA-N 499.873 5.456 5 20 JKBD COc1ccc([N+](=O)[O-])cc1NC(=O)[C@H](C)N[C@H](C)c1ccc(Oc2ccccc2)c(F)c1 515717556 OVBRYXRIJZANJY-CVEARBPZSA-N 453.470 5.213 5 20 JKBD Cc1nn(Cc2ccc(C(=O)N3CCC(c4c(C)[nH]c5ccccc45)CC3)cc2)c(C)c1[N+](=O)[O-] 516001973 IPCSWBUCTIVNTI-UHFFFAOYSA-N 471.561 5.266 5 20 JKBD CS(=O)(=O)c1ccc(C(=O)Nc2ccc(Sc3ccccc3Cl)cc2)cc1[N+](=O)[O-] 520485723 GAIWBLLKXIJDMT-UHFFFAOYSA-N 462.936 5.055 5 20 JKBD CC(=O)Nc1ccc(NC(=O)c2ccc(Sc3nc4ccccc4s3)c([N+](=O)[O-])c2)c(Cl)c1 551310977 NRBZFPRWRIOJBH-UHFFFAOYSA-N 498.973 6.220 5 20 JKBD COc1cc([N+](=O)[O-])ccc1NC(=O)CSc1nnc(-c2ccco2)n1[C@H](C)[C@@H]1C[C@H]2CC[C@H]1C2 594534377 FPQFLUATHWVWIE-CVYDXHPNSA-N 497.577 5.183 5 20 JKBD CN(Cc1ccccc1[N+](=O)[O-])C(=O)c1ccc(NC(=O)c2cc(Cl)cc(Cl)c2)cc1 603596155 LSJUNVISXUNYKR-UHFFFAOYSA-N 458.301 5.426 5 20 JKBD Cc1cc(NC(=O)C(C)(C)C)sc1C(=O)N(Cc1ccccc1[N+](=O)[O-])CC(F)(F)F 603742406 UIQLGMSCVQFUHC-UHFFFAOYSA-N 457.474 5.154 5 20 JKBD CSc1ccc([N+](=O)[O-])c(C(=O)Nc2ccc(NC(=O)c3ccccc3)cc2C(F)(F)F)c1 603742818 AZBDGTYXOKZQFO-UHFFFAOYSA-N 475.448 5.840 5 20 JKBD O=C(NC1CC1)c1cccc(CNC(=O)c2cc([N+](=O)[O-])ccc2Sc2ccc(Cl)cc2)c1 603774689 DVLSJYKSUDSRBX-UHFFFAOYSA-N 481.961 5.222 5 20 JKBD Cc1nc(NC(=O)c2cc(OCC(F)(F)F)ccc2[N+](=O)[O-])sc1Cc1ccc(F)cc1 603975072 ARXGJKMKRMLCFK-UHFFFAOYSA-N 469.416 5.283 5 20 JKBD C[C@H](NC(=O)C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)c1ccc2nc(O)[nH]c2c1 604244094 UHPVXZHOVJPKLP-BRFSQIRFSA-N 499.552 5.595 5 20 JKBD Cc1nc(-c2ccc(F)cc2)sc1[C@@H](C)NC(=O)[C@H](C)Oc1ccc(Cl)cc1[N+](=O)[O-] 609186360 JIFLOZPKTBOAPU-YPMHNXCESA-N 463.918 5.464 5 20 JKBD CSc1ccc(C(=O)c2ccccc2C(=O)N2CC=C(c3ccc(F)cc3)CC2)cc1[N+](=O)[O-] 610868825 FZQUMZTWGNNTOP-UHFFFAOYSA-N 476.529 5.616 5 20 JKBD C[C@@H](Sc1ncccc1C(=O)OCc1nc2ccccc2c2ccccc12)C(=O)N1CCCC1 726223978 OJXIHHJPQSDTJN-GOSISDBHSA-N 471.582 5.243 5 20 JKBD COC(=O)Nc1cc(NC(=O)c2ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])c(OC)c2)ccc1F 727335503 WBRGYNODVFIEIA-UHFFFAOYSA-N 489.843 5.619 5 20 JKBD C[C@@H](OC(=O)c1ccccc1OCc1cccs1)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl 730612972 CEYUWCSHMRWGPA-CYBMUJFWSA-N 460.895 5.073 5 20 JKBD CC(C)N(C(=O)COC(=O)c1cc(F)ccc1[N+](=O)[O-])c1ccc(Nc2ccccc2)cc1 743197557 QDUAKSLLNIFPBY-UHFFFAOYSA-N 451.454 5.076 5 20 JKBD Cc1cccc(NC(=O)[C@H](OC(=O)c2csc(-c3ccc([N+](=O)[O-])cc3)n2)C(C)C)c1C 747958327 YOWKHSCKSHWFNM-HXUWFJFHSA-N 453.520 5.155 5 20 JKBD O=C(N[C@@H](Cn1cnc2ccccc21)c1ccc(F)cc1)c1cc([N+](=O)[O-])ccc1Br 751089685 PEIIXZBMDDURPR-FQEVSTJZSA-N 483.297 5.017 5 20 JKBD CCc1cccc(CC)c1NC(=O)[C@@H](C)OC(=O)c1cc([N+](=O)[O-])ccc1Oc1ccccc1 917257909 VYGNEBOJTSAPHR-QGZVFWFLSA-N 462.502 5.696 5 20 JKBD O=C(OCC(=O)N(Cc1ccccc1)c1nc2c(s1)CCCC2)c1cc2cc([N+](=O)[O-])ccc2o1 919209488 BKFKUHLHXHALTG-UHFFFAOYSA-N 491.525 5.067 5 20 JKBD CCCn1cc(NC(=O)c2ccc(Sc3nc4ccccc4s3)c([N+](=O)[O-])c2)ccc1=O 919846715 UMMIJWGJZBCOQC-UHFFFAOYSA-N 466.544 5.180 5 20 JKBD CCOC(=O)N(C)c1ccc(N[C@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2ccccc2)cc1 920062617 QRSOLWDXFHRZGG-QFIPXVFZSA-N 482.924 5.633 5 20 JKBD O=C(/C=C/c1ccc([N+](=O)[O-])o1)NC1(c2ccc(NC(=O)CSC3CCCC3)cc2)CCC1 1786346793 TVLLXKYDINKDQW-ZRDIBKRKSA-N 469.563 5.011 5 20 JKBD CC(F)(F)C(C)(C)C(=O)Nc1ccc(C2(NC(=O)CSc3ccccc3[N+](=O)[O-])CCC2)cc1 1786456175 PWOLSSTZHBIYSN-UHFFFAOYSA-N 491.560 5.502 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)c3cc4cccc(F)c4s3)CCC2)cc1)c1ccc([N+](=O)[O-])[nH]1 1790186315 LVKGWFAVSODZKJ-UHFFFAOYSA-N 478.505 5.338 5 20 JKBD C[C@@H](Cc1ccncc1)C(=O)Nc1ccc(C2(NC(=O)/C=C/c3ccccc3[N+](=O)[O-])CCC2)cc1 1791039027 BUQCCFICLWJGFG-BESKYLIDSA-N 484.556 5.016 5 20 JKBD Cc1c(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2ccc(C(F)(F)F)cc2)cc(Cl)cc1[N+](=O)[O-] 1799706642 WWGJATORPVYYNS-BCDXTJNWSA-N 495.885 5.141 5 20 JKBD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc([N+](=O)[O-])cc1F)c1ccc(Oc2ccccc2)cc1 1800353318 TWQTXIIYCYJDLO-ACDBMABISA-N 489.503 5.092 5 20 JKBD CC(C)[C@H](C(=O)N1CCC([C@H]2CCCCN2C(=O)/C=C/c2ccc([N+](=O)[O-])o2)CC1)c1ccccc1 1824275535 CZBAVNYKMYAGBS-ZWDZFUMFSA-N 493.604 5.261 5 20 JKBD CC(C)CCC(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cc(Br)ccc2[N+](=O)[O-])CC1 1830564064 NTSKIIORMCMSBD-FQEVSTJZSA-N 494.430 5.027 5 20 JKBD O=C(CSc1ncc(-c2ccc(Cl)cc2)o1)Nc1ccc([N+](=O)[O-])cc1Br 11300143 DKAQTSAATLOUPY-UHFFFAOYSA-N 468.716 5.397 5 20 JKBD CC(=O)c1c(C)[nH]c(C(=O)[C@@H](C)OC(=O)c2ccc(Sc3nc(C)cs3)c([N+](=O)[O-])c2)c1C 15749320 VUBQMWAAYCLLQK-CQSZACIVSA-N 487.559 5.087 5 20 JKBD Cc1cccc([N+](=O)[O-])c1NC(=O)CSc1ncnc2scc(-c3ccc(F)cc3)c12 21120423 RYGBJZKUIDAYPD-UHFFFAOYSA-N 454.508 5.445 5 20 JKBD C[C@@H](N[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Br)c1ccccc1)c1ccccc1 21818277 UUJNCBDMTOURNE-QVKFZJNVSA-N 454.324 5.388 5 20 JKBD Cc1ccc(C)c(OCc2nnc(Sc3ccc(C(=O)c4ccccc4)cc3[N+](=O)[O-])o2)c1 22062112 DUGDIDQEEUQYLG-UHFFFAOYSA-N 461.499 5.556 5 20 JKBD O=C(CSc1nnc(NC2CCCCC2)s1)Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1 28788017 HQECSLMXKJAPLS-UHFFFAOYSA-N 476.609 5.045 5 20 JKBD COc1cc(C(=O)NCCc2cccc3cccnc23)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 29451995 KVXZWDZTEQOQFH-UHFFFAOYSA-N 477.904 5.570 5 20 JKBD Cc1ccccc1N(C(=O)C1CCN(c2ccccc2[N+](=O)[O-])CC1)c1nc2ccccc2s1 104670858 BRJWSIPJEYPMEC-UHFFFAOYSA-N 472.570 6.094 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)N[C@@H]2CCOc3c(-c4ccccc4)cccc32)cc1SC 483580709 RPZOAXDGMUZRQT-LJQANCHMSA-N 450.516 5.246 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)N[C@@H](Cc2ccccc2Cl)c2ccccc2)cc1SC 483641125 IQCQQATUUJDQJG-IBGZPJMESA-N 456.951 5.693 5 20 JKBD CCNC(=O)c1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2Sc2ccc(Cl)cc2)cc1 485381614 NJONTNLJWMVFDS-UHFFFAOYSA-N 455.923 5.401 5 20 JKBD Cc1ccccc1-c1ccc(CN(C(=O)c2ccc(-n3cncn3)c([N+](=O)[O-])c2)C(C)C)s1 498414011 HHUJPMZSYVTQDV-UHFFFAOYSA-N 461.547 5.263 5 20 JKBD CC(C)N(Cc1nnc(-c2ccccc2Cl)o1)C(=O)c1ccc(Nc2ccccc2)c([N+](=O)[O-])c1 498731027 SMHARYQFZPCTMB-UHFFFAOYSA-N 491.935 6.093 5 20 JKBD CSc1ccc([N+](=O)[O-])c(C(=O)Nc2cccc(Cl)c2Sc2nc(C)cs2)c1 499242323 FWRYJJXTUKHQEM-UHFFFAOYSA-N 451.982 6.139 5 20 JKBD O=C(NCCSCc1cccc2ccccc12)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-] 500714377 SHTJRJHEAYPKPM-UHFFFAOYSA-N 464.465 5.352 5 20 JKBD Cc1nn(Cc2ccc(C(=O)N[C@@H](COc3ccccc3)c3ccccc3)cc2)c(C)c1[N+](=O)[O-] 502346086 NTEPKRVZNDFSSF-VWLOTQADSA-N 470.529 5.007 5 20 JKBD Cc1cc([N+](=O)[O-])ccc1C(=O)Nc1ccc(CNC(=O)c2ccc(C(F)(F)F)cc2)cc1 502562468 GMWDHSOCNUFKEQ-UHFFFAOYSA-N 457.408 5.104 5 20 JKBD COc1ccc(CN[C@@H](C)c2cnn(-c3ccc(F)cc3)c2C)cc1OCc1ccc([N+](=O)[O-])cc1 507958068 YGWSVLXCUMSHDK-SFHVURJKSA-N 490.535 5.666 5 20 JKBD CCN(Cc1ccccc1NC(=O)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])c(OC)c1)C(C)=O 509524564 MXIOWFSTCBUUOW-UHFFFAOYSA-N 497.935 5.670 5 20 JKBD Cc1ncc(CNC(=O)C/C(=C/c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)s1 509862663 FZXOGXGCGQIRHN-YBEGLDIGSA-N 450.545 5.217 5 20 JKBD CC(C)N(Cc1ccc(-c2ccccc2F)s1)C(=O)CSc1ccc(C(N)=O)cc1[N+](=O)[O-] 510297537 ISVWHRZIOIHJAD-UHFFFAOYSA-N 487.578 5.091 5 20 JKBD C[C@H](NCC1(c2ccc3c(c2)OCO3)CCCCC1)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 513192572 MTOFDOMTZLPUPF-HNNXBMFYSA-N 493.482 5.161 5 20 JKBD CSc1ccc(C(=O)N(Cc2ccccc2)[C@@H](C)c2cccc(NC(C)=O)c2)cc1[N+](=O)[O-] 514904035 WJPMNLWLVMKFNA-KRWDZBQOSA-N 463.559 5.679 5 20 JKBD C[C@@H](c1ccccc1)n1c(SCC(=O)Nc2ccc(Cl)cc2[N+](=O)[O-])nnc1-c1ccccc1 515571494 UZBHZMMCSRCNJT-INIZCTEOSA-N 493.976 5.847 5 20 JKBD C[C@H](NCc1ccc(-c2ccc([N+](=O)[O-])cc2Br)o1)c1ccccc1OC(F)F 517538669 IDICZNNRLKMHIC-LBPRGKRZSA-N 467.266 6.070 5 20 JKBD CO[C@@H](C)C(=O)Nc1cccc(NC(=O)c2ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])cc2)c1 520450651 WWQQWCMPSNRJEV-AWEZNQCLSA-N 469.881 5.266 5 20 JKBD COc1ccc([N+](=O)[O-])cc1NC(=O)[C@@H](Oc1ccc(F)cc1Br)c1ccccc1 520765236 XUWJVPQCZHLNKD-FQEVSTJZSA-N 475.270 5.264 5 20 JKBD C[C@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)Nc1cc(C(=O)Nc2ccccc2)ccc1Cl 521250462 YPNDFDKQQAMCHV-ZDUSSCGKSA-N 474.300 5.560 5 20 JKBD Cc1csc([C@@H](C)NC(=O)C/C(=C\c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)n1 524323141 OUXUWBDCCDLOCB-QAEAHILHSA-N 464.572 5.778 5 20 JKBD CC(C)c1ccc(OC2CCN(C(=O)C3CCN(c4ccccc4[N+](=O)[O-])CC3)CC2)cc1 603814448 NCQWDRMXLJAMAD-UHFFFAOYSA-N 451.567 5.005 5 20 JKBD COc1cc(C(=O)N2CC[C@@H](C)Sc3ccc(C(F)(F)F)cc32)c([N+](=O)[O-])cc1OC 603961987 UDLBXMCYFUQCPE-LLVKDONJSA-N 456.442 5.162 5 20 JKBD Cc1cc([N+](=O)[O-])ccc1NC(=O)CNc1ccc(C(=O)N(C)C2CCCCC2)c(Cl)c1 604009691 MJMISSOIPIMFNG-UHFFFAOYSA-N 458.946 5.012 5 20 JKBD CCO[C@@H]1CCCN(C(=O)C/C(=C/c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)C1 604427854 DKQMBPNCDOYACQ-BKHFDQEPSA-N 451.548 5.163 5 20 JKBD O=C(NC1(c2ccc(F)cc2)CCC1)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 604434148 DGFVWWBHVWOBTF-UHFFFAOYSA-N 465.447 5.165 5 20 JKBD COc1ccc(-c2ccc(CNCc3cccc(NC(=O)C4CCCCC4)c3)o2)c([N+](=O)[O-])c1 608836489 MIUHWBUMJCZAEQ-UHFFFAOYSA-N 463.534 5.672 5 20 JKBD COc1cc(C(=O)Nc2cccc([C@@H](C)OC)c2)ccc1Oc1ccc(Cl)cc1[N+](=O)[O-] 608874919 HIAOUAASKBWSPQ-CQSZACIVSA-N 456.882 6.009 5 20 JKBD COc1ccc(CSCC(=O)Nc2ccc(OCc3cccc(F)c3)cc2C)cc1[N+](=O)[O-] 609064932 SKSQDTZBZQNUQB-UHFFFAOYSA-N 470.522 5.502 5 20 JKBD Cc1nc(-c2ccc(F)cc2)sc1[C@@H](C)NC(=O)N(Cc1ccc([N+](=O)[O-])cc1)C(C)C 609213355 DTAUHMKFXLOUSI-MRXNPFEDSA-N 456.543 5.847 5 20 JKBD COc1ccc([N+](=O)[O-])cc1NC(=O)[C@@H](C)N[C@@H](C)c1sc(-c2ccc(C)cc2)nc1C 609353448 QHKNRVYBDATQEM-GOEBONIOSA-N 454.552 5.022 5 20 JKBD Cc1ccc(Sc2ccc(C(=O)Nc3ccccc3SCCC(N)=O)cc2[N+](=O)[O-])cc1 609407777 VMPFALGJFVHXFT-UHFFFAOYSA-N 467.572 5.274 5 20 JKBD CCOc1cc(CNCc2ccc(C)c(F)c2)ccc1OCc1cc([N+](=O)[O-])cc2c1OCOC2 617227656 UPYJTHNFTGMPKK-UHFFFAOYSA-N 482.508 5.176 5 20 JKBD C[C@H](OC(=O)/C=C\c1cc(C(F)(F)F)ccc1Cl)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 746154332 IRPUSJBJVAWFID-NJHLSQGMSA-N 467.787 5.635 5 20 JKBD O=[N+]([O-])c1ccc(Sc2nnc(-c3ccc(Cl)cc3)n2Cc2ccco2)c([N+](=O)[O-])c1 799790985 SHSHDSIOIFSCPN-UHFFFAOYSA-N 457.855 5.207 5 20 JKBD COc1cc(/C=C\C(=O)N(C)Cc2cc([N+](=O)[O-])ccc2Cl)ccc1OCc1c(C)noc1C 812210880 QGNZERLZONYKQT-POHAHGRESA-N 485.924 5.112 5 20 JKBD CC(C)Cc1noc(COC(=O)C/C(=C\c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)n1 863837809 XNDFYKUHIXJIAX-SFQUDFHCSA-N 478.530 5.460 5 20 JKBD COc1cc(-c2noc(-c3ccc(N[C@@H](C)c4ccccn4)c([N+](=O)[O-])c3)n2)cc(Cl)c1OC 904403617 XOKQNFXZCYSMJT-ZDUSSCGKSA-N 481.896 5.551 5 20 JKBD O=C(Nc1ccccc1)c1nnc(/C(Cl)=C\c2ccc(-c3cccc([N+](=O)[O-])c3)s2)s1 912858811 FFSYSEHAQGYJDK-SFQUDFHCSA-N 468.947 6.164 5 20 JKBD COc1ccccc1-c1nn(CN(C)Cc2ccccc2[N+](=O)[O-])c(=S)n1-c1ccc(C)cc1 914783466 CSWPIALQIJJZJD-UHFFFAOYSA-N 475.574 5.385 5 20 JKBD C[C@H](OC(=O)c1ccc(Sc2nncn2C)c([N+](=O)[O-])c1)c1ccc(Cl)c(Cl)c1 917959044 WZVKRBLBEQNWSL-JTQLQIEISA-N 453.307 5.099 5 20 JKBD C[C@H](OC(=O)c1ccccc1N(C)C(=O)c1ccc(Br)o1)c1ccc([N+](=O)[O-])cc1 920158945 QZTXQWQUMUUGAM-ZDUSSCGKSA-N 473.279 5.145 5 20 JKBD C[C@H](Nc1ccc(C(=O)O[C@H](C)C(=O)Nc2cccc3ccccc23)cc1[N+](=O)[O-])c1ccccn1 920543660 HIQIUPGTUGPULC-ZWKOTPCHSA-N 484.512 5.500 5 20 JKBD COc1cc(C(=O)Nc2ccccc2C(=O)Nc2cccc(C(F)(F)F)c2)c([N+](=O)[O-])cc1OC 920819611 COKYDNNMZNAUIM-UHFFFAOYSA-N 489.406 5.135 5 20 JKBD Cc1ccc(NC(=O)c2cccc(C(F)(F)F)c2)cc1NC(=S)Nc1ccc([N+](=O)[O-])cc1 920832660 VTDYGUSLBBFSIH-UHFFFAOYSA-N 474.464 5.983 5 20 JKBD COC(=O)/C=C\c1ccc(Oc2ccc3c(-c4ccc([N+](=O)[O-])cc4)cc(=O)oc3c2)c([N+](=O)[O-])c1 931294785 LTAGINDCURCELP-JYOAFUTRSA-N 488.408 5.255 5 20 JKBD Cc1c(C(=O)NC2(c3ccc(NC(=O)c4cccnc4)cc3)CCC2)cc(Cl)cc1[N+](=O)[O-] 1787305908 ZYCWTMMACZBACV-UHFFFAOYSA-N 464.909 5.013 5 20 JKBD O=C(Cc1ccc(C(F)(F)F)cc1)Nc1ccc(C2(NC(=O)c3ccc([N+](=O)[O-])o3)CCC2)cc1 1787768763 KIQYKLXGBJTPJA-UHFFFAOYSA-N 487.434 5.197 5 20 JKBD Cc1c(C(=O)Nc2ccc(C3(NC(=O)C(C)(F)F)CCC3)cc2)cc(Br)cc1[N+](=O)[O-] 1790713359 PKXSRJZQHVVCJD-UHFFFAOYSA-N 496.308 5.069 5 20 JKBD O=C(Cc1cccc([N+](=O)[O-])c1)N1CCCC2(CCN(C(=O)c3ccc(-c4ccccc4)cc3)CC2)C1 1804752876 KELGAUDESOPZCT-UHFFFAOYSA-N 497.595 5.349 5 20 JKBD CCC[C@H]1CC[C@H](C(=O)N2CC[C@H](CNC(=O)c3cc(F)cc([N+](=O)[O-])c3)[C@@H]2c2cccnc2)CC1 1811306489 DZYXUDPYDBDKGK-JDFHOKRYSA-N 496.583 5.055 5 20 JKBD CC(C)(C)CC(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cc3cc([N+](=O)[O-])ccc3s2)n[nH]1 1821610274 XLAXLVJTZJQZEU-QGZVFWFLSA-N 469.567 5.275 5 20 JKBD Cc1cccnc1C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)CC1 1824699251 AEKYVDJYJAKIOX-NRFANRHFSA-N 492.601 5.060 5 20 JKBD Cc1ccc(CC(=O)N2CCC([C@@H]3CCCCN3C(=O)CCC3CCCC3)CC2)cc1[N+](=O)[O-] 1826269279 DVXMSTSVOYOIEY-DEOSSOPVSA-N 469.626 5.036 5 20 JKBD CC(C)(C)CC(=O)N1CCC([C@H]2CCCCN2C(=O)c2cc(Br)ccc2[N+](=O)[O-])CC1 1830563500 CRAHHZRPOXQHHO-LJQANCHMSA-N 494.430 5.027 5 20 JKBD CCCCC[C@H](C)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)Cc2cc(F)ccc2[N+](=O)[O-])CC1 1831468059 IWOTWIGIPAKFGC-WMZHIEFXSA-N 475.605 5.113 5 20 JKBD Cc1cccc(F)c1C(=O)N1CCC([C@H]2CCCCN2C(=O)CSc2ccccc2[N+](=O)[O-])CC1 1831777478 RIEPGEKAYMPYMG-OAQYLSRUSA-N 499.608 5.068 5 20 JKBD O=C(c1cc2cc([N+](=O)[O-])ccc2s1)N1CC2(CCCN2C(=O)c2cc3cc(F)ccc3s2)C1 1844064954 BIZLQSZOUFPSFZ-UHFFFAOYSA-N 495.557 5.294 5 20 JKBD CC(=O)N(c1nc(CSc2nc3ccc([N+](=O)[O-])cc3s2)cs1)c1ccccc1F 10592215 LNWWBICHTPRHEM-UHFFFAOYSA-N 460.537 5.777 5 20 JKBD COc1ccc(NC(=O)[C@@H](OC(=O)c2cc([N+](=O)[O-])ccc2Cl)c2ccccc2)cc1Cl 10665338 VARCGGYZLUCQJA-FQEVSTJZSA-N 475.284 5.447 5 20 JKBD O=[N+]([O-])c1cccc(OC[C@@H](O)CSc2nnc(-c3ccccc3Cl)n2Cc2ccccc2)c1 15237043 IOJQVEMNYRYWLE-LJQANCHMSA-N 496.976 5.087 5 20 JKBD COc1ccc(C)cc1NC(=O)[C@H](OC(=O)c1cc(SC)ccc1[N+](=O)[O-])c1ccccc1 16196187 SFLSOYQGZFZYAF-JOCHJYFZSA-N 466.515 5.171 5 20 JKBD Cc1cc(/C=C/C(=O)O[C@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)c(C)n1C1CCCCC1 17892671 XGBKBBHMLJPASD-GPZRYRNASA-N 464.522 5.886 5 20 JKBD COc1ccc(Br)cc1-c1nc(COC(=O)c2ccc(C)c([N+](=O)[O-])c2)cs1 21280041 KIRDVMAIMNUYDR-UHFFFAOYSA-N 463.309 5.155 5 20 JKBD C[C@H](c1ccc(F)cc1)N(C)C(=O)Cc1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1 33233619 NGFDINOTVLXHPA-GOSISDBHSA-N 458.493 5.349 5 20 JKBD COCc1c(Br)cccc1NC(=O)CSc1ccc(C(F)(F)F)cc1[N+](=O)[O-] 303105811 JMTRHXLWLTZLBF-UHFFFAOYSA-N 479.274 5.253 5 20 JKBD O=[N+]([O-])c1ccc(S(=O)(=O)Nc2nc(C3CC3)c(Cc3ccccc3Cl)s2)s1 409673003 VYPSNOWVPMUTPW-UHFFFAOYSA-N 455.970 5.035 5 20 JKBD COc1cc([C@@H](C)NC(=O)c2cc3cc([N+](=O)[O-])ccc3s2)ccc1OCc1ccncc1 502681504 DSJQHTFSGLKMSP-OAHLLOKOSA-N 463.515 5.283 5 20 JKBD CCN(c1ccccc1)S(=O)(=O)c1ccc(N[C@@H](c2ccccc2)c2nccs2)c([N+](=O)[O-])c1 505571413 ZEWHETADEZKNBB-QHCPKHFHSA-N 494.598 5.468 5 20 JKBD COc1ccc(CNCc2cc(F)ccc2Br)cc1OCc1ccc([N+](=O)[O-])cc1 507919750 FOSUYMXLZKGUFE-UHFFFAOYSA-N 475.314 5.374 5 20 JKBD O=C(c1c2c(nc3ccccc13)/C(=C\c1cccc([N+](=O)[O-])c1)CCC2)N1CCC(n2cncn2)CC1 509970106 ONSQLTILQPJUGX-HKWRFOASSA-N 494.555 5.089 5 20 JKBD COc1ccc(Oc2ccc([N+](=O)[O-])cc2C(=O)N[C@@H](C)c2nc3ccccc3n2C(F)F)cc1 512244289 OLYWMLVBJFGSQB-AWEZNQCLSA-N 482.443 5.632 5 20 JKBD O=C(CCSc1nnc(-c2ccncc2)n1-c1ccc(Cl)cc1)Nc1ccc([N+](=O)[O-])cc1 592995314 WBBZMCZQUISTNX-UHFFFAOYSA-N 480.937 5.012 5 20 JKBD CCOc1c(Cl)cc(CNC(=O)CSc2ccc(C(F)(F)F)cc2[N+](=O)[O-])cc1OC 603988879 KKCCLAHJEBXCFM-UHFFFAOYSA-N 478.876 5.083 5 20 JKBD CC[C@@H](C)C(=O)Nc1cccc(CNCc2cn(-c3ccccc3)nc2-c2ccc([N+](=O)[O-])cc2)c1 608836688 FPOWPEVMNRCHLP-HXUWFJFHSA-N 483.572 5.722 5 20 JKBD O=C(c1ccccc1)c1ccc(N2CCC(c3nc(-c4ccccc4)no3)CC2)c([N+](=O)[O-])c1 609143690 MIYTZGBJEIRVMN-UHFFFAOYSA-N 454.486 5.260 5 20 JKBD CCOC(=O)c1sc(-c2ccc(Cl)cc2)cc1NC(=O)c1cc(OC)c(OC)cc1[N+](=O)[O-] 611981449 HCAINMUFEAKWHX-UHFFFAOYSA-N 490.921 5.423 5 20 JKBD O=C(Nc1ccc([N+](=O)[O-])cc1F)c1cc(-c2ccncc2)nc2ccc(Br)cc12 726915855 MJPYQQUNKHBCQF-UHFFFAOYSA-N 467.254 5.359 5 20 JKBD O=C(Nc1cccc(SC(F)F)c1)N1CCN(c2ccc([N+](=O)[O-])cc2C(F)(F)F)CC1 727597467 FMZKJOASSUKVFR-UHFFFAOYSA-N 476.427 5.282 5 20 JKBD Cc1nc(NC(=O)c2cc(F)c(F)cc2[N+](=O)[O-])sc1Cc1cccc(Br)c1 727708422 RYBKLUIZCBIFRB-UHFFFAOYSA-N 468.279 5.244 5 20 JKBD COc1ccc2oc(C)c(C(=O)Nc3ccc(NS(=O)(=O)c4ccc(C)c([N+](=O)[O-])c4)cc3)c2c1 916108543 NBDCOYZRJUKWKI-UHFFFAOYSA-N 495.513 5.020 5 20 JKBD C[C@H](Nc1ccc(C(=O)Oc2cccc(Oc3ccccn3)c2)cc1[N+](=O)[O-])c1ccccn1 920107794 JYDNGDQMYKTNCU-KRWDZBQOSA-N 456.458 5.569 5 20 JKBD O=C(OCc1nc2ccccc2c2ccccc12)[C@@H]1CS[C@@]2(c3ccc(F)cc3)CCC(=O)N12 921265324 WPJFIDVNKALFQW-RPLLCQBOSA-N 472.541 5.161 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)c3nc4cc([N+](=O)[O-])ccc4[nH]3)CCC2)cc1)c1ccc2occc2c1 1789049709 VUZUYFFWUJJRIN-UHFFFAOYSA-N 495.495 5.279 5 20 JKBD COc1cc(C(=O)Nc2ccc(C3(NC(=O)[C@@H]4C[C@@H]4c4ccccc4)CCC3)cc2)ccc1[N+](=O)[O-] 1792165407 JTABKLBHDZCVFG-DHIUTWEWSA-N 485.540 5.155 5 20 JKBD C[C@H](C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)C1(c3cccc([N+](=O)[O-])c3)CCC1)C2)c1ccc(Cl)cc1 1792820372 ASFIVYYIAKLDHR-QMZRJTEUSA-N 496.007 5.112 5 20 JKBD CC(C)(C)CCCCCC(=O)NC[C@H]1CCN(C(=O)c2cccc(F)c2[N+](=O)[O-])[C@H]1c1cccnc1 1812809559 STVHYNCJQMVLPY-YKSBVNFPSA-N 498.599 5.445 5 20 JKBD Cc1c(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)[C@H]3CCC[C@H]3C)n[nH]2)cc(Cl)cc1[N+](=O)[O-] 1818958877 IKSKDHNEUIPOIY-ACWOFJMJSA-N 473.961 5.022 5 20 JKBD CCC(C)(C)C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)[nH]n1 1821939449 MSKPZBGSOIYLLW-QGZVFWFLSA-N 469.567 5.275 5 20 JKBD CC(C)c1ccc(CC(=O)Nc2cc([C@H]3CCCCN3C(=O)c3ccc([N+](=O)[O-])cc3F)[nH]n2)cc1 1822137969 GKXHBLCYQDMXFE-HSZRJFAPSA-N 493.539 5.129 5 20 JKBD CC[C@H]1CC[C@H](C(=O)Nc2cc([C@@H]3CCCCN3C(=O)CSc3ccccc3[N+](=O)[O-])[nH]n2)CC1 1822224323 LVVQBXPZVGBDKL-BJLQDIEVSA-N 499.637 5.319 5 20 JKBD COc1cc(C(=O)N2CCC([C@@H]3CCCCN3C(=O)c3ccc(C)c(Cl)c3)CC2)ccc1[N+](=O)[O-] 1823908503 YCVBFFOZMHUZLF-QFIPXVFZSA-N 499.995 5.112 5 20 JKBD O=C(c1sccc1F)N1CCCC[C@H]1C1CCN(C(=O)C2(c3cccc([N+](=O)[O-])c3)CCC2)CC1 1824729212 IOHXZFLNMYKAPA-QFIPXVFZSA-N 499.608 5.151 5 20 JKBD CCCOc1ccc(C(=O)N2CCC([C@H]3CCCCN3C(=O)c3cccc(F)c3[N+](=O)[O-])CC2)cc1 1830621692 QUGQKHSAYCBWJX-XMMPIXPASA-N 497.567 5.070 5 20 JKBD COc1ccc([N+](=O)[O-])cc1NC(=O)CSc1nnc(-c2ccccc2)n1-c1ccc(Cl)cc1 3604146 MPRMEAIZZCFELR-UHFFFAOYSA-N 495.948 5.235 5 20 JKBD CC(C)c1ccccc1NC(=O)COC(=O)c1ccccc1C(=O)c1ccc(Cl)c([N+](=O)[O-])c1 11029366 ZUGYKAQYEZAPHE-UHFFFAOYSA-N 480.904 5.398 5 20 JKBD O=C(NCc1cn(Cc2ccccc2)nc1-c1ccccc1)C1CCN(c2ccccc2[N+](=O)[O-])CC1 14502495 CMECAJFTZGIQDT-UHFFFAOYSA-N 495.583 5.039 5 20 JKBD Cc1ccc(NC(=O)[C@H](C)Sc2nc3cc4ccccc4cc3c(=O)n2C)c(Br)c1 18591175 HCTLNSGNUKSNEK-AWEZNQCLSA-N 482.403 5.277 5 20 JKBD CSc1ccc(C(=O)c2ccccc2C(=O)N(C)Cc2nc3ccccc3s2)cc1[N+](=O)[O-] 26186069 JHDNWHOHCQNBPG-UHFFFAOYSA-N 477.567 5.430 5 20 JKBD C[C@@H]1CCCN(c2ccc(C(=O)N(C)CCCc3cc(-c4cccc(F)c4)n[nH]3)cc2[N+](=O)[O-])C1 117694607 YZYLBZZZYAJPRZ-GOSISDBHSA-N 479.556 5.065 5 20 JKBD CSc1ccc(C(=O)Nc2ccccc2Oc2ncc(Cl)cc2Cl)cc1[N+](=O)[O-] 195612756 KVHNCQVAIHREIG-UHFFFAOYSA-N 450.303 6.063 5 20 JKBD Cc1cc(C(=O)Nc2ccc(NC(=O)c3ccc(F)cc3)cc2C(F)(F)F)cc([N+](=O)[O-])c1 195692100 QGTJGOPPUKYJFB-UHFFFAOYSA-N 461.371 5.566 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)N2CC[C@H](C)Sc3ccc(C(F)(F)F)cc32)cc1SC 482993292 LZIIHWIDFCAAGQ-NSHDSACASA-N 472.510 5.875 5 20 JKBD O=C(Nc1ccccc1NC(=O)N1CCCC1)c1ccc(NCc2ccccc2)c([N+](=O)[O-])c1 485121021 KUXVHBPPQRGGSO-UHFFFAOYSA-N 459.506 5.087 5 20 JKBD O=C([C@@H]1CCC[C@H](C(F)(F)F)C1)N1CCN(Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)CC1 500725795 PAVNRQAPPJUCIL-SJORKVTESA-N 481.540 5.336 5 20 JKBD CSc1ccc(C(=O)c2ccccc2C(=O)Nc2ccc(OC[C@H]3CCCO3)cc2)cc1[N+](=O)[O-] 502079952 PSYAAPAWUKIWIA-HXUWFJFHSA-N 492.553 5.358 5 20 JKBD C[C@H]1CCCN(c2ccc(C(=O)Nc3ccc(Sc4nncn4C)c(Cl)c3)cc2[N+](=O)[O-])C1 502091909 VYBQIDSAXZOIRH-AWEZNQCLSA-N 486.985 5.017 5 20 JKBD O=C(c1csc(-c2cccc([N+](=O)[O-])c2)n1)N1CCCc2cc(Br)cc(F)c21 502769425 GJJHDLZXQLMFAD-UHFFFAOYSA-N 462.300 5.213 5 20 JKBD O=C(C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)NCCc1c(F)cccc1F 502769666 VNIUEHRWWKJKAD-SAPNQHFASA-N 479.508 5.772 5 20 JKBD C[C@@H](NC(=O)c1cc([N+](=O)[O-])ccc1Sc1ccccc1)C(=O)Nc1cccc(N2CCCC2)c1 505490205 ARDUTACJLNZLTF-GOSISDBHSA-N 490.585 5.103 5 20 JKBD CN(Cc1ccc(Br)s1)C(=O)c1cc([N+](=O)[O-])ccc1NCc1ccccc1 515163666 VWZRYBXLSRBCMN-UHFFFAOYSA-N 460.353 5.303 5 20 JKBD C[C@H](Nc1ccc(C(=O)N[C@H](C)c2ccc(OCc3cccnc3)cc2)cc1[N+](=O)[O-])c1ccccn1 516594384 ITWPMHIDOZDVJL-UXHICEINSA-N 497.555 5.628 5 20 JKBD CC(C)c1nccn1Cc1cccc(NC(=O)c2ccc(N[C@@H](C)c3ccccn3)c([N+](=O)[O-])c2)c1 518433649 RIXPAXWVIIATKM-IBGZPJMESA-N 484.560 5.783 5 20 JKBD C[C@@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)Nc1ccc(NC(=O)c2ccco2)cc1C(F)(F)F 518880926 RYQYLVZBYXQVKA-LLVKDONJSA-N 497.813 5.518 5 20 JKBD Cc1ccc(Oc2ccccc2NC(=O)c2ccc([N+](=O)[O-])cc2I)cc1 524430287 CDHHFKDCRIOODK-UHFFFAOYSA-N 474.254 5.552 5 20 JKBD COc1ccc(CSCC(=O)N[C@@H](C)c2ccc(NC(=O)c3ccc(F)cc3)cc2)cc1[N+](=O)[O-] 604016024 BJPMUTXFDLMEES-INIZCTEOSA-N 497.548 5.105 5 20 JKBD Cc1nc(CNC(=O)c2ccccc2Sc2ccc(C(F)(F)F)cc2[N+](=O)[O-])cs1 604248549 RAUNOHWYMUYBDY-UHFFFAOYSA-N 453.467 5.460 5 20 JKBD Cn1ccnc1[C@H](NCc1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1)c1ccc(Cl)cc1 604417841 BHVDLVFRRZYMBI-HSZRJFAPSA-N 483.355 6.307 5 20 JKBD Cc1ccc(C(C)C)c(Oc2ccc(CNCc3ccc(S(C)(=O)=O)cc3)cc2[N+](=O)[O-])c1 604448262 NZHHNJIIKCBAAB-UHFFFAOYSA-N 468.575 5.512 5 20 JKBD O=C(c1c2c(nc3ccccc13)/C(=C/c1ccc([N+](=O)[O-])cc1)CCC2)N1CC[C@H](N2CCCC2)C1 608906286 WFXCOPNZJGPXEW-WVLWKRQNSA-N 482.584 5.330 5 20 JKBD CC1CCC(OC2CCN(C(=O)CSc3ccc(C(F)(F)F)cc3[N+](=O)[O-])CC2)CC1 609374291 OLYZKJATALQWOW-UHFFFAOYSA-N 460.518 5.292 5 20 JKBD CC(C)n1ncc2cc(NC(=O)c3ccc(Oc4ccc(Cl)cc4[N+](=O)[O-])cc3)cnc21 610912617 GVALTQFWLDXEKP-UHFFFAOYSA-N 451.870 5.618 5 20 JKBD O=C(COC(=O)Cc1csc(-c2cccc(C(F)(F)F)c2)n1)Nc1ccc([N+](=O)[O-])cc1Cl 725970264 WQMCOSPQPQGMHM-UHFFFAOYSA-N 499.854 5.115 5 20 JKBD O=C(c1c2c(nc3ccccc13)/C(=C\c1ccc([N+](=O)[O-])cc1)CCC2)N1CCC(C2OCCO2)CC1 726773400 BMCLYKHGEIFLHV-UZYVYHOESA-N 499.567 5.245 5 20 JKBD Cc1cccc(-c2nnc(-c3ccc(C(=O)N(CC4CC4)c4ccc(Cl)c([N+](=O)[O-])c4)cc3)o2)c1 728166069 VQSOTVUDDLEVJS-UHFFFAOYSA-N 488.931 6.330 5 20 JKBD C[C@@H](OC(=O)c1c(Cl)cccc1[N+](=O)[O-])C(=O)Nc1ccc(OCc2ccccc2)cc1 730644722 FGXTTWMNTWZHGE-OAHLLOKOSA-N 454.866 5.011 5 20 JKBD Cc1ccc(Sc2ccc(C(=O)Nc3ccc(N4CCC(C(N)=O)CC4)cc3)cc2[N+](=O)[O-])cc1 748762478 VSXKWFPPHDEAFK-UHFFFAOYSA-N 490.585 5.008 5 20 JKBD C[C@H](OC(=O)c1c(Cl)c2ccccc2n1C)C(=O)Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1 915462659 ILHUWELXSYOWKE-LBPRGKRZSA-N 484.921 5.047 5 20 JKBD CCOC(=O)Nc1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2Oc2ccc(OC)cc2)cc1 916068305 FPJYCGUZMBHDTH-UHFFFAOYSA-N 451.435 5.216 5 20 JKBD Cc1ccc(NC(=O)c2ccccc2)cc1NC(=O)c1ccc(Br)c([N+](=O)[O-])c1 916084685 UCNJRENMYBCUNY-UHFFFAOYSA-N 454.280 5.170 5 20 JKBD O=C(c1cccc(COc2ccc3c(-c4ccc([N+](=O)[O-])cc4)cc(=O)oc3c2)c1)N1CCCCC1 917622783 FOARHTPHFSBOHI-UHFFFAOYSA-N 484.508 5.573 5 20 JKBD Cc1cc(C)c(OC(=O)C2CCN(c3ncc(C(F)(F)F)cc3Cl)CC2)c([N+](=O)[O-])c1 919656375 YVPHIBSFPSFJDJ-UHFFFAOYSA-N 457.836 5.101 5 20 JKBD CCCCc1nc(-c2cccc(OC(=O)Cn3c4ccccc4c(=O)c4ccccc43)c2)no1 920226987 SXCYNKYMDHBPMD-UHFFFAOYSA-N 453.498 5.153 5 20 JKBD Cn1cccc1C(=O)Nc1ccc(C2(NC(=O)c3cc4cc([N+](=O)[O-])ccc4s3)CCC2)cc1 1787267188 PXELRFYLVCYWIP-UHFFFAOYSA-N 474.542 5.210 5 20 JKBD Cc1oc(C(C)(C)C)cc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)C1(c3cccc([N+](=O)[O-])c3)CCC1)C2 1795128793 WAGPDSZOBOEASA-WKCHPHFGSA-N 493.604 5.167 5 20 JKBD Cc1ccc(CC(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)[C@H](c2ccc(Cl)cc2)C(C)C)C3)cc1[N+](=O)[O-] 1800136369 NJGFLVXGXMZXSX-LNEBKTTKSA-N 498.023 5.177 5 20 JKBD CC[C@H]1CC[C@H](C(=O)N2CCCC[C@H]2c2cc(NC(=O)CSc3ccccc3[N+](=O)[O-])n[nH]2)CC1 1822312939 HJWGSFUVZIYNQS-BJLQDIEVSA-N 499.637 5.319 5 20 JKBD Cc1cccc(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)c3ccc([N+](=O)[O-])cc3F)[nH]n2)c1Cl 1823183518 BBNYUPSGCVPTQS-IBGZPJMESA-N 485.903 5.039 5 20 JKBD O=C(c1ccc([N+](=O)[O-])cc1F)N1CCC([C@@H]2CCCCN2C(=O)c2cc(Cl)ccc2F)CC1 1823938546 GFTSUJWFRDIPNS-QFIPXVFZSA-N 491.922 5.074 5 20 JKBD O=C(CSc1ccccc1[N+](=O)[O-])N1CCC([C@H]2CCCCN2C(=O)/C=C/c2cccs2)CC1 1827080546 IRMKFPVLTUHQHF-RQWLHQTBSA-N 499.658 5.082 5 20 JKBD O=C(Cc1ccc([N+](=O)[O-])cc1F)N1CCC([C@H]2CCCCN2C(=O)c2cc3ccoc3s2)CC1 1827414261 SPWZPQOOGABYDT-OAQYLSRUSA-N 499.564 5.018 5 20 JKBD O=C(c1ccc2ccoc2c1)N1CCC([C@H]2CCCCN2C(=O)c2cccc(F)c2[N+](=O)[O-])CC1 1830621231 HSLVVPHPAGWMKQ-JOCHJYFZSA-N 479.508 5.027 5 20 JKBD Cc1ccc(Sc2ccc(C(=O)N3CCC(C(=O)NCc4ccccc4)CC3)cc2[N+](=O)[O-])cc1 15175010 JBCYMLUPONJTRX-UHFFFAOYSA-N 489.597 5.223 5 20 JKBD Cc1sc2nc(S[C@@H](C)c3nnc(-c4ccc([N+](=O)[O-])cc4)o3)n(C3CCCC3)c(=O)c2c1C 17721111 SULVZDPBPYYQJM-AWEZNQCLSA-N 497.602 6.001 5 20 JKBD CCc1ccccc1NC(=O)CN(C)C(=O)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])c(OC)c1 17903898 KTKYSXRXBCGYFW-UHFFFAOYSA-N 497.935 5.322 5 20 JKBD CCOc1ccc(Oc2ccccc2NC(=O)CCCn2c(=O)oc3cc([N+](=O)[O-])ccc32)cc1 18085366 SZQSHDDURAKBKK-UHFFFAOYSA-N 477.473 5.113 5 20 JKBD COc1cc(C(=O)N[C@@H](C)C(c2ccccc2)c2ccccc2)c([N+](=O)[O-])cc1OC(F)F 33178326 AXLNJOJIWBEXBM-HNNXBMFYSA-N 456.445 5.155 5 20 JKBD Cc1ccc(NC(=O)c2c[nH]c3ccc([N+](=O)[O-])cc23)cc1S(=O)(=O)Nc1cccc(Cl)c1 109890763 MUGDPKWYLRTLGG-UHFFFAOYSA-N 484.921 5.091 5 20 JKBD C[C@@H](Nc1ccc(C(=O)Nc2ccc(-c3ncc4n3CCCC4)cc2)cc1[N+](=O)[O-])c1ccccn1 195626637 XGEGWZXDTUINEK-GOSISDBHSA-N 482.544 5.615 5 20 JKBD Cc1sc(NC(=O)[C@@H]2CCCN(C(=O)c3ccc(Cl)cc3)C2)nc1-c1cccc([N+](=O)[O-])c1 195703894 CZSILDWVFRHCLN-QGZVFWFLSA-N 484.965 5.171 5 20 JKBD CC(C)N(C)C(=O)c1ccc(Cl)c(NC(=O)c2ccc(N3C[C@@H](C)C[C@@H](C)C3)c([N+](=O)[O-])c2)c1 303158043 UPAVSUZFHCUOIQ-CALCHBBNSA-N 487.000 5.463 5 20 JKBD COc1cc([N+](=O)[O-])c(C(=O)Nc2sc3c(c2C(=O)OC(C)C)CCCC3)cc1SC 482910357 ZBPIJKJXHKRNJE-UHFFFAOYSA-N 464.565 5.083 5 20 JKBD CCOC(=O)c1sc(-c2cccc([N+](=O)[O-])c2)cc1NC(=O)Cc1nc(-c2ccco2)oc1C 503235816 ZICSPFFGNXRWHE-UHFFFAOYSA-N 481.486 5.238 5 20 JKBD Cc1nnc(SCc2c(C(=O)N3c4ccc([N+](=O)[O-])cc4C[C@@H]3C)oc3ccccc23)s1 504371531 OJDKAYDTYHNHBI-LBPRGKRZSA-N 466.544 5.385 5 20 JKBD O=C(Nc1cccc(OCc2cscn2)c1)c1ccc(NCc2ccccc2)c([N+](=O)[O-])c1 505036043 RNODUGJBCHTBBB-UHFFFAOYSA-N 460.515 5.495 5 20 JKBD CN(CCCCCc1cc(-c2ccccc2)no1)C(=O)c1ccc(N2CCCC2)c([N+](=O)[O-])c1 506542056 NQMANHPPATZHRO-UHFFFAOYSA-N 462.550 5.335 5 20 JKBD CCOC(=O)c1cc(C(=O)Nc2ccc(Cl)cc2C(=O)N2[C@@H](C)CCC[C@H]2C)cc([N+](=O)[O-])c1 508305908 MUPSKQBWKVULHC-GASCZTMLSA-N 487.940 5.080 5 20 JKBD Cc1nc(-c2ccc(F)cc2)sc1[C@H](C)Nc1cnn(-c2ccc([N+](=O)[O-])cc2)c(=O)c1Cl 511439795 ZMHUUUGBMKTSEV-LBPRGKRZSA-N 485.928 5.538 5 20 JKBD COc1cc(C(=O)N(Cc2ccccc2)c2ccccc2)c([N+](=O)[O-])cc1OCc1cscn1 512570817 ZBPGHOWILXKLDF-UHFFFAOYSA-N 475.526 5.486 5 20 JKBD Cn1c(SCC(=O)N2CCc3sccc3[C@@H]2c2ccccc2)nc2cc3ccccc3cc2c1=O 515424053 LXEIRHQZWNOCAR-SANMLTNESA-N 497.645 5.415 5 20 JKBD C[C@@H]1CN(C(=O)C/C(=C\c2ccc([N+](=O)[O-])cc2)c2nc3ccccc3s2)C[C@@H](c2ccccc2)O1 516754654 SOJKROKOLQGXMO-XNZRPZTCSA-N 499.592 6.124 5 20 JKBD CN(C)[C@@H](CNC(=O)C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)c1ccco1 518748636 KFEFCCFIMVVKBH-NUVSWBFWSA-N 476.558 5.147 5 20 JKBD Cc1cc(Oc2ncccn2)ccc1NC(=O)c1cc([N+](=O)[O-])ccc1Sc1ccc(Cl)cc1 519956405 FRZZJFUZHUELEC-UHFFFAOYSA-N 492.944 6.542 5 20 JKBD CN(c1ccccc1)c1ccc(CN[C@@H](c2ccc(Cl)cc2)c2nccn2C)cc1[N+](=O)[O-] 520209858 LVSQKSVINSDVSS-DEOSSOPVSA-N 461.953 5.629 5 20 JKBD O=C(CCNc1ccc(C(F)(F)F)cc1[N+](=O)[O-])Nc1ccc(NC(=O)c2cccs2)cc1 523334679 ABQXXPVVVCBOLE-UHFFFAOYSA-N 478.452 5.368 5 20 JKBD CC1CCN(c2ccc(C(=O)Nc3ccc(-c4noc(C(F)(F)F)n4)cc3)cc2[N+](=O)[O-])CC1 524163436 JRLOWWSNAZAWTB-UHFFFAOYSA-N 475.427 5.152 5 20 JKBD Cc1ccc(NC(=O)[C@H](Sc2nnc(-c3ccccc3F)o2)c2ccccc2)c([N+](=O)[O-])c1 592943590 IGBNJTQGHZZGNY-HXUWFJFHSA-N 464.478 5.564 5 20 JKBD O=C(Cc1ccc([N+](=O)[O-])cc1)N(C[C@@H]1CCCO1)c1nc(-c2ccc(Cl)cc2Cl)cs1 603463238 SVXRPEONJAENBF-KRWDZBQOSA-N 492.384 5.780 5 20 JKBD O=C(Nc1ccc(Cl)cc1Cl)[C@@H]1CCCCN1C(=O)c1c[nH]c2ccc([N+](=O)[O-])cc12 604545998 AITHCOYBULUKNH-IBGZPJMESA-N 461.305 5.016 5 20 JKBD COc1cc(C(=O)NCC2(c3cccc(C)c3)CCCC2)c([N+](=O)[O-])cc1OCc1cscn1 608874208 FFKBVJZKFDFRTD-UHFFFAOYSA-N 481.574 5.189 5 20 JKBD C[C@@H](CN(C)C(=O)c1ccc(C(=O)N(C)C[C@H](C)c2ccccc2)c([N+](=O)[O-])c1)c1ccccc1 609044505 ABXMCTKVCZMKGZ-SFTDATJTSA-N 473.573 5.346 5 20 JKBD O=C(C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)Nc1cccc(-c2nc(=O)o[nH]2)c1 609171657 LAFPHVBTLDVNTO-SFQUDFHCSA-N 499.508 5.117 5 20 JKBD CC(C)c1nccn1Cc1cccc(NC(=O)Cn2c3ccccc3c(=O)c3ccccc32)c1 614273065 WTHFAEPDAJPLFZ-UHFFFAOYSA-N 450.542 5.162 5 20 JKBD Cc1nn(CCC(=O)O[C@@H](C(=O)Nc2cc(Cl)cc(Cl)c2)c2ccccc2)c(C)c1[N+](=O)[O-] 726649488 HUXOLXJLOGOKOH-OAQYLSRUSA-N 491.331 5.028 5 20 JKBD CC(C)Oc1ccc([N+](=O)[O-])cc1COC(=O)C1CCN(C(=O)c2cccc3ccccc23)CC1 729114865 UNJMGHCFTWVCFD-UHFFFAOYSA-N 476.529 5.131 5 20 JKBD C[C@@H](c1ccc(S(C)(=O)=O)cc1)N(C)C(=O)CCC(=O)c1ccc2ccc3cccc4ccc1c2c34 729259893 LJQPSYWXIGOXPF-IBGZPJMESA-N 497.616 6.170 5 20 JKBD COc1ccc(-c2n[nH]c(S[C@H](C(=O)Nc3ccc(Cl)c([N+](=O)[O-])c3)c3ccccc3)n2)cc1 785501129 QFOYTGMGXDAKCZ-FQEVSTJZSA-N 495.948 5.514 5 20 JKBD CC(C)Oc1cc(-c2nc(-c3ccc(CNC(=O)OC(C)(C)C)cc3)no2)ccc1[N+](=O)[O-] 904716635 FAIYTQKUVHGIGP-UHFFFAOYSA-N 454.483 5.124 5 20 JKBD O=C(CCc1nc2ccccc2o1)O[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1 917234101 PDQVDDQPUDPTDK-HSZRJFAPSA-N 479.876 5.245 5 20 JKBD C[C@H](Nc1cccc(COc2ccccc2)c1)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F 917941914 XUGHJNUSSIUVKX-HNNXBMFYSA-N 459.424 5.632 5 20 JKBD CC(=O)N(c1nc(COC(=O)c2csc([N+](=O)[O-])c2)cs1)c1c(C)cc(C)cc1Cl 919368209 KWMRAHFXNXSWMJ-UHFFFAOYSA-N 465.940 5.425 5 20 JKBD O=C(OCc1nnc(-c2ccc([N+](=O)[O-])cc2)o1)c1cccnc1Oc1ccc(Cl)cc1Cl 920911942 JOXYMWKUJFAWRE-UHFFFAOYSA-N 487.255 5.496 5 20 JKBD C[C@@H](NC(=O)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1)c1ccc(N2CCOC2=O)cc1 920952713 QTOXMFZKBJYPDO-OAHLLOKOSA-N 481.892 5.488 5 20 JKBD CC1=C(C(=O)Nc2ccc([N+](=O)[O-])cc2)[C@H](c2ccc(O)c(Cl)c2)NC(=S)N1c1ccccc1 921294800 OJRZIFYQNRJGMD-QFIPXVFZSA-N 494.960 5.302 5 20 JKBD O=C(Nc1ccc(C2(NC(=O)c3ccc(Cl)cc3F)CCC2)cc1)c1ccc([N+](=O)[O-])o1 1785748889 UXFDKUBLHYPJOS-UHFFFAOYSA-N 457.845 5.042 5 20 JKBD C[C@@H](Sc1ccccc1)C(=O)NC1(c2ccc(NC(=O)c3ccc([N+](=O)[O-])o3)cc2)CCC1 1785748924 ZNCZHUHPINWKKM-MRXNPFEDSA-N 465.531 5.116 5 20 JKBD O=C(Cc1ccc(Cl)cc1[N+](=O)[O-])Nc1ccc(C2(NC(=O)CCc3ccoc3)CCC2)cc1 1786115896 KGFVFMIFZASCAR-UHFFFAOYSA-N 481.936 5.151 5 20 JKBD CN1CCCC[C@H]1C(=O)Nc1ccc(C2(NC(=O)c3cc4cc([N+](=O)[O-])ccc4s3)CCC2)cc1 1786152897 CCGKDRXGNNNSFS-NRFANRHFSA-N 492.601 5.042 5 20 JKBD O=C(/C=C/c1ccc([N+](=O)[O-])o1)Nc1ccc(C2(NC(=O)[C@@H]3C[C@H]3c3ccccc3)CCC2)cc1 1786208071 IZZVGPNHOXJWBY-ASTIYFOKSA-N 471.513 5.139 5 20 JKBD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)NC1(c2ccc(NC(=O)c3ccnc(C(F)F)c3)cc2)CCC1 1787018674 LGDFFWUMZSZWKG-UHFFFAOYSA-N 498.461 5.436 5 20 JKBD Cc1ccc2oc(C(=O)Nc3ccc(C4(NC(=O)c5cc(F)cc([N+](=O)[O-])c5)CCC4)cc3)cc2n1 1788322815 PEZITQMMHONKPR-UHFFFAOYSA-N 488.475 5.245 5 20 JKBD O=C(CSc1ccccc1[N+](=O)[O-])Nc1ccc(C2(NC(=O)Cc3ccc(F)cc3)CCC2)cc1 1791522376 MGGAQKWZUYOZTE-UHFFFAOYSA-N 493.560 5.203 5 20 JKBD CSc1ccc(CC(=O)Nc2ccc(C3(NC(=O)c4cc(C)c([N+](=O)[O-])cn4)CCC3)cc2)cc1 1791735072 FJURJIGUPNOLCV-UHFFFAOYSA-N 490.585 5.011 5 20 JKBD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1sccc1Cl)c1cc2cc([N+](=O)[O-])ccc2s1 1798974443 FOWLCRZCJZIAJX-BTTYYORXSA-N 475.979 5.090 5 20 JKBD O=C(Nc1cc([C@@H]2CCCCN2C(=O)C2(c3cccc([N+](=O)[O-])c3)CCC2)[nH]n1)C1(F)CCCCC1 1818881654 KBBICTMYXBMZHC-NRFANRHFSA-N 497.571 5.104 5 20 JKBD Cc1ccc(C(=O)N2CCCC[C@H]2C2CCN(C(=O)CCCc3cc(C)c(F)cc3[N+](=O)[O-])CC2)o1 1824679886 FRCJITPKXXYASX-QHCPKHFHSA-N 499.583 5.200 5 20 JKBD O=C(c1ccc(O)c([N+](=O)[O-])c1)N1CCC([C@@H]2CCCCN2C(=O)c2cc3sccc3s2)CC1 1828553994 QYUJQCCVQBBRED-KRWDZBQOSA-N 499.614 5.124 5 20 JKBD Cc1cccc(C)c1C(=O)N1CCCC[C@@H]1C1CCN(C(=O)CSc2ccccc2[N+](=O)[O-])CC1 1830641802 OZHXBAJYRXYWTE-JOCHJYFZSA-N 495.645 5.237 5 20 JKBD O=C(c1ccc(C2CC2)cc1)N1CCC([C@@H]2CCCCN2C(=O)/C=C/c2ccccc2[N+](=O)[O-])CC1 1832904804 XEBCEPHMDXPNAP-BOMYWPOKSA-N 487.600 5.419 5 20 JKBD Cc1c(-c2ccccc2)nc2ccccc2c1C(=O)OCC(=O)Nc1cc([N+](=O)[O-])ccc1F 10445013 LIWXIGCWTGADBH-UHFFFAOYSA-N 459.433 5.053 5 20 JKBD O=C(Nc1ccc(OC(=O)[C@@H]2Cc3cc(Cl)ccc3O2)cc1)c1cc([N+](=O)[O-])ccc1Cl 15516115 PHULAPOYAMDLIK-FQEVSTJZSA-N 473.268 5.063 5 20 JKBD O=C(CSc1nc2ccccc2o1)O[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1 22029883 OPJMBMHQHBEGMR-OAQYLSRUSA-N 497.916 5.405 5 20 JKBD C[C@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)Nc1cccc(S(=O)(=O)Nc2ccccc2Cl)c1 22591095 OAKJYGRAYUJAFO-AWEZNQCLSA-N 491.978 5.168 5 20 JKBD Cc1c(NC(=O)[C@@H](C)Sc2ccc([N+](=O)[O-])cc2)cccc1C(=O)N1CCc2sccc2C1 26046815 TUCQDSZZMBKBDL-MRXNPFEDSA-N 481.599 5.283 5 20 JKBD Cn1cnnc1-c1cccc(NC(=O)c2cc([N+](=O)[O-])ccc2Sc2ccc(Cl)cc2)c1 33127029 XASIWJCZKHVFJM-UHFFFAOYSA-N 465.922 5.447 5 20 JKBD Cc1csc(N(C(=O)CCNc2ccc(C(F)(F)F)cc2[N+](=O)[O-])c2ccccc2)n1 57962545 DYBGWECEBMEQKS-UHFFFAOYSA-N 450.442 5.545 5 20 JKBD COc1ccc(NC(=O)c2ccc(Cl)cc2[N+](=O)[O-])cc1NC(=O)c1ccc(Cl)cc1F 108538582 HJOVQXCWYQHUMG-UHFFFAOYSA-N 478.263 5.554 5 20 JKBD C[C@H](Nc1ccc(C(=O)N(C)Cc2ccccc2Br)cc1[N+](=O)[O-])c1ccccn1 108753952 HXSCBQZNUKXNDW-HNNXBMFYSA-N 469.339 5.198 5 20 JKBD C[C@@H]1CCCN(c2ccc(C(=O)N(C)CCCc3cc(-c4ccc(F)cc4)n[nH]3)cc2[N+](=O)[O-])C1 117226687 RHWBJGZPAQDQOD-GOSISDBHSA-N 479.556 5.065 5 20 JKBD Cc1nc(S[C@@H](C)C(=O)Nc2nc(-c3cccc([N+](=O)[O-])c3)cs2)c2ccccc2n1 255927435 SJFYSTOYXHLMEZ-LBPRGKRZSA-N 451.533 5.089 5 20 JKBD CCc1cc(O)nc(-c2cccc(NC(=O)c3ccc(NCc4ccccc4)c([N+](=O)[O-])c3)c2)n1 485811167 FHQUAICTKXVLJS-UHFFFAOYSA-N 469.501 5.184 5 20 JKBD Cc1cccc(C(=O)Nc2nc(-c3ccc(OC(F)F)cc3OC(F)F)cs2)c1[N+](=O)[O-] 494013027 WTBCKRJWUFNBKI-UHFFFAOYSA-N 471.388 5.482 5 20 JKBD COc1cccc(OC)c1OC1CCN(C(=O)c2cc([N+](=O)[O-])ccc2Oc2ccccc2)CC1 501923645 DYMSHWNCWNSRTE-UHFFFAOYSA-N 478.501 5.088 5 20 JKBD Cc1cc([N+](=O)[O-])ccc1NC(=O)CSc1nnc(-c2ccc(Cl)cc2Cl)n1C(C)C 502592129 DIMFZHZPOGHQBA-UHFFFAOYSA-N 480.377 5.780 5 20 JKBD COc1ccc(CCC2CCN(C(=O)c3ccc(N[C@@H](C)c4ccccn4)c([N+](=O)[O-])c3)CC2)cc1 506072450 QPSUNEOJHBLJSG-FQEVSTJZSA-N 488.588 5.657 5 20 JKBD O=C(NCCc1ccc([N+](=O)[O-])cc1)Nc1ccc(NC(=O)c2ccc(F)cc2)cc1C(F)(F)F 506278429 DFXJCUQUAOQMSS-UHFFFAOYSA-N 490.413 5.369 5 20 JKBD CCOC(=O)[C@@H]1CCCCN1C(=O)C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1 509858776 WHNAOQZXAJTKAA-TXOBRMIJSA-N 479.558 5.079 5 20 JKBD Cc1csc(Sc2ccc(C(=O)Nc3cc(-c4nnco4)ccc3C)cc2[N+](=O)[O-])n1 511980348 CHVTVHVWTKMIFB-UHFFFAOYSA-N 453.505 5.122 5 20 JKBD COc1cc(C(=O)Nc2c(C(C)C)cccc2C(C)C)c([N+](=O)[O-])cc1OCc1cscn1 512389537 NNDVLHYOWJGPFH-UHFFFAOYSA-N 469.563 6.138 5 20 JKBD Cc1csc(-c2ccc(NC(=O)N[C@H](CC(=O)OC(C)C)c3ccccc3[N+](=O)[O-])cc2)n1 513965994 JMLZZTHJQMWEOZ-LJQANCHMSA-N 468.535 5.231 5 20 JKBD O=C(Nc1ccc(CC(=O)N2CCc3ccccc32)cc1)Nc1ccc([N+](=O)[O-])cc1Cl 522841592 BARJMSUCIXRRFH-UHFFFAOYSA-N 450.882 5.024 5 20 JKBD O=C(c1ccccc1Sc1ccc(C(F)(F)F)cc1[N+](=O)[O-])N1CCC(n2ccnc2)CC1 523848222 UJMGFUTTXMUWMR-UHFFFAOYSA-N 476.480 5.439 5 20 JKBD Cc1ccc(-c2c(C(=O)Nc3cccc([N+](=O)[O-])c3)c(C)nc3sc4c(c23)CCN(C)C4)cc1 543445308 FJWKZHACLFAAEW-UHFFFAOYSA-N 472.570 5.729 5 20 JKBD COc1ccc(NC(=O)c2ccc(NCc3ccccc3)c([N+](=O)[O-])c2)c(Br)c1 550083978 ZGPMOVWAOIIFBQ-UHFFFAOYSA-N 456.296 5.230 5 20 JKBD CSc1ccc(C(=O)c2ccccc2C(=O)N2CCC[C@H](N3[C@H](C)CC[C@H]3C)C2)cc1[N+](=O)[O-] 550895714 SFEQLYVJZCXTTJ-GGPKGHCWSA-N 481.618 5.025 5 20 JKBD C[C@H](NC(=O)C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2s1)c1nnc2ccccn12 610428540 ZTHFKZOWOJRSIG-IYWFSZBXSA-N 484.541 5.055 5 20 JKBD Cc1c(NC(=O)[C@H](C)OC(=O)Cc2csc(-c3cccc(C(F)(F)F)c3)n2)cccc1[N+](=O)[O-] 725969681 ODFNFISVWSQZEU-ZDUSSCGKSA-N 493.463 5.158 5 20 JKBD C[C@@H](NC(=S)/C(=C(/O)c1ccc([N+](=O)[O-])cc1)[n+]1ccc(C(C)(C)C)cc1)c1cccs1 726578969 IAHUHPRQRSGOII-MRXNPFEDSA-O 468.624 5.803 5 20 JKBD Cc1cc(C)n(-c2ccc(C(F)(F)F)cc2NC(=O)c2cc([N+](=O)[O-])ccc2Br)n1 751089458 VQOAQFAIRFPAHQ-UHFFFAOYSA-N 483.244 5.431 5 20 JKBD COc1ccc(CCC(=O)O[C@@H](C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c2ccccc2)cc1F 792725694 LVZIHGUJEIXLHU-HSZRJFAPSA-N 486.883 5.252 5 20 JKBD CC(C)N(Cc1nnc(-c2cccc([N+](=O)[O-])c2)o1)C(=O)c1ccc2[nH]c3c(c2c1)C[C@@H](C)CC3 864242365 CMYJXVOKJLARFU-INIZCTEOSA-N 473.533 5.302 5 20 JKBD O=C(Nc1c(C(=O)c2ccco2)oc2ccccc12)c1ccc(Br)c([N+](=O)[O-])c1 912602343 OLNIRIRLBIRDSH-UHFFFAOYSA-N 455.220 5.180 5 20 JKBD O=C(Nc1cc([N+](=O)[O-])c(F)cc1F)c1ccc(COc2ccccc2Br)cc1 916375260 RGYKUCKQBLXQJJ-UHFFFAOYSA-N 463.234 5.467 5 20 JKBD C[C@H](OC(=O)c1cc2cc([N+](=O)[O-])ccc2s1)C(=O)c1ccc(NC(=O)C(C)(C)C)cc1 916540685 DOGHOKSVLMXJGP-ZDUSSCGKSA-N 454.504 5.222 5 20 JKBD C[C@@H](NC(=O)CSc1nc2ccc([N+](=O)[O-])cc2s1)c1ccc(OC(F)(F)F)cc1 917171973 WXCONZXZNUPAKE-SNVBAGLBSA-N 457.455 5.073 5 20 JKBD O=C(Nc1ccccc1C(=O)Nc1ccc(OC[C@@H]2CCCO2)cc1)c1ccc([N+](=O)[O-])cc1Cl 918615665 BRVRIBXZHJDDEQ-IBGZPJMESA-N 495.919 5.311 5 20 JKBD Cc1ccc(NS(=O)(=O)c2ccc(NCc3cccnc3N3CCCCC3)c([N+](=O)[O-])c2)c(C)c1 921057409 UYXHSVQHJVWCFF-UHFFFAOYSA-N 495.605 5.010 5 20 JKBD O=C(NC1(c2ccc(NC(=O)C34CC(C(F)(F)F)(C3)C4)cc2)CCC1)c1cccc(F)c1[N+](=O)[O-] 1786461617 ROPBUDOFKBOEQE-UHFFFAOYSA-N 491.441 5.214 5 20 JKBD O=C(Cc1ccc2ccccc2c1)Nc1ccc(C2(NC(=O)c3ccc([N+](=O)[O-])o3)CCC2)cc1 1787700790 KHOHSOLUAZGJJO-UHFFFAOYSA-N 469.497 5.331 5 20 JKBD Cc1cc(O)c([N+](=O)[O-])cc1C(=O)Nc1ccc(C2(NC(=O)[C@@]3(F)CCCC=C3F)CCC2)cc1 1790808132 TUOLBLZHNRJXHI-RUZDIDTESA-N 485.487 5.102 5 20 JKBD COc1cc(CC(=O)NC2(c3ccc(NC(=O)c4cccc5ccoc45)cc3)CCC2)ccc1[N+](=O)[O-] 1790956503 KEZBNTHUUKJYRS-UHFFFAOYSA-N 499.523 5.340 5 20 JKBD C/C(=C\c1cccs1)C(=O)N1CCC([C@@H]2CCCCN2C(=O)CCc2cccc([N+](=O)[O-])c2)CC1 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